A0A077Z6Z9_TRITR Loading...

Ubiquinol cytochrome c reductase

AlphaFold DB , UniProt , Accession A0A077Z6Z9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 610 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	29.5	Very low	29.5	Very low	228 Å²	228	133.4 Å²	133.4	100%	1.123	67%	0.671	S	S	*	*				0	80.1	0	-63.6	-57.9	-177.1	0	0	110
2	P	30.8	Very low	29.3	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	69%	0.687	S	S	*	*			trans	-76.5	133.5	-173.5	30.8	-33	0	0	0	112.1
3	R	29.6	Very low	29.9	Very low	230 Å²	230	137.4 Å²	137.4	87%	0.868	67%	0.67	S	S	*	*			trans	-93.7	109.3	175.1	-63.5	171.7	177.3	170	-1	108.6
4	C	27.2	Very low	30	Very low	114 Å²	114	133.1 Å²	133.1	77%	0.77	67%	0.667	S	S	*	*			trans	-86.8	113.9	174.8	-61.6	0	0	0	0	110.3
5	A	28.8	Very low	29.9	Very low	74 Å²	74	139.5 Å²	139.5	61%	0.612	68%	0.681	S	S	*	*			trans	-108.9	148.5	177.2	0	0	0	0	0	110.6
6	N	31.8	Very low	29.9	Very low	56 Å²	56	136.6 Å²	136.6	30%	0.299	68%	0.679	S	S	.	*			trans	-124.6	130.1	-171.2	-61.1	-67.6	0	0	0	111.3	V122	N6-V122 HydrophobicContact CB-CG2 3.7Å; N6-V122 VanDerWaalsContact CG-CG1 3.48Å; N6-V122 VanDerWaalsContact ND2-CG1 3.32Å; N6-V122 WeakPolarHBondContact ND2-CG1 3.49Å; N6-V122 VanDerWaalsContact ND2-CG2 3.32Å; N6-V122 WeakPolarHBondContact ND2-CG2 3.45Å; N6-V122 WeakPolarHBondContact OD1-CG1 3.26Å
7	Y	27.5	Very low	30	Very low	195 Å²	195	135.6 Å²	135.6	77%	0.765	69%	0.688	S	S	*	*			trans	-104.2	140.4	-177.8	-71.5	-91.6	0	0	0	110.7
8	F	32.8	Very low	30.5	Very low	56 Å²	56	134.1 Å²	134.1	25%	0.246	69%	0.692	C	S	.	*			trans	-111.1	153.6	172.8	-81.1	-96.1	0	0	0	110.1	L35 A44 Q120	F8-L35 HydrophobicContact CE2-CD2 4.13Å; F8-L35 HydrophobicContact CZ-CD2 4.17Å; F8-A44 HydrophobicContact CB-CB 4.26Å; F8-A44 VanDerWaalsContact O-CB 3.26Å; F8-A44 WeakPolarHBondContact O-CB 3.47Å; F8-Q120 HydrophobicContact CE1-CB 4.26Å
9	F	25.7	Very low	30.8	Very low	185 Å²	185	132.1 Å²	132.1	81%	0.811	69%	0.69	S	S	*	*			trans	-126.1	126.5	176.4	-133.5	-88.6	0	0	0	110.1
10	A	32.2	Very low	31.1	Very low	49 Å²	49	128.8 Å²	128.8	41%	0.405	68%	0.679	S	S	.	*			trans	-131.6	149.9	-179.2	0	0	0	0	0	112.8	M38	A10-M38 HydrophobicContact CB-CE 4.09Å; A10-M38 HydrophobicContact CB-CG 3.89Å; A10-M38 HydrophobicContact CB-SD 4.12Å
11	K	28.7	Very low	31.4	Very low	157 Å²	157	125.2 Å²	125.2	68%	0.683	67%	0.665	S	S	*	*			trans	-94.3	135.1	-158.4	-161.7	170.9	-174.6	170.2	0	113.3	I13	K11-I13 PolarHBondContact O-N 3.23Å
12	R	27.8	Very low	31.9	Very low	229 Å²	229	114.6 Å²	114.6	86%	0.864	61%	0.612	S	S	*	*			trans	-31.7	108.4	179.2	-170.5	-179.4	-166.2	159.9	4.1	115.7
13	I	35.9	Very low	32.3	Very low	90 Å²	90	111.9 Å²	111.9	46%	0.462	59%	0.588	S	S	.	*			trans	-92.2	131.5	157.6	-61.6	179.4	0	0	0	108.2	K11 R15 F23	K11-I13 PolarHBondContact O-N 3.23Å; I13-R15 PolarHBondContact O-N 3.13Å; I13-F23 HydrophobicContact CD1-CE2 3.73Å; I13-F23 HydrophobicContact CD1-CZ 3.93Å
14	A	31.3	Very low	32.9	Very low	77 Å²	77	101.2 Å²	101.2	64%	0.636	55%	0.548	S	S	*	.			trans	-64.8	125.8	179.8	0	0	0	0	0	111.5	S16	A14-S16 PolarHBondContact O-N 3.33Å; A14-S16 VanDerWaalsContact O-N 3.15Å
15	R	29.8	Very low	33.3	Very low	230 Å²	230	97.1 Å²	97.1	87%	0.868	52%	0.519	S	S	*	.			trans	-60.6	110	167.7	-78.7	177.8	166.8	164.4	-4.7	109.3	I13	I13-R15 PolarHBondContact O-N 3.13Å
16	S	29.8	Very low	33.8	Very low	93 Å²	93	94.4 Å²	94.4	65%	0.65	49%	0.494	S	S	*	.			trans	-82.9	153.8	144.7	62.2	0	0	0	0	108.3	A14	A14-S16 PolarHBondContact O-N 3.33Å; A14-S16 VanDerWaalsContact O-N 3.15Å
17	S	31.4	Very low	33.8	Very low	119 Å²	119	93.2 Å²	93.2	83%	0.832	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	139.7	171.7	-169.7	0	0	0	0	111.3
18	S	38.7	Very low	34.1	Very low	109 Å²	109	90.7 Å²	90.7	76%	0.762	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	22.6	162.7	-151.3	0	0	0	0	121.2
19	S	35.5	Very low	34.4	Very low	95 Å²	95	93.1 Å²	93.1	66%	0.664	51%	0.508	S	S	*	.			trans	-158.1	131.9	164.1	-89.6	0	0	0	0	115.7
20	S	38.2	Very low	34.4	Very low	66 Å²	66	91.4 Å²	91.4	46%	0.462	51%	0.513	S	S	.	.			trans	-88.9	130.9	168.7	-61.1	0	0	0	0	110.3
21	S	36	Very low	34.1	Very low	54 Å²	54	93.7 Å²	93.7	38%	0.378	52%	0.522	S	S	.	.			trans	-121.5	133.8	178	-62.3	0	0	0	0	109.8
22	F	40.6	Very low	34.2	Very low	5 Å²	5	89.3 Å²	89.3	2%	0.022	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	163.7	-167.6	-56.8	-102.9	0	0	0	110.9	F24 M38 A39 L61 V62 V64 L69	F22-F24 HydrophobicContact CB-CD2 4.3Å; F22-F24 HydrophobicContact CB-CE2 3.63Å; F22-M38 WeakPolarHBondContact CD1-O 3.37Å; F22-A39 HydrophobicContact CE1-CB 4.03Å; F22-L61 WeakPolarHBondContact O-CD1 3.27Å; F22-L61 WeakPolarHBondContact O-CG 3.16Å; F22-V62 CarbonylContact C-O 3.41Å; F22-V62 WeakPolarHBondContact CA-O 3.36Å; F22-V62 WeakPolarHBondContact CB-O 3.41Å; F22-V62 PolarHBondContact N-O 3.28Å; F22-V62 PolarHBondContact O-N 3.4Å; F22-V64 HydrophobicContact CB-CG2 4.18Å; F22-V64 HydrophobicContact CD1-CG2 4.36Å; F22-V64 HydrophobicContact CD2-CB 3.74Å; F22-V64 HydrophobicContact CD2-CG2 3.51Å; F22-V64 HydrophobicContact CE2-CB 3.53Å; F22-V64 HydrophobicContact CE2-CG2 3.83Å; F22-V64 HydrophobicContact CG-CB 4.44Å; F22-V64 HydrophobicContact CG-CG2 3.8Å; F22-V64 HydrophobicContact CZ-CB 4.07Å; F22-V64 HydrophobicContact CZ-CG2 4.39Å; F22-L69 HydrophobicContact CE1-CD1 3.81Å; F22-L69 HydrophobicContact CE1-CD2 4.49Å; F22-L69 HydrophobicContact CZ-CB 4.48Å; F22-L69 HydrophobicContact CZ-CD1 4.09Å; F22-L69 HydrophobicContact CZ-CD2 4.14Å; F22-L69 HydrophobicContact CZ-CG 4.46Å
23	F	38.4	Very low	34.3	Very low	67 Å²	67	80.2 Å²	80.2	29%	0.294	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.2	-176.3	-72.4	-118.9	0	0	0	110.4	I13 A37 L61 L115 M133	I13-F23 HydrophobicContact CD1-CE2 3.73Å; I13-F23 HydrophobicContact CD1-CZ 3.93Å; F23-A37 PolarHBondContact O-N 3.36Å; F23-L61 HydrophobicContact CD1-CD1 4.43Å; F23-L61 HydrophobicContact CD2-CD1 3.88Å; F23-L61 HydrophobicContact CE1-CD1 4.3Å; F23-L61 HydrophobicContact CE2-CD1 3.71Å; F23-L61 HydrophobicContact CG-CD1 4.21Å; F23-L61 HydrophobicContact CZ-CD1 3.93Å; F23-L115 HydrophobicContact CE1-CD1 4.25Å; F23-L115 HydrophobicContact CZ-CD1 4.08Å; F23-L115 HydrophobicContact CZ-CD2 4.44Å; F23-M133 HydrophobicContact CD1-CE 3.23Å; F23-M133 HydrophobicContact CD1-SD 3.34Å; F23-M133 WeakPolarHBondContact CD1-SD 3.35Å; F23-M133 HydrophobicContact CE1-CE 3.41Å; F23-M133 VanDerWaalsContact CE1-CE 3.41Å; F23-M133 HydrophobicContact CE1-SD 3.31Å; F23-M133 WeakPolarHBondContact CE1-SD 3.42Å; F23-M133 HydrophobicContact CG-CE 3.99Å; F23-M133 HydrophobicContact CZ-CE 4.28Å
24	F	42.1	Very low	34.2	Very low	5 Å²	5	76.9 Å²	76.9	2%	0.022	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	168.1	-171.4	-72.9	-113	0	0	0	110.6	F22 F26 I36 F60 V62 V64	F22-F24 HydrophobicContact CB-CD2 4.3Å; F22-F24 HydrophobicContact CB-CE2 3.63Å; F24-F26 HydrophobicContact CB-CE2 4.3Å; F24-F26 HydrophobicContact CB-CZ 4.41Å; F24-F26 HydrophobicContact CD1-CE1 4.42Å; F24-F26 AromaticContact CD1-CZ 3.9Å; F24-F26 HydrophobicContact CD1-CZ 3.9Å; F24-F26 HydrophobicContact CG-CZ 4.48Å; F24-I36 HydrophobicContact CD1-CB 4.43Å; F24-I36 HydrophobicContact CD1-CD1 4.12Å; F24-I36 HydrophobicContact CD1-CG1 3.84Å; F24-I36 HydrophobicContact CD1-CG2 4.07Å; F24-I36 HydrophobicContact CE1-CB 4.28Å; F24-I36 HydrophobicContact CE1-CD1 3.71Å; F24-I36 HydrophobicContact CE1-CG1 3.82Å; F24-I36 HydrophobicContact CE1-CG2 3.57Å; F24-I36 HydrophobicContact CE2-CG2 4.04Å; F24-I36 HydrophobicContact CZ-CG2 3.54Å; F24-F60 CarbonylContact C-O 3.58Å; F24-F60 WeakPolarHBondContact CA-O 3.4Å; F24-F60 HydrophobicContact CB-CB 4.26Å; F24-F60 PolarHBondContact N-O 3.4Å; F24-F60 CarbonylContact O-C 3.51Å; F24-F60 PolarHBondContact O-N 2.89Å; F24-V62 HydrophobicContact CB-CG2 3.63Å; F24-V62 HydrophobicContact CD1-CG1 4.32Å; F24-V62 HydrophobicContact CD1-CG2 3.79Å; F24-V62 HydrophobicContact CD2-CB 3.62Å; F24-V62 HydrophobicContact CD2-CG1 3.63Å; F24-V62 HydrophobicContact CD2-CG2 3.28Å; F24-V62 HydrophobicContact CE1-CG1 3.9Å; F24-V62 HydrophobicContact CE1-CG2 4.25Å; F24-V62 HydrophobicContact CE2-CB 3.72Å; F24-V62 HydrophobicContact CE2-CG1 3.17Å; F24-V62 HydrophobicContact CE2-CG2 3.84Å; F24-V62 HydrophobicContact CG-CB 4.13Å; F24-V62 HydrophobicContact CG-CG1 4.21Å; F24-V62 HydrophobicContact CG-CG2 3.29Å; F24-V62 HydrophobicContact CZ-CB 4.25Å; F24-V62 HydrophobicContact CZ-CG1 3.32Å; F24-V62 HydrophobicContact CZ-CG2 4.29Å; F24-V64 HydrophobicContact CE2-CG2 3.88Å; F24-V64 HydrophobicContact CZ-CG2 3.62Å
25	V	36.4	Very low	34.4	Very low	28 Å²	28	75.5 Å²	75.5	17%	0.17	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	126.4	173.1	-176.8	0	0	0	0	107.7	L35 V57 P59 L130	V25-L35 PolarHBondContact N-O 3.24Å; V25-V57 HydrophobicContact CG1-CG1 3.1Å; V25-P59 HydrophobicContact CG2-CB 4.35Å; V25-L130 HydrophobicContact CG2-CD1 4.15Å
26	F	38.8	Very low	34.9	Very low	17 Å²	17	64.7 Å²	64.7	8%	0.075	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	153.4	178	-63.6	-62.8	0	0	0	111.2	F24 Y34 T58 F60 V62 L84 I89 A137	F24-F26 HydrophobicContact CB-CE2 4.3Å; F24-F26 HydrophobicContact CB-CZ 4.41Å; F24-F26 HydrophobicContact CD1-CE1 4.42Å; F24-F26 AromaticContact CD1-CZ 3.9Å; F24-F26 HydrophobicContact CD1-CZ 3.9Å; F24-F26 HydrophobicContact CG-CZ 4.48Å; F26-Y34 HydrophobicContact CD1-CD1 4.15Å; F26-Y34 HydrophobicContact CD1-CE1 4.11Å; F26-Y34 HydrophobicContact CE1-CD1 4.25Å; F26-Y34 HydrophobicContact CE1-CE1 4.27Å; F26-T58 PolarHBondContact N-O 3.4Å; F26-T58 VanDerWaalsContact N-O 3.12Å; F26-F60 HydrophobicContact CB-CD2 3.94Å; F26-F60 HydrophobicContact CB-CE2 3.74Å; F26-F60 HydrophobicContact CB-CZ 4.32Å; F26-F60 HydrophobicContact CD2-CB 3.94Å; F26-F60 AromaticContact CD2-CD1 3.72Å; F26-F60 HydrophobicContact CD2-CD1 3.72Å; F26-F60 AromaticContact CD2-CD2 3.59Å; F26-F60 HydrophobicContact CD2-CD2 3.59Å; F26-F60 HydrophobicContact CD2-CE1 4.05Å; F26-F60 AromaticContact CD2-CE2 3.94Å; F26-F60 HydrophobicContact CD2-CE2 3.94Å; F26-F60 AromaticContact CD2-CG 3.5Å; F26-F60 HydrophobicContact CD2-CG 3.5Å; F26-F60 HydrophobicContact CD2-CZ 4.16Å; F26-F60 HydrophobicContact CE2-CB 4.17Å; F26-F60 HydrophobicContact CE2-CD1 4.18Å; F26-F60 HydrophobicContact CE2-CG 4.11Å; F26-F60 HydrophobicContact CG-CD2 4.21Å; F26-F60 HydrophobicContact CG-CE2 4.35Å; F26-V62 HydrophobicContact CE2-CG2 3.83Å; F26-V62 HydrophobicContact CZ-CG2 4.17Å; F26-L84 HydrophobicContact CD1-CD1 3.9Å; F26-L84 HydrophobicContact CE1-CD1 3.47Å; F26-L84 VanDerWaalsContact CE1-CD1 3.47Å; F26-L84 HydrophobicContact CZ-CD1 4.03Å; F26-I89 HydrophobicContact CE1-CD1 4.28Å; F26-I89 HydrophobicContact CZ-CD1 4.32Å; F26-A137 HydrophobicContact CE2-CB 4.38Å
27	N	32.3	Very low	35.3	Very low	32 Å²	32	61.7 Å²	61.7	17%	0.171	38%	0.381	C	S	.	.			trans	-131.1	134.5	-179.8	-126.6	-30.9	0	0	0	109.4	R56	N27-R56 PolarHBondContact OD1-O 3.24Å
28	L	34.6	Very low	35.3	Very low	141 Å²	141	57.3 Å²	57.3	74%	0.738	35%	0.348	S	S	*	.			trans	-137.5	144	174.7	-82.9	93.6	0	0	0	109.7
29	P	37.9	Very low	34.9	Very low	108 Å²	108	52.8 Å²	52.8	70%	0.701	32%	0.317	S	S	*	.	S	Bend	cis	-133	117.3	-21.2	33.8	-15.5	0	0	0	113.2
30	T	26	Very low	34.7	Very low	148 Å²	148	50.8 Å²	50.8	91%	0.908	31%	0.306	S	S	*	.	S	Bend	trans	-173.6	-29	149	7	0	0	0	0	113
31	T	25.9	Very low	34.4	Very low	98 Å²	98	51.9 Å²	51.9	60%	0.601	31%	0.312	S	S	*	.			trans	-141	124.1	173.7	-50.2	0	0	0	0	109
32	V	29.9	Very low	34.2	Very low	65 Å²	65	54.3 Å²	54.3	39%	0.394	33%	0.329	S	S	.	.			trans	-107.1	133.4	-175.5	-152.8	0	0	0	0	111	Y34	V32-Y34 HydrophobicContact CB-CE1 4.42Å; V32-Y34 HydrophobicContact CB-CE2 3.9Å; V32-Y34 HydrophobicContact CG1-CD1 4.1Å; V32-Y34 HydrophobicContact CG1-CD2 4.37Å; V32-Y34 HydrophobicContact CG1-CE1 3.44Å; V32-Y34 VanDerWaalsContact CG1-CE1 3.44Å; V32-Y34 HydrophobicContact CG1-CE2 3.74Å; V32-Y34 WeakPolarHBondContact CG1-OH 3.48Å
33	T	29.8	Very low	33.9	Very low	37 Å²	37	58.4 Å²	58.4	23%	0.227	35%	0.348	C	S	.	.			trans	-142.7	123.6	179.3	-39.7	0	0	0	0	108.1	A48 N49	T33-A48 HydrophobicContact CG2-CB 3.64Å; T33-N49 WeakPolarHBondContact CG2-O 3.5Å
34	Y	35.3	Very low	33.6	Very low	21 Å²	21	56.3 Å²	56.3	8%	0.082	34%	0.343	C	S	.	.			trans	-112.1	131.8	-160.1	-55.2	-93.3	0	0	0	113	F26 V32 L47 A48 T82 L84	F26-Y34 HydrophobicContact CD1-CD1 4.15Å; F26-Y34 HydrophobicContact CD1-CE1 4.11Å; F26-Y34 HydrophobicContact CE1-CD1 4.25Å; F26-Y34 HydrophobicContact CE1-CE1 4.27Å; V32-Y34 HydrophobicContact CB-CE1 4.42Å; V32-Y34 HydrophobicContact CB-CE2 3.9Å; V32-Y34 HydrophobicContact CG1-CD1 4.1Å; V32-Y34 HydrophobicContact CG1-CD2 4.37Å; V32-Y34 HydrophobicContact CG1-CE1 3.44Å; V32-Y34 VanDerWaalsContact CG1-CE1 3.44Å; V32-Y34 HydrophobicContact CG1-CE2 3.74Å; V32-Y34 WeakPolarHBondContact CG1-OH 3.48Å; Y34-L47 CarbonylContact O-C 3.6Å; Y34-A48 VanDerWaalsContact O-CB 3.23Å; Y34-A48 WeakPolarHBondContact O-CB 3.4Å; Y34-A48 PolarHBondContact O-N 2.68Å; Y34-T82 WeakPolarHBondContact CE2-O 3.45Å; Y34-L84 HydrophobicContact CE1-CB 4.07Å; Y34-L84 WeakPolarHBondContact OH-CB 3.45Å; Y34-L84 PolarHBondContact OH-N 3.09Å
35	L	35.6	Very low	33.4	Very low	47 Å²	47	58.4 Å²	58.4	25%	0.246	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.4	159.3	-88.1	108.4	0	0	0	109.5	F8 V25 R50	F8-L35 HydrophobicContact CE2-CD2 4.13Å; F8-L35 HydrophobicContact CZ-CD2 4.17Å; V25-L35 PolarHBondContact N-O 3.24Å; L35-R50 HydrophobicContact CD1-CB 4.49Å
36	I	40.6	Very low	33.7	Very low	4 Å²	4	60.8 Å²	60.8	2%	0.021	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	128.6	179.4	-52.6	-179.2	0	0	0	106.9	F24 L47 L72 F91	F24-I36 HydrophobicContact CD1-CB 4.43Å; F24-I36 HydrophobicContact CD1-CD1 4.12Å; F24-I36 HydrophobicContact CD1-CG1 3.84Å; F24-I36 HydrophobicContact CD1-CG2 4.07Å; F24-I36 HydrophobicContact CE1-CB 4.28Å; F24-I36 HydrophobicContact CE1-CD1 3.71Å; F24-I36 HydrophobicContact CE1-CG1 3.82Å; F24-I36 HydrophobicContact CE1-CG2 3.57Å; F24-I36 HydrophobicContact CE2-CG2 4.04Å; F24-I36 HydrophobicContact CZ-CG2 3.54Å; I36-L47 HydrophobicContact CB-CD1 3.78Å; I36-L47 HydrophobicContact CD1-CD1 4.04Å; I36-L47 HydrophobicContact CG1-CD1 4.16Å; I36-L72 HydrophobicContact CB-CD1 4.32Å; I36-L72 HydrophobicContact CD1-CD1 3.6Å; I36-L72 HydrophobicContact CG2-CD1 3.99Å; I36-L72 HydrophobicContact CG2-CD2 3.73Å; I36-L72 HydrophobicContact CG2-CG 4.49Å; I36-F91 HydrophobicContact CD1-CD1 4.45Å; I36-F91 HydrophobicContact CD1-CE1 3.9Å
37	A	37.7	Very low	34	Very low	29 Å²	29	61.6 Å²	61.6	24%	0.24	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.2	-177.3	0	0	0	0	0	115.5	F23	F23-A37 PolarHBondContact O-N 3.36Å
38	M	31.3	Very low	34.6	Very low	28 Å²	28	61.7 Å²	61.7	14%	0.138	38%	0.379	C	S	.	.			trans	76.9	89.8	169	-49.8	-59.5	-70.9	0	0	117.4	A10 F22 A40 E43 A44	A10-M38 HydrophobicContact CB-CE 4.09Å; A10-M38 HydrophobicContact CB-CG 3.89Å; A10-M38 HydrophobicContact CB-SD 4.12Å; F22-M38 WeakPolarHBondContact CD1-O 3.37Å; M38-A40 WeakPolarHBondContact CE-O 3.39Å; M38-E43 WeakPolarHBondContact CA-O 3.41Å; M38-A44 HydrophobicContact SD-CB 4.26Å
39	A	29.7	Very low	35.2	Very low	13 Å²	13	62.1 Å²	62.1	11%	0.107	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-93	114.2	146.7	0	0	0	0	0	107.9	F22 E43 F45 L69	F22-A39 HydrophobicContact CE1-CB 4.03Å; A39-E43 WeakPolarHBondContact O-CB 3.27Å; A39-F45 HydrophobicContact CB-CE2 4.08Å; A39-L69 HydrophobicContact CB-CD1 3.95Å; A39-L69 HydrophobicContact CB-CD2 4.32Å
40	A	31.3	Very low	35.8	Very low	53 Å²	53	60.2 Å²	60.2	44%	0.438	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	166.5	-175.7	0	0	0	0	0	115.6	M38 S42	M38-A40 WeakPolarHBondContact CE-O 3.39Å; A40-S42 PolarHBondContact O-N 3.2Å; A40-S42 VanDerWaalsContact O-N 3.14Å
41	P	31.5	Very low	36.8	Very low	89 Å²	89	56.4 Å²	56.4	58%	0.578	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-0.3	-170.5	-19.1	33.7	0	0	0	116.4
42	S	33.1	Very low	37.7	Very low	106 Å²	106	57.6 Å²	57.6	74%	0.741	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	-6.8	-170.5	52.9	0	0	0	0	114.5	A40	A40-S42 PolarHBondContact O-N 3.2Å; A40-S42 VanDerWaalsContact O-N 3.14Å
43	E	32.8	Very low	38.5	Very low	90 Å²	90	57.7 Å²	57.7	42%	0.421	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-118.7	104.5	-177.3	-53.8	-175.5	151.7	0	0	111.4	M38 A39 F45	M38-E43 WeakPolarHBondContact CA-O 3.41Å; A39-E43 WeakPolarHBondContact O-CB 3.27Å; E43-F45 HydrophobicContact CB-CD2 4.37Å; E43-F45 HydrophobicContact CB-CE2 3.5Å; E43-F45 VanDerWaalsContact CB-CE2 3.5Å; E43-F45 HydrophobicContact CB-CZ 3.61Å; E43-F45 HydrophobicContact CG-CZ 4.35Å; E43-F45 WeakPolarHBondContact OE2-CZ 3.23Å
44	A	33	Very low	39.5	Very low	23 Å²	23	58.3 Å²	58.3	19%	0.19	37%	0.367	C	S	.	.			trans	-95.7	133.2	169.2	0	0	0	0	0	109.8	F8 M38	F8-A44 HydrophobicContact CB-CB 4.26Å; F8-A44 VanDerWaalsContact O-CB 3.26Å; F8-A44 WeakPolarHBondContact O-CB 3.47Å; M38-A44 HydrophobicContact SD-CB 4.26Å
45	F	38.2	Very low	40.1	Very low	50 Å²	50	63.4 Å²	63.4	22%	0.219	40%	0.402	C	S	.	.			trans	-123.4	125.1	-176.3	-63.7	-74.2	0	0	0	109.7	A39 E43 L76	A39-F45 HydrophobicContact CB-CE2 4.08Å; E43-F45 HydrophobicContact CB-CD2 4.37Å; E43-F45 HydrophobicContact CB-CE2 3.5Å; E43-F45 VanDerWaalsContact CB-CE2 3.5Å; E43-F45 HydrophobicContact CB-CZ 3.61Å; E43-F45 HydrophobicContact CG-CZ 4.35Å; E43-F45 WeakPolarHBondContact OE2-CZ 3.23Å; F45-L76 HydrophobicContact CB-CD1 3.53Å; F45-L76 HydrophobicContact CB-CD2 3.83Å; F45-L76 HydrophobicContact CB-CG 4.35Å; F45-L76 HydrophobicContact CD1-CD1 3.7Å; F45-L76 HydrophobicContact CG-CD1 3.69Å
46	P	43.4	Very low	41.1	Very low	78 Å²	78	71.4 Å²	71.4	51%	0.506	43%	0.429	S	S	.	.			trans	-100.4	123	176.2	33.4	-28.1	0	0	0	111.3	L76	P46-L76 VanDerWaalsContact O-CD2 3.3Å; P46-L76 WeakPolarHBondContact O-CD2 3.37Å
47	L	43.5	Very low	42.1	Very low	33 Å²	33	72.4 Å²	72.4	17%	0.173	44%	0.436	C	S	.	.			trans	-108.7	-21.6	-174.2	-108.1	134.4	0	0	0	116.8	Y34 I36 L72 L76 T82	Y34-L47 CarbonylContact O-C 3.6Å; I36-L47 HydrophobicContact CB-CD1 3.78Å; I36-L47 HydrophobicContact CD1-CD1 4.04Å; I36-L47 HydrophobicContact CG1-CD1 4.16Å; L47-L72 HydrophobicContact CD1-CD1 3.42Å; L47-L72 VanDerWaalsContact CD1-CD1 3.42Å; L47-L72 HydrophobicContact CD1-CG 4.2Å; L47-L76 HydrophobicContact CB-CD2 4.45Å; L47-L76 HydrophobicContact CD1-CD1 3.75Å; L47-L76 HydrophobicContact CD1-CD2 3.65Å; L47-L76 HydrophobicContact CD1-CG 3.54Å; L47-L76 HydrophobicContact CD2-CG 4.45Å; L47-L76 HydrophobicContact CG-CD1 4.5Å; L47-L76 HydrophobicContact CG-CD2 3.57Å; L47-L76 HydrophobicContact CG-CG 3.77Å; L47-T82 WeakPolarHBondContact CD2-OG1 3.48Å
48	A	46.3	Very low	43.6	Very low	35 Å²	35	73.6 Å²	73.6	29%	0.289	44%	0.44	S	S	.	.			trans	-159.8	148.9	167.1	0	0	0	0	0	112.2	T33 Y34 R50	T33-A48 HydrophobicContact CG2-CB 3.64Å; Y34-A48 VanDerWaalsContact O-CB 3.23Å; Y34-A48 WeakPolarHBondContact O-CB 3.4Å; Y34-A48 PolarHBondContact O-N 2.68Å; A48-R50 PolarHBondContact O-N 2.69Å
49	N	46	Very low	45.4	Very low	149 Å²	149	72.5 Å²	72.5	80%	0.797	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-73	119.2	165	-86.7	-8.3	0	0	0	109.5	T33	T33-N49 WeakPolarHBondContact CG2-O 3.5Å
50	R	50.4	Low	47.4	Very low	68 Å²	68	73 Å²	73	26%	0.257	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-67.3	126.9	168	175.5	176.2	169.1	-126.3	-6.1	109.7	L35 A48 S52 L54 E119	L35-R50 HydrophobicContact CD1-CB 4.49Å; A48-R50 PolarHBondContact O-N 2.69Å; R50-S52 PolarHBondContact O-N 3.14Å; R50-L54 PolarHBondContact NH2-O 2.74Å; R50-E119 IonicContact CZ-OE2 3.29Å; R50-E119 IonicContact NH1-OE2 3.7Å; R50-E119 PolarHBondContact NH1-OE2 2.95Å
51	P	46.6	Very low	49.4	Very low	68 Å²	68	71.1 Å²	71.1	44%	0.442	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-64.6	130.9	170.4	26.1	-33.2	0	0	0	110.2	G53 L54	P51-G53 PolarHBondContact O-N 3.2Å; P51-L54 HydrophobicContact CG-CD1 3.97Å; P51-L54 HydrophobicContact CG-CG 4.45Å
52	S	45.8	Very low	51.6	Low	124 Å²	124	67 Å²	67	87%	0.867	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	94.8	178.2	52.1	0	0	0	0	110.6	R50	R50-S52 PolarHBondContact O-N 3.14Å
53	G	47.5	Very low	53.8	Low	67 Å²	67	65.2 Å²	65.2	69%	0.691	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	163.6	-16.2	177.9	0	0	0	0	0	116.6	P51 P55	P51-G53 PolarHBondContact O-N 3.2Å; G53-P55 WeakPolarHBondContact O-CD 3.25Å
54	L	49.4	Very low	56.1	Low	50 Å²	50	61.5 Å²	61.5	26%	0.262	35%	0.353	S	S	.	.			trans	-69.3	120.9	-176	-73.8	167.1	0	0	0	112.5	R50 P51 R56	R50-L54 PolarHBondContact NH2-O 2.74Å; P51-L54 HydrophobicContact CG-CD1 3.97Å; P51-L54 HydrophobicContact CG-CG 4.45Å; L54-R56 PolarHBondContact O-N 3.16Å
55	P	49.6	Very low	58.3	Low	127 Å²	127	61.4 Å²	61.4	83%	0.825	35%	0.35	S	S	*	.	S	Bend	trans	-80.4	-17.5	-164.5	30.3	-36.8	0	0	0	115.4	G53	G53-P55 WeakPolarHBondContact O-CD 3.25Å
56	R	55.6	Low	60.1	Low	216 Å²	216	61.7 Å²	61.7	82%	0.815	35%	0.354	S	S	*	.			trans	-140.3	148	174	-81.6	-174.7	166.4	-173.4	-3.2	110.2	N27 L54	N27-R56 PolarHBondContact OD1-O 3.24Å; L54-R56 PolarHBondContact O-N 3.16Å
57	V	62.7	Low	61.9	Low	25 Å²	25	58.7 Å²	58.7	15%	0.152	33%	0.334	C	S	.	.			trans	-146.9	132.3	-177.3	178.7	0	0	0	0	107.1	V25 L130	V25-V57 HydrophobicContact CG1-CG1 3.1Å; V57-L130 HydrophobicContact CB-CD2 4.42Å; V57-L130 HydrophobicContact CG1-CD2 4.18Å
58	T	68	Low	63.6	Low	54 Å²	54	57.1 Å²	57.1	33%	0.331	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.6	-179.1	-58.7	0	0	0	0	109.9	F26 F60 Y135	F26-T58 PolarHBondContact N-O 3.4Å; F26-T58 VanDerWaalsContact N-O 3.12Å; T58-F60 HydrophobicContact CG2-CD2 4.14Å; T58-F60 HydrophobicContact CG2-CE2 3.61Å; T58-F60 HydrophobicContact CG2-CZ 4.38Å; T58-F60 VanDerWaalsContact O-CD2 3.3Å; T58-F60 WeakPolarHBondContact O-CD2 3.49Å; T58-Y135 HydrophobicContact CG2-CD2 3.93Å; T58-Y135 HydrophobicContact CG2-CE2 4.1Å
59	P	69.9	Low	65.3	Low	5 Å²	5	56.7 Å²	56.7	3%	0.032	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	139.9	177.4	33.9	-34.7	0	0	0	111.5	V25 A117 M133	V25-P59 HydrophobicContact CG2-CB 4.35Å; P59-A117 HydrophobicContact CB-CB 3.54Å; P59-A117 HydrophobicContact CG-CB 3.92Å; P59-M133 HydrophobicContact CB-CG 3.77Å; P59-M133 HydrophobicContact CG-CG 3.96Å
60	F	71.3	Confident	66.8	Low	23 Å²	23	55.8 Å²	55.8	10%	0.101	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.7	-179.7	-75.5	-115.8	0	0	0	109.7	F24 F26 T58 V62 V102 Y135	F24-F60 CarbonylContact C-O 3.58Å; F24-F60 WeakPolarHBondContact CA-O 3.4Å; F24-F60 HydrophobicContact CB-CB 4.26Å; F24-F60 PolarHBondContact N-O 3.4Å; F24-F60 CarbonylContact O-C 3.51Å; F24-F60 PolarHBondContact O-N 2.89Å; F26-F60 HydrophobicContact CB-CD2 3.94Å; F26-F60 HydrophobicContact CB-CE2 3.74Å; F26-F60 HydrophobicContact CB-CZ 4.32Å; F26-F60 HydrophobicContact CD2-CB 3.94Å; F26-F60 AromaticContact CD2-CD1 3.72Å; F26-F60 HydrophobicContact CD2-CD1 3.72Å; F26-F60 AromaticContact CD2-CD2 3.59Å; F26-F60 HydrophobicContact CD2-CD2 3.59Å; F26-F60 HydrophobicContact CD2-CE1 4.05Å; F26-F60 AromaticContact CD2-CE2 3.94Å; F26-F60 HydrophobicContact CD2-CE2 3.94Å; F26-F60 AromaticContact CD2-CG 3.5Å; F26-F60 HydrophobicContact CD2-CG 3.5Å; F26-F60 HydrophobicContact CD2-CZ 4.16Å; F26-F60 HydrophobicContact CE2-CB 4.17Å; F26-F60 HydrophobicContact CE2-CD1 4.18Å; F26-F60 HydrophobicContact CE2-CG 4.11Å; F26-F60 HydrophobicContact CG-CD2 4.21Å; F26-F60 HydrophobicContact CG-CE2 4.35Å; T58-F60 HydrophobicContact CG2-CD2 4.14Å; T58-F60 HydrophobicContact CG2-CE2 3.61Å; T58-F60 HydrophobicContact CG2-CZ 4.38Å; T58-F60 VanDerWaalsContact O-CD2 3.3Å; T58-F60 WeakPolarHBondContact O-CD2 3.49Å; F60-V62 HydrophobicContact CB-CG2 4.44Å; F60-V102 HydrophobicContact CE1-CG1 4.04Å; F60-Y135 CarbonylContact C-O 3.51Å; F60-Y135 VanDerWaalsContact CA-O 3.25Å; F60-Y135 WeakPolarHBondContact CA-O 3.27Å; F60-Y135 HydrophobicContact CD1-CG 4.38Å; F60-Y135 HydrophobicContact CE1-CD2 4.08Å; F60-Y135 AromaticContact CE1-CG 3.96Å; F60-Y135 HydrophobicContact CE1-CG 3.96Å; F60-Y135 HydrophobicContact CE2-CD2 4.32Å; F60-Y135 AromaticContact CZ-CD2 3.9Å; F60-Y135 HydrophobicContact CZ-CD2 3.9Å; F60-Y135 HydrophobicContact CZ-CG 4.25Å
61	L	73.9	Confident	68.2	Low	13 Å²	13	53.6 Å²	53.6	7%	0.068	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	147.1	154.2	-164.9	77.4	0	0	0	107	F22 F23 M105 L115 M133 Y135 R136 A137	F22-L61 WeakPolarHBondContact O-CD1 3.27Å; F22-L61 WeakPolarHBondContact O-CG 3.16Å; F23-L61 HydrophobicContact CD1-CD1 4.43Å; F23-L61 HydrophobicContact CD2-CD1 3.88Å; F23-L61 HydrophobicContact CE1-CD1 4.3Å; F23-L61 HydrophobicContact CE2-CD1 3.71Å; F23-L61 HydrophobicContact CG-CD1 4.21Å; F23-L61 HydrophobicContact CZ-CD1 3.93Å; L61-M105 HydrophobicContact CB-CE 4.33Å; L61-M105 HydrophobicContact CB-SD 3.69Å; L61-M105 HydrophobicContact CD2-CE 4Å; L61-M105 HydrophobicContact CD2-SD 4.3Å; L61-L115 HydrophobicContact CD1-CD1 4.47Å; L61-M133 VanDerWaalsContact CA-CE 3.5Å; L61-M133 HydrophobicContact CB-CE 3.63Å; L61-M133 HydrophobicContact CD1-CE 3.69Å; L61-M133 HydrophobicContact CG-CE 4.29Å; L61-M133 VanDerWaalsContact N-CE 3.31Å; L61-Y135 PolarHBondContact N-O 3.22Å; L61-R136 HydrophobicContact CB-CB 4.15Å; L61-R136 HydrophobicContact CB-CG 4.31Å; L61-R136 HydrophobicContact CD2-CG 4.19Å; L61-R136 CarbonylContact O-C 3.56Å; L61-R136 WeakPolarHBondContact O-CA 3.46Å; L61-A137 PolarHBondContact O-N 2.85Å
62	V	76.4	Confident	69.7	Low	2 Å²	2	50.7 Å²	50.7	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151	154.1	119.3	0	0	0	0	113.1	F22 F24 F26 F60 V64 A137 I139	F22-V62 CarbonylContact C-O 3.41Å; F22-V62 WeakPolarHBondContact CA-O 3.36Å; F22-V62 WeakPolarHBondContact CB-O 3.41Å; F22-V62 PolarHBondContact N-O 3.28Å; F22-V62 PolarHBondContact O-N 3.4Å; F24-V62 HydrophobicContact CB-CG2 3.63Å; F24-V62 HydrophobicContact CD1-CG1 4.32Å; F24-V62 HydrophobicContact CD1-CG2 3.79Å; F24-V62 HydrophobicContact CD2-CB 3.62Å; F24-V62 HydrophobicContact CD2-CG1 3.63Å; F24-V62 HydrophobicContact CD2-CG2 3.28Å; F24-V62 HydrophobicContact CE1-CG1 3.9Å; F24-V62 HydrophobicContact CE1-CG2 4.25Å; F24-V62 HydrophobicContact CE2-CB 3.72Å; F24-V62 HydrophobicContact CE2-CG1 3.17Å; F24-V62 HydrophobicContact CE2-CG2 3.84Å; F24-V62 HydrophobicContact CG-CB 4.13Å; F24-V62 HydrophobicContact CG-CG1 4.21Å; F24-V62 HydrophobicContact CG-CG2 3.29Å; F24-V62 HydrophobicContact CZ-CB 4.25Å; F24-V62 HydrophobicContact CZ-CG1 3.32Å; F24-V62 HydrophobicContact CZ-CG2 4.29Å; F26-V62 HydrophobicContact CE2-CG2 3.83Å; F26-V62 HydrophobicContact CZ-CG2 4.17Å; F60-V62 HydrophobicContact CB-CG2 4.44Å; V62-V64 HydrophobicContact CG1-CG2 3.91Å; V62-A137 CarbonylContact C-O 3.36Å; V62-A137 WeakPolarHBondContact CA-O 3.45Å; V62-A137 HydrophobicContact CB-CB 3.83Å; V62-A137 VanDerWaalsContact CB-O 3.3Å; V62-A137 WeakPolarHBondContact CB-O 3.45Å; V62-A137 HydrophobicContact CG2-CB 3.57Å; V62-I139 HydrophobicContact CG1-CD1 4.27Å
63	K	80.3	Confident	71.1	Confident	69 Å²	69	47.6 Å²	47.6	30%	0.3	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.6	171.6	-68.2	173.9	175.2	174.4	0	107.8	A137 T138 I139	K63-A137 PolarHBondContact N-O 3.03Å; K63-T138 HydrophobicContact CB-CG2 4.11Å; K63-I139 PolarHBondContact O-N 3.03Å
64	V	79.6	Confident	72.5	Confident	13 Å²	13	47.9 Å²	47.9	8%	0.079	24%	0.241	C	C	.	.			trans	-111.3	138.7	-179.3	-164.9	0	0	0	0	108.1	F22 F24 V62 L69 I139	F22-V64 HydrophobicContact CB-CG2 4.18Å; F22-V64 HydrophobicContact CD1-CG2 4.36Å; F22-V64 HydrophobicContact CD2-CB 3.74Å; F22-V64 HydrophobicContact CD2-CG2 3.51Å; F22-V64 HydrophobicContact CE2-CB 3.53Å; F22-V64 HydrophobicContact CE2-CG2 3.83Å; F22-V64 HydrophobicContact CG-CB 4.44Å; F22-V64 HydrophobicContact CG-CG2 3.8Å; F22-V64 HydrophobicContact CZ-CB 4.07Å; F22-V64 HydrophobicContact CZ-CG2 4.39Å; F24-V64 HydrophobicContact CE2-CG2 3.88Å; F24-V64 HydrophobicContact CZ-CG2 3.62Å; V62-V64 HydrophobicContact CG1-CG2 3.91Å; V64-L69 HydrophobicContact CG1-CB 4.28Å; V64-L69 VanDerWaalsContact CG1-N 3.26Å; V64-I139 HydrophobicContact CB-CD1 4.28Å; V64-I139 HydrophobicContact CG1-CD1 3.83Å; V64-I139 HydrophobicContact CG2-CD1 4.16Å
65	T	80.7	Confident	73.6	Confident	20 Å²	20	45.6 Å²	45.6	12%	0.123	23%	0.23	C	C	.	.			trans	-74.8	164.7	171.6	55.6	0	0	0	0	110.7	S67 G68 L69 I139	T65-S67 PolarHBondContact O-N 2.99Å; T65-S67 PolarHBondContact OG1-OG 2.72Å; T65-S67 VanDerWaalsContact OG1-OG 3.06Å; T65-G68 PolarHBondContact O-N 2.89Å; T65-G68 PolarHBondContact OG1-N 3.38Å; T65-L69 WeakPolarHBondContact O-CB 3.16Å; T65-L69 PolarHBondContact O-N 3.19Å; T65-I139 HydrophobicContact CG2-CG2 4.09Å
66	D	76.2	Confident	74.5	Confident	57 Å²	57	41 Å²	41	31%	0.305	20%	0.198	S	C	.	.	H	α-helix	trans	-56.8	-37.8	173.7	-81.6	3.4	0	0	0	112.6	K70 K152	D66-K70 PolarHBondContact O-N 3.4Å; D66-K70 VanDerWaalsContact O-N 3.09Å; D66-K152 IonicContact OD2-NZ 2.95Å; D66-K152 PolarHBondContact OD2-NZ 3.04Å
67	S	79.8	Confident	75.3	Confident	14 Å²	14	38.3 Å²	38.3	10%	0.098	19%	0.194	C	C	.	.	H	α-helix	trans	-68	-44.3	176.1	50	0	0	0	0	112.1	T65 K70 S71 T142	T65-S67 PolarHBondContact O-N 2.99Å; T65-S67 PolarHBondContact OG1-OG 2.72Å; T65-S67 VanDerWaalsContact OG1-OG 3.06Å; S67-K70 PolarHBondContact O-N 3.24Å; S67-S71 PolarHBondContact O-N 3.35Å; S67-S71 PolarHBondContact O-OG 3.35Å; S67-T142 PolarHBondContact OG-OG1 3.31Å
68	G	80.7	Confident	75.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-37.1	175.7	0	0	0	0	0	112.8	T65 L72	T65-G68 PolarHBondContact O-N 2.89Å; T65-G68 PolarHBondContact OG1-N 3.38Å; G68-L72 VanDerWaalsContact O-CB 3.23Å; G68-L72 WeakPolarHBondContact O-CB 3.31Å; G68-L72 PolarHBondContact O-N 3.1Å
69	L	80.1	Confident	75.6	Confident	27 Å²	27	46.5 Å²	46.5	14%	0.141	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-42.2	175.9	173.6	60.7	0	0	0	110.8	F22 A39 V64 T65 L72 Q73	F22-L69 HydrophobicContact CE1-CD1 3.81Å; F22-L69 HydrophobicContact CE1-CD2 4.49Å; F22-L69 HydrophobicContact CZ-CB 4.48Å; F22-L69 HydrophobicContact CZ-CD1 4.09Å; F22-L69 HydrophobicContact CZ-CD2 4.14Å; F22-L69 HydrophobicContact CZ-CG 4.46Å; A39-L69 HydrophobicContact CB-CD1 3.95Å; A39-L69 HydrophobicContact CB-CD2 4.32Å; V64-L69 HydrophobicContact CG1-CB 4.28Å; V64-L69 VanDerWaalsContact CG1-N 3.26Å; T65-L69 WeakPolarHBondContact O-CB 3.16Å; T65-L69 PolarHBondContact O-N 3.19Å; L69-L72 HydrophobicContact CD1-CD2 4.38Å; L69-L72 WeakPolarHBondContact O-CB 3.15Å; L69-L72 PolarHBondContact O-N 3.37Å; L69-Q73 HydrophobicContact CD1-CG 4.23Å; L69-Q73 WeakPolarHBondContact O-CG 3.34Å; L69-Q73 PolarHBondContact O-N 2.85Å
70	K	79	Confident	75	Confident	130 Å²	130	47.2 Å²	47.2	57%	0.565	24%	0.238	S	C	*	.	H	α-helix	trans	-62.2	-51.6	176.6	-172.3	-178.8	175.8	-174.9	0	111.1	D66 S67 L72 Q73 D74	D66-K70 PolarHBondContact O-N 3.4Å; D66-K70 VanDerWaalsContact O-N 3.09Å; S67-K70 PolarHBondContact O-N 3.24Å; K70-L72 PolarHBondContact O-N 3.22Å; K70-Q73 WeakPolarHBondContact O-CB 2.98Å; K70-Q73 PolarHBondContact O-N 3.4Å; K70-D74 VanDerWaalsContact O-CG 3.23Å; K70-D74 PolarHBondContact O-N 2.72Å
71	S	79.1	Confident	74.1	Confident	22 Å²	22	50.9 Å²	50.9	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-33.4	177.5	-60.3	0	0	0	0	112.9	S67 A75	S67-S71 PolarHBondContact O-N 3.35Å; S67-S71 PolarHBondContact O-OG 3.35Å; S71-A75 VanDerWaalsContact O-CB 3.29Å; S71-A75 WeakPolarHBondContact O-CB 3.24Å; S71-A75 PolarHBondContact O-N 3.27Å
72	L	77.5	Confident	73.3	Confident	7 Å²	7	50.8 Å²	50.8	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-46.5	171.7	-179.2	72.7	0	0	0	112.1	I36 L47 G68 L69 K70 A75 L76 F91	I36-L72 HydrophobicContact CB-CD1 4.32Å; I36-L72 HydrophobicContact CD1-CD1 3.6Å; I36-L72 HydrophobicContact CG2-CD1 3.99Å; I36-L72 HydrophobicContact CG2-CD2 3.73Å; I36-L72 HydrophobicContact CG2-CG 4.49Å; L47-L72 HydrophobicContact CD1-CD1 3.42Å; L47-L72 VanDerWaalsContact CD1-CD1 3.42Å; L47-L72 HydrophobicContact CD1-CG 4.2Å; G68-L72 VanDerWaalsContact O-CB 3.23Å; G68-L72 WeakPolarHBondContact O-CB 3.31Å; G68-L72 PolarHBondContact O-N 3.1Å; L69-L72 HydrophobicContact CD1-CD2 4.38Å; L69-L72 WeakPolarHBondContact O-CB 3.15Å; L69-L72 PolarHBondContact O-N 3.37Å; K70-L72 PolarHBondContact O-N 3.22Å; L72-A75 PolarHBondContact O-N 2.74Å; L72-L76 HydrophobicContact CG-CD1 4.23Å; L72-L76 WeakPolarHBondContact O-CD1 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.19Å; L72-L76 PolarHBondContact O-N 3.22Å; L72-F91 HydrophobicContact CB-CD1 4.35Å; L72-F91 HydrophobicContact CB-CD2 4.47Å; L72-F91 HydrophobicContact CB-CG 4.24Å; L72-F91 HydrophobicContact CD1-CD1 3.6Å; L72-F91 HydrophobicContact CD1-CE1 3.74Å; L72-F91 HydrophobicContact CD1-CG 4.29Å
73	Q	75.1	Confident	72.3	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-63.5	-40.9	176.4	-72.6	172	-36.8	0	0	111.9	L69 K70 L76 Q77	L69-Q73 HydrophobicContact CD1-CG 4.23Å; L69-Q73 WeakPolarHBondContact O-CG 3.34Å; L69-Q73 PolarHBondContact O-N 2.85Å; K70-Q73 WeakPolarHBondContact O-CB 2.98Å; K70-Q73 PolarHBondContact O-N 3.4Å; Q73-L76 WeakPolarHBondContact O-CB 3.47Å; Q73-L76 PolarHBondContact O-N 3.07Å; Q73-Q77 WeakPolarHBondContact O-CG 3.39Å; Q73-Q77 PolarHBondContact O-N 3.14Å; Q73-Q77 VanDerWaalsContact O-N 3.1Å
74	D	78.3	Confident	71.2	Confident	74 Å²	74	51.9 Å²	51.9	40%	0.396	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-39.5	176.4	-60.7	-25.3	0	0	0	111.2	K70 Q77 S78	K70-D74 VanDerWaalsContact O-CG 3.23Å; K70-D74 PolarHBondContact O-N 2.72Å; D74-Q77 PolarHBondContact O-N 2.96Å; D74-S78 WeakPolarHBondContact O-CB 3.4Å; D74-S78 PolarHBondContact O-N 3.42Å; D74-S78 PolarHBondContact O-OG 2.97Å
75	A	71.2	Confident	70.2	Confident	2 Å²	2	54.3 Å²	54.3	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-41.2	174.9	0	0	0	0	0	112.6	S71 L72 S78 K79 S80 F91	S71-A75 VanDerWaalsContact O-CB 3.29Å; S71-A75 WeakPolarHBondContact O-CB 3.24Å; S71-A75 PolarHBondContact O-N 3.27Å; L72-A75 PolarHBondContact O-N 2.74Å; A75-S78 WeakPolarHBondContact CA-OG 3.4Å; A75-S78 PolarHBondContact O-N 2.8Å; A75-S78 PolarHBondContact O-OG 3.49Å; A75-K79 WeakPolarHBondContact O-CA 3.45Å; A75-K79 PolarHBondContact O-N 2.82Å; A75-S80 PolarHBondContact O-N 2.74Å; A75-F91 HydrophobicContact CB-CB 4.15Å
76	L	68.4	Low	69.3	Low	30 Å²	30	62.8 Å²	62.8	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-47.7	174.6	-84.7	153.2	0	0	0	112.4	F45 P46 L47 L72 Q73 K79	F45-L76 HydrophobicContact CB-CD1 3.53Å; F45-L76 HydrophobicContact CB-CD2 3.83Å; F45-L76 HydrophobicContact CB-CG 4.35Å; F45-L76 HydrophobicContact CD1-CD1 3.7Å; F45-L76 HydrophobicContact CG-CD1 3.69Å; P46-L76 VanDerWaalsContact O-CD2 3.3Å; P46-L76 WeakPolarHBondContact O-CD2 3.37Å; L47-L76 HydrophobicContact CB-CD2 4.45Å; L47-L76 HydrophobicContact CD1-CD1 3.75Å; L47-L76 HydrophobicContact CD1-CD2 3.65Å; L47-L76 HydrophobicContact CD1-CG 3.54Å; L47-L76 HydrophobicContact CD2-CG 4.45Å; L47-L76 HydrophobicContact CG-CD1 4.5Å; L47-L76 HydrophobicContact CG-CD2 3.57Å; L47-L76 HydrophobicContact CG-CG 3.77Å; L72-L76 HydrophobicContact CG-CD1 4.23Å; L72-L76 WeakPolarHBondContact O-CD1 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.19Å; L72-L76 PolarHBondContact O-N 3.22Å; Q73-L76 WeakPolarHBondContact O-CB 3.47Å; Q73-L76 PolarHBondContact O-N 3.07Å; L76-K79 PolarHBondContact O-N 3.18Å
77	Q	72.8	Confident	69	Low	159 Å²	159	61.6 Å²	61.6	74%	0.743	34%	0.337	S	S	*	.	H	α-helix	trans	-65.7	-42.2	179.6	-69.5	178.7	28.4	0	0	111.8	Q73 D74 K79	Q73-Q77 WeakPolarHBondContact O-CG 3.39Å; Q73-Q77 PolarHBondContact O-N 3.14Å; Q73-Q77 VanDerWaalsContact O-N 3.1Å; D74-Q77 PolarHBondContact O-N 2.96Å; Q77-K79 VanDerWaalsContact C-N 3.26Å; Q77-K79 PolarHBondContact O-N 3.32Å
78	S	70.3	Confident	68.7	Low	75 Å²	75	64.8 Å²	64.8	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-77.2	-6.3	177.3	56.5	0	0	0	0	114.3	D74 A75 S80	D74-S78 WeakPolarHBondContact O-CB 3.4Å; D74-S78 PolarHBondContact O-N 3.42Å; D74-S78 PolarHBondContact O-OG 2.97Å; A75-S78 WeakPolarHBondContact CA-OG 3.4Å; A75-S78 PolarHBondContact O-N 2.8Å; A75-S78 PolarHBondContact O-OG 3.49Å; S78-S80 PolarHBondContact O-N 2.7Å; S78-S80 WeakPolarHBondContact OG-CB 3.18Å; S78-S80 PolarHBondContact OG-OG 3.37Å
79	K	67.4	Low	68.5	Low	177 Å²	177	65 Å²	65	77%	0.77	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	28.3	-170.6	-55.7	-179.2	-179.5	179	0	113.5	A75 L76 Q77	A75-K79 WeakPolarHBondContact O-CA 3.45Å; A75-K79 PolarHBondContact O-N 2.82Å; L76-K79 PolarHBondContact O-N 3.18Å; Q77-K79 VanDerWaalsContact C-N 3.26Å; Q77-K79 PolarHBondContact O-N 3.32Å
80	S	56.6	Low	68.4	Low	20 Å²	20	65.4 Å²	65.4	14%	0.14	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-86.1	145.7	-172.9	59.1	0	0	0	0	111.2	A75 S78 G92 A93	A75-S80 PolarHBondContact O-N 2.74Å; S78-S80 PolarHBondContact O-N 2.7Å; S78-S80 WeakPolarHBondContact OG-CB 3.18Å; S78-S80 PolarHBondContact OG-OG 3.37Å; S80-G92 WeakPolarHBondContact OG-CA 3.25Å; S80-A93 PolarHBondContact OG-N 2.79Å
81	P	53	Low	68.2	Low	99 Å²	99	59.2 Å²	59.2	64%	0.643	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-67.4	141.9	-170.6	26.5	-34.7	0	0	0	111.8	G92	P81-G92 WeakPolarHBondContact O-CA 3.38Å; P81-G92 PolarHBondContact O-N 2.9Å; P81-G92 VanDerWaalsContact O-N 3.13Å
82	T	57.8	Low	67.7	Low	12 Å²	12	58.3 Å²	58.3	7%	0.074	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.5	167.5	-61.6	0	0	0	0	109.1	Y34 L47 I89 V90 F91	Y34-T82 WeakPolarHBondContact CE2-O 3.45Å; L47-T82 WeakPolarHBondContact CD2-OG1 3.48Å; T82-I89 HydrophobicContact CG2-CD1 4.36Å; T82-I89 HydrophobicContact CG2-CG1 4.1Å; T82-V90 CarbonylContact C-O 3.49Å; T82-V90 VanDerWaalsContact CA-O 3.25Å; T82-V90 WeakPolarHBondContact CA-O 3.41Å; T82-V90 WeakPolarHBondContact CG2-O 3.29Å; T82-F91 HydrophobicContact CG2-CD1 3.74Å; T82-F91 HydrophobicContact CG2-CE1 4.02Å
83	G	54.7	Low	66.6	Low	32 Å²	32	61 Å²	61	33%	0.33	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.1	174.2	0	0	0	0	0	111.3	V90	G83-V90 PolarHBondContact N-O 3.36Å; G83-V90 PolarHBondContact O-N 2.84Å
84	L	56.7	Low	66	Low	62 Å²	62	66.5 Å²	66.5	33%	0.325	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.6	169.1	-166.6	138	0	0	0	108.3	F26 Y34 Q88 I89 F100	F26-L84 HydrophobicContact CD1-CD1 3.9Å; F26-L84 HydrophobicContact CE1-CD1 3.47Å; F26-L84 VanDerWaalsContact CE1-CD1 3.47Å; F26-L84 HydrophobicContact CZ-CD1 4.03Å; Y34-L84 HydrophobicContact CE1-CB 4.07Å; Y34-L84 WeakPolarHBondContact OH-CB 3.45Å; Y34-L84 PolarHBondContact OH-N 3.09Å; L84-Q88 WeakPolarHBondContact CA-O 3.33Å; L84-I89 HydrophobicContact CD1-CB 4.45Å; L84-I89 HydrophobicContact CD1-CD1 4.15Å; L84-I89 HydrophobicContact CD1-CG1 4.29Å; L84-F100 HydrophobicContact CD1-CE1 4.01Å; L84-F100 HydrophobicContact CD1-CZ 3.99Å; L84-F100 HydrophobicContact CD2-CE1 4.49Å; L84-F100 HydrophobicContact CD2-CZ 4.21Å; L84-F100 HydrophobicContact CG-CE1 4.09Å; L84-F100 HydrophobicContact CG-CZ 4.22Å
85	S	58	Low	65.7	Low	63 Å²	63	65 Å²	65	44%	0.441	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	174.1	172.6	54.8	0	0	0	0	108.7	G87 Q88	S85-G87 PolarHBondContact O-N 3.45Å; S85-Q88 PolarHBondContact N-O 3.48Å; S85-Q88 PolarHBondContact O-N 3.03Å
86	E	62.5	Low	66.1	Low	199 Å²	199	75.2 Å²	75.2	93%	0.93	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	110.3	-170.8	-160.5	165.5	-150.1	0	0	111.7	Q88	E86-Q88 VanDerWaalsContact C-N 3.32Å; E86-Q88 PolarHBondContact O-N 3.25Å
87	G	69.3	Low	66.8	Low	31 Å²	31	77 Å²	77	32%	0.32	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	4.2	-175.5	0	0	0	0	0	116.6	S85 K99 F100	S85-G87 PolarHBondContact O-N 3.45Å; G87-K99 WeakPolarHBondContact O-CA 3.49Å; G87-F100 PolarHBondContact O-N 3.01Å
88	Q	75.2	Confident	67.3	Low	82 Å²	82	70 Å²	70	38%	0.383	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.4	-177.9	-57.8	-177.8	15.1	0	0	113.2	L84 S85 E86 P97 F98	L84-Q88 WeakPolarHBondContact CA-O 3.33Å; S85-Q88 PolarHBondContact N-O 3.48Å; S85-Q88 PolarHBondContact O-N 3.03Å; E86-Q88 VanDerWaalsContact C-N 3.32Å; E86-Q88 PolarHBondContact O-N 3.25Å; Q88-P97 HydrophobicContact CB-CB 4.19Å; Q88-P97 VanDerWaalsContact OE1-CB 3.22Å; Q88-F98 CarbonylContact C-O 3.42Å; Q88-F98 WeakPolarHBondContact CA-O 3.45Å
89	I	76	Confident	68	Low	3 Å²	3	72.6 Å²	72.6	2%	0.015	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.5	174.6	-167.6	168.1	0	0	0	110.1	F26 T82 L84 F91 F98 F100 I139	F26-I89 HydrophobicContact CE1-CD1 4.28Å; F26-I89 HydrophobicContact CZ-CD1 4.32Å; T82-I89 HydrophobicContact CG2-CD1 4.36Å; T82-I89 HydrophobicContact CG2-CG1 4.1Å; L84-I89 HydrophobicContact CD1-CB 4.45Å; L84-I89 HydrophobicContact CD1-CD1 4.15Å; L84-I89 HydrophobicContact CD1-CG1 4.29Å; I89-F91 HydrophobicContact CD1-CE1 3.57Å; I89-F91 HydrophobicContact CD1-CZ 3.64Å; I89-F91 HydrophobicContact CG1-CD1 4.47Å; I89-F91 HydrophobicContact CG1-CE1 3.84Å; I89-F91 HydrophobicContact CG1-CZ 3.92Å; I89-F91 HydrophobicContact CG2-CE2 4.11Å; I89-F91 HydrophobicContact CG2-CZ 3.98Å; I89-F98 HydrophobicContact CG2-CB 3.88Å; I89-F98 PolarHBondContact N-O 2.97Å; I89-F98 PolarHBondContact O-N 3.04Å; I89-F100 HydrophobicContact CB-CD1 4.14Å; I89-F100 HydrophobicContact CB-CE1 4.38Å; I89-F100 HydrophobicContact CG2-CD1 4.22Å; I89-I139 HydrophobicContact CG2-CD1 4.03Å; I89-I139 HydrophobicContact CG2-CG1 3.99Å
90	V	76.7	Confident	68.9	Low	37 Å²	37	65.6 Å²	65.6	22%	0.224	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.1	-176.6	178.6	0	0	0	0	108	T82 G83 G92 P97	T82-V90 CarbonylContact C-O 3.49Å; T82-V90 VanDerWaalsContact CA-O 3.25Å; T82-V90 WeakPolarHBondContact CA-O 3.41Å; T82-V90 WeakPolarHBondContact CG2-O 3.29Å; G83-V90 PolarHBondContact N-O 3.36Å; G83-V90 PolarHBondContact O-N 2.84Å; V90-G92 WeakPolarHBondContact CG1-O 3.44Å; V90-P97 HydrophobicContact CG2-CB 3.83Å
91	F	75.5	Confident	70.3	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	93.8	179.9	-61.2	-61.9	0	0	0	110	I36 L72 A75 T82 I89 T95 F98 I139	I36-F91 HydrophobicContact CD1-CD1 4.45Å; I36-F91 HydrophobicContact CD1-CE1 3.9Å; L72-F91 HydrophobicContact CB-CD1 4.35Å; L72-F91 HydrophobicContact CB-CD2 4.47Å; L72-F91 HydrophobicContact CB-CG 4.24Å; L72-F91 HydrophobicContact CD1-CD1 3.6Å; L72-F91 HydrophobicContact CD1-CE1 3.74Å; L72-F91 HydrophobicContact CD1-CG 4.29Å; A75-F91 HydrophobicContact CB-CB 4.15Å; T82-F91 HydrophobicContact CG2-CD1 3.74Å; T82-F91 HydrophobicContact CG2-CE1 4.02Å; I89-F91 HydrophobicContact CD1-CE1 3.57Å; I89-F91 HydrophobicContact CD1-CZ 3.64Å; I89-F91 HydrophobicContact CG1-CD1 4.47Å; I89-F91 HydrophobicContact CG1-CE1 3.84Å; I89-F91 HydrophobicContact CG1-CZ 3.92Å; I89-F91 HydrophobicContact CG2-CE2 4.11Å; I89-F91 HydrophobicContact CG2-CZ 3.98Å; F91-T95 PolarHBondContact N-OG1 3.36Å; F91-T95 WeakPolarHBondContact O-CB 3.46Å; F91-T95 WeakPolarHBondContact O-CG2 3.27Å; F91-T95 PolarHBondContact O-OG1 3.07Å; F91-F98 AromaticContact CD2-CD2 3.82Å; F91-F98 HydrophobicContact CD2-CD2 3.82Å; F91-F98 AromaticContact CD2-CE2 3.89Å; F91-F98 HydrophobicContact CD2-CE2 3.89Å; F91-F98 HydrophobicContact CE2-CD2 4.06Å; F91-F98 HydrophobicContact CE2-CE2 4.45Å; F91-I139 HydrophobicContact CE2-CD1 3.84Å; F91-I139 HydrophobicContact CZ-CD1 3.77Å
92	G	68.5	Low	71.7	Confident	2 Å²	2	67 Å²	67	2%	0.021	37%	0.366	C	S	.	.	S	Bend	trans	92.2	162.7	177.2	0	0	0	0	0	114.9	S80 P81 V90 T95	S80-G92 WeakPolarHBondContact OG-CA 3.25Å; P81-G92 WeakPolarHBondContact O-CA 3.38Å; P81-G92 PolarHBondContact O-N 2.9Å; P81-G92 VanDerWaalsContact O-N 3.13Å; V90-G92 WeakPolarHBondContact CG1-O 3.44Å; G92-T95 PolarHBondContact O-OG1 3.2Å
93	A	55.7	Low	72.9	Confident	64 Å²	64	68.1 Å²	68.1	53%	0.529	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	133.2	180	0	0	0	0	0	110.3	S80 T95	S80-A93 PolarHBondContact OG-N 2.79Å; A93-T95 PolarHBondContact O-N 2.71Å
94	N	62.5	Low	74.3	Confident	173 Å²	173	70.1 Å²	70.1	93%	0.925	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	19.4	-179.7	-49.3	-22.9	0	0	0	116.2
95	T	70.5	Confident	75.2	Confident	43 Å²	43	68 Å²	68	26%	0.264	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-93.1	157.7	172.3	65.8	0	0	0	0	112.9	F91 G92 A93	F91-T95 PolarHBondContact N-OG1 3.36Å; F91-T95 WeakPolarHBondContact O-CB 3.46Å; F91-T95 WeakPolarHBondContact O-CG2 3.27Å; F91-T95 PolarHBondContact O-OG1 3.07Å; G92-T95 PolarHBondContact O-OG1 3.2Å; A93-T95 PolarHBondContact O-N 2.71Å
96	R	81.1	Confident	75.6	Confident	217 Å²	217	71.8 Å²	71.8	82%	0.819	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-69.3	138.5	178.3	-71.7	-172.7	176.8	-159.1	-0.4	110.6	F98	R96-F98 WeakPolarHBondContact O-CD2 3.46Å; R96-F98 WeakPolarHBondContact O-CE2 3.45Å
97	P	82.8	Confident	75.4	Confident	68 Å²	68	71.8 Å²	71.8	44%	0.442	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-67.1	136.1	173.4	26.6	-33	0	0	0	111.6	Q88 V90	Q88-P97 HydrophobicContact CB-CB 4.19Å; Q88-P97 VanDerWaalsContact OE1-CB 3.22Å; V90-P97 HydrophobicContact CG2-CB 3.83Å
98	F	83.1	Confident	74.7	Confident	12 Å²	12	74.9 Å²	74.9	5%	0.053	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.5	172	-65.5	-89.2	0	0	0	109.4	Q88 I89 F91 R96 I139 T142	Q88-F98 CarbonylContact C-O 3.42Å; Q88-F98 WeakPolarHBondContact CA-O 3.45Å; I89-F98 HydrophobicContact CG2-CB 3.88Å; I89-F98 PolarHBondContact N-O 2.97Å; I89-F98 PolarHBondContact O-N 3.04Å; F91-F98 AromaticContact CD2-CD2 3.82Å; F91-F98 HydrophobicContact CD2-CD2 3.82Å; F91-F98 AromaticContact CD2-CE2 3.89Å; F91-F98 HydrophobicContact CD2-CE2 3.89Å; F91-F98 HydrophobicContact CE2-CD2 4.06Å; F91-F98 HydrophobicContact CE2-CE2 4.45Å; R96-F98 WeakPolarHBondContact O-CD2 3.46Å; R96-F98 WeakPolarHBondContact O-CE2 3.45Å; F98-I139 HydrophobicContact CB-CG2 3.88Å; F98-I139 HydrophobicContact CD1-CG2 3.98Å; F98-I139 HydrophobicContact CG-CG2 4.22Å; F98-T142 HydrophobicContact CD1-CG2 4.13Å; F98-T142 HydrophobicContact CE1-CG2 4.28Å
99	K	85.2	Confident	73.6	Confident	129 Å²	129	73.8 Å²	73.8	56%	0.561	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	139.2	172.2	-177.7	166.9	173.5	176.2	0	110	G87 M140	G87-K99 WeakPolarHBondContact O-CA 3.49Å; K99-M140 HydrophobicContact CB-CE 3.99Å; K99-M140 HydrophobicContact CB-SD 4.49Å; K99-M140 HydrophobicContact CD-CE 3.62Å; K99-M140 HydrophobicContact CD-SD 4.16Å; K99-M140 HydrophobicContact CG-CE 3.75Å; K99-M140 HydrophobicContact CG-SD 3.9Å; K99-M140 WeakPolarHBondContact O-CB 3.44Å; K99-M140 WeakPolarHBondContact O-CG 3.42Å; K99-M140 PolarHBondContact O-N 2.88Å
100	F	85.6	Confident	72.5	Confident	29 Å²	29	76.4 Å²	76.4	13%	0.127	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	156.4	179.1	72.2	-89.3	0	0	0	112.4	L84 G87 I89 V102 A137 T138 I139	L84-F100 HydrophobicContact CD1-CE1 4.01Å; L84-F100 HydrophobicContact CD1-CZ 3.99Å; L84-F100 HydrophobicContact CD2-CE1 4.49Å; L84-F100 HydrophobicContact CD2-CZ 4.21Å; L84-F100 HydrophobicContact CG-CE1 4.09Å; L84-F100 HydrophobicContact CG-CZ 4.22Å; G87-F100 PolarHBondContact O-N 3.01Å; I89-F100 HydrophobicContact CB-CD1 4.14Å; I89-F100 HydrophobicContact CB-CE1 4.38Å; I89-F100 HydrophobicContact CG2-CD1 4.22Å; F100-V102 HydrophobicContact CD2-CG2 3.94Å; F100-V102 HydrophobicContact CE2-CG2 3.63Å; F100-A137 HydrophobicContact CD2-CB 3.99Å; F100-T138 CarbonylContact C-O 3.59Å; F100-T138 VanDerWaalsContact CA-O 3.23Å; F100-T138 WeakPolarHBondContact CA-O 3.39Å; F100-T138 WeakPolarHBondContact CB-O 3.47Å; F100-I139 HydrophobicContact CB-CG1 4.21Å
101	T	85.1	Confident	71.1	Confident	70 Å²	70	80.2 Å²	80.2	43%	0.429	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	155.8	170.3	59.3	0	0	0	0	110.2	A137 T138 M140	T101-A137 CarbonylContact O-C 3.56Å; T101-A137 WeakPolarHBondContact O-CA 3.29Å; T101-A137 WeakPolarHBondContact O-CB 3.38Å; T101-T138 PolarHBondContact N-O 3.37Å; T101-T138 PolarHBondContact O-N 3.24Å; T101-M140 HydrophobicContact CG2-CG 4.39Å; T101-M140 HydrophobicContact CG2-SD 4.06Å
102	V	84.4	Confident	70.2	Confident	80 Å²	80	88.1 Å²	88.1	49%	0.485	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.4	173.3	-175.8	0	0	0	0	109.1	F60 F100 R136 A137	F60-V102 HydrophobicContact CE1-CG1 4.04Å; F100-V102 HydrophobicContact CD2-CG2 3.94Å; F100-V102 HydrophobicContact CE2-CG2 3.63Å; V102-R136 CarbonylContact C-O 3.49Å; V102-A137 HydrophobicContact CG2-CB 4.13Å
103	S	82.9	Confident	69.9	Low	34 Å²	34	89.5 Å²	89.5	24%	0.238	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.7	-178.4	50.8	0	0	0	0	110.1	Y135 R136	S103-Y135 CarbonylContact O-C 3.45Å; S103-Y135 WeakPolarHBondContact O-CA 3.34Å; S103-R136 PolarHBondContact N-O 2.98Å; S103-R136 PolarHBondContact O-N 3.25Å; S103-R136 PolarHBondContact OG-NE 3.1Å; S103-R136 PolarHBondContact OG-O 2.89Å
104	D	83.9	Confident	70.6	Confident	74 Å²	74	91.2 Å²	91.2	40%	0.396	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.8	170	-157.8	-54.8	0	0	0	110.1	Q106	D104-Q106 VanDerWaalsContact OD1-CB 3.32Å; D104-Q106 WeakPolarHBondContact OD1-CB 3.39Å; D104-Q106 VanDerWaalsContact OD1-CG 3.27Å; D104-Q106 WeakPolarHBondContact OD1-CG 3.38Å; D104-Q106 PolarHBondContact OD1-N 3.16Å
105	M	74	Confident	71	Confident	17 Å²	17	85.7 Å²	85.7	8%	0.084	47%	0.473	C	S	.	.	S	Bend	trans	-95.1	-7.6	179.3	-65.5	-172.3	60.9	0	0	113.7	L61 Q107 D108 L115 R134 R136	L61-M105 HydrophobicContact CB-CE 4.33Å; L61-M105 HydrophobicContact CB-SD 3.69Å; L61-M105 HydrophobicContact CD2-CE 4Å; L61-M105 HydrophobicContact CD2-SD 4.3Å; M105-Q107 PolarHBondContact O-N 3.18Å; M105-D108 PolarHBondContact O-N 3.4Å; M105-L115 HydrophobicContact CE-CD1 4.03Å; M105-R134 WeakPolarHBondContact CB-O 3.45Å; M105-R134 PolarHBondContact N-O 3.12Å; M105-R136 HydrophobicContact CG-CB 3.69Å; M105-R136 HydrophobicContact SD-CB 3.86Å
106	Q	67.5	Low	71.1	Confident	144 Å²	144	88.5 Å²	88.5	67%	0.673	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.5	-176	-78.3	-175.8	-28.7	0	0	114.4	D104	D104-Q106 VanDerWaalsContact OD1-CB 3.32Å; D104-Q106 WeakPolarHBondContact OD1-CB 3.39Å; D104-Q106 VanDerWaalsContact OD1-CG 3.27Å; D104-Q106 WeakPolarHBondContact OD1-CG 3.38Å; D104-Q106 PolarHBondContact OD1-N 3.16Å
107	Q	57.2	Low	70.6	Confident	199 Å²	199	79 Å²	79	93%	0.93	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-18	176	-69.8	-176.4	-2.6	0	0	114	M105	M105-Q107 PolarHBondContact O-N 3.18Å
108	D	55.2	Low	70	Confident	96 Å²	96	78.2 Å²	78.2	51%	0.513	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	0.7	-168	-138.2	-10.6	0	0	0	112.8	M105 G110 R136	M105-D108 PolarHBondContact O-N 3.4Å; D108-G110 PolarHBondContact O-N 2.97Å; D108-R136 IonicContact OD2-CZ 2.76Å; D108-R136 IonicContact OD2-NH1 2.87Å; D108-R136 PolarHBondContact OD2-NH1 3.32Å; D108-R136 IonicContact OD2-NH2 2.98Å; D108-R136 PolarHBondContact OD2-NH2 3.07Å
109	T	51.9	Low	69.3	Low	59 Å²	59	78.7 Å²	78.7	36%	0.362	45%	0.452	S	S	.	.			trans	-80.2	45.2	-179.2	41.3	0	0	0	0	114.4	A111	T109-A111 PolarHBondContact O-N 3.04Å
110	G	52.5	Low	68.4	Low	58 Å²	58	75.4 Å²	75.4	60%	0.598	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	128.8	171	0	0	0	0	0	112.3	D108 K112	D108-G110 PolarHBondContact O-N 2.97Å; G110-K112 PolarHBondContact O-N 3.37Å
111	A	48.3	Very low	67.2	Low	117 Å²	117	77.3 Å²	77.3	97%	0.967	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	-11	172.6	0	0	0	0	0	119.4	T109	T109-A111 PolarHBondContact O-N 3.04Å
112	K	56	Low	65.8	Low	165 Å²	165	78.1 Å²	78.1	72%	0.717	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-9.5	-172.6	-68.9	-175.6	178.9	174.5	0	114.8	G110	G110-K112 PolarHBondContact O-N 3.37Å
113	G	63.1	Low	64.6	Low	32 Å²	32	79.1 Å²	79.1	33%	0.33	46%	0.463	S	S	.	.			trans	72.5	174.6	-178.4	0	0	0	0	0	113.9
114	P	68.9	Low	63.9	Low	100 Å²	100	80.8 Å²	80.8	65%	0.649	47%	0.469	S	S	*	.			trans	-69.6	141.4	178.2	29.7	-34.9	0	0	0	111.4	L132	P114-L132 HydrophobicContact CB-CD2 4.33Å
115	L	71.7	Confident	62.9	Low	56 Å²	56	78.8 Å²	78.8	29%	0.293	47%	0.466	S	S	.	.			trans	-88.3	140.5	176.6	-67.7	170.9	0	0	0	110.8	F23 L61 M105 L132 M133	F23-L115 HydrophobicContact CE1-CD1 4.25Å; F23-L115 HydrophobicContact CZ-CD1 4.08Å; F23-L115 HydrophobicContact CZ-CD2 4.44Å; L61-L115 HydrophobicContact CD1-CD1 4.47Å; M105-L115 HydrophobicContact CE-CD1 4.03Å; L115-L132 WeakPolarHBondContact O-CA 3.23Å; L115-M133 HydrophobicContact CB-CB 4.18Å; L115-M133 HydrophobicContact CB-SD 3.77Å; L115-M133 HydrophobicContact CD1-CE 4.38Å; L115-M133 HydrophobicContact CD1-SD 4.5Å; L115-M133 PolarHBondContact O-N 3.17Å
116	E	72.4	Confident	62.4	Low	103 Å²	103	85.9 Å²	85.9	48%	0.481	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.2	-178	-175.9	173	-124	0	0	110	K129 L132	E116-K129 WeakPolarHBondContact OE1-CD 3.22Å; E116-K129 WeakPolarHBondContact OE1-CE 3.48Å; E116-K129 IonicContact OE1-NZ 2.8Å; E116-K129 PolarHBondContact OE1-NZ 2.75Å; E116-L132 HydrophobicContact CB-CD2 4.26Å
117	A	71.9	Confident	62.6	Low	16 Å²	16	86.6 Å²	86.6	13%	0.132	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	142.9	179.3	0	0	0	0	0	111.4	P59 L130 G131 M133	P59-A117 HydrophobicContact CB-CB 3.54Å; P59-A117 HydrophobicContact CG-CB 3.92Å; A117-L130 HydrophobicContact CB-CB 4.09Å; A117-L130 HydrophobicContact CB-CD1 4.31Å; A117-L130 WeakPolarHBondContact O-CB 3.49Å; A117-L130 PolarHBondContact O-N 3.15Å; A117-G131 PolarHBondContact N-O 3.05Å; A117-G131 PolarHBondContact O-N 3.41Å; A117-M133 HydrophobicContact CB-CG 4.36Å
118	A	69.2	Low	63.1	Low	53 Å²	53	79.1 Å²	79.1	44%	0.438	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.8	173.5	0	0	0	0	0	110.4	W127 C128	A118-W127 HydrophobicContact CB-CE3 4.2Å; A118-C128 CarbonylContact C-O 3.58Å; A118-C128 VanDerWaalsContact CA-O 3.22Å; A118-C128 WeakPolarHBondContact CA-O 3.42Å
119	E	69.3	Low	63.9	Low	21 Å²	21	81.5 Å²	81.5	10%	0.098	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	144.3	173.9	-179.8	171.2	-135.2	0	0	108.3	R50 W127 C128 L130	R50-E119 IonicContact CZ-OE2 3.29Å; R50-E119 IonicContact NH1-OE2 3.7Å; R50-E119 PolarHBondContact NH1-OE2 2.95Å; E119-W127 WeakPolarHBondContact O-CA 3.43Å; E119-C128 HydrophobicContact CB-CB 4.39Å; E119-C128 PolarHBondContact N-O 2.92Å; E119-C128 PolarHBondContact O-N 3.19Å; E119-L130 HydrophobicContact CB-CD1 4.07Å; E119-L130 HydrophobicContact CB-CD2 3.96Å; E119-L130 HydrophobicContact CB-CG 3.98Å
120	Q	65.7	Low	64.8	Low	61 Å²	61	80.3 Å²	80.3	29%	0.285	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.6	169.4	-168.8	178.6	11.3	0	0	108.2	F8 G125 R126 W127	F8-Q120 HydrophobicContact CE1-CB 4.26Å; Q120-G125 PolarHBondContact NE2-O 3.41Å; Q120-R126 WeakPolarHBondContact CA-O 3.5Å; Q120-W127 HydrophobicContact CB-CD2 4.09Å; Q120-W127 HydrophobicContact CB-CE3 4.1Å; Q120-W127 HydrophobicContact CB-CH2 4.2Å; Q120-W127 HydrophobicContact CB-CZ2 4.17Å; Q120-W127 HydrophobicContact CB-CZ3 4.16Å; Q120-W127 VanDerWaalsContact CD-CE2 3.49Å; Q120-W127 VanDerWaalsContact CD-CZ2 3.46Å; Q120-W127 HydrophobicContact CG-CD2 4.07Å; Q120-W127 HydrophobicContact CG-CG 4.4Å; Q120-W127 HydrophobicContact CG-CZ2 4.08Å; Q120-W127 VanDerWaalsContact OE1-CZ2 3.23Å
121	F	60.5	Low	65.7	Low	69 Å²	69	78.3 Å²	78.3	30%	0.303	44%	0.435	S	S	.	.			trans	-72.9	128.5	176.3	-76.1	-71.5	0	0	0	110.6	D124 G125 R126 C128	F121-D124 VanDerWaalsContact CB-OD1 3.27Å; F121-D124 WeakPolarHBondContact CB-OD1 3.48Å; F121-G125 WeakPolarHBondContact O-CA 3.43Å; F121-G125 PolarHBondContact O-N 3.43Å; F121-R126 HydrophobicContact CD2-CB 4.31Å; F121-R126 PolarHBondContact N-O 3.11Å; F121-C128 HydrophobicContact CD2-CB 4.26Å; F121-C128 HydrophobicContact CE2-CB 3.65Å; F121-C128 HydrophobicContact CZ-CB 4.34Å
122	V	55.6	Low	66.9	Low	86 Å²	86	77 Å²	77	52%	0.521	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-42.2	177.7	166.1	0	0	0	0	112.5	N6 D124	N6-V122 HydrophobicContact CB-CG2 3.7Å; N6-V122 VanDerWaalsContact CG-CG1 3.48Å; N6-V122 VanDerWaalsContact ND2-CG1 3.32Å; N6-V122 WeakPolarHBondContact ND2-CG1 3.49Å; N6-V122 VanDerWaalsContact ND2-CG2 3.32Å; N6-V122 WeakPolarHBondContact ND2-CG2 3.45Å; N6-V122 WeakPolarHBondContact OD1-CG1 3.26Å; V122-D124 VanDerWaalsContact C-N 3.3Å; V122-D124 PolarHBondContact O-N 3.37Å
123	S	58.4	Low	67.8	Low	101 Å²	101	69.6 Å²	69.6	71%	0.706	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.4	-169.7	44.3	0	0	0	0	114.3
124	D	68.5	Low	68.4	Low	69 Å²	69	74.4 Å²	74.4	37%	0.369	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.9	2.8	-167.3	54.4	45.7	0	0	0	113.7	F121 V122 R126	F121-D124 VanDerWaalsContact CB-OD1 3.27Å; F121-D124 WeakPolarHBondContact CB-OD1 3.48Å; V122-D124 VanDerWaalsContact C-N 3.3Å; V122-D124 PolarHBondContact O-N 3.37Å; D124-R126 HydrophobicContact CB-CG 4.33Å; D124-R126 PolarHBondContact O-N 2.92Å; D124-R126 VanDerWaalsContact O-N 3.14Å; D124-R126 WeakPolarHBondContact OD1-CB 3.38Å; D124-R126 WeakPolarHBondContact OD1-CG 3.46Å; D124-R126 PolarHBondContact OD1-N 3.12Å; D124-R126 IonicContact OD1-NE 3.76Å; D124-R126 PolarHBondContact OD1-NE 3.24Å; D124-R126 IonicContact OD2-CZ 3.46Å; D124-R126 VanDerWaalsContact OD2-CZ 3.22Å; D124-R126 IonicContact OD2-NE 2.74Å; D124-R126 PolarHBondContact OD2-NE 3.02Å; D124-R126 IonicContact OD2-NH2 3.64Å; D124-R126 PolarHBondContact OD2-NH2 3.02Å
125	G	62	Low	68.8	Low	33 Å²	33	73.4 Å²	73.4	34%	0.34	37%	0.371	S	S	.	.			trans	68.7	1.8	-179.4	0	0	0	0	0	115.4	Q120 F121	Q120-G125 PolarHBondContact NE2-O 3.41Å; F121-G125 WeakPolarHBondContact O-CA 3.43Å; F121-G125 PolarHBondContact O-N 3.43Å
126	R	65	Low	69.3	Low	165 Å²	165	72.6 Å²	72.6	62%	0.623	36%	0.364	S	S	*	.			trans	-68.6	145.2	-175.7	-66.3	-177.3	-67.6	-177.5	-6.9	111.5	Q120 F121 D124	Q120-R126 WeakPolarHBondContact CA-O 3.5Å; F121-R126 HydrophobicContact CD2-CB 4.31Å; F121-R126 PolarHBondContact N-O 3.11Å; D124-R126 HydrophobicContact CB-CG 4.33Å; D124-R126 PolarHBondContact O-N 2.92Å; D124-R126 VanDerWaalsContact O-N 3.14Å; D124-R126 WeakPolarHBondContact OD1-CB 3.38Å; D124-R126 WeakPolarHBondContact OD1-CG 3.46Å; D124-R126 PolarHBondContact OD1-N 3.12Å; D124-R126 IonicContact OD1-NE 3.76Å; D124-R126 PolarHBondContact OD1-NE 3.24Å; D124-R126 IonicContact OD2-CZ 3.46Å; D124-R126 VanDerWaalsContact OD2-CZ 3.22Å; D124-R126 IonicContact OD2-NE 2.74Å; D124-R126 PolarHBondContact OD2-NE 3.02Å; D124-R126 IonicContact OD2-NH2 3.64Å; D124-R126 PolarHBondContact OD2-NH2 3.02Å
127	W	71.9	Confident	69.7	Low	159 Å²	159	67.8 Å²	67.8	60%	0.602	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.6	177.7	-69.7	78.6	0	0	0	111.1	A118 E119 Q120	A118-W127 HydrophobicContact CB-CE3 4.2Å; E119-W127 WeakPolarHBondContact O-CA 3.43Å; Q120-W127 HydrophobicContact CB-CD2 4.09Å; Q120-W127 HydrophobicContact CB-CE3 4.1Å; Q120-W127 HydrophobicContact CB-CH2 4.2Å; Q120-W127 HydrophobicContact CB-CZ2 4.17Å; Q120-W127 HydrophobicContact CB-CZ3 4.16Å; Q120-W127 VanDerWaalsContact CD-CE2 3.49Å; Q120-W127 VanDerWaalsContact CD-CZ2 3.46Å; Q120-W127 HydrophobicContact CG-CD2 4.07Å; Q120-W127 HydrophobicContact CG-CG 4.4Å; Q120-W127 HydrophobicContact CG-CZ2 4.08Å; Q120-W127 VanDerWaalsContact OE1-CZ2 3.23Å
128	C	67	Low	70.2	Confident	43 Å²	43	68.8 Å²	68.8	29%	0.291	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124	176.9	-168.5	0	0	0	0	109.9	A118 E119 F121 L130	A118-C128 CarbonylContact C-O 3.58Å; A118-C128 VanDerWaalsContact CA-O 3.22Å; A118-C128 WeakPolarHBondContact CA-O 3.42Å; E119-C128 HydrophobicContact CB-CB 4.39Å; E119-C128 PolarHBondContact N-O 2.92Å; E119-C128 PolarHBondContact O-N 3.19Å; F121-C128 HydrophobicContact CD2-CB 4.26Å; F121-C128 HydrophobicContact CE2-CB 3.65Å; F121-C128 HydrophobicContact CZ-CB 4.34Å; C128-L130 PolarHBondContact O-N 3.28Å
129	K	71.9	Confident	70.9	Confident	145 Å²	145	66.6 Å²	66.6	63%	0.63	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	113.9	175.1	170	169	160.2	157.6	0	109.5	E116	E116-K129 WeakPolarHBondContact OE1-CD 3.22Å; E116-K129 WeakPolarHBondContact OE1-CE 3.48Å; E116-K129 IonicContact OE1-NZ 2.8Å; E116-K129 PolarHBondContact OE1-NZ 2.75Å
130	L	70.9	Confident	71.7	Confident	35 Å²	35	69.2 Å²	69.2	18%	0.183	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-31.7	175.3	-62.6	178.3	0	0	0	111.7	V25 V57 A117 E119 C128	V25-L130 HydrophobicContact CG2-CD1 4.15Å; V57-L130 HydrophobicContact CB-CD2 4.42Å; V57-L130 HydrophobicContact CG1-CD2 4.18Å; A117-L130 HydrophobicContact CB-CB 4.09Å; A117-L130 HydrophobicContact CB-CD1 4.31Å; A117-L130 WeakPolarHBondContact O-CB 3.49Å; A117-L130 PolarHBondContact O-N 3.15Å; E119-L130 HydrophobicContact CB-CD1 4.07Å; E119-L130 HydrophobicContact CB-CD2 3.96Å; E119-L130 HydrophobicContact CB-CG 3.98Å; C128-L130 PolarHBondContact O-N 3.28Å
131	G	72.1	Confident	72.6	Confident	16 Å²	16	68.4 Å²	68.4	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120	-166.9	172.6	0	0	0	0	0	114.3	A117	A117-G131 PolarHBondContact N-O 3.05Å; A117-G131 PolarHBondContact O-N 3.41Å
132	L	73.6	Confident	73.6	Confident	88 Å²	88	67.3 Å²	67.3	46%	0.461	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	134.2	-178.4	-63.1	180	0	0	0	111.8	P114 L115 E116 R134	P114-L132 HydrophobicContact CB-CD2 4.33Å; L115-L132 WeakPolarHBondContact O-CA 3.23Å; E116-L132 HydrophobicContact CB-CD2 4.26Å; L132-R134 PolarHBondContact O-N 3.49Å
133	M	74.8	Confident	74.8	Confident	11 Å²	11	68.6 Å²	68.6	5%	0.054	35%	0.347	C	S	.	.			trans	-77.6	106	170	-68.2	162.8	70	0	0	109.6	F23 P59 L61 L115 A117	F23-M133 HydrophobicContact CD1-CE 3.23Å; F23-M133 HydrophobicContact CD1-SD 3.34Å; F23-M133 WeakPolarHBondContact CD1-SD 3.35Å; F23-M133 HydrophobicContact CE1-CE 3.41Å; F23-M133 VanDerWaalsContact CE1-CE 3.41Å; F23-M133 HydrophobicContact CE1-SD 3.31Å; F23-M133 WeakPolarHBondContact CE1-SD 3.42Å; F23-M133 HydrophobicContact CG-CE 3.99Å; F23-M133 HydrophobicContact CZ-CE 4.28Å; P59-M133 HydrophobicContact CB-CG 3.77Å; P59-M133 HydrophobicContact CG-CG 3.96Å; L61-M133 VanDerWaalsContact CA-CE 3.5Å; L61-M133 HydrophobicContact CB-CE 3.63Å; L61-M133 HydrophobicContact CD1-CE 3.69Å; L61-M133 HydrophobicContact CG-CE 4.29Å; L61-M133 VanDerWaalsContact N-CE 3.31Å; L115-M133 HydrophobicContact CB-CB 4.18Å; L115-M133 HydrophobicContact CB-SD 3.77Å; L115-M133 HydrophobicContact CD1-CE 4.38Å; L115-M133 HydrophobicContact CD1-SD 4.5Å; L115-M133 PolarHBondContact O-N 3.17Å; A117-M133 HydrophobicContact CB-CG 4.36Å
134	R	74.8	Confident	75.8	Confident	133 Å²	133	68 Å²	68	50%	0.502	34%	0.336	S	S	.	.			trans	-96	-24.3	177.8	-78.7	179.3	-86.7	171.5	-6.6	113.5	M105 L132	M105-R134 WeakPolarHBondContact CB-O 3.45Å; M105-R134 PolarHBondContact N-O 3.12Å; L132-R134 PolarHBondContact O-N 3.49Å
135	Y	78.1	Confident	76	Confident	78 Å²	78	65 Å²	65	31%	0.306	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142.3	-171.5	-55.5	-62.3	0	0	0	111.6	T58 F60 L61 S103	T58-Y135 HydrophobicContact CG2-CD2 3.93Å; T58-Y135 HydrophobicContact CG2-CE2 4.1Å; F60-Y135 CarbonylContact C-O 3.51Å; F60-Y135 VanDerWaalsContact CA-O 3.25Å; F60-Y135 WeakPolarHBondContact CA-O 3.27Å; F60-Y135 HydrophobicContact CD1-CG 4.38Å; F60-Y135 HydrophobicContact CE1-CD2 4.08Å; F60-Y135 AromaticContact CE1-CG 3.96Å; F60-Y135 HydrophobicContact CE1-CG 3.96Å; F60-Y135 HydrophobicContact CE2-CD2 4.32Å; F60-Y135 AromaticContact CZ-CD2 3.9Å; F60-Y135 HydrophobicContact CZ-CD2 3.9Å; F60-Y135 HydrophobicContact CZ-CG 4.25Å; L61-Y135 PolarHBondContact N-O 3.22Å; S103-Y135 CarbonylContact O-C 3.45Å; S103-Y135 WeakPolarHBondContact O-CA 3.34Å
136	R	81	Confident	76.7	Confident	40 Å²	40	70.6 Å²	70.6	15%	0.151	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117.1	169.5	170.8	-177.7	64.7	-159.6	-1.9	109.3	L61 V102 S103 M105 D108	L61-R136 HydrophobicContact CB-CB 4.15Å; L61-R136 HydrophobicContact CB-CG 4.31Å; L61-R136 HydrophobicContact CD2-CG 4.19Å; L61-R136 CarbonylContact O-C 3.56Å; L61-R136 WeakPolarHBondContact O-CA 3.46Å; V102-R136 CarbonylContact C-O 3.49Å; S103-R136 PolarHBondContact N-O 2.98Å; S103-R136 PolarHBondContact O-N 3.25Å; S103-R136 PolarHBondContact OG-NE 3.1Å; S103-R136 PolarHBondContact OG-O 2.89Å; M105-R136 HydrophobicContact CG-CB 3.69Å; M105-R136 HydrophobicContact SD-CB 3.86Å; D108-R136 IonicContact OD2-CZ 2.76Å; D108-R136 IonicContact OD2-NH1 2.87Å; D108-R136 PolarHBondContact OD2-NH1 3.32Å; D108-R136 IonicContact OD2-NH2 2.98Å; D108-R136 PolarHBondContact OD2-NH2 3.07Å
137	A	81.6	Confident	77.4	Confident	2 Å²	2	66.4 Å²	66.4	2%	0.017	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	158.7	161.1	0	0	0	0	0	111.2	F26 L61 V62 K63 F100 T101 V102	F26-A137 HydrophobicContact CE2-CB 4.38Å; L61-A137 PolarHBondContact O-N 2.85Å; V62-A137 CarbonylContact C-O 3.36Å; V62-A137 WeakPolarHBondContact CA-O 3.45Å; V62-A137 HydrophobicContact CB-CB 3.83Å; V62-A137 VanDerWaalsContact CB-O 3.3Å; V62-A137 WeakPolarHBondContact CB-O 3.45Å; V62-A137 HydrophobicContact CG2-CB 3.57Å; K63-A137 PolarHBondContact N-O 3.03Å; F100-A137 HydrophobicContact CD2-CB 3.99Å; T101-A137 CarbonylContact O-C 3.56Å; T101-A137 WeakPolarHBondContact O-CA 3.29Å; T101-A137 WeakPolarHBondContact O-CB 3.38Å; V102-A137 HydrophobicContact CG2-CB 4.13Å
138	T	81.9	Confident	77.4	Confident	37 Å²	37	60.1 Å²	60.1	23%	0.227	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	114.5	176.3	-63.2	0	0	0	0	107.9	K63 F100 T101 M140	K63-T138 HydrophobicContact CB-CG2 4.11Å; F100-T138 CarbonylContact C-O 3.59Å; F100-T138 VanDerWaalsContact CA-O 3.23Å; F100-T138 WeakPolarHBondContact CA-O 3.39Å; F100-T138 WeakPolarHBondContact CB-O 3.47Å; T101-T138 PolarHBondContact N-O 3.37Å; T101-T138 PolarHBondContact O-N 3.24Å; T138-M140 PolarHBondContact O-N 3.04Å
139	I	85	Confident	77.7	Confident	7 Å²	7	61.6 Å²	61.6	4%	0.036	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	128.2	171.4	-73.2	159	0	0	0	107.7	V62 K63 V64 T65 I89 F91 F98 F100	V62-I139 HydrophobicContact CG1-CD1 4.27Å; K63-I139 PolarHBondContact O-N 3.03Å; V64-I139 HydrophobicContact CB-CD1 4.28Å; V64-I139 HydrophobicContact CG1-CD1 3.83Å; V64-I139 HydrophobicContact CG2-CD1 4.16Å; T65-I139 HydrophobicContact CG2-CG2 4.09Å; I89-I139 HydrophobicContact CG2-CD1 4.03Å; I89-I139 HydrophobicContact CG2-CG1 3.99Å; F91-I139 HydrophobicContact CE2-CD1 3.84Å; F91-I139 HydrophobicContact CZ-CD1 3.77Å; F98-I139 HydrophobicContact CB-CG2 3.88Å; F98-I139 HydrophobicContact CD1-CG2 3.98Å; F98-I139 HydrophobicContact CG-CG2 4.22Å; F100-I139 HydrophobicContact CB-CG1 4.21Å
140	M	85.9	Confident	78.1	Confident	75 Å²	75	61.8 Å²	61.8	37%	0.369	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-74.1	145.9	-177.5	-56.6	-168.5	-16.4	0	0	110.6	K99 T101 T138 T142	K99-M140 HydrophobicContact CB-CE 3.99Å; K99-M140 HydrophobicContact CB-SD 4.49Å; K99-M140 HydrophobicContact CD-CE 3.62Å; K99-M140 HydrophobicContact CD-SD 4.16Å; K99-M140 HydrophobicContact CG-CE 3.75Å; K99-M140 HydrophobicContact CG-SD 3.9Å; K99-M140 WeakPolarHBondContact O-CB 3.44Å; K99-M140 WeakPolarHBondContact O-CG 3.42Å; K99-M140 PolarHBondContact O-N 2.88Å; T101-M140 HydrophobicContact CG2-CG 4.39Å; T101-M140 HydrophobicContact CG2-SD 4.06Å; T138-M140 PolarHBondContact O-N 3.04Å; M140-T142 PolarHBondContact O-N 2.77Å
141	A	83.5	Confident	78.7	Confident	45 Å²	45	67.4 Å²	67.4	37%	0.372	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-62	126.7	175.6	0	0	0	0	0	111.2	S145 Y146	A141-S145 WeakPolarHBondContact CA-OG 3.49Å; A141-Y146 HydrophobicContact CB-CD2 4.18Å; A141-Y146 HydrophobicContact CB-CE1 4.21Å; A141-Y146 HydrophobicContact CB-CE2 3.44Å; A141-Y146 VanDerWaalsContact CB-CE2 3.44Å; A141-Y146 VanDerWaalsContact CB-CZ 3.47Å
142	T	82.5	Confident	78.8	Confident	46 Å²	46	72.2 Å²	72.2	28%	0.282	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-89.8	158.4	169.4	58.7	0	0	0	0	110.1	S67 F98 M140 D144 S145 Y146	S67-T142 PolarHBondContact OG-OG1 3.31Å; F98-T142 HydrophobicContact CD1-CG2 4.13Å; F98-T142 HydrophobicContact CE1-CG2 4.28Å; M140-T142 PolarHBondContact O-N 2.77Å; T142-D144 VanDerWaalsContact C-N 3.29Å; T142-D144 PolarHBondContact O-N 3.33Å; T142-S145 PolarHBondContact N-OG 3.29Å; T142-S145 WeakPolarHBondContact O-CA 3.43Å; T142-S145 WeakPolarHBondContact O-CB 3.36Å; T142-S145 PolarHBondContact O-N 2.69Å; T142-S145 PolarHBondContact O-OG 3.36Å; T142-S145 PolarHBondContact OG1-N 3.1Å; T142-Y146 VanDerWaalsContact O-CD2 3.28Å; T142-Y146 WeakPolarHBondContact O-CD2 3.49Å; T142-Y146 PolarHBondContact O-N 3.05Å
143	D	81.2	Confident	78.8	Confident	113 Å²	113	70.9 Å²	70.9	60%	0.604	35%	0.346	S	S	*	.	H	α-helix	trans	-51.9	-46.9	176.5	179.7	62.2	0	0	0	112.3	S145 Y146 Q147	D143-S145 PolarHBondContact O-N 3.22Å; D143-S145 VanDerWaalsContact O-N 3.17Å; D143-Y146 WeakPolarHBondContact O-CA 3.04Å; D143-Y146 WeakPolarHBondContact O-CB 3.4Å; D143-Y146 PolarHBondContact O-N 3.41Å; D143-Q147 WeakPolarHBondContact O-CG 3.43Å; D143-Q147 PolarHBondContact O-N 3.37Å
144	D	77.8	Confident	79.3	Confident	88 Å²	88	74.9 Å²	74.9	47%	0.471	37%	0.367	S	S	.	.	H	α-helix	trans	-54.6	-35.7	173.7	177.4	64.4	0	0	0	113.5	T142 Q147 S148	T142-D144 VanDerWaalsContact C-N 3.29Å; T142-D144 PolarHBondContact O-N 3.33Å; D144-Q147 PolarHBondContact O-N 2.92Å; D144-S148 WeakPolarHBondContact O-CB 3.44Å; D144-S148 PolarHBondContact O-N 3.3Å
145	S	73.3	Confident	79.6	Confident	7 Å²	7	72.8 Å²	72.8	5%	0.049	36%	0.363	C	S	.	.	H	α-helix	trans	-69.1	-35.3	176.1	76.9	0	0	0	0	112.7	A141 T142 D143 T149	A141-S145 WeakPolarHBondContact CA-OG 3.49Å; T142-S145 PolarHBondContact N-OG 3.29Å; T142-S145 WeakPolarHBondContact O-CA 3.43Å; T142-S145 WeakPolarHBondContact O-CB 3.36Å; T142-S145 PolarHBondContact O-N 2.69Å; T142-S145 PolarHBondContact O-OG 3.36Å; T142-S145 PolarHBondContact OG1-N 3.1Å; D143-S145 PolarHBondContact O-N 3.22Å; D143-S145 VanDerWaalsContact O-N 3.17Å; S145-T149 WeakPolarHBondContact O-CB 3.46Å; S145-T149 PolarHBondContact O-N 3.45Å; S145-T149 PolarHBondContact O-OG1 3.32Å
146	Y	76.2	Confident	79.6	Confident	149 Å²	149	72 Å²	72	58%	0.584	37%	0.372	S	S	*	.	H	α-helix	trans	-67.6	-45.1	172.5	-69.5	-75.9	0	0	0	110.9	A141 T142 D143 T149 K150	A141-Y146 HydrophobicContact CB-CD2 4.18Å; A141-Y146 HydrophobicContact CB-CE1 4.21Å; A141-Y146 HydrophobicContact CB-CE2 3.44Å; A141-Y146 VanDerWaalsContact CB-CE2 3.44Å; A141-Y146 VanDerWaalsContact CB-CZ 3.47Å; T142-Y146 VanDerWaalsContact O-CD2 3.28Å; T142-Y146 WeakPolarHBondContact O-CD2 3.49Å; T142-Y146 PolarHBondContact O-N 3.05Å; D143-Y146 WeakPolarHBondContact O-CA 3.04Å; D143-Y146 WeakPolarHBondContact O-CB 3.4Å; D143-Y146 PolarHBondContact O-N 3.41Å; Y146-T149 PolarHBondContact O-N 2.98Å; Y146-K150 WeakPolarHBondContact O-CB 3.34Å; Y146-K150 PolarHBondContact O-N 3.3Å
147	Q	81.3	Confident	79.5	Confident	77 Å²	77	75.1 Å²	75.1	36%	0.36	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-44.3	177.3	-61	-64.4	-9.1	0	0	111.9	D143 D144 K150 R151	D143-Q147 WeakPolarHBondContact O-CG 3.43Å; D143-Q147 PolarHBondContact O-N 3.37Å; D144-Q147 PolarHBondContact O-N 2.92Å; Q147-K150 PolarHBondContact O-N 2.97Å; Q147-R151 WeakPolarHBondContact O-CG 3.13Å; Q147-R151 PolarHBondContact O-N 2.63Å
148	S	70.9	Confident	79.6	Confident	27 Å²	27	79.1 Å²	79.1	19%	0.189	41%	0.407	C	S	.	.	H	α-helix	trans	-60.5	-45.4	175.3	-172.6	0	0	0	0	111.7	D144 K150 R151 K152	D144-S148 WeakPolarHBondContact O-CB 3.44Å; D144-S148 PolarHBondContact O-N 3.3Å; S148-K150 PolarHBondContact O-N 2.67Å; S148-R151 PolarHBondContact O-N 2.73Å; S148-K152 WeakPolarHBondContact O-CB 3.2Å; S148-K152 WeakPolarHBondContact O-CG 3.34Å; S148-K152 PolarHBondContact O-N 3.18Å
149	T	72.7	Confident	79.3	Confident	75 Å²	75	80.8 Å²	80.8	46%	0.46	42%	0.415	S	S	.	.	H	α-helix	trans	-61.7	-44.1	175.7	-56.8	0	0	0	0	111.5	S145 Y146 K152 A153	S145-T149 WeakPolarHBondContact O-CB 3.46Å; S145-T149 PolarHBondContact O-N 3.45Å; S145-T149 PolarHBondContact O-OG1 3.32Å; Y146-T149 PolarHBondContact O-N 2.98Å; T149-K152 PolarHBondContact O-N 3.49Å; T149-A153 WeakPolarHBondContact O-CB 3.2Å; T149-A153 PolarHBondContact O-N 3.2Å
150	K	80.7	Confident	78.9	Confident	148 Å²	148	83 Å²	83	64%	0.643	43%	0.433	S	S	*	.	H	α-helix	trans	-61.3	-44.4	177.6	-171.1	176.2	-178	179.5	0	111.9	Y146 Q147 S148 A153 L154	Y146-K150 WeakPolarHBondContact O-CB 3.34Å; Y146-K150 PolarHBondContact O-N 3.3Å; Q147-K150 PolarHBondContact O-N 2.97Å; S148-K150 PolarHBondContact O-N 2.67Å; K150-A153 PolarHBondContact O-N 3.43Å; K150-L154 WeakPolarHBondContact O-CB 3.28Å; K150-L154 PolarHBondContact O-N 3.05Å
151	R	83.9	Confident	78.7	Confident	154 Å²	154	85.4 Å²	85.4	58%	0.581	44%	0.442	S	S	*	.	H	α-helix	trans	-62.7	-46.2	174.5	-67.5	-177.1	-148.1	109.4	-1.3	111.9	Q147 S148 A153 L154 Q155	Q147-R151 WeakPolarHBondContact O-CG 3.13Å; Q147-R151 PolarHBondContact O-N 2.63Å; S148-R151 PolarHBondContact O-N 2.73Å; R151-A153 PolarHBondContact O-N 3.26Å; R151-L154 PolarHBondContact O-N 3.05Å; R151-Q155 WeakPolarHBondContact O-CB 3.46Å; R151-Q155 PolarHBondContact O-N 2.86Å
152	K	74.5	Confident	78.3	Confident	116 Å²	116	89 Å²	89	50%	0.504	45%	0.449	S	S	.	.	H	α-helix	trans	-62.7	-39.6	178.1	-74	178.7	-179	-178.6	0	112.6	D66 S148 T149 A156	D66-K152 IonicContact OD2-NZ 2.95Å; D66-K152 PolarHBondContact OD2-NZ 3.04Å; S148-K152 WeakPolarHBondContact O-CB 3.2Å; S148-K152 WeakPolarHBondContact O-CG 3.34Å; S148-K152 PolarHBondContact O-N 3.18Å; T149-K152 PolarHBondContact O-N 3.49Å; K152-A156 WeakPolarHBondContact O-CB 3.47Å; K152-A156 PolarHBondContact O-N 3.42Å
153	A	74.2	Confident	77.5	Confident	61 Å²	61	89.3 Å²	89.3	50%	0.504	46%	0.457	S	S	.	.	H	α-helix	trans	-65	-45.9	176.1	0	0	0	0	0	111.8	T149 K150 R151 Q155 A156 E157	T149-A153 WeakPolarHBondContact O-CB 3.2Å; T149-A153 PolarHBondContact O-N 3.2Å; K150-A153 PolarHBondContact O-N 3.43Å; R151-A153 PolarHBondContact O-N 3.26Å; A153-Q155 PolarHBondContact O-N 3.13Å; A153-A156 PolarHBondContact O-N 2.9Å; A153-E157 PolarHBondContact O-N 2.89Å
154	L	85.3	Confident	76.4	Confident	94 Å²	94	87.3 Å²	87.3	49%	0.492	45%	0.452	S	S	.	.	H	α-helix	trans	-62.7	-41.2	177	-174	152.6	0	0	0	111.8	K150 R151 E157 Q158	K150-L154 WeakPolarHBondContact O-CB 3.28Å; K150-L154 PolarHBondContact O-N 3.05Å; R151-L154 PolarHBondContact O-N 3.05Å; L154-E157 PolarHBondContact O-N 3.42Å; L154-Q158 HydrophobicContact CD2-CG 4.35Å; L154-Q158 WeakPolarHBondContact O-CG 3.41Å; L154-Q158 PolarHBondContact O-N 3.34Å
155	Q	80.6	Confident	75.5	Confident	89 Å²	89	86.2 Å²	86.2	42%	0.416	46%	0.455	S	S	.	.	H	α-helix	trans	-60.2	-48.7	173.6	-176.7	60.4	48.2	0	0	111.5	R151 A153 E157 Q158 D159	R151-Q155 WeakPolarHBondContact O-CB 3.46Å; R151-Q155 PolarHBondContact O-N 2.86Å; A153-Q155 PolarHBondContact O-N 3.13Å; Q155-E157 VanDerWaalsContact C-N 3.27Å; Q155-E157 PolarHBondContact O-N 3.32Å; Q155-Q158 PolarHBondContact O-N 3.42Å; Q155-Q158 VanDerWaalsContact O-N 3.16Å; Q155-D159 VanDerWaalsContact NE2-CG 3.29Å; Q155-D159 PolarHBondContact NE2-OD1 3.38Å; Q155-D159 VanDerWaalsContact NE2-OD1 3.1Å; Q155-D159 PolarHBondContact NE2-OD2 2.91Å; Q155-D159 PolarHBondContact O-N 3.17Å
156	A	77.3	Confident	74.5	Confident	61 Å²	61	93.6 Å²	93.6	50%	0.504	49%	0.486	S	S	.	.	H	α-helix	trans	-61.7	-33.8	177.9	0	0	0	0	0	112.8	K152 A153 A160	K152-A156 WeakPolarHBondContact O-CB 3.47Å; K152-A156 PolarHBondContact O-N 3.42Å; A153-A156 PolarHBondContact O-N 2.9Å; A156-A160 VanDerWaalsContact O-CB 3.28Å; A156-A160 WeakPolarHBondContact O-CB 3.39Å; A156-A160 PolarHBondContact O-N 3.42Å
157	E	80.3	Confident	73.2	Confident	106 Å²	106	89 Å²	89	50%	0.495	47%	0.473	S	S	.	.	H	α-helix	trans	-68.6	-42.9	173.7	-163.8	-165.8	145.8	0	0	112	A153 L154 Q155 D159 A160 K161	A153-E157 PolarHBondContact O-N 2.89Å; L154-E157 PolarHBondContact O-N 3.42Å; Q155-E157 VanDerWaalsContact C-N 3.27Å; Q155-E157 PolarHBondContact O-N 3.32Å; E157-D159 VanDerWaalsContact C-N 3.33Å; E157-D159 PolarHBondContact O-N 3.06Å; E157-A160 PolarHBondContact O-N 2.73Å; E157-K161 WeakPolarHBondContact O-CG 3.3Å; E157-K161 PolarHBondContact O-N 2.73Å; E157-K161 WeakPolarHBondContact OE1-CE 3.36Å; E157-K161 IonicContact OE1-NZ 3.4Å; E157-K161 PolarHBondContact OE1-NZ 3.01Å
158	Q	82	Confident	71.6	Confident	87 Å²	87	93 Å²	93	41%	0.407	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-42.4	174	-71.3	-169.9	14.1	0	0	111.8	L154 Q155 K161 K162	L154-Q158 HydrophobicContact CD2-CG 4.35Å; L154-Q158 WeakPolarHBondContact O-CG 3.41Å; L154-Q158 PolarHBondContact O-N 3.34Å; Q155-Q158 PolarHBondContact O-N 3.42Å; Q155-Q158 VanDerWaalsContact O-N 3.16Å; Q158-K161 WeakPolarHBondContact O-CB 3.45Å; Q158-K161 PolarHBondContact O-N 2.99Å; Q158-K162 VanDerWaalsContact O-CG 3.3Å; Q158-K162 WeakPolarHBondContact O-CG 3.37Å; Q158-K162 PolarHBondContact O-N 3.27Å
159	D	76.5	Confident	70.4	Confident	72 Å²	72	94.5 Å²	94.5	39%	0.385	50%	0.5	S	S	.	.	H	α-helix	trans	-71.5	-34	-179.8	-63.7	-27.5	0	0	0	111.7	Q155 E157 K162 A163	Q155-D159 VanDerWaalsContact NE2-CG 3.29Å; Q155-D159 PolarHBondContact NE2-OD1 3.38Å; Q155-D159 VanDerWaalsContact NE2-OD1 3.1Å; Q155-D159 PolarHBondContact NE2-OD2 2.91Å; Q155-D159 PolarHBondContact O-N 3.17Å; E157-D159 VanDerWaalsContact C-N 3.33Å; E157-D159 PolarHBondContact O-N 3.06Å; D159-K162 PolarHBondContact O-N 2.96Å; D159-K162 IonicContact OD1-NZ 2.96Å; D159-A163 VanDerWaalsContact O-CB 3.27Å; D159-A163 WeakPolarHBondContact O-CB 3.36Å; D159-A163 PolarHBondContact O-N 3.48Å
160	A	77	Confident	69	Low	52 Å²	52	93.2 Å²	93.2	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-38	169.9	0	0	0	0	0	112.8	A156 E157 S164	A156-A160 VanDerWaalsContact O-CB 3.28Å; A156-A160 WeakPolarHBondContact O-CB 3.39Å; A156-A160 PolarHBondContact O-N 3.42Å; E157-A160 PolarHBondContact O-N 2.73Å; A160-S164 VanDerWaalsContact O-CB 3.31Å; A160-S164 WeakPolarHBondContact O-CB 3.46Å; A160-S164 PolarHBondContact O-N 3.15Å; A160-S164 PolarHBondContact O-OG 3.08Å
161	K	80.7	Confident	67.7	Low	127 Å²	127	90 Å²	90	55%	0.552	49%	0.486	S	S	*	.	H	α-helix	trans	-64.5	-49.1	173.4	-75.2	170.7	179.9	171.6	0	111.2	E157 Q158 A163 S164 A165	E157-K161 WeakPolarHBondContact O-CG 3.3Å; E157-K161 PolarHBondContact O-N 2.73Å; E157-K161 WeakPolarHBondContact OE1-CE 3.36Å; E157-K161 IonicContact OE1-NZ 3.4Å; E157-K161 PolarHBondContact OE1-NZ 3.01Å; Q158-K161 WeakPolarHBondContact O-CB 3.45Å; Q158-K161 PolarHBondContact O-N 2.99Å; K161-A163 PolarHBondContact O-N 2.96Å; K161-S164 PolarHBondContact O-N 2.8Å; K161-A165 PolarHBondContact O-N 3Å
162	K	76.5	Confident	66.4	Low	119 Å²	119	90.4 Å²	90.4	52%	0.517	49%	0.493	S	S	.	.	H	α-helix	trans	-59.4	-44	176.3	-69.4	166.8	-169.6	165.2	0	112	Q158 D159 K166	Q158-K162 VanDerWaalsContact O-CG 3.3Å; Q158-K162 WeakPolarHBondContact O-CG 3.37Å; Q158-K162 PolarHBondContact O-N 3.27Å; D159-K162 PolarHBondContact O-N 2.96Å; D159-K162 IonicContact OD1-NZ 2.96Å; K162-K166 PolarHBondContact O-N 2.84Å
163	A	65.1	Low	65.4	Low	54 Å²	54	86.6 Å²	86.6	45%	0.446	48%	0.477	S	S	.	.	H	α-helix	trans	-63.4	-43.1	175.8	0	0	0	0	0	112.2	D159 K161 A165 K166 V167	D159-A163 VanDerWaalsContact O-CB 3.27Å; D159-A163 WeakPolarHBondContact O-CB 3.36Å; D159-A163 PolarHBondContact O-N 3.48Å; K161-A163 PolarHBondContact O-N 2.96Å; A163-A165 PolarHBondContact O-N 3.38Å; A163-K166 PolarHBondContact O-N 3.03Å; A163-V167 WeakPolarHBondContact O-CG2 3.4Å; A163-V167 PolarHBondContact O-N 3.04Å
164	S	58.2	Low	63.9	Low	71 Å²	71	92.5 Å²	92.5	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-66	-34.8	-179.3	-61.1	0	0	0	0	113.1	A160 K161 K168	A160-S164 VanDerWaalsContact O-CB 3.31Å; A160-S164 WeakPolarHBondContact O-CB 3.46Å; A160-S164 PolarHBondContact O-N 3.15Å; A160-S164 PolarHBondContact O-OG 3.08Å; K161-S164 PolarHBondContact O-N 2.8Å; S164-K168 WeakPolarHBondContact O-CG 3.31Å; S164-K168 PolarHBondContact O-N 3.29Å
165	A	58	Low	62.7	Low	64 Å²	64	92.4 Å²	92.4	53%	0.529	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-47.2	172.4	0	0	0	0	0	111.5	K161 A163 V167 K168 S169	K161-A165 PolarHBondContact O-N 3Å; A163-A165 PolarHBondContact O-N 3.38Å; A165-V167 PolarHBondContact O-N 3.25Å; A165-K168 PolarHBondContact O-N 3.02Å; A165-K168 VanDerWaalsContact O-N 3.11Å; A165-S169 PolarHBondContact O-N 2.95Å
166	K	53.7	Low	61.9	Low	163 Å²	163	96.2 Å²	96.2	71%	0.709	50%	0.502	S	S	*	.	H	α-helix	trans	-66.8	-30.2	179.8	-120.2	164	-177.7	165	0	114.2	K162 A163 S169 S170	K162-K166 PolarHBondContact O-N 2.84Å; A163-K166 PolarHBondContact O-N 3.03Å; K166-S169 PolarHBondContact O-OG 3.4Å; K166-S170 PolarHBondContact O-N 3.25Å; K166-S170 PolarHBondContact O-OG 3.31Å
167	V	48.8	Very low	60.9	Low	51 Å²	51	97.5 Å²	97.5	31%	0.309	50%	0.503	S	S	.	.	H	α-helix	trans	-69.7	-32.8	171.6	176.8	0	0	0	0	112	A163 A165 S170 V171	A163-V167 WeakPolarHBondContact O-CG2 3.4Å; A163-V167 PolarHBondContact O-N 3.04Å; A165-V167 PolarHBondContact O-N 3.25Å; V167-S170 WeakPolarHBondContact CA-OG 3.06Å; V167-S170 PolarHBondContact O-OG 2.99Å; V167-V171 HydrophobicContact CG1-CG2 4.27Å; V167-V171 VanDerWaalsContact O-CG2 3.3Å; V167-V171 WeakPolarHBondContact O-CG2 3.34Å; V167-V171 PolarHBondContact O-N 3.1Å
168	K	47.4	Very low	60	Low	161 Å²	161	96 Å²	96	70%	0.7	50%	0.499	S	S	*	.	H	α-helix	trans	-70.5	-35.9	179.9	-75.3	-179.5	178.3	-176.3	0	113.8	S164 A165	S164-K168 WeakPolarHBondContact O-CG 3.31Å; S164-K168 PolarHBondContact O-N 3.29Å; A165-K168 PolarHBondContact O-N 3.02Å; A165-K168 VanDerWaalsContact O-N 3.11Å
169	S	45.1	Very low	59	Low	60 Å²	60	97 Å²	97	42%	0.42	51%	0.506	S	S	.	.	H	α-helix	trans	-71.9	-50.9	174.1	60.4	0	0	0	0	111.3	A165 K166 V171 K172 I173	A165-S169 PolarHBondContact O-N 2.95Å; K166-S169 PolarHBondContact O-OG 3.4Å; S169-V171 VanDerWaalsContact C-N 3.27Å; S169-V171 PolarHBondContact O-N 3.28Å; S169-V171 VanDerWaalsContact O-N 3.16Å; S169-K172 WeakPolarHBondContact O-CB 3.26Å; S169-K172 PolarHBondContact O-N 3.35Å; S169-I173 PolarHBondContact O-N 2.97Å
170	S	43	Very low	58	Low	48 Å²	48	96.5 Å²	96.5	34%	0.336	51%	0.513	S	S	.	.	H	α-helix	trans	-57.4	-32.7	-178.6	48.4	0	0	0	0	114.7	K166 V167 W174	K166-S170 PolarHBondContact O-N 3.25Å; K166-S170 PolarHBondContact O-OG 3.31Å; V167-S170 WeakPolarHBondContact CA-OG 3.06Å; V167-S170 PolarHBondContact O-OG 2.99Å; S170-W174 PolarHBondContact O-N 3.26Å
171	V	52.7	Low	56.5	Low	79 Å²	79	96.5 Å²	96.5	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-69.3	-34.9	174.7	170.5	0	0	0	0	112.5	V167 S169 N175	V167-V171 HydrophobicContact CG1-CG2 4.27Å; V167-V171 VanDerWaalsContact O-CG2 3.3Å; V167-V171 WeakPolarHBondContact O-CG2 3.34Å; V167-V171 PolarHBondContact O-N 3.1Å; S169-V171 VanDerWaalsContact C-N 3.27Å; S169-V171 PolarHBondContact O-N 3.28Å; S169-V171 VanDerWaalsContact O-N 3.16Å; V171-N175 PolarHBondContact O-N 2.93Å
172	K	57.6	Low	55.5	Low	164 Å²	164	93.6 Å²	93.6	71%	0.713	51%	0.508	S	S	*	.	H	α-helix	trans	-65.4	-45.5	174.6	-70.1	-177.1	174.9	-173.6	0	111.1	S169 W174 N175 K176	S169-K172 WeakPolarHBondContact O-CB 3.26Å; S169-K172 PolarHBondContact O-N 3.35Å; K172-W174 PolarHBondContact O-N 2.92Å; K172-N175 PolarHBondContact O-N 3.28Å; K172-K176 PolarHBondContact O-N 3.34Å; K172-K176 VanDerWaalsContact O-N 3.08Å
173	I	54.4	Low	54.5	Low	36 Å²	36	90.8 Å²	90.8	19%	0.185	51%	0.508	C	S	.	.	H	α-helix	trans	-60.5	-46.7	179.1	-60.9	169.3	0	0	0	110.4	S169 N175 K176 V177 E604	S169-I173 PolarHBondContact O-N 2.97Å; I173-N175 VanDerWaalsContact C-N 3.31Å; I173-N175 PolarHBondContact O-N 2.87Å; I173-K176 PolarHBondContact O-N 2.97Å; I173-V177 HydrophobicContact CG2-CG2 4.34Å; I173-V177 WeakPolarHBondContact O-CG2 3.4Å; I173-V177 PolarHBondContact O-N 2.97Å; I173-E604 WeakPolarHBondContact CD1-OE2 3.44Å
174	W	40.9	Very low	53.5	Low	184 Å²	184	95.6 Å²	95.6	70%	0.697	52%	0.522	S	S	*	.	H	α-helix	trans	-63.6	-34.6	-178.5	-140.1	90	0	0	0	113.3	S170 K172 N178	S170-W174 PolarHBondContact O-N 3.26Å; K172-W174 PolarHBondContact O-N 2.92Å; W174-N178 WeakPolarHBondContact O-CB 3.44Å; W174-N178 PolarHBondContact O-N 3.07Å; W174-N178 VanDerWaalsContact O-N 3.14Å
175	N	61.4	Low	53	Low	92 Å²	92	98 Å²	98	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-49.1	172.3	-69.6	-14.2	0	0	0	111.3	V171 K172 I173 V177 N178 D179	V171-N175 PolarHBondContact O-N 2.93Å; K172-N175 PolarHBondContact O-N 3.28Å; I173-N175 VanDerWaalsContact C-N 3.31Å; I173-N175 PolarHBondContact O-N 2.87Å; N175-V177 VanDerWaalsContact C-N 3.3Å; N175-V177 PolarHBondContact O-N 3.22Å; N175-N178 PolarHBondContact O-N 3.16Å; N175-D179 PolarHBondContact O-N 2.86Å
176	K	62.3	Low	52.5	Low	169 Å²	169	105.2 Å²	105.2	74%	0.735	55%	0.548	S	S	*	.	H	α-helix	trans	-59.9	-38.6	-178.5	-155	176.4	-178	-171.3	0	111.8	K172 I173 A180	K172-K176 PolarHBondContact O-N 3.34Å; K172-K176 VanDerWaalsContact O-N 3.08Å; I173-K176 PolarHBondContact O-N 2.97Å; K176-A180 WeakPolarHBondContact O-CB 3.36Å; K176-A180 PolarHBondContact O-N 2.66Å; K176-A180 VanDerWaalsContact O-N 3.07Å
177	V	58	Low	51.8	Low	88 Å²	88	102.6 Å²	102.6	53%	0.533	55%	0.549	S	S	.	.	H	α-helix	trans	-67.7	-41.1	173.5	173.1	0	0	0	0	112.3	I173 N175 A180 A181	I173-V177 HydrophobicContact CG2-CG2 4.34Å; I173-V177 WeakPolarHBondContact O-CG2 3.4Å; I173-V177 PolarHBondContact O-N 2.97Å; N175-V177 VanDerWaalsContact C-N 3.3Å; N175-V177 PolarHBondContact O-N 3.22Å; V177-A180 PolarHBondContact O-N 2.74Å; V177-A181 WeakPolarHBondContact O-CB 3.48Å; V177-A181 PolarHBondContact O-N 3.11Å
178	N	61	Low	51.4	Low	76 Å²	76	109 Å²	109	41%	0.406	58%	0.575	S	S	.	*	H	α-helix	trans	-68.6	-35.4	178.8	-174	85	0	0	0	112.5	W174 N175 S182	W174-N178 WeakPolarHBondContact O-CB 3.44Å; W174-N178 PolarHBondContact O-N 3.07Å; W174-N178 VanDerWaalsContact O-N 3.14Å; N175-N178 PolarHBondContact O-N 3.16Å; N178-S182 WeakPolarHBondContact O-CB 3.46Å; N178-S182 PolarHBondContact O-N 3.24Å; N178-S182 PolarHBondContact O-OG 3.48Å
179	D	60.6	Low	50.9	Low	106 Å²	106	112.3 Å²	112.3	57%	0.567	58%	0.583	S	S	*	*	H	α-helix	trans	-68	-43.2	174.1	-67.8	-25.5	0	0	0	111.2	N175 S182 A183	N175-D179 PolarHBondContact O-N 2.86Å; D179-S182 PolarHBondContact O-N 2.83Å; D179-A183 PolarHBondContact O-N 2.98Å
180	A	55.8	Low	50.7	Low	62 Å²	62	117.8 Å²	117.8	51%	0.512	61%	0.605	S	S	.	*	H	α-helix	trans	-61.9	-43.6	174.6	0	0	0	0	0	112.8	K176 V177 S182 A183 M184	K176-A180 WeakPolarHBondContact O-CB 3.36Å; K176-A180 PolarHBondContact O-N 2.66Å; K176-A180 VanDerWaalsContact O-N 3.07Å; V177-A180 PolarHBondContact O-N 2.74Å; A180-S182 VanDerWaalsContact C-N 3.32Å; A180-S182 PolarHBondContact O-N 3.2Å; A180-A183 PolarHBondContact O-N 3.37Å; A180-M184 PolarHBondContact O-N 3.19Å
181	A	45.9	Very low	50.6	Low	52 Å²	52	121 Å²	121	43%	0.43	62%	0.624	S	S	.	*	H	α-helix	trans	-63.6	-38.1	174.8	0	0	0	0	0	112.2	V177 M184 T185	V177-A181 WeakPolarHBondContact O-CB 3.48Å; V177-A181 PolarHBondContact O-N 3.11Å; A181-M184 PolarHBondContact O-N 2.96Å; A181-T185 PolarHBondContact O-N 2.84Å; A181-T185 PolarHBondContact O-OG1 3.47Å
182	S	59.2	Low	50	Low	66 Å²	66	125.9 Å²	125.9	46%	0.462	65%	0.647	S	S	.	*	H	α-helix	trans	-68	-34.7	176.5	-60.7	0	0	0	0	112.5	N178 D179 A180	N178-S182 WeakPolarHBondContact O-CB 3.46Å; N178-S182 PolarHBondContact O-N 3.24Å; N178-S182 PolarHBondContact O-OG 3.48Å; D179-S182 PolarHBondContact O-N 2.83Å; A180-S182 VanDerWaalsContact C-N 3.32Å; A180-S182 PolarHBondContact O-N 3.2Å
183	A	55.2	Low	49.3	Very low	61 Å²	61	130.1 Å²	130.1	50%	0.504	66%	0.658	S	S	.	*	H	α-helix	trans	-68.7	-47	172.9	0	0	0	0	0	111.9	D179 A180 T185 R186	D179-A183 PolarHBondContact O-N 2.98Å; A180-A183 PolarHBondContact O-N 3.37Å; A183-T185 PolarHBondContact O-N 2.89Å; A183-R186 WeakPolarHBondContact O-CB 3.36Å; A183-R186 PolarHBondContact O-N 3.31Å
184	M	44.6	Very low	48.5	Very low	154 Å²	154	132.7 Å²	132.7	76%	0.759	69%	0.685	S	S	*	*	H	α-helix	trans	-60.6	-32.1	-178.9	-163.3	65.4	175.8	0	0	112.8	A180 A181 R186	A180-M184 PolarHBondContact O-N 3.19Å; A181-M184 PolarHBondContact O-N 2.96Å; M184-R186 PolarHBondContact O-N 3.43Å
185	T	48.2	Very low	48.4	Very low	121 Å²	121	130.9 Å²	130.9	74%	0.742	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-9.7	178.6	-43.9	0	0	0	0	113.1	A181 A183	A181-T185 PolarHBondContact O-N 2.84Å; A181-T185 PolarHBondContact O-OG1 3.47Å; A183-T185 PolarHBondContact O-N 2.89Å
186	R	46.7	Very low	47.4	Very low	217 Å²	217	132.1 Å²	132.1	82%	0.819	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-13.1	-177	-165	169.4	-76.3	-178	-2.8	114.3	A183 M184	A183-R186 WeakPolarHBondContact O-CB 3.36Å; A183-R186 PolarHBondContact O-N 3.31Å; M184-R186 PolarHBondContact O-N 3.43Å
187	C	39.3	Very low	46.5	Very low	108 Å²	108	129.3 Å²	129.3	73%	0.73	71%	0.712	S	S	*	*	S	Bend	trans	-89.4	3.7	-177.3	-73.9	0	0	0	0	115.9
188	Q	40.6	Very low	45.9	Very low	184 Å²	184	129.7 Å²	129.7	86%	0.86	72%	0.718	S	S	*	*			trans	-100.6	55.7	174.1	-67	-167.9	6.9	0	0	113.3
189	R	35.4	Very low	45	Very low	231 Å²	231	134.6 Å²	134.6	87%	0.872	74%	0.739	S	S	*	*			trans	-151.4	93.7	158.8	-82.1	-164	-176.4	104.8	3.3	110.2
190	M	41.3	Very low	43.6	Very low	176 Å²	176	135.7 Å²	135.7	87%	0.867	75%	0.753	S	S	*	*			trans	-114.7	128.5	160.9	-77.5	-65.7	165.8	0	0	108.8
191	P	42.4	Very low	42.8	Very low	115 Å²	115	142 Å²	142	75%	0.747	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-82.1	134.5	-176.7	31.8	-33	0	0	0	111.3	R193	P191-R193 PolarHBondContact O-N 3.11Å
192	L	39.6	Very low	42.3	Very low	181 Å²	181	145.4 Å²	145.4	95%	0.948	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.8	122	166	-69.9	168	0	0	0	108.9
193	R	42.4	Very low	41.4	Very low	253 Å²	253	147.9 Å²	147.9	96%	0.955	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-85.3	123.8	174.7	-125.8	176.2	-176.1	166.9	0.1	108.9	P191	P191-R193 PolarHBondContact O-N 3.11Å
194	A	36.9	Very low	40.7	Very low	91 Å²	91	149.9 Å²	149.9	75%	0.752	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.8	143.8	-178.4	0	0	0	0	0	112.4
195	V	40.3	Very low	40.4	Very low	146 Å²	146	147.6 Å²	147.6	89%	0.885	81%	0.807	S	S	*	*			trans	-140.7	124.6	140.8	-167.8	0	0	0	0	107.1
196	S	40.5	Very low	40.3	Very low	118 Å²	118	150 Å²	150	83%	0.825	81%	0.813	S	S	*	*			trans	-146.2	133.6	170.9	-55.7	0	0	0	0	109
197	S	41.6	Very low	40.2	Very low	110 Å²	110	144.8 Å²	144.8	77%	0.769	81%	0.81	S	S	*	*			trans	-116.6	171.9	169.8	57.2	0	0	0	0	110.4
198	S	47.4	Very low	39.9	Very low	95 Å²	95	149 Å²	149	66%	0.664	82%	0.816	S	S	*	*			trans	58.3	95	-166.8	56	0	0	0	0	113.8
199	E	40.3	Very low	39.8	Very low	180 Å²	180	146.4 Å²	146.4	84%	0.841	82%	0.815	S	S	*	*				77.5	122.5	91.5	-72.7	168.5	140.4	0	0	111.4
200	C	32.2	Very low	39.8	Very low	129 Å²	129	140.4 Å²	140.4	87%	0.872	81%	0.808	S	S	*	*				-146.4	164.8	56.1	-64.7	0	0	0	0	114.4
201	K	39	Very low	39.8	Very low	193 Å²	193	137 Å²	137	84%	0.839	80%	0.802	S	S	*	*			trans	-70.8	161.3	173	-61.9	153.4	-176.4	166.4	0	109.5
202	T	35.7	Very low	40	Very low	125 Å²	125	138.8 Å²	138.8	77%	0.767	80%	0.8	S	S	*	*				-171.3	158.5	62.6	-61.4	0	0	0	0	111.9
203	T	39.2	Very low	39.9	Very low	117 Å²	117	139.1 Å²	139.1	72%	0.718	79%	0.794	S	S	*	*			trans	-42.3	169.2	174.7	64.1	0	0	0	0	116.7
204	S	42	Very low	39.6	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	79%	0.786	S	S	*	*			cis	-164	163.8	21.2	-4.6	0	0	0	0	113.1
205	S	37.6	Very low	39.4	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	79%	0.79	S	S	*	*			trans	-37.6	152.2	165.3	53.3	0	0	0	0	119.2
206	I	45.5	Very low	39.3	Very low	172 Å²	172	132.7 Å²	132.7	88%	0.882	79%	0.786	S	S	*	*				-161.9	170.4	129.9	-104.1	156.7	0	0	0	111.8
207	S	45.4	Very low	38.9	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	79%	0.788	S	S	*	*			trans	-89.3	168.9	-148.2	50.3	0	0	0	0	119.5
208	K	33	Very low	38.6	Very low	196 Å²	196	131.9 Å²	131.9	85%	0.852	78%	0.779	S	S	*	*			trans	-58.3	163.3	162.8	-47.1	171.5	-179.1	171.5	0	111.2
209	P	38.7	Very low	38.3	Very low	129 Å²	129	136.4 Å²	136.4	84%	0.838	79%	0.789	S	S	*	*				-149.2	-176.9	84.1	38.8	-19.5	0	0	0	116
210	S	34.3	Very low	38	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	79%	0.786	S	S	*	*			trans	-84	147.6	-179.7	51.4	0	0	0	0	115
211	S	41.4	Very low	38.2	Very low	104 Å²	104	134 Å²	134	73%	0.727	77%	0.771	S	S	*	*				172.4	143.5	126.2	-88	0	0	0	0	116.9
212	Q	47.6	Very low	39.1	Very low	154 Å²	154	129.5 Å²	129.5	72%	0.72	76%	0.755	S	S	*	*			trans	73.7	125.1	146.3	-69.4	-177.7	25.8	0	0	123.9
213	K	37.9	Very low	40.6	Very low	188 Å²	188	127.3 Å²	127.3	82%	0.817	74%	0.739	S	S	*	*			trans	62.9	108.8	139.2	-65.8	174.1	178.3	171.6	0	121
214	A	35.7	Very low	42.4	Very low	95 Å²	95	122.9 Å²	122.9	79%	0.785	71%	0.712	S	S	*	*				169.5	150.1	104.6	0	0	0	0	0	110.9
215	P	33.1	Very low	44.1	Very low	129 Å²	129	120.8 Å²	120.8	84%	0.838	69%	0.694	S	S	*	*			trans	-92.8	137.8	-164	34.9	-33.7	0	0	0	114.3
216	T	36.4	Very low	46.2	Very low	131 Å²	131	123.1 Å²	123.1	80%	0.804	69%	0.691	S	S	*	*			trans	-122	130.6	166.5	51.1	0	0	0	0	111.1	N218	T216-N218 PolarHBondContact O-N 2.83Å
217	A	33.9	Very low	48	Very low	105 Å²	105	116.7 Å²	116.7	87%	0.868	66%	0.657	S	S	*	*			trans	-63.6	127.1	-171.8	0	0	0	0	0	112.9
218	N	33.7	Very low	50.1	Low	106 Å²	106	115.3 Å²	115.3	57%	0.567	64%	0.644	S	S	*	*			trans	-144.3	105.8	167.5	-107.7	-73.4	0	0	0	108.4	T216 R220	T216-N218 PolarHBondContact O-N 2.83Å; N218-R220 VanDerWaalsContact C-N 3.35Å; N218-R220 HydrophobicContact CB-CG 4.49Å; N218-R220 PolarHBondContact O-N 2.98Å; N218-R220 PolarHBondContact OD1-NE 3.41Å; N218-R220 PolarHBondContact OD1-NH2 3.06Å
219	Q	41.1	Very low	52.8	Low	189 Å²	189	106.6 Å²	106.6	88%	0.883	61%	0.607	S	S	*	*			trans	-71.1	90	172.4	-66.8	-173.2	12.2	0	0	109.6
220	R	34.2	Very low	55.4	Low	205 Å²	205	105.7 Å²	105.7	77%	0.774	59%	0.587	S	S	*	*			trans	-134.4	129.3	172.2	-56.3	-172.6	-160.6	-175.1	6.9	109.5	N218	N218-R220 VanDerWaalsContact C-N 3.35Å; N218-R220 HydrophobicContact CB-CG 4.49Å; N218-R220 PolarHBondContact O-N 2.98Å; N218-R220 PolarHBondContact OD1-NE 3.41Å; N218-R220 PolarHBondContact OD1-NH2 3.06Å
221	G	37.8	Very low	58.1	Low	54 Å²	54	103.7 Å²	103.7	56%	0.557	57%	0.566	S	S	*	*			trans	107	23.8	171.1	0	0	0	0	0	117.2	D223 K226	G221-D223 PolarHBondContact O-N 2.98Å; G221-K226 PolarHBondContact O-NZ 2.87Å
222	L	57.1	Low	60.5	Low	98 Å²	98	98.9 Å²	98.9	51%	0.513	53%	0.532	S	S	.	.			trans	-72.4	88.3	172.4	-69.6	172.8	0	0	0	111.1	P296 F297	L222-P296 HydrophobicContact CD1-CB 3.53Å; L222-P296 HydrophobicContact CD1-CG 4.48Å; L222-P296 HydrophobicContact CD2-CB 3.6Å; L222-P296 HydrophobicContact CD2-CG 3.77Å; L222-P296 HydrophobicContact CG-CB 4.17Å; L222-F297 HydrophobicContact CB-CE1 3.99Å; L222-F297 HydrophobicContact CB-CZ 3.84Å; L222-F297 HydrophobicContact CD2-CZ 4.38Å; L222-F297 WeakPolarHBondContact O-CE1 3.41Å
223	D	67.3	Low	62.5	Low	79 Å²	79	91.6 Å²	91.6	42%	0.422	50%	0.497	S	S	.	.			trans	-98.9	126.3	166.9	-168.8	-25.9	0	0	0	108.5	G221 T225 K226 F297	G221-D223 PolarHBondContact O-N 2.98Å; D223-T225 PolarHBondContact O-N 3.46Å; D223-T225 WeakPolarHBondContact OD1-CB 3.3Å; D223-T225 WeakPolarHBondContact OD1-CG2 3.33Å; D223-T225 PolarHBondContact OD1-N 3.41Å; D223-T225 VanDerWaalsContact OD1-N 3.1Å; D223-T225 PolarHBondContact OD1-OG1 3.28Å; D223-T225 PolarHBondContact OD2-OG1 3.13Å; D223-K226 HydrophobicContact CB-CD 4.15Å; D223-K226 HydrophobicContact CB-CG 4.21Å; D223-K226 PolarHBondContact O-N 2.56Å; D223-F297 VanDerWaalsContact C-CZ 3.46Å
224	V	77.2	Confident	65.1	Low	24 Å²	24	82.7 Å²	82.7	15%	0.145	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-69	-24.3	-175.3	69.1	0	0	0	0	111.8	K226 K227 E254 F297	V224-K226 PolarHBondContact O-N 3.26Å; V224-K227 PolarHBondContact O-N 3.12Å; V224-E254 HydrophobicContact CG1-CB 3.89Å; V224-E254 HydrophobicContact CG1-CG 4.48Å; V224-E254 WeakPolarHBondContact CG1-O 3.37Å; V224-F297 VanDerWaalsContact CA-CZ 3.43Å; V224-F297 HydrophobicContact CB-CD1 3.88Å; V224-F297 HydrophobicContact CB-CD2 4.33Å; V224-F297 HydrophobicContact CB-CE1 3.7Å; V224-F297 HydrophobicContact CB-CE2 4.18Å; V224-F297 HydrophobicContact CB-CG 4.2Å; V224-F297 HydrophobicContact CB-CZ 3.87Å; V224-F297 HydrophobicContact CG2-CD1 4.19Å; V224-F297 HydrophobicContact CG2-CD2 4.02Å; V224-F297 HydrophobicContact CG2-CE1 4.39Å; V224-F297 HydrophobicContact CG2-CE2 4.24Å; V224-F297 HydrophobicContact CG2-CG 4Å; V224-F297 HydrophobicContact CG2-CZ 4.42Å
225	T	77.7	Confident	67.6	Low	59 Å²	59	78.2 Å²	78.2	36%	0.362	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-65.1	-17.3	176.6	62.6	0	0	0	0	113.6	D223 K227 E254	D223-T225 PolarHBondContact O-N 3.46Å; D223-T225 WeakPolarHBondContact OD1-CB 3.3Å; D223-T225 WeakPolarHBondContact OD1-CG2 3.33Å; D223-T225 PolarHBondContact OD1-N 3.41Å; D223-T225 VanDerWaalsContact OD1-N 3.1Å; D223-T225 PolarHBondContact OD1-OG1 3.28Å; D223-T225 PolarHBondContact OD2-OG1 3.13Å; T225-K227 VanDerWaalsContact C-N 3.25Å; T225-K227 PolarHBondContact O-N 2.88Å; T225-E254 WeakPolarHBondContact CG2-O 3.34Å
226	K	80.4	Confident	70.3	Confident	156 Å²	156	73.3 Å²	73.3	68%	0.678	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-76.5	-8.1	176.3	-64.8	176.1	-177.7	172.9	0	114.1	G221 D223 V224	G221-K226 PolarHBondContact O-NZ 2.87Å; D223-K226 HydrophobicContact CB-CD 4.15Å; D223-K226 HydrophobicContact CB-CG 4.21Å; D223-K226 PolarHBondContact O-N 2.56Å; V224-K226 PolarHBondContact O-N 3.26Å
227	K	84.1	Confident	72.8	Confident	38 Å²	38	67.3 Å²	67.3	17%	0.165	35%	0.35	C	S	.	.	S	Bend	trans	-96.7	143.9	175.8	-86.2	131.4	175.4	-64	0	110.8	V224 T225 R232 W295 F297	V224-K227 PolarHBondContact O-N 3.12Å; T225-K227 VanDerWaalsContact C-N 3.25Å; T225-K227 PolarHBondContact O-N 2.88Å; K227-R232 HydrophobicContact CB-CG 4.06Å; K227-R232 PolarHBondContact O-NE 3.28Å; K227-W295 HydrophobicContact CB-CH2 3.72Å; K227-W295 HydrophobicContact CB-CZ2 4.36Å; K227-W295 HydrophobicContact CD-CH2 3.44Å; K227-W295 VanDerWaalsContact CD-CH2 3.44Å; K227-W295 HydrophobicContact CD-CZ2 3.76Å; K227-W295 HydrophobicContact CD-CZ3 3.88Å; K227-W295 HydrophobicContact CG-CH2 3.5Å; K227-W295 HydrophobicContact CG-CZ2 4.26Å; K227-W295 HydrophobicContact CG-CZ3 3.91Å; K227-F297 HydrophobicContact CD-CD2 4.03Å; K227-F297 HydrophobicContact CD-CE2 3.55Å
228	T	90.2	Very high	75.4	Confident	77 Å²	77	62.8 Å²	62.8	47%	0.472	31%	0.312	S	S	.	.			trans	-59.1	147.3	179.7	64.9	0	0	0	0	110.5	R230 E231 R232	T228-R230 PolarHBondContact O-N 2.7Å; T228-R230 VanDerWaalsContact O-N 3.14Å; T228-E231 WeakPolarHBondContact CB-OE2 3.18Å; T228-E231 PolarHBondContact N-OE2 3.47Å; T228-E231 PolarHBondContact O-N 2.8Å; T228-E231 VanDerWaalsContact OG1-CG 3.23Å; T228-E231 WeakPolarHBondContact OG1-CG 3.3Å; T228-E231 PolarHBondContact OG1-N 2.7Å; T228-E231 PolarHBondContact OG1-OE2 2.72Å; T228-R232 PolarHBondContact O-N 3.2Å; T228-R232 VanDerWaalsContact O-N 3.07Å
229	L	89.7	Confident	77.9	Confident	14 Å²	14	59.5 Å²	59.5	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-47.4	-41.3	171.8	-178.3	59.4	0	0	0	112.4	R232 V233 L251 L256 E260 N263 F264 T267	L229-R232 PolarHBondContact O-N 3.46Å; L229-V233 HydrophobicContact CD1-CG2 4.33Å; L229-V233 WeakPolarHBondContact O-CB 3.32Å; L229-V233 VanDerWaalsContact O-CG2 3.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.41Å; L229-V233 PolarHBondContact O-N 3.11Å; L229-L251 HydrophobicContact CD1-CD1 4.14Å; L229-L256 HydrophobicContact CD1-CD1 3.45Å; L229-L256 VanDerWaalsContact CD1-CD1 3.45Å; L229-E260 HydrophobicContact CB-CG 4.43Å; L229-E260 HydrophobicContact CD1-CB 4.4Å; L229-E260 HydrophobicContact CD2-CB 4.13Å; L229-E260 WeakPolarHBondContact CD2-O 3.39Å; L229-N263 HydrophobicContact CD2-CB 3.97Å; L229-F264 HydrophobicContact CD1-CD2 4.4Å; L229-T267 HydrophobicContact CG-CG2 4.16Å
230	R	92.4	Very high	79.8	Confident	109 Å²	109	57.1 Å²	57.1	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-61.3	-52.2	179.3	-170.1	173.2	-176.5	-122	-9.3	112.4	T228 R232 V233 I234 T267 V271 E290	T228-R230 PolarHBondContact O-N 2.7Å; T228-R230 VanDerWaalsContact O-N 3.14Å; R230-R232 VanDerWaalsContact C-N 3.33Å; R230-R232 PolarHBondContact O-N 3.23Å; R230-V233 PolarHBondContact O-N 2.83Å; R230-I234 HydrophobicContact CG-CD1 4Å; R230-I234 WeakPolarHBondContact O-CD1 3.48Å; R230-I234 VanDerWaalsContact O-CG1 3.25Å; R230-I234 WeakPolarHBondContact O-CG1 3.42Å; R230-I234 PolarHBondContact O-N 3.05Å; R230-T267 HydrophobicContact CB-CG2 3.91Å; R230-T267 HydrophobicContact CG-CG2 4.24Å; R230-V271 HydrophobicContact CG-CG2 4.11Å; R230-E290 VanDerWaalsContact CZ-CD 3.44Å; R230-E290 IonicContact CZ-OE1 3.13Å; R230-E290 IonicContact CZ-OE2 3.24Å; R230-E290 IonicContact NE-OE2 3.2Å; R230-E290 IonicContact NH1-OE1 3.62Å; R230-E290 PolarHBondContact NH1-OE1 3.08Å; R230-E290 IonicContact NH1-OE2 2.69Å; R230-E290 PolarHBondContact NH1-OE2 3.14Å; R230-E290 IonicContact NH2-OE1 2.97Å; R230-E290 PolarHBondContact NH2-OE1 2.69Å; R230-E290 IonicContact NH2-OE2 3.19Å; R230-E290 PolarHBondContact NH2-OE2 3.36Å
231	E	91.3	Very high	81.9	Confident	64 Å²	64	50.4 Å²	50.4	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-43.3	176.3	-68.1	164.3	102.7	0	0	111.7	T228 V233 I234 H235 W295	T228-E231 WeakPolarHBondContact CB-OE2 3.18Å; T228-E231 PolarHBondContact N-OE2 3.47Å; T228-E231 PolarHBondContact O-N 2.8Å; T228-E231 VanDerWaalsContact OG1-CG 3.23Å; T228-E231 WeakPolarHBondContact OG1-CG 3.3Å; T228-E231 PolarHBondContact OG1-N 2.7Å; T228-E231 PolarHBondContact OG1-OE2 2.72Å; E231-V233 PolarHBondContact O-N 3.43Å; E231-I234 PolarHBondContact O-N 3.38Å; E231-H235 WeakPolarHBondContact O-CB 3.37Å; E231-H235 PolarHBondContact O-CD2 3.19Å; E231-H235 VanDerWaalsContact O-CD2 3.27Å; E231-H235 PolarHBondContact O-N 3.13Å; E231-W295 HydrophobicContact CB-CH2 3.57Å; E231-W295 HydrophobicContact CB-CZ3 3.74Å; E231-W295 HydrophobicContact CG-CZ3 4.4Å
232	R	90.9	Very high	83.7	Confident	3 Å²	3	47.9 Å²	47.9	1%	0.011	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-43.2	179.2	-66.8	-172.3	-64.9	160.7	2.1	111.9	K227 T228 L229 R230 H236 L251 E260 W295	K227-R232 HydrophobicContact CB-CG 4.06Å; K227-R232 PolarHBondContact O-NE 3.28Å; T228-R232 PolarHBondContact O-N 3.2Å; T228-R232 VanDerWaalsContact O-N 3.07Å; L229-R232 PolarHBondContact O-N 3.46Å; R230-R232 VanDerWaalsContact C-N 3.33Å; R230-R232 PolarHBondContact O-N 3.23Å; R232-H236 WeakPolarHBondContact O-CB 3.34Å; R232-H236 PolarHBondContact O-N 3.39Å; R232-L251 HydrophobicContact CB-CD2 3.85Å; R232-E260 IonicContact CZ-OE1 2.99Å; R232-E260 IonicContact CZ-OE2 2.68Å; R232-E260 IonicContact NH1-OE2 2.69Å; R232-E260 IonicContact NH2-OE1 3.72Å; R232-E260 PolarHBondContact NH2-OE1 2.9Å; R232-E260 IonicContact NH2-OE2 3.2Å; R232-E260 PolarHBondContact NH2-OE2 3.2Å; R232-W295 HydrophobicContact CG-CH2 4.47Å; R232-W295 HydrophobicContact CG-CZ2 4.29Å
233	V	91.2	Very high	85	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.1	-45.8	175.3	169.3	0	0	0	0	111.5	L229 R230 E231 H236 L237 L247 L251 F264 T267 F268 V271	L229-V233 HydrophobicContact CD1-CG2 4.33Å; L229-V233 WeakPolarHBondContact O-CB 3.32Å; L229-V233 VanDerWaalsContact O-CG2 3.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.41Å; L229-V233 PolarHBondContact O-N 3.11Å; R230-V233 PolarHBondContact O-N 2.83Å; E231-V233 PolarHBondContact O-N 3.43Å; V233-H236 PolarHBondContact O-N 3.19Å; V233-L237 HydrophobicContact CG1-CD1 3.85Å; V233-L237 HydrophobicContact CG1-CG 4.5Å; V233-L237 WeakPolarHBondContact O-CB 2.96Å; V233-L237 WeakPolarHBondContact O-CG 3.37Å; V233-L237 PolarHBondContact O-N 3.11Å; V233-L247 HydrophobicContact CB-CD2 4.47Å; V233-L247 HydrophobicContact CG1-CD2 4.06Å; V233-L247 HydrophobicContact CG2-CD2 4.21Å; V233-L251 HydrophobicContact CG2-CD1 3.98Å; V233-F264 HydrophobicContact CG2-CD2 4.3Å; V233-F264 HydrophobicContact CG2-CE2 4.06Å; V233-T267 HydrophobicContact CG2-CG2 4.46Å; V233-F268 HydrophobicContact CG1-CD2 4.33Å; V233-V271 HydrophobicContact CG1-CB 4.1Å; V233-V271 HydrophobicContact CG1-CG1 3.96Å
234	I	91.1	Very high	85.9	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-56.4	-53.3	176.3	-70.7	164.4	0	0	0	110.4	R230 E231 H236 L237 L238 V271 L283 C287 E290 V291	R230-I234 HydrophobicContact CG-CD1 4Å; R230-I234 WeakPolarHBondContact O-CD1 3.48Å; R230-I234 VanDerWaalsContact O-CG1 3.25Å; R230-I234 WeakPolarHBondContact O-CG1 3.42Å; R230-I234 PolarHBondContact O-N 3.05Å; E231-I234 PolarHBondContact O-N 3.38Å; I234-H236 VanDerWaalsContact C-N 3.32Å; I234-H236 PolarHBondContact O-N 3.18Å; I234-L237 PolarHBondContact O-N 3.29Å; I234-L238 WeakPolarHBondContact O-CB 3.39Å; I234-L238 PolarHBondContact O-N 3.04Å; I234-V271 HydrophobicContact CB-CG1 4.43Å; I234-V271 HydrophobicContact CG1-CG1 3.52Å; I234-V271 HydrophobicContact CG1-CG2 4.11Å; I234-L283 HydrophobicContact CB-CD1 4.31Å; I234-L283 HydrophobicContact CG1-CD1 4.12Å; I234-L283 HydrophobicContact CG2-CD1 4.17Å; I234-L283 HydrophobicContact CG2-CD2 3.99Å; I234-C287 HydrophobicContact CG1-CB 4.41Å; I234-E290 HydrophobicContact CD1-CB 3.96Å; I234-E290 WeakPolarHBondContact CD1-OE2 3.15Å; I234-V291 HydrophobicContact CG2-CG2 3.81Å
235	H	89.5	Confident	86.3	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-67.6	-30.3	-175.1	-83.3	-74.9	0	0	0	113.4	E231 S292 W295 Y298	E231-H235 WeakPolarHBondContact O-CB 3.37Å; E231-H235 PolarHBondContact O-CD2 3.19Å; E231-H235 VanDerWaalsContact O-CD2 3.27Å; E231-H235 PolarHBondContact O-N 3.13Å; H235-S292 PolarHBondContact CE1-N 2.7Å; H235-S292 PolarHBondContact CE1-O 3.02Å; H235-S292 VanDerWaalsContact CE1-O 3.31Å; H235-S292 PolarHBondContact NE2-N 2.95Å; H235-S292 VanDerWaalsContact NE2-N 3.1Å; H235-W295 HydrophobicContact CB-CD2 4.06Å; H235-W295 HydrophobicContact CB-CG 4.3Å; H235-W295 HydrophobicContact CB-CZ2 4.16Å; H235-W295 AromaticContact CD2-CD2 3.41Å; H235-W295 VanDerWaalsContact CD2-CD2 3.41Å; H235-W295 AromaticContact CD2-CE2 3.85Å; H235-W295 AromaticContact CD2-CE3 3.11Å; H235-W295 AromaticContact CD2-CH2 3.75Å; H235-W295 AromaticContact CD2-CZ3 3.27Å; H235-W295 WeakPolarHBondContact CD2-CZ3 3.48Å; H235-W295 AromaticContact CE1-CD2 3.85Å; H235-W295 AromaticContact CE1-CE3 3.73Å; H235-W295 AromaticContact CE1-CG 3.83Å; H235-W295 AromaticContact CG-CD2 3.43Å; H235-W295 VanDerWaalsContact CG-CD2 3.43Å; H235-W295 AromaticContact CG-CE2 3.71Å; H235-W295 AromaticContact CG-CE3 3.69Å; H235-W295 AromaticContact CG-CG 3.71Å; H235-W295 AromaticContact ND1-CD2 3.72Å; H235-W295 AromaticContact ND1-CG 3.55Å; H235-W295 AromaticContact NE2-CD2 3.68Å; H235-W295 AromaticContact NE2-CE3 3.15Å; H235-W295 AromaticContact NE2-CZ3 3.63Å; H235-Y298 WeakPolarHBondContact CA-OH 3.29Å; H235-Y298 HydrophobicContact CB-CE1 4.11Å; H235-Y298 WeakPolarHBondContact CB-OH 3.34Å; H235-Y298 AromaticContact ND1-CE2 3.55Å; H235-Y298 AromaticContact ND1-CZ 3.26Å; H235-Y298 VanDerWaalsContact ND1-CZ 3.26Å; H235-Y298 PolarHBondContact ND1-OH 3.05Å; H235-Y298 WeakPolarHBondContact O-CE1 3.44Å; H235-Y298 PolarHBondContact O-OH 3.06Å
236	H	89	Confident	86.8	Confident	25 Å²	25	51 Å²	51	12%	0.116	25%	0.245	C	C	.	.	H	α-helix	trans	-70.1	-49.7	171	-108.3	70.5	0	0	0	112.7	R232 V233 I234 L238 I239 R240 L247 R250 E254	R232-H236 WeakPolarHBondContact O-CB 3.34Å; R232-H236 PolarHBondContact O-N 3.39Å; V233-H236 PolarHBondContact O-N 3.19Å; I234-H236 VanDerWaalsContact C-N 3.32Å; I234-H236 PolarHBondContact O-N 3.18Å; H236-L238 PolarHBondContact O-N 2.9Å; H236-I239 WeakPolarHBondContact O-CG1 3.44Å; H236-I239 PolarHBondContact O-N 3.24Å; H236-R240 PolarHBondContact O-N 3.06Å; H236-L247 HydrophobicContact CB-CD1 3.44Å; H236-L247 VanDerWaalsContact CB-CD1 3.44Å; H236-L247 WeakPolarHBondContact CD2-CD1 3.17Å; H236-L247 VanDerWaalsContact CG-CD1 3.48Å; H236-R250 WeakPolarHBondContact NE2-CD 3.38Å; H236-E254 IonicContact CE1-OE1 2.9Å; H236-E254 PolarHBondContact CE1-OE1 3.15Å; H236-E254 VanDerWaalsContact CE1-OE1 3.25Å
237	L	89.6	Confident	87.2	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-24.6	-178.5	-74.9	175.4	0	0	0	113.3	V233 I234 L247 F268 V271 A272 L283	V233-L237 HydrophobicContact CG1-CD1 3.85Å; V233-L237 HydrophobicContact CG1-CG 4.5Å; V233-L237 WeakPolarHBondContact O-CB 2.96Å; V233-L237 WeakPolarHBondContact O-CG 3.37Å; V233-L237 PolarHBondContact O-N 3.11Å; I234-L237 PolarHBondContact O-N 3.29Å; L237-L247 HydrophobicContact CD2-CD2 4.5Å; L237-L247 HydrophobicContact CG-CD2 4.27Å; L237-F268 HydrophobicContact CD1-CD2 4.31Å; L237-F268 HydrophobicContact CD1-CE2 4.01Å; L237-F268 HydrophobicContact CD2-CE2 4.06Å; L237-F268 HydrophobicContact CG-CE2 4.47Å; L237-V271 HydrophobicContact CD1-CG1 4.13Å; L237-A272 HydrophobicContact CD1-CB 3.89Å; L237-L283 HydrophobicContact CB-CB 4.12Å
238	L	86.9	Confident	87.4	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-46.2	173.1	-175.5	70.6	0	0	0	112.4	I234 H236 L283 L288 V291 A306 A309 L310	I234-L238 WeakPolarHBondContact O-CB 3.39Å; I234-L238 PolarHBondContact O-N 3.04Å; H236-L238 PolarHBondContact O-N 2.9Å; L238-L283 HydrophobicContact CB-CD2 4.12Å; L238-L283 HydrophobicContact CD1-CD2 4.07Å; L238-L288 HydrophobicContact CD1-CD2 3.91Å; L238-V291 HydrophobicContact CD1-CG2 4.47Å; L238-V291 HydrophobicContact CD2-CB 4.33Å; L238-V291 HydrophobicContact CD2-CG1 3.43Å; L238-V291 VanDerWaalsContact CD2-CG1 3.43Å; L238-V291 HydrophobicContact CD2-CG2 3.91Å; L238-A306 HydrophobicContact CD2-CB 3.74Å; L238-A306 HydrophobicContact CG-CB 4.42Å; L238-A309 HydrophobicContact CD1-CB 3.76Å; L238-A309 HydrophobicContact CG-CB 4.14Å; L238-L310 HydrophobicContact CD1-CD2 4.22Å; L238-L310 HydrophobicContact CD1-CG 4.38Å; L238-L310 HydrophobicContact CD2-CD2 4.48Å; L238-L310 HydrophobicContact CD2-CG 4.33Å
239	I	86.8	Confident	87.2	Confident	38 Å²	38	43.1 Å²	43.1	20%	0.195	21%	0.214	C	C	.	.	H	α-helix	trans	-83.2	-24.8	-177.8	63.3	173	0	0	0	112.8	H236 Y298 D302 V305 A306	H236-I239 WeakPolarHBondContact O-CG1 3.44Å; H236-I239 PolarHBondContact O-N 3.24Å; I239-Y298 HydrophobicContact CD1-CD1 4.33Å; I239-Y298 HydrophobicContact CD1-CE1 3.99Å; I239-Y298 HydrophobicContact CG1-CE1 4.41Å; I239-Y298 HydrophobicContact CG2-CD1 4.22Å; I239-Y298 HydrophobicContact CG2-CE1 3.52Å; I239-Y298 HydrophobicContact CG2-CE2 4.42Å; I239-D302 HydrophobicContact CD1-CB 4.18Å; I239-D302 HydrophobicContact CG2-CB 4.28Å; I239-V305 HydrophobicContact CB-CG1 4.24Å; I239-V305 WeakPolarHBondContact O-CG1 3.24Å; I239-A306 HydrophobicContact CG2-CB 4.02Å
240	R	82.2	Confident	87	Confident	138 Å²	138	45.7 Å²	45.7	52%	0.521	22%	0.223	S	C	.	.			trans	-153.4	111.8	-174.8	-167.5	176.9	-177.5	97.4	2.6	111.5	H236 C242 E246	H236-R240 PolarHBondContact O-N 3.06Å; R240-C242 PolarHBondContact O-N 3.07Å; R240-C242 PolarHBondContact O-SG 3.24Å; R240-E246 IonicContact NE-OE1 2.73Å; R240-E246 PolarHBondContact NE-OE1 3.14Å; R240-E246 IonicContact NH2-OE1 3.11Å
241	S	77.4	Confident	86.8	Confident	64 Å²	64	40.5 Å²	40.5	45%	0.448	20%	0.203	S	C	.	.			trans	-65.5	104.3	166.3	48.8	0	0	0	0	109.7	N281	S241-N281 WeakPolarHBondContact CA-O 3.27Å; S241-N281 WeakPolarHBondContact CB-O 3.19Å
242	C	76.1	Confident	86.7	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	21%	0.211	C	C	.	.			trans	-123.2	156	-175.6	48.4	0	0	0	0	110.8	R240 E246	R240-C242 PolarHBondContact O-N 3.07Å; R240-C242 PolarHBondContact O-SG 3.24Å; C242-E246 HydrophobicContact CB-CB 4.25Å; C242-E246 HydrophobicContact CB-CG 4.21Å; C242-E246 WeakPolarHBondContact CB-OE2 3.44Å
243	S	83.7	Confident	86.3	Confident	42 Å²	42	49.6 Å²	49.6	29%	0.294	25%	0.248	S	C	.	.			trans	-69.5	155.7	174.8	68.7	0	0	0	0	110.7	K245 E246 L247	S243-K245 PolarHBondContact O-N 3.33Å; S243-E246 PolarHBondContact O-N 2.95Å; S243-E246 WeakPolarHBondContact OG-CB 3.48Å; S243-E246 PolarHBondContact OG-N 3.36Å; S243-L247 PolarHBondContact O-N 2.63Å
244	P	86.2	Confident	85.9	Confident	49 Å²	49	52.6 Å²	52.6	32%	0.318	26%	0.262	S	S	.	.	H	α-helix	trans	-54.4	-42.1	178.8	-17.9	24.1	0	0	0	112	L247 L248 F264 F268	P244-L247 PolarHBondContact O-N 2.75Å; P244-L248 WeakPolarHBondContact O-CB 3.41Å; P244-L248 PolarHBondContact O-N 3.19Å; P244-F264 HydrophobicContact CB-CE1 4.39Å; P244-F264 WeakPolarHBondContact O-CZ 3.32Å; P244-F268 HydrophobicContact CB-CD1 4.29Å; P244-F268 HydrophobicContact CB-CE1 4.06Å; P244-F268 HydrophobicContact CB-CE2 4.47Å; P244-F268 HydrophobicContact CB-CZ 4.13Å; P244-F268 HydrophobicContact CG-CD1 4.22Å; P244-F268 HydrophobicContact CG-CE1 3.6Å; P244-F268 HydrophobicContact CG-CZ 3.79Å
245	K	86.2	Confident	85.5	Confident	172 Å²	172	54.7 Å²	54.7	75%	0.748	28%	0.284	S	S	*	.	H	α-helix	trans	-65.4	-38.9	178.3	-61.8	-175.3	179.5	-177.5	0	112.9	S243 S249	S243-K245 PolarHBondContact O-N 3.33Å; K245-S249 VanDerWaalsContact O-CB 3.3Å; K245-S249 WeakPolarHBondContact O-CB 3.44Å; K245-S249 PolarHBondContact O-N 3.35Å; K245-S249 VanDerWaalsContact O-N 3.11Å; K245-S249 PolarHBondContact O-OG 3.19Å
246	E	87.4	Confident	85.3	Confident	63 Å²	63	55.5 Å²	55.5	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-68.1	-40.2	175.9	-174.1	-168.5	162.9	0	0	111.2	R240 C242 S243 S249 R250	R240-E246 IonicContact NE-OE1 2.73Å; R240-E246 PolarHBondContact NE-OE1 3.14Å; R240-E246 IonicContact NH2-OE1 3.11Å; C242-E246 HydrophobicContact CB-CB 4.25Å; C242-E246 HydrophobicContact CB-CG 4.21Å; C242-E246 WeakPolarHBondContact CB-OE2 3.44Å; S243-E246 PolarHBondContact O-N 2.95Å; S243-E246 WeakPolarHBondContact OG-CB 3.48Å; S243-E246 PolarHBondContact OG-N 3.36Å; E246-S249 PolarHBondContact O-N 3.34Å; E246-R250 PolarHBondContact O-N 3.35Å; E246-R250 IonicContact OE1-CZ 2.73Å; E246-R250 IonicContact OE1-NH1 3.3Å; E246-R250 PolarHBondContact OE1-NH1 3.48Å; E246-R250 IonicContact OE1-NH2 3.25Å; E246-R250 PolarHBondContact OE1-NH2 3.04Å
247	L	88.8	Confident	85	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-48.8	178.1	-179.1	55.6	0	0	0	111.9	V233 H236 L237 S243 P244 S249 R250 L251 F264 F268	V233-L247 HydrophobicContact CB-CD2 4.47Å; V233-L247 HydrophobicContact CG1-CD2 4.06Å; V233-L247 HydrophobicContact CG2-CD2 4.21Å; H236-L247 HydrophobicContact CB-CD1 3.44Å; H236-L247 VanDerWaalsContact CB-CD1 3.44Å; H236-L247 WeakPolarHBondContact CD2-CD1 3.17Å; H236-L247 VanDerWaalsContact CG-CD1 3.48Å; L237-L247 HydrophobicContact CD2-CD2 4.5Å; L237-L247 HydrophobicContact CG-CD2 4.27Å; S243-L247 PolarHBondContact O-N 2.63Å; P244-L247 PolarHBondContact O-N 2.75Å; L247-S249 PolarHBondContact O-N 3.42Å; L247-R250 WeakPolarHBondContact O-CA 3.2Å; L247-R250 WeakPolarHBondContact O-CB 3.32Å; L247-R250 PolarHBondContact O-N 2.97Å; L247-L251 HydrophobicContact CD1-CD1 4.2Å; L247-L251 HydrophobicContact CD1-CG 4.15Å; L247-L251 HydrophobicContact CG-CD1 4.05Å; L247-L251 HydrophobicContact CG-CG 4.44Å; L247-L251 PolarHBondContact O-N 3.13Å; L247-F264 HydrophobicContact CB-CE2 4.44Å; L247-F264 HydrophobicContact CB-CZ 4.09Å; L247-F264 HydrophobicContact CD2-CE2 3.93Å; L247-F264 HydrophobicContact CD2-CZ 4.08Å; L247-F264 HydrophobicContact CG-CE2 3.88Å; L247-F264 HydrophobicContact CG-CZ 4.02Å; L247-F268 HydrophobicContact CD2-CD2 3.73Å; L247-F268 HydrophobicContact CD2-CE2 3.79Å
248	L	89.1	Confident	84.8	Confident	39 Å²	39	60.4 Å²	60.4	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-55.6	-42	175.1	-176.4	58.8	0	0	0	111.2	P244 R250 L251 V252 L256 R261 F264	P244-L248 WeakPolarHBondContact O-CB 3.41Å; P244-L248 PolarHBondContact O-N 3.19Å; L248-R250 PolarHBondContact O-N 3.06Å; L248-L251 PolarHBondContact O-N 2.93Å; L248-V252 HydrophobicContact CD1-CG2 4.21Å; L248-V252 HydrophobicContact CG-CG2 4.47Å; L248-V252 WeakPolarHBondContact O-CB 3.43Å; L248-V252 VanDerWaalsContact O-CG2 3.28Å; L248-V252 WeakPolarHBondContact O-CG2 3.37Å; L248-V252 PolarHBondContact O-N 2.88Å; L248-L256 HydrophobicContact CD1-CD2 4.35Å; L248-R261 HydrophobicContact CD1-CG 4.32Å; L248-F264 HydrophobicContact CB-CD1 4.13Å; L248-F264 HydrophobicContact CB-CE1 3.77Å; L248-F264 HydrophobicContact CB-CZ 4Å; L248-F264 HydrophobicContact CD1-CB 4.21Å; L248-F264 HydrophobicContact CD1-CD1 3.89Å; L248-F264 HydrophobicContact CD1-CD2 4.27Å; L248-F264 HydrophobicContact CD1-CE1 4.39Å; L248-F264 HydrophobicContact CD1-CG 3.83Å; L248-F264 HydrophobicContact CD2-CD1 4.26Å; L248-F264 HydrophobicContact CG-CD1 4.32Å; L248-F264 HydrophobicContact CG-CE1 4.45Å
249	S	86.5	Confident	84.8	Confident	66 Å²	66	65.3 Å²	65.3	46%	0.462	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-18.3	176.4	-60.1	0	0	0	0	114.6	K245 E246 L247 K253	K245-S249 VanDerWaalsContact O-CB 3.3Å; K245-S249 WeakPolarHBondContact O-CB 3.44Å; K245-S249 PolarHBondContact O-N 3.35Å; K245-S249 VanDerWaalsContact O-N 3.11Å; K245-S249 PolarHBondContact O-OG 3.19Å; E246-S249 PolarHBondContact O-N 3.34Å; L247-S249 PolarHBondContact O-N 3.42Å; S249-K253 WeakPolarHBondContact O-CD 3.47Å; S249-K253 WeakPolarHBondContact O-CE 3.16Å; S249-K253 WeakPolarHBondContact O-CG 3.4Å
250	R	84.8	Confident	84.9	Confident	69 Å²	69	65.3 Å²	65.3	26%	0.26	36%	0.356	S	S	.	.	H	α-helix	trans	-86.4	-50.1	170.2	-74	-167.3	179.1	96.6	12.2	111.1	H236 E246 L247 L248 V252 K253 E254	H236-R250 WeakPolarHBondContact NE2-CD 3.38Å; E246-R250 PolarHBondContact O-N 3.35Å; E246-R250 IonicContact OE1-CZ 2.73Å; E246-R250 IonicContact OE1-NH1 3.3Å; E246-R250 PolarHBondContact OE1-NH1 3.48Å; E246-R250 IonicContact OE1-NH2 3.25Å; E246-R250 PolarHBondContact OE1-NH2 3.04Å; L247-R250 WeakPolarHBondContact O-CA 3.2Å; L247-R250 WeakPolarHBondContact O-CB 3.32Å; L247-R250 PolarHBondContact O-N 2.97Å; L248-R250 PolarHBondContact O-N 3.06Å; R250-V252 VanDerWaalsContact C-N 3.28Å; R250-V252 PolarHBondContact O-N 2.85Å; R250-K253 WeakPolarHBondContact O-CA 3.4Å; R250-K253 WeakPolarHBondContact O-CB 3.41Å; R250-K253 PolarHBondContact O-N 3.43Å; R250-E254 PolarHBondContact O-N 3.29Å; R250-E254 VanDerWaalsContact O-N 3.12Å
251	L	89	Confident	85.2	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.9	-37.2	-178.9	-63.8	171.2	0	0	0	112.2	L229 R232 V233 L247 L248 K253 E254 G255 L256 F264	L229-L251 HydrophobicContact CD1-CD1 4.14Å; R232-L251 HydrophobicContact CB-CD2 3.85Å; V233-L251 HydrophobicContact CG2-CD1 3.98Å; L247-L251 HydrophobicContact CD1-CD1 4.2Å; L247-L251 HydrophobicContact CD1-CG 4.15Å; L247-L251 HydrophobicContact CG-CD1 4.05Å; L247-L251 HydrophobicContact CG-CG 4.44Å; L247-L251 PolarHBondContact O-N 3.13Å; L248-L251 PolarHBondContact O-N 2.93Å; L251-K253 VanDerWaalsContact C-N 3.25Å; L251-K253 PolarHBondContact O-N 3.36Å; L251-E254 CarbonylContact O-C 3.59Å; L251-E254 WeakPolarHBondContact O-CA 3.21Å; L251-E254 WeakPolarHBondContact O-CB 3.14Å; L251-E254 PolarHBondContact O-N 2.73Å; L251-G255 PolarHBondContact O-N 3.1Å; L251-L256 HydrophobicContact CB-CB 4.07Å; L251-L256 HydrophobicContact CB-CD1 3.55Å; L251-L256 HydrophobicContact CB-CG 4.39Å; L251-L256 HydrophobicContact CD1-CD1 3.97Å; L251-L256 HydrophobicContact CG-CD1 4.35Å; L251-L256 WeakPolarHBondContact O-CB 3.35Å; L251-L256 PolarHBondContact O-N 2.79Å; L251-L256 VanDerWaalsContact O-N 3.1Å; L251-F264 HydrophobicContact CD1-CD2 3.81Å; L251-F264 HydrophobicContact CD1-CE2 3.64Å
252	V	87.9	Confident	85.8	Confident	77 Å²	77	71 Å²	71	47%	0.467	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-60.9	-31.9	172.6	169.7	0	0	0	0	112.4	L248 R250 E254 L256	L248-V252 HydrophobicContact CD1-CG2 4.21Å; L248-V252 HydrophobicContact CG-CG2 4.47Å; L248-V252 WeakPolarHBondContact O-CB 3.43Å; L248-V252 VanDerWaalsContact O-CG2 3.28Å; L248-V252 WeakPolarHBondContact O-CG2 3.37Å; L248-V252 PolarHBondContact O-N 2.88Å; R250-V252 VanDerWaalsContact C-N 3.28Å; R250-V252 PolarHBondContact O-N 2.85Å; V252-E254 VanDerWaalsContact C-N 3.32Å; V252-L256 HydrophobicContact CG2-CD2 4.12Å
253	K	83.8	Confident	86.5	Confident	181 Å²	181	75 Å²	75	79%	0.787	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-79.1	-17	174	-64.2	172.5	-175.7	173.5	0	113.1	S249 R250 L251	S249-K253 WeakPolarHBondContact O-CD 3.47Å; S249-K253 WeakPolarHBondContact O-CE 3.16Å; S249-K253 WeakPolarHBondContact O-CG 3.4Å; R250-K253 WeakPolarHBondContact O-CA 3.4Å; R250-K253 WeakPolarHBondContact O-CB 3.41Å; R250-K253 PolarHBondContact O-N 3.43Å; L251-K253 VanDerWaalsContact C-N 3.25Å; L251-K253 PolarHBondContact O-N 3.36Å
254	E	81.4	Confident	86.9	Confident	63 Å²	63	73.1 Å²	73.1	29%	0.294	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-90.8	2.6	175	-68.9	178.6	-179	0	0	112.9	V224 T225 H236 R250 L251 V252	V224-E254 HydrophobicContact CG1-CB 3.89Å; V224-E254 HydrophobicContact CG1-CG 4.48Å; V224-E254 WeakPolarHBondContact CG1-O 3.37Å; T225-E254 WeakPolarHBondContact CG2-O 3.34Å; H236-E254 IonicContact CE1-OE1 2.9Å; H236-E254 PolarHBondContact CE1-OE1 3.15Å; H236-E254 VanDerWaalsContact CE1-OE1 3.25Å; R250-E254 PolarHBondContact O-N 3.29Å; R250-E254 VanDerWaalsContact O-N 3.12Å; L251-E254 CarbonylContact O-C 3.59Å; L251-E254 WeakPolarHBondContact O-CA 3.21Å; L251-E254 WeakPolarHBondContact O-CB 3.14Å; L251-E254 PolarHBondContact O-N 2.73Å; V252-E254 VanDerWaalsContact C-N 3.32Å
255	G	83.1	Confident	87.1	Confident	44 Å²	44	77.4 Å²	77.4	45%	0.454	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	30.9	177.7	0	0	0	0	0	115	L251	L251-G255 PolarHBondContact O-N 3.1Å
256	L	84.9	Confident	87.4	Confident	20 Å²	20	72.7 Å²	72.7	11%	0.105	39%	0.387	C	S	.	.			trans	-59.5	130.3	173.4	176.9	135.7	0	0	0	112.4	L229 L248 L251 V252 E260 R261	L229-L256 HydrophobicContact CD1-CD1 3.45Å; L229-L256 VanDerWaalsContact CD1-CD1 3.45Å; L248-L256 HydrophobicContact CD1-CD2 4.35Å; L251-L256 HydrophobicContact CB-CB 4.07Å; L251-L256 HydrophobicContact CB-CD1 3.55Å; L251-L256 HydrophobicContact CB-CG 4.39Å; L251-L256 HydrophobicContact CD1-CD1 3.97Å; L251-L256 HydrophobicContact CG-CD1 4.35Å; L251-L256 WeakPolarHBondContact O-CB 3.35Å; L251-L256 PolarHBondContact O-N 2.79Å; L251-L256 VanDerWaalsContact O-N 3.1Å; V252-L256 HydrophobicContact CG2-CD2 4.12Å; L256-E260 HydrophobicContact CD1-CB 4.1Å; L256-E260 HydrophobicContact CD2-CB 4.39Å; L256-E260 HydrophobicContact CG-CB 3.77Å; L256-R261 HydrophobicContact CD2-CB 3.63Å; L256-R261 HydrophobicContact CD2-CG 4.1Å
257	S	84	Confident	87.6	Confident	49 Å²	49	70.8 Å²	70.8	34%	0.343	38%	0.379	S	S	.	.			trans	-74.6	172.3	-176.2	87.7	0	0	0	0	113.3	D259 E260 R261	S257-D259 PolarHBondContact OG-N 2.88Å; S257-E260 PolarHBondContact N-OE2 3.01Å; S257-E260 WeakPolarHBondContact OG-CG 3.44Å; S257-E260 PolarHBondContact OG-N 3.2Å; S257-R261 WeakPolarHBondContact O-CB 3.49Å; S257-R261 PolarHBondContact O-N 3.03Å
258	A	85.2	Confident	87.8	Confident	83 Å²	83	70.9 Å²	70.9	69%	0.686	38%	0.38	S	S	*	.	H	α-helix	trans	-63.6	-45.2	176	0	0	0	0	0	112.2	R261 Q262	A258-R261 VanDerWaalsContact O-CB 3.26Å; A258-R261 WeakPolarHBondContact O-CB 3.22Å; A258-R261 PolarHBondContact O-N 3.43Å; A258-R261 VanDerWaalsContact O-N 3.13Å; A258-Q262 PolarHBondContact O-N 3.12Å
259	D	86.8	Confident	87.8	Confident	113 Å²	113	73.8 Å²	73.8	60%	0.604	40%	0.395	S	S	*	.	H	α-helix	trans	-65.2	-45.1	179	-42.3	-56.7	0	0	0	110.5	S257 R261 Q262 N263	S257-D259 PolarHBondContact OG-N 2.88Å; D259-R261 PolarHBondContact O-N 3.49Å; D259-R261 VanDerWaalsContact O-N 3.16Å; D259-Q262 WeakPolarHBondContact O-CB 3.5Å; D259-Q262 PolarHBondContact O-N 2.96Å; D259-N263 PolarHBondContact O-N 2.96Å; D259-N263 PolarHBondContact O-OD1 2.79Å; D259-N263 VanDerWaalsContact O-OD1 3.04Å
260	E	89.5	Confident	88	Confident	38 Å²	38	73 Å²	73	18%	0.178	39%	0.393	C	S	.	.	H	α-helix	trans	-60.9	-26.4	174.9	-69.9	-171.7	121.9	0	0	113	L229 R232 L256 S257 F264	L229-E260 HydrophobicContact CB-CG 4.43Å; L229-E260 HydrophobicContact CD1-CB 4.4Å; L229-E260 HydrophobicContact CD2-CB 4.13Å; L229-E260 WeakPolarHBondContact CD2-O 3.39Å; R232-E260 IonicContact CZ-OE1 2.99Å; R232-E260 IonicContact CZ-OE2 2.68Å; R232-E260 IonicContact NH1-OE2 2.69Å; R232-E260 IonicContact NH2-OE1 3.72Å; R232-E260 PolarHBondContact NH2-OE1 2.9Å; R232-E260 IonicContact NH2-OE2 3.2Å; R232-E260 PolarHBondContact NH2-OE2 3.2Å; L256-E260 HydrophobicContact CD1-CB 4.1Å; L256-E260 HydrophobicContact CD2-CB 4.39Å; L256-E260 HydrophobicContact CG-CB 3.77Å; S257-E260 PolarHBondContact N-OE2 3.01Å; S257-E260 WeakPolarHBondContact OG-CG 3.44Å; S257-E260 PolarHBondContact OG-N 3.2Å; E260-F264 WeakPolarHBondContact O-CB 3.48Å; E260-F264 PolarHBondContact O-N 3.4Å
261	R	88.3	Confident	88.3	Confident	162 Å²	162	69.7 Å²	69.7	61%	0.611	38%	0.381	S	S	*	.	H	α-helix	trans	-71.6	-36.1	174.4	-165.1	176	176	-169.4	-4.9	112.2	L248 L256 S257 A258 D259	L248-R261 HydrophobicContact CD1-CG 4.32Å; L256-R261 HydrophobicContact CD2-CB 3.63Å; L256-R261 HydrophobicContact CD2-CG 4.1Å; S257-R261 WeakPolarHBondContact O-CB 3.49Å; S257-R261 PolarHBondContact O-N 3.03Å; A258-R261 VanDerWaalsContact O-CB 3.26Å; A258-R261 WeakPolarHBondContact O-CB 3.22Å; A258-R261 PolarHBondContact O-N 3.43Å; A258-R261 VanDerWaalsContact O-N 3.13Å; D259-R261 PolarHBondContact O-N 3.49Å; D259-R261 VanDerWaalsContact O-N 3.16Å
262	Q	89.3	Confident	88.2	Confident	161 Å²	161	69.9 Å²	69.9	75%	0.752	38%	0.382	S	S	*	.	H	α-helix	trans	-71.5	-39.7	174.2	-171.2	174.2	2.6	0	0	111.2	A258 D259 F264	A258-Q262 PolarHBondContact O-N 3.12Å; D259-Q262 WeakPolarHBondContact O-CB 3.5Å; D259-Q262 PolarHBondContact O-N 2.96Å; Q262-F264 VanDerWaalsContact C-N 3.28Å; Q262-F264 PolarHBondContact O-N 3.2Å
263	N	91	Very high	88	Confident	84 Å²	84	70.6 Å²	70.6	45%	0.449	38%	0.381	S	S	.	.	S	Bend	trans	-79.7	-2.1	177.8	-70.3	74.4	0	0	0	114.4	L229 D259 S266 T267	L229-N263 HydrophobicContact CD2-CB 3.97Å; D259-N263 PolarHBondContact O-N 2.96Å; D259-N263 PolarHBondContact O-OD1 2.79Å; D259-N263 VanDerWaalsContact O-OD1 3.04Å; N263-S266 PolarHBondContact O-OG 3.34Å; N263-T267 VanDerWaalsContact O-CB 3.24Å; N263-T267 WeakPolarHBondContact O-CB 3.34Å; N263-T267 PolarHBondContact O-N 2.91Å; N263-T267 VanDerWaalsContact O-N 3.09Å; N263-T267 PolarHBondContact O-OG1 2.85Å
264	F	92.1	Very high	87.7	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.009	37%	0.37	C	S	.	.	H	α-helix	trans	-64.7	-48.3	-176	172.6	-99.6	0	0	0	113.3	L229 V233 P244 L247 L248 L251 E260 Q262 T267 F268	L229-F264 HydrophobicContact CD1-CD2 4.4Å; V233-F264 HydrophobicContact CG2-CD2 4.3Å; V233-F264 HydrophobicContact CG2-CE2 4.06Å; P244-F264 HydrophobicContact CB-CE1 4.39Å; P244-F264 WeakPolarHBondContact O-CZ 3.32Å; L247-F264 HydrophobicContact CB-CE2 4.44Å; L247-F264 HydrophobicContact CB-CZ 4.09Å; L247-F264 HydrophobicContact CD2-CE2 3.93Å; L247-F264 HydrophobicContact CD2-CZ 4.08Å; L247-F264 HydrophobicContact CG-CE2 3.88Å; L247-F264 HydrophobicContact CG-CZ 4.02Å; L248-F264 HydrophobicContact CB-CD1 4.13Å; L248-F264 HydrophobicContact CB-CE1 3.77Å; L248-F264 HydrophobicContact CB-CZ 4Å; L248-F264 HydrophobicContact CD1-CB 4.21Å; L248-F264 HydrophobicContact CD1-CD1 3.89Å; L248-F264 HydrophobicContact CD1-CD2 4.27Å; L248-F264 HydrophobicContact CD1-CE1 4.39Å; L248-F264 HydrophobicContact CD1-CG 3.83Å; L248-F264 HydrophobicContact CD2-CD1 4.26Å; L248-F264 HydrophobicContact CG-CD1 4.32Å; L248-F264 HydrophobicContact CG-CE1 4.45Å; L251-F264 HydrophobicContact CD1-CD2 3.81Å; L251-F264 HydrophobicContact CD1-CE2 3.64Å; E260-F264 WeakPolarHBondContact O-CB 3.48Å; E260-F264 PolarHBondContact O-N 3.4Å; Q262-F264 VanDerWaalsContact C-N 3.28Å; Q262-F264 PolarHBondContact O-N 3.2Å; F264-T267 PolarHBondContact O-N 2.81Å; F264-F268 HydrophobicContact CE1-CB 4.38Å; F264-F268 HydrophobicContact CE2-CB 4.46Å; F264-F268 HydrophobicContact CE2-CD2 4.41Å; F264-F268 HydrophobicContact CZ-CB 4.2Å; F264-F268 AromaticContact CZ-CD2 3.93Å; F264-F268 HydrophobicContact CZ-CD2 3.93Å; F264-F268 HydrophobicContact CZ-CG 4.29Å; F264-F268 VanDerWaalsContact O-CB 3.23Å; F264-F268 WeakPolarHBondContact O-CB 3.27Å; F264-F268 PolarHBondContact O-N 3.21Å
265	E	90.9	Very high	87	Confident	139 Å²	139	69.3 Å²	69.3	65%	0.65	38%	0.381	S	S	*	.	H	α-helix	trans	-66.7	-44.8	-174.2	-64.4	-167.6	151.1	0	0	111.5	T267 F268 D269	E265-T267 PolarHBondContact O-N 2.78Å; E265-F268 WeakPolarHBondContact O-CB 3.39Å; E265-F268 PolarHBondContact O-N 3Å; E265-D269 PolarHBondContact O-N 2.9Å
266	S	92.1	Very high	85.8	Confident	73 Å²	73	73 Å²	73	51%	0.51	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-39.4	175.2	56.5	0	0	0	0	112.8	N263 A270	N263-S266 PolarHBondContact O-OG 3.34Å; S266-A270 WeakPolarHBondContact O-CB 3.22Å; S266-A270 PolarHBondContact O-N 3.28Å
267	T	92	Very high	84.6	Confident	23 Å²	23	80.9 Å²	80.9	14%	0.141	44%	0.437	C	S	.	.	H	α-helix	trans	-67.5	-38	174.4	-56.3	0	0	0	0	111.7	L229 R230 V233 N263 F264 E265 V271	L229-T267 HydrophobicContact CG-CG2 4.16Å; R230-T267 HydrophobicContact CB-CG2 3.91Å; R230-T267 HydrophobicContact CG-CG2 4.24Å; V233-T267 HydrophobicContact CG2-CG2 4.46Å; N263-T267 VanDerWaalsContact O-CB 3.24Å; N263-T267 WeakPolarHBondContact O-CB 3.34Å; N263-T267 PolarHBondContact O-N 2.91Å; N263-T267 VanDerWaalsContact O-N 3.09Å; N263-T267 PolarHBondContact O-OG1 2.85Å; F264-T267 PolarHBondContact O-N 2.81Å; E265-T267 PolarHBondContact O-N 2.78Å; T267-V271 WeakPolarHBondContact O-CB 3.43Å; T267-V271 VanDerWaalsContact O-CG2 3.27Å; T267-V271 WeakPolarHBondContact O-CG2 3.49Å; T267-V271 PolarHBondContact O-N 3.17Å
268	F	91.5	Very high	83.3	Confident	3 Å²	3	82.2 Å²	82.2	1%	0.013	44%	0.443	C	S	.	.	H	α-helix	trans	-64.7	-50.6	177.2	-177.2	-91.8	0	0	0	111	V233 L237 P244 L247 F264 E265 A270 V271 A272 N281	V233-F268 HydrophobicContact CG1-CD2 4.33Å; L237-F268 HydrophobicContact CD1-CD2 4.31Å; L237-F268 HydrophobicContact CD1-CE2 4.01Å; L237-F268 HydrophobicContact CD2-CE2 4.06Å; L237-F268 HydrophobicContact CG-CE2 4.47Å; P244-F268 HydrophobicContact CB-CD1 4.29Å; P244-F268 HydrophobicContact CB-CE1 4.06Å; P244-F268 HydrophobicContact CB-CE2 4.47Å; P244-F268 HydrophobicContact CB-CZ 4.13Å; P244-F268 HydrophobicContact CG-CD1 4.22Å; P244-F268 HydrophobicContact CG-CE1 3.6Å; P244-F268 HydrophobicContact CG-CZ 3.79Å; L247-F268 HydrophobicContact CD2-CD2 3.73Å; L247-F268 HydrophobicContact CD2-CE2 3.79Å; F264-F268 HydrophobicContact CE1-CB 4.38Å; F264-F268 HydrophobicContact CE2-CB 4.46Å; F264-F268 HydrophobicContact CE2-CD2 4.41Å; F264-F268 HydrophobicContact CZ-CB 4.2Å; F264-F268 AromaticContact CZ-CD2 3.93Å; F264-F268 HydrophobicContact CZ-CD2 3.93Å; F264-F268 HydrophobicContact CZ-CG 4.29Å; F264-F268 VanDerWaalsContact O-CB 3.23Å; F264-F268 WeakPolarHBondContact O-CB 3.27Å; F264-F268 PolarHBondContact O-N 3.21Å; E265-F268 WeakPolarHBondContact O-CB 3.39Å; E265-F268 PolarHBondContact O-N 3Å; F268-A270 VanDerWaalsContact C-N 3.28Å; F268-A270 PolarHBondContact O-N 2.98Å; F268-V271 CarbonylContact O-C 3.5Å; F268-V271 PolarHBondContact O-N 2.82Å; F268-A272 HydrophobicContact CD1-CB 3.87Å; F268-A272 HydrophobicContact CD2-CB 4.35Å; F268-A272 HydrophobicContact CE1-CB 3.52Å; F268-A272 HydrophobicContact CE2-CB 4.09Å; F268-A272 HydrophobicContact CG-CB 4.28Å; F268-A272 HydrophobicContact CZ-CB 3.67Å; F268-A272 WeakPolarHBondContact O-CB 3.27Å; F268-A272 PolarHBondContact O-N 3.07Å; F268-N281 WeakPolarHBondContact CE1-ND2 3.38Å; F268-N281 HydrophobicContact CZ-CB 4.06Å
269	D	89.6	Confident	81.9	Confident	99 Å²	99	83.9 Å²	83.9	53%	0.529	45%	0.449	S	S	.	.	H	α-helix	trans	-68.1	-28.1	-179.2	-72.7	-20.7	0	0	0	112.7	E265 V271 K284	E265-D269 PolarHBondContact O-N 2.9Å; D269-V271 VanDerWaalsContact C-N 3.31Å; D269-V271 PolarHBondContact O-N 2.83Å; D269-K284 WeakPolarHBondContact O-CE 3.36Å; D269-K284 PolarHBondContact O-NZ 3.22Å
270	A	90.7	Very high	80.7	Confident	50 Å²	50	80.7 Å²	80.7	41%	0.413	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-37.6	169.4	0	0	0	0	0	112.3	S266 F268 K284	S266-A270 WeakPolarHBondContact O-CB 3.22Å; S266-A270 PolarHBondContact O-N 3.28Å; F268-A270 VanDerWaalsContact C-N 3.28Å; F268-A270 PolarHBondContact O-N 2.98Å; A270-K284 WeakPolarHBondContact O-CD 3.33Å; A270-K284 VanDerWaalsContact O-CE 3.31Å; A270-K284 WeakPolarHBondContact O-CE 3.28Å; A270-K284 PolarHBondContact O-NZ 3.02Å
271	V	90.6	Very high	79.8	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-100.7	-28.2	-169.7	174.7	0	0	0	0	113.9	R230 V233 I234 L237 T267 F268 D269 L283 K284 C287	R230-V271 HydrophobicContact CG-CG2 4.11Å; V233-V271 HydrophobicContact CG1-CB 4.1Å; V233-V271 HydrophobicContact CG1-CG1 3.96Å; I234-V271 HydrophobicContact CB-CG1 4.43Å; I234-V271 HydrophobicContact CG1-CG1 3.52Å; I234-V271 HydrophobicContact CG1-CG2 4.11Å; L237-V271 HydrophobicContact CD1-CG1 4.13Å; T267-V271 WeakPolarHBondContact O-CB 3.43Å; T267-V271 VanDerWaalsContact O-CG2 3.27Å; T267-V271 WeakPolarHBondContact O-CG2 3.49Å; T267-V271 PolarHBondContact O-N 3.17Å; F268-V271 CarbonylContact O-C 3.5Å; F268-V271 PolarHBondContact O-N 2.82Å; D269-V271 VanDerWaalsContact C-N 3.31Å; D269-V271 PolarHBondContact O-N 2.83Å; V271-L283 HydrophobicContact CG1-CD1 3.26Å; V271-K284 WeakPolarHBondContact O-CG 3.34Å; V271-K284 PolarHBondContact O-N 3.18Å; V271-C287 HydrophobicContact CG1-CB 4.44Å
272	A	88	Confident	79.2	Confident	4 Å²	4	72.3 Å²	72.3	3%	0.033	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.1	-171.3	0	0	0	0	0	113.2	L237 F268 N281 G282 K284	L237-A272 HydrophobicContact CD1-CB 3.89Å; F268-A272 HydrophobicContact CD1-CB 3.87Å; F268-A272 HydrophobicContact CD2-CB 4.35Å; F268-A272 HydrophobicContact CE1-CB 3.52Å; F268-A272 HydrophobicContact CE2-CB 4.09Å; F268-A272 HydrophobicContact CG-CB 4.28Å; F268-A272 HydrophobicContact CZ-CB 3.67Å; F268-A272 WeakPolarHBondContact O-CB 3.27Å; F268-A272 PolarHBondContact O-N 3.07Å; A272-N281 HydrophobicContact CB-CB 4.33Å; A272-G282 CarbonylContact C-O 3.46Å; A272-G282 WeakPolarHBondContact CA-O 3.44Å; A272-K284 WeakPolarHBondContact O-CE 3.15Å
273	Q	83.9	Confident	79.1	Confident	92 Å²	92	64.7 Å²	64.7	43%	0.43	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	103.8	169.5	-169.5	177.9	37.8	0	0	108.9	K275 G282 K284	Q273-K275 PolarHBondContact O-N 3.16Å; Q273-G282 PolarHBondContact N-O 3.42Å; Q273-G282 PolarHBondContact O-N 3.05Å; Q273-K284 HydrophobicContact CB-CG 3.96Å
274	V	77.6	Confident	78.8	Confident	93 Å²	93	63.3 Å²	63.3	56%	0.564	36%	0.361	S	S	*	.			trans	-70.2	125.3	172	-175.5	0	0	0	0	109.1	N281	V274-N281 WeakPolarHBondContact CA-OD1 3.17Å
275	K	65.6	Low	78.4	Confident	123 Å²	123	67.3 Å²	67.3	54%	0.535	38%	0.38	S	S	.	.			trans	-103.2	114.1	171.6	-70.9	-175.5	176.4	-175.8	0	108.4	Q273 Q277 T278	Q273-K275 PolarHBondContact O-N 3.16Å; K275-Q277 PolarHBondContact O-N 3.47Å; K275-T278 PolarHBondContact O-N 3.22Å; K275-T278 VanDerWaalsContact O-N 3.16Å; K275-T278 VanDerWaalsContact O-O 3.13Å
276	S	58.9	Low	78.1	Confident	122 Å²	122	67.1 Å²	67.1	85%	0.853	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-11.7	-170.2	57.2	0	0	0	0	116.5
277	Q	59.1	Low	77.8	Confident	185 Å²	185	63.7 Å²	63.7	86%	0.864	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	1.8	-176.2	-66	-174.5	-24.9	0	0	115	K275	K275-Q277 PolarHBondContact O-N 3.47Å
278	T	55.9	Low	77.3	Confident	78 Å²	78	63.2 Å²	63.2	48%	0.479	35%	0.351	S	S	.	.	S	Bend	trans	-149.5	135.5	178.6	39	0	0	0	0	111.5	K275 S280	K275-T278 PolarHBondContact O-N 3.22Å; K275-T278 VanDerWaalsContact O-N 3.16Å; K275-T278 VanDerWaalsContact O-O 3.13Å; T278-S280 PolarHBondContact O-N 3.29Å
279	S	57.1	Low	76.9	Confident	117 Å²	117	68.2 Å²	68.2	82%	0.818	39%	0.386	S	S	*	.	S	Bend	trans	-69.8	16.4	-177.9	54.8	0	0	0	0	115.6
280	S	61.6	Low	76.7	Confident	46 Å²	46	66.9 Å²	66.9	32%	0.322	38%	0.377	S	S	.	.			trans	-115.6	96.7	-179	59.9	0	0	0	0	110.5	T278	T278-S280 PolarHBondContact O-N 3.29Å
281	N	69.1	Low	76.4	Confident	17 Å²	17	65.3 Å²	65.3	9%	0.091	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-72.8	136.1	176.4	-63.7	-16.2	0	0	0	109.7	S241 F268 A272 V274	S241-N281 WeakPolarHBondContact CA-O 3.27Å; S241-N281 WeakPolarHBondContact CB-O 3.19Å; F268-N281 WeakPolarHBondContact CE1-ND2 3.38Å; F268-N281 HydrophobicContact CZ-CB 4.06Å; A272-N281 HydrophobicContact CB-CB 4.33Å; V274-N281 WeakPolarHBondContact CA-OD1 3.17Å
282	G	77.7	Confident	75.9	Confident	8 Å²	8	67.7 Å²	67.7	8%	0.082	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	172.7	173.1	0	0	0	0	0	111.5	A272 Q273	A272-G282 CarbonylContact C-O 3.46Å; A272-G282 WeakPolarHBondContact CA-O 3.44Å; Q273-G282 PolarHBondContact N-O 3.42Å; Q273-G282 PolarHBondContact O-N 3.05Å
283	L	85.6	Confident	75	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	142.5	166.3	-177.9	59.8	0	0	0	110.7	I234 L237 L238 V271 C287 L288 V291 R313	I234-L283 HydrophobicContact CB-CD1 4.31Å; I234-L283 HydrophobicContact CG1-CD1 4.12Å; I234-L283 HydrophobicContact CG2-CD1 4.17Å; I234-L283 HydrophobicContact CG2-CD2 3.99Å; L237-L283 HydrophobicContact CB-CB 4.12Å; L238-L283 HydrophobicContact CB-CD2 4.12Å; L238-L283 HydrophobicContact CD1-CD2 4.07Å; V271-L283 HydrophobicContact CG1-CD1 3.26Å; L283-C287 HydrophobicContact CD1-CB 3.55Å; L283-C287 HydrophobicContact CG-CB 4.12Å; L283-L288 HydrophobicContact CD2-CD2 3.74Å; L283-L288 HydrophobicContact CD2-CG 4.47Å; L283-L288 HydrophobicContact CG-CD2 4.44Å; L283-V291 HydrophobicContact CD2-CG2 4.17Å; L283-R313 VanDerWaalsContact O-CZ 3.23Å; L283-R313 PolarHBondContact O-NH1 2.94Å; L283-R313 PolarHBondContact O-NH2 3.21Å
284	K	85.9	Confident	74.5	Confident	56 Å²	56	76.9 Å²	76.9	24%	0.243	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-67.2	152.4	170.5	-71.4	179.9	-164.7	170	0	111.1	D269 A270 V271 A272 Q273 Q286 C287	D269-K284 WeakPolarHBondContact O-CE 3.36Å; D269-K284 PolarHBondContact O-NZ 3.22Å; A270-K284 WeakPolarHBondContact O-CD 3.33Å; A270-K284 VanDerWaalsContact O-CE 3.31Å; A270-K284 WeakPolarHBondContact O-CE 3.28Å; A270-K284 PolarHBondContact O-NZ 3.02Å; V271-K284 WeakPolarHBondContact O-CG 3.34Å; V271-K284 PolarHBondContact O-N 3.18Å; A272-K284 WeakPolarHBondContact O-CE 3.15Å; Q273-K284 HydrophobicContact CB-CG 3.96Å; K284-Q286 VanDerWaalsContact C-N 3.33Å; K284-Q286 HydrophobicContact CB-CG 4.16Å; K284-Q286 PolarHBondContact O-N 3.24Å; K284-C287 PolarHBondContact O-N 3.4Å
285	Q	83.2	Confident	74.7	Confident	86 Å²	86	73 Å²	73	40%	0.402	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-60.2	-42.1	179.9	-168.7	71.9	7.5	0	0	112	C287 L288 R313	Q285-C287 PolarHBondContact O-N 2.95Å; Q285-C287 VanDerWaalsContact O-N 3.16Å; Q285-L288 VanDerWaalsContact CD-CD1 3.48Å; Q285-L288 HydrophobicContact CG-CD1 4.26Å; Q285-L288 WeakPolarHBondContact O-CB 3.31Å; Q285-L288 WeakPolarHBondContact O-CG 3.46Å; Q285-L288 PolarHBondContact O-N 2.87Å; Q285-L288 VanDerWaalsContact O-N 3.14Å; Q285-L288 VanDerWaalsContact OE1-CD1 3.3Å; Q285-R313 PolarHBondContact NE2-O 2.94Å
286	Q	84.6	Confident	75.3	Confident	135 Å²	135	69.3 Å²	69.3	63%	0.631	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-62.6	-19.2	-179.9	73.4	-167.5	16	0	0	114.7	K284 S289	K284-Q286 VanDerWaalsContact C-N 3.33Å; K284-Q286 HydrophobicContact CB-CG 4.16Å; K284-Q286 PolarHBondContact O-N 3.24Å; Q286-S289 PolarHBondContact O-OG 2.83Å
287	C	86	Confident	76.3	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.007	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-93.9	4	-179.9	-57.6	0	0	0	0	112.7	I234 V271 L283 K284 Q285	I234-C287 HydrophobicContact CG1-CB 4.41Å; V271-C287 HydrophobicContact CG1-CB 4.44Å; L283-C287 HydrophobicContact CD1-CB 3.55Å; L283-C287 HydrophobicContact CG-CB 4.12Å; K284-C287 PolarHBondContact O-N 3.4Å; Q285-C287 PolarHBondContact O-N 2.95Å; Q285-C287 VanDerWaalsContact O-N 3.16Å
288	L	81.8	Confident	77.4	Confident	13 Å²	13	58.6 Å²	58.6	7%	0.068	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-76.3	-26.9	178.2	-67.6	166.6	0	0	0	112.9	L238 L283 Q285 E290 V291 L310 R313	L238-L288 HydrophobicContact CD1-CD2 3.91Å; L283-L288 HydrophobicContact CD2-CD2 3.74Å; L283-L288 HydrophobicContact CD2-CG 4.47Å; L283-L288 HydrophobicContact CG-CD2 4.44Å; Q285-L288 VanDerWaalsContact CD-CD1 3.48Å; Q285-L288 HydrophobicContact CG-CD1 4.26Å; Q285-L288 WeakPolarHBondContact O-CB 3.31Å; Q285-L288 WeakPolarHBondContact O-CG 3.46Å; Q285-L288 PolarHBondContact O-N 2.87Å; Q285-L288 VanDerWaalsContact O-N 3.14Å; Q285-L288 VanDerWaalsContact OE1-CD1 3.3Å; L288-E290 PolarHBondContact O-N 3.37Å; L288-V291 WeakPolarHBondContact O-CB 3.45Å; L288-V291 PolarHBondContact O-N 3.39Å; L288-L310 HydrophobicContact CD2-CD2 4.05Å; L288-R313 HydrophobicContact CD1-CB 3.61Å; L288-R313 HydrophobicContact CD1-CG 4.35Å
289	S	82.9	Confident	78.6	Confident	107 Å²	107	57.4 Å²	57.4	75%	0.748	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-67.9	-15.6	173.5	45.8	0	0	0	0	113.6	Q286	Q286-S289 PolarHBondContact O-OG 2.83Å
290	E	84.1	Confident	79.5	Confident	72 Å²	72	56.6 Å²	56.6	34%	0.336	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-98.4	3	-179.3	-62.1	174.4	169.7	0	0	112.4	R230 I234 L288 S292	R230-E290 VanDerWaalsContact CZ-CD 3.44Å; R230-E290 IonicContact CZ-OE1 3.13Å; R230-E290 IonicContact CZ-OE2 3.24Å; R230-E290 IonicContact NE-OE2 3.2Å; R230-E290 IonicContact NH1-OE1 3.62Å; R230-E290 PolarHBondContact NH1-OE1 3.08Å; R230-E290 IonicContact NH1-OE2 2.69Å; R230-E290 PolarHBondContact NH1-OE2 3.14Å; R230-E290 IonicContact NH2-OE1 2.97Å; R230-E290 PolarHBondContact NH2-OE1 2.69Å; R230-E290 IonicContact NH2-OE2 3.19Å; R230-E290 PolarHBondContact NH2-OE2 3.36Å; I234-E290 HydrophobicContact CD1-CB 3.96Å; I234-E290 WeakPolarHBondContact CD1-OE2 3.15Å; L288-E290 PolarHBondContact O-N 3.37Å; E290-S292 PolarHBondContact O-N 3.06Å
291	V	85.2	Confident	80.3	Confident	16 Å²	16	60.5 Å²	60.5	10%	0.097	32%	0.321	C	S	.	.			trans	-76.5	115.7	176.5	175.5	0	0	0	0	109.1	I234 L238 L283 L288 D293 L310	I234-V291 HydrophobicContact CG2-CG2 3.81Å; L238-V291 HydrophobicContact CD1-CG2 4.47Å; L238-V291 HydrophobicContact CD2-CB 4.33Å; L238-V291 HydrophobicContact CD2-CG1 3.43Å; L238-V291 VanDerWaalsContact CD2-CG1 3.43Å; L238-V291 HydrophobicContact CD2-CG2 3.91Å; L283-V291 HydrophobicContact CD2-CG2 4.17Å; L288-V291 WeakPolarHBondContact O-CB 3.45Å; L288-V291 PolarHBondContact O-N 3.39Å; V291-D293 PolarHBondContact O-N 2.8Å; V291-L310 HydrophobicContact CB-CD2 4.14Å; V291-L310 HydrophobicContact CG1-CD1 4.05Å; V291-L310 HydrophobicContact CG1-CD2 4.14Å; V291-L310 HydrophobicContact CG1-CG 4.48Å; V291-L310 HydrophobicContact CG2-CD2 4.17Å
292	S	79.5	Confident	81.2	Confident	51 Å²	51	61.8 Å²	61.8	36%	0.357	33%	0.328	S	S	.	.			trans	-72.3	118.4	171.5	-178.6	0	0	0	0	111.6	H235 E290 E294 W295	H235-S292 PolarHBondContact CE1-N 2.7Å; H235-S292 PolarHBondContact CE1-O 3.02Å; H235-S292 VanDerWaalsContact CE1-O 3.31Å; H235-S292 PolarHBondContact NE2-N 2.95Å; H235-S292 VanDerWaalsContact NE2-N 3.1Å; E290-S292 PolarHBondContact O-N 3.06Å; S292-E294 PolarHBondContact O-N 2.9Å; S292-W295 PolarHBondContact O-N 2.91Å
293	D	69.6	Low	81.6	Confident	131 Å²	131	65.7 Å²	65.7	70%	0.701	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.7	177.8	-72	-46.3	0	0	0	113.5	V291	V291-D293 PolarHBondContact O-N 2.8Å
294	E	73.1	Confident	81.5	Confident	158 Å²	158	70.1 Å²	70.1	74%	0.738	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	21.4	-178	-64.1	-157.8	159.5	0	0	114.3	S292 P296	S292-E294 PolarHBondContact O-N 2.9Å; E294-P296 WeakPolarHBondContact O-CD 3.47Å
295	W	82.7	Confident	81.5	Confident	10 Å²	10	69 Å²	69	4%	0.038	36%	0.359	C	S	.	.			trans	-44.3	108.5	-176.7	-169.7	-104.4	0	0	0	113.1	K227 E231 R232 H235 S292 F297 Y298 R303	K227-W295 HydrophobicContact CB-CH2 3.72Å; K227-W295 HydrophobicContact CB-CZ2 4.36Å; K227-W295 HydrophobicContact CD-CH2 3.44Å; K227-W295 VanDerWaalsContact CD-CH2 3.44Å; K227-W295 HydrophobicContact CD-CZ2 3.76Å; K227-W295 HydrophobicContact CD-CZ3 3.88Å; K227-W295 HydrophobicContact CG-CH2 3.5Å; K227-W295 HydrophobicContact CG-CZ2 4.26Å; K227-W295 HydrophobicContact CG-CZ3 3.91Å; E231-W295 HydrophobicContact CB-CH2 3.57Å; E231-W295 HydrophobicContact CB-CZ3 3.74Å; E231-W295 HydrophobicContact CG-CZ3 4.4Å; R232-W295 HydrophobicContact CG-CH2 4.47Å; R232-W295 HydrophobicContact CG-CZ2 4.29Å; H235-W295 HydrophobicContact CB-CD2 4.06Å; H235-W295 HydrophobicContact CB-CG 4.3Å; H235-W295 HydrophobicContact CB-CZ2 4.16Å; H235-W295 AromaticContact CD2-CD2 3.41Å; H235-W295 VanDerWaalsContact CD2-CD2 3.41Å; H235-W295 AromaticContact CD2-CE2 3.85Å; H235-W295 AromaticContact CD2-CE3 3.11Å; H235-W295 AromaticContact CD2-CH2 3.75Å; H235-W295 AromaticContact CD2-CZ3 3.27Å; H235-W295 WeakPolarHBondContact CD2-CZ3 3.48Å; H235-W295 AromaticContact CE1-CD2 3.85Å; H235-W295 AromaticContact CE1-CE3 3.73Å; H235-W295 AromaticContact CE1-CG 3.83Å; H235-W295 AromaticContact CG-CD2 3.43Å; H235-W295 VanDerWaalsContact CG-CD2 3.43Å; H235-W295 AromaticContact CG-CE2 3.71Å; H235-W295 AromaticContact CG-CE3 3.69Å; H235-W295 AromaticContact CG-CG 3.71Å; H235-W295 AromaticContact ND1-CD2 3.72Å; H235-W295 AromaticContact ND1-CG 3.55Å; H235-W295 AromaticContact NE2-CD2 3.68Å; H235-W295 AromaticContact NE2-CE3 3.15Å; H235-W295 AromaticContact NE2-CZ3 3.63Å; S292-W295 PolarHBondContact O-N 2.91Å; W295-F297 HydrophobicContact CZ2-CD2 4.46Å; W295-F297 PolarHBondContact O-N 2.96Å; W295-F297 VanDerWaalsContact O-N 3.12Å; W295-Y298 HydrophobicContact CB-CD2 3.68Å; W295-Y298 HydrophobicContact CB-CE2 3.8Å; W295-Y298 HydrophobicContact CB-CG 4.17Å; W295-Y298 AromaticContact CD1-CD1 3.65Å; W295-Y298 AromaticContact CD1-CE1 3.83Å; W295-Y298 AromaticContact CD1-CG 3.82Å; W295-Y298 HydrophobicContact CG-CD1 4.5Å; W295-Y298 HydrophobicContact CG-CD2 4.28Å; W295-Y298 HydrophobicContact CG-CE2 4.31Å; W295-Y298 HydrophobicContact CG-CG 4.39Å; W295-Y298 PolarHBondContact O-N 3.39Å; W295-Y298 VanDerWaalsContact O-N 3.17Å; W295-R303 PolarHBondContact O-NH1 2.96Å; W295-R303 PolarHBondContact O-NH2 3.47Å; W295-R303 VanDerWaalsContact O-NH2 3.15Å
296	P	76.8	Confident	81.7	Confident	46 Å²	46	65.1 Å²	65.1	30%	0.299	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-25.4	-162.8	-26.6	35.9	0	0	0	114.2	L222 E294 Y298 R303	L222-P296 HydrophobicContact CD1-CB 3.53Å; L222-P296 HydrophobicContact CD1-CG 4.48Å; L222-P296 HydrophobicContact CD2-CB 3.6Å; L222-P296 HydrophobicContact CD2-CG 3.77Å; L222-P296 HydrophobicContact CG-CB 4.17Å; E294-P296 WeakPolarHBondContact O-CD 3.47Å; P296-Y298 VanDerWaalsContact C-N 3.32Å; P296-Y298 PolarHBondContact O-N 3.42Å; P296-R303 PolarHBondContact O-NH2 3.3Å
297	F	80.4	Confident	81.7	Confident	67 Å²	67	66 Å²	66	29%	0.294	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.1	-177	-55.1	-80.5	0	0	0	114	L222 D223 V224 K227 W295	L222-F297 HydrophobicContact CB-CE1 3.99Å; L222-F297 HydrophobicContact CB-CZ 3.84Å; L222-F297 HydrophobicContact CD2-CZ 4.38Å; L222-F297 WeakPolarHBondContact O-CE1 3.41Å; D223-F297 VanDerWaalsContact C-CZ 3.46Å; V224-F297 VanDerWaalsContact CA-CZ 3.43Å; V224-F297 HydrophobicContact CB-CD1 3.88Å; V224-F297 HydrophobicContact CB-CD2 4.33Å; V224-F297 HydrophobicContact CB-CE1 3.7Å; V224-F297 HydrophobicContact CB-CE2 4.18Å; V224-F297 HydrophobicContact CB-CG 4.2Å; V224-F297 HydrophobicContact CB-CZ 3.87Å; V224-F297 HydrophobicContact CG2-CD1 4.19Å; V224-F297 HydrophobicContact CG2-CD2 4.02Å; V224-F297 HydrophobicContact CG2-CE1 4.39Å; V224-F297 HydrophobicContact CG2-CE2 4.24Å; V224-F297 HydrophobicContact CG2-CG 4Å; V224-F297 HydrophobicContact CG2-CZ 4.42Å; K227-F297 HydrophobicContact CD-CD2 4.03Å; K227-F297 HydrophobicContact CD-CE2 3.55Å; W295-F297 HydrophobicContact CZ2-CD2 4.46Å; W295-F297 PolarHBondContact O-N 2.96Å; W295-F297 VanDerWaalsContact O-N 3.12Å
298	Y	83.1	Confident	81.7	Confident	16 Å²	16	72.4 Å²	72.4	6%	0.063	37%	0.368	C	S	.	.			trans	-75.2	126.3	170.2	-73.7	-25.1	0	0	0	111.2	H235 I239 W295 P296 D302 R303 A306	H235-Y298 WeakPolarHBondContact CA-OH 3.29Å; H235-Y298 HydrophobicContact CB-CE1 4.11Å; H235-Y298 WeakPolarHBondContact CB-OH 3.34Å; H235-Y298 AromaticContact ND1-CE2 3.55Å; H235-Y298 AromaticContact ND1-CZ 3.26Å; H235-Y298 VanDerWaalsContact ND1-CZ 3.26Å; H235-Y298 PolarHBondContact ND1-OH 3.05Å; H235-Y298 WeakPolarHBondContact O-CE1 3.44Å; H235-Y298 PolarHBondContact O-OH 3.06Å; I239-Y298 HydrophobicContact CD1-CD1 4.33Å; I239-Y298 HydrophobicContact CD1-CE1 3.99Å; I239-Y298 HydrophobicContact CG1-CE1 4.41Å; I239-Y298 HydrophobicContact CG2-CD1 4.22Å; I239-Y298 HydrophobicContact CG2-CE1 3.52Å; I239-Y298 HydrophobicContact CG2-CE2 4.42Å; W295-Y298 HydrophobicContact CB-CD2 3.68Å; W295-Y298 HydrophobicContact CB-CE2 3.8Å; W295-Y298 HydrophobicContact CB-CG 4.17Å; W295-Y298 AromaticContact CD1-CD1 3.65Å; W295-Y298 AromaticContact CD1-CE1 3.83Å; W295-Y298 AromaticContact CD1-CG 3.82Å; W295-Y298 HydrophobicContact CG-CD1 4.5Å; W295-Y298 HydrophobicContact CG-CD2 4.28Å; W295-Y298 HydrophobicContact CG-CE2 4.31Å; W295-Y298 HydrophobicContact CG-CG 4.39Å; W295-Y298 PolarHBondContact O-N 3.39Å; W295-Y298 VanDerWaalsContact O-N 3.17Å; P296-Y298 VanDerWaalsContact C-N 3.32Å; P296-Y298 PolarHBondContact O-N 3.42Å; Y298-D302 HydrophobicContact CD1-CB 3.84Å; Y298-D302 HydrophobicContact CG-CB 4.04Å; Y298-R303 VanDerWaalsContact CB-CG 3.46Å; Y298-R303 HydrophobicContact CD2-CG 4.21Å; Y298-R303 HydrophobicContact CG-CG 4.33Å; Y298-R303 PolarHBondContact O-NE 3.24Å; Y298-R303 PolarHBondContact O-NH2 2.91Å; Y298-A306 HydrophobicContact CD2-CB 4.17Å; Y298-A306 HydrophobicContact CE2-CB 3.54Å
299	S	80.3	Confident	81.8	Confident	52 Å²	52	72.8 Å²	72.8	36%	0.364	37%	0.372	S	S	.	.			trans	-60.9	164	164.9	75.1	0	0	0	0	110.7	W301 D302 R303	S299-W301 PolarHBondContact O-N 3.27Å; S299-W301 VanDerWaalsContact O-N 3.15Å; S299-W301 PolarHBondContact OG-N 3.48Å; S299-D302 VanDerWaalsContact CB-OD2 3.26Å; S299-D302 WeakPolarHBondContact CB-OD2 3.47Å; S299-D302 PolarHBondContact N-OD2 2.82Å; S299-D302 PolarHBondContact O-N 2.75Å; S299-D302 PolarHBondContact OG-N 3.22Å; S299-D302 VanDerWaalsContact OG-N 3.13Å; S299-D302 PolarHBondContact OG-OD2 2.82Å; S299-R303 WeakPolarHBondContact O-CG 3.17Å; S299-R303 PolarHBondContact O-N 3.21Å
300	S	77.1	Confident	81.8	Confident	100 Å²	100	68.9 Å²	68.9	70%	0.699	34%	0.343	S	S	*	.	H	α-helix	trans	-55.3	-32.7	175.5	54.2	0	0	0	0	112.7	Q304	S300-Q304 WeakPolarHBondContact O-CG 3.4Å
301	W	77.9	Confident	81.7	Confident	129 Å²	129	68.3 Å²	68.3	49%	0.489	35%	0.351	S	S	.	.	H	α-helix	trans	-71.1	-46.6	172.6	179.3	-104.7	0	0	0	112.5	S299 R303 Q304 V305	S299-W301 PolarHBondContact O-N 3.27Å; S299-W301 VanDerWaalsContact O-N 3.15Å; S299-W301 PolarHBondContact OG-N 3.48Å; W301-R303 VanDerWaalsContact C-N 3.31Å; W301-R303 PolarHBondContact O-N 3.32Å; W301-Q304 WeakPolarHBondContact O-CA 3.5Å; W301-Q304 WeakPolarHBondContact O-CB 3.37Å; W301-Q304 PolarHBondContact O-N 2.75Å; W301-V305 HydrophobicContact CZ2-CG2 4.48Å; W301-V305 WeakPolarHBondContact O-CG2 3.5Å; W301-V305 PolarHBondContact O-N 3.46Å
302	D	88.3	Confident	81.5	Confident	44 Å²	44	70.2 Å²	70.2	24%	0.235	37%	0.368	C	S	.	.	H	α-helix	trans	-64.5	-35.8	-177.9	-58.5	-45.9	0	0	0	111.7	I239 Y298 S299 Q304 V305 A306	I239-D302 HydrophobicContact CD1-CB 4.18Å; I239-D302 HydrophobicContact CG2-CB 4.28Å; Y298-D302 HydrophobicContact CD1-CB 3.84Å; Y298-D302 HydrophobicContact CG-CB 4.04Å; S299-D302 VanDerWaalsContact CB-OD2 3.26Å; S299-D302 WeakPolarHBondContact CB-OD2 3.47Å; S299-D302 PolarHBondContact N-OD2 2.82Å; S299-D302 PolarHBondContact O-N 2.75Å; S299-D302 PolarHBondContact OG-N 3.22Å; S299-D302 VanDerWaalsContact OG-N 3.13Å; S299-D302 PolarHBondContact OG-OD2 2.82Å; D302-Q304 VanDerWaalsContact C-N 3.3Å; D302-Q304 PolarHBondContact O-N 3.24Å; D302-V305 PolarHBondContact O-N 3.36Å; D302-V305 VanDerWaalsContact O-N 3.08Å; D302-A306 WeakPolarHBondContact O-CB 3.21Å; D302-A306 PolarHBondContact O-N 2.91Å
303	R	85.8	Confident	81.4	Confident	89 Å²	89	70.1 Å²	70.1	34%	0.336	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-40.7	171.6	-65.3	-179.3	-164.9	-107	-0.8	111.7	W295 P296 Y298 S299 W301 V305 K307	W295-R303 PolarHBondContact O-NH1 2.96Å; W295-R303 PolarHBondContact O-NH2 3.47Å; W295-R303 VanDerWaalsContact O-NH2 3.15Å; P296-R303 PolarHBondContact O-NH2 3.3Å; Y298-R303 VanDerWaalsContact CB-CG 3.46Å; Y298-R303 HydrophobicContact CD2-CG 4.21Å; Y298-R303 HydrophobicContact CG-CG 4.33Å; Y298-R303 PolarHBondContact O-NE 3.24Å; Y298-R303 PolarHBondContact O-NH2 2.91Å; S299-R303 WeakPolarHBondContact O-CG 3.17Å; S299-R303 PolarHBondContact O-N 3.21Å; W301-R303 VanDerWaalsContact C-N 3.31Å; W301-R303 PolarHBondContact O-N 3.32Å; R303-V305 VanDerWaalsContact C-N 3.34Å; R303-K307 WeakPolarHBondContact O-CB 3.31Å; R303-K307 WeakPolarHBondContact O-CG 3.39Å; R303-K307 PolarHBondContact O-N 3.3Å
304	Q	83.7	Confident	81.5	Confident	93 Å²	93	69.2 Å²	69.2	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-69.8	-29.6	175.2	-66.9	177.2	4.8	0	0	112.8	S300 W301 D302 R308	S300-Q304 WeakPolarHBondContact O-CG 3.4Å; W301-Q304 WeakPolarHBondContact O-CA 3.5Å; W301-Q304 WeakPolarHBondContact O-CB 3.37Å; W301-Q304 PolarHBondContact O-N 2.75Å; D302-Q304 VanDerWaalsContact C-N 3.3Å; D302-Q304 PolarHBondContact O-N 3.24Å; Q304-R308 WeakPolarHBondContact O-CG 3.06Å; Q304-R308 PolarHBondContact O-N 2.96Å; Q304-R308 PolarHBondContact O-NE 3Å
305	V	85.9	Confident	81.1	Confident	32 Å²	32	65.7 Å²	65.7	19%	0.194	35%	0.347	C	S	.	.	H	α-helix	trans	-73.8	-46.7	174.4	179.8	0	0	0	0	110.2	I239 W301 D302 R303 R308 A309	I239-V305 HydrophobicContact CB-CG1 4.24Å; I239-V305 WeakPolarHBondContact O-CG1 3.24Å; W301-V305 HydrophobicContact CZ2-CG2 4.48Å; W301-V305 WeakPolarHBondContact O-CG2 3.5Å; W301-V305 PolarHBondContact O-N 3.46Å; D302-V305 PolarHBondContact O-N 3.36Å; D302-V305 VanDerWaalsContact O-N 3.08Å; R303-V305 VanDerWaalsContact C-N 3.34Å; V305-R308 PolarHBondContact O-N 2.64Å; V305-A309 WeakPolarHBondContact O-CB 3.41Å; V305-A309 PolarHBondContact O-N 3.3Å
306	A	86	Confident	79.9	Confident	6 Å²	6	71.6 Å²	71.6	5%	0.05	38%	0.379	C	S	.	.	H	α-helix	trans	-57.2	-51	176.1	0	0	0	0	0	112	L238 I239 Y298 D302 R308 A309 L310	L238-A306 HydrophobicContact CD2-CB 3.74Å; L238-A306 HydrophobicContact CG-CB 4.42Å; I239-A306 HydrophobicContact CG2-CB 4.02Å; Y298-A306 HydrophobicContact CD2-CB 4.17Å; Y298-A306 HydrophobicContact CE2-CB 3.54Å; D302-A306 WeakPolarHBondContact O-CB 3.21Å; D302-A306 PolarHBondContact O-N 2.91Å; A306-R308 VanDerWaalsContact C-N 3.31Å; A306-R308 PolarHBondContact O-N 3.15Å; A306-A309 PolarHBondContact O-N 2.82Å; A306-A309 VanDerWaalsContact O-N 3.1Å; A306-L310 WeakPolarHBondContact O-CG 3.18Å; A306-L310 PolarHBondContact O-N 2.88Å
307	K	85.4	Confident	78.6	Confident	153 Å²	153	72 Å²	72	67%	0.665	39%	0.391	S	S	*	.	H	α-helix	trans	-56.1	-42.7	176	-76	-171.4	174.8	-165.7	0	112.6	R303 A311	R303-K307 WeakPolarHBondContact O-CB 3.31Å; R303-K307 WeakPolarHBondContact O-CG 3.39Å; R303-K307 PolarHBondContact O-N 3.3Å; K307-A311 WeakPolarHBondContact O-CB 3.32Å; K307-A311 PolarHBondContact O-N 2.94Å; K307-A311 VanDerWaalsContact O-N 3.07Å
308	R	85.3	Confident	76.8	Confident	136 Å²	136	74.3 Å²	74.3	51%	0.513	42%	0.415	S	S	.	.	H	α-helix	trans	-67.7	-38.9	175.8	-79.4	178.9	-74.1	153.4	-8	112.8	Q304 V305 A306 A312	Q304-R308 WeakPolarHBondContact O-CG 3.06Å; Q304-R308 PolarHBondContact O-N 2.96Å; Q304-R308 PolarHBondContact O-NE 3Å; V305-R308 PolarHBondContact O-N 2.64Å; A306-R308 VanDerWaalsContact C-N 3.31Å; A306-R308 PolarHBondContact O-N 3.15Å; R308-A312 VanDerWaalsContact O-CB 3.29Å; R308-A312 WeakPolarHBondContact O-CB 3.21Å; R308-A312 PolarHBondContact O-N 3.38Å
309	A	83.7	Confident	74.7	Confident	20 Å²	20	82.9 Å²	82.9	17%	0.165	45%	0.453	C	S	.	.	H	α-helix	trans	-66.4	-41.5	178.1	0	0	0	0	0	111.8	L238 V305 A306 R313	L238-A309 HydrophobicContact CD1-CB 3.76Å; L238-A309 HydrophobicContact CG-CB 4.14Å; V305-A309 WeakPolarHBondContact O-CB 3.41Å; V305-A309 PolarHBondContact O-N 3.3Å; A306-A309 PolarHBondContact O-N 2.82Å; A306-A309 VanDerWaalsContact O-N 3.1Å; A309-R313 WeakPolarHBondContact O-CB 3.26Å; A309-R313 VanDerWaalsContact O-CD 3.27Å; A309-R313 WeakPolarHBondContact O-CD 3.48Å; A309-R313 VanDerWaalsContact O-CG 3.25Å; A309-R313 WeakPolarHBondContact O-CG 3.32Å; A309-R313 PolarHBondContact O-N 3.46Å
310	L	83.9	Confident	72.6	Confident	25 Å²	25	91.7 Å²	91.7	13%	0.131	48%	0.478	C	S	.	.	H	α-helix	trans	-61	-54.5	173.2	-70.7	171.4	0	0	0	111.2	L238 L288 V291 A306 A312 R313 L314	L238-L310 HydrophobicContact CD1-CD2 4.22Å; L238-L310 HydrophobicContact CD1-CG 4.38Å; L238-L310 HydrophobicContact CD2-CD2 4.48Å; L238-L310 HydrophobicContact CD2-CG 4.33Å; L288-L310 HydrophobicContact CD2-CD2 4.05Å; V291-L310 HydrophobicContact CB-CD2 4.14Å; V291-L310 HydrophobicContact CG1-CD1 4.05Å; V291-L310 HydrophobicContact CG1-CD2 4.14Å; V291-L310 HydrophobicContact CG1-CG 4.48Å; V291-L310 HydrophobicContact CG2-CD2 4.17Å; A306-L310 WeakPolarHBondContact O-CG 3.18Å; A306-L310 PolarHBondContact O-N 2.88Å; L310-A312 VanDerWaalsContact C-N 3.31Å; L310-A312 PolarHBondContact O-N 2.92Å; L310-R313 PolarHBondContact O-N 3.07Å; L310-L314 WeakPolarHBondContact O-CG 3.1Å; L310-L314 PolarHBondContact O-N 3.28Å
311	A	83.1	Confident	70.5	Confident	61 Å²	61	95.9 Å²	95.9	50%	0.504	49%	0.487	S	S	.	.	H	α-helix	trans	-56.8	-41.8	-180	0	0	0	0	0	113	K307 R313 S315	K307-A311 WeakPolarHBondContact O-CB 3.32Å; K307-A311 PolarHBondContact O-N 2.94Å; K307-A311 VanDerWaalsContact O-N 3.07Å; A311-R313 VanDerWaalsContact C-N 3.27Å; A311-R313 PolarHBondContact O-N 3.46Å; A311-S315 WeakPolarHBondContact O-CB 3.21Å; A311-S315 PolarHBondContact O-N 3.49Å; A311-S315 PolarHBondContact O-OG 2.97Å
312	A	80.8	Confident	68.2	Low	55 Å²	55	97.1 Å²	97.1	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-69.1	-19.8	177.7	0	0	0	0	0	114.2	R308 L310 S315 L316	R308-A312 VanDerWaalsContact O-CB 3.29Å; R308-A312 WeakPolarHBondContact O-CB 3.21Å; R308-A312 PolarHBondContact O-N 3.38Å; L310-A312 VanDerWaalsContact C-N 3.31Å; L310-A312 PolarHBondContact O-N 2.92Å; A312-S315 PolarHBondContact O-OG 3.29Å; A312-L316 WeakPolarHBondContact O-CD1 3.47Å
313	R	76.3	Confident	65.5	Low	49 Å²	49	101.2 Å²	101.2	19%	0.185	53%	0.534	C	S	.	.	H	α-helix	trans	-102.7	-31.6	-177	-73.4	166.5	153.3	-113	-3.3	113.4	L283 Q285 L288 A309 L310 A311 L316	L283-R313 VanDerWaalsContact O-CZ 3.23Å; L283-R313 PolarHBondContact O-NH1 2.94Å; L283-R313 PolarHBondContact O-NH2 3.21Å; Q285-R313 PolarHBondContact NE2-O 2.94Å; L288-R313 HydrophobicContact CD1-CB 3.61Å; L288-R313 HydrophobicContact CD1-CG 4.35Å; A309-R313 WeakPolarHBondContact O-CB 3.26Å; A309-R313 VanDerWaalsContact O-CD 3.27Å; A309-R313 WeakPolarHBondContact O-CD 3.48Å; A309-R313 VanDerWaalsContact O-CG 3.25Å; A309-R313 WeakPolarHBondContact O-CG 3.32Å; A309-R313 PolarHBondContact O-N 3.46Å; L310-R313 PolarHBondContact O-N 3.07Å; A311-R313 VanDerWaalsContact C-N 3.27Å; A311-R313 PolarHBondContact O-N 3.46Å; R313-L316 PolarHBondContact O-N 3.32Å
314	L	71.7	Confident	63.1	Low	113 Å²	113	102.8 Å²	102.8	59%	0.592	55%	0.553	S	S	*	*	H	α-helix	trans	-66.8	-40.7	171.8	-66.9	171.9	0	0	0	110.7	L310 L316 G317	L310-L314 WeakPolarHBondContact O-CG 3.1Å; L310-L314 PolarHBondContact O-N 3.28Å; L314-L316 PolarHBondContact O-N 2.94Å; L314-G317 PolarHBondContact O-N 3.4Å; L314-G317 VanDerWaalsContact O-N 3.13Å
315	S	65.2	Low	60.6	Low	84 Å²	84	105.6 Å²	105.6	59%	0.587	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-20.5	175.5	49.5	0	0	0	0	114.8	A311 A312	A311-S315 WeakPolarHBondContact O-CB 3.21Å; A311-S315 PolarHBondContact O-N 3.49Å; A311-S315 PolarHBondContact O-OG 2.97Å; A312-S315 PolarHBondContact O-OG 3.29Å
316	L	57.4	Low	58.3	Low	134 Å²	134	110.5 Å²	110.5	70%	0.702	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-15.6	175.1	-81.7	166.1	0	0	0	113.9	A312 R313 L314	A312-L316 WeakPolarHBondContact O-CD1 3.47Å; R313-L316 PolarHBondContact O-N 3.32Å; L314-L316 PolarHBondContact O-N 2.94Å
317	G	49.1	Very low	55.7	Low	53 Å²	53	115.5 Å²	115.5	55%	0.546	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.7	-30.6	-176.7	0	0	0	0	0	114.6	L314 K319	L314-G317 PolarHBondContact O-N 3.4Å; L314-G317 VanDerWaalsContact O-N 3.13Å; G317-K319 VanDerWaalsContact C-N 3.35Å; G317-K319 PolarHBondContact O-N 2.92Å
318	S	43.5	Very low	53.4	Low	116 Å²	116	116 Å²	116	81%	0.811	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	22.1	-164.5	-163.7	0	0	0	0	115.5
319	K	39.4	Very low	50.9	Low	197 Å²	197	117.1 Å²	117.1	86%	0.857	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.4	30.7	-172.8	-147.5	-177.1	-175.9	-179.5	0	115	G317	G317-K319 VanDerWaalsContact C-N 3.35Å; G317-K319 PolarHBondContact O-N 2.92Å
320	R	34.4	Very low	48.7	Very low	237 Å²	237	123.7 Å²	123.7	89%	0.894	68%	0.682	S	S	*	*			trans	-145.5	55.8	-177.8	-150.4	178.8	-169.8	-175.4	1.5	115.1
321	E	33.1	Very low	46.4	Very low	187 Å²	187	128.2 Å²	128.2	87%	0.874	71%	0.711	S	S	*	*			trans	-123.4	156.9	157.9	-65.4	-175.4	167.8	0	0	108.4
322	N	31.2	Very low	44.1	Very low	155 Å²	155	130.9 Å²	130.9	83%	0.829	72%	0.723	S	S	*	*	S	Bend	trans	63.4	92.1	-169.4	-69.6	7	0	0	0	116.7
323	C	31.3	Very low	42.1	Very low	131 Å²	131	137.7 Å²	137.7	89%	0.885	74%	0.742	S	S	*	*				166.7	116.5	102.7	-86.8	0	0	0	0	110.9
324	T	34.4	Very low	40.3	Very low	122 Å²	122	143.5 Å²	143.5	75%	0.748	77%	0.769	S	S	*	*			trans	-119	136.3	176.2	41.3	0	0	0	0	110.7
325	N	31.8	Very low	38.8	Very low	152 Å²	152	144.7 Å²	144.7	81%	0.813	77%	0.772	S	S	*	*			trans	69.2	142.6	173.7	-44.2	-40.1	0	0	0	113.3
326	V	36.8	Very low	37.4	Very low	134 Å²	134	148.2 Å²	148.2	81%	0.812	78%	0.779	S	S	*	*			cis	-145.3	149.7	27.7	-169.8	0	0	0	0	110.4
327	P	30.9	Very low	36.6	Very low	111 Å²	111	146.6 Å²	146.6	72%	0.721	78%	0.779	S	S	*	*			trans	-119	129.3	174.2	36.6	-24.2	0	0	0	115.4
328	L	37.4	Very low	36.1	Very low	164 Å²	164	153.2 Å²	153.2	86%	0.859	79%	0.792	S	S	*	*			trans	-162.6	115.2	155.4	-98.7	125.3	0	0	0	107.7
329	E	34	Very low	35.8	Very low	159 Å²	159	157.4 Å²	157.4	74%	0.743	80%	0.796	S	S	*	*				77.4	109.5	84.1	-116.8	-97.6	112.2	0	0	114
330	M	36.4	Very low	35.8	Very low	158 Å²	158	154.1 Å²	154.1	78%	0.778	80%	0.798	S	S	*	*				164	116.8	125.2	-86	178.5	74.7	0	0	114.7
331	V	35.4	Very low	35.9	Very low	120 Å²	120	153.1 Å²	153.1	73%	0.727	79%	0.794	S	S	*	*			trans	56.7	124.5	139.4	-168.8	0	0	0	0	122.4
332	P	36.5	Very low	36.1	Very low	118 Å²	118	149.8 Å²	149.8	77%	0.766	79%	0.789	S	S	*	*			trans	-107.3	163.8	169.7	40.1	-33.1	0	0	0	114.9
333	K	38.8	Very low	36.3	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	78%	0.782	S	S	*	*			trans	-163.9	135.7	160.2	-114	169	-174.1	175.5	0	113.6
334	K	38.3	Very low	36.4	Very low	170 Å²	170	146.3 Å²	146.3	74%	0.739	78%	0.779	S	S	*	*			trans	38.2	149.6	143.6	-72	-174.9	158.8	-146.8	0	120.9
335	E	39.7	Very low	36.2	Very low	139 Å²	139	144 Å²	144	65%	0.65	78%	0.779	S	S	*	*			cis	-158.3	151.3	9	-131.4	157.3	-158.6	0	0	113.4
336	E	34.8	Very low	36.5	Very low	157 Å²	157	142.9 Å²	142.9	73%	0.734	78%	0.784	S	S	*	*			trans	21.2	113.8	143	-154.7	166.9	-156.5	0	0	123.3
337	S	40.6	Very low	36.2	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	79%	0.786	S	S	*	*				170.3	118.8	115.6	-83.7	0	0	0	0	117.6
338	K	40.4	Very low	36.4	Very low	192 Å²	192	141 Å²	141	84%	0.835	79%	0.792	S	S	*	*			trans	39.9	114.1	137.3	-62.6	170.4	-174.6	164.4	0	121.9
339	K	35.4	Very low	36.2	Very low	204 Å²	204	138.1 Å²	138.1	89%	0.887	79%	0.785	S	S	*	*				82.9	95.1	128	-164.4	179.4	-175	-179.9	0	120.2
340	S	40.8	Very low	36.3	Very low	127 Å²	127	135 Å²	135	89%	0.888	78%	0.781	S	S	*	*				178.6	163.4	120.9	44.1	0	0	0	0	112.1
341	R	36.4	Very low	36.3	Very low	216 Å²	216	133.4 Å²	133.4	82%	0.815	77%	0.77	S	S	*	*			trans	-108.3	143.1	-176.2	-151.5	-169.1	-175.4	-150.2	3.1	108.5
342	P	37.2	Very low	36.2	Very low	118 Å²	118	132.6 Å²	132.6	77%	0.766	78%	0.776	S	S	*	*				-140.1	142.2	93.4	20.2	2	0	0	0	113.2
343	V	34.3	Very low	36.4	Very low	112 Å²	112	135.6 Å²	135.6	68%	0.679	78%	0.777	S	S	*	*				52.9	93.7	92.2	-173.1	0	0	0	0	115.4
344	A	34.9	Very low	36.6	Very low	100 Å²	100	131.4 Å²	131.4	83%	0.826	76%	0.76	S	S	*	*			trans	-169.5	146.4	140.8	0	0	0	0	0	111.9
345	G	30.3	Very low	36.9	Very low	74 Å²	74	129.7 Å²	129.7	76%	0.763	76%	0.764	S	S	*	*			trans	66.1	98.8	149.1	0	0	0	0	0	121.2
346	S	36.8	Very low	37	Very low	129 Å²	129	128.7 Å²	128.7	90%	0.902	76%	0.759	S	S	*	*				-177.7	134.9	100.5	-102.1	0	0	0	0	114
347	S	30.8	Very low	37.3	Very low	122 Å²	122	123 Å²	123	85%	0.853	74%	0.742	S	S	*	*			trans	-78	131.2	178.6	47.8	0	0	0	0	113.1
348	G	35.7	Very low	37.3	Very low	83 Å²	83	120 Å²	120	86%	0.856	72%	0.724	S	S	*	*			trans	-123	109.3	167.6	0	0	0	0	0	110.6
349	S	33.7	Very low	37.5	Very low	103 Å²	103	118.2 Å²	118.2	72%	0.72	71%	0.712	S	S	*	*			trans	-105.6	147	-165.8	177.4	0	0	0	0	113.6
350	S	35.9	Very low	38.4	Very low	93 Å²	93	111.9 Å²	111.9	65%	0.65	69%	0.693	S	S	*	*			trans	69.9	162.2	150.8	-67.5	0	0	0	0	119.9
351	K	35.9	Very low	39	Very low	126 Å²	126	106.6 Å²	106.6	55%	0.548	66%	0.655	S	S	.	*			cis	-168.5	128.4	-29.6	-105.7	175.1	177.1	-175.1	0	105.7
352	A	32.4	Very low	39.8	Very low	102 Å²	102	98.8 Å²	98.8	84%	0.843	63%	0.629	S	S	*	*			trans	-167.1	47.8	172.1	0	0	0	0	0	115.5
353	K	41.4	Very low	40.8	Very low	181 Å²	181	97.8 Å²	97.8	79%	0.787	62%	0.617	S	S	*	*			trans	-132.4	-11.3	-178.6	-76.9	-174.6	178.8	174.8	0	118.2	T355	K353-T355 PolarHBondContact O-N 3.18Å
354	H	42.1	Very low	42.2	Very low	110 Å²	110	96.9 Å²	96.9	51%	0.509	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-76.5	-17.4	-169.4	-92.3	-120.9	0	0	0	116.9	Q356 E555	H354-Q356 VanDerWaalsContact C-N 3.34Å; H354-Q356 PolarHBondContact O-N 3Å; H354-E555 IonicContact CE1-OE1 2.64Å; H354-E555 PolarHBondContact CE1-OE1 2.61Å; H354-E555 IonicContact CG-OE1 2.62Å; H354-E555 IonicContact ND1-OE1 3.33Å; H354-E555 PolarHBondContact ND1-OE1 3.06Å; H354-E555 IonicContact NE2-OE1 2.71Å
355	T	44.6	Very low	43.5	Very low	135 Å²	135	92.2 Å²	92.2	83%	0.828	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-80.8	-2.7	-169.5	55.3	0	0	0	0	116.2	K353	K353-T355 PolarHBondContact O-N 3.18Å
356	Q	42.2	Very low	45.1	Very low	117 Å²	117	89.9 Å²	89.9	55%	0.547	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-99	-14.7	174.9	-77.5	-176.7	-33.2	0	0	114.1	H354 S360	H354-Q356 VanDerWaalsContact C-N 3.34Å; H354-Q356 PolarHBondContact O-N 3Å; Q356-S360 PolarHBondContact O-N 3.21Å
357	G	42.4	Very low	46	Very low	37 Å²	37	86.3 Å²	86.3	38%	0.381	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-55.1	-179.3	0	0	0	0	0	112.5	R359 S360 I361	G357-R359 VanDerWaalsContact C-N 3.26Å; G357-R359 PolarHBondContact O-N 2.9Å; G357-R359 VanDerWaalsContact O-N 3.14Å; G357-S360 WeakPolarHBondContact O-CA 3.36Å; G357-S360 WeakPolarHBondContact O-CB 3.44Å; G357-S360 PolarHBondContact O-N 2.85Å; G357-I361 WeakPolarHBondContact O-CG1 3.42Å; G357-I361 PolarHBondContact O-N 3.08Å
358	A	39.9	Very low	46.8	Very low	38 Å²	38	83.4 Å²	83.4	31%	0.314	49%	0.493	S	S	.	.	H	α-helix	trans	-55.8	-35.3	-175.6	0	0	0	0	0	114.3	L362	A358-L362 PolarHBondContact O-N 3.45Å
359	R	45.1	Very low	47.4	Very low	156 Å²	156	81 Å²	81	59%	0.589	46%	0.461	S	S	*	.	H	α-helix	trans	-72.6	-39.5	174.4	-84.2	-173.7	158.1	154.8	-3.3	112.9	G357 I361 L362 D363	G357-R359 VanDerWaalsContact C-N 3.26Å; G357-R359 PolarHBondContact O-N 2.9Å; G357-R359 VanDerWaalsContact O-N 3.14Å; R359-I361 VanDerWaalsContact C-N 3.27Å; R359-I361 PolarHBondContact O-N 3.3Å; R359-L362 WeakPolarHBondContact O-CB 3.32Å; R359-L362 PolarHBondContact O-N 2.69Å; R359-L362 VanDerWaalsContact O-N 3.12Å; R359-D363 PolarHBondContact O-N 3.4Å
360	S	53.7	Low	47.6	Very low	71 Å²	71	82.6 Å²	82.6	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-61.3	-38	174.9	-160.4	0	0	0	0	111.7	Q356 G357 L362 D364	Q356-S360 PolarHBondContact O-N 3.21Å; G357-S360 WeakPolarHBondContact O-CA 3.36Å; G357-S360 WeakPolarHBondContact O-CB 3.44Å; G357-S360 PolarHBondContact O-N 2.85Å; S360-L362 VanDerWaalsContact C-N 3.31Å; S360-D364 WeakPolarHBondContact O-CB 3.4Å; S360-D364 PolarHBondContact O-N 2.96Å
361	I	53.6	Low	47.7	Very low	16 Å²	16	81.6 Å²	81.6	8%	0.082	45%	0.449	C	S	.	.	H	α-helix	trans	-64.1	-38	175.2	-61.5	171.2	0	0	0	110.9	G357 R359 D364 L365 F534 Y562	G357-I361 WeakPolarHBondContact O-CG1 3.42Å; G357-I361 PolarHBondContact O-N 3.08Å; R359-I361 VanDerWaalsContact C-N 3.27Å; R359-I361 PolarHBondContact O-N 3.3Å; I361-D364 WeakPolarHBondContact O-CB 3.43Å; I361-D364 PolarHBondContact O-N 3.33Å; I361-L365 HydrophobicContact CG2-CD1 3.88Å; I361-L365 WeakPolarHBondContact O-CB 3.25Å; I361-L365 WeakPolarHBondContact O-CG 3.3Å; I361-L365 PolarHBondContact O-N 3.33Å; I361-F534 HydrophobicContact CG2-CB 4.46Å; I361-F534 HydrophobicContact CG2-CD1 4.35Å; I361-F534 HydrophobicContact CG2-CD2 4.03Å; I361-F534 HydrophobicContact CG2-CE2 4.36Å; I361-F534 HydrophobicContact CG2-CG 4.03Å; I361-Y562 HydrophobicContact CB-CD2 4.47Å; I361-Y562 HydrophobicContact CB-CE2 4.27Å; I361-Y562 HydrophobicContact CD1-CD2 3.67Å; I361-Y562 HydrophobicContact CD1-CE2 4.03Å; I361-Y562 HydrophobicContact CD1-CG 4.09Å; I361-Y562 HydrophobicContact CG1-CD2 3.77Å; I361-Y562 HydrophobicContact CG1-CE2 3.59Å; I361-Y562 HydrophobicContact CG2-CD2 3.89Å; I361-Y562 HydrophobicContact CG2-CE2 3.92Å
362	L	53.9	Low	48.1	Very low	51 Å²	51	77.4 Å²	77.4	27%	0.267	43%	0.43	S	S	.	.	H	α-helix	trans	-69.6	-45.3	178.7	-146.5	81.5	0	0	0	112.8	A358 R359 S360 D364 L365 L366 A531 L535	A358-L362 PolarHBondContact O-N 3.45Å; R359-L362 WeakPolarHBondContact O-CB 3.32Å; R359-L362 PolarHBondContact O-N 2.69Å; R359-L362 VanDerWaalsContact O-N 3.12Å; S360-L362 VanDerWaalsContact C-N 3.31Å; L362-D364 PolarHBondContact O-N 3.2Å; L362-L365 PolarHBondContact O-N 3.13Å; L362-L366 PolarHBondContact O-N 2.9Å; L362-A531 HydrophobicContact CD1-CB 3.69Å; L362-A531 WeakPolarHBondContact CD1-O 3.48Å; L362-L535 HydrophobicContact CD1-CD1 3.82Å; L362-L535 HydrophobicContact CD1-CD2 4.21Å; L362-L535 HydrophobicContact CD1-CG 3.73Å; L362-L535 HydrophobicContact CD2-CD1 4.24Å; L362-L535 HydrophobicContact CD2-CD2 4.24Å; L362-L535 HydrophobicContact CD2-CG 4.48Å
363	D	58.1	Low	47.9	Very low	98 Å²	98	77.3 Å²	77.3	52%	0.524	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-33.7	175.4	-76.2	-46.7	0	0	0	111.3	R359	R359-D363 PolarHBondContact O-N 3.4Å
364	D	62.7	Low	47.4	Very low	92 Å²	92	71.8 Å²	71.8	49%	0.492	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-47.6	171.6	-133.8	38.8	0	0	0	110.8	S360 I361 L362 R575	S360-D364 WeakPolarHBondContact O-CB 3.4Å; S360-D364 PolarHBondContact O-N 2.96Å; I361-D364 WeakPolarHBondContact O-CB 3.43Å; I361-D364 PolarHBondContact O-N 3.33Å; L362-D364 PolarHBondContact O-N 3.2Å; D364-R575 PolarHBondContact O-NH1 3.49Å
365	L	62.3	Low	46.9	Very low	2 Å²	2	72.7 Å²	72.7	1%	0.01	43%	0.432	C	S	.	.	H	α-helix	trans	-67.4	-40.9	-177.8	-83.7	164.2	0	0	0	114.4	I361 L362 L527 I530 A531 F534 F565	I361-L365 HydrophobicContact CG2-CD1 3.88Å; I361-L365 WeakPolarHBondContact O-CB 3.25Å; I361-L365 WeakPolarHBondContact O-CG 3.3Å; I361-L365 PolarHBondContact O-N 3.33Å; L362-L365 PolarHBondContact O-N 3.13Å; L365-L527 HydrophobicContact CD2-CD2 4.37Å; L365-I530 HydrophobicContact CD1-CG2 4.37Å; L365-I530 HydrophobicContact CD2-CG2 4.18Å; L365-A531 HydrophobicContact CB-CB 4.45Å; L365-A531 HydrophobicContact CD1-CB 4.13Å; L365-F534 HydrophobicContact CD1-CD2 3.83Å; L365-F534 HydrophobicContact CD1-CE2 4.31Å; L365-F565 HydrophobicContact CD2-CD2 4.47Å; L365-F565 HydrophobicContact CD2-CE1 3.87Å; L365-F565 HydrophobicContact CD2-CE2 3.59Å; L365-F565 HydrophobicContact CD2-CZ 3.26Å; L365-F565 HydrophobicContact CG-CZ 4.39Å
366	L	63.7	Low	46.3	Very low	26 Å²	26	72.6 Å²	72.6	14%	0.136	43%	0.431	C	S	.	.	S	Bend	trans	-148.6	87.9	-172.9	-73	178.9	0	0	0	109.7	L362 S368 Y524 L527 S528 A531	L362-L366 PolarHBondContact O-N 2.9Å; L366-S368 PolarHBondContact O-N 3.14Å; L366-Y524 HydrophobicContact CD1-CE2 4.09Å; L366-Y524 HydrophobicContact CD2-CD2 3.66Å; L366-Y524 HydrophobicContact CD2-CE2 3.73Å; L366-Y524 HydrophobicContact CG-CE2 4.46Å; L366-L527 HydrophobicContact CD2-CB 3.65Å; L366-L527 HydrophobicContact CD2-CD1 4.18Å; L366-L527 HydrophobicContact CG-CB 4.16Å; L366-S528 WeakPolarHBondContact CD1-OG 3.23Å; L366-A531 HydrophobicContact CD1-CB 4.07Å
367	P	55.9	Low	45.8	Very low	53 Å²	53	71.2 Å²	71.2	34%	0.344	44%	0.44	S	S	.	.			trans	-61.7	115.6	-179.4	-17.6	27.2	0	0	0	110.2	D369 R582	P367-D369 PolarHBondContact O-N 3.31Å; P367-R582 PolarHBondContact O-NH1 2.61Å; P367-R582 PolarHBondContact O-NH2 3.11Å
368	S	48.6	Very low	45.4	Very low	62 Å²	62	79 Å²	79	43%	0.434	46%	0.463	S	S	.	.			trans	-43	101.2	-158.9	-164.8	0	0	0	0	116.5	L366 N370	L366-S368 PolarHBondContact O-N 3.14Å; S368-N370 PolarHBondContact O-N 2.95Å
369	D	47.2	Very low	45.2	Very low	33 Å²	33	86.2 Å²	86.2	18%	0.176	49%	0.49	C	S	.	.			trans	-92.1	81.9	-179.2	-95.2	-36.4	0	0	0	112.7	P367 D371 Y372 Y520 R582	P367-D369 PolarHBondContact O-N 3.31Å; D369-D371 VanDerWaalsContact C-N 3.28Å; D369-D371 PolarHBondContact O-N 3.5Å; D369-Y372 HydrophobicContact CB-CD2 3.85Å; D369-Y372 HydrophobicContact CB-CE2 4.39Å; D369-Y372 WeakPolarHBondContact OD1-CD2 3.14Å; D369-Y372 WeakPolarHBondContact OD1-CE2 3.3Å; D369-Y520 PolarHBondContact OD2-OH 3Å; D369-R582 IonicContact OD1-CZ 2.65Å; D369-R582 VanDerWaalsContact OD1-CZ 3.24Å; D369-R582 IonicContact OD1-NE 2.88Å; D369-R582 PolarHBondContact OD1-NE 2.83Å; D369-R582 IonicContact OD1-NH2 2.61Å; D369-R582 PolarHBondContact OD1-NH2 3.37Å; D369-R582 IonicContact OD2-CZ 3.61Å; D369-R582 IonicContact OD2-NE 2.7Å; D369-R582 PolarHBondContact OD2-NE 2.95Å; D369-R582 IonicContact OD2-NH1 3.17Å; D369-R582 IonicContact OD2-NH2 3.26Å; D369-R582 PolarHBondContact OD2-NH2 3.13Å; D369-R582 VanDerWaalsContact OD2-NH2 3.13Å
370	N	38.6	Very low	44.7	Very low	136 Å²	136	88 Å²	88	73%	0.727	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	3.3	176.4	-97.6	-13.3	0	0	0	114.6	S368	S368-N370 PolarHBondContact O-N 2.95Å
371	D	37.4	Very low	43.8	Very low	72 Å²	72	94.3 Å²	94.3	39%	0.385	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	11	-168.2	-72.2	-68.7	0	0	0	115.2	D369 S483 K589	D369-D371 VanDerWaalsContact C-N 3.28Å; D369-D371 PolarHBondContact O-N 3.5Å; D371-S483 WeakPolarHBondContact OD2-CB 3.3Å; D371-S483 PolarHBondContact OD2-OG 3.12Å; D371-K589 PolarHBondContact O-NZ 3.06Å
372	Y	43.7	Very low	43	Very low	38 Å²	38	99.6 Å²	99.6	15%	0.149	56%	0.556	C	S	.	*			trans	-107.7	7.6	-176.9	-76.5	-83.4	0	0	0	115.6	D369 A374 Y517 Y520	D369-Y372 HydrophobicContact CB-CD2 3.85Å; D369-Y372 HydrophobicContact CB-CE2 4.39Å; D369-Y372 WeakPolarHBondContact OD1-CD2 3.14Å; D369-Y372 WeakPolarHBondContact OD1-CE2 3.3Å; Y372-A374 VanDerWaalsContact C-N 3.34Å; Y372-A374 PolarHBondContact O-N 3.07Å; Y372-Y517 HydrophobicContact CD1-CE2 4.3Å; Y372-Y520 HydrophobicContact CD1-CE1 4.06Å; Y372-Y520 HydrophobicContact CE1-CE1 4.41Å; Y372-Y520 HydrophobicContact CG-CE1 4.3Å
373	A	29.9	Very low	41.9	Very low	99 Å²	99	102 Å²	102	82%	0.818	58%	0.578	S	S	*	*			trans	-75	82.4	172.5	0	0	0	0	0	111.4
374	A	30.8	Very low	41.1	Very low	65 Å²	65	103.7 Å²	103.7	54%	0.537	59%	0.592	S	S	.	*			trans	-63.8	144.6	160.5	0	0	0	0	0	109.6	Y372 V376	Y372-A374 VanDerWaalsContact C-N 3.34Å; Y372-A374 PolarHBondContact O-N 3.07Å; A374-V376 PolarHBondContact O-N 3.43Å
375	P	31	Very low	39.9	Very low	129 Å²	129	107.6 Å²	107.6	84%	0.838	61%	0.607	S	S	*	*			trans	-70	105.9	-179.2	28.2	-33.5	0	0	0	110.2	A377	P375-A377 PolarHBondContact O-N 3.14Å; P375-A377 VanDerWaalsContact O-N 3.1Å
376	V	32	Very low	38.8	Very low	134 Å²	134	114.3 Å²	114.3	81%	0.812	65%	0.648	S	S	*	*			trans	-62.1	114.4	168.4	175	0	0	0	0	108.2	A374 K378	A374-V376 PolarHBondContact O-N 3.43Å; V376-K378 PolarHBondContact O-N 3.06Å; V376-K378 VanDerWaalsContact O-N 3.15Å
377	A	32.2	Very low	37.4	Very low	87 Å²	87	118.1 Å²	118.1	72%	0.719	68%	0.676	S	S	*	*			trans	-58.9	116.9	173.1	0	0	0	0	0	109.4	P375 Q379	P375-A377 PolarHBondContact O-N 3.14Å; P375-A377 VanDerWaalsContact O-N 3.1Å; A377-Q379 PolarHBondContact O-N 2.96Å
378	K	32.4	Very low	36.6	Very low	200 Å²	200	124.4 Å²	124.4	87%	0.87	70%	0.7	S	S	*	*			trans	-70.4	102.9	173.8	-70.7	-179.2	178.8	177.8	0	108.6	V376 Q380	V376-K378 PolarHBondContact O-N 3.06Å; V376-K378 VanDerWaalsContact O-N 3.15Å; K378-Q380 PolarHBondContact O-N 3.32Å
379	Q	36.6	Very low	36	Very low	191 Å²	191	130.5 Å²	130.5	89%	0.893	72%	0.719	S	S	*	*			trans	-58.8	122.2	166.5	-72.1	-179.1	-17.2	0	0	109.2	A377 K381	A377-Q379 PolarHBondContact O-N 2.96Å; Q379-K381 PolarHBondContact O-N 2.98Å
380	Q	34.7	Very low	35.9	Very low	194 Å²	194	135.7 Å²	135.7	91%	0.907	75%	0.751	S	S	*	*			trans	-69.7	108	165.4	-73.8	170.1	-84.6	0	0	108.1	K378	K378-Q380 PolarHBondContact O-N 3.32Å
381	K	35.6	Very low	36.2	Very low	202 Å²	202	133.3 Å²	133.3	88%	0.878	75%	0.751	S	S	*	*			trans	-91.4	114.7	165.6	-166.4	171.4	-176.9	179.2	0	108.6	Q379	Q379-K381 PolarHBondContact O-N 2.98Å
382	V	36.5	Very low	36.4	Very low	127 Å²	127	135.6 Å²	135.6	77%	0.77	77%	0.769	S	S	*	*			trans	-60.6	137	171.5	175.8	0	0	0	0	108.8
383	S	29.9	Very low	36.6	Very low	102 Å²	102	140.1 Å²	140.1	71%	0.713	80%	0.804	S	S	*	*			trans	-101.2	126.5	-178.3	-169.6	0	0	0	0	109.8
384	T	40.7	Very low	36.9	Very low	134 Å²	134	140.9 Å²	140.9	82%	0.822	80%	0.803	S	S	*	*			trans	-122.1	119.5	169.5	-38.3	0	0	0	0	107.7
385	Q	37.8	Very low	37.5	Very low	174 Å²	174	142.9 Å²	142.9	81%	0.813	81%	0.813	S	S	*	*			trans	-91.5	135.2	-179.4	-61.8	175.1	-11.6	0	0	110.4
386	V	40.4	Very low	37.8	Very low	143 Å²	143	142 Å²	142	87%	0.867	81%	0.81	S	S	*	*			trans	-144.5	145.9	142.6	-175.5	0	0	0	0	108.9
387	C	33.4	Very low	38.2	Very low	106 Å²	106	140.7 Å²	140.7	72%	0.716	81%	0.807	S	S	*	*			trans	-46.5	171.1	165.8	-92.3	0	0	0	0	114.9
388	E	38.9	Very low	38.6	Very low	185 Å²	185	142 Å²	142	86%	0.864	81%	0.811	S	S	*	*			cis	-152.9	-172.3	20.9	-146.4	149	-172.1	0	0	114.5
389	K	35.9	Very low	38.9	Very low	189 Å²	189	137 Å²	137	82%	0.822	80%	0.801	S	S	*	*			trans	-95.8	148.9	-164.4	168.3	-166.3	-174.5	-170	0	112.8
390	V	45.7	Very low	39	Very low	142 Å²	142	135.8 Å²	135.8	86%	0.861	80%	0.797	S	S	*	*			trans	177.4	147.8	135.6	154.2	0	0	0	0	109.6
391	A	44.2	Very low	39.2	Very low	86 Å²	86	132.1 Å²	132.1	71%	0.711	78%	0.783	S	S	*	*			trans	-105.7	164.9	-173.7	0	0	0	0	0	112.9
392	P	42.6	Very low	39.5	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	78%	0.782	S	S	*	*			trans	-104.3	174.8	-165.4	40.9	-35.9	0	0	0	114.4
393	P	47.4	Very low	39.7	Very low	134 Å²	134	136.2 Å²	136.2	87%	0.87	78%	0.784	S	S	*	*			trans	-117.2	162.8	156.1	37.7	-27.2	0	0	0	113.7
394	S	36.6	Very low	39.8	Very low	115 Å²	115	139.2 Å²	139.2	80%	0.804	79%	0.787	S	S	*	*			trans	-112	134.6	-174.8	54.2	0	0	0	0	113.5
395	S	42.6	Very low	39.9	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	79%	0.786	S	S	*	*			trans	-176.2	116.4	153.8	53.6	0	0	0	0	108.9
396	S	38.7	Very low	39.7	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	78%	0.777	S	S	*	*				99.8	141	77.5	-65.5	0	0	0	0	112.7
397	S	39.4	Very low	39.7	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	78%	0.781	S	S	*	*			trans	86.5	114.4	155	-52.5	0	0	0	0	120.7
398	S	40.2	Very low	40	Very low	115 Å²	115	135.2 Å²	135.2	80%	0.804	78%	0.782	S	S	*	*			trans	69.2	152.6	133.4	-53.3	0	0	0	0	119.9
399	S	38.9	Very low	40.1	Very low	95 Å²	95	130.5 Å²	130.5	66%	0.664	78%	0.783	S	S	*	*			cis	-175.4	169.5	-22.9	55.3	0	0	0	0	107.4
400	M	39.7	Very low	40.2	Very low	165 Å²	165	130.3 Å²	130.3	81%	0.813	79%	0.785	S	S	*	*			trans	71.3	153.6	163.6	-62.1	-145.6	168.4	0	0	118
401	L	38.9	Very low	39.9	Very low	116 Å²	116	127.7 Å²	127.7	61%	0.607	77%	0.771	S	S	*	*			cis	-165.8	137.7	-28.1	-141.5	81.8	0	0	0	109.4
402	R	40.9	Very low	39.6	Very low	225 Å²	225	131.6 Å²	131.6	85%	0.849	78%	0.779	S	S	*	*			trans	62.5	171.7	163.9	-44.4	-174.3	-175	-154.4	1.9	115
403	K	41.6	Very low	39.6	Very low	190 Å²	190	130.7 Å²	130.7	83%	0.826	78%	0.782	S	S	*	*			cis	-158.9	137.2	12.9	-163	177.9	171.2	-175.7	0	111.1
404	E	31.9	Very low	39.4	Very low	165 Å²	165	133.4 Å²	133.4	77%	0.771	78%	0.783	S	S	*	*			trans	-78.9	149.7	163.1	-81.2	-74.6	140.2	0	0	110.5
405	P	42.3	Very low	40.7	Very low	123 Å²	123	133.7 Å²	133.7	80%	0.799	78%	0.782	S	S	*	*				-151.3	166.2	87.5	39	-20.2	0	0	0	116.3
406	G	33.7	Very low	41.2	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	78%	0.782	S	S	*	*			trans	-107.3	-178.4	-176.1	0	0	0	0	0	117.5
407	F	40.3	Very low	42	Very low	220 Å²	220	134.7 Å²	134.7	97%	0.965	78%	0.783	S	S	*	*			trans	-160.1	156.1	166.8	-108.6	-92.4	0	0	0	107.7
408	G	39.7	Very low	43.2	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	79%	0.785	S	S	*	*			cis	145.9	97.1	-9.3	0	0	0	0	0	112.9
409	G	40.2	Very low	43.6	Very low	85 Å²	85	135.9 Å²	135.9	88%	0.876	79%	0.786	S	S	*	*			trans	161	149.6	179.6	0	0	0	0	0	115.3
410	E	38.3	Very low	43.5	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.864	80%	0.797	S	S	*	*			trans	-111.6	-156.7	-169.9	-149.5	-158.9	116.6	0	0	111.3
411	P	39.4	Very low	43.9	Very low	87 Å²	87	139.8 Å²	139.8	57%	0.565	80%	0.796	S	S	*	*				-124.8	-163.1	-112.8	46.9	-33	0	0	0	117
412	L	38.1	Very low	44	Very low	169 Å²	169	143.1 Å²	143.1	89%	0.885	81%	0.806	S	S	*	*			trans	70.6	108.4	155.7	-69.6	169.9	0	0	0	119.3
413	A	42.5	Very low	43.7	Very low	101 Å²	101	136.9 Å²	136.9	84%	0.835	80%	0.802	S	S	*	*			trans	-153.8	128	148.3	0	0	0	0	0	111.3
414	Q	44.2	Very low	43.7	Very low	191 Å²	191	137.9 Å²	137.9	89%	0.893	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-97.7	143.2	164.8	-68.1	179.2	-10.2	0	0	109.5
415	P	64.1	Low	44.1	Very low	120 Å²	120	136.1 Å²	136.1	78%	0.779	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-93.7	152.8	164.9	34.5	-30.2	0	0	0	112.5
416	P	52.3	Low	44.1	Very low	117 Å²	117	136.2 Å²	136.2	76%	0.76	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-90.7	168.6	-167.2	37	-38.2	0	0	0	114.8
417	P	54.8	Low	44.2	Very low	122 Å²	122	139 Å²	139	79%	0.792	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-85	142.7	170.9	34.3	-33.2	0	0	0	112.7
418	P	66.3	Low	44.2	Very low	120 Å²	120	136.5 Å²	136.5	78%	0.779	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84.7	157.6	170.1	33.5	-33.1	0	0	0	112.9
419	P	47.9	Very low	43.9	Very low	127 Å²	127	138.3 Å²	138.3	83%	0.825	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-94.7	166.9	-163.6	37.1	-36.3	0	0	0	115.3
420	Q	36.7	Very low	43.9	Very low	192 Å²	192	138.6 Å²	138.6	90%	0.897	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-81.3	142.8	168.7	-63.3	177.4	-39.8	0	0	111.1
421	D	47.3	Very low	43.9	Very low	150 Å²	150	137.5 Å²	137.5	80%	0.802	79%	0.794	S	S	*	*			trans	-147.6	169.3	156.3	-135.7	-25.2	0	0	0	113.5
422	K	41	Very low	44	Very low	186 Å²	186	141.8 Å²	141.8	81%	0.809	81%	0.81	S	S	*	*			trans	-102.8	145.9	-144.5	-62.8	156.2	-175.1	165	0	116
423	A	36.1	Very low	44.1	Very low	94 Å²	94	139.3 Å²	139.3	78%	0.777	80%	0.802	S	S	*	*			trans	36	125.1	140.2	0	0	0	0	0	121.1
424	K	41.7	Very low	43.7	Very low	210 Å²	210	144 Å²	144	91%	0.913	80%	0.804	S	S	*	*				-163.5	133.2	124.9	-108.9	168.2	-174.1	-175.1	0	111.9
425	V	38.8	Very low	43.5	Very low	128 Å²	128	140.5 Å²	140.5	78%	0.776	80%	0.8	S	S	*	*			trans	-108.2	149.9	164.4	-162.9	0	0	0	0	106.6
426	P	42.2	Very low	42.4	Very low	125 Å²	125	139 Å²	139	81%	0.812	79%	0.793	S	S	*	*				-140.2	153.7	120.7	32.6	-17.7	0	0	0	114.2
427	V	36.7	Very low	41.7	Very low	118 Å²	118	141.5 Å²	141.5	72%	0.715	80%	0.799	S	S	*	*			trans	-78.2	148.7	174.9	175.1	0	0	0	0	110.1
428	N	39.1	Very low	40.9	Very low	169 Å²	169	139.2 Å²	139.2	90%	0.904	80%	0.798	S	S	*	*			trans	-137.3	137.6	151.8	-108.4	-8.2	0	0	0	109.8
429	S	33.6	Very low	39.6	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	81%	0.805	S	S	*	*			trans	-128.1	129.3	-177.9	176.5	0	0	0	0	109.1
430	S	42	Very low	39.2	Very low	92 Å²	92	147 Å²	147	64%	0.643	80%	0.804	S	S	*	*			trans	-158.6	96.4	174.7	51.4	0	0	0	0	113.1
431	H	38.3	Very low	39.3	Very low	162 Å²	162	143 Å²	143	75%	0.75	80%	0.797	S	S	*	*			trans	17.9	135.6	136.1	48.7	-102.3	0	0	0	120.4
432	I	40	Very low	38.9	Very low	176 Å²	176	139.5 Å²	139.5	90%	0.903	80%	0.796	S	S	*	*			trans	-155	148.2	133.8	-103.9	155.7	0	0	0	108.8
433	T	39.8	Very low	38.9	Very low	118 Å²	118	139 Å²	139	72%	0.724	80%	0.797	S	S	*	*			trans	-122.2	147.8	-164.8	51.6	0	0	0	0	114.3
434	K	34.8	Very low	39.2	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	80%	0.8	S	S	*	*			trans	44.3	126	145.8	-70	-178.7	174.3	179.2	0	120.6
435	S	39.6	Very low	39.2	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	80%	0.797	S	S	*	*				174.6	150.7	126.5	-75	0	0	0	0	108.4
436	S	41.5	Very low	39.2	Very low	89 Å²	89	149 Å²	149	62%	0.622	80%	0.8	S	S	*	*			cis	164	131	-29.5	52.5	0	0	0	0	105.7
437	N	38.5	Very low	39.3	Very low	169 Å²	169	149.3 Å²	149.3	90%	0.904	80%	0.803	S	S	*	*			trans	67.8	145.3	167.3	-46.2	-6.3	0	0	0	116.1
438	G	37.2	Very low	39.4	Very low	73 Å²	73	151.2 Å²	151.2	75%	0.753	80%	0.803	S	S	*	*			cis	157.6	142.4	-7.1	0	0	0	0	0	110.9
439	Y	40	Very low	39.5	Very low	240 Å²	240	150.7 Å²	150.7	94%	0.941	80%	0.801	S	S	*	*			trans	-156.8	167.2	159.7	67.7	-91.8	0	0	0	111.3
440	E	38.3	Very low	39.9	Very low	172 Å²	172	148.9 Å²	148.9	80%	0.804	79%	0.792	S	S	*	*			trans	-128	159.3	-145.6	-159.8	-162.8	113.3	0	0	114.3
441	S	38	Very low	39.9	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	80%	0.801	S	S	*	*			trans	84.2	134.2	145.8	-134.8	0	0	0	0	120.3
442	G	40.5	Very low	40.1	Very low	77 Å²	77	148.6 Å²	148.6	79%	0.794	80%	0.796	S	S	*	*			trans	167.9	55.1	-179.2	0	0	0	0	0	114.9
443	Q	41.2	Very low	40.3	Very low	175 Å²	175	147.7 Å²	147.7	82%	0.818	79%	0.793	S	S	*	*			trans	-68.8	145.4	-178	-62	178.3	-28	0	0	114.2
444	R	42.2	Very low	40.3	Very low	224 Å²	224	145.4 Å²	145.4	85%	0.845	79%	0.793	S	S	*	*				179.8	113.7	116.3	-99.8	170.9	168.4	-143.3	-2.6	116.8
445	K	42.1	Very low	40.8	Very low	194 Å²	194	144.7 Å²	144.7	84%	0.843	79%	0.792	S	S	*	*			trans	50.6	118.5	132.4	-58.3	-169.9	176.9	-168	0	122.4
446	R	37.9	Very low	40.7	Very low	225 Å²	225	145.3 Å²	145.3	85%	0.849	79%	0.786	S	S	*	*			trans	-83.8	174.1	144.6	-71.7	-176.4	171.5	-169.3	-2.1	111.1
447	P	44.4	Very low	40.5	Very low	132 Å²	132	145.2 Å²	145.2	86%	0.857	79%	0.786	S	S	*	*				-137.6	176.4	118	38.2	-26.8	0	0	0	115.5
448	H	38.6	Very low	40.3	Very low	158 Å²	158	142 Å²	142	73%	0.731	78%	0.776	S	S	*	*			trans	-92.7	160.1	-175.1	-113.6	-110	0	0	0	113.8
449	N	41.7	Very low	40.1	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	78%	0.775	S	S	*	*			trans	-177.4	132.6	135.3	-89.2	-8.3	0	0	0	106.6
450	A	41.4	Very low	39.7	Very low	69 Å²	69	138.5 Å²	138.5	57%	0.57	77%	0.766	S	S	*	*			cis	105.7	126.6	27.5	0	0	0	0	0	112.4
451	D	41.6	Very low	39.5	Very low	156 Å²	156	135.2 Å²	135.2	83%	0.834	76%	0.762	S	S	*	*			trans	64.2	149.3	165.7	-51.3	-22.6	0	0	0	118.9
452	S	44.1	Very low	39.4	Very low	93 Å²	93	136 Å²	136	65%	0.65	76%	0.763	S	S	*	*			cis	-155.3	154.9	-2.5	-127.3	0	0	0	0	112.8
453	D	43.4	Very low	39.1	Very low	156 Å²	156	140.5 Å²	140.5	83%	0.834	76%	0.763	S	S	*	*			trans	42.2	142.8	145.6	-60.9	-62.9	0	0	0	125.2
454	G	40.3	Very low	38.9	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	76%	0.755	S	S	*	*			trans	142.2	92.9	140.1	0	0	0	0	0	119.2
455	H	44.4	Very low	38.5	Very low	184 Å²	184	134.3 Å²	134.3	85%	0.852	75%	0.754	S	S	*	*			trans	-6.2	154.8	142	-81.5	-90.7	0	0	0	119.7
456	D	36.8	Very low	38.1	Very low	130 Å²	130	130.1 Å²	130.1	70%	0.695	75%	0.749	S	S	*	*			cis	-169.5	159.8	-5.6	-172.8	14.9	0	0	0	110.4
457	S	37.5	Very low	37.8	Very low	87 Å²	87	124.2 Å²	124.2	61%	0.608	74%	0.742	S	S	*	*			trans	38	115.5	149.8	-72.2	0	0	0	0	123.5
458	S	35.9	Very low	37.2	Very low	101 Å²	101	123.1 Å²	123.1	71%	0.706	74%	0.738	S	S	*	*				104.3	128.8	111.5	74.8	0	0	0	0	122.6
459	T	31.7	Very low	37.1	Very low	118 Å²	118	120.9 Å²	120.9	72%	0.724	74%	0.74	S	S	*	*			trans	80.8	118.4	139.5	44.7	0	0	0	0	123.6
460	T	32.3	Very low	36.7	Very low	123 Å²	123	120.1 Å²	120.1	76%	0.755	74%	0.736	S	S	*	*			trans	71.6	127.1	141.4	42	0	0	0	0	121.9
461	S	33.7	Very low	36.6	Very low	103 Å²	103	124.7 Å²	124.7	72%	0.72	75%	0.751	S	S	*	*			trans	46.4	128.9	132.9	-48	0	0	0	0	118.5
462	T	36	Very low	36	Very low	122 Å²	122	122.5 Å²	122.5	75%	0.748	74%	0.743	S	S	*	*			cis	-165.7	160.3	45	-21.5	0	0	0	0	111.2
463	E	34.8	Very low	35.2	Very low	171 Å²	171	123 Å²	123	80%	0.799	75%	0.745	S	S	*	*			trans	-2.9	130.3	157.8	-60.4	171.7	154	0	0	120.1
464	S	36	Very low	34.7	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	74%	0.741	S	S	*	*				153.1	139.1	114.8	-72.5	0	0	0	0	115.4
465	H	34.3	Very low	34.2	Very low	174 Å²	174	128.4 Å²	128.4	81%	0.806	74%	0.744	S	S	*	*			trans	41.1	120	156	-48.5	-52.8	0	0	0	119.2
466	S	33.9	Very low	33.8	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	75%	0.745	S	S	*	*				170.7	152.4	68.4	46.3	0	0	0	0	113.3
467	S	30.9	Very low	34	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	75%	0.75	S	S	*	*			trans	50.4	130.9	149.4	49.2	0	0	0	0	124.3
468	S	31.8	Very low	33.8	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	75%	0.753	S	S	*	*			trans	71.4	105.6	140	-59.5	0	0	0	0	120.5
469	S	36.5	Very low	33.8	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	76%	0.763	S	S	*	*				-178.4	134.8	89.2	-76.6	0	0	0	0	114.2
470	N	33.8	Very low	34	Very low	143 Å²	143	133.9 Å²	133.9	77%	0.765	75%	0.754	S	S	*	*			trans	-6.3	129.8	156.5	-52.6	-31.3	0	0	0	118.4
471	N	38.2	Very low	34	Very low	165 Å²	165	133.3 Å²	133.3	88%	0.882	76%	0.755	S	S	*	*				-164.6	133.8	105.4	-95.3	-31.5	0	0	0	115.1
472	T	30.2	Very low	34.1	Very low	109 Å²	109	134.1 Å²	134.1	67%	0.669	76%	0.755	S	S	*	*			trans	-61.8	142.4	174.2	-58.6	0	0	0	0	113.3	Y474	T472-Y474 HydrophobicContact CG2-CE1 4.02Å
473	C	27.5	Very low	33.9	Very low	103 Å²	103	130.5 Å²	130.5	70%	0.696	74%	0.735	S	S	*	*			trans	179.1	102.1	138.4	-167.6	0	0	0	0	114.2
474	Y	31.6	Very low	33.8	Very low	194 Å²	194	130.6 Å²	130.6	76%	0.761	74%	0.739	S	S	*	*			trans	28.7	104.6	148.3	-35.7	-52.5	0	0	0	121.2	T472 K476	T472-Y474 HydrophobicContact CG2-CE1 4.02Å; Y474-K476 PolarHBondContact O-N 2.91Å
475	N	30.5	Very low	33.8	Very low	147 Å²	147	130.1 Å²	130.1	79%	0.786	73%	0.729	S	S	*	*			trans	-89.3	96.3	174.6	-162.4	-18.8	0	0	0	112.7	K477	N475-K477 PolarHBondContact O-N 2.85Å
476	K	37	Very low	34.2	Very low	201 Å²	201	125.6 Å²	125.6	87%	0.874	72%	0.717	S	S	*	*			trans	-85.6	87.9	179.5	-166.2	178.4	-174.8	179.8	0	110.9	Y474 G478	Y474-K476 PolarHBondContact O-N 2.91Å; K476-G478 PolarHBondContact O-N 2.8Å
477	K	40.8	Very low	35.1	Very low	186 Å²	186	122.1 Å²	122.1	81%	0.809	69%	0.693	S	S	*	*			trans	-69.2	85.3	178.1	-78.4	-169.8	175.2	-178.2	0	113	N475	N475-K477 PolarHBondContact O-N 2.85Å
478	G	33.1	Very low	36.3	Very low	65 Å²	65	123.2 Å²	123.2	67%	0.67	70%	0.697	S	S	*	*			trans	-66.9	130.4	160.8	0	0	0	0	0	110.9	K476	K476-G478 PolarHBondContact O-N 2.8Å
479	K	35.7	Very low	37.8	Very low	208 Å²	208	121.7 Å²	121.7	90%	0.904	68%	0.68	S	S	*	*			trans	-87.1	115.1	175.4	-66.5	172.1	-179.9	172.7	0	108.8
480	S	35	Very low	39.5	Very low	76 Å²	76	120.8 Å²	120.8	53%	0.531	67%	0.667	S	S	.	*			trans	-76.7	127.6	165.2	-178	0	0	0	0	109.6
481	S	32.5	Very low	41.6	Very low	111 Å²	111	117 Å²	117	78%	0.776	66%	0.656	S	S	*	*			trans	-86.4	107.7	-174.5	52.5	0	0	0	0	111.9
482	V	36.5	Very low	43.8	Very low	120 Å²	120	112 Å²	112	73%	0.727	64%	0.637	S	S	*	*			trans	-129.2	115.4	148.7	-170.2	0	0	0	0	106.2
483	S	30.7	Very low	46.4	Very low	46 Å²	46	108 Å²	108	32%	0.322	61%	0.611	S	S	.	*			trans	-71.2	128.3	-164.8	-166.9	0	0	0	0	111.9	D371 N485	D371-S483 WeakPolarHBondContact OD2-CB 3.3Å; D371-S483 PolarHBondContact OD2-OG 3.12Å; S483-N485 PolarHBondContact O-N 3.08Å; S483-N485 VanDerWaalsContact O-N 3.11Å
484	L	33.1	Very low	49.1	Very low	172 Å²	172	105 Å²	105	90%	0.901	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	10.8	-177.7	-76.1	165.1	0	0	0	113.9
485	N	37.3	Very low	51.7	Low	85 Å²	85	102 Å²	102	46%	0.455	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.1	2.2	-173.5	-67.4	8.4	0	0	0	113.9	S483	S483-N485 PolarHBondContact O-N 3.08Å; S483-N485 VanDerWaalsContact O-N 3.11Å
486	S	42	Very low	54.6	Low	79 Å²	79	100.3 Å²	100.3	55%	0.552	57%	0.573	S	S	*	*	S	Bend	trans	-64.4	142.7	172.4	-58.5	0	0	0	0	110.5
487	P	53.4	Low	57.2	Low	34 Å²	34	91.4 Å²	91.4	22%	0.221	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-52.5	145.9	167.8	-23.8	33.3	0	0	0	110.7	L489 R582	P487-L489 PolarHBondContact O-N 3.31Å; P487-L489 VanDerWaalsContact O-N 3.15Å; P487-R582 HydrophobicContact CG-CG 4.24Å
488	P	55.5	Low	59.7	Low	125 Å²	125	85.5 Å²	85.5	81%	0.812	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-51.9	124.3	166	-22.3	33.2	0	0	0	108.6	D490	P488-D490 PolarHBondContact O-N 3.06Å; P488-D490 VanDerWaalsContact O-N 3.13Å
489	L	63.8	Low	62.6	Low	77 Å²	77	85.9 Å²	85.9	40%	0.403	50%	0.504	S	S	.	.			trans	-66.9	114.7	177.9	-70.1	169.1	0	0	0	108	P487 A491 L494 A586 A587	P487-L489 PolarHBondContact O-N 3.31Å; P487-L489 VanDerWaalsContact O-N 3.15Å; L489-A491 PolarHBondContact O-N 3.36Å; L489-L494 HydrophobicContact CB-CD1 4.02Å; L489-L494 HydrophobicContact CB-CG 4.41Å; L489-A586 HydrophobicContact CD2-CB 4.34Å; L489-A587 HydrophobicContact CD2-CB 4.47Å
490	D	71.8	Confident	65.3	Low	91 Å²	91	76 Å²	76	49%	0.487	46%	0.461	S	S	.	.			trans	-63.2	130.2	174.4	-171.2	-12	0	0	0	109.3	P488 A492 L493 L494	P488-D490 PolarHBondContact O-N 3.06Å; P488-D490 VanDerWaalsContact O-N 3.13Å; D490-A492 VanDerWaalsContact C-N 3.25Å; D490-A492 PolarHBondContact O-N 3.05Å; D490-A492 PolarHBondContact OD1-N 2.82Å; D490-L493 HydrophobicContact CB-CB 4.32Å; D490-L493 HydrophobicContact CB-CD1 4.15Å; D490-L493 HydrophobicContact CB-CG 4.27Å; D490-L493 PolarHBondContact O-N 2.88Å; D490-L494 PolarHBondContact O-N 2.71Å; D490-L494 VanDerWaalsContact O-N 3.16Å
491	A	77.8	Confident	68.1	Low	64 Å²	64	79.7 Å²	79.7	53%	0.529	47%	0.469	S	S	.	.	H	α-helix	trans	-59.3	-39.7	177.8	0	0	0	0	0	111	L489 L493 L494 D495	L489-A491 PolarHBondContact O-N 3.36Å; A491-L493 VanDerWaalsContact C-N 3.28Å; A491-L493 PolarHBondContact O-N 2.8Å; A491-L494 CarbonylContact O-C 3.57Å; A491-L494 WeakPolarHBondContact O-CA 3.1Å; A491-L494 WeakPolarHBondContact O-CB 3.19Å; A491-L494 PolarHBondContact O-N 2.64Å; A491-D495 PolarHBondContact O-N 3.5Å
492	A	84.5	Confident	71	Confident	60 Å²	60	77.8 Å²	77.8	50%	0.496	45%	0.453	S	S	.	.	H	α-helix	trans	-62.7	-34.5	179.8	0	0	0	0	0	112.7	D490 D495 E496	D490-A492 VanDerWaalsContact C-N 3.25Å; D490-A492 PolarHBondContact O-N 3.05Å; D490-A492 PolarHBondContact OD1-N 2.82Å; A492-D495 PolarHBondContact O-N 2.79Å; A492-E496 PolarHBondContact O-N 3.06Å
493	L	85.1	Confident	73.7	Confident	24 Å²	24	77.3 Å²	77.3	13%	0.126	45%	0.446	C	S	.	.	H	α-helix	trans	-74.7	-27.7	173.4	-72.8	174.1	0	0	0	112.4	D490 A491 D495 Y497 A583 A587	D490-L493 HydrophobicContact CB-CB 4.32Å; D490-L493 HydrophobicContact CB-CD1 4.15Å; D490-L493 HydrophobicContact CB-CG 4.27Å; D490-L493 PolarHBondContact O-N 2.88Å; A491-L493 VanDerWaalsContact C-N 3.28Å; A491-L493 PolarHBondContact O-N 2.8Å; L493-D495 VanDerWaalsContact C-N 3.3Å; L493-Y497 WeakPolarHBondContact O-CB 3.34Å; L493-Y497 WeakPolarHBondContact O-CD2 3.3Å; L493-Y497 PolarHBondContact O-N 3.33Å; L493-A583 HydrophobicContact CD1-CB 3.6Å; L493-A587 HydrophobicContact CB-CB 4.11Å
494	L	83	Confident	76.8	Confident	40 Å²	40	82.6 Å²	82.6	21%	0.209	47%	0.466	C	S	.	.	H	α-helix	trans	-74.2	-23.2	172.5	-67.7	176.4	0	0	0	112.2	L489 D490 A491 Y497 R591	L489-L494 HydrophobicContact CB-CD1 4.02Å; L489-L494 HydrophobicContact CB-CG 4.41Å; D490-L494 PolarHBondContact O-N 2.71Å; D490-L494 VanDerWaalsContact O-N 3.16Å; A491-L494 CarbonylContact O-C 3.57Å; A491-L494 WeakPolarHBondContact O-CA 3.1Å; A491-L494 WeakPolarHBondContact O-CB 3.19Å; A491-L494 PolarHBondContact O-N 2.64Å; L494-Y497 CarbonylContact O-C 3.3Å; L494-Y497 VanDerWaalsContact O-C 3.3Å; L494-R591 PolarHBondContact O-NH2 3.03Å
495	D	87.3	Confident	79.7	Confident	132 Å²	132	76.5 Å²	76.5	71%	0.706	43%	0.432	S	S	*	.	H	α-helix	trans	-80	-38.1	171.7	-61.8	-27.6	0	0	0	111.8	A491 A492 L493 Y497	A491-D495 PolarHBondContact O-N 3.5Å; A492-D495 PolarHBondContact O-N 2.79Å; L493-D495 VanDerWaalsContact C-N 3.3Å; D495-Y497 VanDerWaalsContact C-N 3.32Å; D495-Y497 PolarHBondContact O-N 2.91Å
496	E	90.7	Very high	82.5	Confident	110 Å²	110	75.3 Å²	75.3	51%	0.514	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-35	171.9	-168.3	-167.6	150.4	0	0	112.1	A492 P498	A492-E496 PolarHBondContact O-N 3.06Å; E496-P498 VanDerWaalsContact O-CD 3.27Å; E496-P498 WeakPolarHBondContact O-CD 3.33Å
497	Y	92.2	Very high	85	Confident	15 Å²	15	77 Å²	77	6%	0.059	42%	0.421	C	S	.	.	S	Bend	trans	-114.6	82.6	178	-64	-76.6	0	0	0	109.9	L493 L494 D495 Y509 L512 K584 I588 R591	L493-Y497 WeakPolarHBondContact O-CB 3.34Å; L493-Y497 WeakPolarHBondContact O-CD2 3.3Å; L493-Y497 PolarHBondContact O-N 3.33Å; L494-Y497 CarbonylContact O-C 3.3Å; L494-Y497 VanDerWaalsContact O-C 3.3Å; D495-Y497 VanDerWaalsContact C-N 3.32Å; D495-Y497 PolarHBondContact O-N 2.91Å; Y497-Y509 HydrophobicContact CD1-CD2 4.44Å; Y497-Y509 HydrophobicContact CD1-CE2 4.06Å; Y497-L512 HydrophobicContact CE1-CD1 4.14Å; Y497-K584 HydrophobicContact CE2-CG 4.03Å; Y497-K584 WeakPolarHBondContact OH-CE 3.47Å; Y497-K584 PolarHBondContact OH-NZ 3.35Å; Y497-I588 HydrophobicContact CD1-CD1 4.2Å; Y497-I588 HydrophobicContact CD1-CG1 3.61Å; Y497-I588 HydrophobicContact CD2-CG1 4.25Å; Y497-I588 HydrophobicContact CE1-CD1 3.81Å; Y497-I588 HydrophobicContact CE1-CG1 3.77Å; Y497-I588 HydrophobicContact CE2-CG1 4.43Å; Y497-I588 HydrophobicContact CG-CG1 3.91Å; Y497-R591 PolarHBondContact O-NE 3.16Å; Y497-R591 PolarHBondContact O-NH2 3.31Å
498	P	92.8	Very high	87.1	Confident	62 Å²	62	81.3 Å²	81.3	40%	0.403	44%	0.436	S	S	.	.			trans	-59.5	176.4	-179.9	22.2	-33.2	0	0	0	114.5	E496 I500 Y509 R591	E496-P498 VanDerWaalsContact O-CD 3.27Å; E496-P498 WeakPolarHBondContact O-CD 3.33Å; P498-I500 PolarHBondContact O-N 3.36Å; P498-Y509 WeakPolarHBondContact CD-OH 3.23Å; P498-Y509 WeakPolarHBondContact CG-OH 3.5Å; P498-Y509 PolarHBondContact O-OH 2.96Å; P498-Y509 VanDerWaalsContact O-OH 3.05Å; P498-R591 VanDerWaalsContact O-CD 3.31Å; P498-R591 WeakPolarHBondContact O-CD 3.3Å; P498-R591 PolarHBondContact O-NE 3.32Å; P498-R591 VanDerWaalsContact O-NE 3.15Å
499	V	93.2	Very high	89	Confident	73 Å²	73	75.8 Å²	75.8	44%	0.442	40%	0.399	S	S	.	.			trans	-67	123.8	173.2	177.7	0	0	0	0	108.4	E501 R591	V499-E501 PolarHBondContact O-N 2.86Å; V499-R591 VanDerWaalsContact CG2-NH1 3.35Å
500	I	94.1	Very high	90.5	Very high	1 Å²	1	76.9 Å²	76.9	1%	0.005	40%	0.4	C	S	.	.			trans	-67	133.3	178.5	-55.8	165.7	0	0	0	109.5	P498 T502 E505 R506 Y509 R591 V592 F595 R598	P498-I500 PolarHBondContact O-N 3.36Å; I500-T502 WeakPolarHBondContact CG2-O 3.33Å; I500-E505 VanDerWaalsContact CA-OE2 3.29Å; I500-E505 WeakPolarHBondContact CA-OE2 3.22Å; I500-E505 HydrophobicContact CB-CG 4.49Å; I500-E505 HydrophobicContact CG1-CG 4.43Å; I500-E505 HydrophobicContact CG2-CB 3.88Å; I500-E505 HydrophobicContact CG2-CG 3.92Å; I500-R506 HydrophobicContact CG2-CB 3.92Å; I500-Y509 HydrophobicContact CD1-CD2 3.63Å; I500-Y509 HydrophobicContact CD1-CE2 4.04Å; I500-Y509 HydrophobicContact CD1-CG 3.91Å; I500-Y509 HydrophobicContact CG1-CD1 4.37Å; I500-Y509 HydrophobicContact CG1-CD2 3.79Å; I500-Y509 HydrophobicContact CG1-CE1 4.27Å; I500-Y509 HydrophobicContact CG1-CE2 3.67Å; I500-Y509 HydrophobicContact CG1-CG 4.12Å; I500-R591 HydrophobicContact CD1-CB 3.89Å; I500-R591 HydrophobicContact CG1-CB 4.11Å; I500-V592 HydrophobicContact CD1-CB 4.48Å; I500-V592 HydrophobicContact CD1-CG2 3.91Å; I500-F595 HydrophobicContact CB-CB 4.05Å; I500-F595 HydrophobicContact CB-CD2 3.65Å; I500-F595 HydrophobicContact CB-CE2 4.38Å; I500-F595 HydrophobicContact CB-CG 4.1Å; I500-F595 HydrophobicContact CD1-CB 4.15Å; I500-F595 HydrophobicContact CG2-CB 4.35Å; I500-F595 HydrophobicContact CG2-CD2 3.29Å; I500-F595 HydrophobicContact CG2-CE2 3.57Å; I500-F595 HydrophobicContact CG2-CG 3.88Å; I500-F595 HydrophobicContact CG2-CZ 4.36Å; I500-F595 WeakPolarHBondContact O-CD2 3.41Å; I500-R598 PolarHBondContact O-NH2 2.64Å
501	E	92.6	Very high	91.7	Very high	152 Å²	152	78.6 Å²	78.6	71%	0.71	41%	0.406	S	S	*	.			trans	-111.3	-24	177.9	-66	-174.8	169.6	0	0	113.5	V499 E505	V499-E501 PolarHBondContact O-N 2.86Å; E501-E505 PolarHBondContact N-OE2 2.97Å
502	T	94.2	Very high	92.6	Very high	71 Å²	71	77.1 Å²	77.1	44%	0.436	39%	0.389	S	S	.	.	S	Bend	trans	-127.3	154.9	-174.9	67.7	0	0	0	0	113.7	I500 Q504 E505 R506 F595	I500-T502 WeakPolarHBondContact CG2-O 3.33Å; T502-Q504 PolarHBondContact O-N 2.81Å; T502-E505 PolarHBondContact O-N 3.24Å; T502-E505 WeakPolarHBondContact OG1-CB 3.4Å; T502-E505 PolarHBondContact OG1-N 3.14Å; T502-E505 VanDerWaalsContact OG1-N 3.14Å; T502-R506 PolarHBondContact O-N 2.62Å; T502-F595 WeakPolarHBondContact O-CE2 3.16Å
503	L	93.2	Very high	93.2	Very high	110 Å²	110	76.2 Å²	76.2	58%	0.576	37%	0.374	S	S	*	.	H	α-helix	trans	-59.4	-33.1	173.2	-76.5	167.9	0	0	0	112.9	R506 Q507 F595	L503-R506 PolarHBondContact O-N 2.9Å; L503-Q507 WeakPolarHBondContact O-CG 3.33Å; L503-Q507 PolarHBondContact O-N 2.89Å; L503-F595 HydrophobicContact CD2-CE1 3.82Å; L503-F595 HydrophobicContact CD2-CZ 3.91Å; L503-F595 HydrophobicContact CG-CZ 4.11Å
504	Q	94.5	Very high	93.7	Very high	158 Å²	158	78.8 Å²	78.8	74%	0.738	39%	0.388	S	S	*	.	H	α-helix	trans	-66.5	-44.4	175.9	-65.8	-178.4	-2.4	0	0	111.3	T502 R506 Q507 K508	T502-Q504 PolarHBondContact O-N 2.81Å; Q504-R506 VanDerWaalsContact C-N 3.33Å; Q504-R506 PolarHBondContact O-N 3.15Å; Q504-Q507 WeakPolarHBondContact O-CB 3.36Å; Q504-Q507 PolarHBondContact O-N 2.99Å; Q504-K508 PolarHBondContact O-N 3.19Å
505	E	94.8	Very high	94.3	Very high	43 Å²	43	83 Å²	83	20%	0.201	40%	0.401	C	S	.	.	H	α-helix	trans	-65.1	-37.7	174.7	-175.5	-178	-160.7	0	0	111.6	I500 E501 T502 Q507 K508 Y509	I500-E505 VanDerWaalsContact CA-OE2 3.29Å; I500-E505 WeakPolarHBondContact CA-OE2 3.22Å; I500-E505 HydrophobicContact CB-CG 4.49Å; I500-E505 HydrophobicContact CG1-CG 4.43Å; I500-E505 HydrophobicContact CG2-CB 3.88Å; I500-E505 HydrophobicContact CG2-CG 3.92Å; E501-E505 PolarHBondContact N-OE2 2.97Å; T502-E505 PolarHBondContact O-N 3.24Å; T502-E505 WeakPolarHBondContact OG1-CB 3.4Å; T502-E505 PolarHBondContact OG1-N 3.14Å; T502-E505 VanDerWaalsContact OG1-N 3.14Å; E505-Q507 VanDerWaalsContact C-N 3.3Å; E505-Q507 PolarHBondContact O-N 2.93Å; E505-K508 WeakPolarHBondContact O-CB 3.44Å; E505-K508 PolarHBondContact O-N 3.33Å; E505-Y509 HydrophobicContact CG-CD1 3.89Å; E505-Y509 HydrophobicContact CG-CE1 3.52Å; E505-Y509 WeakPolarHBondContact O-CD1 3.15Å; E505-Y509 PolarHBondContact O-N 3.19Å; E505-Y509 WeakPolarHBondContact OE1-CE1 3.47Å; E505-Y509 PolarHBondContact OE1-OH 3.16Å
506	R	95.7	Very high	94.7	Very high	61 Å²	61	76.9 Å²	76.9	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-60.9	-37	172.7	-171.2	-107.6	-172.8	-129	-1.2	112.9	I500 T502 L503 Q504 K510 V592 F595 D596	I500-R506 HydrophobicContact CG2-CB 3.92Å; T502-R506 PolarHBondContact O-N 2.62Å; L503-R506 PolarHBondContact O-N 2.9Å; Q504-R506 VanDerWaalsContact C-N 3.33Å; Q504-R506 PolarHBondContact O-N 3.15Å; R506-K510 PolarHBondContact O-N 2.92Å; R506-V592 HydrophobicContact CG-CG1 4.28Å; R506-F595 HydrophobicContact CB-CD1 3.85Å; R506-F595 HydrophobicContact CB-CE1 3.58Å; R506-F595 HydrophobicContact CB-CE2 4.4Å; R506-F595 HydrophobicContact CB-CG 4.35Å; R506-F595 HydrophobicContact CB-CZ 3.85Å; R506-F595 HydrophobicContact CG-CD1 3.53Å; R506-F595 HydrophobicContact CG-CE1 3.62Å; R506-F595 HydrophobicContact CG-CG 4.25Å; R506-F595 HydrophobicContact CG-CZ 4.39Å; R506-D596 IonicContact CZ-OD1 2.63Å; R506-D596 IonicContact CZ-OD2 2.9Å; R506-D596 IonicContact NE-OD1 3.22Å; R506-D596 PolarHBondContact NE-OD1 3.4Å; R506-D596 IonicContact NE-OD2 2.7Å; R506-D596 IonicContact NH2-OD1 3.2Å; R506-D596 PolarHBondContact NH2-OD1 3.43Å; R506-D596 IonicContact NH2-OD2 3.94Å; R506-D596 PolarHBondContact NH2-OD2 3.41Å
507	Q	95.4	Very high	95	Very high	114 Å²	114	74.2 Å²	74.2	53%	0.533	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-48	172.9	-72.4	171.9	-0.3	0	0	111.2	L503 Q504 E505 Y509 K510 E511	L503-Q507 WeakPolarHBondContact O-CG 3.33Å; L503-Q507 PolarHBondContact O-N 2.89Å; Q504-Q507 WeakPolarHBondContact O-CB 3.36Å; Q504-Q507 PolarHBondContact O-N 2.99Å; E505-Q507 VanDerWaalsContact C-N 3.3Å; E505-Q507 PolarHBondContact O-N 2.93Å; Q507-Y509 VanDerWaalsContact C-N 3.29Å; Q507-Y509 PolarHBondContact O-N 3.48Å; Q507-K510 WeakPolarHBondContact O-CA 3.26Å; Q507-K510 WeakPolarHBondContact O-CB 3.12Å; Q507-K510 PolarHBondContact O-N 3.15Å; Q507-E511 PolarHBondContact O-N 3.02Å
508	K	96.2	Very high	95.2	Very high	125 Å²	125	77 Å²	77	54%	0.543	37%	0.374	S	S	.	.	H	α-helix	trans	-54.1	-42.2	174.1	-179.8	-176	177.6	-174	0	112.5	Q504 E505 E511 L512	Q504-K508 PolarHBondContact O-N 3.19Å; E505-K508 WeakPolarHBondContact O-CB 3.44Å; E505-K508 PolarHBondContact O-N 3.33Å; K508-E511 PolarHBondContact O-N 3.21Å; K508-L512 HydrophobicContact CG-CD1 4.33Å; K508-L512 VanDerWaalsContact O-CG 3.27Å; K508-L512 WeakPolarHBondContact O-CG 3.36Å; K508-L512 PolarHBondContact O-N 3.26Å
509	Y	96.7	Very high	95.3	Very high	8 Å²	8	78.7 Å²	78.7	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-67.1	-37.2	177.5	-84.5	49.7	0	0	0	111.8	Y497 P498 I500 E505 Q507 L512 F513 I588 R591	Y497-Y509 HydrophobicContact CD1-CD2 4.44Å; Y497-Y509 HydrophobicContact CD1-CE2 4.06Å; P498-Y509 WeakPolarHBondContact CD-OH 3.23Å; P498-Y509 WeakPolarHBondContact CG-OH 3.5Å; P498-Y509 PolarHBondContact O-OH 2.96Å; P498-Y509 VanDerWaalsContact O-OH 3.05Å; I500-Y509 HydrophobicContact CD1-CD2 3.63Å; I500-Y509 HydrophobicContact CD1-CE2 4.04Å; I500-Y509 HydrophobicContact CD1-CG 3.91Å; I500-Y509 HydrophobicContact CG1-CD1 4.37Å; I500-Y509 HydrophobicContact CG1-CD2 3.79Å; I500-Y509 HydrophobicContact CG1-CE1 4.27Å; I500-Y509 HydrophobicContact CG1-CE2 3.67Å; I500-Y509 HydrophobicContact CG1-CG 4.12Å; E505-Y509 HydrophobicContact CG-CD1 3.89Å; E505-Y509 HydrophobicContact CG-CE1 3.52Å; E505-Y509 WeakPolarHBondContact O-CD1 3.15Å; E505-Y509 PolarHBondContact O-N 3.19Å; E505-Y509 WeakPolarHBondContact OE1-CE1 3.47Å; E505-Y509 PolarHBondContact OE1-OH 3.16Å; Q507-Y509 VanDerWaalsContact C-N 3.29Å; Q507-Y509 PolarHBondContact O-N 3.48Å; Y509-L512 PolarHBondContact O-N 2.76Å; Y509-F513 PolarHBondContact O-N 3.44Å; Y509-I588 HydrophobicContact CD2-CG2 4.22Å; Y509-I588 VanDerWaalsContact O-CG2 3.23Å; Y509-I588 WeakPolarHBondContact O-CG2 3.14Å; Y509-R591 HydrophobicContact CD2-CB 4.02Å; Y509-R591 HydrophobicContact CE2-CB 3.87Å; Y509-R591 HydrophobicContact CE2-CG 4.11Å
510	K	95.2	Very high	95.4	Very high	100 Å²	100	75.4 Å²	75.4	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-44.6	172.3	-175.3	-171.9	174.8	-65.7	0	111.5	R506 Q507 L512 F513 D514	R506-K510 PolarHBondContact O-N 2.92Å; Q507-K510 WeakPolarHBondContact O-CA 3.26Å; Q507-K510 WeakPolarHBondContact O-CB 3.12Å; Q507-K510 PolarHBondContact O-N 3.15Å; K510-L512 VanDerWaalsContact C-N 3.34Å; K510-L512 PolarHBondContact O-N 3.36Å; K510-F513 WeakPolarHBondContact O-CB 3.39Å; K510-F513 PolarHBondContact O-N 3.32Å; K510-D514 IonicContact NZ-OD2 3.66Å; K510-D514 PolarHBondContact NZ-OD2 3.45Å; K510-D514 VanDerWaalsContact O-CG 3.29Å; K510-D514 PolarHBondContact O-N 3.42Å
511	E	96.6	Very high	95.4	Very high	127 Å²	127	79.1 Å²	79.1	59%	0.593	37%	0.374	S	S	*	.	H	α-helix	trans	-61.8	-41.1	176.9	-68.6	168.6	-175.1	0	0	112.2	Q507 K508 F513 D514 R515	Q507-E511 PolarHBondContact O-N 3.02Å; K508-E511 PolarHBondContact O-N 3.21Å; E511-F513 VanDerWaalsContact C-N 3.34Å; E511-F513 PolarHBondContact O-N 3.02Å; E511-D514 PolarHBondContact O-N 3.25Å; E511-R515 VanDerWaalsContact O-CB 3.29Å; E511-R515 WeakPolarHBondContact O-CB 3.43Å; E511-R515 PolarHBondContact O-N 2.88Å
512	L	95.8	Very high	95.5	Very high	33 Å²	33	78.8 Å²	78.8	17%	0.173	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-39	174.5	-68.7	170.5	0	0	0	112.1	Y497 K508 Y509 K510 R515 D516 I588	Y497-L512 HydrophobicContact CE1-CD1 4.14Å; K508-L512 HydrophobicContact CG-CD1 4.33Å; K508-L512 VanDerWaalsContact O-CG 3.27Å; K508-L512 WeakPolarHBondContact O-CG 3.36Å; K508-L512 PolarHBondContact O-N 3.26Å; Y509-L512 PolarHBondContact O-N 2.76Å; K510-L512 VanDerWaalsContact C-N 3.34Å; K510-L512 PolarHBondContact O-N 3.36Å; L512-R515 VanDerWaalsContact CD2-NH1 3.31Å; L512-D516 PolarHBondContact O-N 3.11Å; L512-I588 HydrophobicContact CB-CD1 4.25Å
513	F	97.3	Very high	95.4	Very high	42 Å²	42	77.2 Å²	77.2	18%	0.184	36%	0.357	C	S	.	.	H	α-helix	trans	-63	-52.2	172.4	-173.1	-81.8	0	0	0	111.1	Y509 K510 E511 R515 D516 Y517 L585 I588 K589	Y509-F513 PolarHBondContact O-N 3.44Å; K510-F513 WeakPolarHBondContact O-CB 3.39Å; K510-F513 PolarHBondContact O-N 3.32Å; E511-F513 VanDerWaalsContact C-N 3.34Å; E511-F513 PolarHBondContact O-N 3.02Å; F513-R515 VanDerWaalsContact C-N 3.27Å; F513-R515 PolarHBondContact O-N 2.79Å; F513-D516 PolarHBondContact O-N 3.3Å; F513-D516 VanDerWaalsContact O-N 3.15Å; F513-Y517 AromaticContact CE1-CD2 3.87Å; F513-Y517 HydrophobicContact CE1-CD2 3.87Å; F513-Y517 AromaticContact CE1-CG 3.96Å; F513-Y517 HydrophobicContact CE1-CG 3.96Å; F513-Y517 AromaticContact CZ-CD2 3.96Å; F513-Y517 HydrophobicContact CZ-CD2 3.96Å; F513-Y517 HydrophobicContact CZ-CG 4.49Å; F513-Y517 VanDerWaalsContact O-CB 3.24Å; F513-Y517 WeakPolarHBondContact O-CB 3.4Å; F513-Y517 PolarHBondContact O-N 2.92Å; F513-L585 HydrophobicContact CB-CD2 4.44Å; F513-L585 HydrophobicContact CD1-CD2 4.49Å; F513-L585 HydrophobicContact CD2-CB 4.23Å; F513-L585 HydrophobicContact CD2-CD2 3.53Å; F513-L585 HydrophobicContact CD2-CG 4.47Å; F513-L585 HydrophobicContact CE2-CB 3.86Å; F513-L585 HydrophobicContact CE2-CD2 3.77Å; F513-L585 HydrophobicContact CE2-CG 4.34Å; F513-L585 HydrophobicContact CG-CD2 3.92Å; F513-L585 HydrophobicContact CZ-CD2 4.34Å; F513-I588 HydrophobicContact CB-CG2 4.02Å; F513-I588 HydrophobicContact CD2-CG2 4.39Å; F513-K589 HydrophobicContact CE2-CB 4.21Å
514	D	95.8	Very high	95.3	Very high	78 Å²	78	75.9 Å²	75.9	42%	0.417	35%	0.345	S	S	.	.	H	α-helix	trans	-63.1	-32.3	-177.5	-67.8	-22.5	0	0	0	112.4	K510 E511 P518	K510-D514 IonicContact NZ-OD2 3.66Å; K510-D514 PolarHBondContact NZ-OD2 3.45Å; K510-D514 VanDerWaalsContact O-CG 3.29Å; K510-D514 PolarHBondContact O-N 3.42Å; E511-D514 PolarHBondContact O-N 3.25Å; D514-P518 WeakPolarHBondContact O-CD 3.5Å
515	R	96.7	Very high	95.2	Very high	128 Å²	128	69.9 Å²	69.9	48%	0.483	33%	0.326	S	S	.	.	H	α-helix	trans	-68.7	-39.1	174	-174.3	-162.9	70.1	-161.9	-9.2	113.2	E511 L512 F513	E511-R515 VanDerWaalsContact O-CB 3.29Å; E511-R515 WeakPolarHBondContact O-CB 3.43Å; E511-R515 PolarHBondContact O-N 2.88Å; L512-R515 VanDerWaalsContact CD2-NH1 3.31Å; F513-R515 VanDerWaalsContact C-N 3.27Å; F513-R515 PolarHBondContact O-N 2.79Å
516	D	94.5	Very high	95	Very high	4 Å²	4	73.3 Å²	73.3	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-96.4	-21.3	-172.4	-70.9	-13.6	0	0	0	112.6	L512 F513 K519 Y520 I581 K584 L585	L512-D516 PolarHBondContact O-N 3.11Å; F513-D516 PolarHBondContact O-N 3.3Å; F513-D516 VanDerWaalsContact O-N 3.15Å; D516-K519 WeakPolarHBondContact O-CB 3.31Å; D516-K519 PolarHBondContact O-N 3.2Å; D516-K519 VanDerWaalsContact O-N 3.07Å; D516-K519 IonicContact OD1-NZ 2.8Å; D516-K519 PolarHBondContact OD1-NZ 3.46Å; D516-Y520 PolarHBondContact O-N 3.43Å; D516-I581 HydrophobicContact CB-CD1 4.17Å; D516-I581 HydrophobicContact CB-CG1 4.48Å; D516-I581 WeakPolarHBondContact O-CD1 3.42Å; D516-K584 IonicContact OD2-NZ 3.59Å; D516-K584 PolarHBondContact OD2-NZ 2.74Å; D516-L585 HydrophobicContact CB-CD2 4.2Å
517	Y	96.5	Very high	94.7	Very high	53 Å²	53	70.4 Å²	70.4	21%	0.208	33%	0.329	C	S	.	.	H	α-helix	trans	-58.6	-40.3	177.1	-177.1	-109.4	0	0	0	114.8	Y372 F513 K519 Y520 L521 L585	Y372-Y517 HydrophobicContact CD1-CE2 4.3Å; F513-Y517 AromaticContact CE1-CD2 3.87Å; F513-Y517 HydrophobicContact CE1-CD2 3.87Å; F513-Y517 AromaticContact CE1-CG 3.96Å; F513-Y517 HydrophobicContact CE1-CG 3.96Å; F513-Y517 AromaticContact CZ-CD2 3.96Å; F513-Y517 HydrophobicContact CZ-CD2 3.96Å; F513-Y517 HydrophobicContact CZ-CG 4.49Å; F513-Y517 VanDerWaalsContact O-CB 3.24Å; F513-Y517 WeakPolarHBondContact O-CB 3.4Å; F513-Y517 PolarHBondContact O-N 2.92Å; Y517-K519 PolarHBondContact O-N 2.99Å; Y517-Y520 HydrophobicContact CD2-CD1 4.05Å; Y517-Y520 AromaticContact CE2-CD1 3.93Å; Y517-Y520 HydrophobicContact CE2-CD1 3.93Å; Y517-Y520 HydrophobicContact CE2-CE1 4.25Å; Y517-Y520 WeakPolarHBondContact O-CB 3.48Å; Y517-Y520 PolarHBondContact O-N 3.46Å; Y517-L521 HydrophobicContact CD1-CD1 4.05Å; Y517-L521 HydrophobicContact CD1-CG 4.43Å; Y517-L521 HydrophobicContact CE1-CD1 3.62Å; Y517-L521 HydrophobicContact CE1-CD2 4.44Å; Y517-L521 HydrophobicContact CE1-CG 4.07Å; Y517-L521 PolarHBondContact O-N 3.49Å; Y517-L585 HydrophobicContact CD2-CD1 4.29Å
518	P	96.9	Very high	94.4	Very high	75 Å²	75	66.1 Å²	66.1	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-30.4	173.2	-25.7	35.3	0	0	0	113.8	D514 K522	D514-P518 WeakPolarHBondContact O-CD 3.5Å; P518-K522 PolarHBondContact O-N 2.8Å
519	K	95.5	Very high	94.1	Very high	96 Å²	96	62.9 Å²	62.9	42%	0.417	30%	0.302	S	S	.	.	H	α-helix	trans	-71.6	-41.5	176.1	-56.7	168.4	-171.4	166.6	0	110.5	D516 Y517 K522 F523 I581	D516-K519 WeakPolarHBondContact O-CB 3.31Å; D516-K519 PolarHBondContact O-N 3.2Å; D516-K519 VanDerWaalsContact O-N 3.07Å; D516-K519 IonicContact OD1-NZ 2.8Å; D516-K519 PolarHBondContact OD1-NZ 3.46Å; Y517-K519 PolarHBondContact O-N 2.99Å; K519-K522 WeakPolarHBondContact O-CB 3.29Å; K519-K522 PolarHBondContact O-N 3.42Å; K519-F523 HydrophobicContact CB-CE2 4.37Å; K519-F523 WeakPolarHBondContact O-CD2 2.88Å; K519-F523 WeakPolarHBondContact O-CG 3.23Å; K519-F523 PolarHBondContact O-N 3.02Å; K519-F523 VanDerWaalsContact O-N 3.07Å; K519-I581 HydrophobicContact CB-CD1 3.47Å; K519-I581 VanDerWaalsContact CB-CD1 3.47Å; K519-I581 HydrophobicContact CD-CD1 4.13Å; K519-I581 HydrophobicContact CG-CD1 4.43Å
520	Y	95.1	Very high	93.6	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-56.7	-50	171.3	164.8	-100.8	0	0	0	111.3	D369 Y372 D516 Y517 K522 F523 Y524 H578 I581 R582 L585	D369-Y520 PolarHBondContact OD2-OH 3Å; Y372-Y520 HydrophobicContact CD1-CE1 4.06Å; Y372-Y520 HydrophobicContact CE1-CE1 4.41Å; Y372-Y520 HydrophobicContact CG-CE1 4.3Å; D516-Y520 PolarHBondContact O-N 3.43Å; Y517-Y520 HydrophobicContact CD2-CD1 4.05Å; Y517-Y520 AromaticContact CE2-CD1 3.93Å; Y517-Y520 HydrophobicContact CE2-CD1 3.93Å; Y517-Y520 HydrophobicContact CE2-CE1 4.25Å; Y517-Y520 WeakPolarHBondContact O-CB 3.48Å; Y517-Y520 PolarHBondContact O-N 3.46Å; Y520-K522 VanDerWaalsContact C-N 3.28Å; Y520-K522 PolarHBondContact O-N 3.28Å; Y520-F523 PolarHBondContact O-N 3.17Å; Y520-F523 VanDerWaalsContact O-N 3.16Å; Y520-Y524 VanDerWaalsContact O-CB 3.28Å; Y520-Y524 WeakPolarHBondContact O-CB 3.37Å; Y520-Y524 PolarHBondContact O-N 3.33Å; Y520-H578 AromaticContact CE2-NE2 3.55Å; Y520-I581 HydrophobicContact CD2-CG2 4.1Å; Y520-I581 HydrophobicContact CG-CG2 4.48Å; Y520-R582 HydrophobicContact CD2-CB 4.3Å; Y520-R582 HydrophobicContact CE2-CB 4.15Å; Y520-R582 HydrophobicContact CE2-CG 4.31Å; Y520-L585 VanDerWaalsContact CB-CD1 3.46Å; Y520-L585 HydrophobicContact CD1-CD1 4.41Å; Y520-L585 HydrophobicContact CD2-CD1 4.47Å; Y520-L585 HydrophobicContact CG-CD1 3.88Å
521	L	94.6	Very high	93.2	Very high	80 Å²	80	59.2 Å²	59.2	42%	0.419	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-39.2	176.6	-69.8	177.7	0	0	0	112.6	Y517 G525	Y517-L521 HydrophobicContact CD1-CD1 4.05Å; Y517-L521 HydrophobicContact CD1-CG 4.43Å; Y517-L521 HydrophobicContact CE1-CD1 3.62Å; Y517-L521 HydrophobicContact CE1-CD2 4.44Å; Y517-L521 HydrophobicContact CE1-CG 4.07Å; Y517-L521 PolarHBondContact O-N 3.49Å; L521-G525 PolarHBondContact O-N 3.23Å
522	K	94.5	Very high	92.8	Very high	144 Å²	144	58.5 Å²	58.5	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-63.7	-42.3	176.6	-174.1	177.2	-178.2	176.6	0	112.6	P518 K519 Y520 K526	P518-K522 PolarHBondContact O-N 2.8Å; K519-K522 WeakPolarHBondContact O-CB 3.29Å; K519-K522 PolarHBondContact O-N 3.42Å; Y520-K522 VanDerWaalsContact C-N 3.28Å; Y520-K522 PolarHBondContact O-N 3.28Å; K522-K526 PolarHBondContact O-N 2.95Å
523	F	91.7	Very high	92.5	Very high	38 Å²	38	60.3 Å²	60.3	17%	0.167	29%	0.288	C	S	.	.	H	α-helix	trans	-73.2	-44.8	177.3	-58.8	-48.5	0	0	0	111.8	K519 Y520 G525 K526 L527 L574 Q577 H578 I581	K519-F523 HydrophobicContact CB-CE2 4.37Å; K519-F523 WeakPolarHBondContact O-CD2 2.88Å; K519-F523 WeakPolarHBondContact O-CG 3.23Å; K519-F523 PolarHBondContact O-N 3.02Å; K519-F523 VanDerWaalsContact O-N 3.07Å; Y520-F523 PolarHBondContact O-N 3.17Å; Y520-F523 VanDerWaalsContact O-N 3.16Å; F523-G525 VanDerWaalsContact C-N 3.33Å; F523-G525 PolarHBondContact O-N 3.4Å; F523-K526 PolarHBondContact O-N 2.91Å; F523-L527 PolarHBondContact O-N 2.99Å; F523-L527 VanDerWaalsContact O-N 3.08Å; F523-L574 HydrophobicContact CB-CD1 4.05Å; F523-L574 HydrophobicContact CD1-CD1 3.53Å; F523-L574 HydrophobicContact CE1-CD1 4.41Å; F523-L574 HydrophobicContact CG-CD1 4.18Å; F523-Q577 HydrophobicContact CD1-CB 4.36Å; F523-Q577 HydrophobicContact CD2-CB 4.16Å; F523-Q577 HydrophobicContact CE1-CB 4.08Å; F523-Q577 HydrophobicContact CE2-CB 3.89Å; F523-Q577 HydrophobicContact CG-CB 4.4Å; F523-Q577 HydrophobicContact CZ-CB 3.84Å; F523-Q577 HydrophobicContact CZ-CG 4.28Å; F523-H578 HydrophobicContact CB-CB 4.05Å; F523-I581 HydrophobicContact CD2-CG2 4.02Å; F523-I581 HydrophobicContact CE2-CG2 4.5Å
524	Y	91.3	Very high	92	Very high	82 Å²	82	58.8 Å²	58.8	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-57.1	-43.5	175.6	-179.9	-92.8	0	0	0	111.9	L366 Y520 K526 L527 S528 H578	L366-Y524 HydrophobicContact CD1-CE2 4.09Å; L366-Y524 HydrophobicContact CD2-CD2 3.66Å; L366-Y524 HydrophobicContact CD2-CE2 3.73Å; L366-Y524 HydrophobicContact CG-CE2 4.46Å; Y520-Y524 VanDerWaalsContact O-CB 3.28Å; Y520-Y524 WeakPolarHBondContact O-CB 3.37Å; Y520-Y524 PolarHBondContact O-N 3.33Å; Y524-K526 VanDerWaalsContact C-N 3.35Å; Y524-K526 PolarHBondContact O-N 3.27Å; Y524-L527 PolarHBondContact O-N 3.23Å; Y524-S528 WeakPolarHBondContact CD1-OG 3.41Å; Y524-S528 WeakPolarHBondContact CE1-OG 3.45Å; Y524-S528 WeakPolarHBondContact O-CB 3.46Å; Y524-S528 PolarHBondContact O-N 3.16Å; Y524-S528 PolarHBondContact O-OG 2.86Å; Y524-H578 AromaticContact CD2-NE2 3.7Å
525	G	92.1	Very high	91.5	Very high	33 Å²	33	59 Å²	59	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-64.1	-34.5	178.6	0	0	0	0	0	114.1	L521 F523 T529	L521-G525 PolarHBondContact O-N 3.23Å; F523-G525 VanDerWaalsContact C-N 3.33Å; F523-G525 PolarHBondContact O-N 3.4Å; G525-T529 PolarHBondContact O-N 3.03Å; G525-T529 PolarHBondContact O-OG1 3.45Å
526	K	91.5	Very high	91.1	Very high	114 Å²	114	57.3 Å²	57.3	50%	0.496	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-52.9	172.3	-72.4	-177.4	171.1	-164.6	0	111.2	K522 F523 Y524 S528 T529 I530 L574	K522-K526 PolarHBondContact O-N 2.95Å; F523-K526 PolarHBondContact O-N 2.91Å; Y524-K526 VanDerWaalsContact C-N 3.35Å; Y524-K526 PolarHBondContact O-N 3.27Å; K526-S528 VanDerWaalsContact C-N 3.28Å; K526-S528 PolarHBondContact O-N 2.74Å; K526-T529 WeakPolarHBondContact O-CB 3.35Å; K526-T529 PolarHBondContact O-N 3.29Å; K526-I530 PolarHBondContact O-N 2.76Å; K526-L574 HydrophobicContact CB-CD1 4.3Å; K526-L574 HydrophobicContact CB-CD2 3.72Å; K526-L574 HydrophobicContact CD-CD1 3.86Å; K526-L574 HydrophobicContact CD-CD2 4.11Å
527	L	89.5	Confident	90.7	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-60	-38.8	178.2	-69	172.4	0	0	0	111.9	L365 L366 F523 Y524 T529 I530 A531 L574 R575 H578	L365-L527 HydrophobicContact CD2-CD2 4.37Å; L366-L527 HydrophobicContact CD2-CB 3.65Å; L366-L527 HydrophobicContact CD2-CD1 4.18Å; L366-L527 HydrophobicContact CG-CB 4.16Å; F523-L527 PolarHBondContact O-N 2.99Å; F523-L527 VanDerWaalsContact O-N 3.08Å; Y524-L527 PolarHBondContact O-N 3.23Å; L527-T529 VanDerWaalsContact C-N 3.27Å; L527-T529 PolarHBondContact O-N 2.95Å; L527-I530 PolarHBondContact O-N 2.97Å; L527-A531 VanDerWaalsContact O-CB 3.32Å; L527-A531 WeakPolarHBondContact O-CB 3.34Å; L527-A531 PolarHBondContact O-N 3.39Å; L527-L574 HydrophobicContact CD2-CD2 3.85Å; L527-L574 HydrophobicContact CD2-CG 4.04Å; L527-L574 HydrophobicContact CG-CD2 4.08Å; L527-L574 HydrophobicContact CG-CG 4.13Å; L527-R575 HydrophobicContact CD2-CG 3.9Å; L527-H578 HydrophobicContact CD1-CB 3.56Å
528	S	87.9	Confident	90.1	Very high	23 Å²	23	55.7 Å²	55.7	16%	0.161	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-31.1	174.8	-63.8	0	0	0	0	113.4	L366 Y524 K526 R532	L366-S528 WeakPolarHBondContact CD1-OG 3.23Å; Y524-S528 WeakPolarHBondContact CD1-OG 3.41Å; Y524-S528 WeakPolarHBondContact CE1-OG 3.45Å; Y524-S528 WeakPolarHBondContact O-CB 3.46Å; Y524-S528 PolarHBondContact O-N 3.16Å; Y524-S528 PolarHBondContact O-OG 2.86Å; K526-S528 VanDerWaalsContact C-N 3.28Å; K526-S528 PolarHBondContact O-N 2.74Å; S528-R532 WeakPolarHBondContact O-CB 3.38Å; S528-R532 PolarHBondContact O-N 3.33Å
529	T	90	Very high	89.6	Confident	57 Å²	57	56.4 Å²	56.4	35%	0.35	28%	0.276	S	S	.	.	H	α-helix	trans	-70.7	-43.5	177.3	-66.1	0	0	0	0	111	G525 K526 L527 R532 E533	G525-T529 PolarHBondContact O-N 3.03Å; G525-T529 PolarHBondContact O-OG1 3.45Å; K526-T529 WeakPolarHBondContact O-CB 3.35Å; K526-T529 PolarHBondContact O-N 3.29Å; L527-T529 VanDerWaalsContact C-N 3.27Å; L527-T529 PolarHBondContact O-N 2.95Å; T529-R532 WeakPolarHBondContact O-CB 3.2Å; T529-R532 PolarHBondContact O-N 3.44Å; T529-R532 PolarHBondContact OG1-NH2 2.89Å; T529-E533 PolarHBondContact O-N 3.13Å; T529-E533 VanDerWaalsContact O-N 3.13Å
530	I	87.2	Confident	89.3	Confident	27 Å²	27	57 Å²	57	14%	0.138	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-42.1	176.4	-57.9	171.3	0	0	0	110.9	L365 K526 L527 R532 E533 F534 F565 L571	L365-I530 HydrophobicContact CD1-CG2 4.37Å; L365-I530 HydrophobicContact CD2-CG2 4.18Å; K526-I530 PolarHBondContact O-N 2.76Å; L527-I530 PolarHBondContact O-N 2.97Å; I530-R532 PolarHBondContact O-N 3.14Å; I530-E533 PolarHBondContact O-N 3.28Å; I530-F534 HydrophobicContact CG2-CD2 3.97Å; I530-F534 HydrophobicContact CG2-CE2 3.7Å; I530-F534 VanDerWaalsContact O-CD2 3.3Å; I530-F534 WeakPolarHBondContact O-CD2 3.25Å; I530-F534 PolarHBondContact O-N 3.47Å; I530-F565 HydrophobicContact CB-CE2 4.49Å; I530-F565 HydrophobicContact CD1-CD2 4.39Å; I530-F565 HydrophobicContact CD1-CE2 3.88Å; I530-F565 HydrophobicContact CG2-CD2 3.57Å; I530-F565 HydrophobicContact CG2-CE2 3.66Å; I530-L571 HydrophobicContact CD1-CD1 4.29Å; I530-L571 HydrophobicContact CD1-CD2 3.43Å; I530-L571 VanDerWaalsContact CD1-CD2 3.43Å; I530-L571 HydrophobicContact CD1-CG 4.5Å
531	A	87.1	Confident	88.8	Confident	4 Å²	4	58 Å²	58	3%	0.033	28%	0.284	C	S	.	.	H	α-helix	trans	-56.8	-36.7	173.2	0	0	0	0	0	112.1	L362 L365 L366 L527 L535	L362-A531 HydrophobicContact CD1-CB 3.69Å; L362-A531 WeakPolarHBondContact CD1-O 3.48Å; L365-A531 HydrophobicContact CB-CB 4.45Å; L365-A531 HydrophobicContact CD1-CB 4.13Å; L366-A531 HydrophobicContact CD1-CB 4.07Å; L527-A531 VanDerWaalsContact O-CB 3.32Å; L527-A531 WeakPolarHBondContact O-CB 3.34Å; L527-A531 PolarHBondContact O-N 3.39Å; A531-L535 WeakPolarHBondContact O-CG 3.38Å; A531-L535 PolarHBondContact O-N 2.7Å
532	R	88.1	Confident	88.4	Confident	113 Å²	113	61.1 Å²	61.1	43%	0.426	29%	0.29	S	S	.	.	H	α-helix	trans	-67.6	-43	175.3	-155.8	-169.1	-47.7	100.6	7.3	112.6	S528 T529 I530 F534 L535 E536	S528-R532 WeakPolarHBondContact O-CB 3.38Å; S528-R532 PolarHBondContact O-N 3.33Å; T529-R532 WeakPolarHBondContact O-CB 3.2Å; T529-R532 PolarHBondContact O-N 3.44Å; T529-R532 PolarHBondContact OG1-NH2 2.89Å; I530-R532 PolarHBondContact O-N 3.14Å; R532-F534 VanDerWaalsContact C-N 3.32Å; R532-F534 PolarHBondContact O-N 3.2Å; R532-L535 WeakPolarHBondContact O-CB 3.5Å; R532-L535 PolarHBondContact O-N 2.95Å; R532-L535 VanDerWaalsContact O-N 3.11Å; R532-E536 WeakPolarHBondContact CD-OE1 3.35Å; R532-E536 WeakPolarHBondContact CG-OE1 3.3Å; R532-E536 WeakPolarHBondContact O-CG 3.4Å; R532-E536 PolarHBondContact O-N 3.45Å
533	E	88.3	Confident	88.1	Confident	70 Å²	70	60.7 Å²	60.7	33%	0.327	29%	0.291	S	S	.	.	H	α-helix	trans	-58.5	-43.1	175.9	-68.8	178.2	-144.1	0	0	112.2	T529 I530 L535 E536 L537 R561	T529-E533 PolarHBondContact O-N 3.13Å; T529-E533 VanDerWaalsContact O-N 3.13Å; I530-E533 PolarHBondContact O-N 3.28Å; E533-L535 VanDerWaalsContact C-N 3.35Å; E533-E536 PolarHBondContact O-N 3.43Å; E533-L537 WeakPolarHBondContact O-CG 3.36Å; E533-L537 PolarHBondContact O-N 2.93Å; E533-R561 IonicContact OE2-CZ 2.67Å; E533-R561 IonicContact OE2-NH1 3.98Å; E533-R561 PolarHBondContact OE2-NH1 3.49Å
534	F	86.5	Confident	88	Confident	10 Å²	10	59.8 Å²	59.8	4%	0.044	29%	0.288	C	S	.	.	H	α-helix	trans	-68.6	-32.4	175.9	-75.4	-68.2	0	0	0	112.9	I361 L365 I530 R532 G538 R561 Y562 F565	I361-F534 HydrophobicContact CG2-CB 4.46Å; I361-F534 HydrophobicContact CG2-CD1 4.35Å; I361-F534 HydrophobicContact CG2-CD2 4.03Å; I361-F534 HydrophobicContact CG2-CE2 4.36Å; I361-F534 HydrophobicContact CG2-CG 4.03Å; L365-F534 HydrophobicContact CD1-CD2 3.83Å; L365-F534 HydrophobicContact CD1-CE2 4.31Å; I530-F534 HydrophobicContact CG2-CD2 3.97Å; I530-F534 HydrophobicContact CG2-CE2 3.7Å; I530-F534 VanDerWaalsContact O-CD2 3.3Å; I530-F534 WeakPolarHBondContact O-CD2 3.25Å; I530-F534 PolarHBondContact O-N 3.47Å; R532-F534 VanDerWaalsContact C-N 3.32Å; R532-F534 PolarHBondContact O-N 3.2Å; F534-G538 PolarHBondContact O-N 3.32Å; F534-R561 HydrophobicContact CE1-CB 4Å; F534-R561 HydrophobicContact CZ-CB 4.14Å; F534-Y562 HydrophobicContact CZ-CD2 4.41Å; F534-F565 HydrophobicContact CE2-CB 4.34Å; F534-F565 HydrophobicContact CE2-CD2 4.31Å; F534-F565 HydrophobicContact CE2-CG 4.2Å; F534-F565 HydrophobicContact CZ-CB 4.1Å; F534-F565 HydrophobicContact CZ-CG 4.42Å
535	L	85.4	Confident	87.8	Confident	83 Å²	83	62.2 Å²	62.2	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-53.9	170.4	-76.1	162.9	0	0	0	110.5	L362 A531 R532 E533 L537 G538 E539	L362-L535 HydrophobicContact CD1-CD1 3.82Å; L362-L535 HydrophobicContact CD1-CD2 4.21Å; L362-L535 HydrophobicContact CD1-CG 3.73Å; L362-L535 HydrophobicContact CD2-CD1 4.24Å; L362-L535 HydrophobicContact CD2-CD2 4.24Å; L362-L535 HydrophobicContact CD2-CG 4.48Å; A531-L535 WeakPolarHBondContact O-CG 3.38Å; A531-L535 PolarHBondContact O-N 2.7Å; R532-L535 WeakPolarHBondContact O-CB 3.5Å; R532-L535 PolarHBondContact O-N 2.95Å; R532-L535 VanDerWaalsContact O-N 3.11Å; E533-L535 VanDerWaalsContact C-N 3.35Å; L535-L537 PolarHBondContact O-N 3.26Å; L535-G538 CarbonylContact O-C 3.52Å; L535-G538 WeakPolarHBondContact O-CA 3.19Å; L535-G538 PolarHBondContact O-N 3.03Å; L535-E539 WeakPolarHBondContact O-CG 3.34Å; L535-E539 PolarHBondContact O-N 3.49Å
536	E	89.3	Confident	87.4	Confident	92 Å²	92	67.9 Å²	67.9	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-56.1	-44.4	-179.8	-72.4	168.9	-154.1	0	0	112.4	R532 E533 E539 K540	R532-E536 WeakPolarHBondContact CD-OE1 3.35Å; R532-E536 WeakPolarHBondContact CG-OE1 3.3Å; R532-E536 WeakPolarHBondContact O-CG 3.4Å; R532-E536 PolarHBondContact O-N 3.45Å; E533-E536 PolarHBondContact O-N 3.43Å; E536-E539 WeakPolarHBondContact O-CB 3.25Å; E536-E539 PolarHBondContact O-N 3.36Å; E536-K540 WeakPolarHBondContact O-CG 3.23Å; E536-K540 PolarHBondContact O-N 2.85Å
537	L	85.5	Confident	86.9	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.016	33%	0.333	C	S	.	.	H	α-helix	trans	-65.4	-38.1	173.6	-70.3	173.6	0	0	0	112.5	E533 L535 E539 K540 L541 I554 E557 I558	E533-L537 WeakPolarHBondContact O-CG 3.36Å; E533-L537 PolarHBondContact O-N 2.93Å; L535-L537 PolarHBondContact O-N 3.26Å; L537-E539 PolarHBondContact O-N 2.88Å; L537-K540 PolarHBondContact O-N 3.46Å; L537-L541 WeakPolarHBondContact O-CB 3.4Å; L537-L541 PolarHBondContact O-N 3.47Å; L537-I554 HydrophobicContact CD2-CG2 4.49Å; L537-E557 HydrophobicContact CD1-CG 4.2Å; L537-E557 HydrophobicContact CD2-CG 4.25Å; L537-E557 WeakPolarHBondContact CD2-OE2 3.44Å; L537-I558 HydrophobicContact CB-CD1 4Å; L537-I558 HydrophobicContact CB-CG1 3.59Å; L537-I558 HydrophobicContact CD1-CG1 4.01Å; L537-I558 HydrophobicContact CG-CG1 4.36Å
538	G	84.3	Confident	86.9	Confident	20 Å²	20	67.4 Å²	67.4	21%	0.206	35%	0.346	C	S	.	.	H	α-helix	trans	-67.7	-21.7	173.2	0	0	0	0	0	114	F534 L535	F534-G538 PolarHBondContact O-N 3.32Å; L535-G538 CarbonylContact O-C 3.52Å; L535-G538 WeakPolarHBondContact O-CA 3.19Å; L535-G538 PolarHBondContact O-N 3.03Å
539	E	86.4	Confident	87.1	Confident	90 Å²	90	70.4 Å²	70.4	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-78	-50.1	171.5	-51.8	-125.9	92.9	0	0	110.1	L535 E536 L537 L541 R542 E543	L535-E539 WeakPolarHBondContact O-CG 3.34Å; L535-E539 PolarHBondContact O-N 3.49Å; E536-E539 WeakPolarHBondContact O-CB 3.25Å; E536-E539 PolarHBondContact O-N 3.36Å; L537-E539 PolarHBondContact O-N 2.88Å; E539-L541 PolarHBondContact O-N 2.93Å; E539-R542 VanDerWaalsContact CD-NH2 3.33Å; E539-R542 WeakPolarHBondContact O-CA 3.43Å; E539-R542 WeakPolarHBondContact O-CB 3.2Å; E539-R542 PolarHBondContact O-N 3.47Å; E539-R542 IonicContact OE1-CZ 3.11Å; E539-R542 IonicContact OE1-NH1 3.67Å; E539-R542 PolarHBondContact OE1-NH1 3.28Å; E539-R542 IonicContact OE1-NH2 2.74Å; E539-R542 PolarHBondContact OE1-NH2 3.19Å; E539-E543 PolarHBondContact O-N 3.07Å
540	K	90	Very high	87.2	Confident	108 Å²	108	73.6 Å²	73.6	47%	0.47	38%	0.383	S	S	.	.	H	α-helix	trans	-54.8	-48	174.2	-68.1	175.7	-178.2	-179.5	0	112	E536 L537 R542 E543 T544 I554	E536-K540 WeakPolarHBondContact O-CG 3.23Å; E536-K540 PolarHBondContact O-N 2.85Å; L537-K540 PolarHBondContact O-N 3.46Å; K540-R542 PolarHBondContact O-N 2.65Å; K540-E543 PolarHBondContact O-N 3.06Å; K540-T544 PolarHBondContact O-N 2.84Å; K540-T544 PolarHBondContact O-OG1 2.94Å; K540-I554 HydrophobicContact CB-CD1 4.01Å; K540-I554 HydrophobicContact CB-CG2 4.36Å
541	L	83.8	Confident	87.4	Confident	25 Å²	25	73.2 Å²	73.2	13%	0.131	38%	0.38	C	S	.	.	H	α-helix	trans	-59.2	-23.5	177.3	-169.1	70.8	0	0	0	113.5	L537 E539 Y551 I554 E555 I558	L537-L541 WeakPolarHBondContact O-CB 3.4Å; L537-L541 PolarHBondContact O-N 3.47Å; E539-L541 PolarHBondContact O-N 2.93Å; L541-Y551 HydrophobicContact CD1-CD1 4.17Å; L541-Y551 HydrophobicContact CD1-CD2 3.76Å; L541-Y551 HydrophobicContact CD1-CE1 3.99Å; L541-Y551 HydrophobicContact CD1-CE2 3.56Å; L541-Y551 HydrophobicContact CD1-CG 4.05Å; L541-Y551 HydrophobicContact CG-CD2 4.33Å; L541-Y551 HydrophobicContact CG-CE2 3.77Å; L541-Y551 VanDerWaalsContact O-CE2 3.29Å; L541-Y551 WeakPolarHBondContact O-CE2 3.19Å; L541-I554 HydrophobicContact CB-CG2 3.86Å; L541-I554 HydrophobicContact CD1-CB 4.08Å; L541-I554 HydrophobicContact CD1-CG2 4.02Å; L541-E555 HydrophobicContact CD1-CB 3.99Å; L541-I558 HydrophobicContact CB-CD1 4.12Å; L541-I558 HydrophobicContact CD2-CD1 3.83Å; L541-I558 HydrophobicContact CG-CD1 4.41Å
542	R	85.5	Confident	87.5	Confident	147 Å²	147	74.9 Å²	74.9	56%	0.555	39%	0.394	S	S	*	.	H	α-helix	trans	-90.2	-25.6	178.8	176.6	-165.5	66.9	-136.5	3.8	112.2	E539 K540	E539-R542 VanDerWaalsContact CD-NH2 3.33Å; E539-R542 WeakPolarHBondContact O-CA 3.43Å; E539-R542 WeakPolarHBondContact O-CB 3.2Å; E539-R542 PolarHBondContact O-N 3.47Å; E539-R542 IonicContact OE1-CZ 3.11Å; E539-R542 IonicContact OE1-NH1 3.67Å; E539-R542 PolarHBondContact OE1-NH1 3.28Å; E539-R542 IonicContact OE1-NH2 2.74Å; E539-R542 PolarHBondContact OE1-NH2 3.19Å; K540-R542 PolarHBondContact O-N 2.65Å
543	E	88.6	Confident	87.7	Confident	135 Å²	135	71.6 Å²	71.6	63%	0.631	39%	0.391	S	S	*	.	H	α-helix	trans	-85.6	-29	177.1	-76.8	151.9	-150.4	0	0	112.3	E539 K540	E539-E543 PolarHBondContact O-N 3.07Å; K540-E543 PolarHBondContact O-N 3.06Å
544	T	89.5	Confident	87.6	Confident	18 Å²	18	68.9 Å²	68.9	11%	0.11	38%	0.378	C	S	.	.	S	Bend	trans	-79	138.2	177.7	-51.4	0	0	0	0	113.1	K540 Q546 S548 E550 I554	K540-T544 PolarHBondContact O-N 2.84Å; K540-T544 PolarHBondContact O-OG1 2.94Å; T544-Q546 PolarHBondContact O-N 2.96Å; T544-S548 VanDerWaalsContact CG2-OG 3.31Å; T544-S548 WeakPolarHBondContact CG2-OG 3.02Å; T544-E550 HydrophobicContact CG2-CB 3.74Å; T544-E550 HydrophobicContact CG2-CG 3.79Å; T544-I554 HydrophobicContact CG2-CD1 4.35Å; T544-I554 WeakPolarHBondContact OG1-CD1 3.34Å
545	D	86.7	Confident	87.5	Confident	134 Å²	134	70.5 Å²	70.5	72%	0.717	39%	0.386	S	S	*	.			trans	-61.1	129.3	-179.8	-76.3	-48.6	0	0	0	113.7	G547 S548 Y551	D545-G547 PolarHBondContact O-N 3.4Å; D545-G547 VanDerWaalsContact O-N 3.11Å; D545-S548 WeakPolarHBondContact O-CB 3.37Å; D545-S548 PolarHBondContact O-N 2.99Å; D545-S548 VanDerWaalsContact O-N 3.12Å; D545-S548 PolarHBondContact O-OG 3.24Å; D545-Y551 WeakPolarHBondContact O-CB 3.37Å
546	Q	84.1	Confident	87.7	Confident	152 Å²	152	73.5 Å²	73.5	71%	0.71	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	109.9	-179	-66.5	-175.5	22.7	0	0	111.5	T544 Y551	T544-Q546 PolarHBondContact O-N 2.96Å; Q546-Y551 HydrophobicContact CG-CD2 4.21Å; Q546-Y551 HydrophobicContact CG-CE2 3.85Å
547	G	81	Confident	87.7	Confident	66 Å²	66	72.5 Å²	72.5	68%	0.68	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	114	-10	-178.4	0	0	0	0	0	113.9	D545	D545-G547 PolarHBondContact O-N 3.4Å; D545-G547 VanDerWaalsContact O-N 3.11Å
548	S	90.6	Very high	87.7	Confident	38 Å²	38	73.6 Å²	73.6	27%	0.266	39%	0.392	S	S	.	.	S	Bend	trans	-64.6	157	167.7	65	0	0	0	0	112	T544 D545 E550 Y551 A552	T544-S548 VanDerWaalsContact CG2-OG 3.31Å; T544-S548 WeakPolarHBondContact CG2-OG 3.02Å; D545-S548 WeakPolarHBondContact O-CB 3.37Å; D545-S548 PolarHBondContact O-N 2.99Å; D545-S548 VanDerWaalsContact O-N 3.12Å; D545-S548 PolarHBondContact O-OG 3.24Å; S548-E550 PolarHBondContact O-N 3.28Å; S548-Y551 PolarHBondContact O-N 2.93Å; S548-Y551 WeakPolarHBondContact OG-CB 3.34Å; S548-Y551 PolarHBondContact OG-N 3.32Å; S548-A552 PolarHBondContact O-N 3.06Å
549	A	91.2	Very high	87.7	Confident	86 Å²	86	75.7 Å²	75.7	71%	0.711	40%	0.403	S	S	*	.	H	α-helix	trans	-63.3	-31.7	171.9	0	0	0	0	0	112.1	A552 A553	A549-A552 PolarHBondContact O-N 2.97Å; A549-A553 WeakPolarHBondContact O-CB 3.27Å; A549-A553 PolarHBondContact O-N 2.93Å
550	E	91.6	Very high	87.8	Confident	124 Å²	124	73.3 Å²	73.3	58%	0.579	39%	0.393	S	S	*	.	H	α-helix	trans	-66.4	-42.9	176.3	-172.3	-179.3	-169.8	0	0	111.8	T544 S548 A552 A553 I554	T544-E550 HydrophobicContact CG2-CB 3.74Å; T544-E550 HydrophobicContact CG2-CG 3.79Å; S548-E550 PolarHBondContact O-N 3.28Å; E550-A552 VanDerWaalsContact C-N 3.29Å; E550-A552 PolarHBondContact O-N 2.93Å; E550-A553 WeakPolarHBondContact O-CA 3.45Å; E550-A553 WeakPolarHBondContact O-CB 3.46Å; E550-A553 PolarHBondContact O-N 3.37Å; E550-I554 HydrophobicContact CG-CD1 3.95Å; E550-I554 WeakPolarHBondContact O-CG1 3.35Å; E550-I554 PolarHBondContact O-N 2.88Å
551	Y	92.7	Very high	87.7	Confident	20 Å²	20	71.9 Å²	71.9	8%	0.078	39%	0.385	C	S	.	.	H	α-helix	trans	-57.2	-45.7	174.4	-177.7	-79.7	0	0	0	111	L541 D545 Q546 S548 A553 I554 E555	L541-Y551 HydrophobicContact CD1-CD1 4.17Å; L541-Y551 HydrophobicContact CD1-CD2 3.76Å; L541-Y551 HydrophobicContact CD1-CE1 3.99Å; L541-Y551 HydrophobicContact CD1-CE2 3.56Å; L541-Y551 HydrophobicContact CD1-CG 4.05Å; L541-Y551 HydrophobicContact CG-CD2 4.33Å; L541-Y551 HydrophobicContact CG-CE2 3.77Å; L541-Y551 VanDerWaalsContact O-CE2 3.29Å; L541-Y551 WeakPolarHBondContact O-CE2 3.19Å; D545-Y551 WeakPolarHBondContact O-CB 3.37Å; Q546-Y551 HydrophobicContact CG-CD2 4.21Å; Q546-Y551 HydrophobicContact CG-CE2 3.85Å; S548-Y551 PolarHBondContact O-N 2.93Å; S548-Y551 WeakPolarHBondContact OG-CB 3.34Å; S548-Y551 PolarHBondContact OG-N 3.32Å; Y551-A553 VanDerWaalsContact C-N 3.28Å; Y551-A553 PolarHBondContact O-N 2.97Å; Y551-I554 PolarHBondContact O-N 3.47Å; Y551-E555 HydrophobicContact CE1-CB 4.47Å; Y551-E555 WeakPolarHBondContact O-CB 3.46Å; Y551-E555 PolarHBondContact O-N 3.28Å
552	A	87.9	Confident	87.7	Confident	39 Å²	39	74.2 Å²	74.2	32%	0.322	39%	0.392	S	S	.	.	H	α-helix	trans	-68	-26.8	177.1	0	0	0	0	0	113	S548 A549 E550 R556	S548-A552 PolarHBondContact O-N 3.06Å; A549-A552 PolarHBondContact O-N 2.97Å; E550-A552 VanDerWaalsContact C-N 3.29Å; E550-A552 PolarHBondContact O-N 2.93Å; A552-R556 VanDerWaalsContact O-CB 3.3Å; A552-R556 WeakPolarHBondContact O-CB 3.49Å; A552-R556 PolarHBondContact O-N 3Å; A552-R556 VanDerWaalsContact O-N 3.17Å; A552-R556 PolarHBondContact O-NH1 3Å
553	A	92.9	Very high	87.7	Confident	44 Å²	44	73.1 Å²	73.1	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-71.6	-48	173.1	0	0	0	0	0	111.6	A549 E550 Y551 R556 E557	A549-A553 WeakPolarHBondContact O-CB 3.27Å; A549-A553 PolarHBondContact O-N 2.93Å; E550-A553 WeakPolarHBondContact O-CA 3.45Å; E550-A553 WeakPolarHBondContact O-CB 3.46Å; E550-A553 PolarHBondContact O-N 3.37Å; Y551-A553 VanDerWaalsContact C-N 3.28Å; Y551-A553 PolarHBondContact O-N 2.97Å; A553-R556 PolarHBondContact O-N 3.48Å; A553-E557 WeakPolarHBondContact O-CB 3.37Å; A553-E557 PolarHBondContact O-N 3.48Å
554	I	86	Confident	87.5	Confident	12 Å²	12	74.9 Å²	74.9	6%	0.062	39%	0.389	C	S	.	.	H	α-helix	trans	-65.7	-40.6	177.7	-60.1	158.6	0	0	0	110.8	L537 K540 L541 T544 E550 Y551 R556 E557 I558	L537-I554 HydrophobicContact CD2-CG2 4.49Å; K540-I554 HydrophobicContact CB-CD1 4.01Å; K540-I554 HydrophobicContact CB-CG2 4.36Å; L541-I554 HydrophobicContact CB-CG2 3.86Å; L541-I554 HydrophobicContact CD1-CB 4.08Å; L541-I554 HydrophobicContact CD1-CG2 4.02Å; T544-I554 HydrophobicContact CG2-CD1 4.35Å; T544-I554 WeakPolarHBondContact OG1-CD1 3.34Å; E550-I554 HydrophobicContact CG-CD1 3.95Å; E550-I554 WeakPolarHBondContact O-CG1 3.35Å; E550-I554 PolarHBondContact O-N 2.88Å; Y551-I554 PolarHBondContact O-N 3.47Å; I554-R556 VanDerWaalsContact C-N 3.35Å; I554-R556 PolarHBondContact O-N 2.71Å; I554-E557 PolarHBondContact O-N 3.38Å; I554-I558 HydrophobicContact CG2-CD1 3.94Å; I554-I558 HydrophobicContact CG2-CG1 4.45Å; I554-I558 VanDerWaalsContact O-CG1 3.31Å; I554-I558 WeakPolarHBondContact O-CG1 3.32Å; I554-I558 PolarHBondContact O-N 3.19Å
555	E	85.2	Confident	87.2	Confident	45 Å²	45	74.8 Å²	74.8	21%	0.21	39%	0.387	C	S	.	.	H	α-helix	trans	-59.7	-44.9	175.2	-176.8	166.4	-117.6	0	0	111.5	H354 L541 Y551 C559	H354-E555 IonicContact CE1-OE1 2.64Å; H354-E555 PolarHBondContact CE1-OE1 2.61Å; H354-E555 IonicContact CG-OE1 2.62Å; H354-E555 IonicContact ND1-OE1 3.33Å; H354-E555 PolarHBondContact ND1-OE1 3.06Å; H354-E555 IonicContact NE2-OE1 2.71Å; L541-E555 HydrophobicContact CD1-CB 3.99Å; Y551-E555 HydrophobicContact CE1-CB 4.47Å; Y551-E555 WeakPolarHBondContact O-CB 3.46Å; Y551-E555 PolarHBondContact O-N 3.28Å; E555-C559 PolarHBondContact O-N 3.37Å; E555-C559 VanDerWaalsContact O-N 3.11Å; E555-C559 PolarHBondContact O-SG 2.89Å
556	R	88.6	Confident	86.9	Confident	146 Å²	146	77.4 Å²	77.4	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-63.6	-44.1	173.9	-171.7	-174.7	-58.5	100	1.4	111.7	A552 A553 I554 I558 C559 D560	A552-R556 VanDerWaalsContact O-CB 3.3Å; A552-R556 WeakPolarHBondContact O-CB 3.49Å; A552-R556 PolarHBondContact O-N 3Å; A552-R556 VanDerWaalsContact O-N 3.17Å; A552-R556 PolarHBondContact O-NH1 3Å; A553-R556 PolarHBondContact O-N 3.48Å; I554-R556 VanDerWaalsContact C-N 3.35Å; I554-R556 PolarHBondContact O-N 2.71Å; R556-I558 PolarHBondContact O-N 2.97Å; R556-C559 PolarHBondContact O-N 3.23Å; R556-D560 WeakPolarHBondContact O-CB 3.28Å; R556-D560 PolarHBondContact O-N 3.21Å
557	E	90.7	Very high	86.9	Confident	71 Å²	71	76.2 Å²	76.2	33%	0.332	38%	0.381	S	S	.	.	H	α-helix	trans	-60.1	-45.2	178.3	-177.8	174.9	-165.1	0	0	112	L537 A553 I554 C559 D560 R561	L537-E557 HydrophobicContact CD1-CG 4.2Å; L537-E557 HydrophobicContact CD2-CG 4.25Å; L537-E557 WeakPolarHBondContact CD2-OE2 3.44Å; A553-E557 WeakPolarHBondContact O-CB 3.37Å; A553-E557 PolarHBondContact O-N 3.48Å; I554-E557 PolarHBondContact O-N 3.38Å; E557-C559 VanDerWaalsContact C-N 3.34Å; E557-C559 PolarHBondContact O-N 3.14Å; E557-D560 PolarHBondContact O-N 3.48Å; E557-R561 HydrophobicContact CG-CG 4.26Å; E557-R561 WeakPolarHBondContact O-CB 3.45Å; E557-R561 WeakPolarHBondContact O-CG 3.48Å; E557-R561 PolarHBondContact O-N 3.25Å; E557-R561 IonicContact OE1-CZ 3.63Å; E557-R561 VanDerWaalsContact OE1-CZ 3.3Å; E557-R561 IonicContact OE1-NE 3.18Å; E557-R561 PolarHBondContact OE1-NE 3.05Å; E557-R561 VanDerWaalsContact OE1-NE 3.11Å; E557-R561 IonicContact OE1-NH2 2.63Å; E557-R561 PolarHBondContact OE1-NH2 3.29Å
558	I	85.5	Confident	87.2	Confident	26 Å²	26	76 Å²	76	13%	0.133	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-46.7	174.7	-69.3	162.4	0	0	0	110.4	L537 L541 I554 R556 Y562	L537-I558 HydrophobicContact CB-CD1 4Å; L537-I558 HydrophobicContact CB-CG1 3.59Å; L537-I558 HydrophobicContact CD1-CG1 4.01Å; L537-I558 HydrophobicContact CG-CG1 4.36Å; L541-I558 HydrophobicContact CB-CD1 4.12Å; L541-I558 HydrophobicContact CD2-CD1 3.83Å; L541-I558 HydrophobicContact CG-CD1 4.41Å; I554-I558 HydrophobicContact CG2-CD1 3.94Å; I554-I558 HydrophobicContact CG2-CG1 4.45Å; I554-I558 VanDerWaalsContact O-CG1 3.31Å; I554-I558 WeakPolarHBondContact O-CG1 3.32Å; I554-I558 PolarHBondContact O-N 3.19Å; R556-I558 PolarHBondContact O-N 2.97Å; I558-Y562 WeakPolarHBondContact O-CB 3.38Å; I558-Y562 PolarHBondContact O-N 3.23Å
559	C	84.1	Confident	87.1	Confident	63 Å²	63	79.1 Å²	79.1	43%	0.426	38%	0.384	S	S	.	.	H	α-helix	trans	-64.4	-41.9	179.3	-70.9	0	0	0	0	112.9	E555 R556 E557 R563	E555-C559 PolarHBondContact O-N 3.37Å; E555-C559 VanDerWaalsContact O-N 3.11Å; E555-C559 PolarHBondContact O-SG 2.89Å; R556-C559 PolarHBondContact O-N 3.23Å; E557-C559 VanDerWaalsContact C-N 3.34Å; E557-C559 PolarHBondContact O-N 3.14Å; C559-R563 WeakPolarHBondContact O-CB 3.34Å; C559-R563 PolarHBondContact O-N 3.05Å
560	D	87.5	Confident	87.1	Confident	41 Å²	41	78.3 Å²	78.3	22%	0.219	38%	0.377	C	S	.	.	H	α-helix	trans	-74.1	-40.2	-179.7	-74	-26.3	0	0	0	112	R556 E557 R563 R564	R556-D560 WeakPolarHBondContact O-CB 3.28Å; R556-D560 PolarHBondContact O-N 3.21Å; E557-D560 PolarHBondContact O-N 3.48Å; D560-R563 PolarHBondContact O-N 2.9Å; D560-R563 IonicContact OD1-CZ 3.93Å; D560-R563 IonicContact OD1-NH1 2.74Å; D560-R563 PolarHBondContact OD1-NH1 2.94Å; D560-R563 IonicContact OD1-NH2 2.66Å; D560-R563 PolarHBondContact OD1-NH2 3.3Å; D560-R564 WeakPolarHBondContact O-CG 3.48Å; D560-R564 PolarHBondContact O-N 3.05Å
561	R	87.2	Confident	86.8	Confident	78 Å²	78	73.8 Å²	73.8	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-42.8	170.9	-71.9	-161.8	-163.4	-164.9	9.8	111	E533 F534 E557 R564 F565	E533-R561 IonicContact OE2-CZ 2.67Å; E533-R561 IonicContact OE2-NH1 3.98Å; E533-R561 PolarHBondContact OE2-NH1 3.49Å; F534-R561 HydrophobicContact CE1-CB 4Å; F534-R561 HydrophobicContact CZ-CB 4.14Å; E557-R561 HydrophobicContact CG-CG 4.26Å; E557-R561 WeakPolarHBondContact O-CB 3.45Å; E557-R561 WeakPolarHBondContact O-CG 3.48Å; E557-R561 PolarHBondContact O-N 3.25Å; E557-R561 IonicContact OE1-CZ 3.63Å; E557-R561 VanDerWaalsContact OE1-CZ 3.3Å; E557-R561 IonicContact OE1-NE 3.18Å; E557-R561 PolarHBondContact OE1-NE 3.05Å; E557-R561 VanDerWaalsContact OE1-NE 3.11Å; E557-R561 IonicContact OE1-NH2 2.63Å; E557-R561 PolarHBondContact OE1-NH2 3.29Å; R561-R564 PolarHBondContact O-N 3.15Å; R561-F565 WeakPolarHBondContact O-CB 3.5Å; R561-F565 PolarHBondContact O-N 2.73Å
562	Y	84	Confident	86.5	Confident	73 Å²	73	76.3 Å²	76.3	29%	0.286	37%	0.372	S	S	.	.	H	α-helix	trans	-65.9	-38.5	177.6	-176.2	-107.7	0	0	0	112.7	I361 F534 I558 F565 R566	I361-Y562 HydrophobicContact CB-CD2 4.47Å; I361-Y562 HydrophobicContact CB-CE2 4.27Å; I361-Y562 HydrophobicContact CD1-CD2 3.67Å; I361-Y562 HydrophobicContact CD1-CE2 4.03Å; I361-Y562 HydrophobicContact CD1-CG 4.09Å; I361-Y562 HydrophobicContact CG1-CD2 3.77Å; I361-Y562 HydrophobicContact CG1-CE2 3.59Å; I361-Y562 HydrophobicContact CG2-CD2 3.89Å; I361-Y562 HydrophobicContact CG2-CE2 3.92Å; F534-Y562 HydrophobicContact CZ-CD2 4.41Å; I558-Y562 WeakPolarHBondContact O-CB 3.38Å; I558-Y562 PolarHBondContact O-N 3.23Å; Y562-F565 PolarHBondContact O-N 3.34Å; Y562-R566 WeakPolarHBondContact O-CB 3.42Å; Y562-R566 PolarHBondContact O-N 2.73Å
563	R	85.6	Confident	86.7	Confident	124 Å²	124	75.8 Å²	75.8	47%	0.468	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-55.1	173.8	-169.6	-172	-48.4	119.5	20.4	110.9	C559 D560 F565 R566 E567	C559-R563 WeakPolarHBondContact O-CB 3.34Å; C559-R563 PolarHBondContact O-N 3.05Å; D560-R563 PolarHBondContact O-N 2.9Å; D560-R563 IonicContact OD1-CZ 3.93Å; D560-R563 IonicContact OD1-NH1 2.74Å; D560-R563 PolarHBondContact OD1-NH1 2.94Å; D560-R563 IonicContact OD1-NH2 2.66Å; D560-R563 PolarHBondContact OD1-NH2 3.3Å; R563-F565 VanDerWaalsContact C-N 3.3Å; R563-F565 PolarHBondContact O-N 3.22Å; R563-R566 PolarHBondContact O-N 3.4Å; R563-R566 VanDerWaalsContact O-N 3.13Å; R563-E567 WeakPolarHBondContact CG-OE1 3.44Å; R563-E567 WeakPolarHBondContact O-CB 3.07Å; R563-E567 WeakPolarHBondContact O-CG 3.27Å; R563-E567 PolarHBondContact O-N 3.39Å
564	R	85.6	Confident	86.6	Confident	172 Å²	172	74.2 Å²	74.2	65%	0.649	36%	0.356	S	S	*	.	H	α-helix	trans	-55.9	-45.2	176.5	-69.8	177.8	-173.5	127.5	2.1	111.6	D560 R561 R566 E567 D568	D560-R564 WeakPolarHBondContact O-CG 3.48Å; D560-R564 PolarHBondContact O-N 3.05Å; R561-R564 PolarHBondContact O-N 3.15Å; R564-R566 VanDerWaalsContact C-N 3.33Å; R564-R566 PolarHBondContact O-N 2.97Å; R564-E567 PolarHBondContact O-N 3.16Å; R564-D568 WeakPolarHBondContact O-CB 3.21Å; R564-D568 PolarHBondContact O-N 3.39Å
565	F	82.5	Confident	86.7	Confident	16 Å²	16	75.5 Å²	75.5	7%	0.07	36%	0.36	C	S	.	.	H	α-helix	trans	-59.2	-42.2	178.3	178.8	-81.9	0	0	0	112.6	L365 I530 F534 R561 Y562 R563 E567 L571 R575	L365-F565 HydrophobicContact CD2-CD2 4.47Å; L365-F565 HydrophobicContact CD2-CE1 3.87Å; L365-F565 HydrophobicContact CD2-CE2 3.59Å; L365-F565 HydrophobicContact CD2-CZ 3.26Å; L365-F565 HydrophobicContact CG-CZ 4.39Å; I530-F565 HydrophobicContact CB-CE2 4.49Å; I530-F565 HydrophobicContact CD1-CD2 4.39Å; I530-F565 HydrophobicContact CD1-CE2 3.88Å; I530-F565 HydrophobicContact CG2-CD2 3.57Å; I530-F565 HydrophobicContact CG2-CE2 3.66Å; F534-F565 HydrophobicContact CE2-CB 4.34Å; F534-F565 HydrophobicContact CE2-CD2 4.31Å; F534-F565 HydrophobicContact CE2-CG 4.2Å; F534-F565 HydrophobicContact CZ-CB 4.1Å; F534-F565 HydrophobicContact CZ-CG 4.42Å; R561-F565 WeakPolarHBondContact O-CB 3.5Å; R561-F565 PolarHBondContact O-N 2.73Å; Y562-F565 PolarHBondContact O-N 3.34Å; R563-F565 VanDerWaalsContact C-N 3.3Å; R563-F565 PolarHBondContact O-N 3.22Å; F565-E567 VanDerWaalsContact C-N 3.33Å; F565-L571 HydrophobicContact CD2-CD1 3.33Å; F565-L571 HydrophobicContact CD2-CG 4.39Å; F565-L571 HydrophobicContact CE2-CB 3.89Å; F565-L571 HydrophobicContact CE2-CD1 3.42Å; F565-L571 VanDerWaalsContact CE2-CD1 3.42Å; F565-L571 HydrophobicContact CE2-CD2 4.2Å; F565-L571 HydrophobicContact CE2-CG 4.02Å; F565-L571 HydrophobicContact CG-CD1 4.19Å; F565-L571 HydrophobicContact CZ-CB 4.03Å; F565-L571 HydrophobicContact CZ-CD1 4.33Å; F565-R575 VanDerWaalsContact CE1-NE 3.3Å; F565-R575 VanDerWaalsContact CE1-NH2 3.25Å
566	R	80.6	Confident	87	Confident	189 Å²	189	79.4 Å²	79.4	71%	0.713	38%	0.376	S	S	*	.	H	α-helix	trans	-72.5	-27.4	-179.9	-172.2	178.8	-174	-100.9	0	112.8	Y562 R563 R564	Y562-R566 WeakPolarHBondContact O-CB 3.42Å; Y562-R566 PolarHBondContact O-N 2.73Å; R563-R566 PolarHBondContact O-N 3.4Å; R563-R566 VanDerWaalsContact O-N 3.13Å; R564-R566 VanDerWaalsContact C-N 3.33Å; R564-R566 PolarHBondContact O-N 2.97Å
567	E	84.3	Confident	87.2	Confident	127 Å²	127	77.4 Å²	77.4	59%	0.593	37%	0.373	S	S	*	.	H	α-helix	trans	-92.9	-16	-177.4	-71.1	164.6	-171	0	0	113.1	R563 R564 F565 P569	R563-E567 WeakPolarHBondContact CG-OE1 3.44Å; R563-E567 WeakPolarHBondContact O-CB 3.07Å; R563-E567 WeakPolarHBondContact O-CG 3.27Å; R563-E567 PolarHBondContact O-N 3.39Å; R564-E567 PolarHBondContact O-N 3.16Å; F565-E567 VanDerWaalsContact C-N 3.33Å; E567-P569 WeakPolarHBondContact O-CD 3.2Å
568	D	87.8	Confident	87.3	Confident	62 Å²	62	74 Å²	74	33%	0.332	36%	0.357	S	S	.	.			trans	-72.5	111.6	-179.9	-174.3	-13.8	0	0	0	112.6	R564 A570 L571 D572	R564-D568 WeakPolarHBondContact O-CB 3.21Å; R564-D568 PolarHBondContact O-N 3.39Å; D568-A570 VanDerWaalsContact C-N 3.26Å; D568-A570 PolarHBondContact O-N 3Å; D568-A570 VanDerWaalsContact OD1-CB 3.27Å; D568-A570 WeakPolarHBondContact OD1-CB 3.44Å; D568-A570 PolarHBondContact OD1-N 2.97Å; D568-L571 HydrophobicContact CB-CB 4.18Å; D568-L571 HydrophobicContact CB-CD1 3.78Å; D568-L571 HydrophobicContact CB-CG 4Å; D568-L571 PolarHBondContact O-N 2.86Å; D568-L571 WeakPolarHBondContact OD2-CD1 3.32Å; D568-L571 WeakPolarHBondContact OD2-CG 3.46Å; D568-D572 PolarHBondContact O-N 3.05Å
569	P	88.7	Confident	87.5	Confident	103 Å²	103	76.1 Å²	76.1	67%	0.669	37%	0.369	S	S	*	.	H	α-helix	trans	-66.4	-25.7	179.8	-18.5	33.3	0	0	0	113.5	E567 L571 G573	E567-P569 WeakPolarHBondContact O-CD 3.2Å; P569-L571 VanDerWaalsContact C-N 3.29Å; P569-G573 PolarHBondContact O-N 2.88Å
570	A	89.7	Confident	87.9	Confident	69 Å²	69	77 Å²	77	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-70.3	-30.4	177.6	0	0	0	0	0	111.4	D568 L574	D568-A570 VanDerWaalsContact C-N 3.26Å; D568-A570 PolarHBondContact O-N 3Å; D568-A570 VanDerWaalsContact OD1-CB 3.27Å; D568-A570 WeakPolarHBondContact OD1-CB 3.44Å; D568-A570 PolarHBondContact OD1-N 2.97Å; A570-L574 VanDerWaalsContact O-CB 3.29Å; A570-L574 WeakPolarHBondContact O-CB 3.34Å; A570-L574 PolarHBondContact O-N 3.39Å
571	L	86.4	Confident	88.2	Confident	29 Å²	29	75.8 Å²	75.8	15%	0.152	37%	0.369	C	S	.	.	H	α-helix	trans	-80	-37.7	176.9	-63.2	174.5	0	0	0	111.9	I530 F565 D568 P569 L574 R575	I530-L571 HydrophobicContact CD1-CD1 4.29Å; I530-L571 HydrophobicContact CD1-CD2 3.43Å; I530-L571 VanDerWaalsContact CD1-CD2 3.43Å; I530-L571 HydrophobicContact CD1-CG 4.5Å; F565-L571 HydrophobicContact CD2-CD1 3.33Å; F565-L571 HydrophobicContact CD2-CG 4.39Å; F565-L571 HydrophobicContact CE2-CB 3.89Å; F565-L571 HydrophobicContact CE2-CD1 3.42Å; F565-L571 VanDerWaalsContact CE2-CD1 3.42Å; F565-L571 HydrophobicContact CE2-CD2 4.2Å; F565-L571 HydrophobicContact CE2-CG 4.02Å; F565-L571 HydrophobicContact CG-CD1 4.19Å; F565-L571 HydrophobicContact CZ-CB 4.03Å; F565-L571 HydrophobicContact CZ-CD1 4.33Å; D568-L571 HydrophobicContact CB-CB 4.18Å; D568-L571 HydrophobicContact CB-CD1 3.78Å; D568-L571 HydrophobicContact CB-CG 4Å; D568-L571 PolarHBondContact O-N 2.86Å; D568-L571 WeakPolarHBondContact OD2-CD1 3.32Å; D568-L571 WeakPolarHBondContact OD2-CG 3.46Å; P569-L571 VanDerWaalsContact C-N 3.29Å; L571-L574 HydrophobicContact CD2-CD2 4.07Å; L571-L574 PolarHBondContact O-N 3Å; L571-R575 WeakPolarHBondContact O-CB 3.49Å; L571-R575 WeakPolarHBondContact O-CD 3.31Å; L571-R575 WeakPolarHBondContact O-CG 3.41Å; L571-R575 PolarHBondContact O-N 3.14Å
572	D	85.8	Confident	88.4	Confident	73 Å²	73	72.6 Å²	72.6	39%	0.39	36%	0.357	S	S	.	.	H	α-helix	trans	-59.9	-45.1	167.3	172.8	65.6	0	0	0	111.6	D568 L574 R575 K576	D568-D572 PolarHBondContact O-N 3.05Å; D572-L574 PolarHBondContact O-N 3Å; D572-R575 WeakPolarHBondContact O-CB 3.45Å; D572-R575 PolarHBondContact O-N 2.74Å; D572-K576 WeakPolarHBondContact O-CG 3.44Å; D572-K576 PolarHBondContact O-N 2.91Å; D572-K576 WeakPolarHBondContact OD1-CE 2.97Å; D572-K576 IonicContact OD1-NZ 2.72Å; D572-K576 PolarHBondContact OD1-NZ 3.09Å; D572-K576 VanDerWaalsContact OD2-CE 3.3Å; D572-K576 WeakPolarHBondContact OD2-CE 3.12Å; D572-K576 IonicContact OD2-NZ 3.19Å; D572-K576 PolarHBondContact OD2-NZ 3.44Å
573	G	91.5	Very high	88.8	Confident	28 Å²	28	70.1 Å²	70.1	29%	0.289	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-44.2	172.7	0	0	0	0	0	113.1	P569 R575 K576 Q577	P569-G573 PolarHBondContact O-N 2.88Å; G573-R575 PolarHBondContact O-N 3.1Å; G573-K576 PolarHBondContact O-N 3.44Å; G573-Q577 WeakPolarHBondContact O-CB 3.12Å; G573-Q577 WeakPolarHBondContact O-CG 3.44Å; G573-Q577 PolarHBondContact O-N 3.29Å
574	L	90.9	Very high	89.2	Confident	12 Å²	12	66 Å²	66	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-40.6	176.3	176.3	64.5	0	0	0	112.6	F523 K526 L527 A570 L571 D572 Q577 H578	F523-L574 HydrophobicContact CB-CD1 4.05Å; F523-L574 HydrophobicContact CD1-CD1 3.53Å; F523-L574 HydrophobicContact CE1-CD1 4.41Å; F523-L574 HydrophobicContact CG-CD1 4.18Å; K526-L574 HydrophobicContact CB-CD1 4.3Å; K526-L574 HydrophobicContact CB-CD2 3.72Å; K526-L574 HydrophobicContact CD-CD1 3.86Å; K526-L574 HydrophobicContact CD-CD2 4.11Å; L527-L574 HydrophobicContact CD2-CD2 3.85Å; L527-L574 HydrophobicContact CD2-CG 4.04Å; L527-L574 HydrophobicContact CG-CD2 4.08Å; L527-L574 HydrophobicContact CG-CG 4.13Å; A570-L574 VanDerWaalsContact O-CB 3.29Å; A570-L574 WeakPolarHBondContact O-CB 3.34Å; A570-L574 PolarHBondContact O-N 3.39Å; L571-L574 HydrophobicContact CD2-CD2 4.07Å; L571-L574 PolarHBondContact O-N 3Å; D572-L574 PolarHBondContact O-N 3Å; L574-Q577 PolarHBondContact O-N 3.17Å; L574-H578 WeakPolarHBondContact O-CB 3.47Å; L574-H578 PolarHBondContact O-N 2.94Å
575	R	89.1	Confident	89.6	Confident	38 Å²	38	57.9 Å²	57.9	14%	0.143	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-50.5	175.2	-71.3	161.1	157.2	-73.4	5.1	111.2	D364 L527 F565 L571 D572 G573 Q577 H578 D579	D364-R575 PolarHBondContact O-NH1 3.49Å; L527-R575 HydrophobicContact CD2-CG 3.9Å; F565-R575 VanDerWaalsContact CE1-NE 3.3Å; F565-R575 VanDerWaalsContact CE1-NH2 3.25Å; L571-R575 WeakPolarHBondContact O-CB 3.49Å; L571-R575 WeakPolarHBondContact O-CD 3.31Å; L571-R575 WeakPolarHBondContact O-CG 3.41Å; L571-R575 PolarHBondContact O-N 3.14Å; D572-R575 WeakPolarHBondContact O-CB 3.45Å; D572-R575 PolarHBondContact O-N 2.74Å; G573-R575 PolarHBondContact O-N 3.1Å; R575-Q577 VanDerWaalsContact C-N 3.28Å; R575-Q577 PolarHBondContact O-N 3.16Å; R575-H578 WeakPolarHBondContact O-CB 3.48Å; R575-H578 PolarHBondContact O-N 3.48Å; R575-H578 VanDerWaalsContact O-N 3.08Å; R575-D579 PolarHBondContact O-N 2.92Å
576	K	90.8	Very high	90.1	Very high	127 Å²	127	57.8 Å²	57.8	55%	0.552	31%	0.309	S	S	*	.	H	α-helix	trans	-57.2	-40.5	175.9	-72.5	167.3	177.4	168	0	112.1	D572 G573 S580	D572-K576 WeakPolarHBondContact O-CG 3.44Å; D572-K576 PolarHBondContact O-N 2.91Å; D572-K576 WeakPolarHBondContact OD1-CE 2.97Å; D572-K576 IonicContact OD1-NZ 2.72Å; D572-K576 PolarHBondContact OD1-NZ 3.09Å; D572-K576 VanDerWaalsContact OD2-CE 3.3Å; D572-K576 WeakPolarHBondContact OD2-CE 3.12Å; D572-K576 IonicContact OD2-NZ 3.19Å; D572-K576 PolarHBondContact OD2-NZ 3.44Å; G573-K576 PolarHBondContact O-N 3.44Å; K576-S580 WeakPolarHBondContact O-CB 3.42Å; K576-S580 PolarHBondContact O-N 3.21Å
577	Q	92.9	Very high	90.7	Very high	104 Å²	104	48.8 Å²	48.8	49%	0.486	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-44.2	174.2	-76.6	-178.4	-23.9	0	0	112.6	F523 G573 L574 R575 I581	F523-Q577 HydrophobicContact CD1-CB 4.36Å; F523-Q577 HydrophobicContact CD2-CB 4.16Å; F523-Q577 HydrophobicContact CE1-CB 4.08Å; F523-Q577 HydrophobicContact CE2-CB 3.89Å; F523-Q577 HydrophobicContact CG-CB 4.4Å; F523-Q577 HydrophobicContact CZ-CB 3.84Å; F523-Q577 HydrophobicContact CZ-CG 4.28Å; G573-Q577 WeakPolarHBondContact O-CB 3.12Å; G573-Q577 WeakPolarHBondContact O-CG 3.44Å; G573-Q577 PolarHBondContact O-N 3.29Å; L574-Q577 PolarHBondContact O-N 3.17Å; R575-Q577 VanDerWaalsContact C-N 3.28Å; R575-Q577 PolarHBondContact O-N 3.16Å; Q577-I581 WeakPolarHBondContact O-CG2 3.28Å; Q577-I581 PolarHBondContact O-N 2.89Å; Q577-I581 VanDerWaalsContact O-N 3.14Å
578	H	93.6	Very high	91.2	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-48.1	175	172.1	-93.1	0	0	0	112.3	Y520 F523 Y524 L527 L574 R575 I581 R582	Y520-H578 AromaticContact CE2-NE2 3.55Å; F523-H578 HydrophobicContact CB-CB 4.05Å; Y524-H578 AromaticContact CD2-NE2 3.7Å; L527-H578 HydrophobicContact CD1-CB 3.56Å; L574-H578 WeakPolarHBondContact O-CB 3.47Å; L574-H578 PolarHBondContact O-N 2.94Å; R575-H578 WeakPolarHBondContact O-CB 3.48Å; R575-H578 PolarHBondContact O-N 3.48Å; R575-H578 VanDerWaalsContact O-N 3.08Å; H578-I581 VanDerWaalsContact O-CG2 3.31Å; H578-I581 WeakPolarHBondContact O-CG2 3.41Å; H578-I581 PolarHBondContact O-N 3.25Å; H578-R582 WeakPolarHBondContact O-CB 3.43Å; H578-R582 PolarHBondContact O-N 2.92Å
579	D	89.5	Confident	91.4	Very high	70 Å²	70	43.8 Å²	43.8	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-73.4	-38.9	-174.2	-63.5	-24.3	0	0	0	111.6	R575 R582 A583	R575-D579 PolarHBondContact O-N 2.92Å; D579-R582 PolarHBondContact O-N 3.36Å; D579-A583 WeakPolarHBondContact O-CB 3.48Å; D579-A583 PolarHBondContact O-N 2.69Å
580	S	91.9	Very high	91.6	Very high	81 Å²	81	40.9 Å²	40.9	57%	0.566	23%	0.23	S	C	*	.	H	α-helix	trans	-57.9	-48.4	171.8	175.1	0	0	0	0	111.7	K576 A583 K584	K576-S580 WeakPolarHBondContact O-CB 3.42Å; K576-S580 PolarHBondContact O-N 3.21Å; S580-A583 PolarHBondContact O-N 2.84Å; S580-K584 WeakPolarHBondContact O-CB 3.45Å; S580-K584 PolarHBondContact O-N 3.25Å
581	I	94	Very high	91.8	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.077	21%	0.212	C	C	.	.	H	α-helix	trans	-73.3	-32.9	-178.8	-158.5	160.6	0	0	0	112.5	D516 K519 Y520 F523 Q577 H578 K584 L585	D516-I581 HydrophobicContact CB-CD1 4.17Å; D516-I581 HydrophobicContact CB-CG1 4.48Å; D516-I581 WeakPolarHBondContact O-CD1 3.42Å; K519-I581 HydrophobicContact CB-CD1 3.47Å; K519-I581 VanDerWaalsContact CB-CD1 3.47Å; K519-I581 HydrophobicContact CD-CD1 4.13Å; K519-I581 HydrophobicContact CG-CD1 4.43Å; Y520-I581 HydrophobicContact CD2-CG2 4.1Å; Y520-I581 HydrophobicContact CG-CG2 4.48Å; F523-I581 HydrophobicContact CD2-CG2 4.02Å; F523-I581 HydrophobicContact CE2-CG2 4.5Å; Q577-I581 WeakPolarHBondContact O-CG2 3.28Å; Q577-I581 PolarHBondContact O-N 2.89Å; Q577-I581 VanDerWaalsContact O-N 3.14Å; H578-I581 VanDerWaalsContact O-CG2 3.31Å; H578-I581 WeakPolarHBondContact O-CG2 3.41Å; H578-I581 PolarHBondContact O-N 3.25Å; I581-K584 PolarHBondContact O-N 3.04Å; I581-L585 HydrophobicContact CG1-CD1 4.19Å; I581-L585 HydrophobicContact CG1-CG 4.36Å; I581-L585 WeakPolarHBondContact O-CB 3.47Å; I581-L585 WeakPolarHBondContact O-CG 3.5Å; I581-L585 PolarHBondContact O-N 3.29Å
582	R	91.5	Very high	92.2	Very high	11 Å²	11	39.4 Å²	39.4	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-45	172.1	-178	-177	176.1	-172.4	5.3	111.1	P367 D369 P487 Y520 H578 D579 A586	P367-R582 PolarHBondContact O-NH1 2.61Å; P367-R582 PolarHBondContact O-NH2 3.11Å; D369-R582 IonicContact OD1-CZ 2.65Å; D369-R582 VanDerWaalsContact OD1-CZ 3.24Å; D369-R582 IonicContact OD1-NE 2.88Å; D369-R582 PolarHBondContact OD1-NE 2.83Å; D369-R582 IonicContact OD1-NH2 2.61Å; D369-R582 PolarHBondContact OD1-NH2 3.37Å; D369-R582 IonicContact OD2-CZ 3.61Å; D369-R582 IonicContact OD2-NE 2.7Å; D369-R582 PolarHBondContact OD2-NE 2.95Å; D369-R582 IonicContact OD2-NH1 3.17Å; D369-R582 IonicContact OD2-NH2 3.26Å; D369-R582 PolarHBondContact OD2-NH2 3.13Å; D369-R582 VanDerWaalsContact OD2-NH2 3.13Å; P487-R582 HydrophobicContact CG-CG 4.24Å; Y520-R582 HydrophobicContact CD2-CB 4.3Å; Y520-R582 HydrophobicContact CE2-CB 4.15Å; Y520-R582 HydrophobicContact CE2-CG 4.31Å; H578-R582 WeakPolarHBondContact O-CB 3.43Å; H578-R582 PolarHBondContact O-N 2.92Å; D579-R582 PolarHBondContact O-N 3.36Å; R582-A586 VanDerWaalsContact O-CB 3.26Å; R582-A586 WeakPolarHBondContact O-CB 3.48Å; R582-A586 PolarHBondContact O-N 2.92Å
583	A	91.4	Very high	92.5	Very high	22 Å²	22	38.7 Å²	38.7	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-44.8	176.1	0	0	0	0	0	111.6	L493 D579 S580 A586 A587	L493-A583 HydrophobicContact CD1-CB 3.6Å; D579-A583 WeakPolarHBondContact O-CB 3.48Å; D579-A583 PolarHBondContact O-N 2.69Å; S580-A583 PolarHBondContact O-N 2.84Å; A583-A586 PolarHBondContact O-N 3.25Å; A583-A587 PolarHBondContact O-N 3.47Å
584	K	94.4	Very high	92.6	Very high	38 Å²	38	40 Å²	40	17%	0.165	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-50.6	175.7	-171.5	-174	-169.1	-176.1	0	112.7	Y497 D516 S580 I581 A586 A587 I588	Y497-K584 HydrophobicContact CE2-CG 4.03Å; Y497-K584 WeakPolarHBondContact OH-CE 3.47Å; Y497-K584 PolarHBondContact OH-NZ 3.35Å; D516-K584 IonicContact OD2-NZ 3.59Å; D516-K584 PolarHBondContact OD2-NZ 2.74Å; S580-K584 WeakPolarHBondContact O-CB 3.45Å; S580-K584 PolarHBondContact O-N 3.25Å; I581-K584 PolarHBondContact O-N 3.04Å; K584-A586 VanDerWaalsContact C-N 3.28Å; K584-A586 PolarHBondContact O-N 2.9Å; K584-A587 PolarHBondContact O-N 3.13Å; K584-I588 HydrophobicContact CG-CD1 4.16Å; K584-I588 WeakPolarHBondContact O-CG1 3.21Å; K584-I588 PolarHBondContact O-N 3.33Å
585	L	95	Very high	92.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.7	-34.7	178	-69.7	170.7	0	0	0	111.6	F513 D516 Y517 Y520 I581 K589	F513-L585 HydrophobicContact CB-CD2 4.44Å; F513-L585 HydrophobicContact CD1-CD2 4.49Å; F513-L585 HydrophobicContact CD2-CB 4.23Å; F513-L585 HydrophobicContact CD2-CD2 3.53Å; F513-L585 HydrophobicContact CD2-CG 4.47Å; F513-L585 HydrophobicContact CE2-CB 3.86Å; F513-L585 HydrophobicContact CE2-CD2 3.77Å; F513-L585 HydrophobicContact CE2-CG 4.34Å; F513-L585 HydrophobicContact CG-CD2 3.92Å; F513-L585 HydrophobicContact CZ-CD2 4.34Å; D516-L585 HydrophobicContact CB-CD2 4.2Å; Y517-L585 HydrophobicContact CD2-CD1 4.29Å; Y520-L585 VanDerWaalsContact CB-CD1 3.46Å; Y520-L585 HydrophobicContact CD1-CD1 4.41Å; Y520-L585 HydrophobicContact CD2-CD1 4.47Å; Y520-L585 HydrophobicContact CG-CD1 3.88Å; I581-L585 HydrophobicContact CG1-CD1 4.19Å; I581-L585 HydrophobicContact CG1-CG 4.36Å; I581-L585 WeakPolarHBondContact O-CB 3.47Å; I581-L585 WeakPolarHBondContact O-CG 3.5Å; I581-L585 PolarHBondContact O-N 3.29Å; L585-K589 WeakPolarHBondContact O-CB 3.06Å; L585-K589 PolarHBondContact O-N 3.34Å
586	A	92.8	Very high	93	Very high	14 Å²	14	40.2 Å²	40.2	12%	0.116	22%	0.217	C	C	.	.	H	α-helix	trans	-66.8	-41.2	173.9	0	0	0	0	0	112.5	L489 R582 A583 K584 S590	L489-A586 HydrophobicContact CD2-CB 4.34Å; R582-A586 VanDerWaalsContact O-CB 3.26Å; R582-A586 WeakPolarHBondContact O-CB 3.48Å; R582-A586 PolarHBondContact O-N 2.92Å; A583-A586 PolarHBondContact O-N 3.25Å; K584-A586 VanDerWaalsContact C-N 3.28Å; K584-A586 PolarHBondContact O-N 2.9Å; A586-S590 WeakPolarHBondContact O-CB 3.46Å; A586-S590 PolarHBondContact O-N 3.4Å
587	A	93.1	Very high	93	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-51.8	174.9	0	0	0	0	0	111.4	L489 L493 A583 K584 K589 S590 R591	L489-A587 HydrophobicContact CD2-CB 4.47Å; L493-A587 HydrophobicContact CB-CB 4.11Å; A583-A587 PolarHBondContact O-N 3.47Å; K584-A587 PolarHBondContact O-N 3.13Å; A587-K589 PolarHBondContact O-N 3.09Å; A587-S590 WeakPolarHBondContact O-CB 3.29Å; A587-S590 PolarHBondContact O-N 2.84Å; A587-S590 VanDerWaalsContact O-N 3.16Å; A587-R591 WeakPolarHBondContact O-CG 3.02Å; A587-R591 PolarHBondContact O-N 2.86Å
588	I	93.7	Very high	93	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-48.7	177.4	-64.3	168.4	0	0	0	110.9	Y497 Y509 L512 F513 K584 S590 R591 V592	Y497-I588 HydrophobicContact CD1-CD1 4.2Å; Y497-I588 HydrophobicContact CD1-CG1 3.61Å; Y497-I588 HydrophobicContact CD2-CG1 4.25Å; Y497-I588 HydrophobicContact CE1-CD1 3.81Å; Y497-I588 HydrophobicContact CE1-CG1 3.77Å; Y497-I588 HydrophobicContact CE2-CG1 4.43Å; Y497-I588 HydrophobicContact CG-CG1 3.91Å; Y509-I588 HydrophobicContact CD2-CG2 4.22Å; Y509-I588 VanDerWaalsContact O-CG2 3.23Å; Y509-I588 WeakPolarHBondContact O-CG2 3.14Å; L512-I588 HydrophobicContact CB-CD1 4.25Å; F513-I588 HydrophobicContact CB-CG2 4.02Å; F513-I588 HydrophobicContact CD2-CG2 4.39Å; K584-I588 HydrophobicContact CG-CD1 4.16Å; K584-I588 WeakPolarHBondContact O-CG1 3.21Å; K584-I588 PolarHBondContact O-N 3.33Å; I588-S590 VanDerWaalsContact C-N 3.31Å; I588-S590 PolarHBondContact O-N 3.35Å; I588-R591 PolarHBondContact O-N 3.1Å; I588-V592 WeakPolarHBondContact O-CG2 3.43Å; I588-V592 PolarHBondContact O-N 2.81Å
589	K	93.9	Very high	92.7	Very high	83 Å²	83	41.3 Å²	41.3	36%	0.361	22%	0.218	S	C	.	.	H	α-helix	trans	-59.9	-40.3	177	-176	178.7	-179.9	-178.3	0	111.7	D371 F513 L585 A587 V593	D371-K589 PolarHBondContact O-NZ 3.06Å; F513-K589 HydrophobicContact CE2-CB 4.21Å; L585-K589 WeakPolarHBondContact O-CB 3.06Å; L585-K589 PolarHBondContact O-N 3.34Å; A587-K589 PolarHBondContact O-N 3.09Å; K589-V593 HydrophobicContact CG-CG2 4.45Å; K589-V593 WeakPolarHBondContact O-CB 3.38Å; K589-V593 VanDerWaalsContact O-CG2 3.25Å; K589-V593 WeakPolarHBondContact O-CG2 3.25Å; K589-V593 PolarHBondContact O-N 3.36Å
590	S	92.5	Very high	92.5	Very high	41 Å²	41	43.2 Å²	43.2	29%	0.287	23%	0.225	S	C	.	.	H	α-helix	trans	-62.6	-43.9	176.7	-173.1	0	0	0	0	111.9	A586 A587 I588 S594	A586-S590 WeakPolarHBondContact O-CB 3.46Å; A586-S590 PolarHBondContact O-N 3.4Å; A587-S590 WeakPolarHBondContact O-CB 3.29Å; A587-S590 PolarHBondContact O-N 2.84Å; A587-S590 VanDerWaalsContact O-N 3.16Å; I588-S590 VanDerWaalsContact C-N 3.31Å; I588-S590 PolarHBondContact O-N 3.35Å; S590-S594 VanDerWaalsContact O-CB 3.25Å; S590-S594 WeakPolarHBondContact O-CB 3.5Å; S590-S594 PolarHBondContact O-N 3.05Å; S590-S594 PolarHBondContact O-OG 3.37Å
591	R	93.6	Very high	91.8	Very high	49 Å²	49	42 Å²	42	19%	0.185	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-48.7	176.3	-66.9	-58.3	-162.7	-166.5	8	112.1	L494 Y497 P498 V499 I500 Y509 A587 I588 V593 S594 F595	L494-R591 PolarHBondContact O-NH2 3.03Å; Y497-R591 PolarHBondContact O-NE 3.16Å; Y497-R591 PolarHBondContact O-NH2 3.31Å; P498-R591 VanDerWaalsContact O-CD 3.31Å; P498-R591 WeakPolarHBondContact O-CD 3.3Å; P498-R591 PolarHBondContact O-NE 3.32Å; P498-R591 VanDerWaalsContact O-NE 3.15Å; V499-R591 VanDerWaalsContact CG2-NH1 3.35Å; I500-R591 HydrophobicContact CD1-CB 3.89Å; I500-R591 HydrophobicContact CG1-CB 4.11Å; Y509-R591 HydrophobicContact CD2-CB 4.02Å; Y509-R591 HydrophobicContact CE2-CB 3.87Å; Y509-R591 HydrophobicContact CE2-CG 4.11Å; A587-R591 WeakPolarHBondContact O-CG 3.02Å; A587-R591 PolarHBondContact O-N 2.86Å; I588-R591 PolarHBondContact O-N 3.1Å; R591-V593 PolarHBondContact O-N 2.93Å; R591-S594 PolarHBondContact O-N 3.31Å; R591-S594 VanDerWaalsContact O-N 3.14Å; R591-F595 WeakPolarHBondContact O-CB 3.44Å; R591-F595 PolarHBondContact O-N 2.95Å
592	V	94.1	Very high	91	Very high	19 Å²	19	45.8 Å²	45.8	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-47.7	177.2	174.7	0	0	0	0	111.3	I500 R506 I588 S594 F595 D596	I500-V592 HydrophobicContact CD1-CB 4.48Å; I500-V592 HydrophobicContact CD1-CG2 3.91Å; R506-V592 HydrophobicContact CG-CG1 4.28Å; I588-V592 WeakPolarHBondContact O-CG2 3.43Å; I588-V592 PolarHBondContact O-N 2.81Å; V592-S594 VanDerWaalsContact C-N 3.27Å; V592-S594 PolarHBondContact O-N 2.95Å; V592-F595 PolarHBondContact O-N 3.01Å; V592-D596 WeakPolarHBondContact O-CB 3.41Å; V592-D596 VanDerWaalsContact O-CG 3.28Å; V592-D596 PolarHBondContact O-N 3.34Å
593	V	93.2	Very high	90.3	Very high	57 Å²	57	50.5 Å²	50.5	35%	0.345	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-31.1	177.4	170.1	0	0	0	0	112.3	K589 R591 K597	K589-V593 HydrophobicContact CG-CG2 4.45Å; K589-V593 WeakPolarHBondContact O-CB 3.38Å; K589-V593 VanDerWaalsContact O-CG2 3.25Å; K589-V593 WeakPolarHBondContact O-CG2 3.25Å; K589-V593 PolarHBondContact O-N 3.36Å; R591-V593 PolarHBondContact O-N 2.93Å; V593-K597 HydrophobicContact CG1-CD 4.13Å; V593-K597 WeakPolarHBondContact O-CB 3.38Å; V593-K597 WeakPolarHBondContact O-CD 3.21Å; V593-K597 WeakPolarHBondContact O-CG 3.5Å; V593-K597 PolarHBondContact O-N 3.36Å
594	S	92.6	Very high	89.5	Confident	56 Å²	56	53.2 Å²	53.2	39%	0.392	27%	0.267	S	S	.	.	H	α-helix	trans	-79	-24.1	177.4	-58.6	0	0	0	0	113.3	S590 R591 V592 R598	S590-S594 VanDerWaalsContact O-CB 3.25Å; S590-S594 WeakPolarHBondContact O-CB 3.5Å; S590-S594 PolarHBondContact O-N 3.05Å; S590-S594 PolarHBondContact O-OG 3.37Å; R591-S594 PolarHBondContact O-N 3.31Å; R591-S594 VanDerWaalsContact O-N 3.14Å; V592-S594 VanDerWaalsContact C-N 3.27Å; V592-S594 PolarHBondContact O-N 2.95Å; S594-R598 WeakPolarHBondContact O-CG 3.38Å; S594-R598 PolarHBondContact O-NE 3.22Å
595	F	94.5	Very high	88.4	Confident	1 Å²	1	58 Å²	58	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-76.8	-53.7	170.7	173.3	-85.1	0	0	0	110.9	I500 T502 L503 R506 R591 V592 K597 R598 H599	I500-F595 HydrophobicContact CB-CB 4.05Å; I500-F595 HydrophobicContact CB-CD2 3.65Å; I500-F595 HydrophobicContact CB-CE2 4.38Å; I500-F595 HydrophobicContact CB-CG 4.1Å; I500-F595 HydrophobicContact CD1-CB 4.15Å; I500-F595 HydrophobicContact CG2-CB 4.35Å; I500-F595 HydrophobicContact CG2-CD2 3.29Å; I500-F595 HydrophobicContact CG2-CE2 3.57Å; I500-F595 HydrophobicContact CG2-CG 3.88Å; I500-F595 HydrophobicContact CG2-CZ 4.36Å; I500-F595 WeakPolarHBondContact O-CD2 3.41Å; T502-F595 WeakPolarHBondContact O-CE2 3.16Å; L503-F595 HydrophobicContact CD2-CE1 3.82Å; L503-F595 HydrophobicContact CD2-CZ 3.91Å; L503-F595 HydrophobicContact CG-CZ 4.11Å; R506-F595 HydrophobicContact CB-CD1 3.85Å; R506-F595 HydrophobicContact CB-CE1 3.58Å; R506-F595 HydrophobicContact CB-CE2 4.4Å; R506-F595 HydrophobicContact CB-CG 4.35Å; R506-F595 HydrophobicContact CB-CZ 3.85Å; R506-F595 HydrophobicContact CG-CD1 3.53Å; R506-F595 HydrophobicContact CG-CE1 3.62Å; R506-F595 HydrophobicContact CG-CG 4.25Å; R506-F595 HydrophobicContact CG-CZ 4.39Å; R591-F595 WeakPolarHBondContact O-CB 3.44Å; R591-F595 PolarHBondContact O-N 2.95Å; V592-F595 PolarHBondContact O-N 3.01Å; F595-K597 PolarHBondContact O-N 3.49Å; F595-K597 VanDerWaalsContact O-N 3.14Å; F595-R598 PolarHBondContact O-N 3.31Å; F595-H599 AromaticContact CD2-CE1 3.9Å; F595-H599 AromaticContact CE1-CD2 3.44Å; F595-H599 VanDerWaalsContact CE1-CD2 3.44Å; F595-H599 WeakPolarHBondContact CE1-CD2 3.42Å; F595-H599 AromaticContact CE1-CG 3.88Å; F595-H599 AromaticContact CE1-NE2 3.8Å; F595-H599 AromaticContact CE2-CD2 3.7Å; F595-H599 AromaticContact CE2-CE1 3.34Å; F595-H599 WeakPolarHBondContact CE2-CE1 3.48Å; F595-H599 AromaticContact CE2-ND1 4Å; F595-H599 AromaticContact CE2-NE2 3.12Å; F595-H599 WeakPolarHBondContact CE2-NE2 3.28Å; F595-H599 AromaticContact CZ-CD2 3.12Å; F595-H599 WeakPolarHBondContact CZ-CD2 3.44Å; F595-H599 AromaticContact CZ-CE1 3.64Å; F595-H599 AromaticContact CZ-CG 3.83Å; F595-H599 AromaticContact CZ-NE2 2.97Å; F595-H599 WeakPolarHBondContact CZ-NE2 3.37Å; F595-H599 PolarHBondContact O-N 2.87Å
596	D	93.3	Very high	87.3	Confident	54 Å²	54	60.7 Å²	60.7	29%	0.289	31%	0.312	S	S	.	.	H	α-helix	trans	-55.4	-38.7	-178.6	-68.3	-10.8	0	0	0	110.7	R506 V592 R598 Q600	R506-D596 IonicContact CZ-OD1 2.63Å; R506-D596 IonicContact CZ-OD2 2.9Å; R506-D596 IonicContact NE-OD1 3.22Å; R506-D596 PolarHBondContact NE-OD1 3.4Å; R506-D596 IonicContact NE-OD2 2.7Å; R506-D596 IonicContact NH2-OD1 3.2Å; R506-D596 PolarHBondContact NH2-OD1 3.43Å; R506-D596 IonicContact NH2-OD2 3.94Å; R506-D596 PolarHBondContact NH2-OD2 3.41Å; V592-D596 WeakPolarHBondContact O-CB 3.41Å; V592-D596 VanDerWaalsContact O-CG 3.28Å; V592-D596 PolarHBondContact O-N 3.34Å; D596-R598 PolarHBondContact O-N 2.99Å; D596-Q600 WeakPolarHBondContact O-CB 3.27Å; D596-Q600 PolarHBondContact O-N 2.82Å
597	K	92	Very high	86.3	Confident	125 Å²	125	66.2 Å²	66.2	54%	0.543	34%	0.34	S	S	.	.	H	α-helix	trans	-67.8	-27.2	175	-77.6	173.4	-177.8	172	0	115.5	V593 F595 C601	V593-K597 HydrophobicContact CG1-CD 4.13Å; V593-K597 WeakPolarHBondContact O-CB 3.38Å; V593-K597 WeakPolarHBondContact O-CD 3.21Å; V593-K597 WeakPolarHBondContact O-CG 3.5Å; V593-K597 PolarHBondContact O-N 3.36Å; F595-K597 PolarHBondContact O-N 3.49Å; F595-K597 VanDerWaalsContact O-N 3.14Å; K597-C601 PolarHBondContact O-SG 3.4Å
598	R	91.7	Very high	85.2	Confident	90 Å²	90	73.3 Å²	73.3	34%	0.34	38%	0.378	S	S	.	.	H	α-helix	trans	-82.2	-49.9	177.1	-78.9	-177	-65.6	132.4	-1.7	110.3	I500 S594 F595 D596 Q600 C601 E602	I500-R598 PolarHBondContact O-NH2 2.64Å; S594-R598 WeakPolarHBondContact O-CG 3.38Å; S594-R598 PolarHBondContact O-NE 3.22Å; F595-R598 PolarHBondContact O-N 3.31Å; D596-R598 PolarHBondContact O-N 2.99Å; R598-Q600 PolarHBondContact O-N 2.94Å; R598-C601 WeakPolarHBondContact O-CA 3.38Å; R598-C601 WeakPolarHBondContact O-CB 3.37Å; R598-C601 PolarHBondContact O-N 2.95Å; R598-E602 WeakPolarHBondContact O-CG 3.49Å; R598-E602 PolarHBondContact O-N 2.97Å
599	H	87.5	Confident	83.8	Confident	40 Å²	40	78 Å²	78	19%	0.185	41%	0.411	C	S	.	.	H	α-helix	trans	-60.3	-33.3	177.8	-75.9	21.3	0	0	0	112.9	F595 C601 E602 I603	F595-H599 AromaticContact CD2-CE1 3.9Å; F595-H599 AromaticContact CE1-CD2 3.44Å; F595-H599 VanDerWaalsContact CE1-CD2 3.44Å; F595-H599 WeakPolarHBondContact CE1-CD2 3.42Å; F595-H599 AromaticContact CE1-CG 3.88Å; F595-H599 AromaticContact CE1-NE2 3.8Å; F595-H599 AromaticContact CE2-CD2 3.7Å; F595-H599 AromaticContact CE2-CE1 3.34Å; F595-H599 WeakPolarHBondContact CE2-CE1 3.48Å; F595-H599 AromaticContact CE2-ND1 4Å; F595-H599 AromaticContact CE2-NE2 3.12Å; F595-H599 WeakPolarHBondContact CE2-NE2 3.28Å; F595-H599 AromaticContact CZ-CD2 3.12Å; F595-H599 WeakPolarHBondContact CZ-CD2 3.44Å; F595-H599 AromaticContact CZ-CE1 3.64Å; F595-H599 AromaticContact CZ-CG 3.83Å; F595-H599 AromaticContact CZ-NE2 2.97Å; F595-H599 WeakPolarHBondContact CZ-NE2 3.37Å; F595-H599 PolarHBondContact O-N 2.87Å; H599-C601 VanDerWaalsContact C-N 3.32Å; H599-C601 PolarHBondContact O-N 3.05Å; H599-E602 WeakPolarHBondContact CA-OE2 3.44Å; H599-E602 IonicContact CE1-OE2 2.64Å; H599-E602 PolarHBondContact CE1-OE2 3.29Å; H599-E602 IonicContact CG-OE2 2.75Å; H599-E602 IonicContact ND1-OE2 3.85Å; H599-E602 PolarHBondContact ND1-OE2 3.48Å; H599-E602 PolarHBondContact O-N 3.17Å; H599-I603 WeakPolarHBondContact O-CD1 3.49Å; H599-I603 VanDerWaalsContact O-CG1 3.28Å; H599-I603 WeakPolarHBondContact O-CG1 3.39Å; H599-I603 PolarHBondContact O-N 2.89Å; H599-I603 VanDerWaalsContact O-N 3.09Å
600	Q	85	Confident	81.6	Confident	109 Å²	109	84.7 Å²	84.7	51%	0.509	45%	0.45	S	S	.	.	H	α-helix	trans	-68.6	-28.1	174	-167.7	159.8	44.4	0	0	113.2	D596 R598 E604	D596-Q600 WeakPolarHBondContact O-CB 3.27Å; D596-Q600 PolarHBondContact O-N 2.82Å; R598-Q600 PolarHBondContact O-N 2.94Å; Q600-E604 WeakPolarHBondContact O-CG 3.42Å; Q600-E604 PolarHBondContact O-N 3.5Å
601	C	78	Confident	81	Confident	55 Å²	55	86.9 Å²	86.9	37%	0.372	46%	0.459	S	S	.	.	H	α-helix	trans	-80.1	-39.1	171.6	-67	0	0	0	0	112.3	K597 R598 H599 I603 E604 E605	K597-C601 PolarHBondContact O-SG 3.4Å; R598-C601 WeakPolarHBondContact O-CA 3.38Å; R598-C601 WeakPolarHBondContact O-CB 3.37Å; R598-C601 PolarHBondContact O-N 2.95Å; H599-C601 VanDerWaalsContact C-N 3.32Å; H599-C601 PolarHBondContact O-N 3.05Å; C601-I603 VanDerWaalsContact C-N 3.27Å; C601-I603 PolarHBondContact O-N 3.4Å; C601-E604 PolarHBondContact O-N 2.75Å; C601-E604 VanDerWaalsContact O-N 3.13Å; C601-E605 WeakPolarHBondContact O-CG 3.29Å; C601-E605 PolarHBondContact O-N 3.03Å
602	E	78.3	Confident	80.3	Confident	95 Å²	95	88.9 Å²	88.9	44%	0.444	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-34.4	177.7	-70.3	153.2	-163.7	0	0	111.9	R598 H599 A606	R598-E602 WeakPolarHBondContact O-CG 3.49Å; R598-E602 PolarHBondContact O-N 2.97Å; H599-E602 WeakPolarHBondContact CA-OE2 3.44Å; H599-E602 IonicContact CE1-OE2 2.64Å; H599-E602 PolarHBondContact CE1-OE2 3.29Å; H599-E602 IonicContact CG-OE2 2.75Å; H599-E602 IonicContact ND1-OE2 3.85Å; H599-E602 PolarHBondContact ND1-OE2 3.48Å; H599-E602 PolarHBondContact O-N 3.17Å; E602-A606 PolarHBondContact O-N 3.4Å
603	I	76.7	Confident	79.6	Confident	110 Å²	110	92.8 Å²	92.8	56%	0.564	49%	0.493	S	S	*	.	H	α-helix	trans	-71.9	-41.4	172.6	-65.3	164.5	0	0	0	111.5	H599 C601 E605 A606 D607	H599-I603 WeakPolarHBondContact O-CD1 3.49Å; H599-I603 VanDerWaalsContact O-CG1 3.28Å; H599-I603 WeakPolarHBondContact O-CG1 3.39Å; H599-I603 PolarHBondContact O-N 2.89Å; H599-I603 VanDerWaalsContact O-N 3.09Å; C601-I603 VanDerWaalsContact C-N 3.27Å; C601-I603 PolarHBondContact O-N 3.4Å; I603-E605 VanDerWaalsContact C-N 3.33Å; I603-E605 PolarHBondContact O-N 3.5Å; I603-A606 PolarHBondContact O-N 2.73Å; I603-D607 PolarHBondContact O-N 3.43Å
604	E	73	Confident	78.8	Confident	79 Å²	79	94.9 Å²	94.9	37%	0.369	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-32.2	177.4	-75.5	178.6	173.5	0	0	112.6	I173 Q600 C601	I173-E604 WeakPolarHBondContact CD1-OE2 3.44Å; Q600-E604 WeakPolarHBondContact O-CG 3.42Å; Q600-E604 PolarHBondContact O-N 3.5Å; C601-E604 PolarHBondContact O-N 2.75Å; C601-E604 VanDerWaalsContact O-N 3.13Å
605	E	73	Confident	77.9	Confident	138 Å²	138	97.3 Å²	97.3	65%	0.645	51%	0.508	S	S	*	.	H	α-helix	trans	-76.7	-26	176	-72.3	177.1	-176.1	0	0	113.1	C601 I603 S609	C601-E605 WeakPolarHBondContact O-CG 3.29Å; C601-E605 PolarHBondContact O-N 3.03Å; I603-E605 VanDerWaalsContact C-N 3.33Å; I603-E605 PolarHBondContact O-N 3.5Å; E605-S609 PolarHBondContact O-OG 3.16Å
606	A	71.6	Confident	76.8	Confident	58 Å²	58	103.7 Å²	103.7	48%	0.479	54%	0.542	S	S	.	.	H	α-helix	trans	-72.8	-42.4	174.5	0	0	0	0	0	112.3	E602 I603 D608 S609	E602-A606 PolarHBondContact O-N 3.4Å; I603-A606 PolarHBondContact O-N 2.73Å; A606-D608 VanDerWaalsContact C-N 3.26Å; A606-D608 PolarHBondContact O-N 3.15Å; A606-S609 PolarHBondContact O-N 2.81Å; A606-S609 VanDerWaalsContact O-N 3.16Å
607	D	70.6	Confident	75.6	Confident	129 Å²	129	107.3 Å²	107.3	69%	0.69	56%	0.56	S	S	*	*	H	α-helix	trans	-67.9	-20.6	178.2	-82.6	-11.9	0	0	0	113.6	I603	I603-D607 PolarHBondContact O-N 3.43Å
608	D	70.6	Confident	74.4	Confident	151 Å²	151	105.9 Å²	105.9	81%	0.807	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	4	175	-87.6	-15.4	0	0	0	112.6	A606	A606-D608 VanDerWaalsContact C-N 3.26Å; A606-D608 PolarHBondContact O-N 3.15Å
609	S	63.6	Low	72.9	Confident	100 Å²	100	107.3 Å²	107.3	70%	0.699	58%	0.58	S	S	*	*			trans	-112.1	-3.7	-174.6	-62.8	0	0	0	0	115.8	E605 A606	E605-S609 PolarHBondContact O-OG 3.16Å; A606-S609 PolarHBondContact O-N 2.81Å; A606-S609 VanDerWaalsContact O-N 3.16Å
610	D	47.4	Very low	71.6	Confident	223 Å²	223	113.4 Å²	113.4	100%	1.193	62%	0.616	S	S	*	*			trans	-105.5	0	169.8	-98.7	-20.3	0	0	0	111

Retrieved 610 of 610 residues in 332.1 ms (Link to these results)

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