A0A087Y3J2_POEFO Loading...

Ras association domain family member 6

AlphaFold DB , UniProt , Accession A0A087Y3J2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 381 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	36.8	Very low	70.5	Confident	237 Å²	237	98.2 Å²	98.2	100%	1.167	55%	0.551	S	S	*	*				0	117.4	0	-75.1	-180	171.6	0	0	108.1	K3	M1-K3 PolarHBondContact O-N 2.86Å; M1-K3 VanDerWaalsContact O-N 3.08Å
2	N	40.5	Very low	71.3	Confident	173 Å²	173	90.3 Å²	90.3	93%	0.925	51%	0.508	S	S	*	.			trans	-68.3	105.8	-179.1	-65.7	-16.3	0	0	0	108.4	A4	N2-A4 PolarHBondContact O-N 3.13Å; N2-A4 VanDerWaalsContact O-N 3.17Å
3	K	56.4	Low	71.5	Confident	175 Å²	175	83.8 Å²	83.8	76%	0.761	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-59.9	118.9	169.1	-85.3	-175.7	175.7	-178.1	0	106.8	M1	M1-K3 PolarHBondContact O-N 2.86Å; M1-K3 VanDerWaalsContact O-N 3.08Å
4	A	65.4	Low	71.4	Confident	60 Å²	60	82.3 Å²	82.3	50%	0.496	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-55.1	143.6	172.8	0	0	0	0	0	109.4	N2 L6	N2-A4 PolarHBondContact O-N 3.13Å; N2-A4 VanDerWaalsContact O-N 3.17Å; A4-L6 PolarHBondContact O-N 2.87Å
5	P	74.4	Confident	71.9	Confident	104 Å²	104	81.2 Å²	81.2	68%	0.675	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-61.1	137.1	-177.4	22.5	-30.6	0	0	0	110.1
6	L	78	Confident	72.9	Confident	18 Å²	18	83.9 Å²	83.9	9%	0.094	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-54.5	139.1	173.2	-81.9	169.8	0	0	0	110.1	A4 R20 L24 Y44 V52	A4-L6 PolarHBondContact O-N 2.87Å; L6-R20 HydrophobicContact CB-CG 4.1Å; L6-R20 HydrophobicContact CD1-CG 4.13Å; L6-L24 HydrophobicContact CD1-CD1 4.23Å; L6-L24 HydrophobicContact CD1-CD2 3.94Å; L6-L24 HydrophobicContact CD1-CG 4.26Å; L6-Y44 HydrophobicContact CD1-CE2 4.11Å; L6-Y44 HydrophobicContact CD2-CD2 4.02Å; L6-Y44 HydrophobicContact CD2-CE2 3.56Å; L6-Y44 HydrophobicContact CG-CE2 4.08Å; L6-V52 HydrophobicContact CD2-CG2 3.6Å
7	P	79.9	Confident	74	Confident	38 Å²	38	83.8 Å²	83.8	25%	0.247	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-61.7	152.8	177.4	29.2	-35	0	0	0	110.4	V9 I10 V52	P7-V9 PolarHBondContact O-N 3.17Å; P7-I10 HydrophobicContact CG-CG1 4Å; P7-V52 HydrophobicContact CG-CG2 3.81Å
8	A	81	Confident	75	Confident	82 Å²	82	80.3 Å²	80.3	68%	0.678	46%	0.464	S	S	*	.	S	Bend	trans	-63.2	-34.2	179.9	0	0	0	0	0	112.2	R20	A8-R20 PolarHBondContact O-N 3.13Å
9	V	85.5	Confident	76	Confident	82 Å²	82	79.5 Å²	79.5	50%	0.497	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.6	-179.4	-176.6	0	0	0	0	109.4	P7 T17 L18	P7-V9 PolarHBondContact O-N 3.17Å; V9-T17 HydrophobicContact CG1-CG2 3.93Å; V9-L18 WeakPolarHBondContact CA-O 3.45Å
10	I	89.5	Confident	76.8	Confident	4 Å²	4	81.5 Å²	81.5	2%	0.021	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.9	179.7	-63.3	166.7	0	0	0	108	P7 A12 T17 L18 F23 V52 W303	P7-I10 HydrophobicContact CG-CG1 4Å; I10-A12 PolarHBondContact O-N 3.2Å; I10-T17 CarbonylContact O-C 3.5Å; I10-T17 WeakPolarHBondContact O-CA 3.19Å; I10-L18 PolarHBondContact N-O 3.08Å; I10-L18 PolarHBondContact O-N 3.02Å; I10-F23 HydrophobicContact CD1-CB 3.52Å; I10-F23 HydrophobicContact CD1-CD1 3.41Å; I10-F23 VanDerWaalsContact CD1-CD1 3.41Å; I10-F23 HydrophobicContact CD1-CD2 4.12Å; I10-F23 HydrophobicContact CD1-CE1 4.17Å; I10-F23 HydrophobicContact CD1-CG 3.38Å; I10-F23 HydrophobicContact CG2-CD2 4.48Å; I10-V52 HydrophobicContact CD1-CB 4.49Å; I10-V52 HydrophobicContact CD1-CG2 3.89Å; I10-V52 HydrophobicContact CG1-CB 4.43Å; I10-V52 HydrophobicContact CG1-CG2 3.83Å; I10-V52 HydrophobicContact CG2-CB 4.09Å; I10-V52 HydrophobicContact CG2-CG2 4.41Å; I10-W303 HydrophobicContact CG2-CH2 3.99Å; I10-W303 HydrophobicContact CG2-CZ2 4.32Å
11	Q	88	Confident	77.6	Confident	107 Å²	107	81 Å²	81	50%	0.5	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	107.3	174.3	-63.4	-66.9	-28.7	0	0	108.6
12	A	80.8	Confident	80.4	Confident	4 Å²	4	74.4 Å²	74.4	3%	0.033	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	149.6	165.5	0	0	0	0	0	108.2	I10 R16 L18 W303 L307	I10-A12 PolarHBondContact O-N 3.2Å; A12-R16 CarbonylContact C-O 3.51Å; A12-R16 HydrophobicContact CB-CB 4.28Å; A12-R16 PolarHBondContact N-O 3.08Å; A12-R16 PolarHBondContact O-N 3.38Å; A12-L18 HydrophobicContact CB-CD1 3.82Å; A12-L18 HydrophobicContact CB-CG 3.97Å; A12-W303 HydrophobicContact CB-CD2 4.11Å; A12-W303 HydrophobicContact CB-CE3 3.94Å; A12-W303 HydrophobicContact CB-CZ3 4.33Å; A12-L307 HydrophobicContact CB-CD1 4.41Å; A12-L307 HydrophobicContact CB-CD2 4.47Å
13	G	73.8	Confident	83	Confident	5 Å²	5	66.2 Å²	66.2	5%	0.052	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-48.5	160.6	179.5	0	0	0	0	0	113.5	G15 W303	G13-G15 VanDerWaalsContact C-N 3.34Å; G13-G15 PolarHBondContact O-N 3.25Å; G13-W303 VanDerWaalsContact N-CD1 3.31Å; G13-W303 VanDerWaalsContact N-CG 3.3Å
14	S	70.3	Confident	84.8	Confident	63 Å²	63	60.1 Å²	60.1	44%	0.441	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	68.7	18.6	-175.2	77.3	0	0	0	0	116.3	R16	S14-R16 VanDerWaalsContact C-N 3.27Å; S14-R16 PolarHBondContact O-N 3.07Å
15	G	78.9	Confident	86.2	Confident	66 Å²	66	60.6 Å²	60.6	68%	0.68	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	77.5	12.4	179.2	0	0	0	0	0	114	G13	G13-G15 VanDerWaalsContact C-N 3.34Å; G13-G15 PolarHBondContact O-N 3.25Å
16	R	86.6	Confident	87.2	Confident	125 Å²	125	57.9 Å²	57.9	47%	0.472	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	141.4	175.1	-67.3	178.5	-177.9	-173.1	0.3	110	A12 S14	A12-R16 CarbonylContact C-O 3.51Å; A12-R16 HydrophobicContact CB-CB 4.28Å; A12-R16 PolarHBondContact N-O 3.08Å; A12-R16 PolarHBondContact O-N 3.38Å; S14-R16 VanDerWaalsContact C-N 3.27Å; S14-R16 PolarHBondContact O-N 3.07Å
17	T	91.9	Very high	88.1	Confident	82 Å²	82	57.5 Å²	57.5	50%	0.503	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.2	175.5	55.2	0	0	0	0	110.2	V9 I10	V9-T17 HydrophobicContact CG1-CG2 3.93Å; I10-T17 CarbonylContact O-C 3.5Å; I10-T17 WeakPolarHBondContact O-CA 3.19Å
18	L	92.9	Very high	88.8	Confident	20 Å²	20	60.2 Å²	60.2	11%	0.105	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.5	176.2	-61.8	175.3	0	0	0	110.1	V9 I10 A12 E22 F23 L26 W303 L307	V9-L18 WeakPolarHBondContact CA-O 3.45Å; I10-L18 PolarHBondContact N-O 3.08Å; I10-L18 PolarHBondContact O-N 3.02Å; A12-L18 HydrophobicContact CB-CD1 3.82Å; A12-L18 HydrophobicContact CB-CG 3.97Å; L18-E22 HydrophobicContact CB-CB 4.48Å; L18-E22 HydrophobicContact CD2-CB 4.36Å; L18-F23 HydrophobicContact CB-CB 4.43Å; L18-F23 HydrophobicContact CD1-CB 4.47Å; L18-L26 HydrophobicContact CD1-CD1 3.83Å; L18-L26 HydrophobicContact CD2-CD1 4.39Å; L18-W303 HydrophobicContact CD1-CZ3 4.39Å; L18-L307 HydrophobicContact CD1-CD2 4.27Å; L18-L307 HydrophobicContact CD2-CD2 4.24Å
19	T	93.8	Very high	89.5	Confident	65 Å²	65	60.1 Å²	60.1	40%	0.399	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	158.5	163.7	65.8	0	0	0	0	110.2	A21 E22 F23	T19-A21 PolarHBondContact O-N 3.05Å; T19-E22 WeakPolarHBondContact CB-OE2 3.34Å; T19-E22 WeakPolarHBondContact CG2-OE2 3.22Å; T19-E22 PolarHBondContact N-OE2 2.79Å; T19-E22 PolarHBondContact O-N 3.39Å; T19-E22 WeakPolarHBondContact OG1-CB 3.29Å; T19-E22 VanDerWaalsContact OG1-CG 3.22Å; T19-E22 WeakPolarHBondContact OG1-CG 3.47Å; T19-E22 PolarHBondContact OG1-N 3.35Å; T19-E22 PolarHBondContact OG1-OE2 3.22Å; T19-F23 PolarHBondContact O-N 2.83Å
20	R	91.6	Very high	90	Very high	119 Å²	119	56.9 Å²	56.9	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-54.1	-39.1	174.4	-179.6	178.8	172.7	173.6	-2.2	112.8	L6 A8 L24	L6-R20 HydrophobicContact CB-CG 4.1Å; L6-R20 HydrophobicContact CD1-CG 4.13Å; A8-R20 PolarHBondContact O-N 3.13Å; R20-L24 HydrophobicContact CG-CD1 4.02Å; R20-L24 WeakPolarHBondContact O-CB 3.05Å; R20-L24 VanDerWaalsContact O-CG 3.29Å; R20-L24 WeakPolarHBondContact O-CG 3.21Å; R20-L24 PolarHBondContact O-N 3.42Å; R20-L24 VanDerWaalsContact O-N 3.1Å
21	A	93.7	Very high	90.3	Very high	73 Å²	73	58 Å²	58	60%	0.603	33%	0.33	S	S	*	.	H	α-helix	trans	-68.1	-46.4	-179.1	0	0	0	0	0	111.6	T19 L24 S25	T19-A21 PolarHBondContact O-N 3.05Å; A21-L24 PolarHBondContact O-N 3.01Å; A21-S25 WeakPolarHBondContact O-CB 2.95Å; A21-S25 PolarHBondContact O-N 2.84Å
22	E	94.8	Very high	90.6	Very high	98 Å²	98	57 Å²	57	46%	0.458	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-46.5	176.8	-71	162.3	154.9	0	0	111.5	L18 T19 L24 S25 L26	L18-E22 HydrophobicContact CB-CB 4.48Å; L18-E22 HydrophobicContact CD2-CB 4.36Å; T19-E22 WeakPolarHBondContact CB-OE2 3.34Å; T19-E22 WeakPolarHBondContact CG2-OE2 3.22Å; T19-E22 PolarHBondContact N-OE2 2.79Å; T19-E22 PolarHBondContact O-N 3.39Å; T19-E22 WeakPolarHBondContact OG1-CB 3.29Å; T19-E22 VanDerWaalsContact OG1-CG 3.22Å; T19-E22 WeakPolarHBondContact OG1-CG 3.47Å; T19-E22 PolarHBondContact OG1-N 3.35Å; T19-E22 PolarHBondContact OG1-OE2 3.22Å; E22-L24 PolarHBondContact O-N 2.97Å; E22-S25 WeakPolarHBondContact O-CB 3.38Å; E22-S25 PolarHBondContact O-N 3.46Å; E22-L26 WeakPolarHBondContact O-CG 3.48Å; E22-L26 PolarHBondContact O-N 3.44Å
23	F	95	Very high	91.3	Very high	1 Å²	1	62.8 Å²	62.8	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-58.2	-49.2	177.7	169	-105.4	0	0	0	112.4	I10 L18 T19 S25 L26 L27 Y44 V52 V54 W303	I10-F23 HydrophobicContact CD1-CB 3.52Å; I10-F23 HydrophobicContact CD1-CD1 3.41Å; I10-F23 VanDerWaalsContact CD1-CD1 3.41Å; I10-F23 HydrophobicContact CD1-CD2 4.12Å; I10-F23 HydrophobicContact CD1-CE1 4.17Å; I10-F23 HydrophobicContact CD1-CG 3.38Å; I10-F23 HydrophobicContact CG2-CD2 4.48Å; L18-F23 HydrophobicContact CB-CB 4.43Å; L18-F23 HydrophobicContact CD1-CB 4.47Å; T19-F23 PolarHBondContact O-N 2.83Å; F23-S25 VanDerWaalsContact C-N 3.29Å; F23-S25 PolarHBondContact O-N 3.33Å; F23-L26 PolarHBondContact O-N 3.2Å; F23-L27 HydrophobicContact CZ-CD2 4.42Å; F23-L27 PolarHBondContact O-N 3.44Å; F23-Y44 HydrophobicContact CE1-CD1 4.2Å; F23-Y44 HydrophobicContact CE1-CD2 4.45Å; F23-Y44 HydrophobicContact CE1-CG 4.13Å; F23-Y44 HydrophobicContact CZ-CD1 4.29Å; F23-Y44 HydrophobicContact CZ-CG 4.07Å; F23-V52 HydrophobicContact CE1-CG1 4Å; F23-V52 HydrophobicContact CE2-CG1 4.19Å; F23-V52 HydrophobicContact CZ-CG1 3.63Å; F23-V54 HydrophobicContact CE2-CG2 3.63Å; F23-V54 HydrophobicContact CZ-CG2 3.89Å; F23-W303 AromaticContact CD2-CH2 3.94Å; F23-W303 HydrophobicContact CD2-CH2 3.94Å; F23-W303 HydrophobicContact CD2-CZ3 4.06Å; F23-W303 AromaticContact CE2-CH2 3.72Å; F23-W303 HydrophobicContact CE2-CH2 3.72Å; F23-W303 HydrophobicContact CE2-CZ3 4.04Å
24	L	94.4	Very high	92.2	Very high	47 Å²	47	63.8 Å²	63.8	25%	0.246	36%	0.36	C	S	.	.	H	α-helix	trans	-65.1	-36.3	178.8	-71	174.6	0	0	0	111.5	L6 R20 A21 E22 L27 N28 Y44	L6-L24 HydrophobicContact CD1-CD1 4.23Å; L6-L24 HydrophobicContact CD1-CD2 3.94Å; L6-L24 HydrophobicContact CD1-CG 4.26Å; R20-L24 HydrophobicContact CG-CD1 4.02Å; R20-L24 WeakPolarHBondContact O-CB 3.05Å; R20-L24 VanDerWaalsContact O-CG 3.29Å; R20-L24 WeakPolarHBondContact O-CG 3.21Å; R20-L24 PolarHBondContact O-N 3.42Å; R20-L24 VanDerWaalsContact O-N 3.1Å; A21-L24 PolarHBondContact O-N 3.01Å; E22-L24 PolarHBondContact O-N 2.97Å; L24-L27 PolarHBondContact O-N 3.43Å; L24-N28 VanDerWaalsContact O-CB 3.27Å; L24-N28 WeakPolarHBondContact O-CB 3.46Å; L24-N28 PolarHBondContact O-N 3.17Å; L24-N28 PolarHBondContact O-ND2 2.97Å; L24-Y44 HydrophobicContact CD2-CE1 4.37Å
25	S	95.9	Very high	93.3	Very high	70 Å²	70	67.5 Å²	67.5	49%	0.49	37%	0.368	S	S	.	.	H	α-helix	trans	-61.6	-47.8	174.4	-169	0	0	0	0	111.3	A21 E22 F23 L27 N28 T29	A21-S25 WeakPolarHBondContact O-CB 2.95Å; A21-S25 PolarHBondContact O-N 2.84Å; E22-S25 WeakPolarHBondContact O-CB 3.38Å; E22-S25 PolarHBondContact O-N 3.46Å; F23-S25 VanDerWaalsContact C-N 3.29Å; F23-S25 PolarHBondContact O-N 3.33Å; S25-L27 PolarHBondContact O-N 2.92Å; S25-N28 PolarHBondContact O-N 2.84Å; S25-T29 WeakPolarHBondContact O-CB 3.27Å; S25-T29 PolarHBondContact O-N 3.12Å; S25-T29 PolarHBondContact O-OG1 2.73Å
26	L	95.8	Very high	94	Very high	47 Å²	47	70.8 Å²	70.8	25%	0.246	37%	0.37	C	S	.	.	H	α-helix	trans	-60.8	-45.7	178	-70.8	171.3	0	0	0	111.6	L18 E22 F23 T29 Y30 I306 L307	L18-L26 HydrophobicContact CD1-CD1 3.83Å; L18-L26 HydrophobicContact CD2-CD1 4.39Å; E22-L26 WeakPolarHBondContact O-CG 3.48Å; E22-L26 PolarHBondContact O-N 3.44Å; F23-L26 PolarHBondContact O-N 3.2Å; L26-T29 PolarHBondContact O-N 3.18Å; L26-Y30 WeakPolarHBondContact O-CB 3.34Å; L26-Y30 PolarHBondContact O-N 2.81Å; L26-I306 HydrophobicContact CB-CG2 3.95Å; L26-I306 HydrophobicContact CD1-CG2 4.3Å; L26-L307 HydrophobicContact CD1-CD2 4.12Å
27	L	95.3	Very high	94.3	Very high	9 Å²	9	68.6 Å²	68.6	5%	0.047	37%	0.365	C	S	.	.	H	α-helix	trans	-64.2	-42.6	179.4	-167.2	75.2	0	0	0	112	F23 L24 S25 Y30 N31 L42 Y44 V54	F23-L27 HydrophobicContact CZ-CD2 4.42Å; F23-L27 PolarHBondContact O-N 3.44Å; L24-L27 PolarHBondContact O-N 3.43Å; S25-L27 PolarHBondContact O-N 2.92Å; L27-Y30 PolarHBondContact O-N 3.07Å; L27-N31 WeakPolarHBondContact O-CB 3.45Å; L27-N31 PolarHBondContact O-N 3.26Å; L27-L42 HydrophobicContact CD1-CB 3.45Å; L27-L42 VanDerWaalsContact CD1-CB 3.45Å; L27-L42 HydrophobicContact CD1-CD1 4.2Å; L27-L42 HydrophobicContact CD1-CG 4.48Å; L27-Y44 HydrophobicContact CD2-CD1 3.44Å; L27-Y44 VanDerWaalsContact CD2-CD1 3.44Å; L27-Y44 HydrophobicContact CD2-CE1 3.92Å; L27-V54 HydrophobicContact CD1-CG1 4.22Å
28	N	95.4	Very high	94.2	Very high	96 Å²	96	69.2 Å²	69.2	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-64.5	-46.6	176.5	-75	-15	0	0	0	110.9	L24 S25 Y30 N31 C32	L24-N28 VanDerWaalsContact O-CB 3.27Å; L24-N28 WeakPolarHBondContact O-CB 3.46Å; L24-N28 PolarHBondContact O-N 3.17Å; L24-N28 PolarHBondContact O-ND2 2.97Å; S25-N28 PolarHBondContact O-N 2.84Å; N28-Y30 VanDerWaalsContact C-N 3.27Å; N28-Y30 PolarHBondContact O-N 3.32Å; N28-N31 PolarHBondContact O-N 2.78Å; N28-C32 WeakPolarHBondContact O-CB 3.42Å; N28-C32 PolarHBondContact O-N 2.88Å; N28-C32 PolarHBondContact O-SG 3.16Å
29	T	95.7	Very high	94.2	Very high	80 Å²	80	74.1 Å²	74.1	49%	0.491	39%	0.392	S	S	.	.	H	α-helix	trans	-56.1	-44.8	175.2	-62.2	0	0	0	0	111.3	S25 L26 Y33	S25-T29 WeakPolarHBondContact O-CB 3.27Å; S25-T29 PolarHBondContact O-N 3.12Å; S25-T29 PolarHBondContact O-OG1 2.73Å; L26-T29 PolarHBondContact O-N 3.18Å; T29-Y33 PolarHBondContact O-N 3.36Å
30	Y	95.5	Very high	94.1	Very high	14 Å²	14	71.9 Å²	71.9	6%	0.055	38%	0.377	C	S	.	.	H	α-helix	trans	-61.3	-50.1	178.6	-160.9	-76.9	0	0	0	112.2	L26 L27 N28 Y33 L34 L42 R305 P310	L26-Y30 WeakPolarHBondContact O-CB 3.34Å; L26-Y30 PolarHBondContact O-N 2.81Å; L27-Y30 PolarHBondContact O-N 3.07Å; N28-Y30 VanDerWaalsContact C-N 3.27Å; N28-Y30 PolarHBondContact O-N 3.32Å; Y30-Y33 WeakPolarHBondContact O-CB 3.45Å; Y30-Y33 PolarHBondContact O-N 3.41Å; Y30-L34 HydrophobicContact CD1-CD1 3.95Å; Y30-L34 HydrophobicContact CE1-CD1 3.5Å; Y30-L34 VanDerWaalsContact CE1-CD1 3.5Å; Y30-L34 PolarHBondContact O-N 2.78Å; Y30-L42 HydrophobicContact CD1-CB 4.49Å; Y30-L42 HydrophobicContact CD1-CD1 3.49Å; Y30-L42 VanDerWaalsContact CD1-CD1 3.49Å; Y30-L42 HydrophobicContact CD1-CD2 4.46Å; Y30-L42 HydrophobicContact CD1-CG 3.5Å; Y30-L42 HydrophobicContact CD2-CD1 3.87Å; Y30-L42 HydrophobicContact CE1-CD1 3.71Å; Y30-L42 HydrophobicContact CE1-CD2 4.04Å; Y30-L42 HydrophobicContact CE1-CG 3.56Å; Y30-L42 HydrophobicContact CE2-CD1 4.09Å; Y30-L42 HydrophobicContact CG-CD1 3.57Å; Y30-L42 HydrophobicContact CG-CG 4.12Å; Y30-R305 HydrophobicContact CE2-CG 3.98Å; Y30-P310 HydrophobicContact CD1-CB 4.28Å; Y30-P310 HydrophobicContact CD2-CB 3.56Å; Y30-P310 HydrophobicContact CD2-CG 4.28Å; Y30-P310 HydrophobicContact CE1-CB 4.39Å; Y30-P310 HydrophobicContact CE2-CB 3.65Å; Y30-P310 HydrophobicContact CG-CB 3.89Å
31	N	95.8	Very high	94.3	Very high	27 Å²	27	68.6 Å²	68.6	14%	0.144	37%	0.366	C	S	.	.	H	α-helix	trans	-72.7	-31	-177.7	-70.3	-11.8	0	0	0	112.6	L27 N28 L34 K35 H41 L42	L27-N31 WeakPolarHBondContact O-CB 3.45Å; L27-N31 PolarHBondContact O-N 3.26Å; N28-N31 PolarHBondContact O-N 2.78Å; N31-L34 CarbonylContact O-C 3.58Å; N31-L34 VanDerWaalsContact O-C 3.23Å; N31-L34 PolarHBondContact O-N 2.85Å; N31-K35 PolarHBondContact O-N 3.09Å; N31-K35 VanDerWaalsContact O-N 3.13Å; N31-H41 PolarHBondContact O-NE2 2.87Å; N31-H41 WeakPolarHBondContact OD1-CA 3.34Å; N31-L42 PolarHBondContact ND2-O 3.08Å; N31-L42 PolarHBondContact OD1-N 3.32Å
32	C	96	Very high	94.4	Very high	87 Å²	87	65.2 Å²	65.2	59%	0.588	34%	0.338	S	S	*	.	H	α-helix	trans	-65.3	-39.1	172.4	-75.3	0	0	0	0	111.9	N28 L34 K35	N28-C32 WeakPolarHBondContact O-CB 3.42Å; N28-C32 PolarHBondContact O-N 2.88Å; N28-C32 PolarHBondContact O-SG 3.16Å; C32-L34 PolarHBondContact O-N 2.95Å; C32-K35 WeakPolarHBondContact O-CB 3.39Å; C32-K35 PolarHBondContact O-N 2.72Å
33	Y	95.1	Very high	94.4	Very high	125 Å²	125	64.2 Å²	64.2	49%	0.49	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-35.3	173.3	-178.7	-92.4	0	0	0	111.6	T29 Y30 P310	T29-Y33 PolarHBondContact O-N 3.36Å; Y30-Y33 WeakPolarHBondContact O-CB 3.45Å; Y30-Y33 PolarHBondContact O-N 3.41Å; Y33-P310 HydrophobicContact CD1-CB 3.53Å; Y33-P310 HydrophobicContact CD1-CG 3.76Å; Y33-P310 HydrophobicContact CD2-CG 3.99Å; Y33-P310 HydrophobicContact CE1-CB 4.2Å; Y33-P310 HydrophobicContact CG-CB 3.78Å; Y33-P310 HydrophobicContact CG-CG 3.43Å; Y33-P310 VanDerWaalsContact CG-CG 3.43Å
34	L	92.8	Very high	94.4	Very high	25 Å²	25	67.4 Å²	67.4	13%	0.131	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	27.1	177.3	-60.6	177.3	0	0	0	113.1	Y30 N31 C32 D36 Q37 L40 H41	Y30-L34 HydrophobicContact CD1-CD1 3.95Å; Y30-L34 HydrophobicContact CE1-CD1 3.5Å; Y30-L34 VanDerWaalsContact CE1-CD1 3.5Å; Y30-L34 PolarHBondContact O-N 2.78Å; N31-L34 CarbonylContact O-C 3.58Å; N31-L34 VanDerWaalsContact O-C 3.23Å; N31-L34 PolarHBondContact O-N 2.85Å; C32-L34 PolarHBondContact O-N 2.95Å; L34-D36 PolarHBondContact O-N 3.23Å; L34-Q37 CarbonylContact O-C 3.6Å; L34-Q37 WeakPolarHBondContact O-CA 3.42Å; L34-Q37 PolarHBondContact O-N 2.9Å; L34-L40 HydrophobicContact CD1-CB 4.03Å; L34-H41 PolarHBondContact O-CD2 2.85Å; L34-H41 PolarHBondContact O-NE2 3.23Å
35	K	91.9	Very high	94.3	Very high	141 Å²	141	67.8 Å²	67.8	61%	0.613	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-37.2	-174	59.7	177.9	-172.7	177.6	0	114	N31 C32 Q37	N31-K35 PolarHBondContact O-N 3.09Å; N31-K35 VanDerWaalsContact O-N 3.13Å; C32-K35 WeakPolarHBondContact O-CB 3.39Å; C32-K35 PolarHBondContact O-N 2.72Å; K35-Q37 VanDerWaalsContact C-N 3.31Å
36	D	94.2	Very high	93.9	Very high	136 Å²	136	67.8 Å²	67.8	73%	0.727	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.4	-177.4	-53.5	-46.3	0	0	0	112.6	L34	L34-D36 PolarHBondContact O-N 3.23Å
37	Q	92.6	Very high	93	Very high	78 Å²	78	66.6 Å²	66.6	36%	0.364	35%	0.349	S	S	.	.			trans	-130.3	62.3	-175.7	-59.5	-178.7	31.9	0	0	110.7	L34 K35 Q39 L40 H41	L34-Q37 CarbonylContact O-C 3.6Å; L34-Q37 WeakPolarHBondContact O-CA 3.42Å; L34-Q37 PolarHBondContact O-N 2.9Å; K35-Q37 VanDerWaalsContact C-N 3.31Å; Q37-Q39 PolarHBondContact O-N 3.16Å; Q37-Q39 VanDerWaalsContact O-N 3.16Å; Q37-L40 HydrophobicContact CB-CB 4.38Å; Q37-L40 HydrophobicContact CB-CD1 4.11Å; Q37-L40 HydrophobicContact CB-CG 4.21Å; Q37-L40 WeakPolarHBondContact O-CB 3.44Å; Q37-L40 PolarHBondContact O-N 3.17Å; Q37-H41 PolarHBondContact O-CD2 3.39Å
38	T	90.9	Very high	91.9	Very high	95 Å²	95	76.2 Å²	76.2	58%	0.583	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-58.4	-29.2	-176.1	59.2	0	0	0	0	113.8	L40 H41	T38-L40 PolarHBondContact O-N 3.41Å; T38-H41 WeakPolarHBondContact O-CB 3.33Å; T38-H41 PolarHBondContact O-N 3.02Å; T38-H41 VanDerWaalsContact O-N 3.12Å
39	Q	91.7	Very high	90.8	Very high	124 Å²	124	75.6 Å²	75.6	58%	0.579	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-64.1	-16.9	173.8	73.7	-76.9	9.5	0	0	113.8	Q37 F57	Q37-Q39 PolarHBondContact O-N 3.16Å; Q37-Q39 VanDerWaalsContact O-N 3.16Å; Q39-F57 WeakPolarHBondContact O-CE2 3.22Å
40	L	92.6	Very high	89.9	Confident	17 Å²	17	73.1 Å²	73.1	9%	0.089	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-103	1.6	177.8	-55.4	-173.1	0	0	0	113.1	L34 Q37 T38 F57 K252	L34-L40 HydrophobicContact CD1-CB 4.03Å; Q37-L40 HydrophobicContact CB-CB 4.38Å; Q37-L40 HydrophobicContact CB-CD1 4.11Å; Q37-L40 HydrophobicContact CB-CG 4.21Å; Q37-L40 WeakPolarHBondContact O-CB 3.44Å; Q37-L40 PolarHBondContact O-N 3.17Å; T38-L40 PolarHBondContact O-N 3.41Å; L40-F57 HydrophobicContact CD2-CB 4.32Å; L40-F57 HydrophobicContact CD2-CD2 3.67Å; L40-F57 HydrophobicContact CD2-CE2 4.15Å; L40-F57 HydrophobicContact CD2-CG 4.05Å; L40-K252 HydrophobicContact CD1-CD 4.09Å; L40-K252 HydrophobicContact CD2-CD 4.05Å
41	H	94.8	Very high	89.4	Confident	50 Å²	50	77.4 Å²	77.4	23%	0.231	42%	0.421	C	S	.	.			trans	-61.4	144.1	178	-74.3	-170.3	0	0	0	111.1	N31 L34 Q37 T38	N31-H41 PolarHBondContact O-NE2 2.87Å; N31-H41 WeakPolarHBondContact OD1-CA 3.34Å; L34-H41 PolarHBondContact O-CD2 2.85Å; L34-H41 PolarHBondContact O-NE2 3.23Å; Q37-H41 PolarHBondContact O-CD2 3.39Å; T38-H41 WeakPolarHBondContact O-CB 3.33Å; T38-H41 PolarHBondContact O-N 3.02Å; T38-H41 VanDerWaalsContact O-N 3.12Å
42	L	96.2	Very high	89.1	Confident	3 Å²	3	76.5 Å²	76.5	2%	0.016	42%	0.416	C	S	.	.			trans	-76.6	134.1	168.8	-60.6	-176	0	0	0	108.8	L27 Y30 N31 V54 L302 I306	L27-L42 HydrophobicContact CD1-CB 3.45Å; L27-L42 VanDerWaalsContact CD1-CB 3.45Å; L27-L42 HydrophobicContact CD1-CD1 4.2Å; L27-L42 HydrophobicContact CD1-CG 4.48Å; Y30-L42 HydrophobicContact CD1-CB 4.49Å; Y30-L42 HydrophobicContact CD1-CD1 3.49Å; Y30-L42 VanDerWaalsContact CD1-CD1 3.49Å; Y30-L42 HydrophobicContact CD1-CD2 4.46Å; Y30-L42 HydrophobicContact CD1-CG 3.5Å; Y30-L42 HydrophobicContact CD2-CD1 3.87Å; Y30-L42 HydrophobicContact CE1-CD1 3.71Å; Y30-L42 HydrophobicContact CE1-CD2 4.04Å; Y30-L42 HydrophobicContact CE1-CG 3.56Å; Y30-L42 HydrophobicContact CE2-CD1 4.09Å; Y30-L42 HydrophobicContact CG-CD1 3.57Å; Y30-L42 HydrophobicContact CG-CG 4.12Å; N31-L42 PolarHBondContact ND2-O 3.08Å; N31-L42 PolarHBondContact OD1-N 3.32Å; L42-V54 HydrophobicContact CB-CG1 4.01Å; L42-V54 HydrophobicContact CD1-CG1 4.35Å; L42-L302 HydrophobicContact CD2-CD1 4.18Å; L42-I306 HydrophobicContact CD1-CD1 3.86Å; L42-I306 HydrophobicContact CD1-CG1 3.58Å
43	T	95.1	Very high	89	Confident	76 Å²	76	73.2 Å²	73.2	47%	0.466	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	153.6	174.5	59	0	0	0	0	108.7	V54 E55	T43-V54 CarbonylContact O-C 3.52Å; T43-V54 VanDerWaalsContact O-CA 3.27Å; T43-V54 WeakPolarHBondContact O-CA 3.41Å; T43-V54 WeakPolarHBondContact O-CG1 3.49Å; T43-E55 PolarHBondContact N-O 3.29Å; T43-E55 PolarHBondContact O-N 3.41Å; T43-E55 PolarHBondContact OG1-O 2.97Å
44	Y	94.4	Very high	89	Confident	69 Å²	69	67.2 Å²	67.2	27%	0.271	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.3	172	75.3	-86.2	0	0	0	110.9	L6 F23 L24 L27 V52 I53	L6-Y44 HydrophobicContact CD1-CE2 4.11Å; L6-Y44 HydrophobicContact CD2-CD2 4.02Å; L6-Y44 HydrophobicContact CD2-CE2 3.56Å; L6-Y44 HydrophobicContact CG-CE2 4.08Å; F23-Y44 HydrophobicContact CE1-CD1 4.2Å; F23-Y44 HydrophobicContact CE1-CD2 4.45Å; F23-Y44 HydrophobicContact CE1-CG 4.13Å; F23-Y44 HydrophobicContact CZ-CD1 4.29Å; F23-Y44 HydrophobicContact CZ-CG 4.07Å; L24-Y44 HydrophobicContact CD2-CE1 4.37Å; L27-Y44 HydrophobicContact CD2-CD1 3.44Å; L27-Y44 VanDerWaalsContact CD2-CD1 3.44Å; L27-Y44 HydrophobicContact CD2-CE1 3.92Å; Y44-V52 HydrophobicContact CD2-CG1 4.15Å; Y44-V52 HydrophobicContact CG-CG1 4.39Å; Y44-I53 CarbonylContact C-O 3.56Å; Y44-I53 WeakPolarHBondContact CA-O 3.49Å
45	S	91.9	Very high	89.2	Confident	54 Å²	54	69.8 Å²	69.8	38%	0.378	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	164.7	171.5	64.2	0	0	0	0	109.5	I53	S45-I53 PolarHBondContact N-O 2.87Å; S45-I53 PolarHBondContact O-N 3.4Å
46	Q	87.8	Confident	89.4	Confident	70 Å²	70	63.1 Å²	63.1	33%	0.327	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.2	173.5	-165.2	171	34.5	0	0	108.3	G50 Q51	Q46-G50 PolarHBondContact NE2-O 3.49Å; Q46-Q51 WeakPolarHBondContact CA-O 3.41Å
47	G	78.3	Confident	89.5	Confident	22 Å²	22	59.3 Å²	59.3	23%	0.227	33%	0.329	C	S	.	.			trans	-74.8	171.1	178.3	0	0	0	0	0	113	G49 G50 Q51	G47-G49 PolarHBondContact O-N 2.85Å; G47-G50 PolarHBondContact O-N 2.94Å; G47-Q51 PolarHBondContact N-O 2.99Å
48	H	71.1	Confident	89.7	Confident	212 Å²	212	55.6 Å²	55.6	98%	0.981	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	108.7	169.9	-62.7	-70.8	0	0	0	109.1
49	G	71.6	Confident	89.9	Confident	83 Å²	83	52.3 Å²	52.3	86%	0.856	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.7	5.2	-174.7	0	0	0	0	0	115.2	G47 Q51	G47-G49 PolarHBondContact O-N 2.85Å; G49-Q51 VanDerWaalsContact C-N 3.27Å; G49-Q51 PolarHBondContact O-N 3.06Å
50	G	77.7	Confident	90.2	Very high	27 Å²	27	46.5 Å²	46.5	28%	0.278	26%	0.263	S	S	.	.	S	Bend	trans	83.5	-1.8	172.5	0	0	0	0	0	114.9	Q46 G47	Q46-G50 PolarHBondContact NE2-O 3.49Å; G47-G50 PolarHBondContact O-N 2.94Å
51	Q	84	Confident	90.4	Very high	105 Å²	105	45.9 Å²	45.9	49%	0.491	26%	0.26	S	S	.	.			trans	-70	136.3	177.5	-169.9	174.9	36.2	0	0	111.1	Q46 G47 G49	Q46-Q51 WeakPolarHBondContact CA-O 3.41Å; G47-Q51 PolarHBondContact N-O 2.99Å; G49-Q51 VanDerWaalsContact C-N 3.27Å; G49-Q51 PolarHBondContact O-N 3.06Å
52	V	90.5	Very high	90.4	Very high	8 Å²	8	43.6 Å²	43.6	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.6	176.5	-179.9	0	0	0	0	109.5	L6 P7 I10 F23 Y44 V54	L6-V52 HydrophobicContact CD2-CG2 3.6Å; P7-V52 HydrophobicContact CG-CG2 3.81Å; I10-V52 HydrophobicContact CD1-CB 4.49Å; I10-V52 HydrophobicContact CD1-CG2 3.89Å; I10-V52 HydrophobicContact CG1-CB 4.43Å; I10-V52 HydrophobicContact CG1-CG2 3.83Å; I10-V52 HydrophobicContact CG2-CB 4.09Å; I10-V52 HydrophobicContact CG2-CG2 4.41Å; F23-V52 HydrophobicContact CE1-CG1 4Å; F23-V52 HydrophobicContact CE2-CG1 4.19Å; F23-V52 HydrophobicContact CZ-CG1 3.63Å; Y44-V52 HydrophobicContact CD2-CG1 4.15Å; Y44-V52 HydrophobicContact CG-CG1 4.39Å; V52-V54 HydrophobicContact CG1-CG2 4.5Å
53	I	93.7	Very high	90.4	Very high	17 Å²	17	43.5 Å²	43.5	9%	0.087	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.5	176.5	-56.3	175.1	0	0	0	107.3	Y44 S45 E55 S256 S257 R258	Y44-I53 CarbonylContact C-O 3.56Å; Y44-I53 WeakPolarHBondContact CA-O 3.49Å; S45-I53 PolarHBondContact N-O 2.87Å; S45-I53 PolarHBondContact O-N 3.4Å; I53-E55 HydrophobicContact CG2-CG 4.27Å; I53-S256 WeakPolarHBondContact CG2-OG 3.33Å; I53-S257 WeakPolarHBondContact CA-OG 3.32Å; I53-R258 HydrophobicContact CD1-CG 4.46Å; I53-R258 HydrophobicContact CG1-CG 4.18Å; I53-R258 HydrophobicContact CG2-CG 4.28Å
54	V	95.3	Very high	90.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.5	170	-168	0	0	0	0	109.6	F23 L27 L42 T43 V52 S256 S257 L302 W303 I306	F23-V54 HydrophobicContact CE2-CG2 3.63Å; F23-V54 HydrophobicContact CZ-CG2 3.89Å; L27-V54 HydrophobicContact CD1-CG1 4.22Å; L42-V54 HydrophobicContact CB-CG1 4.01Å; L42-V54 HydrophobicContact CD1-CG1 4.35Å; T43-V54 CarbonylContact O-C 3.52Å; T43-V54 VanDerWaalsContact O-CA 3.27Å; T43-V54 WeakPolarHBondContact O-CA 3.41Å; T43-V54 WeakPolarHBondContact O-CG1 3.49Å; V52-V54 HydrophobicContact CG1-CG2 4.5Å; V54-S256 CarbonylContact O-C 3.48Å; V54-S256 WeakPolarHBondContact O-CA 3.47Å; V54-S257 PolarHBondContact N-OG 2.77Å; V54-S257 WeakPolarHBondContact O-CB 3.5Å; V54-S257 PolarHBondContact O-N 3.42Å; V54-S257 PolarHBondContact O-OG 2.84Å; V54-S257 VanDerWaalsContact O-OG 3.07Å; V54-L302 HydrophobicContact CB-CD2 4.24Å; V54-L302 HydrophobicContact CG1-CD2 4.26Å; V54-W303 HydrophobicContact CG2-CH2 3.73Å; V54-W303 HydrophobicContact CG2-CZ2 4.1Å; V54-W303 HydrophobicContact CG2-CZ3 4.28Å; V54-I306 HydrophobicContact CB-CD1 4.23Å; V54-I306 HydrophobicContact CG1-CD1 3.87Å; V54-I306 HydrophobicContact CG2-CD1 4.32Å
55	E	96.7	Very high	89.8	Confident	78 Å²	78	45.6 Å²	45.6	36%	0.364	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	143	175.7	-60.7	-167.6	154.3	0	0	110.5	T43 I53	T43-E55 PolarHBondContact N-O 3.29Å; T43-E55 PolarHBondContact O-N 3.41Å; T43-E55 PolarHBondContact OG1-O 2.97Å; I53-E55 HydrophobicContact CG2-CG 4.27Å
56	G	96.1	Very high	89.5	Confident	2 Å²	2	46.1 Å²	46.1	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174	-159.5	176.6	0	0	0	0	0	112.8	R254 I255	G56-R254 CarbonylContact O-C 3.57Å; G56-R254 WeakPolarHBondContact O-CA 3.42Å; G56-I255 PolarHBondContact N-O 2.92Å; G56-I255 VanDerWaalsContact N-O 3.09Å; G56-I255 PolarHBondContact O-N 3.2Å
57	F	96.1	Very high	89.3	Confident	55 Å²	55	47 Å²	47	24%	0.241	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.8	177.1	-70.1	-85.5	0	0	0	111	Q39 L40 K252 V253 R254	Q39-F57 WeakPolarHBondContact O-CE2 3.22Å; L40-F57 HydrophobicContact CD2-CB 4.32Å; L40-F57 HydrophobicContact CD2-CD2 3.67Å; L40-F57 HydrophobicContact CD2-CE2 4.15Å; L40-F57 HydrophobicContact CD2-CG 4.05Å; F57-K252 HydrophobicContact CB-CB 4.39Å; F57-K252 HydrophobicContact CD1-CB 4.08Å; F57-V253 CarbonylContact C-O 3.57Å; F57-V253 WeakPolarHBondContact CA-O 3.43Å; F57-R254 HydrophobicContact CD1-CB 4Å; F57-R254 HydrophobicContact CE1-CB 3.75Å; F57-R254 HydrophobicContact CE1-CG 4.37Å; F57-R254 HydrophobicContact CZ-CB 4.33Å
58	L	96.5	Very high	89.9	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130.5	168.1	-177.6	65	0	0	0	109.5	I60 K252 V253 I255 V264 P301 R305 I317	L58-I60 HydrophobicContact CD2-CD1 4.18Å; L58-I60 HydrophobicContact CD2-CG1 4.03Å; L58-I60 HydrophobicContact CG-CG1 4.06Å; L58-K252 CarbonylContact O-C 3.46Å; L58-K252 WeakPolarHBondContact O-CA 3.19Å; L58-V253 PolarHBondContact N-O 2.93Å; L58-V253 PolarHBondContact O-N 2.81Å; L58-I255 HydrophobicContact CB-CD1 3.41Å; L58-I255 VanDerWaalsContact CB-CD1 3.41Å; L58-I255 HydrophobicContact CB-CG1 3.79Å; L58-I255 HydrophobicContact CD2-CD1 3.46Å; L58-I255 VanDerWaalsContact CD2-CD1 3.46Å; L58-I255 HydrophobicContact CG-CD1 4.01Å; L58-V264 HydrophobicContact CD2-CG1 4.48Å; L58-P301 HydrophobicContact CD2-CB 3.75Å; L58-R305 HydrophobicContact CD1-CB 3.6Å; L58-R305 HydrophobicContact CD1-CG 3.67Å; L58-I317 HydrophobicContact CD1-CD1 4.01Å; L58-I317 HydrophobicContact CD2-CD1 4.16Å
59	N	95.9	Very high	90.9	Very high	27 Å²	27	42.5 Å²	42.5	14%	0.144	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.4	171.6	-163.1	26.2	0	0	0	110	S250 T251 R305 D312	N59-S250 VanDerWaalsContact ND2-CB 3.34Å; N59-S250 WeakPolarHBondContact ND2-CB 3.37Å; N59-S250 PolarHBondContact ND2-OG 3.26Å; N59-S250 WeakPolarHBondContact OD1-CB 3.36Å; N59-S250 PolarHBondContact OD1-OG 2.92Å; N59-T251 PolarHBondContact OD1-N 3.11Å; N59-R305 PolarHBondContact O-NH2 3.24Å; N59-D312 PolarHBondContact ND2-OD2 3.4Å
60	I	97.3	Very high	91.7	Very high	2 Å²	2	40 Å²	40	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.9	179.1	-54.7	175.1	0	0	0	108.3	L58 T251 V253 V264 L268 L283 I317 L319	L58-I60 HydrophobicContact CD2-CD1 4.18Å; L58-I60 HydrophobicContact CD2-CG1 4.03Å; L58-I60 HydrophobicContact CG-CG1 4.06Å; I60-T251 PolarHBondContact N-O 2.91Å; I60-T251 PolarHBondContact O-N 2.96Å; I60-V253 HydrophobicContact CD1-CB 4.46Å; I60-V253 HydrophobicContact CD1-CG2 4.05Å; I60-V264 HydrophobicContact CD1-CG1 3.62Å; I60-L268 HydrophobicContact CB-CD2 4.28Å; I60-L268 HydrophobicContact CD1-CD2 4.13Å; I60-L268 HydrophobicContact CG2-CD2 3.82Å; I60-L283 HydrophobicContact CG2-CD2 4.15Å; I60-I317 CarbonylContact C-O 3.59Å; I60-I317 WeakPolarHBondContact CA-O 3.32Å; I60-L319 HydrophobicContact CG2-CB 4.12Å
61	S	97.1	Very high	92	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	149.2	175.4	-73.4	0	0	0	0	111.8	D248 T249 S250 I317 F318 L319	S61-D248 PolarHBondContact OG-OD1 2.82Å; S61-T249 CarbonylContact C-O 3.57Å; S61-T249 VanDerWaalsContact CA-O 3.3Å; S61-T249 WeakPolarHBondContact CA-O 3.39Å; S61-S250 PolarHBondContact OG-OG 2.83Å; S61-I317 PolarHBondContact N-O 3.21Å; S61-F318 CarbonylContact O-C 3.6Å; S61-F318 WeakPolarHBondContact O-CA 3.49Å; S61-L319 PolarHBondContact O-N 3.34Å
62	W	96.2	Very high	91.8	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.8	173.1	-64.5	98.2	0	0	0	111.1	V64 I68 H234 F243 P245 D248 T249 T251 L268 F272 I274 L319	W62-V64 HydrophobicContact CE3-CG2 4.4Å; W62-I68 HydrophobicContact CZ3-CD1 4.28Å; W62-H234 AromaticContact CD1-CE1 3.42Å; W62-H234 VanDerWaalsContact CD1-CE1 3.42Å; W62-H234 AromaticContact NE1-CE1 3.48Å; W62-H234 PolarHBondContact NE1-CE1 2.87Å; W62-H234 AromaticContact NE1-NE2 3.95Å; W62-F243 HydrophobicContact CH2-CE1 4.45Å; W62-F243 HydrophobicContact CZ2-CE1 4.47Å; W62-P245 HydrophobicContact CB-CB 3.75Å; W62-P245 HydrophobicContact CB-CG 4.33Å; W62-P245 HydrophobicContact CD2-CB 3.71Å; W62-P245 HydrophobicContact CD2-CG 4.3Å; W62-P245 HydrophobicContact CE3-CB 3.9Å; W62-P245 HydrophobicContact CE3-CG 3.99Å; W62-P245 HydrophobicContact CG-CB 3.65Å; W62-P245 HydrophobicContact CG-CG 4.47Å; W62-D248 PolarHBondContact O-N 3.46Å; W62-T249 PolarHBondContact N-O 2.83Å; W62-T251 PolarHBondContact NE1-OG1 2.8Å; W62-L268 HydrophobicContact CH2-CD1 4.34Å; W62-L268 HydrophobicContact CH2-CD2 4.46Å; W62-L268 HydrophobicContact CH2-CG 4.25Å; W62-L268 HydrophobicContact CZ2-CD1 4.13Å; W62-F272 AromaticContact CH2-CD2 3.99Å; W62-F272 HydrophobicContact CH2-CD2 3.99Å; W62-F272 HydrophobicContact CH2-CE2 4.35Å; W62-F272 HydrophobicContact CH2-CG 4.2Å; W62-F272 HydrophobicContact CZ2-CD1 4.15Å; W62-F272 AromaticContact CZ2-CD2 3.58Å; W62-F272 HydrophobicContact CZ2-CD2 3.58Å; W62-F272 HydrophobicContact CZ2-CE1 4.08Å; W62-F272 AromaticContact CZ2-CE2 3.51Å; W62-F272 HydrophobicContact CZ2-CE2 3.51Å; W62-F272 AromaticContact CZ2-CG 3.9Å; W62-F272 HydrophobicContact CZ2-CG 3.9Å; W62-F272 AromaticContact CZ2-CZ 3.77Å; W62-F272 HydrophobicContact CZ2-CZ 3.77Å; W62-I274 HydrophobicContact CH2-CD1 3.75Å; W62-I274 HydrophobicContact CZ3-CD1 4.08Å; W62-L319 HydrophobicContact CE3-CD2 3.92Å; W62-L319 HydrophobicContact CH2-CD2 4.26Å; W62-L319 HydrophobicContact CZ3-CD2 3.45Å; W62-L319 VanDerWaalsContact CZ3-CD2 3.45Å
63	G	95.1	Very high	90.3	Very high	2 Å²	2	52.3 Å²	52.3	2%	0.021	24%	0.239	C	C	.	.			trans	-131.5	11.1	174.1	0	0	0	0	0	113.7	L319	G63-L319 CarbonylContact C-O 3.23Å; G63-L319 WeakPolarHBondContact CA-O 3.43Å; G63-L319 PolarHBondContact N-O 3.44Å
64	V	92.7	Very high	88.4	Confident	12 Å²	12	58.9 Å²	58.9	7%	0.073	27%	0.274	C	S	.	.			trans	-68.4	130.1	178.6	-177.3	0	0	0	0	110.1	W62 R66 I68 P245 F281 L319 D321	W62-V64 HydrophobicContact CE3-CG2 4.4Å; V64-R66 HydrophobicContact CG1-CG 3.85Å; V64-R66 WeakPolarHBondContact CG1-O 3.49Å; V64-I68 HydrophobicContact CB-CD1 3.91Å; V64-I68 HydrophobicContact CG1-CD1 3.68Å; V64-I68 HydrophobicContact CG1-CG1 3.78Å; V64-I68 HydrophobicContact CG2-CD1 3.97Å; V64-P245 HydrophobicContact CB-CG 4.32Å; V64-F281 HydrophobicContact CG1-CE1 4.02Å; V64-F281 HydrophobicContact CG2-CD1 3.86Å; V64-F281 HydrophobicContact CG2-CE1 3.78Å; V64-L319 HydrophobicContact CG2-CD2 4.18Å; V64-L319 HydrophobicContact CG2-CG 4.29Å; V64-L319 WeakPolarHBondContact CG2-O 3.34Å; V64-L319 PolarHBondContact N-O 3.45Å; V64-D321 WeakPolarHBondContact CG1-OD1 3.41Å
65	R	85.2	Confident	86.2	Confident	176 Å²	176	66.3 Å²	66.3	66%	0.664	31%	0.309	S	S	*	.			trans	-99.6	-29.8	178.7	-65.5	-174	-174.8	146	14.9	112.7	D321 E324	R65-D321 PolarHBondContact N-OD2 3.2Å; R65-E324 IonicContact CZ-OE1 3.74Å; R65-E324 IonicContact CZ-OE2 3.35Å; R65-E324 IonicContact NH1-OE1 2.57Å; R65-E324 PolarHBondContact NH1-OE1 3.06Å; R65-E324 IonicContact NH1-OE2 3.38Å; R65-E324 IonicContact NH2-OE1 3.95Å; R65-E324 PolarHBondContact NH2-OE1 3.27Å; R65-E324 IonicContact NH2-OE2 3.26Å
66	R	84.9	Confident	83.7	Confident	65 Å²	65	71.8 Å²	71.8	25%	0.245	33%	0.332	C	S	.	.	S	Bend	trans	-76.8	154.8	179.7	70.4	-168.3	177.1	94.1	7.5	112.3	V64 I68 N276 E280 F281 D321	V64-R66 HydrophobicContact CG1-CG 3.85Å; V64-R66 WeakPolarHBondContact CG1-O 3.49Å; R66-I68 PolarHBondContact O-N 2.9Å; R66-N276 PolarHBondContact NH1-ND2 3.02Å; R66-E280 IonicContact CZ-OE2 2.64Å; R66-E280 IonicContact NH1-OE1 3.93Å; R66-E280 IonicContact NH1-OE2 3.09Å; R66-E280 PolarHBondContact NH1-OE2 3.25Å; R66-E280 IonicContact NH2-OE2 3.8Å; R66-E280 PolarHBondContact NH2-OE2 3.49Å; R66-F281 VanDerWaalsContact NH2-CE2 3.31Å; R66-D321 WeakPolarHBondContact CD-OD1 3.45Å; R66-D321 VanDerWaalsContact CG-OD1 3.26Å; R66-D321 WeakPolarHBondContact CG-OD1 3.5Å; R66-D321 IonicContact CZ-OD1 3.94Å; R66-D321 PolarHBondContact N-OD2 3.48Å; R66-D321 IonicContact NE-OD1 2.95Å; R66-D321 PolarHBondContact NE-OD1 3.08Å
67	P	83.7	Confident	81.1	Confident	89 Å²	89	79.7 Å²	79.7	58%	0.578	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-61.7	129.9	173.2	-20.9	32.7	0	0	0	111.5	I242	P67-I242 HydrophobicContact CB-CG2 4.06Å
68	I	91.8	Very high	78.3	Confident	0 Å²	0	84.9 Å²	84.9	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	150.1	174.7	-50.7	177.6	0	0	0	108.4	W62 V64 R66 I242 F243 P245 I274 N276 F281	W62-I68 HydrophobicContact CZ3-CD1 4.28Å; V64-I68 HydrophobicContact CB-CD1 3.91Å; V64-I68 HydrophobicContact CG1-CD1 3.68Å; V64-I68 HydrophobicContact CG1-CG1 3.78Å; V64-I68 HydrophobicContact CG2-CD1 3.97Å; R66-I68 PolarHBondContact O-N 2.9Å; I68-I242 CarbonylContact O-C 3.57Å; I68-I242 WeakPolarHBondContact O-CA 3.4Å; I68-F243 PolarHBondContact N-O 3.13Å; I68-F243 PolarHBondContact O-N 3.19Å; I68-P245 HydrophobicContact CD1-CG 3.94Å; I68-I274 HydrophobicContact CG2-CB 4.13Å; I68-I274 HydrophobicContact CG2-CD1 3.92Å; I68-I274 HydrophobicContact CG2-CG1 3.76Å; I68-I274 HydrophobicContact CG2-CG2 3.31Å; I68-N276 WeakPolarHBondContact CG2-OD1 3.28Å; I68-F281 HydrophobicContact CD1-CE1 4.04Å; I68-F281 HydrophobicContact CD1-CZ 4.27Å; I68-F281 HydrophobicContact CG1-CE1 4.31Å; I68-F281 HydrophobicContact CG1-CZ 4.33Å; I68-F281 HydrophobicContact CG2-CZ 4.3Å
69	R	90.3	Very high	75.4	Confident	140 Å²	140	90.8 Å²	90.8	53%	0.528	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.6	176.7	-68.9	-178.8	171.8	-142.3	-1.3	111.8	S241 I274 E275 N276	R69-S241 CarbonylContact C-O 3.56Å; R69-S241 VanDerWaalsContact CA-O 3.28Å; R69-S241 WeakPolarHBondContact CA-O 3.13Å; R69-I274 CarbonylContact O-C 3.56Å; R69-I274 WeakPolarHBondContact O-CA 3.46Å; R69-E275 HydrophobicContact CB-CB 4.45Å; R69-E275 PolarHBondContact O-N 3.27Å; R69-N276 PolarHBondContact N-OD1 2.93Å
70	L	89.2	Confident	72.5	Confident	29 Å²	29	94.8 Å²	94.8	15%	0.152	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-92.3	143.4	169.6	-53.1	-168.7	0	0	0	110.3	I72 Y236 S241 F243 F272 K273 I274	L70-I72 PolarHBondContact O-N 3.43Å; L70-Y236 HydrophobicContact CB-CE2 3.96Å; L70-Y236 HydrophobicContact CD1-CD2 3.49Å; L70-Y236 VanDerWaalsContact CD1-CD2 3.49Å; L70-Y236 HydrophobicContact CD1-CE2 3.35Å; L70-Y236 HydrophobicContact CD1-CG 4.46Å; L70-Y236 HydrophobicContact CG-CD2 3.96Å; L70-Y236 HydrophobicContact CG-CE2 3.66Å; L70-S241 PolarHBondContact N-O 2.79Å; L70-S241 WeakPolarHBondContact O-CB 3.48Å; L70-F243 HydrophobicContact CD1-CB 4.32Å; L70-F243 HydrophobicContact CD1-CD2 4.47Å; L70-F243 HydrophobicContact CD2-CB 3.64Å; L70-F243 HydrophobicContact CD2-CD1 4.36Å; L70-F243 HydrophobicContact CD2-CG 3.97Å; L70-F243 HydrophobicContact CG-CB 3.8Å; L70-F243 HydrophobicContact CG-CG 4.44Å; L70-F272 WeakPolarHBondContact CD2-O 3.39Å; L70-K273 CarbonylContact C-O 3.49Å; L70-K273 VanDerWaalsContact CA-O 3.29Å; L70-K273 WeakPolarHBondContact CA-O 3.45Å; L70-I274 HydrophobicContact CD2-CG1 3.86Å
71	K	84.9	Confident	69.6	Low	149 Å²	149	102.7 Å²	102.7	65%	0.648	50%	0.497	S	S	*	.			trans	-63.7	114.8	170.4	-170.2	172	-174.6	171.8	0	108.8	Q73 K273	K71-Q73 PolarHBondContact O-N 3.04Å; K71-K273 HydrophobicContact CB-CB 4.46Å; K71-K273 WeakPolarHBondContact CB-O 3.2Å; K71-K273 PolarHBondContact N-O 2.87Å
72	I	78.3	Confident	66.6	Low	101 Å²	101	111.1 Å²	111.1	52%	0.518	54%	0.535	S	S	.	.			trans	-72.9	123.9	171.1	-53.3	173.2	0	0	0	106.9	L70 S241	L70-I72 PolarHBondContact O-N 3.43Å; I72-S241 WeakPolarHBondContact CD1-OG 3.34Å; I72-S241 WeakPolarHBondContact CG1-OG 3.42Å
73	Q	60.6	Low	63.5	Low	150 Å²	150	115.7 Å²	115.7	70%	0.701	57%	0.568	S	S	*	*			trans	-93.8	101.1	173.6	-150.7	158.2	5.9	0	0	107.1	K71 E75	K71-Q73 PolarHBondContact O-N 3.04Å; Q73-E75 PolarHBondContact O-N 3.15Å
74	D	52.8	Low	60.6	Low	154 Å²	154	121.4 Å²	121.4	82%	0.824	60%	0.604	S	S	*	*			trans	-72.5	67	174.1	-76	-28.9	0	0	0	110.1
75	E	49	Very low	57.6	Low	157 Å²	157	127 Å²	127	73%	0.734	64%	0.639	S	S	*	*			trans	-120.5	97.3	166.9	-75.3	-170.1	-177	0	0	109.9	Q73	Q73-E75 PolarHBondContact O-N 3.15Å
76	K	44.5	Very low	55.2	Low	192 Å²	192	124.1 Å²	124.1	84%	0.835	65%	0.646	S	S	*	*	S	Bend	trans	81.5	100.1	170.9	-53	-178.9	-174.9	179.3	0	115	I78	K76-I78 PolarHBondContact O-N 3.35Å; K76-I78 VanDerWaalsContact O-N 3.13Å
77	Q	40.8	Very low	52.7	Low	169 Å²	169	128 Å²	128	79%	0.79	68%	0.676	S	S	*	*			trans	15.4	88.8	146.9	-61.2	-180	20.6	0	0	114.1	L79	Q77-L79 HydrophobicContact CB-CG 4.41Å; Q77-L79 PolarHBondContact O-N 3.44Å
78	I	38.4	Very low	50.2	Low	163 Å²	163	131.6 Å²	131.6	84%	0.836	69%	0.691	S	S	*	*			trans	-69.9	85.2	153	-56.1	171.8	0	0	0	104.5	K76	K76-I78 PolarHBondContact O-N 3.35Å; K76-I78 VanDerWaalsContact O-N 3.13Å
79	L	34.3	Very low	47.9	Very low	125 Å²	125	136.5 Å²	136.5	65%	0.654	72%	0.722	S	S	*	*			trans	-52.5	131.5	164.7	-68.9	170.9	0	0	0	106.4	Q77 L81	Q77-L79 HydrophobicContact CB-CG 4.41Å; Q77-L79 PolarHBondContact O-N 3.44Å; L79-L81 PolarHBondContact O-N 3.43Å
80	P	34.9	Very low	45	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	74%	0.739	S	S	*	*			trans	-53.9	122.6	170.2	-18.1	29.3	0	0	0	107.1	E82	P80-E82 PolarHBondContact O-N 2.77Å
81	L	37.3	Very low	42.1	Very low	169 Å²	169	140 Å²	140	89%	0.885	77%	0.765	S	S	*	*			trans	-61.2	95.6	168.7	-175.8	68.8	0	0	0	106.4	L79 S83	L79-L81 PolarHBondContact O-N 3.43Å; L81-S83 PolarHBondContact O-N 3.41Å
82	E	34.2	Very low	39.5	Very low	179 Å²	179	141 Å²	141	84%	0.836	77%	0.772	S	S	*	*			trans	-59.1	121.2	166.7	-73.9	-172	160.8	0	0	106.8	P80	P80-E82 PolarHBondContact O-N 2.77Å
83	S	31	Very low	37.3	Very low	99 Å²	99	143.8 Å²	143.8	69%	0.692	79%	0.788	S	S	*	*			trans	-55	125.5	176.3	47.5	0	0	0	0	109.8	L81 T85	L81-S83 PolarHBondContact O-N 3.41Å; S83-T85 PolarHBondContact O-N 3.07Å; S83-T85 VanDerWaalsContact O-N 3.13Å
84	P	34.5	Very low	35.7	Very low	121 Å²	121	142 Å²	142	79%	0.786	79%	0.792	S	S	*	*			trans	-69.6	115.4	172	26.7	-29.6	0	0	0	108.6	S86	P84-S86 PolarHBondContact O-N 3.47Å
85	T	29	Very low	34.5	Very low	129 Å²	129	141.3 Å²	141.3	79%	0.791	79%	0.794	S	S	*	*			trans	-57.6	117.4	161.4	31.6	0	0	0	0	109.7	S83	S83-T85 PolarHBondContact O-N 3.07Å; S83-T85 VanDerWaalsContact O-N 3.13Å
86	S	33.8	Very low	33.5	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	80%	0.798	S	S	*	*			trans	9.7	110.3	145.1	162.4	0	0	0	0	116.8	P84	P84-S86 PolarHBondContact O-N 3.47Å
87	V	33.4	Very low	32.8	Very low	147 Å²	147	136.3 Å²	136.3	89%	0.891	80%	0.795	S	S	*	*			trans	-154.3	140.5	140.1	-98.2	0	0	0	0	110.2
88	D	30.3	Very low	32.1	Very low	164 Å²	164	137 Å²	137	88%	0.877	80%	0.801	S	S	*	*			trans	-68.5	172	-168.9	-122.3	2.8	0	0	0	115.2
89	P	43.9	Very low	31.7	Very low	103 Å²	103	134.8 Å²	134.8	67%	0.669	80%	0.799	S	S	*	*			trans	-96.5	148.9	-150.2	37.6	-37	0	0	0	114.2
90	T	29.2	Very low	31.4	Very low	141 Å²	141	138.4 Å²	138.4	87%	0.865	81%	0.805	S	S	*	*			trans	-158.5	116	145.4	-8.3	0	0	0	0	112.2
91	S	28.1	Very low	31.1	Very low	101 Å²	101	145.1 Å²	145.1	71%	0.706	82%	0.816	S	S	*	*			trans	72.6	126.7	142.9	-137.5	0	0	0	0	121.6
92	Q	32	Very low	30.7	Very low	170 Å²	170	140 Å²	140	79%	0.794	80%	0.804	S	S	*	*			trans	101.1	92.1	146.7	-47.6	-157.9	-25.5	0	0	119.4
93	N	30.3	Very low	30.3	Very low	161 Å²	161	138.8 Å²	138.8	86%	0.861	80%	0.798	S	S	*	*			trans	50	107.9	130.9	-64.1	-0.1	0	0	0	119.8
94	S	28.1	Very low	30.1	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	80%	0.801	S	S	*	*			trans	-68.3	139.4	166.1	29.4	0	0	0	0	113.6
95	T	27.6	Very low	29.8	Very low	139 Å²	139	142 Å²	142	85%	0.853	81%	0.805	S	S	*	*			trans	-158.8	92.6	130.8	-4.8	0	0	0	0	109
96	S	28.2	Very low	29.8	Very low	117 Å²	117	144.5 Å²	144.5	82%	0.818	81%	0.808	S	S	*	*			trans	-126.2	90.8	166.5	-174.5	0	0	0	0	107.8	M98	S96-M98 PolarHBondContact O-N 3.09Å
97	T	30.4	Very low	29.4	Very low	127 Å²	127	144.9 Å²	144.9	78%	0.779	81%	0.805	S	S	*	*			trans	-70.1	112.5	172.3	41.2	0	0	0	0	109.2
98	M	25.6	Very low	29.2	Very low	183 Å²	183	146.9 Å²	146.9	90%	0.901	80%	0.804	S	S	*	*			trans	-72.5	131.8	171	-98.7	-168.4	68	0	0	110.9	S96 R100	S96-M98 PolarHBondContact O-N 3.09Å; M98-R100 PolarHBondContact O-N 2.72Å
99	S	30.5	Very low	28.8	Very low	116 Å²	116	147.9 Å²	147.9	81%	0.811	80%	0.803	S	S	*	*			trans	-53.3	114.2	-174	-53.8	0	0	0	0	113.7
100	R	27.3	Very low	28	Very low	202 Å²	202	150.7 Å²	150.7	76%	0.762	81%	0.811	S	S	*	*			trans	-37.8	129.8	151.4	-174.2	176.4	-173.9	170.8	-2.1	110.8	M98 G102 E103	M98-R100 PolarHBondContact O-N 2.72Å; R100-G102 PolarHBondContact O-N 2.84Å; R100-G102 VanDerWaalsContact O-N 3.08Å; R100-E103 IonicContact CZ-OE2 2.93Å; R100-E103 IonicContact NE-OE2 2.82Å; R100-E103 IonicContact NH2-OE2 3.76Å; R100-E103 PolarHBondContact NH2-OE2 2.94Å
101	W	28.7	Very low	27.8	Very low	251 Å²	251	153.3 Å²	153.3	95%	0.951	81%	0.811	S	S	*	*			trans	-55.7	114.8	169.3	-73.3	93.5	0	0	0	108.9	E103	W101-E103 PolarHBondContact O-N 3.07Å
102	G	28.3	Very low	27.7	Very low	62 Å²	62	156.4 Å²	156.4	64%	0.639	81%	0.814	S	S	*	*			trans	-62.7	113.1	-173.1	0	0	0	0	0	112.4	R100	R100-G102 PolarHBondContact O-N 2.84Å; R100-G102 VanDerWaalsContact O-N 3.08Å
103	E	27.2	Very low	27.6	Very low	152 Å²	152	154.3 Å²	154.3	71%	0.71	82%	0.815	S	S	*	*			trans	-58.2	122.8	144.3	-70.9	165.4	128.1	0	0	108.5	R100 W101	R100-E103 IonicContact CZ-OE2 2.93Å; R100-E103 IonicContact NE-OE2 2.82Å; R100-E103 IonicContact NH2-OE2 3.76Å; R100-E103 PolarHBondContact NH2-OE2 2.94Å; W101-E103 PolarHBondContact O-N 3.07Å
104	H	25	Very low	27.3	Very low	164 Å²	164	154.8 Å²	154.8	76%	0.759	81%	0.812	S	S	*	*			trans	-134.3	108.8	159.2	-80.1	-80.4	0	0	0	109.1
105	S	28.2	Very low	27.3	Very low	123 Å²	123	153.8 Å²	153.8	86%	0.86	81%	0.81	S	S	*	*			trans	-147.1	101	143.4	-74.2	0	0	0	0	106
106	E	29	Very low	27.3	Very low	182 Å²	182	152.1 Å²	152.1	85%	0.85	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.9	138.3	173.7	-99.2	174.3	143.8	0	0	110.8
107	V	25.7	Very low	27.2	Very low	124 Å²	124	155.5 Å²	155.5	75%	0.752	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.4	175.6	171.6	0	0	0	0	108.7
108	H	28.6	Very low	27	Very low	190 Å²	190	158.9 Å²	158.9	88%	0.88	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-98.8	123.9	156.9	-80.2	-47.8	0	0	0	110.2
109	Q	23.4	Very low	27	Very low	184 Å²	184	155.8 Å²	155.8	86%	0.86	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-85	122.8	-178.5	-175.6	174.9	44.3	0	0	110.2
110	I	26.2	Very low	26.8	Very low	163 Å²	163	155.8 Å²	155.8	84%	0.836	81%	0.807	S	S	*	*			trans	-141	120	159.2	-57.5	-178.4	0	0	0	110.1
111	K	24.6	Very low	26.9	Very low	195 Å²	195	154.7 Å²	154.7	85%	0.848	81%	0.808	S	S	*	*			trans	1.1	138.1	161.6	-79.4	174.1	169.1	179.1	0	122.1
112	E	26.8	Very low	26.8	Very low	167 Å²	167	147.8 Å²	147.8	78%	0.78	79%	0.794	S	S	*	*			trans	-61.2	170.2	156.8	-58.1	-161.2	145.8	0	0	114
113	P	30.7	Very low	26.9	Very low	126 Å²	126	152.1 Å²	152.1	82%	0.818	80%	0.802	S	S	*	*				-139.5	140	88.8	33.8	-17.2	0	0	0	116.6
114	E	24.3	Very low	27.6	Very low	171 Å²	171	149.9 Å²	149.9	80%	0.799	80%	0.801	S	S	*	*			trans	27.7	132.7	132.5	-119.7	-174.4	154.8	0	0	124.5
115	A	26.8	Very low	27.8	Very low	91 Å²	91	149.7 Å²	149.7	75%	0.752	81%	0.805	S	S	*	*			trans	71	115.8	137.9	0	0	0	0	0	122.2
116	A	27.5	Very low	28.4	Very low	105 Å²	105	149.1 Å²	149.1	87%	0.868	80%	0.798	S	S	*	*				-166.1	139	102.3	0	0	0	0	0	111.2
117	Q	26.5	Very low	28.5	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	80%	0.795	S	S	*	*			trans	-79.7	152.4	-178.7	-63.2	158.4	-38.5	0	0	111.2
118	E	26.4	Very low	29	Very low	198 Å²	198	147.7 Å²	147.7	93%	0.925	80%	0.799	S	S	*	*				-159.4	135	125.8	-115.7	174.8	-170.9	0	0	111.8
119	T	25.4	Very low	29	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.724	80%	0.797	S	S	*	*			trans	-87.5	160.1	-176	46.1	0	0	0	0	111.8
120	V	27.3	Very low	29.3	Very low	115 Å²	115	141.5 Å²	141.5	70%	0.697	79%	0.792	S	S	*	*				172.4	118.5	118.3	155.1	0	0	0	0	113.2
121	F	27.5	Very low	29.7	Very low	179 Å²	179	139.8 Å²	139.8	79%	0.785	79%	0.791	S	S	*	*			trans	52	143.3	137.9	-69.8	-107.7	0	0	0	121.1
122	T	26.8	Very low	29.8	Very low	107 Å²	107	138.4 Å²	138.4	66%	0.656	79%	0.791	S	S	*	*			cis	-175.1	135.5	3.5	14.3	0	0	0	0	111.2
123	D	30.1	Very low	30	Very low	152 Å²	152	135.4 Å²	135.4	81%	0.813	79%	0.789	S	S	*	*				62.1	160.2	122.2	-90.5	16.2	0	0	0	125.3
124	P	43.2	Very low	30.1	Very low	106 Å²	106	135.4 Å²	135.4	69%	0.688	79%	0.789	S	S	*	*				-137.5	176.3	-111.1	40.3	-19.6	0	0	0	119.4
125	L	29.1	Very low	30.1	Very low	160 Å²	160	135.7 Å²	135.7	84%	0.838	80%	0.795	S	S	*	*			trans	62.1	161.9	155.8	-128.9	51.8	0	0	0	119
126	P	39.8	Very low	30	Very low	110 Å²	110	134.5 Å²	134.5	71%	0.714	79%	0.792	S	S	*	*			cis	-137.8	174.6	8.2	41.9	-21.6	0	0	0	119.6
127	D	32.1	Very low	30.1	Very low	148 Å²	148	135.6 Å²	135.6	79%	0.791	79%	0.793	S	S	*	*			trans	-55.9	161.1	170.4	-65.8	-43	0	0	0	114.1
128	P	36.1	Very low	30.3	Very low	128 Å²	128	136.5 Å²	136.5	83%	0.831	79%	0.794	S	S	*	*			trans	-137.1	156.9	132.5	34.9	-20	0	0	0	116.3
129	V	28.2	Very low	30.5	Very low	138 Å²	138	132.7 Å²	132.7	84%	0.836	79%	0.789	S	S	*	*			trans	-59.8	152.1	-178.1	-179.3	0	0	0	0	114.6
130	S	29.9	Very low	30.6	Very low	107 Å²	107	133.1 Å²	133.1	75%	0.748	79%	0.792	S	S	*	*			trans	-47.8	164.6	168.6	-42.7	0	0	0	0	115.9
131	P	34.9	Very low	30.6	Very low	127 Å²	127	136.4 Å²	136.4	83%	0.825	80%	0.802	S	S	*	*				-134.5	172.5	128.1	35.1	-20.7	0	0	0	114.5
132	I	26.4	Very low	30.7	Very low	166 Å²	166	132.6 Å²	132.6	85%	0.851	80%	0.797	S	S	*	*			trans	-86	156.3	-154.8	-69.1	149.9	0	0	0	114.3
133	S	30.6	Very low	31.2	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	81%	0.809	S	S	*	*			trans	-38.2	171	177.2	-40.8	0	0	0	0	120.2
134	P	32.2	Very low	31.4	Very low	125 Å²	125	143.2 Å²	143.2	81%	0.812	81%	0.814	S	S	*	*				-142.9	136.8	97.8	35.6	-19.5	0	0	0	117.2
135	L	25	Very low	31	Very low	177 Å²	177	140.2 Å²	140.2	93%	0.927	80%	0.803	S	S	*	*				39.7	119	126.7	-159.3	68.5	0	0	0	121.3
136	G	24.2	Very low	31	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	80%	0.8	S	S	*	*			trans	136.9	85	134.5	0	0	0	0	0	118.8
137	S	29.3	Very low	31	Very low	127 Å²	127	145 Å²	145	89%	0.888	80%	0.804	S	S	*	*				177.9	121.6	119.6	42	0	0	0	0	110.4
138	K	31.4	Very low	31.3	Very low	207 Å²	207	142 Å²	142	90%	0.9	80%	0.795	S	S	*	*			trans	-78	123.1	173.9	-64.1	168.9	174.7	178.1	0	107.1
139	S	30.6	Very low	31.6	Very low	118 Å²	118	139.9 Å²	139.9	83%	0.825	77%	0.774	S	S	*	*			trans	-121	107.3	152.2	-161.2	0	0	0	0	107.8	M141	S139-M141 PolarHBondContact O-N 2.84Å
140	T	28.4	Very low	32.5	Very low	128 Å²	128	139.4 Å²	139.4	79%	0.785	77%	0.766	S	S	*	*			trans	-61.8	106.8	179.1	-23.2	0	0	0	0	108.1	S142	T140-S142 PolarHBondContact O-N 3.2Å; T140-S142 VanDerWaalsContact O-N 3.16Å
141	M	25.7	Very low	33.1	Very low	184 Å²	184	139.2 Å²	139.2	91%	0.906	75%	0.753	S	S	*	*			trans	-67.3	111.7	165	-85.6	178.1	66.2	0	0	107.8	S139 R143	S139-M141 PolarHBondContact O-N 2.84Å; M141-R143 VanDerWaalsContact C-N 3.3Å; M141-R143 PolarHBondContact O-N 2.86Å
142	S	30.7	Very low	33.5	Very low	99 Å²	99	136.8 Å²	136.8	69%	0.692	73%	0.731	S	S	*	*			trans	-59.6	94.5	170.3	-66.7	0	0	0	0	109.7	T140 W144	T140-S142 PolarHBondContact O-N 3.2Å; T140-S142 VanDerWaalsContact O-N 3.16Å; S142-W144 PolarHBondContact O-N 2.82Å
143	R	36.3	Very low	34.1	Very low	237 Å²	237	133.7 Å²	133.7	89%	0.894	72%	0.715	S	S	*	*			trans	22.9	88.7	130.4	-171.6	178.5	169.9	-166.3	-2.4	114.1	M141	M141-R143 VanDerWaalsContact C-N 3.3Å; M141-R143 PolarHBondContact O-N 2.86Å
144	W	34.2	Very low	34.6	Very low	244 Å²	244	133.7 Å²	133.7	92%	0.924	71%	0.706	S	S	*	*			trans	-117.2	107.7	154.1	-76.2	99.4	0	0	0	108.6	S142	S142-W144 PolarHBondContact O-N 2.82Å
145	G	36.6	Very low	35.1	Very low	44 Å²	44	133.3 Å²	133.3	45%	0.454	69%	0.694	S	S	.	*			trans	50.8	96	153.1	0	0	0	0	0	118	Y147	G145-Y147 WeakPolarHBondContact O-CD2 3.48Å; G145-Y147 WeakPolarHBondContact O-CE2 3.14Å; G145-Y147 PolarHBondContact O-N 2.82Å
146	E	28.7	Very low	35.7	Very low	164 Å²	164	129.3 Å²	129.3	77%	0.766	67%	0.672	S	S	*	*			trans	-68.1	105.4	153.9	-171.3	169.9	-179.7	0	0	108	S148 E149	E146-S148 PolarHBondContact O-N 3.44Å; E146-E149 PolarHBondContact O-N 3.36Å
147	Y	39.4	Very low	36.7	Very low	205 Å²	205	129.3 Å²	129.3	80%	0.804	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	24.7	-166.6	-82	-86.4	0	0	0	115.9	G145	G145-Y147 WeakPolarHBondContact O-CD2 3.48Å; G145-Y147 WeakPolarHBondContact O-CE2 3.14Å; G145-Y147 PolarHBondContact O-N 2.82Å
148	S	37.6	Very low	37.4	Very low	86 Å²	86	127.7 Å²	127.7	60%	0.601	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-6.6	169.3	-61.6	0	0	0	0	113.3	E146 L150	E146-S148 PolarHBondContact O-N 3.44Å; S148-L150 PolarHBondContact O-N 3.26Å
149	E	44.3	Very low	37.8	Very low	83 Å²	83	121 Å²	121	39%	0.388	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-83.5	2.6	-171.5	-92.9	-175.1	169	0	0	116.4	E146 H151 Q152 I153	E146-E149 PolarHBondContact O-N 3.36Å; E149-H151 PolarHBondContact O-N 2.82Å; E149-Q152 HydrophobicContact CB-CB 4.3Å; E149-Q152 HydrophobicContact CG-CB 3.99Å; E149-Q152 HydrophobicContact CG-CG 4.44Å; E149-Q152 CarbonylContact O-C 3.55Å; E149-Q152 WeakPolarHBondContact O-CA 3.49Å; E149-Q152 PolarHBondContact O-N 2.81Å; E149-I153 WeakPolarHBondContact O-CG1 3.34Å; E149-I153 PolarHBondContact O-N 2.89Å
150	L	46.4	Very low	38.3	Very low	129 Å²	129	122.4 Å²	122.4	68%	0.675	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-74.7	-11	177.3	-98.1	163.4	0	0	0	114.4	S148 I153	S148-L150 PolarHBondContact O-N 3.26Å; L150-I153 HydrophobicContact CD2-CD1 3.83Å; L150-I153 HydrophobicContact CG-CD1 4.14Å
151	H	42.3	Very low	38.8	Very low	103 Å²	103	119.9 Å²	119.9	48%	0.477	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-88.4	-18.3	163.2	-71.3	-66.9	0	0	0	112.8	E149	E149-H151 PolarHBondContact O-N 2.82Å
152	Q	44.1	Very low	39.6	Very low	76 Å²	76	114.2 Å²	114.2	36%	0.355	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.1	-21.1	-174.9	-68	173.6	35.8	0	0	113.1	E149 D154 E155 M156	E149-Q152 HydrophobicContact CB-CB 4.3Å; E149-Q152 HydrophobicContact CG-CB 3.99Å; E149-Q152 HydrophobicContact CG-CG 4.44Å; E149-Q152 CarbonylContact O-C 3.55Å; E149-Q152 WeakPolarHBondContact O-CA 3.49Å; E149-Q152 PolarHBondContact O-N 2.81Å; Q152-D154 VanDerWaalsContact C-N 3.31Å; Q152-D154 PolarHBondContact O-N 3.13Å; Q152-E155 CarbonylContact O-C 3.54Å; Q152-E155 WeakPolarHBondContact O-CA 3.04Å; Q152-E155 WeakPolarHBondContact O-CB 3.3Å; Q152-E155 PolarHBondContact O-N 2.87Å; Q152-M156 WeakPolarHBondContact O-CB 3.3Å; Q152-M156 WeakPolarHBondContact O-CG 3.44Å; Q152-M156 PolarHBondContact O-N 3.34Å
153	I	37.9	Very low	40	Very low	100 Å²	100	117.2 Å²	117.2	51%	0.513	59%	0.591	S	S	.	*	H	α-helix	trans	-64.1	-37	177.1	-62.1	156.7	0	0	0	111.6	E149 L150 E155 A157	E149-I153 WeakPolarHBondContact O-CG1 3.34Å; E149-I153 PolarHBondContact O-N 2.89Å; L150-I153 HydrophobicContact CD2-CD1 3.83Å; L150-I153 HydrophobicContact CG-CD1 4.14Å; I153-E155 VanDerWaalsContact C-N 3.28Å; I153-A157 WeakPolarHBondContact O-CB 3.17Å; I153-A157 PolarHBondContact O-N 2.96Å
154	D	40.6	Very low	40	Very low	104 Å²	104	114.5 Å²	114.5	56%	0.556	59%	0.589	S	S	*	*	H	α-helix	trans	-73.5	-21.5	171.6	-100.1	-6.4	0	0	0	112.1	Q152	Q152-D154 VanDerWaalsContact C-N 3.31Å; Q152-D154 PolarHBondContact O-N 3.13Å
155	E	43.1	Very low	40.3	Very low	118 Å²	118	107.8 Å²	107.8	55%	0.551	58%	0.575	S	S	*	*	H	α-helix	trans	-86.2	-43.8	-176.9	-154.5	171	-160.7	0	0	111.5	Q152 I153 E158 T159	Q152-E155 CarbonylContact O-C 3.54Å; Q152-E155 WeakPolarHBondContact O-CA 3.04Å; Q152-E155 WeakPolarHBondContact O-CB 3.3Å; Q152-E155 PolarHBondContact O-N 2.87Å; I153-E155 VanDerWaalsContact C-N 3.28Å; E155-E158 PolarHBondContact O-N 3.25Å; E155-T159 WeakPolarHBondContact O-CG2 3.49Å; E155-T159 PolarHBondContact O-N 2.87Å; E155-T159 PolarHBondContact O-OG1 2.91Å
156	M	37.3	Very low	40.1	Very low	93 Å²	93	112.3 Å²	112.3	46%	0.458	59%	0.593	S	S	.	*	H	α-helix	trans	-67.6	-38.8	178	-67.3	177.7	62.4	0	0	112.6	Q152 E158 T159 E160	Q152-M156 WeakPolarHBondContact O-CB 3.3Å; Q152-M156 WeakPolarHBondContact O-CG 3.44Å; Q152-M156 PolarHBondContact O-N 3.34Å; M156-E158 PolarHBondContact O-N 3.13Å; M156-T159 WeakPolarHBondContact CA-OG1 3.35Å; M156-T159 PolarHBondContact O-N 3.33Å; M156-T159 PolarHBondContact O-OG1 2.92Å; M156-E160 PolarHBondContact O-N 3Å
157	A	45.4	Very low	40.6	Very low	67 Å²	67	110.9 Å²	110.9	55%	0.554	60%	0.595	S	S	*	*	H	α-helix	trans	-67	-16.9	177.2	0	0	0	0	0	113.2	I153	I153-A157 WeakPolarHBondContact O-CB 3.17Å; I153-A157 PolarHBondContact O-N 2.96Å
158	E	44	Very low	40.3	Very low	93 Å²	93	110.5 Å²	110.5	44%	0.435	60%	0.598	S	S	.	*	H	α-helix	trans	-105.2	-28	177.5	-67.9	-164.9	153.2	0	0	113.6	E155 M156 E160 A161 A162 R221	E155-E158 PolarHBondContact O-N 3.25Å; M156-E158 PolarHBondContact O-N 3.13Å; E158-E160 VanDerWaalsContact C-N 3.35Å; E158-A161 PolarHBondContact O-N 2.76Å; E158-A162 WeakPolarHBondContact O-CB 3.29Å; E158-A162 PolarHBondContact O-N 3.48Å; E158-R221 IonicContact OE1-CZ 2.65Å; E158-R221 IonicContact OE1-NH1 2.9Å; E158-R221 PolarHBondContact OE1-NH1 2.9Å; E158-R221 IonicContact OE1-NH2 3.84Å; E158-R221 PolarHBondContact OE1-NH2 3.24Å; E158-R221 IonicContact OE2-CZ 3.93Å; E158-R221 IonicContact OE2-NH1 3.18Å; E158-R221 PolarHBondContact OE2-NH1 3.4Å
159	T	39.7	Very low	40.1	Very low	66 Å²	66	113.7 Å²	113.7	41%	0.405	61%	0.608	S	S	.	*	H	α-helix	trans	-67	-34.4	172.1	49.7	0	0	0	0	112.6	E155 M156 A161 A162 Q163	E155-T159 WeakPolarHBondContact O-CG2 3.49Å; E155-T159 PolarHBondContact O-N 2.87Å; E155-T159 PolarHBondContact O-OG1 2.91Å; M156-T159 WeakPolarHBondContact CA-OG1 3.35Å; M156-T159 PolarHBondContact O-N 3.33Å; M156-T159 PolarHBondContact O-OG1 2.92Å; T159-A161 VanDerWaalsContact C-N 3.27Å; T159-A161 PolarHBondContact O-N 2.89Å; T159-A162 PolarHBondContact O-N 3.15Å; T159-Q163 VanDerWaalsContact O-CG 3.32Å; T159-Q163 WeakPolarHBondContact O-CG 3.45Å; T159-Q163 PolarHBondContact O-N 3.29Å
160	E	40.8	Very low	39.8	Very low	147 Å²	147	115.4 Å²	115.4	69%	0.687	63%	0.627	S	S	*	*	H	α-helix	trans	-68.1	-27.2	174	-71.3	-179	175.9	0	0	112.5	M156 E158	M156-E160 PolarHBondContact O-N 3Å; E158-E160 VanDerWaalsContact C-N 3.35Å
161	A	39.9	Very low	39.4	Very low	75 Å²	75	117.4 Å²	117.4	62%	0.62	64%	0.637	S	S	*	*	H	α-helix	trans	-84.4	-23.2	177	0	0	0	0	0	113.5	E158 T159	E158-A161 PolarHBondContact O-N 2.76Å; T159-A161 VanDerWaalsContact C-N 3.27Å; T159-A161 PolarHBondContact O-N 2.89Å
162	A	41.7	Very low	39.1	Very low	65 Å²	65	118.3 Å²	118.3	54%	0.537	65%	0.652	S	S	.	*	H	α-helix	trans	-93.5	-17.5	-178.1	0	0	0	0	0	114	E158 T159	E158-A162 WeakPolarHBondContact O-CB 3.29Å; E158-A162 PolarHBondContact O-N 3.48Å; T159-A162 PolarHBondContact O-N 3.15Å
163	Q	39.4	Very low	38.6	Very low	162 Å²	162	118.1 Å²	118.1	76%	0.757	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-9.5	-178.9	-74	179.3	0.5	0	0	114.6	T159 T165	T159-Q163 VanDerWaalsContact O-CG 3.32Å; T159-Q163 WeakPolarHBondContact O-CG 3.45Å; T159-Q163 PolarHBondContact O-N 3.29Å; Q163-T165 VanDerWaalsContact C-N 3.31Å; Q163-T165 PolarHBondContact O-N 2.82Å
164	E	36.8	Very low	38.6	Very low	180 Å²	180	118.9 Å²	118.9	84%	0.841	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	0.3	176.2	-107.4	-174.5	171.6	0	0	114.4
165	T	39.8	Very low	38.6	Very low	104 Å²	104	119 Å²	119	64%	0.638	69%	0.688	S	S	*	*	S	Bend	trans	-132.4	89.8	179.5	60.3	0	0	0	0	111	Q163	Q163-T165 VanDerWaalsContact C-N 3.31Å; Q163-T165 PolarHBondContact O-N 2.82Å
166	V	33.2	Very low	38.3	Very low	139 Å²	139	119.7 Å²	119.7	84%	0.842	70%	0.7	S	S	*	*			trans	177	114.1	141.6	160.9	0	0	0	0	108.4
167	V	37.9	Very low	38.3	Very low	133 Å²	133	124.9 Å²	124.9	81%	0.806	72%	0.716	S	S	*	*			trans	-93.1	141.5	175.4	172.4	0	0	0	0	109.7
168	K	33	Very low	37.8	Very low	198 Å²	198	130.8 Å²	130.8	86%	0.861	73%	0.732	S	S	*	*			trans	-140.4	113.2	152.4	-80.7	-166.6	176	-179.6	0	111.9
169	D	34.7	Very low	37.4	Very low	152 Å²	152	132.6 Å²	132.6	81%	0.813	75%	0.75	S	S	*	*			trans	29.7	143.1	160.7	-61.1	-25.4	0	0	0	124.7
170	P	38.1	Very low	37.4	Very low	120 Å²	120	133.8 Å²	133.8	78%	0.779	77%	0.767	S	S	*	*			trans	-105.9	151.4	-168.4	33.7	-17.5	0	0	0	114.7
171	L	36.9	Very low	37.4	Very low	171 Å²	171	132.6 Å²	132.6	90%	0.895	77%	0.769	S	S	*	*			trans	-124.6	158.7	169.2	-82.5	176.4	0	0	0	110.6
172	P	36.3	Very low	37.2	Very low	122 Å²	122	136.7 Å²	136.7	79%	0.792	78%	0.78	S	S	*	*			trans	-81.3	144.4	-135.6	32	-35.5	0	0	0	114.6
173	G	33.9	Very low	36.9	Very low	72 Å²	72	145.3 Å²	145.3	74%	0.742	80%	0.799	S	S	*	*			trans	-86.2	176.2	-172.3	0	0	0	0	0	116.2
174	P	37.3	Very low	36.7	Very low	116 Å²	116	143.4 Å²	143.4	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-91.1	159.6	162.3	29.4	-17	0	0	0	111.4
175	P	42.3	Very low	36.3	Very low	106 Å²	106	143.8 Å²	143.8	69%	0.688	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-72.8	133.9	-153.1	29.1	-34.7	0	0	0	113.1
176	V	36.7	Very low	36	Very low	133 Å²	133	150.6 Å²	150.6	81%	0.806	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-86.5	123.8	169	178.7	0	0	0	0	108.5	E178	V176-E178 PolarHBondContact O-N 2.85Å
177	Y	35.9	Very low	36	Very low	202 Å²	202	152.3 Å²	152.3	79%	0.792	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.1	120.6	175.5	-15.6	-85	0	0	0	109.1	T179	Y177-T179 PolarHBondContact O-N 2.92Å
178	E	34.9	Very low	35.6	Very low	190 Å²	190	157.8 Å²	157.8	89%	0.888	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.4	120.3	172.8	-77.9	-178.5	144.7	0	0	110.4	V176	V176-E178 PolarHBondContact O-N 2.85Å
179	T	35.6	Very low	35.3	Very low	132 Å²	132	153.6 Å²	153.6	81%	0.81	82%	0.819	S	S	*	*			trans	-102.6	96.3	153.1	52.1	0	0	0	0	108.1	Y177 T181	Y177-T179 PolarHBondContact O-N 2.92Å; T179-T181 PolarHBondContact O-N 3.19Å
180	A	40.9	Very low	35.2	Very low	91 Å²	91	155 Å²	155	75%	0.752	82%	0.82	S	S	*	*			trans	-63.7	112.5	167.7	0	0	0	0	0	109.4
181	T	40.6	Very low	34.8	Very low	121 Å²	121	158.1 Å²	158.1	74%	0.742	82%	0.824	S	S	*	*			trans	-162.1	119.1	150.5	2.2	0	0	0	0	110.7	T179	T179-T181 PolarHBondContact O-N 3.19Å
182	L	35.6	Very low	35.1	Very low	161 Å²	161	157.2 Å²	157.2	84%	0.843	82%	0.82	S	S	*	*			trans	76	85.1	161.6	-47.5	-179.6	0	0	0	117.7
183	R	35.5	Very low	34.9	Very low	247 Å²	247	160 Å²	160	93%	0.932	82%	0.822	S	S	*	*			trans	-111.5	118	147.7	-70.1	-169.5	-177.6	-178.7	3	110
184	P	35.4	Very low	34.9	Very low	122 Å²	122	161.2 Å²	161.2	79%	0.792	82%	0.816	S	S	*	*			trans	-79.6	123.7	152.2	-11.5	28.6	0	0	0	109
185	M	27.4	Very low	34.6	Very low	188 Å²	188	164.5 Å²	164.5	93%	0.926	82%	0.822	S	S	*	*			trans	-67.5	128.4	174.6	-156.6	-172.4	177.7	0	0	109.6
186	R	34.2	Very low	34.3	Very low	247 Å²	247	164 Å²	164	93%	0.932	82%	0.821	S	S	*	*			trans	-132.6	136.3	159.4	-83.8	-165.9	177.5	150.1	0.4	112.1
187	H	32.4	Very low	34.8	Very low	175 Å²	175	165 Å²	165	81%	0.81	82%	0.822	S	S	*	*			trans	-51.4	144.7	-173.4	-135.6	-94.4	0	0	0	113.9
188	R	29.6	Very low	35	Very low	248 Å²	248	161.5 Å²	161.5	94%	0.936	82%	0.816	S	S	*	*			trans	-72.9	126.7	158.7	-118.2	-178.3	-176.9	177.7	0.9	107.8
189	S	26.9	Very low	35.7	Very low	110 Å²	110	158.8 Å²	158.8	77%	0.769	81%	0.812	S	S	*	*			trans	-138.4	132.2	156.8	35.4	0	0	0	0	108
190	H	32.7	Very low	36.3	Very low	182 Å²	182	162 Å²	162	84%	0.843	81%	0.809	S	S	*	*			trans	-94.3	108.6	-178.2	-179.6	-61.1	0	0	0	107
191	E	29.9	Very low	36.7	Very low	185 Å²	185	164.3 Å²	164.3	86%	0.864	82%	0.819	S	S	*	*			trans	-150.6	133.9	169.5	-128.4	168.4	-171.8	0	0	110.5
192	L	44.3	Very low	36.9	Very low	152 Å²	152	164.4 Å²	164.4	80%	0.796	81%	0.812	S	S	*	*			trans	-69.6	126.6	-179.2	-66.7	158.5	0	0	0	109.3
193	E	31.7	Very low	37.7	Very low	180 Å²	180	160.6 Å²	160.6	84%	0.841	80%	0.799	S	S	*	*			trans	-158.2	153.9	161.5	-95.4	-51.5	102.6	0	0	109.4
194	P	33.8	Very low	38.4	Very low	97 Å²	97	155 Å²	155	63%	0.63	79%	0.788	S	S	*	*			trans	-77.2	155.4	-140.6	30.6	-38.5	0	0	0	114.2	S196	P194-S196 PolarHBondContact O-N 2.88Å
195	E	31.5	Very low	39	Very low	186 Å²	186	154.6 Å²	154.6	87%	0.869	78%	0.783	S	S	*	*			trans	-50.3	99.5	172.5	-68.5	-178.3	159.7	0	0	110.9	N197	E195-N197 PolarHBondContact O-N 2.9Å; E195-N197 VanDerWaalsContact O-N 3.15Å
196	S	34.3	Very low	40	Very low	96 Å²	96	148 Å²	148	67%	0.671	76%	0.755	S	S	*	*			trans	-69.6	107.5	174.8	64.8	0	0	0	0	109.2	P194 L198	P194-S196 PolarHBondContact O-N 2.88Å; S196-L198 PolarHBondContact O-N 2.65Å
197	N	48	Very low	40.7	Very low	153 Å²	153	140.5 Å²	140.5	82%	0.818	73%	0.733	S	S	*	*			trans	-70.3	58	169.5	-71.4	-58.5	0	0	0	111.9	E195	E195-N197 PolarHBondContact O-N 2.9Å; E195-N197 VanDerWaalsContact O-N 3.15Å
198	L	39.7	Very low	41.5	Very low	129 Å²	129	137 Å²	137	68%	0.675	72%	0.723	S	S	*	*			trans	-96.7	98.1	170.7	-118.7	75.1	0	0	0	109.3	S196 R200	S196-L198 PolarHBondContact O-N 2.65Å; L198-R200 VanDerWaalsContact C-N 3.25Å; L198-R200 PolarHBondContact O-N 3.34Å
199	V	49.5	Very low	42.4	Very low	133 Å²	133	134 Å²	134	81%	0.806	72%	0.717	S	S	*	*			trans	-65.4	88.8	167.1	-175	0	0	0	0	107.6	C201	V199-C201 PolarHBondContact O-N 2.77Å
200	R	48.4	Very low	43.5	Very low	198 Å²	198	139.7 Å²	139.7	75%	0.747	72%	0.722	S	S	*	*			trans	-71.5	124.7	167.7	-65.1	-169.9	-172.3	105.2	1.4	107.6	L198 M202	L198-R200 VanDerWaalsContact C-N 3.25Å; L198-R200 PolarHBondContact O-N 3.34Å; R200-M202 PolarHBondContact O-N 3.38Å
201	C	49.2	Very low	44.3	Very low	140 Å²	140	141.2 Å²	141.2	95%	0.946	72%	0.72	S	S	*	*			trans	-6.8	88.9	174.6	-66.5	0	0	0	0	115.1	V199	V199-C201 PolarHBondContact O-N 2.77Å
202	M	45.4	Very low	45.1	Very low	124 Å²	124	141.1 Å²	141.1	61%	0.611	72%	0.717	S	S	*	*			trans	-98.8	127.6	160.8	-67	-172	72.6	0	0	107.3	R200	R200-M202 PolarHBondContact O-N 3.38Å
203	S	52.8	Low	45.3	Very low	81 Å²	81	136.9 Å²	136.9	57%	0.566	71%	0.71	S	S	*	*			trans	-64.8	148.3	177.6	53.3	0	0	0	0	111.7	V205 S206	S203-V205 PolarHBondContact O-N 2.87Å; S203-S206 PolarHBondContact O-N 3.11Å
204	D	50.2	Low	46.3	Very low	130 Å²	130	140.3 Å²	140.3	70%	0.695	72%	0.715	S	S	*	*	H	α-helix	trans	-51	-25.1	-175.4	-69	-38.3	0	0	0	114.6	S206 L207 V208	D204-S206 VanDerWaalsContact C-N 3.29Å; D204-S206 PolarHBondContact O-N 3.21Å; D204-L207 PolarHBondContact O-N 3.18Å; D204-V208 PolarHBondContact O-N 3.3Å
205	V	46.9	Very low	47.4	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.685	71%	0.712	S	S	*	*	H	α-helix	trans	-61.1	-34.5	177.5	-178.9	0	0	0	0	112.4	S203 K209	S203-V205 PolarHBondContact O-N 2.87Å; V205-K209 PolarHBondContact O-N 3.26Å
206	S	48.8	Very low	49.1	Very low	48 Å²	48	134.4 Å²	134.4	34%	0.336	69%	0.692	S	S	.	*	H	α-helix	trans	-78.2	-25.8	-178.8	-62.4	0	0	0	0	112.9	S203 D204	S203-S206 PolarHBondContact O-N 3.11Å; D204-S206 VanDerWaalsContact C-N 3.29Å; D204-S206 PolarHBondContact O-N 3.21Å
207	L	49.1	Very low	51	Low	91 Å²	91	133.4 Å²	133.4	48%	0.476	69%	0.685	S	S	.	*	H	α-helix	trans	-75.6	-31.5	175.5	-66.6	176.6	0	0	0	111.8	D204 K209 R210 R211	D204-L207 PolarHBondContact O-N 3.18Å; L207-K209 VanDerWaalsContact C-N 3.35Å; L207-R210 PolarHBondContact O-N 2.95Å; L207-R211 PolarHBondContact O-N 3.47Å
208	V	48.3	Very low	52.2	Low	100 Å²	100	129.6 Å²	129.6	61%	0.606	68%	0.675	S	S	*	*	H	α-helix	trans	-66.8	-36.2	173.4	178.6	0	0	0	0	111.4	D204 R210 R211 K212	D204-V208 PolarHBondContact O-N 3.3Å; V208-R210 VanDerWaalsContact C-N 3.29Å; V208-R210 PolarHBondContact O-N 3.43Å; V208-R211 PolarHBondContact O-N 3.33Å; V208-R211 VanDerWaalsContact O-N 3.07Å; V208-K212 PolarHBondContact O-N 2.94Å; V208-K212 VanDerWaalsContact O-N 3.14Å
209	K	50.1	Low	53.8	Low	185 Å²	185	126.4 Å²	126.4	80%	0.804	67%	0.667	S	S	*	*	H	α-helix	trans	-65	-29.7	178.9	-134.4	174.5	-176.2	179.4	0	113	V205 L207	V205-K209 PolarHBondContact O-N 3.26Å; L207-K209 VanDerWaalsContact C-N 3.35Å
210	R	48.8	Very low	54.9	Low	230 Å²	230	124.8 Å²	124.8	87%	0.868	65%	0.651	S	S	*	*	H	α-helix	trans	-83.7	-13.8	173.5	-67.7	-173.5	100.1	129.9	0.4	114	L207 V208	L207-R210 PolarHBondContact O-N 2.95Å; V208-R210 VanDerWaalsContact C-N 3.29Å; V208-R210 PolarHBondContact O-N 3.43Å
211	R	50.1	Low	55.9	Low	214 Å²	214	118.4 Å²	118.4	81%	0.808	63%	0.627	S	S	*	*	H	α-helix	trans	-99.6	-8.6	178.8	-70.3	-176.9	-175.8	-176	2.9	114.2	L207 V208 G213	L207-R211 PolarHBondContact O-N 3.47Å; V208-R211 PolarHBondContact O-N 3.33Å; V208-R211 VanDerWaalsContact O-N 3.07Å; R211-G213 PolarHBondContact O-N 3.19Å
212	K	47	Very low	57	Low	183 Å²	183	117.1 Å²	117.1	80%	0.796	61%	0.607	S	S	*	*	S	Bend	trans	-72.6	99.2	170.6	-150.7	173.5	-173.7	-179.9	0	107.6	V208 R214	V208-K212 PolarHBondContact O-N 2.94Å; V208-K212 VanDerWaalsContact O-N 3.14Å; K212-R214 PolarHBondContact O-N 3.44Å
213	G	46.9	Very low	58.2	Low	63 Å²	63	117.6 Å²	117.6	65%	0.649	61%	0.606	S	S	*	*			trans	-45.3	135.3	-176.2	0	0	0	0	0	111.8	R211 G215	R211-G213 PolarHBondContact O-N 3.19Å; G213-G215 PolarHBondContact O-N 3.47Å
214	R	54.5	Low	58.9	Low	252 Å²	252	117.3 Å²	117.3	95%	0.951	60%	0.596	S	S	*	*			trans	1.4	89.6	158.7	-163.9	172.3	179.3	177.3	-1.2	111.9	K212	K212-R214 PolarHBondContact O-N 3.44Å
215	G	56.1	Low	59.7	Low	55 Å²	55	116 Å²	116	57%	0.567	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-50.7	143.4	173.1	0	0	0	0	0	109.1	G213 S217	G213-G215 PolarHBondContact O-N 3.47Å; G215-S217 PolarHBondContact O-N 3.15Å
216	K	66.3	Low	60.9	Low	104 Å²	104	116.4 Å²	116.4	45%	0.452	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-49.2	130.1	178.3	-62.4	178.8	-178.5	-173.6	0	108.6	Q220 R221 E224	K216-Q220 HydrophobicContact CB-CB 4.42Å; K216-Q220 HydrophobicContact CB-CG 4.38Å; K216-R221 HydrophobicContact CB-CG 4.18Å; K216-E224 WeakPolarHBondContact CD-OE1 3.38Å; K216-E224 WeakPolarHBondContact CE-OE1 3.39Å; K216-E224 IonicContact NZ-OE1 2.71Å; K216-E224 PolarHBondContact NZ-OE1 3.46Å; K216-E224 IonicContact NZ-OE2 3.47Å; K216-E224 PolarHBondContact NZ-OE2 2.89Å
217	S	75.6	Confident	62.1	Low	76 Å²	76	115.1 Å²	115.1	53%	0.531	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-54.7	147.3	178.4	176.3	0	0	0	0	110.3	G215 A219 Q220 R221	G215-S217 PolarHBondContact O-N 3.15Å; S217-A219 PolarHBondContact O-N 2.76Å; S217-A219 VanDerWaalsContact O-N 3.13Å; S217-Q220 WeakPolarHBondContact O-CA 3.41Å; S217-Q220 WeakPolarHBondContact O-CB 3.45Å; S217-Q220 PolarHBondContact O-N 2.79Å; S217-R221 PolarHBondContact O-N 3.27Å
218	A	72.6	Confident	63.6	Low	72 Å²	72	116.6 Å²	116.6	60%	0.595	57%	0.566	S	S	*	*	H	α-helix	trans	-50.1	-39.5	176.7	0	0	0	0	0	112.1	Q220 R221 E222	A218-Q220 VanDerWaalsContact C-N 3.31Å; A218-Q220 PolarHBondContact O-N 2.94Å; A218-R221 PolarHBondContact O-N 3.25Å; A218-E222 PolarHBondContact O-N 3.1Å
219	A	72.7	Confident	65.1	Low	63 Å²	63	115.8 Å²	115.8	52%	0.521	55%	0.554	S	S	.	*	H	α-helix	trans	-65.1	-30.4	175.1	0	0	0	0	0	113.8	S217 K223	S217-A219 PolarHBondContact O-N 2.76Å; S217-A219 VanDerWaalsContact O-N 3.13Å; A219-K223 WeakPolarHBondContact O-CG 3.42Å; A219-K223 PolarHBondContact O-N 3.45Å; A219-K223 VanDerWaalsContact O-N 3.15Å
220	Q	72.6	Confident	66.7	Low	98 Å²	98	111 Å²	111	46%	0.458	54%	0.544	S	S	.	.	H	α-helix	trans	-76.4	-35.7	175.4	-175.8	164.4	-11.9	0	0	111.6	K216 S217 A218 K223 E224	K216-Q220 HydrophobicContact CB-CB 4.42Å; K216-Q220 HydrophobicContact CB-CG 4.38Å; S217-Q220 WeakPolarHBondContact O-CA 3.41Å; S217-Q220 WeakPolarHBondContact O-CB 3.45Å; S217-Q220 PolarHBondContact O-N 2.79Å; A218-Q220 VanDerWaalsContact C-N 3.31Å; A218-Q220 PolarHBondContact O-N 2.94Å; Q220-K223 PolarHBondContact O-N 3.22Å; Q220-E224 WeakPolarHBondContact O-CG 3.48Å; Q220-E224 PolarHBondContact O-N 3.38Å
221	R	70.6	Confident	68.1	Low	64 Å²	64	104.4 Å²	104.4	24%	0.242	53%	0.525	C	S	.	.	H	α-helix	trans	-65.6	-42.1	172	-66.3	-176.3	-180	145.4	-9.8	111.7	E158 K216 S217 A218 K223 E224 K225	E158-R221 IonicContact OE1-CZ 2.65Å; E158-R221 IonicContact OE1-NH1 2.9Å; E158-R221 PolarHBondContact OE1-NH1 2.9Å; E158-R221 IonicContact OE1-NH2 3.84Å; E158-R221 PolarHBondContact OE1-NH2 3.24Å; E158-R221 IonicContact OE2-CZ 3.93Å; E158-R221 IonicContact OE2-NH1 3.18Å; E158-R221 PolarHBondContact OE2-NH1 3.4Å; K216-R221 HydrophobicContact CB-CG 4.18Å; S217-R221 PolarHBondContact O-N 3.27Å; A218-R221 PolarHBondContact O-N 3.25Å; R221-K223 VanDerWaalsContact C-N 3.34Å; R221-K223 PolarHBondContact O-N 3.47Å; R221-E224 PolarHBondContact O-N 2.9Å; R221-K225 WeakPolarHBondContact O-CG 3.45Å; R221-K225 PolarHBondContact O-N 3.4Å
222	E	70.9	Confident	69.4	Low	113 Å²	113	101 Å²	101	53%	0.528	52%	0.523	S	S	.	.	H	α-helix	trans	-58.3	-46.7	174.6	-158.7	70.8	-151.8	0	0	111	A218 E224 K225 Q226	A218-E222 PolarHBondContact O-N 3.1Å; E222-E224 PolarHBondContact O-N 3.36Å; E222-K225 PolarHBondContact O-N 3.35Å; E222-Q226 WeakPolarHBondContact O-CG 3.4Å; E222-Q226 PolarHBondContact O-N 3.17Å
223	K	70.9	Confident	71.1	Confident	134 Å²	134	94.4 Å²	94.4	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-61.1	-42.9	174.3	-75.9	179.3	-179.3	-175	0	112.2	A219 Q220 R221 K225 Q226 H227	A219-K223 WeakPolarHBondContact O-CG 3.42Å; A219-K223 PolarHBondContact O-N 3.45Å; A219-K223 VanDerWaalsContact O-N 3.15Å; Q220-K223 PolarHBondContact O-N 3.22Å; R221-K223 VanDerWaalsContact C-N 3.34Å; R221-K223 PolarHBondContact O-N 3.47Å; K223-K225 VanDerWaalsContact C-N 3.31Å; K223-K225 PolarHBondContact O-N 3.3Å; K223-Q226 PolarHBondContact O-N 2.8Å; K223-H227 PolarHBondContact O-CD2 3.48Å; K223-H227 PolarHBondContact O-NE2 3.36Å; K223-H227 VanDerWaalsContact O-NE2 3.07Å
224	E	67.1	Low	72.9	Confident	76 Å²	76	91.8 Å²	91.8	36%	0.355	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-34.1	177.6	-75.2	176.7	-174.9	0	0	112.7	K216 Q220 R221 E222 H227	K216-E224 WeakPolarHBondContact CD-OE1 3.38Å; K216-E224 WeakPolarHBondContact CE-OE1 3.39Å; K216-E224 IonicContact NZ-OE1 2.71Å; K216-E224 PolarHBondContact NZ-OE1 3.46Å; K216-E224 IonicContact NZ-OE2 3.47Å; K216-E224 PolarHBondContact NZ-OE2 2.89Å; Q220-E224 WeakPolarHBondContact O-CG 3.48Å; Q220-E224 PolarHBondContact O-N 3.38Å; R221-E224 PolarHBondContact O-N 2.9Å; E222-E224 PolarHBondContact O-N 3.36Å; E224-H227 PolarHBondContact O-N 3.39Å
225	K	68.7	Low	74.5	Confident	101 Å²	101	82.6 Å²	82.6	44%	0.439	45%	0.445	S	S	.	.	H	α-helix	trans	-66.1	-37.3	174.9	-72	176.2	-177.7	-175.7	0	112.4	R221 E222 K223 H227 R228	R221-K225 WeakPolarHBondContact O-CG 3.45Å; R221-K225 PolarHBondContact O-N 3.4Å; E222-K225 PolarHBondContact O-N 3.35Å; K223-K225 VanDerWaalsContact C-N 3.31Å; K223-K225 PolarHBondContact O-N 3.3Å; K225-H227 PolarHBondContact O-N 2.97Å; K225-R228 PolarHBondContact O-N 3.22Å; K225-R228 VanDerWaalsContact O-N 3.11Å
226	Q	70.5	Confident	76	Confident	122 Å²	122	81.8 Å²	81.8	57%	0.57	43%	0.425	S	S	*	.	H	α-helix	trans	-59.8	-22	179	-70.3	173.1	2.1	0	0	113.5	E222 K223 Y238	E222-Q226 WeakPolarHBondContact O-CG 3.4Å; E222-Q226 PolarHBondContact O-N 3.17Å; K223-Q226 PolarHBondContact O-N 2.8Å; Q226-Y238 WeakPolarHBondContact O-CE1 3.42Å
227	H	75.6	Confident	77	Confident	21 Å²	21	78.2 Å²	78.2	10%	0.097	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	0.8	-177.8	-53.4	-51.7	0	0	0	114.8	K223 E224 K225 N237 Y238 K239	K223-H227 PolarHBondContact O-CD2 3.48Å; K223-H227 PolarHBondContact O-NE2 3.36Å; K223-H227 VanDerWaalsContact O-NE2 3.07Å; E224-H227 PolarHBondContact O-N 3.39Å; K225-H227 PolarHBondContact O-N 2.97Å; H227-N237 WeakPolarHBondContact O-CA 3.46Å; H227-Y238 HydrophobicContact CB-CD1 4.3Å; H227-Y238 HydrophobicContact CB-CE1 3.99Å; H227-Y238 HydrophobicContact CB-CE2 4.43Å; H227-Y238 PolarHBondContact CE1-OH 3.37Å; H227-Y238 AromaticContact CG-CZ 3.93Å; H227-Y238 AromaticContact ND1-CE1 3.83Å; H227-Y238 AromaticContact ND1-CE2 3.46Å; H227-Y238 WeakPolarHBondContact ND1-CE2 3.4Å; H227-Y238 AromaticContact ND1-CZ 3.07Å; H227-Y238 PolarHBondContact ND1-OH 3.01Å; H227-Y238 WeakPolarHBondContact O-CD1 2.78Å; H227-Y238 PolarHBondContact O-N 2.9Å; H227-Y238 VanDerWaalsContact O-N 3.15Å; H227-K239 HydrophobicContact CB-CB 4.36Å; H227-K239 HydrophobicContact CB-CD 3.93Å; H227-K239 HydrophobicContact CB-CG 3.86Å; H227-K239 WeakPolarHBondContact CD2-CD 3.39Å; H227-K239 WeakPolarHBondContact CD2-CE 3.34Å; H227-K239 PolarHBondContact CD2-NZ 3.31Å; H227-K239 WeakPolarHBondContact CE1-CE 3.35Å; H227-K239 PolarHBondContact CE1-NZ 3.06Å; H227-K239 VanDerWaalsContact CG-CE 3.43Å; H227-K239 WeakPolarHBondContact ND1-CE 3.19Å; H227-K239 WeakPolarHBondContact NE2-CE 3.36Å; H227-K239 PolarHBondContact NE2-NZ 2.94Å
228	R	80.1	Confident	77.3	Confident	123 Å²	123	79.4 Å²	79.4	46%	0.464	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.9	-179.5	-62.8	175.2	67.3	89.8	1	108.9	K225 Y236 N237	K225-R228 PolarHBondContact O-N 3.22Å; K225-R228 VanDerWaalsContact O-N 3.11Å; R228-Y236 WeakPolarHBondContact CA-O 3.3Å; R228-N237 HydrophobicContact CG-CB 4.46Å
229	F	79.1	Confident	77.9	Confident	83 Å²	83	82.4 Å²	82.4	36%	0.364	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.3	172.4	54.9	-110.3	0	0	0	110.5	I231 Y236 Y238	F229-I231 HydrophobicContact CD2-CD1 3.84Å; F229-I231 HydrophobicContact CD2-CG1 3.73Å; F229-I231 HydrophobicContact CE2-CD1 3.32Å; F229-I231 HydrophobicContact CE2-CG1 3.77Å; F229-I231 HydrophobicContact CZ-CD1 4.27Å; F229-Y236 HydrophobicContact CD1-CD1 4.14Å; F229-Y236 AromaticContact CD2-CD1 3.95Å; F229-Y236 HydrophobicContact CD2-CD1 3.95Å; F229-Y236 HydrophobicContact CD2-CG 4.43Å; F229-Y236 AromaticContact CE1-CD1 3.42Å; F229-Y236 HydrophobicContact CE1-CD1 3.42Å; F229-Y236 VanDerWaalsContact CE1-CD1 3.42Å; F229-Y236 AromaticContact CE1-CE1 3.71Å; F229-Y236 HydrophobicContact CE1-CE1 3.71Å; F229-Y236 AromaticContact CE2-CD1 3.17Å; F229-Y236 HydrophobicContact CE2-CD1 3.17Å; F229-Y236 AromaticContact CE2-CE1 3.93Å; F229-Y236 HydrophobicContact CE2-CE1 3.93Å; F229-Y236 AromaticContact CE2-CG 3.77Å; F229-Y236 HydrophobicContact CE2-CG 3.77Å; F229-Y236 HydrophobicContact CG-CD1 4.42Å; F229-Y236 AromaticContact CZ-CD1 2.93Å; F229-Y236 HydrophobicContact CZ-CD1 2.93Å; F229-Y236 AromaticContact CZ-CE1 3.25Å; F229-Y236 HydrophobicContact CZ-CE1 3.25Å; F229-Y236 AromaticContact CZ-CG 3.97Å; F229-Y236 HydrophobicContact CZ-CG 3.97Å; F229-Y236 PolarHBondContact N-O 2.78Å; F229-Y236 PolarHBondContact O-N 2.84Å; F229-Y238 AromaticContact CD1-CD1 3.74Å; F229-Y238 HydrophobicContact CD1-CD1 3.74Å; F229-Y238 HydrophobicContact CD1-CE1 4.36Å; F229-Y238 AromaticContact CE1-CD1 3.62Å; F229-Y238 HydrophobicContact CE1-CD1 3.62Å; F229-Y238 HydrophobicContact CE1-CG 4.23Å
230	S	83.3	Confident	78.6	Confident	83 Å²	83	82.3 Å²	82.3	58%	0.58	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.5	171.5	57.2	0	0	0	0	110.4	H234	S230-H234 CarbonylContact C-O 3.57Å; S230-H234 WeakPolarHBondContact CA-O 3.14Å
231	I	78.5	Confident	79.3	Confident	92 Å²	92	77.9 Å²	77.9	47%	0.472	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.1	171.4	-62.7	179.6	0	0	0	107.2	F229 G233 H234	F229-I231 HydrophobicContact CD2-CD1 3.84Å; F229-I231 HydrophobicContact CD2-CG1 3.73Å; F229-I231 HydrophobicContact CE2-CD1 3.32Å; F229-I231 HydrophobicContact CE2-CG1 3.77Å; F229-I231 HydrophobicContact CZ-CD1 4.27Å; I231-G233 PolarHBondContact O-N 3.44Å; I231-G233 VanDerWaalsContact O-N 3.11Å; I231-H234 PolarHBondContact N-O 3.06Å; I231-H234 WeakPolarHBondContact O-CB 3.43Å; I231-H234 PolarHBondContact O-CD2 3.37Å; I231-H234 PolarHBondContact O-N 3.13Å
232	N	78.4	Confident	80.3	Confident	142 Å²	142	77.2 Å²	77.2	76%	0.759	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	34.2	-179.8	-59.1	-26.4	0	0	0	113.3	H234	N232-H234 VanDerWaalsContact C-N 3.26Å; N232-H234 PolarHBondContact O-N 3.2Å
233	G	81.9	Confident	81.2	Confident	45 Å²	45	72.4 Å²	72.4	46%	0.464	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-5	-177.7	0	0	0	0	0	115.1	I231 S246	I231-G233 PolarHBondContact O-N 3.44Å; I231-G233 VanDerWaalsContact O-N 3.11Å; G233-S246 WeakPolarHBondContact O-CB 3.47Å; G233-S246 PolarHBondContact O-OG 3.5Å
234	H	86.2	Confident	82.1	Confident	9 Å²	9	69.1 Å²	69.1	4%	0.042	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	152	172.1	-50.4	-79.4	0	0	0	111.1	W62 S230 I231 N232 F243 P245 S246 T249	W62-H234 AromaticContact CD1-CE1 3.42Å; W62-H234 VanDerWaalsContact CD1-CE1 3.42Å; W62-H234 AromaticContact NE1-CE1 3.48Å; W62-H234 PolarHBondContact NE1-CE1 2.87Å; W62-H234 AromaticContact NE1-NE2 3.95Å; S230-H234 CarbonylContact C-O 3.57Å; S230-H234 WeakPolarHBondContact CA-O 3.14Å; I231-H234 PolarHBondContact N-O 3.06Å; I231-H234 WeakPolarHBondContact O-CB 3.43Å; I231-H234 PolarHBondContact O-CD2 3.37Å; I231-H234 PolarHBondContact O-N 3.13Å; N232-H234 VanDerWaalsContact C-N 3.26Å; N232-H234 PolarHBondContact O-N 3.2Å; H234-F243 HydrophobicContact CB-CD2 4.31Å; H234-F243 HydrophobicContact CB-CE2 3.34Å; H234-F243 HydrophobicContact CB-CZ 3.63Å; H234-F243 AromaticContact CG-CE2 3.79Å; H234-F243 AromaticContact CG-CZ 3.57Å; H234-F243 AromaticContact ND1-CZ 3.81Å; H234-P245 WeakPolarHBondContact ND1-CA 3.35Å; H234-S246 PolarHBondContact ND1-N 3.38Å; H234-T249 PolarHBondContact CE1-OG1 3.46Å
235	F	86.6	Confident	83.3	Confident	59 Å²	59	66 Å²	66	26%	0.259	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.4	176.8	-63.3	-87.4	0	0	0	111.4	T244	F235-T244 PolarHBondContact N-O 3.46Å; F235-T244 PolarHBondContact O-N 3.39Å
236	Y	87.3	Confident	84.3	Confident	38 Å²	38	62.7 Å²	62.7	15%	0.149	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	137.4	173.7	176.6	-99.9	0	0	0	111.6	L70 R228 F229 I242 F243	L70-Y236 HydrophobicContact CB-CE2 3.96Å; L70-Y236 HydrophobicContact CD1-CD2 3.49Å; L70-Y236 VanDerWaalsContact CD1-CD2 3.49Å; L70-Y236 HydrophobicContact CD1-CE2 3.35Å; L70-Y236 HydrophobicContact CD1-CG 4.46Å; L70-Y236 HydrophobicContact CG-CD2 3.96Å; L70-Y236 HydrophobicContact CG-CE2 3.66Å; R228-Y236 WeakPolarHBondContact CA-O 3.3Å; F229-Y236 HydrophobicContact CD1-CD1 4.14Å; F229-Y236 AromaticContact CD2-CD1 3.95Å; F229-Y236 HydrophobicContact CD2-CD1 3.95Å; F229-Y236 HydrophobicContact CD2-CG 4.43Å; F229-Y236 AromaticContact CE1-CD1 3.42Å; F229-Y236 HydrophobicContact CE1-CD1 3.42Å; F229-Y236 VanDerWaalsContact CE1-CD1 3.42Å; F229-Y236 AromaticContact CE1-CE1 3.71Å; F229-Y236 HydrophobicContact CE1-CE1 3.71Å; F229-Y236 AromaticContact CE2-CD1 3.17Å; F229-Y236 HydrophobicContact CE2-CD1 3.17Å; F229-Y236 AromaticContact CE2-CE1 3.93Å; F229-Y236 HydrophobicContact CE2-CE1 3.93Å; F229-Y236 AromaticContact CE2-CG 3.77Å; F229-Y236 HydrophobicContact CE2-CG 3.77Å; F229-Y236 HydrophobicContact CG-CD1 4.42Å; F229-Y236 AromaticContact CZ-CD1 2.93Å; F229-Y236 HydrophobicContact CZ-CD1 2.93Å; F229-Y236 AromaticContact CZ-CE1 3.25Å; F229-Y236 HydrophobicContact CZ-CE1 3.25Å; F229-Y236 AromaticContact CZ-CG 3.97Å; F229-Y236 HydrophobicContact CZ-CG 3.97Å; F229-Y236 PolarHBondContact N-O 2.78Å; F229-Y236 PolarHBondContact O-N 2.84Å; Y236-I242 CarbonylContact C-O 3.57Å; Y236-I242 WeakPolarHBondContact CA-O 3.49Å; Y236-I242 WeakPolarHBondContact CD2-O 3.35Å; Y236-F243 HydrophobicContact CD2-CB 4.36Å
237	N	87.3	Confident	85.3	Confident	29 Å²	29	63.1 Å²	63.1	16%	0.155	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	109.9	171.3	-178.2	-23.5	0	0	0	108.9	H227 R228 K239 T240 S241 I242	H227-N237 WeakPolarHBondContact O-CA 3.46Å; R228-N237 HydrophobicContact CG-CB 4.46Å; N237-K239 VanDerWaalsContact C-N 3.32Å; N237-K239 PolarHBondContact O-N 2.94Å; N237-K239 WeakPolarHBondContact OD1-CB 3.34Å; N237-K239 PolarHBondContact OD1-N 2.96Å; N237-T240 WeakPolarHBondContact CB-OG1 3.33Å; N237-T240 PolarHBondContact ND2-OG1 3.44Å; N237-T240 PolarHBondContact O-N 3Å; N237-T240 PolarHBondContact OD1-N 3.32Å; N237-S241 CarbonylContact O-C 3.52Å; N237-S241 WeakPolarHBondContact O-CA 3.42Å; N237-S241 PolarHBondContact O-N 3.43Å; N237-I242 PolarHBondContact N-O 2.89Å; N237-I242 PolarHBondContact O-N 2.95Å
238	Y	83.3	Confident	86.1	Confident	101 Å²	101	65.2 Å²	65.2	40%	0.396	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-18.4	-175	66.6	-101.5	0	0	0	114.5	Q226 H227 F229	Q226-Y238 WeakPolarHBondContact O-CE1 3.42Å; H227-Y238 HydrophobicContact CB-CD1 4.3Å; H227-Y238 HydrophobicContact CB-CE1 3.99Å; H227-Y238 HydrophobicContact CB-CE2 4.43Å; H227-Y238 PolarHBondContact CE1-OH 3.37Å; H227-Y238 AromaticContact CG-CZ 3.93Å; H227-Y238 AromaticContact ND1-CE1 3.83Å; H227-Y238 AromaticContact ND1-CE2 3.46Å; H227-Y238 WeakPolarHBondContact ND1-CE2 3.4Å; H227-Y238 AromaticContact ND1-CZ 3.07Å; H227-Y238 PolarHBondContact ND1-OH 3.01Å; H227-Y238 WeakPolarHBondContact O-CD1 2.78Å; H227-Y238 PolarHBondContact O-N 2.9Å; H227-Y238 VanDerWaalsContact O-N 3.15Å; F229-Y238 AromaticContact CD1-CD1 3.74Å; F229-Y238 HydrophobicContact CD1-CD1 3.74Å; F229-Y238 HydrophobicContact CD1-CE1 4.36Å; F229-Y238 AromaticContact CE1-CD1 3.62Å; F229-Y238 HydrophobicContact CE1-CD1 3.62Å; F229-Y238 HydrophobicContact CE1-CG 4.23Å
239	K	85.4	Confident	86.8	Confident	134 Å²	134	61.1 Å²	61.1	58%	0.583	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-37.7	174.1	-81.9	-170.3	166	174.2	0	112.3	H227 N237	H227-K239 HydrophobicContact CB-CB 4.36Å; H227-K239 HydrophobicContact CB-CD 3.93Å; H227-K239 HydrophobicContact CB-CG 3.86Å; H227-K239 WeakPolarHBondContact CD2-CD 3.39Å; H227-K239 WeakPolarHBondContact CD2-CE 3.34Å; H227-K239 PolarHBondContact CD2-NZ 3.31Å; H227-K239 WeakPolarHBondContact CE1-CE 3.35Å; H227-K239 PolarHBondContact CE1-NZ 3.06Å; H227-K239 VanDerWaalsContact CG-CE 3.43Å; H227-K239 WeakPolarHBondContact ND1-CE 3.19Å; H227-K239 WeakPolarHBondContact NE2-CE 3.36Å; H227-K239 PolarHBondContact NE2-NZ 2.94Å; N237-K239 VanDerWaalsContact C-N 3.32Å; N237-K239 PolarHBondContact O-N 2.94Å; N237-K239 WeakPolarHBondContact OD1-CB 3.34Å; N237-K239 PolarHBondContact OD1-N 2.96Å
240	T	87.3	Confident	87.4	Confident	61 Å²	61	59.8 Å²	59.8	37%	0.374	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-4	-177.4	62.4	0	0	0	0	112.5	N237 I242	N237-T240 WeakPolarHBondContact CB-OG1 3.33Å; N237-T240 PolarHBondContact ND2-OG1 3.44Å; N237-T240 PolarHBondContact O-N 3Å; N237-T240 PolarHBondContact OD1-N 3.32Å; T240-I242 PolarHBondContact O-N 3.19Å; T240-I242 VanDerWaalsContact O-N 3.13Å; T240-I242 WeakPolarHBondContact OG1-CD1 3.36Å; T240-I242 WeakPolarHBondContact OG1-CG1 3.37Å
241	S	87.6	Confident	87.9	Confident	5 Å²	5	56.5 Å²	56.5	4%	0.035	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	30	-171.4	-59.7	0	0	0	0	114.3	R69 L70 I72 N237	R69-S241 CarbonylContact C-O 3.56Å; R69-S241 VanDerWaalsContact CA-O 3.28Å; R69-S241 WeakPolarHBondContact CA-O 3.13Å; L70-S241 PolarHBondContact N-O 2.79Å; L70-S241 WeakPolarHBondContact O-CB 3.48Å; I72-S241 WeakPolarHBondContact CD1-OG 3.34Å; I72-S241 WeakPolarHBondContact CG1-OG 3.42Å; N237-S241 CarbonylContact O-C 3.52Å; N237-S241 WeakPolarHBondContact O-CA 3.42Å; N237-S241 PolarHBondContact O-N 3.43Å
242	I	90.1	Very high	88.7	Confident	50 Å²	50	56.6 Å²	56.6	26%	0.256	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.4	179.6	-67.5	171.8	0	0	0	108.2	P67 I68 Y236 N237 T240	P67-I242 HydrophobicContact CB-CG2 4.06Å; I68-I242 CarbonylContact O-C 3.57Å; I68-I242 WeakPolarHBondContact O-CA 3.4Å; Y236-I242 CarbonylContact C-O 3.57Å; Y236-I242 WeakPolarHBondContact CA-O 3.49Å; Y236-I242 WeakPolarHBondContact CD2-O 3.35Å; N237-I242 PolarHBondContact N-O 2.89Å; N237-I242 PolarHBondContact O-N 2.95Å; T240-I242 PolarHBondContact O-N 3.19Å; T240-I242 VanDerWaalsContact O-N 3.13Å; T240-I242 WeakPolarHBondContact OG1-CD1 3.36Å; T240-I242 WeakPolarHBondContact OG1-CG1 3.37Å
243	F	90.3	Very high	89.5	Confident	13 Å²	13	50.1 Å²	50.1	6%	0.057	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.7	170.4	179.6	-111.4	0	0	0	109.5	W62 I68 L70 H234 Y236 P245 F272	W62-F243 HydrophobicContact CH2-CE1 4.45Å; W62-F243 HydrophobicContact CZ2-CE1 4.47Å; I68-F243 PolarHBondContact N-O 3.13Å; I68-F243 PolarHBondContact O-N 3.19Å; L70-F243 HydrophobicContact CD1-CB 4.32Å; L70-F243 HydrophobicContact CD1-CD2 4.47Å; L70-F243 HydrophobicContact CD2-CB 3.64Å; L70-F243 HydrophobicContact CD2-CD1 4.36Å; L70-F243 HydrophobicContact CD2-CG 3.97Å; L70-F243 HydrophobicContact CG-CB 3.8Å; L70-F243 HydrophobicContact CG-CG 4.44Å; H234-F243 HydrophobicContact CB-CD2 4.31Å; H234-F243 HydrophobicContact CB-CE2 3.34Å; H234-F243 HydrophobicContact CB-CZ 3.63Å; H234-F243 AromaticContact CG-CE2 3.79Å; H234-F243 AromaticContact CG-CZ 3.57Å; H234-F243 AromaticContact ND1-CZ 3.81Å; Y236-F243 HydrophobicContact CD2-CB 4.36Å; F243-P245 HydrophobicContact CD1-CB 4.38Å; F243-P245 HydrophobicContact CD1-CG 4.43Å; F243-P245 HydrophobicContact CE1-CB 3.68Å; F243-P245 HydrophobicContact CE1-CG 4.15Å; F243-P245 HydrophobicContact CZ-CB 4.14Å; F243-F272 HydrophobicContact CZ-CD1 4.25Å
244	T	90.3	Very high	90.2	Very high	65 Å²	65	54.6 Å²	54.6	40%	0.399	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	98.1	175.8	-53.7	0	0	0	0	107.4	F235	F235-T244 PolarHBondContact N-O 3.46Å; F235-T244 PolarHBondContact O-N 3.39Å
245	P	90.9	Very high	90.7	Very high	11 Å²	11	54.5 Å²	54.5	7%	0.071	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-69.7	135.4	178.7	27.7	-32	0	0	0	110.3	W62 V64 I68 H234 F243 F247	W62-P245 HydrophobicContact CB-CB 3.75Å; W62-P245 HydrophobicContact CB-CG 4.33Å; W62-P245 HydrophobicContact CD2-CB 3.71Å; W62-P245 HydrophobicContact CD2-CG 4.3Å; W62-P245 HydrophobicContact CE3-CB 3.9Å; W62-P245 HydrophobicContact CE3-CG 3.99Å; W62-P245 HydrophobicContact CG-CB 3.65Å; W62-P245 HydrophobicContact CG-CG 4.47Å; V64-P245 HydrophobicContact CB-CG 4.32Å; I68-P245 HydrophobicContact CD1-CG 3.94Å; H234-P245 WeakPolarHBondContact ND1-CA 3.35Å; F243-P245 HydrophobicContact CD1-CB 4.38Å; F243-P245 HydrophobicContact CD1-CG 4.43Å; F243-P245 HydrophobicContact CE1-CB 3.68Å; F243-P245 HydrophobicContact CE1-CG 4.15Å; F243-P245 HydrophobicContact CZ-CB 4.14Å; P245-F247 PolarHBondContact O-N 3.16Å
246	S	90.7	Very high	91.2	Very high	31 Å²	31	52.6 Å²	52.6	22%	0.217	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-69.4	131.3	173.3	-69.2	0	0	0	0	111.1	G233 H234 T249	G233-S246 WeakPolarHBondContact O-CB 3.47Å; G233-S246 PolarHBondContact O-OG 3.5Å; H234-S246 PolarHBondContact ND1-N 3.38Å; S246-T249 WeakPolarHBondContact O-CB 3.27Å; S246-T249 PolarHBondContact O-N 3.42Å; S246-T249 PolarHBondContact O-OG1 3.41Å
247	F	92.1	Very high	91.5	Very high	130 Å²	130	50.9 Å²	50.9	57%	0.57	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	141.9	-177.8	-175	-93.9	0	0	0	111.5	P245 T249 F318 M320	P245-F247 PolarHBondContact O-N 3.16Å; F247-T249 PolarHBondContact O-N 3.01Å; F247-F318 HydrophobicContact CZ-CE1 4.26Å; F247-M320 HydrophobicContact CE2-CE 4.43Å
248	D	92.3	Very high	91.8	Very high	65 Å²	65	57 Å²	57	35%	0.348	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	5.8	-178.7	-159.8	32.7	0	0	0	115.4	S61 W62 S250 K316 F318	S61-D248 PolarHBondContact OG-OD1 2.82Å; W62-D248 PolarHBondContact O-N 3.46Å; D248-S250 PolarHBondContact O-N 3.38Å; D248-K316 IonicContact OD1-NZ 2.81Å; D248-K316 PolarHBondContact OD1-NZ 3.37Å; D248-K316 IonicContact OD2-NZ 3.95Å; D248-K316 PolarHBondContact OD2-NZ 3.43Å; D248-F318 HydrophobicContact CB-CE1 4.4Å; D248-F318 WeakPolarHBondContact OD1-CZ 3.44Å
249	T	93.2	Very high	92.4	Very high	38 Å²	38	53 Å²	53	23%	0.233	26%	0.259	C	S	.	.			trans	-69.8	134	166.3	59.6	0	0	0	0	109.6	S61 W62 H234 S246 F247	S61-T249 CarbonylContact C-O 3.57Å; S61-T249 VanDerWaalsContact CA-O 3.3Å; S61-T249 WeakPolarHBondContact CA-O 3.39Å; W62-T249 PolarHBondContact N-O 2.83Å; H234-T249 PolarHBondContact CE1-OG1 3.46Å; S246-T249 WeakPolarHBondContact O-CB 3.27Å; S246-T249 PolarHBondContact O-N 3.42Å; S246-T249 PolarHBondContact O-OG1 3.41Å; F247-T249 PolarHBondContact O-N 3.01Å
250	S	92.9	Very high	93	Very high	54 Å²	54	48.2 Å²	48.2	38%	0.378	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	136.1	-169.2	-99.2	0	0	0	0	111.2	N59 S61 D248	N59-S250 VanDerWaalsContact ND2-CB 3.34Å; N59-S250 WeakPolarHBondContact ND2-CB 3.37Å; N59-S250 PolarHBondContact ND2-OG 3.26Å; N59-S250 WeakPolarHBondContact OD1-CB 3.36Å; N59-S250 PolarHBondContact OD1-OG 2.92Å; S61-S250 PolarHBondContact OG-OG 2.83Å; D248-S250 PolarHBondContact O-N 3.38Å
251	T	93.8	Very high	93.5	Very high	14 Å²	14	45.4 Å²	45.4	9%	0.086	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.1	173.7	-59.8	0	0	0	0	112.1	N59 I60 W62 L268 K271 F272	N59-T251 PolarHBondContact OD1-N 3.11Å; I60-T251 PolarHBondContact N-O 2.91Å; I60-T251 PolarHBondContact O-N 2.96Å; W62-T251 PolarHBondContact NE1-OG1 2.8Å; T251-L268 HydrophobicContact CG2-CD1 4.43Å; T251-K271 HydrophobicContact CG2-CD 4.19Å; T251-F272 HydrophobicContact CG2-CE2 3.66Å; T251-F272 HydrophobicContact CG2-CZ 3.73Å; T251-F272 WeakPolarHBondContact OG1-CZ 3.3Å
252	K	94.8	Very high	93.9	Very high	94 Å²	94	48.3 Å²	48.3	41%	0.409	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.5	173.8	-64.9	170.6	-174.6	163.4	0	111	L40 F57 L58 K271	L40-K252 HydrophobicContact CD1-CD 4.09Å; L40-K252 HydrophobicContact CD2-CD 4.05Å; F57-K252 HydrophobicContact CB-CB 4.39Å; F57-K252 HydrophobicContact CD1-CB 4.08Å; L58-K252 CarbonylContact O-C 3.46Å; L58-K252 WeakPolarHBondContact O-CA 3.19Å; K252-K271 PolarHBondContact O-NZ 2.8Å
253	V	96.1	Very high	94.3	Very high	7 Å²	7	50.1 Å²	50.1	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.5	174.5	-172.9	0	0	0	0	108.4	F57 L58 I60 I255 Q267 L268	F57-V253 CarbonylContact C-O 3.57Å; F57-V253 WeakPolarHBondContact CA-O 3.43Å; L58-V253 PolarHBondContact N-O 2.93Å; L58-V253 PolarHBondContact O-N 2.81Å; I60-V253 HydrophobicContact CD1-CB 4.46Å; I60-V253 HydrophobicContact CD1-CG2 4.05Å; V253-I255 HydrophobicContact CB-CG2 4.2Å; V253-I255 HydrophobicContact CG1-CG2 3.77Å; V253-I255 PolarHBondContact O-N 2.92Å; V253-Q267 HydrophobicContact CG1-CB 4.29Å; V253-L268 HydrophobicContact CG2-CB 4.22Å; V253-L268 HydrophobicContact CG2-CD1 3.65Å; V253-L268 HydrophobicContact CG2-CG 4.45Å
254	R	96.1	Very high	94.6	Very high	138 Å²	138	49.5 Å²	49.5	52%	0.521	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	117	177.4	-172.1	174.3	-176.5	83.5	3.4	108.7	G56 F57 Q267	G56-R254 CarbonylContact O-C 3.57Å; G56-R254 WeakPolarHBondContact O-CA 3.42Å; F57-R254 HydrophobicContact CD1-CB 4Å; F57-R254 HydrophobicContact CE1-CB 3.75Å; F57-R254 HydrophobicContact CE1-CG 4.37Å; F57-R254 HydrophobicContact CZ-CB 4.33Å; R254-Q267 PolarHBondContact O-OE1 3.46Å
255	I	97.3	Very high	95	Very high	7 Å²	7	46.5 Å²	46.5	4%	0.036	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	163.2	-174.6	67.2	166.9	0	0	0	112.1	G56 L58 V253 M259 V264 L302	G56-I255 PolarHBondContact N-O 2.92Å; G56-I255 VanDerWaalsContact N-O 3.09Å; G56-I255 PolarHBondContact O-N 3.2Å; L58-I255 HydrophobicContact CB-CD1 3.41Å; L58-I255 VanDerWaalsContact CB-CD1 3.41Å; L58-I255 HydrophobicContact CB-CG1 3.79Å; L58-I255 HydrophobicContact CD2-CD1 3.46Å; L58-I255 VanDerWaalsContact CD2-CD1 3.46Å; L58-I255 HydrophobicContact CG-CD1 4.01Å; V253-I255 HydrophobicContact CB-CG2 4.2Å; V253-I255 HydrophobicContact CG1-CG2 3.77Å; V253-I255 PolarHBondContact O-N 2.92Å; I255-M259 HydrophobicContact CB-CE 4.25Å; I255-M259 HydrophobicContact CB-SD 3.76Å; I255-M259 HydrophobicContact CG2-CE 3.98Å; I255-M259 HydrophobicContact CG2-SD 4.11Å; I255-V264 HydrophobicContact CD1-CG2 4.16Å; I255-V264 HydrophobicContact CG2-CG1 4.3Å; I255-V264 HydrophobicContact CG2-CG2 4.12Å; I255-L302 HydrophobicContact CD1-CB 3.66Å; I255-L302 HydrophobicContact CD1-CD1 4.11Å; I255-L302 HydrophobicContact CD1-CG 4.34Å; I255-L302 HydrophobicContact CG1-CB 4.19Å; I255-L302 HydrophobicContact CG1-CD1 4.11Å; I255-L302 HydrophobicContact CG1-CD2 4.34Å; I255-L302 HydrophobicContact CG1-CG 4.44Å
256	S	96.1	Very high	95.3	Very high	19 Å²	19	50.4 Å²	50.4	13%	0.133	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	149.8	173.1	-178.8	0	0	0	0	110.5	I53 V54 R258 M259	I53-S256 WeakPolarHBondContact CG2-OG 3.33Å; V54-S256 CarbonylContact O-C 3.48Å; V54-S256 WeakPolarHBondContact O-CA 3.47Å; S256-R258 PolarHBondContact O-N 2.87Å; S256-R258 VanDerWaalsContact O-N 3.08Å; S256-M259 PolarHBondContact N-SD 3.37Å; S256-M259 VanDerWaalsContact N-SD 3.36Å; S256-M259 WeakPolarHBondContact O-CB 3.43Å; S256-M259 PolarHBondContact O-N 3.11Å
257	S	94.8	Very high	95.6	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.021	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-17.8	174.8	54.2	0	0	0	0	114.7	I53 V54	I53-S257 WeakPolarHBondContact CA-OG 3.32Å; V54-S257 PolarHBondContact N-OG 2.77Å; V54-S257 WeakPolarHBondContact O-CB 3.5Å; V54-S257 PolarHBondContact O-N 3.42Å; V54-S257 PolarHBondContact O-OG 2.84Å; V54-S257 VanDerWaalsContact O-OG 3.07Å
258	R	93.4	Very high	95.7	Very high	156 Å²	156	46.6 Å²	46.6	59%	0.589	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-16.6	175	-66.4	-176.6	65.7	-169.7	2.5	113.6	I53 S256	I53-R258 HydrophobicContact CD1-CG 4.46Å; I53-R258 HydrophobicContact CG1-CG 4.18Å; I53-R258 HydrophobicContact CG2-CG 4.28Å; S256-R258 PolarHBondContact O-N 2.87Å; S256-R258 VanDerWaalsContact O-N 3.08Å
259	M	95.9	Very high	95.9	Very high	18 Å²	18	43.7 Å²	43.7	9%	0.089	21%	0.208	C	C	.	.			trans	-71.3	138.3	-177.6	-67.2	174.7	54.8	0	0	110.5	I255 S256 Q263 V264 Q267 H300	I255-M259 HydrophobicContact CB-CE 4.25Å; I255-M259 HydrophobicContact CB-SD 3.76Å; I255-M259 HydrophobicContact CG2-CE 3.98Å; I255-M259 HydrophobicContact CG2-SD 4.11Å; S256-M259 PolarHBondContact N-SD 3.37Å; S256-M259 VanDerWaalsContact N-SD 3.36Å; S256-M259 WeakPolarHBondContact O-CB 3.43Å; S256-M259 PolarHBondContact O-N 3.11Å; M259-Q263 VanDerWaalsContact CA-OE1 3.31Å; M259-Q263 HydrophobicContact CB-CB 4.36Å; M259-Q263 HydrophobicContact CE-CB 4.11Å; M259-V264 HydrophobicContact CB-CG2 4.03Å; M259-V264 HydrophobicContact CE-CB 4.43Å; M259-V264 HydrophobicContact CE-CG2 3.76Å; M259-Q267 HydrophobicContact CE-CB 4.47Å; M259-Q267 HydrophobicContact CE-CG 3.94Å; M259-Q267 PolarHBondContact SD-NE2 3.24Å; M259-Q267 VanDerWaalsContact SD-NE2 3.44Å; M259-H300 PolarHBondContact O-ND1 2.85Å
260	T	96.8	Very high	95.9	Very high	34 Å²	34	46.8 Å²	46.8	21%	0.209	22%	0.223	C	C	.	.			trans	-83.1	165.3	172.6	60.6	0	0	0	0	111.1	D262 Q263 V264 H297 D299	T260-D262 VanDerWaalsContact C-N 3.28Å; T260-D262 PolarHBondContact O-N 3.28Å; T260-Q263 PolarHBondContact O-N 2.96Å; T260-Q263 VanDerWaalsContact O-N 3.17Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.49Å; T260-V264 WeakPolarHBondContact O-CG2 3.49Å; T260-V264 PolarHBondContact O-N 3.24Å; T260-H297 WeakPolarHBondContact CB-O 3.22Å; T260-D299 CarbonylContact C-O 3.6Å; T260-D299 VanDerWaalsContact CA-O 3.22Å; T260-D299 WeakPolarHBondContact CA-O 3.49Å
261	T	97.5	Very high	95.9	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-48.6	-48.5	173.4	-60.1	0	0	0	0	112.1	Q263 V264 I265 L283 L295 S296 D299	T261-Q263 PolarHBondContact O-N 2.57Å; T261-V264 PolarHBondContact O-N 2.94Å; T261-V264 VanDerWaalsContact O-N 3.16Å; T261-I265 HydrophobicContact CG2-CD1 3.93Å; T261-I265 WeakPolarHBondContact O-CG1 3.46Å; T261-I265 PolarHBondContact O-N 2.79Å; T261-L283 HydrophobicContact CG2-CB 4.02Å; T261-L283 HydrophobicContact CG2-CD1 4Å; T261-L283 HydrophobicContact CG2-CG 3.98Å; T261-L295 HydrophobicContact CG2-CB 4.26Å; T261-S296 WeakPolarHBondContact CB-O 3.28Å; T261-S296 PolarHBondContact OG1-O 3.5Å; T261-D299 PolarHBondContact N-O 2.81Å; T261-D299 PolarHBondContact OG1-O 3.38Å
262	D	96.9	Very high	95.8	Very high	65 Å²	65	50.8 Å²	50.8	35%	0.348	23%	0.232	S	C	.	.	H	α-helix	trans	-59.6	-44.7	-179.5	-61.4	-20.3	0	0	0	112	T260 V264 I265 E266 H297	T260-D262 VanDerWaalsContact C-N 3.28Å; T260-D262 PolarHBondContact O-N 3.28Å; D262-V264 VanDerWaalsContact C-N 3.32Å; D262-V264 PolarHBondContact O-N 2.98Å; D262-I265 PolarHBondContact O-N 2.87Å; D262-E266 WeakPolarHBondContact O-CG 3.44Å; D262-E266 PolarHBondContact O-N 2.6Å; D262-H297 WeakPolarHBondContact OD1-CB 3.38Å; D262-H297 WeakPolarHBondContact OD2-CB 3.4Å; D262-H297 IonicContact OD2-CG 2.84Å; D262-H297 IonicContact OD2-ND1 3.56Å
263	Q	97.5	Very high	95.6	Very high	89 Å²	89	52 Å²	52	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-65.5	-36.3	178.6	-68.2	176.7	-10.9	0	0	112.1	M259 T260 T261 Q267	M259-Q263 VanDerWaalsContact CA-OE1 3.31Å; M259-Q263 HydrophobicContact CB-CB 4.36Å; M259-Q263 HydrophobicContact CE-CB 4.11Å; T260-Q263 PolarHBondContact O-N 2.96Å; T260-Q263 VanDerWaalsContact O-N 3.17Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.49Å; T261-Q263 PolarHBondContact O-N 2.57Å; Q263-Q267 WeakPolarHBondContact O-CB 3.44Å; Q263-Q267 WeakPolarHBondContact O-CG 3.49Å; Q263-Q267 PolarHBondContact O-N 2.7Å
264	V	97.9	Very high	95.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-42.6	175.5	174.6	0	0	0	0	110.4	L58 I60 I255 M259 T260 T261 D262 Q267 L268 L283 P301	L58-V264 HydrophobicContact CD2-CG1 4.48Å; I60-V264 HydrophobicContact CD1-CG1 3.62Å; I255-V264 HydrophobicContact CD1-CG2 4.16Å; I255-V264 HydrophobicContact CG2-CG1 4.3Å; I255-V264 HydrophobicContact CG2-CG2 4.12Å; M259-V264 HydrophobicContact CB-CG2 4.03Å; M259-V264 HydrophobicContact CE-CB 4.43Å; M259-V264 HydrophobicContact CE-CG2 3.76Å; T260-V264 WeakPolarHBondContact O-CG2 3.49Å; T260-V264 PolarHBondContact O-N 3.24Å; T261-V264 PolarHBondContact O-N 2.94Å; T261-V264 VanDerWaalsContact O-N 3.16Å; D262-V264 VanDerWaalsContact C-N 3.32Å; D262-V264 PolarHBondContact O-N 2.98Å; V264-Q267 PolarHBondContact O-N 2.74Å; V264-L268 WeakPolarHBondContact O-CB 3.42Å; V264-L268 PolarHBondContact O-N 3.01Å; V264-L283 HydrophobicContact CB-CD1 4.34Å; V264-L283 HydrophobicContact CG1-CD1 3.99Å; V264-P301 HydrophobicContact CB-CG 4.3Å; V264-P301 HydrophobicContact CG2-CB 4.48Å; V264-P301 HydrophobicContact CG2-CG 3.99Å
265	I	97.6	Very high	95.2	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-52.7	175	-66.7	168.4	0	0	0	109.6	T261 D262 Q267 L268 L269 P278 F281 L283 L319	T261-I265 HydrophobicContact CG2-CD1 3.93Å; T261-I265 WeakPolarHBondContact O-CG1 3.46Å; T261-I265 PolarHBondContact O-N 2.79Å; D262-I265 PolarHBondContact O-N 2.87Å; I265-Q267 VanDerWaalsContact C-N 3.3Å; I265-Q267 PolarHBondContact O-N 3.03Å; I265-L268 WeakPolarHBondContact O-CB 3.22Å; I265-L268 PolarHBondContact O-N 3.03Å; I265-L269 HydrophobicContact CG2-CD1 3.87Å; I265-L269 HydrophobicContact CG2-CG 4.1Å; I265-L269 WeakPolarHBondContact O-CG 3.23Å; I265-L269 PolarHBondContact O-N 3.15Å; I265-P278 HydrophobicContact CG2-CB 4.19Å; I265-F281 HydrophobicContact CG2-CB 4.26Å; I265-L283 HydrophobicContact CD1-CG 4.16Å; I265-L283 HydrophobicContact CG1-CD1 4.37Å; I265-L283 HydrophobicContact CG1-CD2 4.11Å; I265-L283 HydrophobicContact CG1-CG 3.82Å; I265-L319 HydrophobicContact CG1-CD1 3.95Å; I265-L319 HydrophobicContact CG2-CD1 4.09Å
266	E	97	Very high	95	Very high	92 Å²	92	53 Å²	53	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-54.9	-44.2	178	-75.7	176.5	-174.8	0	0	112.3	D262 L268 L269 N270 P278	D262-E266 WeakPolarHBondContact O-CG 3.44Å; D262-E266 PolarHBondContact O-N 2.6Å; E266-L268 PolarHBondContact O-N 3.04Å; E266-L269 PolarHBondContact O-N 3.23Å; E266-N270 WeakPolarHBondContact O-CB 3.34Å; E266-N270 PolarHBondContact O-N 3.48Å; E266-N270 PolarHBondContact O-ND2 3.4Å; E266-P278 HydrophobicContact CG-CB 4.05Å; E266-P278 HydrophobicContact CG-CG 3.82Å
267	Q	96.8	Very high	94.9	Very high	81 Å²	81	55.8 Å²	55.8	38%	0.379	26%	0.262	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.9	-78.2	-168.6	17.3	0	0	112.7	V253 R254 M259 Q263 V264 I265 K271	V253-Q267 HydrophobicContact CG1-CB 4.29Å; R254-Q267 PolarHBondContact O-OE1 3.46Å; M259-Q267 HydrophobicContact CE-CB 4.47Å; M259-Q267 HydrophobicContact CE-CG 3.94Å; M259-Q267 PolarHBondContact SD-NE2 3.24Å; M259-Q267 VanDerWaalsContact SD-NE2 3.44Å; Q263-Q267 WeakPolarHBondContact O-CB 3.44Å; Q263-Q267 WeakPolarHBondContact O-CG 3.49Å; Q263-Q267 PolarHBondContact O-N 2.7Å; V264-Q267 PolarHBondContact O-N 2.74Å; I265-Q267 VanDerWaalsContact C-N 3.3Å; I265-Q267 PolarHBondContact O-N 3.03Å; Q267-K271 WeakPolarHBondContact O-CB 3.4Å; Q267-K271 PolarHBondContact O-N 3.49Å
268	L	96	Very high	94.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.3	-47.6	175.5	177.4	60.2	0	0	0	111	I60 W62 T251 V253 V264 I265 E266 N270 K271 F272 L319	I60-L268 HydrophobicContact CB-CD2 4.28Å; I60-L268 HydrophobicContact CD1-CD2 4.13Å; I60-L268 HydrophobicContact CG2-CD2 3.82Å; W62-L268 HydrophobicContact CH2-CD1 4.34Å; W62-L268 HydrophobicContact CH2-CD2 4.46Å; W62-L268 HydrophobicContact CH2-CG 4.25Å; W62-L268 HydrophobicContact CZ2-CD1 4.13Å; T251-L268 HydrophobicContact CG2-CD1 4.43Å; V253-L268 HydrophobicContact CG2-CB 4.22Å; V253-L268 HydrophobicContact CG2-CD1 3.65Å; V253-L268 HydrophobicContact CG2-CG 4.45Å; V264-L268 WeakPolarHBondContact O-CB 3.42Å; V264-L268 PolarHBondContact O-N 3.01Å; I265-L268 WeakPolarHBondContact O-CB 3.22Å; I265-L268 PolarHBondContact O-N 3.03Å; E266-L268 PolarHBondContact O-N 3.04Å; L268-N270 VanDerWaalsContact C-N 3.33Å; L268-N270 PolarHBondContact O-N 3.18Å; L268-K271 WeakPolarHBondContact O-CB 3.38Å; L268-K271 PolarHBondContact O-N 2.83Å; L268-F272 HydrophobicContact CD1-CD2 3.87Å; L268-F272 HydrophobicContact CD1-CE2 3.65Å; L268-F272 WeakPolarHBondContact O-CD2 3.18Å; L268-F272 PolarHBondContact O-N 3.13Å; L268-L319 HydrophobicContact CD2-CB 4.1Å; L268-L319 HydrophobicContact CD2-CD1 4.41Å; L268-L319 HydrophobicContact CD2-CD2 3.88Å; L268-L319 HydrophobicContact CD2-CG 4.36Å
269	L	94.9	Very high	94.9	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-41.9	178.5	-63	-175.8	0	0	0	111.6	I265 E266 K271 F272 K273 I274 P278 F281 L319	I265-L269 HydrophobicContact CG2-CD1 3.87Å; I265-L269 HydrophobicContact CG2-CG 4.1Å; I265-L269 WeakPolarHBondContact O-CG 3.23Å; I265-L269 PolarHBondContact O-N 3.15Å; E266-L269 PolarHBondContact O-N 3.23Å; L269-K271 VanDerWaalsContact C-N 3.33Å; L269-K271 PolarHBondContact O-N 2.82Å; L269-F272 CarbonylContact O-C 3.6Å; L269-F272 PolarHBondContact O-N 3.37Å; L269-K273 PolarHBondContact O-N 2.87Å; L269-I274 HydrophobicContact CB-CB 4.11Å; L269-I274 HydrophobicContact CD2-CB 3.97Å; L269-I274 HydrophobicContact CD2-CD1 3.47Å; L269-I274 VanDerWaalsContact CD2-CD1 3.47Å; L269-I274 HydrophobicContact CD2-CG1 4.3Å; L269-I274 HydrophobicContact CD2-CG2 3.9Å; L269-I274 PolarHBondContact O-N 3.23Å; L269-P278 HydrophobicContact CD1-CB 4.04Å; L269-P278 HydrophobicContact CD1-CG 4.02Å; L269-F281 HydrophobicContact CD1-CD2 3.8Å; L269-F281 HydrophobicContact CD1-CE2 3.83Å; L269-F281 HydrophobicContact CD2-CD2 4.19Å; L269-F281 HydrophobicContact CD2-CE2 3.91Å; L269-F281 HydrophobicContact CD2-CZ 4.28Å; L269-L319 HydrophobicContact CD2-CD2 4.14Å
270	N	94.6	Very high	94.9	Very high	102 Å²	102	59.5 Å²	59.5	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-35	175.7	-78.6	-39.8	0	0	0	113.2	E266 L268 F272 K273	E266-N270 WeakPolarHBondContact O-CB 3.34Å; E266-N270 PolarHBondContact O-N 3.48Å; E266-N270 PolarHBondContact O-ND2 3.4Å; L268-N270 VanDerWaalsContact C-N 3.33Å; L268-N270 PolarHBondContact O-N 3.18Å; N270-F272 VanDerWaalsContact C-N 3.29Å; N270-F272 PolarHBondContact O-N 3.44Å; N270-K273 PolarHBondContact O-N 3.36Å
271	K	92.9	Very high	94.9	Very high	111 Å²	111	58.1 Å²	58.1	48%	0.483	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-39.3	174.9	-176.8	-177.2	-179.2	-173.9	0	111.4	T251 K252 Q267 L268 L269	T251-K271 HydrophobicContact CG2-CD 4.19Å; K252-K271 PolarHBondContact O-NZ 2.8Å; Q267-K271 WeakPolarHBondContact O-CB 3.4Å; Q267-K271 PolarHBondContact O-N 3.49Å; L268-K271 WeakPolarHBondContact O-CB 3.38Å; L268-K271 PolarHBondContact O-N 2.83Å; L269-K271 VanDerWaalsContact C-N 3.33Å; L269-K271 PolarHBondContact O-N 2.82Å
272	F	90.6	Very high	94.9	Very high	41 Å²	41	58.4 Å²	58.4	18%	0.18	28%	0.283	C	S	.	.	H	α-helix	trans	-95.2	2.4	179.7	-73.2	-92	0	0	0	114.1	W62 L70 F243 T251 L268 L269 N270 I274	W62-F272 AromaticContact CH2-CD2 3.99Å; W62-F272 HydrophobicContact CH2-CD2 3.99Å; W62-F272 HydrophobicContact CH2-CE2 4.35Å; W62-F272 HydrophobicContact CH2-CG 4.2Å; W62-F272 HydrophobicContact CZ2-CD1 4.15Å; W62-F272 AromaticContact CZ2-CD2 3.58Å; W62-F272 HydrophobicContact CZ2-CD2 3.58Å; W62-F272 HydrophobicContact CZ2-CE1 4.08Å; W62-F272 AromaticContact CZ2-CE2 3.51Å; W62-F272 HydrophobicContact CZ2-CE2 3.51Å; W62-F272 AromaticContact CZ2-CG 3.9Å; W62-F272 HydrophobicContact CZ2-CG 3.9Å; W62-F272 AromaticContact CZ2-CZ 3.77Å; W62-F272 HydrophobicContact CZ2-CZ 3.77Å; L70-F272 WeakPolarHBondContact CD2-O 3.39Å; F243-F272 HydrophobicContact CZ-CD1 4.25Å; T251-F272 HydrophobicContact CG2-CE2 3.66Å; T251-F272 HydrophobicContact CG2-CZ 3.73Å; T251-F272 WeakPolarHBondContact OG1-CZ 3.3Å; L268-F272 HydrophobicContact CD1-CD2 3.87Å; L268-F272 HydrophobicContact CD1-CE2 3.65Å; L268-F272 WeakPolarHBondContact O-CD2 3.18Å; L268-F272 PolarHBondContact O-N 3.13Å; L269-F272 CarbonylContact O-C 3.6Å; L269-F272 PolarHBondContact O-N 3.37Å; N270-F272 VanDerWaalsContact C-N 3.29Å; N270-F272 PolarHBondContact O-N 3.44Å; F272-I274 VanDerWaalsContact C-N 3.27Å; F272-I274 HydrophobicContact CB-CD1 3.89Å; F272-I274 HydrophobicContact CB-CG1 3.97Å; F272-I274 PolarHBondContact O-N 3.49Å
273	K	91	Very high	94.9	Very high	120 Å²	120	55.3 Å²	55.3	52%	0.522	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	41.1	-176.2	-52.6	-60.7	177.8	-164.3	0	112.2	L70 K71 L269 N270	L70-K273 CarbonylContact C-O 3.49Å; L70-K273 VanDerWaalsContact CA-O 3.29Å; L70-K273 WeakPolarHBondContact CA-O 3.45Å; K71-K273 HydrophobicContact CB-CB 4.46Å; K71-K273 WeakPolarHBondContact CB-O 3.2Å; K71-K273 PolarHBondContact N-O 2.87Å; L269-K273 PolarHBondContact O-N 2.87Å; N270-K273 PolarHBondContact O-N 3.36Å
274	I	92.3	Very high	94.9	Very high	15 Å²	15	51.1 Å²	51.1	8%	0.077	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-74.9	133.9	177	-68.8	165.3	0	0	0	109.4	W62 I68 R69 L70 L269 F272 N276	W62-I274 HydrophobicContact CH2-CD1 3.75Å; W62-I274 HydrophobicContact CZ3-CD1 4.08Å; I68-I274 HydrophobicContact CG2-CB 4.13Å; I68-I274 HydrophobicContact CG2-CD1 3.92Å; I68-I274 HydrophobicContact CG2-CG1 3.76Å; I68-I274 HydrophobicContact CG2-CG2 3.31Å; R69-I274 CarbonylContact O-C 3.56Å; R69-I274 WeakPolarHBondContact O-CA 3.46Å; L70-I274 HydrophobicContact CD2-CG1 3.86Å; L269-I274 HydrophobicContact CB-CB 4.11Å; L269-I274 HydrophobicContact CD2-CB 3.97Å; L269-I274 HydrophobicContact CD2-CD1 3.47Å; L269-I274 VanDerWaalsContact CD2-CD1 3.47Å; L269-I274 HydrophobicContact CD2-CG1 4.3Å; L269-I274 HydrophobicContact CD2-CG2 3.9Å; L269-I274 PolarHBondContact O-N 3.23Å; F272-I274 VanDerWaalsContact C-N 3.27Å; F272-I274 HydrophobicContact CB-CD1 3.89Å; F272-I274 HydrophobicContact CB-CG1 3.97Å; F272-I274 PolarHBondContact O-N 3.49Å; I274-N276 HydrophobicContact CG2-CB 3.72Å
275	E	92.2	Very high	94.9	Very high	127 Å²	127	51.8 Å²	51.8	59%	0.593	25%	0.251	S	S	*	.			trans	-86.1	-24.7	179.9	-173.6	-176.5	-177.2	0	0	112.6	R69	R69-E275 HydrophobicContact CB-CB 4.45Å; R69-E275 PolarHBondContact O-N 3.27Å
276	N	92.8	Very high	94.8	Very high	30 Å²	30	53.8 Å²	53.8	16%	0.16	26%	0.261	C	S	.	.	S	Bend	trans	-56.3	149.3	-178.9	-73	87.6	0	0	0	113.3	R66 I68 R69 I274 E280 F281	R66-N276 PolarHBondContact NH1-ND2 3.02Å; I68-N276 WeakPolarHBondContact CG2-OD1 3.28Å; R69-N276 PolarHBondContact N-OD1 2.93Å; I274-N276 HydrophobicContact CG2-CB 3.72Å; N276-E280 WeakPolarHBondContact CB-OE2 3.29Å; N276-E280 PolarHBondContact ND2-OE2 3.28Å; N276-F281 HydrophobicContact CB-CE2 3.71Å; N276-F281 HydrophobicContact CB-CZ 3.92Å
277	D	93.8	Very high	94.7	Very high	78 Å²	78	51.7 Å²	51.7	42%	0.417	25%	0.251	S	S	.	.			trans	-63.4	127.2	175.9	-177.9	-9.6	0	0	0	109.9	Q279 E280 F281	D277-Q279 PolarHBondContact O-N 3.5Å; D277-Q279 VanDerWaalsContact O-N 3.11Å; D277-Q279 WeakPolarHBondContact OD1-CB 3.48Å; D277-Q279 PolarHBondContact OD1-N 2.83Å; D277-E280 HydrophobicContact CB-CG 4.11Å; D277-E280 WeakPolarHBondContact O-CB 3.38Å; D277-E280 PolarHBondContact O-N 3.17Å; D277-F281 WeakPolarHBondContact O-CD2 3.45Å
278	P	94.7	Very high	94.6	Very high	42 Å²	42	53.8 Å²	53.8	27%	0.273	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-49.8	-31.5	173.3	-26.4	32.3	0	0	0	114.3	I265 E266 L269 E280 F281	I265-P278 HydrophobicContact CG2-CB 4.19Å; E266-P278 HydrophobicContact CG-CB 4.05Å; E266-P278 HydrophobicContact CG-CG 3.82Å; L269-P278 HydrophobicContact CD1-CB 4.04Å; L269-P278 HydrophobicContact CD1-CG 4.02Å; P278-E280 PolarHBondContact O-N 2.83Å; P278-F281 PolarHBondContact O-N 2.98Å; P278-F281 VanDerWaalsContact O-N 3.15Å
279	Q	94.3	Very high	94.4	Very high	137 Å²	137	55.4 Å²	55.4	64%	0.64	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-67.9	-18.7	179	-62.3	-172.9	14.4	0	0	113	D277 F281 M322	D277-Q279 PolarHBondContact O-N 3.5Å; D277-Q279 VanDerWaalsContact O-N 3.11Å; D277-Q279 WeakPolarHBondContact OD1-CB 3.48Å; D277-Q279 PolarHBondContact OD1-N 2.83Å; Q279-F281 PolarHBondContact O-N 3.23Å; Q279-M322 HydrophobicContact CB-CE 4.26Å; Q279-M322 WeakPolarHBondContact O-CE 3.47Å; Q279-M322 VanDerWaalsContact O-SD 3.37Å
280	E	94.5	Very high	94.2	Very high	76 Å²	76	56.2 Å²	56.2	36%	0.355	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-73.5	-6	175.5	-60.6	175.2	156	0	0	112.6	R66 N276 D277 P278 M322	R66-E280 IonicContact CZ-OE2 2.64Å; R66-E280 IonicContact NH1-OE1 3.93Å; R66-E280 IonicContact NH1-OE2 3.09Å; R66-E280 PolarHBondContact NH1-OE2 3.25Å; R66-E280 IonicContact NH2-OE2 3.8Å; R66-E280 PolarHBondContact NH2-OE2 3.49Å; N276-E280 WeakPolarHBondContact CB-OE2 3.29Å; N276-E280 PolarHBondContact ND2-OE2 3.28Å; D277-E280 HydrophobicContact CB-CG 4.11Å; D277-E280 WeakPolarHBondContact O-CB 3.38Å; D277-E280 PolarHBondContact O-N 3.17Å; P278-E280 PolarHBondContact O-N 2.83Å; E280-M322 PolarHBondContact O-N 3.25Å
281	F	96.3	Very high	94.3	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	158.9	-178	-53.2	-82.5	0	0	0	112	V64 R66 I68 I265 L269 N276 D277 P278 Q279 L319 M320	V64-F281 HydrophobicContact CG1-CE1 4.02Å; V64-F281 HydrophobicContact CG2-CD1 3.86Å; V64-F281 HydrophobicContact CG2-CE1 3.78Å; R66-F281 VanDerWaalsContact NH2-CE2 3.31Å; I68-F281 HydrophobicContact CD1-CE1 4.04Å; I68-F281 HydrophobicContact CD1-CZ 4.27Å; I68-F281 HydrophobicContact CG1-CE1 4.31Å; I68-F281 HydrophobicContact CG1-CZ 4.33Å; I68-F281 HydrophobicContact CG2-CZ 4.3Å; I265-F281 HydrophobicContact CG2-CB 4.26Å; L269-F281 HydrophobicContact CD1-CD2 3.8Å; L269-F281 HydrophobicContact CD1-CE2 3.83Å; L269-F281 HydrophobicContact CD2-CD2 4.19Å; L269-F281 HydrophobicContact CD2-CE2 3.91Å; L269-F281 HydrophobicContact CD2-CZ 4.28Å; N276-F281 HydrophobicContact CB-CE2 3.71Å; N276-F281 HydrophobicContact CB-CZ 3.92Å; D277-F281 WeakPolarHBondContact O-CD2 3.45Å; P278-F281 PolarHBondContact O-N 2.98Å; P278-F281 VanDerWaalsContact O-N 3.15Å; Q279-F281 PolarHBondContact O-N 3.23Å; F281-L319 HydrophobicContact CB-CD1 3.78Å; F281-L319 HydrophobicContact CB-CG 4.27Å; F281-L319 HydrophobicContact CD1-CD2 4.17Å; F281-L319 HydrophobicContact CD1-CG 4.26Å; F281-L319 HydrophobicContact CG-CD1 4.37Å; F281-L319 HydrophobicContact CG-CD2 4.46Å; F281-L319 HydrophobicContact CG-CG 4.48Å; F281-M320 VanDerWaalsContact CA-O 3.3Å; F281-M320 WeakPolarHBondContact CA-O 3.22Å
282	A	97.5	Very high	94.4	Very high	7 Å²	7	49.9 Å²	49.9	6%	0.058	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	157	167.4	0	0	0	0	0	110.6	Y284 K294 M320	A282-Y284 HydrophobicContact CB-CD2 4.34Å; A282-Y284 HydrophobicContact CB-CE2 3.76Å; A282-K294 HydrophobicContact CB-CD 4.33Å; A282-K294 HydrophobicContact CB-CG 4.21Å; A282-M320 PolarHBondContact N-O 2.83Å; A282-M320 PolarHBondContact O-N 3.28Å
283	L	98	Very high	94.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	134	170.4	-64.7	-175.9	0	0	0	110.1	I60 T261 V264 I265 L295 P301 I317 F318 L319	I60-L283 HydrophobicContact CG2-CD2 4.15Å; T261-L283 HydrophobicContact CG2-CB 4.02Å; T261-L283 HydrophobicContact CG2-CD1 4Å; T261-L283 HydrophobicContact CG2-CG 3.98Å; V264-L283 HydrophobicContact CB-CD1 4.34Å; V264-L283 HydrophobicContact CG1-CD1 3.99Å; I265-L283 HydrophobicContact CD1-CG 4.16Å; I265-L283 HydrophobicContact CG1-CD1 4.37Å; I265-L283 HydrophobicContact CG1-CD2 4.11Å; I265-L283 HydrophobicContact CG1-CG 3.82Å; L283-L295 HydrophobicContact CB-CB 4.28Å; L283-L295 HydrophobicContact CB-CD1 3.98Å; L283-L295 HydrophobicContact CB-CG 4.4Å; L283-L295 PolarHBondContact O-N 2.89Å; L283-P301 HydrophobicContact CD1-CB 4.1Å; L283-P301 HydrophobicContact CD1-CG 3.67Å; L283-I317 HydrophobicContact CB-CG2 4.23Å; L283-I317 HydrophobicContact CD1-CG2 4.34Å; L283-I317 HydrophobicContact CD2-CG2 4.29Å; L283-F318 CarbonylContact C-O 3.51Å; L283-F318 VanDerWaalsContact CA-O 3.29Å; L283-F318 WeakPolarHBondContact CA-O 3.42Å; L283-L319 HydrophobicContact CD2-CB 4.27Å; L283-L319 HydrophobicContact CD2-CD1 3.84Å
284	Y	97.9	Very high	95	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.3	175.6	-71.7	-102.6	0	0	0	110	A282 K292 K293 K294 I317 F318 M320 D321 M322 E324 E326	A282-Y284 HydrophobicContact CB-CD2 4.34Å; A282-Y284 HydrophobicContact CB-CE2 3.76Å; Y284-K292 HydrophobicContact CD1-CD 4.3Å; Y284-K292 HydrophobicContact CD1-CG 3.87Å; Y284-K293 CarbonylContact C-O 3.38Å; Y284-K293 WeakPolarHBondContact CA-O 3.44Å; Y284-K294 HydrophobicContact CD1-CB 3.92Å; Y284-K294 HydrophobicContact CD1-CG 4.45Å; Y284-K294 HydrophobicContact CE1-CB 3.61Å; Y284-K294 HydrophobicContact CE1-CD 4.3Å; Y284-K294 HydrophobicContact CE1-CG 3.99Å; Y284-K294 HydrophobicContact CE2-CG 4.33Å; Y284-I317 CarbonylContact O-C 3.55Å; Y284-I317 WeakPolarHBondContact O-CA 3.41Å; Y284-F318 PolarHBondContact N-O 3.33Å; Y284-F318 PolarHBondContact O-N 3.39Å; Y284-M320 HydrophobicContact CD2-CB 3.63Å; Y284-M320 HydrophobicContact CD2-CG 3.99Å; Y284-M320 HydrophobicContact CD2-SD 4.06Å; Y284-M320 HydrophobicContact CE2-CB 3.84Å; Y284-M320 HydrophobicContact CG-SD 4.04Å; Y284-D321 PolarHBondContact OH-O 3.41Å; Y284-M322 PolarHBondContact OH-O 2.93Å; Y284-E324 HydrophobicContact CE1-CB 4.28Å; Y284-E324 HydrophobicContact CE2-CB 4.15Å; Y284-E324 PolarHBondContact OH-N 2.84Å; Y284-E324 PolarHBondContact OH-O 3.21Å; Y284-E326 HydrophobicContact CE1-CG 4.03Å
285	C	96.9	Very high	95.2	Very high	14 Å²	14	48.9 Å²	48.9	10%	0.095	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.2	167.3	-70.6	0	0	0	0	108.4	K292 K293 M315 K316	C285-K292 WeakPolarHBondContact O-CA 3.26Å; C285-K293 PolarHBondContact N-O 3.37Å; C285-K293 PolarHBondContact O-N 2.9Å; C285-M315 HydrophobicContact CB-CG 4.27Å; C285-M315 HydrophobicContact CB-SD 4.12Å; C285-K316 WeakPolarHBondContact CA-O 3.35Å
286	I	96.1	Very high	95.3	Very high	44 Å²	44	45.5 Å²	45.5	23%	0.226	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.1	173	-57.1	-175.1	0	0	0	107.8	E291 K292 M315 K316 F318 M320	I286-E291 CarbonylContact C-O 3.6Å; I286-E291 WeakPolarHBondContact CA-O 3.48Å; I286-K292 HydrophobicContact CD1-CD 4.46Å; I286-K292 HydrophobicContact CG1-CB 4.41Å; I286-K292 HydrophobicContact CG1-CG 4.23Å; I286-M315 CarbonylContact O-C 3.59Å; I286-M315 VanDerWaalsContact O-CA 3.32Å; I286-M315 WeakPolarHBondContact O-CA 3.02Å; I286-K316 PolarHBondContact N-O 3.33Å; I286-K316 PolarHBondContact O-N 3.18Å; I286-F318 HydrophobicContact CB-CD2 4.17Å; I286-F318 HydrophobicContact CB-CE2 4.12Å; I286-F318 HydrophobicContact CD1-CD2 3.57Å; I286-F318 HydrophobicContact CD1-CE2 3.74Å; I286-F318 HydrophobicContact CD1-CG 4.18Å; I286-F318 HydrophobicContact CD1-CZ 4.49Å; I286-F318 HydrophobicContact CG1-CD2 3.83Å; I286-F318 HydrophobicContact CG1-CE2 4.16Å; I286-M320 HydrophobicContact CD1-CE 3.68Å
287	H	95.3	Very high	95.4	Very high	48 Å²	48	48.4 Å²	48.4	22%	0.222	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	157.6	178.7	-170.9	-108.5	0	0	0	110.8	S289 G290 E291 I314	H287-S289 PolarHBondContact ND1-N 2.71Å; H287-S289 PolarHBondContact ND1-OG 2.92Å; H287-S289 PolarHBondContact O-N 3.42Å; H287-G290 PolarHBondContact O-N 3Å; H287-E291 HydrophobicContact CB-CB 4.2Å; H287-E291 PolarHBondContact N-O 2.84Å; H287-I314 CarbonylContact C-O 3.57Å; H287-I314 WeakPolarHBondContact CA-O 3.39Å; H287-I314 PolarHBondContact CD2-O 2.64Å
288	Q	93.6	Very high	95.4	Very high	126 Å²	126	53.4 Å²	53.4	59%	0.589	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.7	176.4	67.5	-178.8	14.3	0	0	114.1	G290 D313 I314	Q288-G290 PolarHBondContact O-N 3.16Å; Q288-D313 VanDerWaalsContact CB-O 3.28Å; Q288-D313 WeakPolarHBondContact CB-O 3.43Å; Q288-I314 PolarHBondContact N-O 3.11Å
289	S	91.9	Very high	95.5	Very high	34 Å²	34	53 Å²	53	24%	0.238	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.7	173.8	56.2	0	0	0	0	113.3	H287 E291 A332	H287-S289 PolarHBondContact ND1-N 2.71Å; H287-S289 PolarHBondContact ND1-OG 2.92Å; H287-S289 PolarHBondContact O-N 3.42Å; S289-E291 PolarHBondContact OG-N 2.99Å; S289-A332 WeakPolarHBondContact O-CB 3.47Å
290	G	91.7	Very high	95.5	Very high	22 Å²	22	48.8 Å²	48.8	23%	0.227	24%	0.238	C	C	.	.	S	Bend	trans	92.4	-0.7	-169.1	0	0	0	0	0	113.8	H287 Q288 K292 A332	H287-G290 PolarHBondContact O-N 3Å; Q288-G290 PolarHBondContact O-N 3.16Å; G290-K292 PolarHBondContact O-N 2.9Å; G290-A332 VanDerWaalsContact C-CB 3.49Å
291	E	95.1	Very high	95.7	Very high	52 Å²	52	45.2 Å²	45.2	24%	0.243	22%	0.221	C	C	.	.			trans	-62.6	129.3	173	-178.6	-178.4	177.6	0	0	109.3	I286 H287 S289 V327 N329 A332	I286-E291 CarbonylContact C-O 3.6Å; I286-E291 WeakPolarHBondContact CA-O 3.48Å; H287-E291 HydrophobicContact CB-CB 4.2Å; H287-E291 PolarHBondContact N-O 2.84Å; S289-E291 PolarHBondContact OG-N 2.99Å; E291-V327 WeakPolarHBondContact CG-O 3.02Å; E291-N329 HydrophobicContact CG-CB 4.42Å; E291-N329 PolarHBondContact OE2-ND2 3.15Å; E291-A332 HydrophobicContact CB-CB 4.2Å; E291-A332 VanDerWaalsContact N-CB 3.32Å
292	K	96.1	Very high	95.7	Very high	28 Å²	28	45 Å²	45	12%	0.122	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	105.5	178.2	173	173.8	43.8	152.7	0	107.9	Y284 C285 I286 G290 M320 E324 E325 E326 V327	Y284-K292 HydrophobicContact CD1-CD 4.3Å; Y284-K292 HydrophobicContact CD1-CG 3.87Å; C285-K292 WeakPolarHBondContact O-CA 3.26Å; I286-K292 HydrophobicContact CD1-CD 4.46Å; I286-K292 HydrophobicContact CG1-CB 4.41Å; I286-K292 HydrophobicContact CG1-CG 4.23Å; G290-K292 PolarHBondContact O-N 2.9Å; K292-M320 HydrophobicContact CD-SD 4.45Å; K292-E324 HydrophobicContact CD-CG 4.43Å; K292-E324 IonicContact NZ-OE1 2.76Å; K292-E324 PolarHBondContact NZ-OE1 2.87Å; K292-E325 WeakPolarHBondContact CD-O 3.44Å; K292-E325 WeakPolarHBondContact CE-O 3.3Å; K292-E325 PolarHBondContact NZ-O 3.48Å; K292-E326 WeakPolarHBondContact O-CA 3.37Å; K292-V327 HydrophobicContact CB-CB 4.04Å; K292-V327 HydrophobicContact CB-CG2 4.25Å; K292-V327 PolarHBondContact N-O 2.95Å; K292-V327 PolarHBondContact O-N 2.92Å
293	K	96.1	Very high	95.6	Very high	89 Å²	89	45 Å²	45	39%	0.387	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.1	-176.4	-179.2	-176	174.5	-168.6	0	110.4	Y284 C285	Y284-K293 CarbonylContact C-O 3.38Å; Y284-K293 WeakPolarHBondContact CA-O 3.44Å; C285-K293 PolarHBondContact N-O 3.37Å; C285-K293 PolarHBondContact O-N 2.9Å
294	K	97.4	Very high	95.5	Very high	61 Å²	61	45.5 Å²	45.5	27%	0.265	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	134.6	172.7	-172.6	175.4	174.1	169.4	0	110.3	A282 Y284 M322 E326	A282-K294 HydrophobicContact CB-CD 4.33Å; A282-K294 HydrophobicContact CB-CG 4.21Å; Y284-K294 HydrophobicContact CD1-CB 3.92Å; Y284-K294 HydrophobicContact CD1-CG 4.45Å; Y284-K294 HydrophobicContact CE1-CB 3.61Å; Y284-K294 HydrophobicContact CE1-CD 4.3Å; Y284-K294 HydrophobicContact CE1-CG 3.99Å; Y284-K294 HydrophobicContact CE2-CG 4.33Å; K294-M322 PolarHBondContact NZ-O 3.37Å; K294-E326 HydrophobicContact CB-CG 3.98Å; K294-E326 WeakPolarHBondContact CB-OE1 3.4Å; K294-E326 PolarHBondContact N-OE2 3.23Å
295	L	96.2	Very high	95.4	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-79.2	135.7	169.8	-65	-175.4	0	0	0	110	T261 L283 P301 E304	T261-L295 HydrophobicContact CG2-CB 4.26Å; L283-L295 HydrophobicContact CB-CB 4.28Å; L283-L295 HydrophobicContact CB-CD1 3.98Å; L283-L295 HydrophobicContact CB-CG 4.4Å; L283-L295 PolarHBondContact O-N 2.89Å; L295-P301 HydrophobicContact CD1-CB 4.21Å; L295-P301 HydrophobicContact CD1-CG 4.16Å; L295-E304 HydrophobicContact CD2-CG 3.95Å
296	S	95.2	Very high	95.3	Very high	56 Å²	56	45 Å²	45	39%	0.392	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-66.8	152.9	171.9	-174.8	0	0	0	0	110.2	T261 R298 D299	T261-S296 WeakPolarHBondContact CB-O 3.28Å; T261-S296 PolarHBondContact OG1-O 3.5Å; S296-R298 PolarHBondContact O-N 2.64Å; S296-R298 VanDerWaalsContact O-N 3.13Å; S296-D299 WeakPolarHBondContact CA-OD2 3.36Å; S296-D299 WeakPolarHBondContact CB-OD2 3.34Å; S296-D299 PolarHBondContact N-OD2 2.98Å; S296-D299 WeakPolarHBondContact O-CB 3.26Å; S296-D299 PolarHBondContact O-N 3.47Å
297	H	94.8	Very high	95.2	Very high	92 Å²	92	44.7 Å²	44.7	43%	0.426	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.1	179.5	80.7	90	0	0	0	112.7	T260 D262	T260-H297 WeakPolarHBondContact CB-O 3.22Å; D262-H297 WeakPolarHBondContact OD1-CB 3.38Å; D262-H297 WeakPolarHBondContact OD2-CB 3.4Å; D262-H297 IonicContact OD2-CG 2.84Å; D262-H297 IonicContact OD2-ND1 3.56Å
298	R	94	Very high	95.1	Very high	183 Å²	183	46.5 Å²	46.5	69%	0.691	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-6.7	177	-54.1	-172.2	-177	-169.5	-6.6	114.6	S296	S296-R298 PolarHBondContact O-N 2.64Å; S296-R298 VanDerWaalsContact O-N 3.13Å
299	D	95.8	Very high	95.2	Very high	32 Å²	32	41.1 Å²	41.1	17%	0.171	20%	0.203	C	C	.	.	S	Bend	trans	-69.7	166.8	-179.2	-68.9	-22.8	0	0	0	110.9	T260 T261 S296 P301	T260-D299 CarbonylContact C-O 3.6Å; T260-D299 VanDerWaalsContact CA-O 3.22Å; T260-D299 WeakPolarHBondContact CA-O 3.49Å; T261-D299 PolarHBondContact N-O 2.81Å; T261-D299 PolarHBondContact OG1-O 3.38Å; S296-D299 WeakPolarHBondContact CA-OD2 3.36Å; S296-D299 WeakPolarHBondContact CB-OD2 3.34Å; S296-D299 PolarHBondContact N-OD2 2.98Å; S296-D299 WeakPolarHBondContact O-CB 3.26Å; S296-D299 PolarHBondContact O-N 3.47Å; D299-P301 WeakPolarHBondContact O-CD 3.46Å
300	H	96.1	Very high	95.3	Very high	50 Å²	50	40.5 Å²	40.5	23%	0.231	20%	0.198	C	C	.	.			trans	-117.1	95.2	-177.2	-65.3	-67.2	0	0	0	109.9	M259 L302 W303 E304	M259-H300 PolarHBondContact O-ND1 2.85Å; H300-L302 PolarHBondContact O-N 2.77Å; H300-L302 VanDerWaalsContact O-N 3.13Å; H300-W303 HydrophobicContact CB-CB 4.22Å; H300-W303 HydrophobicContact CB-CG 4.4Å; H300-W303 WeakPolarHBondContact O-CB 3.13Å; H300-W303 PolarHBondContact O-N 2.96Å; H300-E304 PolarHBondContact O-N 3.5Å; H300-E304 VanDerWaalsContact O-N 3.16Å
301	P	96.9	Very high	95.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.4	-31.8	-170.8	-28.4	35.9	0	0	0	114.6	L58 V264 L283 L295 D299 E304 R305	L58-P301 HydrophobicContact CD2-CB 3.75Å; V264-P301 HydrophobicContact CB-CG 4.3Å; V264-P301 HydrophobicContact CG2-CB 4.48Å; V264-P301 HydrophobicContact CG2-CG 3.99Å; L283-P301 HydrophobicContact CD1-CB 4.1Å; L283-P301 HydrophobicContact CD1-CG 3.67Å; L295-P301 HydrophobicContact CD1-CB 4.21Å; L295-P301 HydrophobicContact CD1-CG 4.16Å; D299-P301 WeakPolarHBondContact O-CD 3.46Å; P301-E304 PolarHBondContact O-N 3.26Å; P301-R305 PolarHBondContact O-N 2.97Å
302	L	96.8	Very high	95.3	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-40.1	176.4	-169.2	60	0	0	0	111.7	L42 V54 I255 H300 R305 I306	L42-L302 HydrophobicContact CD2-CD1 4.18Å; V54-L302 HydrophobicContact CB-CD2 4.24Å; V54-L302 HydrophobicContact CG1-CD2 4.26Å; I255-L302 HydrophobicContact CD1-CB 3.66Å; I255-L302 HydrophobicContact CD1-CD1 4.11Å; I255-L302 HydrophobicContact CD1-CG 4.34Å; I255-L302 HydrophobicContact CG1-CB 4.19Å; I255-L302 HydrophobicContact CG1-CD1 4.11Å; I255-L302 HydrophobicContact CG1-CD2 4.34Å; I255-L302 HydrophobicContact CG1-CG 4.44Å; H300-L302 PolarHBondContact O-N 2.77Å; H300-L302 VanDerWaalsContact O-N 3.13Å; L302-R305 PolarHBondContact O-N 3.27Å; L302-I306 HydrophobicContact CG-CD1 3.96Å; L302-I306 WeakPolarHBondContact O-CD1 3.35Å; L302-I306 VanDerWaalsContact O-CG1 3.23Å; L302-I306 WeakPolarHBondContact O-CG1 3.32Å; L302-I306 PolarHBondContact O-N 3.07Å
303	W	95.7	Very high	95.1	Very high	9 Å²	9	44.6 Å²	44.6	3%	0.034	22%	0.219	C	C	.	.	H	α-helix	trans	-67.6	-42.9	176.7	-80.2	124.4	0	0	0	111.5	I10 A12 G13 L18 F23 V54 H300 R305 I306 L307	I10-W303 HydrophobicContact CG2-CH2 3.99Å; I10-W303 HydrophobicContact CG2-CZ2 4.32Å; A12-W303 HydrophobicContact CB-CD2 4.11Å; A12-W303 HydrophobicContact CB-CE3 3.94Å; A12-W303 HydrophobicContact CB-CZ3 4.33Å; G13-W303 VanDerWaalsContact N-CD1 3.31Å; G13-W303 VanDerWaalsContact N-CG 3.3Å; L18-W303 HydrophobicContact CD1-CZ3 4.39Å; F23-W303 AromaticContact CD2-CH2 3.94Å; F23-W303 HydrophobicContact CD2-CH2 3.94Å; F23-W303 HydrophobicContact CD2-CZ3 4.06Å; F23-W303 AromaticContact CE2-CH2 3.72Å; F23-W303 HydrophobicContact CE2-CH2 3.72Å; F23-W303 HydrophobicContact CE2-CZ3 4.04Å; V54-W303 HydrophobicContact CG2-CH2 3.73Å; V54-W303 HydrophobicContact CG2-CZ2 4.1Å; V54-W303 HydrophobicContact CG2-CZ3 4.28Å; H300-W303 HydrophobicContact CB-CB 4.22Å; H300-W303 HydrophobicContact CB-CG 4.4Å; H300-W303 WeakPolarHBondContact O-CB 3.13Å; H300-W303 PolarHBondContact O-N 2.96Å; W303-R305 VanDerWaalsContact C-N 3.27Å; W303-R305 PolarHBondContact O-N 3.39Å; W303-I306 HydrophobicContact CE3-CB 4.43Å; W303-I306 HydrophobicContact CE3-CD1 4.08Å; W303-I306 HydrophobicContact CE3-CG2 4.47Å; W303-I306 HydrophobicContact CZ3-CD1 4.25Å; W303-I306 HydrophobicContact CZ3-CG2 4.46Å; W303-I306 PolarHBondContact O-N 3.4Å; W303-L307 WeakPolarHBondContact O-CB 3.5Å; W303-L307 VanDerWaalsContact O-CG 3.22Å; W303-L307 WeakPolarHBondContact O-CG 3.28Å; W303-L307 PolarHBondContact O-N 2.9Å
304	E	95.6	Very high	95.1	Very high	9 Å²	9	43.2 Å²	43.2	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-55.5	-45.7	174.4	-67.2	-61	149.1	0	0	111	L295 H300 P301 L307 Q308	L295-E304 HydrophobicContact CD2-CG 3.95Å; H300-E304 PolarHBondContact O-N 3.5Å; H300-E304 VanDerWaalsContact O-N 3.16Å; P301-E304 PolarHBondContact O-N 3.26Å; E304-L307 PolarHBondContact O-N 3.29Å; E304-Q308 WeakPolarHBondContact O-CG 3.1Å; E304-Q308 PolarHBondContact O-N 3.42Å
305	R	96	Very high	95	Very high	3 Å²	3	40.6 Å²	40.6	1%	0.011	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-45	175.9	176.9	61	77.6	153	9.1	112.8	Y30 L58 N59 P301 L302 W303 L307 Q308 G309 D312 M315 I317	Y30-R305 HydrophobicContact CE2-CG 3.98Å; L58-R305 HydrophobicContact CD1-CB 3.6Å; L58-R305 HydrophobicContact CD1-CG 3.67Å; N59-R305 PolarHBondContact O-NH2 3.24Å; P301-R305 PolarHBondContact O-N 2.97Å; L302-R305 PolarHBondContact O-N 3.27Å; W303-R305 VanDerWaalsContact C-N 3.27Å; W303-R305 PolarHBondContact O-N 3.39Å; R305-L307 VanDerWaalsContact C-N 3.31Å; R305-L307 PolarHBondContact O-N 2.82Å; R305-Q308 PolarHBondContact O-N 3.5Å; R305-G309 VanDerWaalsContact CD-O 3.28Å; R305-G309 WeakPolarHBondContact CD-O 3.46Å; R305-G309 CarbonylContact O-C 3.41Å; R305-G309 PolarHBondContact O-N 3.24Å; R305-G309 VanDerWaalsContact O-O 3.11Å; R305-D312 IonicContact CZ-OD1 3.39Å; R305-D312 VanDerWaalsContact CZ-OD1 3.26Å; R305-D312 IonicContact NH1-OD1 3.91Å; R305-D312 PolarHBondContact NH1-OD1 3.06Å; R305-D312 IonicContact NH2-OD1 3.52Å; R305-D312 PolarHBondContact NH2-OD1 3.14Å; R305-M315 PolarHBondContact NH1-O 3.32Å; R305-I317 HydrophobicContact CB-CD1 4.28Å
306	I	95.4	Very high	95	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-39.8	-179.8	-70.3	164.1	0	0	0	111.2	L26 L42 V54 L302 W303	L26-I306 HydrophobicContact CB-CG2 3.95Å; L26-I306 HydrophobicContact CD1-CG2 4.3Å; L42-I306 HydrophobicContact CD1-CD1 3.86Å; L42-I306 HydrophobicContact CD1-CG1 3.58Å; V54-I306 HydrophobicContact CB-CD1 4.23Å; V54-I306 HydrophobicContact CG1-CD1 3.87Å; V54-I306 HydrophobicContact CG2-CD1 4.32Å; L302-I306 HydrophobicContact CG-CD1 3.96Å; L302-I306 WeakPolarHBondContact O-CD1 3.35Å; L302-I306 VanDerWaalsContact O-CG1 3.23Å; L302-I306 WeakPolarHBondContact O-CG1 3.32Å; L302-I306 PolarHBondContact O-N 3.07Å; W303-I306 HydrophobicContact CE3-CB 4.43Å; W303-I306 HydrophobicContact CE3-CD1 4.08Å; W303-I306 HydrophobicContact CE3-CG2 4.47Å; W303-I306 HydrophobicContact CZ3-CD1 4.25Å; W303-I306 HydrophobicContact CZ3-CG2 4.46Å; W303-I306 PolarHBondContact O-N 3.4Å
307	L	94.3	Very high	95.2	Very high	36 Å²	36	40.2 Å²	40.2	19%	0.188	20%	0.195	C	C	.	.	H	α-helix	trans	-68.6	-34.8	-178.9	-70.3	168	0	0	0	112.5	A12 L18 L26 W303 E304 R305	A12-L307 HydrophobicContact CB-CD1 4.41Å; A12-L307 HydrophobicContact CB-CD2 4.47Å; L18-L307 HydrophobicContact CD1-CD2 4.27Å; L18-L307 HydrophobicContact CD2-CD2 4.24Å; L26-L307 HydrophobicContact CD1-CD2 4.12Å; W303-L307 WeakPolarHBondContact O-CB 3.5Å; W303-L307 VanDerWaalsContact O-CG 3.22Å; W303-L307 WeakPolarHBondContact O-CG 3.28Å; W303-L307 PolarHBondContact O-N 2.9Å; E304-L307 PolarHBondContact O-N 3.29Å; R305-L307 VanDerWaalsContact C-N 3.31Å; R305-L307 PolarHBondContact O-N 2.82Å
308	Q	93.6	Very high	95.3	Very high	86 Å²	86	36.2 Å²	36.2	40%	0.402	18%	0.176	S	C	.	.	H	α-helix	trans	-84.9	-26	177.6	-63.2	-66.4	9.5	0	0	113.3	E304 R305 M315	E304-Q308 WeakPolarHBondContact O-CG 3.1Å; E304-Q308 PolarHBondContact O-N 3.42Å; R305-Q308 PolarHBondContact O-N 3.5Å; Q308-M315 HydrophobicContact CB-CB 4.22Å; Q308-M315 HydrophobicContact CB-SD 4.02Å; Q308-M315 HydrophobicContact CG-CG 4.47Å; Q308-M315 HydrophobicContact CG-SD 3.84Å
309	G	93.8	Very high	95.5	Very high	14 Å²	14	27.5 Å²	27.5	14%	0.144	14%	0.143	C	C	.	.			trans	108	174.2	178.3	0	0	0	0	0	114.3	R305	R305-G309 VanDerWaalsContact CD-O 3.28Å; R305-G309 WeakPolarHBondContact CD-O 3.46Å; R305-G309 CarbonylContact O-C 3.41Å; R305-G309 PolarHBondContact O-N 3.24Å; R305-G309 VanDerWaalsContact O-O 3.11Å
310	P	94.1	Very high	95.6	Very high	20 Å²	20	26.3 Å²	26.3	13%	0.13	14%	0.137	C	C	.	.	S	Bend	trans	-80.2	-17.4	-171	32.2	-38.2	0	0	0	114.8	Y30 Y33 D312	Y30-P310 HydrophobicContact CD1-CB 4.28Å; Y30-P310 HydrophobicContact CD2-CB 3.56Å; Y30-P310 HydrophobicContact CD2-CG 4.28Å; Y30-P310 HydrophobicContact CE1-CB 4.39Å; Y30-P310 HydrophobicContact CE2-CB 3.65Å; Y30-P310 HydrophobicContact CG-CB 3.89Å; Y33-P310 HydrophobicContact CD1-CB 3.53Å; Y33-P310 HydrophobicContact CD1-CG 3.76Å; Y33-P310 HydrophobicContact CD2-CG 3.99Å; Y33-P310 HydrophobicContact CE1-CB 4.2Å; Y33-P310 HydrophobicContact CG-CB 3.78Å; Y33-P310 HydrophobicContact CG-CG 3.43Å; Y33-P310 VanDerWaalsContact CG-CG 3.43Å; P310-D312 PolarHBondContact O-N 3.38Å
311	S	94.3	Very high	95.5	Very high	16 Å²	16	25.2 Å²	25.2	11%	0.112	13%	0.132	C	C	.	.			trans	-75.3	126.3	-173.7	-174.3	0	0	0	0	111.9	D313 I314 M315	S311-D313 PolarHBondContact O-N 2.88Å; S311-D313 WeakPolarHBondContact OG-CB 3.45Å; S311-D313 PolarHBondContact OG-N 2.9Å; S311-D313 VanDerWaalsContact OG-N 3.16Å; S311-I314 PolarHBondContact O-N 3.07Å; S311-M315 PolarHBondContact O-N 3.44Å
312	D	93.2	Very high	95.4	Very high	47 Å²	47	28.1 Å²	28.1	25%	0.251	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.7	170.6	-77.1	-24.1	0	0	0	112.6	N59 R305 P310 K316	N59-D312 PolarHBondContact ND2-OD2 3.4Å; R305-D312 IonicContact CZ-OD1 3.39Å; R305-D312 VanDerWaalsContact CZ-OD1 3.26Å; R305-D312 IonicContact NH1-OD1 3.91Å; R305-D312 PolarHBondContact NH1-OD1 3.06Å; R305-D312 IonicContact NH2-OD1 3.52Å; R305-D312 PolarHBondContact NH2-OD1 3.14Å; P310-D312 PolarHBondContact O-N 3.38Å; D312-K316 HydrophobicContact CB-CG 4.06Å; D312-K316 VanDerWaalsContact O-CE 3.26Å; D312-K316 WeakPolarHBondContact O-CE 2.83Å; D312-K316 WeakPolarHBondContact O-CG 3.33Å
313	D	93.1	Very high	95.2	Very high	126 Å²	126	36.2 Å²	36.2	67%	0.674	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-32.8	171.9	-60.8	-34.3	0	0	0	111.3	Q288 S311	Q288-D313 VanDerWaalsContact CB-O 3.28Å; Q288-D313 WeakPolarHBondContact CB-O 3.43Å; S311-D313 PolarHBondContact O-N 2.88Å; S311-D313 WeakPolarHBondContact OG-CB 3.45Å; S311-D313 PolarHBondContact OG-N 2.9Å; S311-D313 VanDerWaalsContact OG-N 3.16Å
314	I	94.6	Very high	95.1	Very high	60 Å²	60	37.2 Å²	37.2	31%	0.308	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-51.3	-176.7	-62.7	173.9	0	0	0	110.6	H287 Q288 S311	H287-I314 CarbonylContact C-O 3.57Å; H287-I314 WeakPolarHBondContact CA-O 3.39Å; H287-I314 PolarHBondContact CD2-O 2.64Å; Q288-I314 PolarHBondContact N-O 3.11Å; S311-I314 PolarHBondContact O-N 3.07Å
315	M	96	Very high	94.9	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.03	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	132.4	-179.8	-178.7	-128	56.2	0	0	109.9	C285 I286 R305 Q308 S311 I317	C285-M315 HydrophobicContact CB-CG 4.27Å; C285-M315 HydrophobicContact CB-SD 4.12Å; I286-M315 CarbonylContact O-C 3.59Å; I286-M315 VanDerWaalsContact O-CA 3.32Å; I286-M315 WeakPolarHBondContact O-CA 3.02Å; R305-M315 PolarHBondContact NH1-O 3.32Å; Q308-M315 HydrophobicContact CB-CB 4.22Å; Q308-M315 HydrophobicContact CB-SD 4.02Å; Q308-M315 HydrophobicContact CG-CG 4.47Å; Q308-M315 HydrophobicContact CG-SD 3.84Å; S311-M315 PolarHBondContact O-N 3.44Å; M315-I317 HydrophobicContact CE-CD1 4.16Å; M315-I317 HydrophobicContact CE-CG1 3.62Å; M315-I317 HydrophobicContact SD-CG1 4.2Å
316	K	96.9	Very high	94.9	Very high	51 Å²	51	49.5 Å²	49.5	22%	0.222	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	148.1	170.6	-67.6	-177	175.2	-179.4	0	110.1	D248 C285 I286 D312 F318	D248-K316 IonicContact OD1-NZ 2.81Å; D248-K316 PolarHBondContact OD1-NZ 3.37Å; D248-K316 IonicContact OD2-NZ 3.95Å; D248-K316 PolarHBondContact OD2-NZ 3.43Å; C285-K316 WeakPolarHBondContact CA-O 3.35Å; I286-K316 PolarHBondContact N-O 3.33Å; I286-K316 PolarHBondContact O-N 3.18Å; D312-K316 HydrophobicContact CB-CG 4.06Å; D312-K316 VanDerWaalsContact O-CE 3.26Å; D312-K316 WeakPolarHBondContact O-CE 2.83Å; D312-K316 WeakPolarHBondContact O-CG 3.33Å; K316-F318 HydrophobicContact CB-CD2 3.98Å; K316-F318 HydrophobicContact CB-CE2 3.44Å; K316-F318 VanDerWaalsContact CB-CE2 3.44Å; K316-F318 HydrophobicContact CB-CZ 4.29Å; K316-F318 HydrophobicContact CD-CE2 3.96Å; K316-F318 HydrophobicContact CD-CZ 4.02Å; K316-F318 HydrophobicContact CG-CE2 4.34Å
317	I	98	Very high	94.9	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.2	171	-55.9	-168.3	0	0	0	107.9	L58 I60 S61 L283 Y284 R305 M315	L58-I317 HydrophobicContact CD1-CD1 4.01Å; L58-I317 HydrophobicContact CD2-CD1 4.16Å; I60-I317 CarbonylContact C-O 3.59Å; I60-I317 WeakPolarHBondContact CA-O 3.32Å; S61-I317 PolarHBondContact N-O 3.21Å; L283-I317 HydrophobicContact CB-CG2 4.23Å; L283-I317 HydrophobicContact CD1-CG2 4.34Å; L283-I317 HydrophobicContact CD2-CG2 4.29Å; Y284-I317 CarbonylContact O-C 3.55Å; Y284-I317 WeakPolarHBondContact O-CA 3.41Å; R305-I317 HydrophobicContact CB-CD1 4.28Å; M315-I317 HydrophobicContact CE-CD1 4.16Å; M315-I317 HydrophobicContact CE-CG1 3.62Å; M315-I317 HydrophobicContact SD-CG1 4.2Å
318	F	98	Very high	94.9	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.1	179.6	-75.4	-99	0	0	0	111.3	S61 F247 D248 L283 Y284 I286 K316 M320	S61-F318 CarbonylContact O-C 3.6Å; S61-F318 WeakPolarHBondContact O-CA 3.49Å; F247-F318 HydrophobicContact CZ-CE1 4.26Å; D248-F318 HydrophobicContact CB-CE1 4.4Å; D248-F318 WeakPolarHBondContact OD1-CZ 3.44Å; L283-F318 CarbonylContact C-O 3.51Å; L283-F318 VanDerWaalsContact CA-O 3.29Å; L283-F318 WeakPolarHBondContact CA-O 3.42Å; Y284-F318 PolarHBondContact N-O 3.33Å; Y284-F318 PolarHBondContact O-N 3.39Å; I286-F318 HydrophobicContact CB-CD2 4.17Å; I286-F318 HydrophobicContact CB-CE2 4.12Å; I286-F318 HydrophobicContact CD1-CD2 3.57Å; I286-F318 HydrophobicContact CD1-CE2 3.74Å; I286-F318 HydrophobicContact CD1-CG 4.18Å; I286-F318 HydrophobicContact CD1-CZ 4.49Å; I286-F318 HydrophobicContact CG1-CD2 3.83Å; I286-F318 HydrophobicContact CG1-CE2 4.16Å; K316-F318 HydrophobicContact CB-CD2 3.98Å; K316-F318 HydrophobicContact CB-CE2 3.44Å; K316-F318 VanDerWaalsContact CB-CE2 3.44Å; K316-F318 HydrophobicContact CB-CZ 4.29Å; K316-F318 HydrophobicContact CD-CE2 3.96Å; K316-F318 HydrophobicContact CD-CZ 4.02Å; K316-F318 HydrophobicContact CG-CE2 4.34Å; F318-M320 HydrophobicContact CB-CE 3.88Å; F318-M320 HydrophobicContact CB-CG 3.81Å; F318-M320 HydrophobicContact CB-SD 4.21Å; F318-M320 HydrophobicContact CD1-CE 4.04Å; F318-M320 HydrophobicContact CG-CE 3.96Å
319	L	97.7	Very high	94.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	118	158.9	-173.3	78.8	0	0	0	108.4	I60 S61 W62 G63 V64 I265 L268 L269 F281 L283	I60-L319 HydrophobicContact CG2-CB 4.12Å; S61-L319 PolarHBondContact O-N 3.34Å; W62-L319 HydrophobicContact CE3-CD2 3.92Å; W62-L319 HydrophobicContact CH2-CD2 4.26Å; W62-L319 HydrophobicContact CZ3-CD2 3.45Å; W62-L319 VanDerWaalsContact CZ3-CD2 3.45Å; G63-L319 CarbonylContact C-O 3.23Å; G63-L319 WeakPolarHBondContact CA-O 3.43Å; G63-L319 PolarHBondContact N-O 3.44Å; V64-L319 HydrophobicContact CG2-CD2 4.18Å; V64-L319 HydrophobicContact CG2-CG 4.29Å; V64-L319 WeakPolarHBondContact CG2-O 3.34Å; V64-L319 PolarHBondContact N-O 3.45Å; I265-L319 HydrophobicContact CG1-CD1 3.95Å; I265-L319 HydrophobicContact CG2-CD1 4.09Å; L268-L319 HydrophobicContact CD2-CB 4.1Å; L268-L319 HydrophobicContact CD2-CD1 4.41Å; L268-L319 HydrophobicContact CD2-CD2 3.88Å; L268-L319 HydrophobicContact CD2-CG 4.36Å; L269-L319 HydrophobicContact CD2-CD2 4.14Å; F281-L319 HydrophobicContact CB-CD1 3.78Å; F281-L319 HydrophobicContact CB-CG 4.27Å; F281-L319 HydrophobicContact CD1-CD2 4.17Å; F281-L319 HydrophobicContact CD1-CG 4.26Å; F281-L319 HydrophobicContact CG-CD1 4.37Å; F281-L319 HydrophobicContact CG-CD2 4.46Å; F281-L319 HydrophobicContact CG-CG 4.48Å; L283-L319 HydrophobicContact CD2-CB 4.27Å; L283-L319 HydrophobicContact CD2-CD1 3.84Å
320	M	97.1	Very high	94.6	Very high	7 Å²	7	56.5 Å²	56.5	3%	0.034	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	174.7	179.9	-56.7	-174.3	148	0	0	110.9	F247 F281 A282 Y284 I286 K292 F318 E324	F247-M320 HydrophobicContact CE2-CE 4.43Å; F281-M320 VanDerWaalsContact CA-O 3.3Å; F281-M320 WeakPolarHBondContact CA-O 3.22Å; A282-M320 PolarHBondContact N-O 2.83Å; A282-M320 PolarHBondContact O-N 3.28Å; Y284-M320 HydrophobicContact CD2-CB 3.63Å; Y284-M320 HydrophobicContact CD2-CG 3.99Å; Y284-M320 HydrophobicContact CD2-SD 4.06Å; Y284-M320 HydrophobicContact CE2-CB 3.84Å; Y284-M320 HydrophobicContact CG-SD 4.04Å; I286-M320 HydrophobicContact CD1-CE 3.68Å; K292-M320 HydrophobicContact CD-SD 4.45Å; F318-M320 HydrophobicContact CB-CE 3.88Å; F318-M320 HydrophobicContact CB-CG 3.81Å; F318-M320 HydrophobicContact CB-SD 4.21Å; F318-M320 HydrophobicContact CD1-CE 4.04Å; F318-M320 HydrophobicContact CG-CE 3.96Å; M320-E324 HydrophobicContact CB-CB 4.43Å; M320-E324 HydrophobicContact SD-CG 4.06Å
321	D	95.4	Very high	94.5	Very high	26 Å²	26	59 Å²	59	14%	0.139	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	143.6	174	-65.7	-42.2	0	0	0	111	V64 R65 R66 Y284 H323 E324	V64-D321 WeakPolarHBondContact CG1-OD1 3.41Å; R65-D321 PolarHBondContact N-OD2 3.2Å; R66-D321 WeakPolarHBondContact CD-OD1 3.45Å; R66-D321 VanDerWaalsContact CG-OD1 3.26Å; R66-D321 WeakPolarHBondContact CG-OD1 3.5Å; R66-D321 IonicContact CZ-OD1 3.94Å; R66-D321 PolarHBondContact N-OD2 3.48Å; R66-D321 IonicContact NE-OD1 2.95Å; R66-D321 PolarHBondContact NE-OD1 3.08Å; Y284-D321 PolarHBondContact OH-O 3.41Å; D321-H323 PolarHBondContact O-N 3.23Å; D321-E324 PolarHBondContact O-N 2.98Å; D321-E324 VanDerWaalsContact O-N 3.15Å
322	M	93.6	Very high	94.4	Very high	62 Å²	62	58.3 Å²	58.3	31%	0.305	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.7	-172.3	177.4	-174.5	-105.6	0	0	114.4	Q279 E280 Y284 K294	Q279-M322 HydrophobicContact CB-CE 4.26Å; Q279-M322 WeakPolarHBondContact O-CE 3.47Å; Q279-M322 VanDerWaalsContact O-SD 3.37Å; E280-M322 PolarHBondContact O-N 3.25Å; Y284-M322 PolarHBondContact OH-O 2.93Å; K294-M322 PolarHBondContact NZ-O 3.37Å
323	H	92.1	Very high	94.2	Very high	171 Å²	171	61.2 Å²	61.2	79%	0.792	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	24	-173.7	-56.5	-57.1	0	0	0	113.1	D321	D321-H323 PolarHBondContact O-N 3.23Å
324	E	93.8	Very high	94	Very high	30 Å²	30	59.9 Å²	59.9	14%	0.14	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-65.7	137.7	171.6	-171.9	70	-162.5	0	0	110	R65 Y284 K292 M320 D321	R65-E324 IonicContact CZ-OE1 3.74Å; R65-E324 IonicContact CZ-OE2 3.35Å; R65-E324 IonicContact NH1-OE1 2.57Å; R65-E324 PolarHBondContact NH1-OE1 3.06Å; R65-E324 IonicContact NH1-OE2 3.38Å; R65-E324 IonicContact NH2-OE1 3.95Å; R65-E324 PolarHBondContact NH2-OE1 3.27Å; R65-E324 IonicContact NH2-OE2 3.26Å; Y284-E324 HydrophobicContact CE1-CB 4.28Å; Y284-E324 HydrophobicContact CE2-CB 4.15Å; Y284-E324 PolarHBondContact OH-N 2.84Å; Y284-E324 PolarHBondContact OH-O 3.21Å; K292-E324 HydrophobicContact CD-CG 4.43Å; K292-E324 IonicContact NZ-OE1 2.76Å; K292-E324 PolarHBondContact NZ-OE1 2.87Å; M320-E324 HydrophobicContact CB-CB 4.43Å; M320-E324 HydrophobicContact SD-CG 4.06Å; D321-E324 PolarHBondContact O-N 2.98Å; D321-E324 VanDerWaalsContact O-N 3.15Å
325	E	92.9	Very high	93.7	Very high	157 Å²	157	61.7 Å²	61.7	73%	0.734	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-59.4	141.9	-176.9	-66.8	178	172.6	0	0	111.5	K292	K292-E325 WeakPolarHBondContact CD-O 3.44Å; K292-E325 WeakPolarHBondContact CE-O 3.3Å; K292-E325 PolarHBondContact NZ-O 3.48Å
326	E	95	Very high	93.1	Very high	113 Å²	113	67.9 Å²	67.9	53%	0.528	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-93.4	145.3	172.8	-68.8	-173.9	-130.8	0	0	110.3	Y284 K292 K294	Y284-E326 HydrophobicContact CE1-CG 4.03Å; K292-E326 WeakPolarHBondContact O-CA 3.37Å; K294-E326 HydrophobicContact CB-CG 3.98Å; K294-E326 WeakPolarHBondContact CB-OE1 3.4Å; K294-E326 PolarHBondContact N-OE2 3.23Å
327	V	95	Very high	92.7	Very high	25 Å²	25	68.4 Å²	68.4	15%	0.152	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-118.6	114.2	175	-178.7	0	0	0	0	107.4	E291 K292 V331 A332 L335	E291-V327 WeakPolarHBondContact CG-O 3.02Å; K292-V327 HydrophobicContact CB-CB 4.04Å; K292-V327 HydrophobicContact CB-CG2 4.25Å; K292-V327 PolarHBondContact N-O 2.95Å; K292-V327 PolarHBondContact O-N 2.92Å; V327-V331 HydrophobicContact CG1-CB 4.09Å; V327-V331 HydrophobicContact CG1-CG1 4Å; V327-A332 HydrophobicContact CG1-CB 4.08Å; V327-L335 HydrophobicContact CG1-CD1 3.94Å
328	S	94.1	Very high	92.4	Very high	61 Å²	61	74.9 Å²	74.9	43%	0.427	38%	0.376	S	S	.	.			trans	-69.4	159.6	176	63.8	0	0	0	0	111.5	D330 V331 A332	S328-D330 VanDerWaalsContact C-N 3.28Å; S328-D330 PolarHBondContact O-N 2.92Å; S328-V331 PolarHBondContact O-N 3.34Å; S328-V331 VanDerWaalsContact O-N 3.11Å; S328-V331 VanDerWaalsContact OG-CG2 3.3Å; S328-V331 WeakPolarHBondContact OG-CG2 3.43Å; S328-V331 PolarHBondContact OG-N 2.85Å; S328-A332 WeakPolarHBondContact O-CB 3.22Å; S328-A332 PolarHBondContact O-N 2.97Å
329	N	92.4	Very high	92.1	Very high	84 Å²	84	80.8 Å²	80.8	45%	0.449	41%	0.407	S	S	.	.	H	α-helix	trans	-55.7	-42.6	177.4	-165.9	-94.8	0	0	0	112.6	E291 V331 A332 Q333	E291-N329 HydrophobicContact CG-CB 4.42Å; E291-N329 PolarHBondContact OE2-ND2 3.15Å; N329-V331 VanDerWaalsContact C-N 3.3Å; N329-V331 PolarHBondContact O-N 3.22Å; N329-A332 WeakPolarHBondContact O-CB 3.46Å; N329-A332 PolarHBondContact O-N 3.16Å; N329-Q333 PolarHBondContact O-N 3.11Å
330	D	90.2	Very high	91.9	Very high	115 Å²	115	85 Å²	85	62%	0.615	44%	0.435	S	S	*	.	H	α-helix	trans	-65.7	-30.9	178.7	-60.1	-28.2	0	0	0	112.9	S328 Q333 Y334	S328-D330 VanDerWaalsContact C-N 3.28Å; S328-D330 PolarHBondContact O-N 2.92Å; D330-Q333 VanDerWaalsContact O-CD 3.31Å; D330-Q333 VanDerWaalsContact O-CG 3.22Å; D330-Q333 WeakPolarHBondContact O-CG 3.41Å; D330-Q333 PolarHBondContact O-NE2 2.82Å; D330-Y334 WeakPolarHBondContact O-CD2 3.32Å; D330-Y334 WeakPolarHBondContact O-CE2 3.1Å
331	V	91.6	Very high	91.8	Very high	74 Å²	74	87.8 Å²	87.8	45%	0.448	45%	0.449	S	S	.	.	H	α-helix	trans	-80.8	-36	176.3	175.5	0	0	0	0	110.6	V327 S328 N329 Q333 Y334	V327-V331 HydrophobicContact CG1-CB 4.09Å; V327-V331 HydrophobicContact CG1-CG1 4Å; S328-V331 PolarHBondContact O-N 3.34Å; S328-V331 VanDerWaalsContact O-N 3.11Å; S328-V331 VanDerWaalsContact OG-CG2 3.3Å; S328-V331 WeakPolarHBondContact OG-CG2 3.43Å; S328-V331 PolarHBondContact OG-N 2.85Å; N329-V331 VanDerWaalsContact C-N 3.3Å; N329-V331 PolarHBondContact O-N 3.22Å; V331-Q333 PolarHBondContact O-N 2.97Å; V331-Y334 WeakPolarHBondContact O-CB 3.22Å; V331-Y334 PolarHBondContact O-N 3.47Å
332	A	92.3	Very high	91.7	Very high	0 Å²	0	88.7 Å²	88.7	0%	0	45%	0.453	C	S	.	.	H	α-helix	trans	-57	-35.7	-177.1	0	0	0	0	0	113	S289 G290 E291 V327 S328 N329 Y334 L335	S289-A332 WeakPolarHBondContact O-CB 3.47Å; G290-A332 VanDerWaalsContact C-CB 3.49Å; E291-A332 HydrophobicContact CB-CB 4.2Å; E291-A332 VanDerWaalsContact N-CB 3.32Å; V327-A332 HydrophobicContact CG1-CB 4.08Å; S328-A332 WeakPolarHBondContact O-CB 3.22Å; S328-A332 PolarHBondContact O-N 2.97Å; N329-A332 WeakPolarHBondContact O-CB 3.46Å; N329-A332 PolarHBondContact O-N 3.16Å; A332-Y334 PolarHBondContact O-N 2.87Å; A332-Y334 VanDerWaalsContact O-N 3.08Å; A332-L335 WeakPolarHBondContact O-CB 3.42Å; A332-L335 PolarHBondContact O-N 3.45Å
333	Q	88.7	Confident	91.7	Very high	108 Å²	108	90.7 Å²	90.7	51%	0.505	47%	0.465	S	S	.	.	H	α-helix	trans	-58.8	-24	177.4	77.2	-167.2	-1.9	0	0	113.7	N329 D330 V331	N329-Q333 PolarHBondContact O-N 3.11Å; D330-Q333 VanDerWaalsContact O-CD 3.31Å; D330-Q333 VanDerWaalsContact O-CG 3.22Å; D330-Q333 WeakPolarHBondContact O-CG 3.41Å; D330-Q333 PolarHBondContact O-NE2 2.82Å; V331-Q333 PolarHBondContact O-N 2.97Å
334	Y	89.5	Confident	91.8	Very high	98 Å²	98	88 Å²	88	38%	0.384	45%	0.453	S	S	.	.	H	α-helix	trans	-92.1	-15.2	-179.1	-58.2	-72.4	0	0	0	113.3	D330 V331 A332 N336 L337	D330-Y334 WeakPolarHBondContact O-CD2 3.32Å; D330-Y334 WeakPolarHBondContact O-CE2 3.1Å; V331-Y334 WeakPolarHBondContact O-CB 3.22Å; V331-Y334 PolarHBondContact O-N 3.47Å; A332-Y334 PolarHBondContact O-N 2.87Å; A332-Y334 VanDerWaalsContact O-N 3.08Å; Y334-N336 PolarHBondContact O-N 3.48Å; Y334-L337 HydrophobicContact CD1-CD1 3.8Å; Y334-L337 WeakPolarHBondContact O-CB 3.43Å; Y334-L337 PolarHBondContact O-N 2.87Å; Y334-L337 VanDerWaalsContact O-N 3.11Å
335	L	87.4	Confident	91.8	Very high	99 Å²	99	90.8 Å²	90.8	52%	0.518	47%	0.465	S	S	.	.	H	α-helix	trans	-62.8	-27.5	-177.2	-70.2	-179.3	0	0	0	113.2	V327 A332 L337	V327-L335 HydrophobicContact CG1-CD1 3.94Å; A332-L335 WeakPolarHBondContact O-CB 3.42Å; A332-L335 PolarHBondContact O-N 3.45Å; L335-L337 VanDerWaalsContact C-N 3.31Å
336	N	83.6	Confident	91.9	Very high	135 Å²	135	88.2 Å²	88.2	72%	0.722	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	5.5	-179	-63.6	-34	0	0	0	113.2	Y334	Y334-N336 PolarHBondContact O-N 3.48Å
337	L	88.9	Confident	91.9	Very high	63 Å²	63	87.3 Å²	87.3	33%	0.33	45%	0.454	S	S	.	.	S	Bend	trans	-96.6	150.3	179.6	-57.9	177.2	0	0	0	111.3	Y334 L335 L342 F345	Y334-L337 HydrophobicContact CD1-CD1 3.8Å; Y334-L337 WeakPolarHBondContact O-CB 3.43Å; Y334-L337 PolarHBondContact O-N 2.87Å; Y334-L337 VanDerWaalsContact O-N 3.11Å; L335-L337 VanDerWaalsContact C-N 3.31Å; L337-L342 HydrophobicContact CB-CD1 4.33Å; L337-L342 HydrophobicContact CB-CG 4.22Å; L337-L342 WeakPolarHBondContact O-CD1 3.38Å; L337-F345 HydrophobicContact CD1-CD2 4.4Å; L337-F345 HydrophobicContact CD1-CE2 3.84Å
338	E	91	Very high	92	Very high	136 Å²	136	91.7 Å²	91.7	64%	0.636	47%	0.471	S	S	*	.			trans	-71.1	145.2	176.5	-58.5	-175.9	174.5	0	0	111.5	P340 I341 L342	E338-P340 VanDerWaalsContact C-N 3.33Å; E338-I341 HydrophobicContact CB-CD1 4.27Å; E338-I341 HydrophobicContact CB-CG1 4.44Å; E338-I341 WeakPolarHBondContact O-CB 3.42Å; E338-I341 PolarHBondContact O-N 2.89Å; E338-L342 PolarHBondContact O-N 3.25Å; E338-L342 VanDerWaalsContact O-N 3.14Å
339	L	91.6	Very high	92.1	Very high	133 Å²	133	94.1 Å²	94.1	70%	0.696	48%	0.479	S	S	*	.	H	α-helix	trans	-49.9	-41.5	179.3	-68	174	0	0	0	114.4	I341 L342 D343	L339-I341 VanDerWaalsContact C-N 3.28Å; L339-I341 PolarHBondContact O-N 3.35Å; L339-L342 HydrophobicContact CD2-CD1 4.22Å; L339-L342 WeakPolarHBondContact O-CB 3.41Å; L339-L342 PolarHBondContact O-N 3.13Å; L339-D343 PolarHBondContact O-N 3.38Å
340	P	93.9	Very high	92.3	Very high	88 Å²	88	98 Å²	98	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-63.7	-32.8	178.2	-22.4	34.9	0	0	0	113.6	E338 Q344	E338-P340 VanDerWaalsContact C-N 3.33Å; P340-Q344 PolarHBondContact O-N 2.91Å; P340-Q344 VanDerWaalsContact O-N 3.15Å
341	I	94.1	Very high	92.7	Very high	65 Å²	65	98.2 Å²	98.2	33%	0.333	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-42.7	177.9	-59.7	174.6	0	0	0	109.3	E338 L339 Q344 F345	E338-I341 HydrophobicContact CB-CD1 4.27Å; E338-I341 HydrophobicContact CB-CG1 4.44Å; E338-I341 WeakPolarHBondContact O-CB 3.42Å; E338-I341 PolarHBondContact O-N 2.89Å; L339-I341 VanDerWaalsContact C-N 3.28Å; L339-I341 PolarHBondContact O-N 3.35Å; I341-Q344 WeakPolarHBondContact O-CB 3.29Å; I341-Q344 PolarHBondContact O-N 3.41Å; I341-F345 HydrophobicContact CG2-CD2 3.93Å; I341-F345 HydrophobicContact CG2-CE2 3.43Å; I341-F345 VanDerWaalsContact CG2-CE2 3.43Å; I341-F345 HydrophobicContact CG2-CZ 4.07Å; I341-F345 VanDerWaalsContact O-CD2 3.29Å; I341-F345 WeakPolarHBondContact O-CD2 3.44Å; I341-F345 PolarHBondContact O-N 3.22Å
342	L	93.1	Very high	93	Very high	45 Å²	45	98.6 Å²	98.6	24%	0.236	48%	0.481	C	S	.	.	H	α-helix	trans	-59	-45	174.3	-73.7	148.8	0	0	0	111.6	L337 E338 L339 Q344 F345 L346	L337-L342 HydrophobicContact CB-CD1 4.33Å; L337-L342 HydrophobicContact CB-CG 4.22Å; L337-L342 WeakPolarHBondContact O-CD1 3.38Å; E338-L342 PolarHBondContact O-N 3.25Å; E338-L342 VanDerWaalsContact O-N 3.14Å; L339-L342 HydrophobicContact CD2-CD1 4.22Å; L339-L342 WeakPolarHBondContact O-CB 3.41Å; L339-L342 PolarHBondContact O-N 3.13Å; L342-Q344 VanDerWaalsContact C-N 3.29Å; L342-Q344 PolarHBondContact O-N 2.97Å; L342-F345 WeakPolarHBondContact O-CB 3.47Å; L342-F345 PolarHBondContact O-N 3.32Å; L342-F345 VanDerWaalsContact O-N 3.13Å; L342-L346 WeakPolarHBondContact O-CG 3.31Å; L342-L346 PolarHBondContact O-N 2.88Å
343	D	94.1	Very high	93.2	Very high	104 Å²	104	104.5 Å²	104.5	56%	0.556	51%	0.509	S	S	*	.	H	α-helix	trans	-59.6	-41.1	176	-76.4	-25	0	0	0	111.7	L339 L346 L347	L339-D343 PolarHBondContact O-N 3.38Å; D343-L346 PolarHBondContact O-N 3.35Å; D343-L347 WeakPolarHBondContact O-CB 3.45Å; D343-L347 PolarHBondContact O-N 2.87Å
344	Q	94.9	Very high	93.6	Very high	115 Å²	115	103.3 Å²	103.3	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-65.2	-39.5	175.8	-166.6	-177.9	32.9	0	0	111.9	P340 I341 L342 L347 K348	P340-Q344 PolarHBondContact O-N 2.91Å; P340-Q344 VanDerWaalsContact O-N 3.15Å; I341-Q344 WeakPolarHBondContact O-CB 3.29Å; I341-Q344 PolarHBondContact O-N 3.41Å; L342-Q344 VanDerWaalsContact C-N 3.29Å; L342-Q344 PolarHBondContact O-N 2.97Å; Q344-L347 PolarHBondContact O-N 3.23Å; Q344-K348 PolarHBondContact O-N 3.14Å
345	F	93.6	Very high	94	Very high	89 Å²	89	105.1 Å²	105.1	39%	0.39	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-45	173.8	-73.3	-48.5	0	0	0	111.8	L337 I341 L342 L347 K348 L349	L337-F345 HydrophobicContact CD1-CD2 4.4Å; L337-F345 HydrophobicContact CD1-CE2 3.84Å; I341-F345 HydrophobicContact CG2-CD2 3.93Å; I341-F345 HydrophobicContact CG2-CE2 3.43Å; I341-F345 VanDerWaalsContact CG2-CE2 3.43Å; I341-F345 HydrophobicContact CG2-CZ 4.07Å; I341-F345 VanDerWaalsContact O-CD2 3.29Å; I341-F345 WeakPolarHBondContact O-CD2 3.44Å; I341-F345 PolarHBondContact O-N 3.22Å; L342-F345 WeakPolarHBondContact O-CB 3.47Å; L342-F345 PolarHBondContact O-N 3.32Å; L342-F345 VanDerWaalsContact O-N 3.13Å; F345-L347 VanDerWaalsContact C-N 3.3Å; F345-L347 PolarHBondContact O-N 2.98Å; F345-K348 PolarHBondContact O-N 3.16Å; F345-L349 WeakPolarHBondContact O-CB 3.38Å; F345-L349 VanDerWaalsContact O-CG 3.31Å; F345-L349 WeakPolarHBondContact O-CG 3.31Å; F345-L349 PolarHBondContact O-N 2.93Å
346	L	94.4	Very high	94.5	Very high	103 Å²	103	104.7 Å²	104.7	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-40.5	176.7	-71.4	176.4	0	0	0	112	L342 D343 L349 R350	L342-L346 WeakPolarHBondContact O-CG 3.31Å; L342-L346 PolarHBondContact O-N 2.88Å; D343-L346 PolarHBondContact O-N 3.35Å; L346-L349 PolarHBondContact O-N 2.57Å; L346-R350 WeakPolarHBondContact O-CB 3.33Å; L346-R350 PolarHBondContact O-N 2.57Å
347	L	96.5	Very high	95.2	Very high	93 Å²	93	101.8 Å²	101.8	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-61.9	-49.3	175.7	-169.6	158.6	0	0	0	110.8	D343 Q344 F345 L349 R350 E351	D343-L347 WeakPolarHBondContact O-CB 3.45Å; D343-L347 PolarHBondContact O-N 2.87Å; Q344-L347 PolarHBondContact O-N 3.23Å; F345-L347 VanDerWaalsContact C-N 3.3Å; F345-L347 PolarHBondContact O-N 2.98Å; L347-L349 PolarHBondContact O-N 3.32Å; L347-R350 WeakPolarHBondContact O-CB 3.39Å; L347-R350 PolarHBondContact O-N 3.32Å; L347-E351 HydrophobicContact CD2-CG 4.12Å; L347-E351 WeakPolarHBondContact CD2-OE1 3.48Å; L347-E351 PolarHBondContact O-N 2.97Å
348	K	96.3	Very high	95.6	Very high	118 Å²	118	103.8 Å²	103.8	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-41	178.3	-76.4	-172.2	176.9	-179.5	0	112.9	Q344 F345 R350 E351 E352	Q344-K348 PolarHBondContact O-N 3.14Å; F345-K348 PolarHBondContact O-N 3.16Å; K348-R350 VanDerWaalsContact C-N 3.32Å; K348-R350 PolarHBondContact O-N 3.33Å; K348-E351 PolarHBondContact O-N 2.99Å; K348-E352 WeakPolarHBondContact O-CB 3.44Å; K348-E352 PolarHBondContact O-N 3.23Å
349	L	96.1	Very high	95.9	Very high	112 Å²	112	102.8 Å²	102.8	59%	0.586	49%	0.489	S	S	*	.	H	α-helix	trans	-63	-40.7	176.6	-73.2	172.2	0	0	0	111.3	F345 L346 L347 E352 E353	F345-L349 WeakPolarHBondContact O-CB 3.38Å; F345-L349 VanDerWaalsContact O-CG 3.31Å; F345-L349 WeakPolarHBondContact O-CG 3.31Å; F345-L349 PolarHBondContact O-N 2.93Å; L346-L349 PolarHBondContact O-N 2.57Å; L347-L349 PolarHBondContact O-N 3.32Å; L349-E352 PolarHBondContact O-N 2.63Å; L349-E353 WeakPolarHBondContact O-CB 3.5Å; L349-E353 PolarHBondContact O-N 3.15Å
350	R	97.4	Very high	96.3	Very high	166 Å²	166	100.5 Å²	100.5	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-63.7	-41.8	175.5	-175	-174.9	-61.3	178.1	2.4	112.2	L346 L347 K348 N354	L346-R350 WeakPolarHBondContact O-CB 3.33Å; L346-R350 PolarHBondContact O-N 2.57Å; L347-R350 WeakPolarHBondContact O-CB 3.39Å; L347-R350 PolarHBondContact O-N 3.32Å; K348-R350 VanDerWaalsContact C-N 3.32Å; K348-R350 PolarHBondContact O-N 3.33Å; R350-N354 WeakPolarHBondContact O-CB 3.46Å; R350-N354 VanDerWaalsContact O-CG 3.26Å; R350-N354 PolarHBondContact O-N 3.37Å; R350-N354 PolarHBondContact O-ND2 3.49Å; R350-N354 VanDerWaalsContact O-ND2 3.1Å
351	E	97.3	Very high	96.4	Very high	119 Å²	119	99.4 Å²	99.4	56%	0.556	47%	0.469	S	S	*	.	H	α-helix	trans	-62.9	-43	175.5	-73.1	179.1	170.7	0	0	111.8	L347 K348 N354 R355	L347-E351 HydrophobicContact CD2-CG 4.12Å; L347-E351 WeakPolarHBondContact CD2-OE1 3.48Å; L347-E351 PolarHBondContact O-N 2.97Å; K348-E351 PolarHBondContact O-N 2.99Å; E351-N354 PolarHBondContact O-N 2.93Å; E351-R355 WeakPolarHBondContact O-CB 3.43Å; E351-R355 PolarHBondContact O-N 2.97Å
352	E	97.4	Very high	96.6	Very high	81 Å²	81	100.5 Å²	100.5	38%	0.379	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-47.9	176.9	-167.7	63.7	-136.5	0	0	111.9	K348 L349 N354 R355 E356	K348-E352 WeakPolarHBondContact O-CB 3.44Å; K348-E352 PolarHBondContact O-N 3.23Å; L349-E352 PolarHBondContact O-N 2.63Å; E352-N354 PolarHBondContact O-N 3.49Å; E352-R355 WeakPolarHBondContact O-CB 3.45Å; E352-R355 PolarHBondContact O-N 3.16Å; E352-R355 VanDerWaalsContact O-N 3.16Å; E352-R355 IonicContact OE1-CZ 2.63Å; E352-R355 VanDerWaalsContact OE1-CZ 3.25Å; E352-R355 IonicContact OE1-NE 3.25Å; E352-R355 PolarHBondContact OE1-NE 3.42Å; E352-R355 IonicContact OE1-NH2 2.57Å; E352-R355 PolarHBondContact OE1-NH2 3.01Å; E352-R355 IonicContact OE2-CZ 3.14Å; E352-R355 IonicContact OE2-NE 3.86Å; E352-R355 IonicContact OE2-NH1 3.63Å; E352-R355 IonicContact OE2-NH2 2.74Å; E352-R355 PolarHBondContact OE2-NH2 3.49Å; E352-E356 PolarHBondContact O-N 2.98Å
353	E	97.6	Very high	96.8	Very high	124 Å²	124	105 Å²	105	58%	0.579	49%	0.493	S	S	*	.	H	α-helix	trans	-58.8	-47.2	177.5	-177.1	179.2	-149	0	0	110.8	L349 R355 E356 I357	L349-E353 WeakPolarHBondContact O-CB 3.5Å; L349-E353 PolarHBondContact O-N 3.15Å; E353-R355 VanDerWaalsContact C-N 3.29Å; E353-R355 PolarHBondContact O-N 2.82Å; E353-E356 PolarHBondContact O-N 2.86Å; E353-E356 VanDerWaalsContact O-N 3.16Å; E353-I357 HydrophobicContact CG-CD1 3.97Å; E353-I357 VanDerWaalsContact O-CG1 3.31Å; E353-I357 WeakPolarHBondContact O-CG1 3.39Å; E353-I357 PolarHBondContact O-N 3.07Å
354	N	97.9	Very high	97	Very high	83 Å²	83	107 Å²	107	44%	0.444	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-40.1	176.5	-78.7	-34.9	0	0	0	112	R350 E351 E352 I357 Q358	R350-N354 WeakPolarHBondContact O-CB 3.46Å; R350-N354 VanDerWaalsContact O-CG 3.26Å; R350-N354 PolarHBondContact O-N 3.37Å; R350-N354 PolarHBondContact O-ND2 3.49Å; R350-N354 VanDerWaalsContact O-ND2 3.1Å; E351-N354 PolarHBondContact O-N 2.93Å; E352-N354 PolarHBondContact O-N 3.49Å; N354-I357 PolarHBondContact O-N 3.25Å; N354-Q358 VanDerWaalsContact O-CG 3.32Å; N354-Q358 WeakPolarHBondContact O-CG 3.45Å; N354-Q358 PolarHBondContact O-N 3.37Å
355	R	97.8	Very high	97.1	Very high	136 Å²	136	106 Å²	106	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-40.4	176.7	-174.8	172.1	66.3	-158.6	19.1	111.8	E351 E352 E353 Q358 R359	E351-R355 WeakPolarHBondContact O-CB 3.43Å; E351-R355 PolarHBondContact O-N 2.97Å; E352-R355 WeakPolarHBondContact O-CB 3.45Å; E352-R355 PolarHBondContact O-N 3.16Å; E352-R355 VanDerWaalsContact O-N 3.16Å; E352-R355 IonicContact OE1-CZ 2.63Å; E352-R355 VanDerWaalsContact OE1-CZ 3.25Å; E352-R355 IonicContact OE1-NE 3.25Å; E352-R355 PolarHBondContact OE1-NE 3.42Å; E352-R355 IonicContact OE1-NH2 2.57Å; E352-R355 PolarHBondContact OE1-NH2 3.01Å; E352-R355 IonicContact OE2-CZ 3.14Å; E352-R355 IonicContact OE2-NE 3.86Å; E352-R355 IonicContact OE2-NH1 3.63Å; E352-R355 IonicContact OE2-NH2 2.74Å; E352-R355 PolarHBondContact OE2-NH2 3.49Å; E353-R355 VanDerWaalsContact C-N 3.29Å; E353-R355 PolarHBondContact O-N 2.82Å; R355-Q358 PolarHBondContact O-N 3.02Å; R355-R359 WeakPolarHBondContact O-CB 3.45Å; R355-R359 PolarHBondContact O-N 3.46Å
356	E	97.4	Very high	97.2	Very high	90 Å²	90	107.2 Å²	107.2	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-64.4	-46.2	175	-167.8	64.6	-114.4	0	0	111.5	E352 E353 Q358 R359 V360	E352-E356 PolarHBondContact O-N 2.98Å; E353-E356 PolarHBondContact O-N 2.86Å; E353-E356 VanDerWaalsContact O-N 3.16Å; E356-Q358 VanDerWaalsContact C-N 3.32Å; E356-Q358 PolarHBondContact O-N 3.1Å; E356-R359 WeakPolarHBondContact O-CB 3.41Å; E356-R359 PolarHBondContact O-N 3Å; E356-R359 VanDerWaalsContact O-N 3.07Å; E356-R359 IonicContact OE1-CZ 2.83Å; E356-R359 IonicContact OE1-NH1 2.82Å; E356-R359 PolarHBondContact OE1-NH1 3.03Å; E356-R359 IonicContact OE2-CZ 2.7Å; E356-R359 IonicContact OE2-NH1 3.32Å; E356-R359 PolarHBondContact OE2-NH1 2.89Å; E356-V360 HydrophobicContact CG-CG2 4.5Å; E356-V360 WeakPolarHBondContact O-CG2 3.35Å; E356-V360 PolarHBondContact O-N 3.25Å
357	I	97.8	Very high	97.3	Very high	75 Å²	75	107.1 Å²	107.1	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-55.9	-48.8	176.4	-69.7	166.8	0	0	0	110.2	E353 N354 R359 V360 I361	E353-I357 HydrophobicContact CG-CD1 3.97Å; E353-I357 VanDerWaalsContact O-CG1 3.31Å; E353-I357 WeakPolarHBondContact O-CG1 3.39Å; E353-I357 PolarHBondContact O-N 3.07Å; N354-I357 PolarHBondContact O-N 3.25Å; I357-R359 VanDerWaalsContact C-N 3.32Å; I357-R359 PolarHBondContact O-N 3.42Å; I357-V360 PolarHBondContact O-N 2.98Å; I357-I361 HydrophobicContact CG2-CD1 3.69Å; I357-I361 HydrophobicContact CG2-CG1 4.38Å; I357-I361 WeakPolarHBondContact O-CB 3.34Å; I357-I361 VanDerWaalsContact O-CG1 3.27Å; I357-I361 WeakPolarHBondContact O-CG1 3.22Å; I357-I361 PolarHBondContact O-N 3.44Å
358	Q	97.8	Very high	97.2	Very high	104 Å²	104	107.3 Å²	107.3	49%	0.486	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-39.2	177.4	-68.6	-55.6	-39.5	0	0	112.2	N354 R355 E356 I361 N362	N354-Q358 VanDerWaalsContact O-CG 3.32Å; N354-Q358 WeakPolarHBondContact O-CG 3.45Å; N354-Q358 PolarHBondContact O-N 3.37Å; R355-Q358 PolarHBondContact O-N 3.02Å; E356-Q358 VanDerWaalsContact C-N 3.32Å; E356-Q358 PolarHBondContact O-N 3.1Å; Q358-I361 PolarHBondContact O-N 2.92Å; Q358-N362 WeakPolarHBondContact O-CB 3.41Å; Q358-N362 PolarHBondContact O-N 3.43Å; Q358-N362 PolarHBondContact O-ND2 3.29Å; Q358-N362 VanDerWaalsContact O-ND2 3.15Å
359	R	97.8	Very high	97.1	Very high	115 Å²	115	109.3 Å²	109.3	43%	0.434	50%	0.495	S	S	.	.	H	α-helix	trans	-61.8	-45.2	175.9	-166.8	-173.2	-62.8	106.4	-7.5	111.5	R355 E356 I357 N362 K363	R355-R359 WeakPolarHBondContact O-CB 3.45Å; R355-R359 PolarHBondContact O-N 3.46Å; E356-R359 WeakPolarHBondContact O-CB 3.41Å; E356-R359 PolarHBondContact O-N 3Å; E356-R359 VanDerWaalsContact O-N 3.07Å; E356-R359 IonicContact OE1-CZ 2.83Å; E356-R359 IonicContact OE1-NH1 2.82Å; E356-R359 PolarHBondContact OE1-NH1 3.03Å; E356-R359 IonicContact OE2-CZ 2.7Å; E356-R359 IonicContact OE2-NH1 3.32Å; E356-R359 PolarHBondContact OE2-NH1 2.89Å; I357-R359 VanDerWaalsContact C-N 3.32Å; I357-R359 PolarHBondContact O-N 3.42Å; R359-N362 PolarHBondContact O-N 2.89Å; R359-K363 WeakPolarHBondContact O-CB 3.5Å; R359-K363 PolarHBondContact O-N 3.41Å
360	V	98.2	Very high	97	Very high	86 Å²	86	108.4 Å²	108.4	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-45.4	177.9	173.1	0	0	0	0	110.9	E356 I357 N362 K363 Y364	E356-V360 HydrophobicContact CG-CG2 4.5Å; E356-V360 WeakPolarHBondContact O-CG2 3.35Å; E356-V360 PolarHBondContact O-N 3.25Å; I357-V360 PolarHBondContact O-N 2.98Å; V360-N362 PolarHBondContact O-N 3.47Å; V360-K363 PolarHBondContact O-N 3.15Å; V360-Y364 WeakPolarHBondContact O-CB 3.32Å; V360-Y364 PolarHBondContact O-N 3.16Å
361	I	97.8	Very high	96.8	Very high	64 Å²	64	105.4 Å²	105.4	33%	0.328	49%	0.486	S	S	.	.	H	α-helix	trans	-58.5	-48.6	176.3	-70.4	168.9	0	0	0	110.6	I357 Q358 K363 Y364 Q365	I357-I361 HydrophobicContact CG2-CD1 3.69Å; I357-I361 HydrophobicContact CG2-CG1 4.38Å; I357-I361 WeakPolarHBondContact O-CB 3.34Å; I357-I361 VanDerWaalsContact O-CG1 3.27Å; I357-I361 WeakPolarHBondContact O-CG1 3.22Å; I357-I361 PolarHBondContact O-N 3.44Å; Q358-I361 PolarHBondContact O-N 2.92Å; I361-K363 VanDerWaalsContact C-N 3.33Å; I361-K363 PolarHBondContact O-N 2.98Å; I361-Y364 PolarHBondContact O-N 3.22Å; I361-Q365 HydrophobicContact CG2-CG 4.32Å; I361-Q365 WeakPolarHBondContact O-CB 3.27Å; I361-Q365 WeakPolarHBondContact O-CG 3.4Å; I361-Q365 PolarHBondContact O-N 2.88Å
362	N	97.4	Very high	96.5	Very high	89 Å²	89	102.2 Å²	102.2	48%	0.476	48%	0.478	S	S	.	.	H	α-helix	trans	-62.1	-41.6	180	-74	-27.9	0	0	0	111.9	Q358 R359 V360 Q365 H366	Q358-N362 WeakPolarHBondContact O-CB 3.41Å; Q358-N362 PolarHBondContact O-N 3.43Å; Q358-N362 PolarHBondContact O-ND2 3.29Å; Q358-N362 VanDerWaalsContact O-ND2 3.15Å; R359-N362 PolarHBondContact O-N 2.89Å; V360-N362 PolarHBondContact O-N 3.47Å; N362-Q365 PolarHBondContact O-N 3.26Å; N362-H366 WeakPolarHBondContact O-CB 3.28Å; N362-H366 PolarHBondContact O-N 3.41Å
363	K	97.6	Very high	96.2	Very high	138 Å²	138	103.3 Å²	103.3	60%	0.6	48%	0.483	S	S	*	.	H	α-helix	trans	-62.5	-45.8	176	-172.7	178.2	-179.8	-178.8	0	111.3	R359 V360 I361 H366 Q367	R359-K363 WeakPolarHBondContact O-CB 3.5Å; R359-K363 PolarHBondContact O-N 3.41Å; V360-K363 PolarHBondContact O-N 3.15Å; I361-K363 VanDerWaalsContact C-N 3.33Å; I361-K363 PolarHBondContact O-N 2.98Å; K363-H366 PolarHBondContact O-N 3.42Å; K363-Q367 WeakPolarHBondContact O-CG 3.43Å; K363-Q367 PolarHBondContact O-N 2.93Å
364	Y	97.6	Very high	95.8	Very high	148 Å²	148	102.1 Å²	102.1	58%	0.58	48%	0.478	S	S	*	.	H	α-helix	trans	-59.7	-50	175.8	173.8	-98	0	0	0	111.6	V360 I361 H366 Q367 H368	V360-Y364 WeakPolarHBondContact O-CB 3.32Å; V360-Y364 PolarHBondContact O-N 3.16Å; I361-Y364 PolarHBondContact O-N 3.22Å; Y364-H366 VanDerWaalsContact C-N 3.3Å; Y364-H366 PolarHBondContact O-N 2.84Å; Y364-Q367 PolarHBondContact O-N 3.42Å; Y364-H368 VanDerWaalsContact O-CB 3.31Å; Y364-H368 WeakPolarHBondContact O-CB 3.42Å; Y364-H368 PolarHBondContact O-N 3.49Å
365	Q	97	Very high	95.3	Very high	94 Å²	94	103.3 Å²	103.3	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-37.4	179.3	-72.6	178.1	0.4	0	0	112.6	I361 N362 R369	I361-Q365 HydrophobicContact CG2-CG 4.32Å; I361-Q365 WeakPolarHBondContact O-CB 3.27Å; I361-Q365 WeakPolarHBondContact O-CG 3.4Å; I361-Q365 PolarHBondContact O-N 2.88Å; N362-Q365 PolarHBondContact O-N 3.26Å; Q365-R369 WeakPolarHBondContact O-CB 3.4Å; Q365-R369 WeakPolarHBondContact O-CG 3.31Å; Q365-R369 PolarHBondContact O-N 2.87Å; Q365-R369 PolarHBondContact O-NE 3.47Å
366	H	96.1	Very high	94.7	Very high	114 Å²	114	100.1 Å²	100.1	53%	0.528	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-49.2	175.9	-179.1	70.9	0	0	0	111.3	N362 K363 Y364 R369 L370	N362-H366 WeakPolarHBondContact O-CB 3.28Å; N362-H366 PolarHBondContact O-N 3.41Å; K363-H366 PolarHBondContact O-N 3.42Å; Y364-H366 VanDerWaalsContact C-N 3.3Å; Y364-H366 PolarHBondContact O-N 2.84Å; H366-R369 PolarHBondContact O-N 3.46Å; H366-L370 PolarHBondContact O-N 3.32Å
367	Q	96.3	Very high	93.6	Very high	101 Å²	101	102.8 Å²	102.8	47%	0.472	49%	0.493	S	S	.	.	H	α-helix	trans	-64.1	-42.6	177.8	-71	-178.7	-31.7	0	0	112.2	K363 Y364 R369 L370 L371	K363-Q367 WeakPolarHBondContact O-CG 3.43Å; K363-Q367 PolarHBondContact O-N 2.93Å; Y364-Q367 PolarHBondContact O-N 3.42Å; Q367-R369 PolarHBondContact O-N 2.97Å; Q367-L370 PolarHBondContact O-N 3.26Å; Q367-L371 WeakPolarHBondContact O-CB 3.34Å; Q367-L371 WeakPolarHBondContact O-CG 3.35Å; Q367-L371 PolarHBondContact O-N 3.2Å
368	H	95.1	Very high	92.3	Very high	96 Å²	96	107.1 Å²	107.1	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-59.4	-47.5	176.4	-174.6	-79.2	0	0	0	111.1	Y364 L370 L371 S372	Y364-H368 VanDerWaalsContact O-CB 3.31Å; Y364-H368 WeakPolarHBondContact O-CB 3.42Å; Y364-H368 PolarHBondContact O-N 3.49Å; H368-L370 VanDerWaalsContact C-N 3.34Å; H368-L370 PolarHBondContact O-N 3.01Å; H368-L371 PolarHBondContact O-N 3.27Å; H368-S372 PolarHBondContact CE1-OG 3.42Å; H368-S372 PolarHBondContact ND1-OG 3.35Å; H368-S372 WeakPolarHBondContact O-CB 3.5Å; H368-S372 PolarHBondContact O-N 3.38Å; H368-S372 PolarHBondContact O-OG 2.81Å
369	R	94.5	Very high	90.5	Very high	160 Å²	160	109.5 Å²	109.5	60%	0.604	52%	0.522	S	S	*	.	H	α-helix	trans	-58.6	-44.5	175.8	-79.2	-175.6	-70.3	154.3	-7.8	112.3	Q365 H366 Q367 S372 H373	Q365-R369 WeakPolarHBondContact O-CB 3.4Å; Q365-R369 WeakPolarHBondContact O-CG 3.31Å; Q365-R369 PolarHBondContact O-N 2.87Å; Q365-R369 PolarHBondContact O-NE 3.47Å; H366-R369 PolarHBondContact O-N 3.46Å; Q367-R369 PolarHBondContact O-N 2.97Å; R369-S372 PolarHBondContact O-N 3.32Å; R369-H373 WeakPolarHBondContact O-CB 3.33Å; R369-H373 PolarHBondContact O-N 3.39Å
370	L	94	Very high	88.5	Confident	94 Å²	94	108.3 Å²	108.3	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-61.1	-47.2	178.5	-178.3	66.6	0	0	0	111.5	H366 Q367 H368 H373 M374	H366-L370 PolarHBondContact O-N 3.32Å; Q367-L370 PolarHBondContact O-N 3.26Å; H368-L370 VanDerWaalsContact C-N 3.34Å; H368-L370 PolarHBondContact O-N 3.01Å; L370-H373 PolarHBondContact O-N 3.05Å; L370-M374 HydrophobicContact CG-SD 4.47Å; L370-M374 WeakPolarHBondContact O-CG 3.11Å; L370-M374 PolarHBondContact O-N 2.94Å
371	L	93.3	Very high	86.6	Confident	102 Å²	102	113.3 Å²	113.3	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-65.3	-44.6	178.3	-73.4	170	0	0	0	111.9	Q367 H368 H373 M374 L375	Q367-L371 WeakPolarHBondContact O-CB 3.34Å; Q367-L371 WeakPolarHBondContact O-CG 3.35Å; Q367-L371 PolarHBondContact O-N 3.2Å; H368-L371 PolarHBondContact O-N 3.27Å; L371-H373 VanDerWaalsContact C-N 3.3Å; L371-H373 PolarHBondContact O-N 2.92Å; L371-M374 PolarHBondContact O-N 3.26Å; L371-L375 WeakPolarHBondContact O-CB 3.5Å; L371-L375 VanDerWaalsContact O-CG 3.28Å; L371-L375 WeakPolarHBondContact O-CG 3.34Å; L371-L375 PolarHBondContact O-N 3.46Å
372	S	91.3	Very high	86	Confident	53 Å²	53	115.8 Å²	115.8	37%	0.371	58%	0.577	S	S	.	*	H	α-helix	trans	-58.8	-42.8	175.7	-61.1	0	0	0	0	111.6	H368 R369 L375 S376	H368-S372 PolarHBondContact CE1-OG 3.42Å; H368-S372 PolarHBondContact ND1-OG 3.35Å; H368-S372 WeakPolarHBondContact O-CB 3.5Å; H368-S372 PolarHBondContact O-N 3.38Å; H368-S372 PolarHBondContact O-OG 2.81Å; R369-S372 PolarHBondContact O-N 3.32Å; S372-L375 PolarHBondContact O-N 3.45Å; S372-S376 PolarHBondContact O-N 2.94Å; S372-S376 PolarHBondContact O-OG 3.4Å
373	H	89.9	Confident	85.4	Confident	104 Å²	104	117.2 Å²	117.2	48%	0.481	58%	0.582	S	S	.	*	H	α-helix	trans	-62.9	-47.5	174.9	-174.9	-89.7	0	0	0	111.3	R369 L370 L371 L375 S376 F377	R369-H373 WeakPolarHBondContact O-CB 3.33Å; R369-H373 PolarHBondContact O-N 3.39Å; L370-H373 PolarHBondContact O-N 3.05Å; L371-H373 VanDerWaalsContact C-N 3.3Å; L371-H373 PolarHBondContact O-N 2.92Å; H373-L375 VanDerWaalsContact C-N 3.29Å; H373-L375 PolarHBondContact O-N 2.92Å; H373-S376 PolarHBondContact O-N 3.36Å; H373-S376 PolarHBondContact O-OG 3.03Å; H373-F377 AromaticContact CD2-CE2 3.72Å; H373-F377 AromaticContact CE1-CD2 3.49Å; H373-F377 VanDerWaalsContact CE1-CD2 3.49Å; H373-F377 WeakPolarHBondContact CE1-CD2 3.33Å; H373-F377 AromaticContact CE1-CE2 3.09Å; H373-F377 WeakPolarHBondContact CE1-CE2 3.41Å; H373-F377 AromaticContact CE1-CZ 3.82Å; H373-F377 AromaticContact ND1-CD2 3.64Å; H373-F377 AromaticContact ND1-CE2 3.71Å; H373-F377 AromaticContact NE2-CD2 3.85Å; H373-F377 AromaticContact NE2-CE2 3.11Å; H373-F377 WeakPolarHBondContact NE2-CE2 3.26Å; H373-F377 AromaticContact NE2-CZ 3.88Å; H373-F377 VanDerWaalsContact O-CD2 3.26Å; H373-F377 WeakPolarHBondContact O-CD2 3.49Å; H373-F377 PolarHBondContact O-N 2.85Å
374	M	88.7	Confident	84.7	Confident	98 Å²	98	116 Å²	116	48%	0.483	58%	0.581	S	S	.	*	H	α-helix	trans	-60.2	-38.5	176.5	-74.8	178.8	50	0	0	113.2	L370 L371 K378	L370-M374 HydrophobicContact CG-SD 4.47Å; L370-M374 WeakPolarHBondContact O-CG 3.11Å; L370-M374 PolarHBondContact O-N 2.94Å; L371-M374 PolarHBondContact O-N 3.26Å; M374-K378 PolarHBondContact O-N 3.35Å; M374-K378 VanDerWaalsContact O-N 3.16Å
375	L	87.4	Confident	84	Confident	108 Å²	108	114.1 Å²	114.1	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-68.6	-41	177.5	-72.7	167.2	0	0	0	111.7	L371 S372 H373 F377 K378 M379	L371-L375 WeakPolarHBondContact O-CB 3.5Å; L371-L375 VanDerWaalsContact O-CG 3.28Å; L371-L375 WeakPolarHBondContact O-CG 3.34Å; L371-L375 PolarHBondContact O-N 3.46Å; S372-L375 PolarHBondContact O-N 3.45Å; H373-L375 VanDerWaalsContact C-N 3.29Å; H373-L375 PolarHBondContact O-N 2.92Å; L375-F377 VanDerWaalsContact C-N 3.32Å; L375-F377 PolarHBondContact O-N 3.39Å; L375-K378 PolarHBondContact O-N 3.49Å; L375-M379 WeakPolarHBondContact O-CG 3.09Å; L375-M379 PolarHBondContact O-N 3.47Å
376	S	85	Confident	83.2	Confident	69 Å²	69	115.4 Å²	115.4	48%	0.483	59%	0.59	S	S	.	*	H	α-helix	trans	-64.9	-36.4	176.4	66.8	0	0	0	0	112.2	S372 H373 M379	S372-S376 PolarHBondContact O-N 2.94Å; S372-S376 PolarHBondContact O-OG 3.4Å; H373-S376 PolarHBondContact O-N 3.36Å; H373-S376 PolarHBondContact O-OG 3.03Å; S376-M379 PolarHBondContact O-N 3.26Å
377	F	74.4	Confident	82.3	Confident	146 Å²	146	115.5 Å²	115.5	64%	0.64	60%	0.595	S	S	*	*	H	α-helix	trans	-70.7	-29.2	175.7	-88.5	-94.9	0	0	0	113.5	H373 L375	H373-F377 AromaticContact CD2-CE2 3.72Å; H373-F377 AromaticContact CE1-CD2 3.49Å; H373-F377 VanDerWaalsContact CE1-CD2 3.49Å; H373-F377 WeakPolarHBondContact CE1-CD2 3.33Å; H373-F377 AromaticContact CE1-CE2 3.09Å; H373-F377 WeakPolarHBondContact CE1-CE2 3.41Å; H373-F377 AromaticContact CE1-CZ 3.82Å; H373-F377 AromaticContact ND1-CD2 3.64Å; H373-F377 AromaticContact ND1-CE2 3.71Å; H373-F377 AromaticContact NE2-CD2 3.85Å; H373-F377 AromaticContact NE2-CE2 3.11Å; H373-F377 WeakPolarHBondContact NE2-CE2 3.26Å; H373-F377 AromaticContact NE2-CZ 3.88Å; H373-F377 VanDerWaalsContact O-CD2 3.26Å; H373-F377 WeakPolarHBondContact O-CD2 3.49Å; H373-F377 PolarHBondContact O-N 2.85Å; L375-F377 VanDerWaalsContact C-N 3.32Å; L375-F377 PolarHBondContact O-N 3.39Å
378	K	71.6	Confident	81.3	Confident	166 Å²	166	116.5 Å²	116.5	72%	0.722	60%	0.603	S	S	*	*	H	α-helix	trans	-80.7	-16.6	175.9	-80.8	-166.3	171.9	-173	0	114.6	M374 L375	M374-K378 PolarHBondContact O-N 3.35Å; M374-K378 VanDerWaalsContact O-N 3.16Å; L375-K378 PolarHBondContact O-N 3.49Å
379	M	60.7	Low	80.2	Confident	154 Å²	154	118.1 Å²	118.1	76%	0.759	62%	0.616	S	S	*	*	S	Bend	trans	-102.3	3.6	-178.4	-67.1	-72.3	116.6	0	0	113.2	L375 S376	L375-M379 WeakPolarHBondContact O-CG 3.09Å; L375-M379 PolarHBondContact O-N 3.47Å; S376-M379 PolarHBondContact O-N 3.26Å
380	S	54	Low	79.1	Confident	90 Å²	90	114.6 Å²	114.6	63%	0.629	62%	0.617	S	S	*	*			trans	-80.3	120.8	169.1	-171.3	0	0	0	0	109
381	P	58.3	Low	77.7	Confident	191 Å²	191	116.5 Å²	116.5	100%	1.24	63%	0.628	S	S	*	*			trans	-69.4	0	-175.8	28.1	-34.3	0	0	0	114.2

Retrieved 381 of 381 residues in 438.5 ms (Link to these results)

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