G4V896_SCHMA Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession G4V896, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 197 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	43.9	Very low	86.3	Confident	234 Å²	234	90 Å²	90	100%	1.153	50%	0.498	S	S	*	.				0	109.7	0	-80.1	167.7	171.1	0	0	107.1	L3	M1-L3 PolarHBondContact O-N 2.97Å
2	A	59.1	Low	87.1	Confident	101 Å²	101	86.3 Å²	86.3	84%	0.835	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-68.9	122.7	168.6	0	0	0	0	0	106.8
3	L	75.3	Confident	87.6	Confident	113 Å²	113	87.2 Å²	87.2	59%	0.592	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-70.2	135.9	176.3	-65.1	175.1	0	0	0	108.6	M1 K88	M1-L3 PolarHBondContact O-N 2.97Å; L3-K88 HydrophobicContact CD1-CB 4.38Å
4	E	91.2	Very high	88.1	Confident	156 Å²	156	86.2 Å²	86.2	73%	0.729	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-59.2	143.9	174	-70.4	-62.5	140.8	0	0	110.5	V6	E4-V6 PolarHBondContact O-N 2.86Å
5	P	95.4	Very high	88.4	Confident	58 Å²	58	85.3 Å²	85.3	38%	0.377	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-59.1	135.5	173.3	-22.7	33.6	0	0	0	111.7	L56 M85 V86	P5-L56 HydrophobicContact CB-CD1 4.14Å; P5-L56 HydrophobicContact CG-CD1 4.05Å; P5-M85 HydrophobicContact CB-CG 3.89Å; P5-M85 HydrophobicContact CB-SD 4.29Å; P5-V86 CarbonylContact C-O 3.55Å; P5-V86 VanDerWaalsContact CA-O 3.31Å; P5-V86 WeakPolarHBondContact CA-O 3.35Å
6	V	96.4	Very high	88.8	Confident	71 Å²	71	88.6 Å²	88.6	43%	0.43	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.9	178.9	-178.5	0	0	0	0	109.5	E4 M85 V86 K88	E4-V6 PolarHBondContact O-N 2.86Å; V6-M85 WeakPolarHBondContact O-CA 2.91Å; V6-V86 PolarHBondContact N-O 3.49Å; V6-V86 PolarHBondContact O-N 2.98Å; V6-K88 HydrophobicContact CG2-CG 4.42Å
7	V	97.3	Very high	89	Confident	87 Å²	87	89.5 Å²	89.5	53%	0.527	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.7	172.3	-179.2	0	0	0	0	109.7	F84 M85	V7-F84 CarbonylContact C-O 3.54Å; V7-F84 VanDerWaalsContact CA-O 3.27Å; V7-F84 WeakPolarHBondContact CA-O 3.49Å; V7-M85 HydrophobicContact CG2-CE 4.16Å
8	I	97.8	Very high	89.3	Confident	10 Å²	10	89.4 Å²	89.4	5%	0.051	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.7	175.5	-62.1	179.4	0	0	0	108.5	L10 S47 L49 F84 V86 K88	I8-L10 HydrophobicContact CG2-CD1 3.98Å; I8-S47 WeakPolarHBondContact CG2-O 3.29Å; I8-L49 HydrophobicContact CD1-CD1 3.81Å; I8-F84 PolarHBondContact N-O 3.39Å; I8-F84 PolarHBondContact O-N 3.22Å; I8-V86 HydrophobicContact CD1-CG1 4.5Å; I8-V86 HydrophobicContact CD1-CG2 3.62Å; I8-V86 HydrophobicContact CG1-CG2 4.1Å; I8-K88 HydrophobicContact CD1-CD 4.32Å
9	S	97.7	Very high	89.8	Confident	56 Å²	56	85.9 Å²	85.9	39%	0.392	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.1	178.5	-65.7	0	0	0	0	111.2	S47 D83	S9-S47 WeakPolarHBondContact O-CB 3.4Å; S9-S47 PolarHBondContact O-OG 3.25Å; S9-D83 VanDerWaalsContact CA-OD1 3.3Å; S9-D83 WeakPolarHBondContact CA-OD1 3.48Å; S9-D83 WeakPolarHBondContact CB-OD1 3.17Å; S9-D83 PolarHBondContact OG-OD1 3.31Å
10	L	98	Very high	90.1	Very high	0 Å²	0	82 Å²	82	0%	0	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.5	172.6	-60.9	88	0	0	0	108.4	I8 W19 F21 I43 A44 L82 F84	I8-L10 HydrophobicContact CG2-CD1 3.98Å; L10-W19 HydrophobicContact CB-CE3 3.71Å; L10-W19 HydrophobicContact CB-CH2 4.33Å; L10-W19 HydrophobicContact CB-CZ3 3.53Å; L10-W19 HydrophobicContact CD2-CB 4.49Å; L10-W19 HydrophobicContact CD2-CE3 4.11Å; L10-F21 HydrophobicContact CD2-CD1 4Å; L10-F21 HydrophobicContact CD2-CE1 3.98Å; L10-I43 HydrophobicContact CB-CG2 4.16Å; L10-I43 HydrophobicContact CD2-CG2 4.45Å; L10-A44 HydrophobicContact CD2-CB 3.88Å; L10-L82 HydrophobicContact CB-CB 4.27Å; L10-L82 PolarHBondContact N-O 3.41Å; L10-L82 PolarHBondContact O-N 3.3Å; L10-F84 HydrophobicContact CD1-CD2 3.78Å; L10-F84 HydrophobicContact CD1-CE2 4.16Å; L10-F84 HydrophobicContact CD1-CG 4.45Å
11	R	97.2	Very high	90.5	Very high	104 Å²	104	79.8 Å²	79.8	39%	0.392	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.1	-178	-58.8	-65.1	-179.7	-92.2	4.1	109.7	D81 L82 D83	R11-D81 WeakPolarHBondContact CD-OD1 3.23Å; R11-D81 IonicContact NE-OD1 2.79Å; R11-D81 PolarHBondContact NE-OD1 2.95Å; R11-L82 PolarHBondContact NH1-O 3.12Å; R11-D83 IonicContact CZ-OD1 3.88Å; R11-D83 IonicContact CZ-OD2 2.69Å; R11-D83 IonicContact NH1-OD1 3.1Å; R11-D83 PolarHBondContact NH1-OD1 2.81Å; R11-D83 IonicContact NH1-OD2 3.21Å; R11-D83 VanDerWaalsContact NH2-CG 3.33Å; R11-D83 IonicContact NH2-OD1 3.99Å; R11-D83 PolarHBondContact NH2-OD1 3.14Å; R11-D83 IonicContact NH2-OD2 3.23Å; R11-D83 PolarHBondContact NH2-OD2 2.95Å; R11-D83 VanDerWaalsContact NH2-OD2 3.1Å
12	R	95.8	Very high	93.1	Very high	46 Å²	46	71.6 Å²	71.6	17%	0.174	42%	0.417	C	S	.	.			trans	-133	141.6	174	64.1	-175.5	176.5	165.7	0.3	110.2	T14 S15 K17 W19 I43 G79 N80	R12-T14 VanDerWaalsContact C-N 3.33Å; R12-T14 WeakPolarHBondContact CD-O 3.42Å; R12-S15 PolarHBondContact NH1-O 3.11Å; R12-K17 WeakPolarHBondContact CD-O 3.48Å; R12-K17 PolarHBondContact NH1-O 2.96Å; R12-W19 HydrophobicContact CB-CH2 4.44Å; R12-W19 HydrophobicContact CB-CZ3 4.1Å; R12-W19 HydrophobicContact CG-CH2 3.78Å; R12-W19 HydrophobicContact CG-CZ2 4.25Å; R12-W19 HydrophobicContact CG-CZ3 3.91Å; R12-I43 HydrophobicContact CB-CD1 3.68Å; R12-G79 PolarHBondContact NE-O 3.25Å; R12-G79 VanDerWaalsContact NE-O 3.16Å; R12-G79 PolarHBondContact NH2-O 3.31Å; R12-N80 HydrophobicContact CG-CB 3.94Å; R12-N80 WeakPolarHBondContact CG-OD1 3.29Å; R12-N80 PolarHBondContact N-O 3.26Å; R12-N80 PolarHBondContact NE-OD1 3.23Å; R12-N80 WeakPolarHBondContact O-CB 2.96Å
13	A	93.8	Very high	94.9	Very high	98 Å²	98	67.7 Å²	67.7	81%	0.81	38%	0.382	S	S	*	.	S	Bend	trans	-69.8	-34.6	179	0	0	0	0	0	112
14	T	94.6	Very high	95.9	Very high	73 Å²	73	64.9 Å²	64.9	45%	0.448	37%	0.366	S	S	.	.	S	Bend	trans	-141.2	149.3	-171.6	54.6	0	0	0	0	110.1	R12 D16	R12-T14 VanDerWaalsContact C-N 3.33Å; R12-T14 WeakPolarHBondContact CD-O 3.42Å; T14-D16 VanDerWaalsContact C-N 3.35Å; T14-D16 WeakPolarHBondContact CB-OD1 3.49Å; T14-D16 PolarHBondContact OG1-OD1 3.39Å
15	S	93.1	Very high	96.1	Very high	73 Å²	73	57.4 Å²	57.4	51%	0.51	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-12.4	-171.6	-51.8	0	0	0	0	114.5	R12 K17 N80	R12-S15 PolarHBondContact NH1-O 3.11Å; S15-K17 VanDerWaalsContact C-N 3.28Å; S15-N80 PolarHBondContact OG-ND2 3.13Å; S15-N80 PolarHBondContact OG-OD1 3.39Å
16	D	93.5	Very high	96.2	Very high	137 Å²	137	54.8 Å²	54.8	73%	0.733	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-30	172.1	66	-49.7	0	0	0	112	T14 S18	T14-D16 VanDerWaalsContact C-N 3.35Å; T14-D16 WeakPolarHBondContact CB-OD1 3.49Å; T14-D16 PolarHBondContact OG1-OD1 3.39Å; D16-S18 PolarHBondContact O-N 3.05Å
17	K	93	Very high	96.2	Very high	105 Å²	105	55.3 Å²	55.3	46%	0.457	32%	0.318	S	S	.	.	S	Bend	trans	-77.1	123.4	177.7	-168.7	173.3	176.3	-169.5	0	110.8	R12 S15 I43	R12-K17 WeakPolarHBondContact CD-O 3.48Å; R12-K17 PolarHBondContact NH1-O 2.96Å; S15-K17 VanDerWaalsContact C-N 3.28Å; K17-I43 HydrophobicContact CD-CD1 3.72Å; K17-I43 HydrophobicContact CD-CG1 4.31Å; K17-I43 HydrophobicContact CG-CD1 3.88Å
18	S	95	Very high	96.2	Very high	87 Å²	87	55.8 Å²	55.8	61%	0.608	32%	0.317	S	S	*	.			trans	-69.8	149.6	174.3	68.4	0	0	0	0	111.9	D16 G20	D16-S18 PolarHBondContact O-N 3.05Å; S18-G20 PolarHBondContact O-N 2.8Å
19	W	97.4	Very high	96.1	Very high	24 Å²	24	58.8 Å²	58.8	9%	0.091	33%	0.331	C	S	.	.			trans	-65.6	-29	176.1	-62.5	116.9	0	0	0	113.1	L10 R12 F21 I43 A44 G79 N80 L82	L10-W19 HydrophobicContact CB-CE3 3.71Å; L10-W19 HydrophobicContact CB-CH2 4.33Å; L10-W19 HydrophobicContact CB-CZ3 3.53Å; L10-W19 HydrophobicContact CD2-CB 4.49Å; L10-W19 HydrophobicContact CD2-CE3 4.11Å; R12-W19 HydrophobicContact CB-CH2 4.44Å; R12-W19 HydrophobicContact CB-CZ3 4.1Å; R12-W19 HydrophobicContact CG-CH2 3.78Å; R12-W19 HydrophobicContact CG-CZ2 4.25Å; R12-W19 HydrophobicContact CG-CZ3 3.91Å; W19-F21 HydrophobicContact CB-CD1 3.44Å; W19-F21 VanDerWaalsContact CB-CD1 3.44Å; W19-F21 HydrophobicContact CB-CE1 3.24Å; W19-F21 HydrophobicContact CB-CZ 4.2Å; W19-F21 AromaticContact CD1-CE1 3.93Å; W19-F21 HydrophobicContact CD2-CE1 4.49Å; W19-F21 HydrophobicContact CG-CD1 4.32Å; W19-F21 AromaticContact CG-CE1 3.63Å; W19-F21 HydrophobicContact CG-CE1 3.63Å; W19-F21 HydrophobicContact CG-CZ 4.34Å; W19-I43 HydrophobicContact CE3-CB 4.49Å; W19-I43 HydrophobicContact CE3-CD1 4.31Å; W19-I43 HydrophobicContact CE3-CG2 3.99Å; W19-I43 HydrophobicContact CZ3-CG2 4.26Å; W19-I43 PolarHBondContact O-N 2.94Å; W19-A44 WeakPolarHBondContact O-CB 3.41Å; W19-A44 PolarHBondContact O-N 3.35Å; W19-G79 VanDerWaalsContact CZ2-O 3.28Å; W19-G79 WeakPolarHBondContact CZ2-O 3.47Å; W19-N80 WeakPolarHBondContact CH2-O 3.29Å; W19-L82 HydrophobicContact CD2-CD2 4.13Å; W19-L82 HydrophobicContact CG-CD2 4.41Å; W19-L82 HydrophobicContact CH2-CB 3.68Å; W19-L82 HydrophobicContact CZ2-CB 3.64Å; W19-L82 HydrophobicContact CZ2-CD2 4.12Å; W19-L82 HydrophobicContact CZ3-CB 4.34Å
20	G	97.4	Very high	96	Very high	7 Å²	7	59.5 Å²	59.5	7%	0.072	35%	0.347	C	S	.	.			trans	79.8	33.2	-179.7	0	0	0	0	0	114.2	S18 T39	S18-G20 PolarHBondContact O-N 2.8Å; G20-T39 WeakPolarHBondContact O-CB 3.37Å; G20-T39 PolarHBondContact O-N 3.38Å; G20-T39 PolarHBondContact O-OG1 3.35Å
21	F	98.1	Very high	95.9	Very high	35 Å²	35	61.5 Å²	61.5	15%	0.154	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	161	170.2	66.6	-100.7	0	0	0	111.1	L10 W19 L23 K37 A44 L49 I75 L82 F84	L10-F21 HydrophobicContact CD2-CD1 4Å; L10-F21 HydrophobicContact CD2-CE1 3.98Å; W19-F21 HydrophobicContact CB-CD1 3.44Å; W19-F21 VanDerWaalsContact CB-CD1 3.44Å; W19-F21 HydrophobicContact CB-CE1 3.24Å; W19-F21 HydrophobicContact CB-CZ 4.2Å; W19-F21 AromaticContact CD1-CE1 3.93Å; W19-F21 HydrophobicContact CD2-CE1 4.49Å; W19-F21 HydrophobicContact CG-CD1 4.32Å; W19-F21 AromaticContact CG-CE1 3.63Å; W19-F21 HydrophobicContact CG-CE1 3.63Å; W19-F21 HydrophobicContact CG-CZ 4.34Å; F21-L23 HydrophobicContact CD2-CD1 4.48Å; F21-L23 HydrophobicContact CD2-CD2 4.16Å; F21-L23 HydrophobicContact CD2-CG 3.82Å; F21-L23 HydrophobicContact CE2-CD1 3.88Å; F21-L23 HydrophobicContact CE2-CD2 4.32Å; F21-L23 HydrophobicContact CE2-CG 3.7Å; F21-K37 CarbonylContact C-O 3.5Å; F21-K37 VanDerWaalsContact CA-O 3.3Å; F21-K37 WeakPolarHBondContact CA-O 3.23Å; F21-A44 HydrophobicContact CB-CB 3.88Å; F21-A44 HydrophobicContact CD1-CB 3.9Å; F21-A44 HydrophobicContact CG-CB 4.38Å; F21-L49 HydrophobicContact CB-CD2 3.92Å; F21-L49 HydrophobicContact CD1-CD2 4.14Å; F21-L49 HydrophobicContact CG-CD2 4.06Å; F21-I75 HydrophobicContact CE2-CD1 4.23Å; F21-I75 HydrophobicContact CZ-CD1 4.3Å; F21-I75 HydrophobicContact CZ-CG2 4.15Å; F21-L82 HydrophobicContact CE1-CD2 3.89Å; F21-L82 HydrophobicContact CZ-CD2 3.97Å; F21-F84 AromaticContact CE1-CE2 3.95Å; F21-F84 HydrophobicContact CE1-CE2 3.95Å; F21-F84 HydrophobicContact CE1-CZ 4.18Å; F21-F84 HydrophobicContact CE2-CE2 4.36Å; F21-F84 HydrophobicContact CE2-CZ 4.2Å; F21-F84 AromaticContact CZ-CE2 3.88Å; F21-F84 HydrophobicContact CZ-CE2 3.88Å; F21-F84 AromaticContact CZ-CZ 3.7Å; F21-F84 HydrophobicContact CZ-CZ 3.7Å
22	V	97.6	Very high	95.9	Very high	62 Å²	62	59.6 Å²	59.6	38%	0.376	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130	170.8	-177.9	0	0	0	0	107.7	H36 K37	V22-H36 PolarHBondContact O-N 2.86Å; V22-K37 HydrophobicContact CB-CB 4.08Å; V22-K37 HydrophobicContact CG2-CB 4.15Å; V22-K37 PolarHBondContact N-O 3.33Å; V22-K37 PolarHBondContact O-N 3.41Å
23	L	96.5	Very high	96	Very high	20 Å²	20	58 Å²	58	11%	0.105	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151.1	173.3	-64.6	178.2	0	0	0	111	F21 V33 F34 V35 I55 V71 I75	F21-L23 HydrophobicContact CD2-CD1 4.48Å; F21-L23 HydrophobicContact CD2-CD2 4.16Å; F21-L23 HydrophobicContact CD2-CG 3.82Å; F21-L23 HydrophobicContact CE2-CD1 3.88Å; F21-L23 HydrophobicContact CE2-CD2 4.32Å; F21-L23 HydrophobicContact CE2-CG 3.7Å; L23-V33 HydrophobicContact CD1-CG1 4.3Å; L23-F34 WeakPolarHBondContact CA-O 3.47Å; L23-F34 WeakPolarHBondContact CD2-O 3.44Å; L23-V35 HydrophobicContact CD2-CB 4.39Å; L23-V35 HydrophobicContact CD2-CG2 3.81Å; L23-I55 HydrophobicContact CD2-CG1 4.02Å; L23-V71 HydrophobicContact CD1-CG1 4.2Å; L23-I75 HydrophobicContact CD1-CD1 3.29Å
24	Q	96.5	Very high	96.1	Very high	53 Å²	53	53.3 Å²	53.3	25%	0.248	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	162.5	168.3	-75.8	-64.4	-20.8	0	0	109.6	V33 F34 H36	Q24-V33 WeakPolarHBondContact O-CA 3.4Å; Q24-F34 HydrophobicContact CB-CD1 4.36Å; Q24-F34 HydrophobicContact CB-CE1 3.66Å; Q24-F34 HydrophobicContact CB-CE2 4.12Å; Q24-F34 HydrophobicContact CB-CZ 3.51Å; Q24-F34 HydrophobicContact CG-CZ 4.38Å; Q24-F34 PolarHBondContact N-O 3.33Å; Q24-F34 PolarHBondContact O-N 3.46Å; Q24-H36 HydrophobicContact CB-CB 4.12Å; Q24-H36 HydrophobicContact CG-CB 3.69Å
25	G	96.5	Very high	96.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	92.8	-176.7	179.4	0	0	0	0	0	114.6	H68	G25-H68 WeakPolarHBondContact O-CB 3.17Å; G25-H68 PolarHBondContact O-ND1 2.91Å
26	G	97.2	Very high	96.5	Very high	2 Å²	2	48.5 Å²	48.5	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	132.9	154.6	-161.6	0	0	0	0	0	109.3	D28 Q29 G30 L31	G26-D28 PolarHBondContact O-N 3.44Å; G26-Q29 PolarHBondContact O-N 3.12Å; G26-G30 PolarHBondContact O-N 2.94Å; G26-L31 CarbonylContact C-O 3.5Å; G26-L31 PolarHBondContact N-O 3.34Å; G26-L31 PolarHBondContact O-N 3.07Å; G26-L31 VanDerWaalsContact O-O 3.13Å
27	V	97	Very high	96.7	Very high	83 Å²	83	48.1 Å²	48.1	50%	0.503	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-63.4	-28.8	-177.1	-60.8	0	0	0	0	112.9	Q29 G30 G65 M66 V67	V27-Q29 PolarHBondContact O-N 3.25Å; V27-G30 PolarHBondContact O-N 3.37Å; V27-G65 WeakPolarHBondContact CG2-O 3.4Å; V27-M66 PolarHBondContact N-O 3.22Å; V27-V67 HydrophobicContact CG2-CB 4.47Å; V27-V67 HydrophobicContact CG2-CG1 3.64Å
28	D	97.2	Very high	97	Very high	96 Å²	96	44.1 Å²	44.1	51%	0.513	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-64.2	-24.8	173.8	58.4	-60.7	0	0	0	113	G26 V67 H68	G26-D28 PolarHBondContact O-N 3.44Å; D28-V67 HydrophobicContact CB-CB 4.17Å; D28-V67 HydrophobicContact CB-CG1 3.97Å; D28-V67 VanDerWaalsContact OD1-CA 3.23Å; D28-V67 WeakPolarHBondContact OD1-CA 2.99Å; D28-V67 WeakPolarHBondContact OD1-CB 3.14Å; D28-H68 PolarHBondContact OD1-N 2.89Å
29	Q	95.2	Very high	97.1	Very high	74 Å²	74	43.5 Å²	43.5	35%	0.346	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-99.5	-3.7	179.4	-57.2	-176.9	-2.9	0	0	112.5	G26 V27 L31	G26-Q29 PolarHBondContact O-N 3.12Å; V27-Q29 PolarHBondContact O-N 3.25Å; Q29-L31 HydrophobicContact CB-CB 4.47Å; Q29-L31 HydrophobicContact CB-CD1 4.36Å; Q29-L31 PolarHBondContact O-N 3.09Å
30	G	95.5	Very high	97.1	Very high	70 Å²	70	51.9 Å²	51.9	72%	0.722	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	22.8	-173.8	0	0	0	0	0	113.8	G26 V27	G26-G30 PolarHBondContact O-N 2.94Å; V27-G30 PolarHBondContact O-N 3.37Å
31	L	95.7	Very high	97	Very high	43 Å²	43	56.1 Å²	56.1	23%	0.225	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.7	-176.2	-67.7	167.7	0	0	0	110.1	G26 Q29 F91 Y96	G26-L31 CarbonylContact C-O 3.5Å; G26-L31 PolarHBondContact N-O 3.34Å; G26-L31 PolarHBondContact O-N 3.07Å; G26-L31 VanDerWaalsContact O-O 3.13Å; Q29-L31 HydrophobicContact CB-CB 4.47Å; Q29-L31 HydrophobicContact CB-CD1 4.36Å; Q29-L31 PolarHBondContact O-N 3.09Å; L31-F91 HydrophobicContact CD2-CE2 4.4Å; L31-F91 HydrophobicContact CD2-CZ 4.45Å; L31-Y96 HydrophobicContact CD1-CD2 4.43Å; L31-Y96 HydrophobicContact CD1-CE2 3.6Å; L31-Y96 HydrophobicContact CD2-CE2 4.49Å
32	P	96.7	Very high	96.9	Very high	64 Å²	64	55.2 Å²	55.2	42%	0.416	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	155	168.3	29.6	-35.3	0	0	0	109.7	F34 V54 F91	P32-F34 WeakPolarHBondContact O-CD1 3.38Å; P32-F34 PolarHBondContact O-N 2.93Å; P32-V54 HydrophobicContact CB-CG1 4.17Å; P32-F91 HydrophobicContact CG-CD2 3.76Å; P32-F91 HydrophobicContact CG-CE2 4.05Å
33	V	98	Very high	96.9	Very high	11 Å²	11	52.7 Å²	52.7	7%	0.067	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	113.8	176.2	179.2	0	0	0	0	108.7	L23 Q24 I55 I63 V71	L23-V33 HydrophobicContact CD1-CG1 4.3Å; Q24-V33 WeakPolarHBondContact O-CA 3.4Å; V33-I55 HydrophobicContact CG1-CB 4.14Å; V33-I55 HydrophobicContact CG1-CG1 4.2Å; V33-I55 PolarHBondContact O-N 3.16Å; V33-I63 HydrophobicContact CB-CD1 3.75Å; V33-I63 HydrophobicContact CG1-CD1 3.88Å; V33-I63 HydrophobicContact CG2-CD1 3.94Å; V33-V71 HydrophobicContact CG1-CG1 3.79Å; V33-V71 HydrophobicContact CG2-CG1 4.45Å; V33-V71 HydrophobicContact CG2-CG2 3.76Å
34	F	97.6	Very high	97	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	157.9	-176.8	72.1	-88.1	0	0	0	112.6	L23 Q24 P32 H36 D53 V54 F91 V93 Y96	L23-F34 WeakPolarHBondContact CA-O 3.47Å; L23-F34 WeakPolarHBondContact CD2-O 3.44Å; Q24-F34 HydrophobicContact CB-CD1 4.36Å; Q24-F34 HydrophobicContact CB-CE1 3.66Å; Q24-F34 HydrophobicContact CB-CE2 4.12Å; Q24-F34 HydrophobicContact CB-CZ 3.51Å; Q24-F34 HydrophobicContact CG-CZ 4.38Å; Q24-F34 PolarHBondContact N-O 3.33Å; Q24-F34 PolarHBondContact O-N 3.46Å; P32-F34 WeakPolarHBondContact O-CD1 3.38Å; P32-F34 PolarHBondContact O-N 2.93Å; F34-H36 HydrophobicContact CD2-CB 4.41Å; F34-H36 HydrophobicContact CE2-CB 3.85Å; F34-H36 AromaticContact CE2-ND1 3.68Å; F34-H36 AromaticContact CZ-ND1 3.96Å; F34-H36 PolarHBondContact O-N 3.2Å; F34-D53 CarbonylContact C-O 3.56Å; F34-D53 VanDerWaalsContact CA-O 3.29Å; F34-D53 WeakPolarHBondContact CA-O 3.45Å; F34-V54 HydrophobicContact CB-CG2 4.23Å; F34-F91 HydrophobicContact CB-CB 3.96Å; F34-F91 HydrophobicContact CB-CD1 4.23Å; F34-F91 HydrophobicContact CB-CG 4.02Å; F34-F91 AromaticContact CD1-CD1 3.8Å; F34-F91 HydrophobicContact CD1-CD1 3.8Å; F34-F91 HydrophobicContact CD1-CD2 4.07Å; F34-F91 AromaticContact CD1-CE1 3.75Å; F34-F91 HydrophobicContact CD1-CE1 3.75Å; F34-F91 HydrophobicContact CD1-CE2 4.01Å; F34-F91 AromaticContact CD1-CG 3.96Å; F34-F91 HydrophobicContact CD1-CG 3.96Å; F34-F91 AromaticContact CD1-CZ 3.85Å; F34-F91 HydrophobicContact CD1-CZ 3.85Å; F34-F91 AromaticContact CD2-CD1 3.44Å; F34-F91 HydrophobicContact CD2-CD1 3.44Å; F34-F91 VanDerWaalsContact CD2-CD1 3.44Å; F34-F91 AromaticContact CD2-CE1 3.77Å; F34-F91 HydrophobicContact CD2-CE1 3.77Å; F34-F91 HydrophobicContact CD2-CG 4.11Å; F34-F91 AromaticContact CE1-CD1 3.99Å; F34-F91 HydrophobicContact CE1-CD1 3.99Å; F34-F91 AromaticContact CE1-CE1 3.45Å; F34-F91 HydrophobicContact CE1-CE1 3.45Å; F34-F91 VanDerWaalsContact CE1-CE1 3.45Å; F34-F91 HydrophobicContact CE1-CE2 4.05Å; F34-F91 HydrophobicContact CE1-CG 4.49Å; F34-F91 AromaticContact CE1-CZ 3.48Å; F34-F91 HydrophobicContact CE1-CZ 3.48Å; F34-F91 VanDerWaalsContact CE1-CZ 3.48Å; F34-F91 AromaticContact CE2-CD1 3.62Å; F34-F91 HydrophobicContact CE2-CD1 3.62Å; F34-F91 AromaticContact CE2-CE1 3.45Å; F34-F91 HydrophobicContact CE2-CE1 3.45Å; F34-F91 VanDerWaalsContact CE2-CE1 3.45Å; F34-F91 HydrophobicContact CE2-CZ 4.33Å; F34-F91 HydrophobicContact CG-CB 4.23Å; F34-F91 AromaticContact CG-CD1 3.55Å; F34-F91 HydrophobicContact CG-CD1 3.55Å; F34-F91 HydrophobicContact CG-CD2 4.32Å; F34-F91 AromaticContact CG-CE1 3.92Å; F34-F91 HydrophobicContact CG-CE1 3.92Å; F34-F91 AromaticContact CG-CG 3.77Å; F34-F91 HydrophobicContact CG-CG 3.77Å; F34-F91 HydrophobicContact CG-CZ 4.44Å; F34-F91 AromaticContact CZ-CD1 3.9Å; F34-F91 HydrophobicContact CZ-CD1 3.9Å; F34-F91 AromaticContact CZ-CE1 3.28Å; F34-F91 HydrophobicContact CZ-CE1 3.28Å; F34-F91 AromaticContact CZ-CZ 3.75Å; F34-F91 HydrophobicContact CZ-CZ 3.75Å; F34-V93 HydrophobicContact CD2-CG2 3.96Å; F34-V93 HydrophobicContact CE2-CG2 3.96Å; F34-Y96 HydrophobicContact CZ-CD1 4.1Å; F34-Y96 HydrophobicContact CZ-CE1 4.15Å; F34-Y96 HydrophobicContact CZ-CG 4.28Å
35	V	98.1	Very high	97.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	110.9	173.4	-176.7	0	0	0	0	109.2	L23 V38 L49 E50 P51 G52 D53 I55	L23-V35 HydrophobicContact CD2-CB 4.39Å; L23-V35 HydrophobicContact CD2-CG2 3.81Å; V35-V38 HydrophobicContact CG1-CG2 3.45Å; V35-V38 VanDerWaalsContact CG1-CG2 3.45Å; V35-L49 HydrophobicContact CG1-CD2 4.13Å; V35-L49 HydrophobicContact CG1-CG 4.24Å; V35-L49 HydrophobicContact CG2-CD1 3.87Å; V35-L49 HydrophobicContact CG2-CD2 3.77Å; V35-L49 HydrophobicContact CG2-CG 3.8Å; V35-E50 WeakPolarHBondContact CB-O 3.23Å; V35-P51 CarbonylContact O-C 3.48Å; V35-P51 VanDerWaalsContact O-CA 3.29Å; V35-P51 WeakPolarHBondContact O-CA 3.45Å; V35-G52 PolarHBondContact O-N 2.94Å; V35-D53 HydrophobicContact CB-CB 4.42Å; V35-D53 HydrophobicContact CG2-CB 4.04Å; V35-D53 PolarHBondContact N-O 3.44Å; V35-I55 HydrophobicContact CG2-CD1 3.89Å
36	H	97.7	Very high	97.1	Very high	46 Å²	46	61 Å²	61	21%	0.213	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-42.3	-177.8	-175.6	83.6	0	0	0	112.4	V22 Q24 F34 Y96 N97	V22-H36 PolarHBondContact O-N 2.86Å; Q24-H36 HydrophobicContact CB-CB 4.12Å; Q24-H36 HydrophobicContact CG-CB 3.69Å; F34-H36 HydrophobicContact CD2-CB 4.41Å; F34-H36 HydrophobicContact CE2-CB 3.85Å; F34-H36 AromaticContact CE2-ND1 3.68Å; F34-H36 AromaticContact CZ-ND1 3.96Å; F34-H36 PolarHBondContact O-N 3.2Å; H36-Y96 AromaticContact CE1-CD1 3.94Å; H36-Y96 AromaticContact CE1-CE1 3.73Å; H36-Y96 AromaticContact ND1-CE1 3.87Å; H36-N97 PolarHBondContact CE1-OD1 2.81Å
37	K	97.9	Very high	97.1	Very high	129 Å²	129	62.9 Å²	62.9	56%	0.561	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.6	145.8	-179.9	-174.7	176.3	179.1	178.7	0	110.2	F21 V22	F21-K37 CarbonylContact C-O 3.5Å; F21-K37 VanDerWaalsContact CA-O 3.3Å; F21-K37 WeakPolarHBondContact CA-O 3.23Å; V22-K37 HydrophobicContact CB-CB 4.08Å; V22-K37 HydrophobicContact CG2-CB 4.15Å; V22-K37 PolarHBondContact N-O 3.33Å; V22-K37 PolarHBondContact O-N 3.41Å
38	V	98.2	Very high	97.1	Very high	21 Å²	21	60.7 Å²	60.7	13%	0.127	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.5	171	-178	0	0	0	0	108.6	V35 A44 H45 P51	V35-V38 HydrophobicContact CG1-CG2 3.45Å; V35-V38 VanDerWaalsContact CG1-CG2 3.45Å; V38-A44 HydrophobicContact CG1-CB 4.04Å; V38-H45 HydrophobicContact CG1-CB 3.73Å; V38-P51 HydrophobicContact CG2-CG 4.29Å
39	T	98	Very high	97.1	Very high	74 Å²	74	56.1 Å²	56.1	45%	0.454	30%	0.303	S	S	.	.			trans	-77.5	123.3	177.5	-57.7	0	0	0	0	108.8	G20 N41 G42 H45	G20-T39 WeakPolarHBondContact O-CB 3.37Å; G20-T39 PolarHBondContact O-N 3.38Å; G20-T39 PolarHBondContact O-OG1 3.35Å; T39-N41 PolarHBondContact O-N 3.19Å; T39-G42 PolarHBondContact O-N 3.24Å; T39-H45 WeakPolarHBondContact O-CB 3.43Å
40	R	96.8	Very high	97.2	Very high	200 Å²	200	55.6 Å²	55.6	76%	0.755	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	133.4	177.3	-174.2	170.6	-166.2	-83.5	1.2	110.1	G42	R40-G42 PolarHBondContact O-N 3.29Å; R40-G42 VanDerWaalsContact O-N 3.12Å
41	N	95.7	Very high	97.3	Very high	96 Å²	96	55.4 Å²	55.4	51%	0.513	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	63	7.4	-177.7	-62.2	25	0	0	0	115.6	T39 K46	T39-N41 PolarHBondContact O-N 3.19Å; N41-K46 WeakPolarHBondContact O-CE 3.37Å
42	G	96.3	Very high	97.4	Very high	15 Å²	15	53.4 Å²	53.4	16%	0.155	28%	0.277	C	S	.	.	S	Bend	trans	-70.5	174.8	171.5	0	0	0	0	0	113.1	T39 R40 A44 H45 K46	T39-G42 PolarHBondContact O-N 3.24Å; R40-G42 PolarHBondContact O-N 3.29Å; R40-G42 VanDerWaalsContact O-N 3.12Å; G42-A44 PolarHBondContact O-N 3.14Å; G42-H45 PolarHBondContact O-N 3.34Å; G42-K46 WeakPolarHBondContact O-CG 3.01Å; G42-K46 PolarHBondContact O-N 2.87Å; G42-K46 VanDerWaalsContact O-N 3.08Å
43	I	97.5	Very high	97.4	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.051	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-48.5	178.3	-66.2	161.9	0	0	0	110	L10 R12 K17 W19 H45 K46 S47	L10-I43 HydrophobicContact CB-CG2 4.16Å; L10-I43 HydrophobicContact CD2-CG2 4.45Å; R12-I43 HydrophobicContact CB-CD1 3.68Å; K17-I43 HydrophobicContact CD-CD1 3.72Å; K17-I43 HydrophobicContact CD-CG1 4.31Å; K17-I43 HydrophobicContact CG-CD1 3.88Å; W19-I43 HydrophobicContact CE3-CB 4.49Å; W19-I43 HydrophobicContact CE3-CD1 4.31Å; W19-I43 HydrophobicContact CE3-CG2 3.99Å; W19-I43 HydrophobicContact CZ3-CG2 4.26Å; W19-I43 PolarHBondContact O-N 2.94Å; I43-H45 VanDerWaalsContact C-N 3.34Å; I43-H45 PolarHBondContact O-N 3.49Å; I43-K46 PolarHBondContact O-N 3.05Å; I43-K46 VanDerWaalsContact O-N 3.11Å; I43-S47 PolarHBondContact O-N 2.92Å; I43-S47 PolarHBondContact O-OG 3.45Å
44	A	98	Very high	97.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.3	-45.6	179.1	0	0	0	0	0	113.1	L10 W19 F21 V38 G42 K46 S47 G48 L49	L10-A44 HydrophobicContact CD2-CB 3.88Å; W19-A44 WeakPolarHBondContact O-CB 3.41Å; W19-A44 PolarHBondContact O-N 3.35Å; F21-A44 HydrophobicContact CB-CB 3.88Å; F21-A44 HydrophobicContact CD1-CB 3.9Å; F21-A44 HydrophobicContact CG-CB 4.38Å; V38-A44 HydrophobicContact CG1-CB 4.04Å; G42-A44 PolarHBondContact O-N 3.14Å; A44-K46 PolarHBondContact O-N 3.06Å; A44-S47 PolarHBondContact O-N 3.41Å; A44-G48 PolarHBondContact O-N 2.93Å; A44-L49 HydrophobicContact CB-CB 4.17Å; A44-L49 HydrophobicContact CB-CD2 4.01Å; A44-L49 VanDerWaalsContact O-CB 3.28Å; A44-L49 WeakPolarHBondContact O-CB 3.35Å; A44-L49 PolarHBondContact O-N 3.26Å
45	H	97.7	Very high	97.4	Very high	92 Å²	92	50.6 Å²	50.6	43%	0.426	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-44	176.5	-175.6	-105.1	0	0	0	111.6	V38 T39 G42 I43 S47 G48	V38-H45 HydrophobicContact CG1-CB 3.73Å; T39-H45 WeakPolarHBondContact O-CB 3.43Å; G42-H45 PolarHBondContact O-N 3.34Å; I43-H45 VanDerWaalsContact C-N 3.34Å; I43-H45 PolarHBondContact O-N 3.49Å; H45-S47 VanDerWaalsContact C-N 3.32Å; H45-S47 PolarHBondContact O-N 3.09Å; H45-G48 PolarHBondContact O-N 3.17Å; H45-G48 VanDerWaalsContact O-N 3.17Å
46	K	97.2	Very high	97.4	Very high	156 Å²	156	53.1 Å²	53.1	68%	0.678	27%	0.271	S	S	*	.	H	α-helix	trans	-68.2	-30.4	179	-70	179.2	179.7	-171.8	0	112.9	N41 G42 I43 A44 G48	N41-K46 WeakPolarHBondContact O-CE 3.37Å; G42-K46 WeakPolarHBondContact O-CG 3.01Å; G42-K46 PolarHBondContact O-N 2.87Å; G42-K46 VanDerWaalsContact O-N 3.08Å; I43-K46 PolarHBondContact O-N 3.05Å; I43-K46 VanDerWaalsContact O-N 3.11Å; A44-K46 PolarHBondContact O-N 3.06Å; K46-G48 PolarHBondContact O-N 3.42Å
47	S	97	Very high	97.4	Very high	41 Å²	41	54.2 Å²	54.2	29%	0.287	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-7.1	173.9	-66.9	0	0	0	0	113.5	I8 S9 I43 A44 H45	I8-S47 WeakPolarHBondContact CG2-O 3.29Å; S9-S47 WeakPolarHBondContact O-CB 3.4Å; S9-S47 PolarHBondContact O-OG 3.25Å; I43-S47 PolarHBondContact O-N 2.92Å; I43-S47 PolarHBondContact O-OG 3.45Å; A44-S47 PolarHBondContact O-N 3.41Å; H45-S47 VanDerWaalsContact C-N 3.32Å; H45-S47 PolarHBondContact O-N 3.09Å
48	G	96.8	Very high	97.4	Very high	36 Å²	36	48.1 Å²	48.1	37%	0.371	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	15.2	179.4	0	0	0	0	0	115	A44 H45 K46 K88	A44-G48 PolarHBondContact O-N 2.93Å; H45-G48 PolarHBondContact O-N 3.17Å; H45-G48 VanDerWaalsContact O-N 3.17Å; K46-G48 PolarHBondContact O-N 3.42Å; G48-K88 PolarHBondContact O-NZ 3Å
49	L	97.6	Very high	97.3	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.			trans	-75.8	134.4	172.6	-160.5	71.5	0	0	0	109.9	I8 F21 V35 A44 D53 F84 V86	I8-L49 HydrophobicContact CD1-CD1 3.81Å; F21-L49 HydrophobicContact CB-CD2 3.92Å; F21-L49 HydrophobicContact CD1-CD2 4.14Å; F21-L49 HydrophobicContact CG-CD2 4.06Å; V35-L49 HydrophobicContact CG1-CD2 4.13Å; V35-L49 HydrophobicContact CG1-CG 4.24Å; V35-L49 HydrophobicContact CG2-CD1 3.87Å; V35-L49 HydrophobicContact CG2-CD2 3.77Å; V35-L49 HydrophobicContact CG2-CG 3.8Å; A44-L49 HydrophobicContact CB-CB 4.17Å; A44-L49 HydrophobicContact CB-CD2 4.01Å; A44-L49 VanDerWaalsContact O-CB 3.28Å; A44-L49 WeakPolarHBondContact O-CB 3.35Å; A44-L49 PolarHBondContact O-N 3.26Å; L49-D53 HydrophobicContact CD1-CB 4.39Å; L49-F84 HydrophobicContact CD1-CD2 4.26Å; L49-F84 HydrophobicContact CD2-CD2 4.4Å; L49-F84 HydrophobicContact CD2-CE2 4.28Å; L49-V86 HydrophobicContact CD1-CG1 4.36Å
50	E	97.5	Very high	97.2	Very high	63 Å²	63	49.2 Å²	49.2	29%	0.294	27%	0.265	S	S	.	.			trans	-131.4	153.3	-176.9	-65.8	175.3	119.4	0	0	111.5	V35 G52 D53 K88 R89	V35-E50 WeakPolarHBondContact CB-O 3.23Å; E50-G52 PolarHBondContact O-N 3.06Å; E50-D53 PolarHBondContact N-OD2 3.17Å; E50-D53 WeakPolarHBondContact O-CB 3.21Å; E50-D53 VanDerWaalsContact O-CG 3.29Å; E50-D53 PolarHBondContact O-N 3.28Å; E50-K88 WeakPolarHBondContact OE2-CE 3.48Å; E50-K88 IonicContact OE2-NZ 2.79Å; E50-K88 PolarHBondContact OE2-NZ 2.98Å; E50-R89 VanDerWaalsContact CD-NH2 3.26Å; E50-R89 IonicContact OE1-CZ 3.37Å; E50-R89 IonicContact OE1-NE 3.12Å; E50-R89 IonicContact OE1-NH2 2.96Å; E50-R89 PolarHBondContact OE1-NH2 2.95Å; E50-R89 IonicContact OE2-CZ 3.97Å; E50-R89 IonicContact OE2-NE 2.74Å; E50-R89 PolarHBondContact OE2-NE 3.46Å; E50-R89 VanDerWaalsContact OE2-NE 3.12Å; E50-R89 IonicContact OE2-NH2 2.73Å; E50-R89 PolarHBondContact OE2-NH2 3.14Å
51	P	97.7	Very high	97.2	Very high	66 Å²	66	41.5 Å²	41.5	43%	0.429	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	132.5	169.6	-23.3	34.4	0	0	0	111.5	V35 V38 V93	V35-P51 CarbonylContact O-C 3.48Å; V35-P51 VanDerWaalsContact O-CA 3.29Å; V35-P51 WeakPolarHBondContact O-CA 3.45Å; V38-P51 HydrophobicContact CG2-CG 4.29Å; P51-V93 HydrophobicContact CB-CG2 4.33Å
52	G	97.4	Very high	97.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.01	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.6	-6.7	-178.8	0	0	0	0	0	114.9	V35 E50 V54 R89 D90 F91 V93	V35-G52 PolarHBondContact O-N 2.94Å; E50-G52 PolarHBondContact O-N 3.06Å; G52-V54 PolarHBondContact O-N 2.76Å; G52-R89 CarbonylContact O-C 3.47Å; G52-R89 WeakPolarHBondContact O-CA 3.48Å; G52-D90 PolarHBondContact O-N 3.05Å; G52-D90 VanDerWaalsContact O-N 3.12Å; G52-F91 VanDerWaalsContact CA-O 3.23Å; G52-F91 WeakPolarHBondContact CA-O 3.33Å; G52-F91 PolarHBondContact O-N 3.46Å; G52-V93 VanDerWaalsContact CA-CG2 3.5Å; G52-V93 VanDerWaalsContact N-CG2 3.29Å
53	D	97.8	Very high	97.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-65.9	129.7	169.3	-66.9	-18.5	0	0	0	110.2	F34 V35 L49 E50 V86 K87 K88 R89	F34-D53 CarbonylContact C-O 3.56Å; F34-D53 VanDerWaalsContact CA-O 3.29Å; F34-D53 WeakPolarHBondContact CA-O 3.45Å; V35-D53 HydrophobicContact CB-CB 4.42Å; V35-D53 HydrophobicContact CG2-CB 4.04Å; V35-D53 PolarHBondContact N-O 3.44Å; L49-D53 HydrophobicContact CD1-CB 4.39Å; E50-D53 PolarHBondContact N-OD2 3.17Å; E50-D53 WeakPolarHBondContact O-CB 3.21Å; E50-D53 VanDerWaalsContact O-CG 3.29Å; E50-D53 PolarHBondContact O-N 3.28Å; D53-V86 HydrophobicContact CB-CB 4.39Å; D53-K87 WeakPolarHBondContact CA-O 3.5Å; D53-K88 VanDerWaalsContact OD1-CA 3.3Å; D53-K88 WeakPolarHBondContact OD1-CA 3.42Å; D53-K88 WeakPolarHBondContact OD1-CD 3.38Å; D53-K88 WeakPolarHBondContact OD1-CE 3.36Å; D53-K88 IonicContact OD1-NZ 2.88Å; D53-K88 PolarHBondContact OD1-NZ 2.95Å; D53-K88 IonicContact OD2-NZ 3.88Å; D53-K88 PolarHBondContact OD2-NZ 3.1Å; D53-R89 PolarHBondContact OD1-N 3.34Å
54	V	97.4	Very high	97.1	Very high	11 Å²	11	46.1 Å²	46.1	7%	0.067	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	125	178	174	0	0	0	0	109.3	P32 F34 G52 L56 V86 K87 D90 F91	P32-V54 HydrophobicContact CB-CG1 4.17Å; F34-V54 HydrophobicContact CB-CG2 4.23Å; G52-V54 PolarHBondContact O-N 2.76Å; V54-L56 HydrophobicContact CG1-CD2 4.31Å; V54-V86 CarbonylContact O-C 3.59Å; V54-V86 WeakPolarHBondContact O-CA 3.45Å; V54-K87 HydrophobicContact CB-CB 4.49Å; V54-K87 PolarHBondContact N-O 3.1Å; V54-K87 PolarHBondContact O-N 3.27Å; V54-D90 HydrophobicContact CB-CB 4.25Å; V54-D90 HydrophobicContact CG2-CB 3.81Å; V54-F91 HydrophobicContact CG2-CB 3.67Å
55	I	97.8	Very high	97	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	127.5	-179.7	-45.7	-56.3	0	0	0	109	L23 V33 V35 I58 I63 F84 V86	L23-I55 HydrophobicContact CD2-CG1 4.02Å; V33-I55 HydrophobicContact CG1-CB 4.14Å; V33-I55 HydrophobicContact CG1-CG1 4.2Å; V33-I55 PolarHBondContact O-N 3.16Å; V35-I55 HydrophobicContact CG2-CD1 3.89Å; I55-I58 HydrophobicContact CG2-CD1 4.49Å; I55-I58 HydrophobicContact CG2-CG1 3.92Å; I55-I63 HydrophobicContact CB-CD1 3.79Å; I55-I63 HydrophobicContact CG2-CD1 3.63Å; I55-I63 WeakPolarHBondContact O-CD1 3.33Å; I55-F84 HydrophobicContact CD1-CB 4.33Å; I55-F84 HydrophobicContact CD1-CD2 4Å; I55-F84 HydrophobicContact CD1-CE2 4.41Å; I55-F84 HydrophobicContact CD1-CG 4.12Å; I55-F84 HydrophobicContact CG2-CD1 4Å; I55-F84 HydrophobicContact CG2-CE1 4.43Å; I55-F84 HydrophobicContact CG2-CG 4.37Å; I55-V86 HydrophobicContact CD1-CG1 3.46Å; I55-V86 VanDerWaalsContact CD1-CG1 3.46Å
56	L	97.2	Very high	97	Very high	53 Å²	53	46.1 Å²	46.1	28%	0.277	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-33.6	176.8	-57.9	-177.2	0	0	0	112.3	P5 V54 I63 M85 K87	P5-L56 HydrophobicContact CB-CD1 4.14Å; P5-L56 HydrophobicContact CG-CD1 4.05Å; V54-L56 HydrophobicContact CG1-CD2 4.31Å; L56-I63 WeakPolarHBondContact O-CG1 3.47Å; L56-I63 PolarHBondContact O-N 3.22Å; L56-I63 VanDerWaalsContact O-N 3.13Å; L56-M85 PolarHBondContact N-O 3.22Å; L56-K87 HydrophobicContact CD1-CD 4.25Å; L56-K87 HydrophobicContact CD1-CG 3.9Å; L56-K87 HydrophobicContact CD2-CD 4.38Å; L56-K87 HydrophobicContact CG-CG 4.39Å
57	K	97.7	Very high	97	Very high	70 Å²	70	41.1 Å²	41.1	30%	0.304	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	143.1	-175.1	-162.1	-175.9	-179.3	-176.1	0	110.4	C59 A60 T61 F84 M85	K57-C59 WeakPolarHBondContact CD-O 3.21Å; K57-C59 WeakPolarHBondContact CE-O 3.33Å; K57-A60 WeakPolarHBondContact CE-O 3.37Å; K57-A60 PolarHBondContact NZ-O 3.14Å; K57-T61 WeakPolarHBondContact CA-O 3.36Å; K57-T61 WeakPolarHBondContact CG-O 3.37Å; K57-F84 WeakPolarHBondContact O-CA 3.39Å; K57-M85 HydrophobicContact CB-CB 3.64Å; K57-M85 PolarHBondContact N-O 2.97Å; K57-M85 PolarHBondContact O-N 3.33Å
58	I	97.9	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	114.3	172.8	-56.7	-178.9	0	0	0	108	I55 A60 T61 I63 V71 E74 I75 L82 D83 F84	I55-I58 HydrophobicContact CG2-CD1 4.49Å; I55-I58 HydrophobicContact CG2-CG1 3.92Å; I58-A60 PolarHBondContact O-N 3.28Å; I58-A60 VanDerWaalsContact O-N 3.12Å; I58-T61 PolarHBondContact N-O 3.25Å; I58-T61 PolarHBondContact O-N 3.07Å; I58-I63 HydrophobicContact CB-CG2 4.14Å; I58-I63 HydrophobicContact CD1-CD1 4.33Å; I58-I63 HydrophobicContact CD1-CG2 3.75Å; I58-I63 HydrophobicContact CG1-CD1 4.4Å; I58-I63 HydrophobicContact CG1-CG2 3.62Å; I58-V71 HydrophobicContact CD1-CG1 3.96Å; I58-E74 HydrophobicContact CB-CB 4.46Å; I58-E74 HydrophobicContact CD1-CB 4.31Å; I58-E74 HydrophobicContact CG2-CB 4.31Å; I58-I75 HydrophobicContact CD1-CD1 4.2Å; I58-I75 HydrophobicContact CD1-CG1 3.75Å; I58-I75 HydrophobicContact CG2-CG1 4.39Å; I58-L82 HydrophobicContact CG2-CD1 3.71Å; I58-D83 CarbonylContact C-O 3.47Å; I58-F84 HydrophobicContact CB-CD1 4.43Å; I58-F84 HydrophobicContact CB-CE1 4.41Å; I58-F84 HydrophobicContact CD1-CE1 4.03Å; I58-F84 HydrophobicContact CG1-CD1 3.91Å; I58-F84 HydrophobicContact CG1-CE1 3.78Å; I58-F84 HydrophobicContact CG2-CD1 4.32Å; I58-F84 HydrophobicContact CG2-CE1 4.03Å
59	C	96.7	Very high	97.1	Very high	39 Å²	39	41.7 Å²	41.7	26%	0.264	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	-114.3	-171.8	-55	0	0	0	0	111	K57 D83	K57-C59 WeakPolarHBondContact CD-O 3.21Å; K57-C59 WeakPolarHBondContact CE-O 3.33Å; C59-D83 PolarHBondContact N-O 2.95Å
60	A	95.2	Very high	97.1	Very high	80 Å²	80	46.3 Å²	46.3	66%	0.661	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.4	178.1	0	0	0	0	0	114	K57 I58	K57-A60 WeakPolarHBondContact CE-O 3.37Å; K57-A60 PolarHBondContact NZ-O 3.14Å; I58-A60 PolarHBondContact O-N 3.28Å; I58-A60 VanDerWaalsContact O-N 3.12Å
61	T	97.1	Very high	97.1	Very high	37 Å²	37	43.4 Å²	43.4	23%	0.227	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.2	-168.9	-44.5	0	0	0	0	112	K57 I58 M66 E74 R77	K57-T61 WeakPolarHBondContact CA-O 3.36Å; K57-T61 WeakPolarHBondContact CG-O 3.37Å; I58-T61 PolarHBondContact N-O 3.25Å; I58-T61 PolarHBondContact O-N 3.07Å; T61-M66 HydrophobicContact CG2-CE 3.63Å; T61-E74 WeakPolarHBondContact CB-OE2 3.48Å; T61-E74 PolarHBondContact OG1-OE2 3.05Å; T61-R77 PolarHBondContact OG1-NH2 3.23Å
62	P	96.9	Very high	97.1	Very high	80 Å²	80	45.7 Å²	45.7	52%	0.519	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	139.7	168.5	28.8	-32.5	0	0	0	110	M66	P62-M66 WeakPolarHBondContact O-CE 3.47Å
63	I	96.6	Very high	97.1	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.041	30%	0.299	C	S	.	.			trans	-104.6	8.2	-176	66.2	168.4	0	0	0	114	V33 I55 L56 I58 G65 M66	V33-I63 HydrophobicContact CB-CD1 3.75Å; V33-I63 HydrophobicContact CG1-CD1 3.88Å; V33-I63 HydrophobicContact CG2-CD1 3.94Å; I55-I63 HydrophobicContact CB-CD1 3.79Å; I55-I63 HydrophobicContact CG2-CD1 3.63Å; I55-I63 WeakPolarHBondContact O-CD1 3.33Å; L56-I63 WeakPolarHBondContact O-CG1 3.47Å; L56-I63 PolarHBondContact O-N 3.22Å; L56-I63 VanDerWaalsContact O-N 3.13Å; I58-I63 HydrophobicContact CB-CG2 4.14Å; I58-I63 HydrophobicContact CD1-CD1 4.33Å; I58-I63 HydrophobicContact CD1-CG2 3.75Å; I58-I63 HydrophobicContact CG1-CD1 4.4Å; I58-I63 HydrophobicContact CG1-CG2 3.62Å; I63-G65 PolarHBondContact O-N 3.45Å; I63-M66 HydrophobicContact CB-CG 4.39Å; I63-M66 HydrophobicContact CB-SD 3.91Å; I63-M66 HydrophobicContact CG2-SD 3.82Å; I63-M66 WeakPolarHBondContact O-CB 3.45Å; I63-M66 PolarHBondContact O-N 3.46Å; I63-M66 VanDerWaalsContact O-N 3.14Å
64	T	94.8	Very high	97	Very high	131 Å²	131	49.6 Å²	49.6	80%	0.804	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	124.8	173.5	-48.9	0	0	0	0	109.8
65	G	95.3	Very high	97	Very high	55 Å²	55	49.8 Å²	49.8	57%	0.567	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-2.8	178.9	0	0	0	0	0	115.4	V27 I63	V27-G65 WeakPolarHBondContact CG2-O 3.4Å; I63-G65 PolarHBondContact O-N 3.45Å
66	M	97.5	Very high	96.9	Very high	37 Å²	37	56.1 Å²	56.1	18%	0.182	34%	0.34	C	S	.	.			trans	-81.6	143.2	-178	-67.5	-170	173.2	0	0	112.9	V27 T61 P62 I63 Q70 V71 E74	V27-M66 PolarHBondContact N-O 3.22Å; T61-M66 HydrophobicContact CG2-CE 3.63Å; P62-M66 WeakPolarHBondContact O-CE 3.47Å; I63-M66 HydrophobicContact CB-CG 4.39Å; I63-M66 HydrophobicContact CB-SD 3.91Å; I63-M66 HydrophobicContact CG2-SD 3.82Å; I63-M66 WeakPolarHBondContact O-CB 3.45Å; I63-M66 PolarHBondContact O-N 3.46Å; I63-M66 VanDerWaalsContact O-N 3.14Å; M66-Q70 HydrophobicContact CB-CB 4.12Å; M66-Q70 HydrophobicContact CG-CB 4.4Å; M66-Q70 HydrophobicContact SD-CB 4.37Å; M66-V71 HydrophobicContact CB-CG2 3.86Å; M66-E74 HydrophobicContact CE-CG 4.35Å; M66-E74 HydrophobicContact SD-CG 4.23Å
67	V	98	Very high	96.9	Very high	50 Å²	50	60.1 Å²	60.1	30%	0.303	35%	0.351	S	S	.	.			trans	-76	157.9	167.6	-59.7	0	0	0	0	110.7	V27 D28 A69 Q70 V71	V27-V67 HydrophobicContact CG2-CB 4.47Å; V27-V67 HydrophobicContact CG2-CG1 3.64Å; D28-V67 HydrophobicContact CB-CB 4.17Å; D28-V67 HydrophobicContact CB-CG1 3.97Å; D28-V67 VanDerWaalsContact OD1-CA 3.23Å; D28-V67 WeakPolarHBondContact OD1-CA 2.99Å; D28-V67 WeakPolarHBondContact OD1-CB 3.14Å; V67-A69 HydrophobicContact CG2-CB 4.34Å; V67-A69 PolarHBondContact O-N 3.45Å; V67-A69 VanDerWaalsContact O-N 3.1Å; V67-Q70 HydrophobicContact CG2-CB 4.12Å; V67-Q70 HydrophobicContact CG2-CG 3.66Å; V67-Q70 WeakPolarHBondContact O-CB 3.47Å; V67-Q70 PolarHBondContact O-N 3.11Å; V67-V71 PolarHBondContact O-N 3.42Å; V67-V71 VanDerWaalsContact O-N 3.1Å
68	H	97.5	Very high	96.8	Very high	22 Å²	22	57.6 Å²	57.6	10%	0.102	34%	0.343	C	S	.	.	H	α-helix	trans	-52.5	-37.7	-177.8	-173	81	0	0	0	113.1	G25 D28 K72	G25-H68 WeakPolarHBondContact O-CB 3.17Å; G25-H68 PolarHBondContact O-ND1 2.91Å; D28-H68 PolarHBondContact OD1-N 2.89Å; H68-K72 PolarHBondContact CD2-NZ 3.4Å; H68-K72 WeakPolarHBondContact NE2-CE 3.5Å; H68-K72 PolarHBondContact NE2-NZ 2.75Å; H68-K72 PolarHBondContact O-N 3.43Å; H68-K72 VanDerWaalsContact O-N 3.12Å
69	A	97.5	Very high	96.7	Very high	67 Å²	67	58.8 Å²	58.8	55%	0.554	36%	0.356	S	S	*	.	H	α-helix	trans	-66.6	-39.1	177	0	0	0	0	0	113.2	V67 K72 A73	V67-A69 HydrophobicContact CG2-CB 4.34Å; V67-A69 PolarHBondContact O-N 3.45Å; V67-A69 VanDerWaalsContact O-N 3.1Å; A69-K72 PolarHBondContact O-N 3.39Å; A69-A73 PolarHBondContact O-N 3.45Å
70	Q	97.8	Very high	96.7	Very high	98 Å²	98	59.1 Å²	59.1	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-67.5	-41.6	176.9	-72.3	172.3	-38.1	0	0	111.1	M66 V67 K72 A73 E74	M66-Q70 HydrophobicContact CB-CB 4.12Å; M66-Q70 HydrophobicContact CG-CB 4.4Å; M66-Q70 HydrophobicContact SD-CB 4.37Å; V67-Q70 HydrophobicContact CG2-CB 4.12Å; V67-Q70 HydrophobicContact CG2-CG 3.66Å; V67-Q70 WeakPolarHBondContact O-CB 3.47Å; V67-Q70 PolarHBondContact O-N 3.11Å; Q70-K72 VanDerWaalsContact C-N 3.3Å; Q70-K72 PolarHBondContact O-N 3.12Å; Q70-A73 WeakPolarHBondContact O-CB 3.3Å; Q70-A73 PolarHBondContact O-N 3.37Å; Q70-A73 VanDerWaalsContact O-N 3.11Å; Q70-E74 PolarHBondContact O-N 2.91Å
71	V	97.8	Very high	96.8	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.012	35%	0.348	C	S	.	.	H	α-helix	trans	-56.8	-45.3	174	175.2	0	0	0	0	110.7	L23 V33 I58 M66 V67 E74 I75	L23-V71 HydrophobicContact CD1-CG1 4.2Å; V33-V71 HydrophobicContact CG1-CG1 3.79Å; V33-V71 HydrophobicContact CG2-CG1 4.45Å; V33-V71 HydrophobicContact CG2-CG2 3.76Å; I58-V71 HydrophobicContact CD1-CG1 3.96Å; M66-V71 HydrophobicContact CB-CG2 3.86Å; V67-V71 PolarHBondContact O-N 3.42Å; V67-V71 VanDerWaalsContact O-N 3.1Å; V71-E74 PolarHBondContact O-N 3.11Å; V71-I75 HydrophobicContact CG1-CD1 4.34Å; V71-I75 WeakPolarHBondContact O-CG1 3.47Å; V71-I75 PolarHBondContact O-N 3.02Å
72	K	96.9	Very high	96.9	Very high	114 Å²	114	58.1 Å²	58.1	50%	0.496	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-43.9	174.9	-76.9	177.4	171.8	163.9	0	112.2	H68 A69 Q70 E74 I75 L76	H68-K72 PolarHBondContact CD2-NZ 3.4Å; H68-K72 WeakPolarHBondContact NE2-CE 3.5Å; H68-K72 PolarHBondContact NE2-NZ 2.75Å; H68-K72 PolarHBondContact O-N 3.43Å; H68-K72 VanDerWaalsContact O-N 3.12Å; A69-K72 PolarHBondContact O-N 3.39Å; Q70-K72 VanDerWaalsContact C-N 3.3Å; Q70-K72 PolarHBondContact O-N 3.12Å; K72-E74 VanDerWaalsContact C-N 3.32Å; K72-E74 PolarHBondContact O-N 3.02Å; K72-I75 PolarHBondContact O-N 3.01Å; K72-L76 WeakPolarHBondContact O-CG 3.38Å; K72-L76 PolarHBondContact O-N 2.95Å
73	A	97.4	Very high	96.9	Very high	51 Å²	51	56.6 Å²	56.6	42%	0.421	33%	0.325	S	S	.	.	H	α-helix	trans	-60.2	-41.9	178.4	0	0	0	0	0	112	A69 Q70 I75 L76 R77	A69-A73 PolarHBondContact O-N 3.45Å; Q70-A73 WeakPolarHBondContact O-CB 3.3Å; Q70-A73 PolarHBondContact O-N 3.37Å; Q70-A73 VanDerWaalsContact O-N 3.11Å; A73-I75 VanDerWaalsContact C-N 3.33Å; A73-I75 PolarHBondContact O-N 2.98Å; A73-L76 PolarHBondContact O-N 3.23Å; A73-R77 WeakPolarHBondContact O-CB 3.28Å; A73-R77 PolarHBondContact O-N 3.42Å
74	E	97.3	Very high	97	Very high	31 Å²	31	56.2 Å²	56.2	15%	0.145	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-37.1	177.2	-73.8	-62.8	103.6	0	0	112.7	I58 T61 M66 Q70 V71 K72 R77 A78	I58-E74 HydrophobicContact CB-CB 4.46Å; I58-E74 HydrophobicContact CD1-CB 4.31Å; I58-E74 HydrophobicContact CG2-CB 4.31Å; T61-E74 WeakPolarHBondContact CB-OE2 3.48Å; T61-E74 PolarHBondContact OG1-OE2 3.05Å; M66-E74 HydrophobicContact CE-CG 4.35Å; M66-E74 HydrophobicContact SD-CG 4.23Å; Q70-E74 PolarHBondContact O-N 2.91Å; V71-E74 PolarHBondContact O-N 3.11Å; K72-E74 VanDerWaalsContact C-N 3.32Å; K72-E74 PolarHBondContact O-N 3.02Å; E74-R77 PolarHBondContact O-N 3.38Å; E74-R77 IonicContact OE1-CZ 3.91Å; E74-R77 IonicContact OE1-NE 3.04Å; E74-R77 PolarHBondContact OE1-NE 3.37Å; E74-R77 IonicContact OE1-NH2 3.75Å; E74-R77 IonicContact OE2-CZ 3.43Å; E74-R77 IonicContact OE2-NE 3.34Å; E74-R77 PolarHBondContact OE2-NE 3.12Å; E74-R77 IonicContact OE2-NH2 3.21Å; E74-R77 PolarHBondContact OE2-NH2 3.25Å; E74-A78 PolarHBondContact O-N 3.39Å
75	I	96.8	Very high	97.1	Very high	16 Å²	16	53.1 Å²	53.1	8%	0.082	30%	0.3	C	S	.	.	H	α-helix	trans	-67.6	-40.7	175.5	-64.9	167.6	0	0	0	111.2	F21 L23 I58 V71 K72 A73 R77 A78 L82 F84	F21-I75 HydrophobicContact CE2-CD1 4.23Å; F21-I75 HydrophobicContact CZ-CD1 4.3Å; F21-I75 HydrophobicContact CZ-CG2 4.15Å; L23-I75 HydrophobicContact CD1-CD1 3.29Å; I58-I75 HydrophobicContact CD1-CD1 4.2Å; I58-I75 HydrophobicContact CD1-CG1 3.75Å; I58-I75 HydrophobicContact CG2-CG1 4.39Å; V71-I75 HydrophobicContact CG1-CD1 4.34Å; V71-I75 WeakPolarHBondContact O-CG1 3.47Å; V71-I75 PolarHBondContact O-N 3.02Å; K72-I75 PolarHBondContact O-N 3.01Å; A73-I75 VanDerWaalsContact C-N 3.33Å; A73-I75 PolarHBondContact O-N 2.98Å; I75-R77 VanDerWaalsContact C-N 3.34Å; I75-A78 WeakPolarHBondContact O-CB 3.42Å; I75-A78 PolarHBondContact O-N 2.88Å; I75-L82 HydrophobicContact CG1-CD1 4.47Å; I75-L82 HydrophobicContact CG2-CD1 4.39Å; I75-L82 HydrophobicContact CG2-CD2 3.99Å; I75-F84 HydrophobicContact CD1-CE1 4.45Å; I75-F84 HydrophobicContact CD1-CZ 4.18Å; I75-F84 HydrophobicContact CG1-CE1 4.18Å; I75-F84 HydrophobicContact CG1-CZ 4.26Å
76	L	95.7	Very high	97.2	Very high	137 Å²	137	50.5 Å²	50.5	72%	0.717	27%	0.273	S	S	*	.	H	α-helix	trans	-65	-41.4	176.8	-68.3	170.4	0	0	0	110.9	K72 A73 A78 G79	K72-L76 WeakPolarHBondContact O-CG 3.38Å; K72-L76 PolarHBondContact O-N 2.95Å; A73-L76 PolarHBondContact O-N 3.23Å; L76-A78 VanDerWaalsContact C-N 3.25Å; L76-A78 PolarHBondContact O-N 3.34Å; L76-G79 PolarHBondContact O-N 3.04Å; L76-G79 VanDerWaalsContact O-N 3.11Å
77	R	96	Very high	97.2	Very high	137 Å²	137	52.4 Å²	52.4	52%	0.517	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-30.9	177.7	-169.3	-176	60.5	66.4	2.5	113	T61 A73 E74 I75 G79	T61-R77 PolarHBondContact OG1-NH2 3.23Å; A73-R77 WeakPolarHBondContact O-CB 3.28Å; A73-R77 PolarHBondContact O-N 3.42Å; E74-R77 PolarHBondContact O-N 3.38Å; E74-R77 IonicContact OE1-CZ 3.91Å; E74-R77 IonicContact OE1-NE 3.04Å; E74-R77 PolarHBondContact OE1-NE 3.37Å; E74-R77 IonicContact OE1-NH2 3.75Å; E74-R77 IonicContact OE2-CZ 3.43Å; E74-R77 IonicContact OE2-NE 3.34Å; E74-R77 PolarHBondContact OE2-NE 3.12Å; E74-R77 IonicContact OE2-NH2 3.21Å; E74-R77 PolarHBondContact OE2-NH2 3.25Å; I75-R77 VanDerWaalsContact C-N 3.34Å; R77-G79 PolarHBondContact O-N 2.76Å
78	A	96	Very high	97.1	Very high	17 Å²	17	52 Å²	52	14%	0.14	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.7	176.4	0	0	0	0	0	113.6	E74 I75 L76 N80 D81 L82	E74-A78 PolarHBondContact O-N 3.39Å; I75-A78 WeakPolarHBondContact O-CB 3.42Å; I75-A78 PolarHBondContact O-N 2.88Å; L76-A78 VanDerWaalsContact C-N 3.25Å; L76-A78 PolarHBondContact O-N 3.34Å; A78-N80 PolarHBondContact O-N 2.69Å; A78-N80 VanDerWaalsContact O-N 3.11Å; A78-D81 PolarHBondContact O-N 3.32Å; A78-L82 HydrophobicContact CB-CB 4.29Å; A78-L82 HydrophobicContact CB-CD1 3.61Å
79	G	95.9	Very high	96.9	Very high	26 Å²	26	59 Å²	59	27%	0.268	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	-109.2	173.4	0	0	0	0	0	113.1	R12 W19 L76 R77	R12-G79 PolarHBondContact NE-O 3.25Å; R12-G79 VanDerWaalsContact NE-O 3.16Å; R12-G79 PolarHBondContact NH2-O 3.31Å; W19-G79 VanDerWaalsContact CZ2-O 3.28Å; W19-G79 WeakPolarHBondContact CZ2-O 3.47Å; L76-G79 PolarHBondContact O-N 3.04Å; L76-G79 VanDerWaalsContact O-N 3.11Å; R77-G79 PolarHBondContact O-N 2.76Å
80	N	97.3	Very high	96.8	Very high	46 Å²	46	60.7 Å²	60.7	25%	0.246	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-4.7	-177.2	-69.1	-20.6	0	0	0	113.8	R12 S15 W19 A78	R12-N80 HydrophobicContact CG-CB 3.94Å; R12-N80 WeakPolarHBondContact CG-OD1 3.29Å; R12-N80 PolarHBondContact N-O 3.26Å; R12-N80 PolarHBondContact NE-OD1 3.23Å; R12-N80 WeakPolarHBondContact O-CB 2.96Å; S15-N80 PolarHBondContact OG-ND2 3.13Å; S15-N80 PolarHBondContact OG-OD1 3.39Å; W19-N80 WeakPolarHBondContact CH2-O 3.29Å; A78-N80 PolarHBondContact O-N 2.69Å; A78-N80 VanDerWaalsContact O-N 3.11Å
81	D	97.3	Very high	96.8	Very high	96 Å²	96	57.8 Å²	57.8	51%	0.513	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	97.4	-179.1	-65	-77.3	0	0	0	109	R11 A78	R11-D81 WeakPolarHBondContact CD-OD1 3.23Å; R11-D81 IonicContact NE-OD1 2.79Å; R11-D81 PolarHBondContact NE-OD1 2.95Å; A78-D81 PolarHBondContact O-N 3.32Å
82	L	98	Very high	96.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.6	-175.7	178.6	66.1	0	0	0	109.7	L10 R11 W19 F21 I58 I75 A78 F84	L10-L82 HydrophobicContact CB-CB 4.27Å; L10-L82 PolarHBondContact N-O 3.41Å; L10-L82 PolarHBondContact O-N 3.3Å; R11-L82 PolarHBondContact NH1-O 3.12Å; W19-L82 HydrophobicContact CD2-CD2 4.13Å; W19-L82 HydrophobicContact CG-CD2 4.41Å; W19-L82 HydrophobicContact CH2-CB 3.68Å; W19-L82 HydrophobicContact CZ2-CB 3.64Å; W19-L82 HydrophobicContact CZ2-CD2 4.12Å; W19-L82 HydrophobicContact CZ3-CB 4.34Å; F21-L82 HydrophobicContact CE1-CD2 3.89Å; F21-L82 HydrophobicContact CZ-CD2 3.97Å; I58-L82 HydrophobicContact CG2-CD1 3.71Å; I75-L82 HydrophobicContact CG1-CD1 4.47Å; I75-L82 HydrophobicContact CG2-CD1 4.39Å; I75-L82 HydrophobicContact CG2-CD2 3.99Å; A78-L82 HydrophobicContact CB-CB 4.29Å; A78-L82 HydrophobicContact CB-CD1 3.61Å; L82-F84 HydrophobicContact CD1-CD1 4.23Å; L82-F84 HydrophobicContact CD1-CE1 3.67Å; L82-F84 HydrophobicContact CD1-CZ 4.13Å; L82-F84 HydrophobicContact CD2-CE1 4.02Å; L82-F84 HydrophobicContact CD2-CE2 4.02Å; L82-F84 HydrophobicContact CD2-CZ 3.59Å; L82-F84 HydrophobicContact CG-CD1 4.35Å; L82-F84 HydrophobicContact CG-CE1 3.92Å; L82-F84 HydrophobicContact CG-CE2 4.46Å; L82-F84 HydrophobicContact CG-CZ 4Å
83	D	98.1	Very high	96.7	Very high	47 Å²	47	58 Å²	58	25%	0.251	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.8	174.9	-68.7	-35.4	0	0	0	109.9	S9 R11 I58 C59	S9-D83 VanDerWaalsContact CA-OD1 3.3Å; S9-D83 WeakPolarHBondContact CA-OD1 3.48Å; S9-D83 WeakPolarHBondContact CB-OD1 3.17Å; S9-D83 PolarHBondContact OG-OD1 3.31Å; R11-D83 IonicContact CZ-OD1 3.88Å; R11-D83 IonicContact CZ-OD2 2.69Å; R11-D83 IonicContact NH1-OD1 3.1Å; R11-D83 PolarHBondContact NH1-OD1 2.81Å; R11-D83 IonicContact NH1-OD2 3.21Å; R11-D83 VanDerWaalsContact NH2-CG 3.33Å; R11-D83 IonicContact NH2-OD1 3.99Å; R11-D83 PolarHBondContact NH2-OD1 3.14Å; R11-D83 IonicContact NH2-OD2 3.23Å; R11-D83 PolarHBondContact NH2-OD2 2.95Å; R11-D83 VanDerWaalsContact NH2-OD2 3.1Å; I58-D83 CarbonylContact C-O 3.47Å; C59-D83 PolarHBondContact N-O 2.95Å
84	F	98.1	Very high	96.7	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135.8	172	-69.3	-33.5	0	0	0	110.2	V7 I8 L10 F21 L49 I55 K57 I58 I75 L82 V86	V7-F84 CarbonylContact C-O 3.54Å; V7-F84 VanDerWaalsContact CA-O 3.27Å; V7-F84 WeakPolarHBondContact CA-O 3.49Å; I8-F84 PolarHBondContact N-O 3.39Å; I8-F84 PolarHBondContact O-N 3.22Å; L10-F84 HydrophobicContact CD1-CD2 3.78Å; L10-F84 HydrophobicContact CD1-CE2 4.16Å; L10-F84 HydrophobicContact CD1-CG 4.45Å; F21-F84 AromaticContact CE1-CE2 3.95Å; F21-F84 HydrophobicContact CE1-CE2 3.95Å; F21-F84 HydrophobicContact CE1-CZ 4.18Å; F21-F84 HydrophobicContact CE2-CE2 4.36Å; F21-F84 HydrophobicContact CE2-CZ 4.2Å; F21-F84 AromaticContact CZ-CE2 3.88Å; F21-F84 HydrophobicContact CZ-CE2 3.88Å; F21-F84 AromaticContact CZ-CZ 3.7Å; F21-F84 HydrophobicContact CZ-CZ 3.7Å; L49-F84 HydrophobicContact CD1-CD2 4.26Å; L49-F84 HydrophobicContact CD2-CD2 4.4Å; L49-F84 HydrophobicContact CD2-CE2 4.28Å; I55-F84 HydrophobicContact CD1-CB 4.33Å; I55-F84 HydrophobicContact CD1-CD2 4Å; I55-F84 HydrophobicContact CD1-CE2 4.41Å; I55-F84 HydrophobicContact CD1-CG 4.12Å; I55-F84 HydrophobicContact CG2-CD1 4Å; I55-F84 HydrophobicContact CG2-CE1 4.43Å; I55-F84 HydrophobicContact CG2-CG 4.37Å; K57-F84 WeakPolarHBondContact O-CA 3.39Å; I58-F84 HydrophobicContact CB-CD1 4.43Å; I58-F84 HydrophobicContact CB-CE1 4.41Å; I58-F84 HydrophobicContact CD1-CE1 4.03Å; I58-F84 HydrophobicContact CG1-CD1 3.91Å; I58-F84 HydrophobicContact CG1-CE1 3.78Å; I58-F84 HydrophobicContact CG2-CD1 4.32Å; I58-F84 HydrophobicContact CG2-CE1 4.03Å; I75-F84 HydrophobicContact CD1-CE1 4.45Å; I75-F84 HydrophobicContact CD1-CZ 4.18Å; I75-F84 HydrophobicContact CG1-CE1 4.18Å; I75-F84 HydrophobicContact CG1-CZ 4.26Å; L82-F84 HydrophobicContact CD1-CD1 4.23Å; L82-F84 HydrophobicContact CD1-CE1 3.67Å; L82-F84 HydrophobicContact CD1-CZ 4.13Å; L82-F84 HydrophobicContact CD2-CE1 4.02Å; L82-F84 HydrophobicContact CD2-CE2 4.02Å; L82-F84 HydrophobicContact CD2-CZ 3.59Å; L82-F84 HydrophobicContact CG-CD1 4.35Å; L82-F84 HydrophobicContact CG-CE1 3.92Å; L82-F84 HydrophobicContact CG-CE2 4.46Å; L82-F84 HydrophobicContact CG-CZ 4Å; F84-V86 HydrophobicContact CB-CG1 3.68Å
85	M	97.9	Very high	96.6	Very high	66 Å²	66	60.3 Å²	60.3	33%	0.325	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.3	159.6	-172.2	175.7	-76.2	0	0	107.9	P5 V6 V7 L56 K57	P5-M85 HydrophobicContact CB-CG 3.89Å; P5-M85 HydrophobicContact CB-SD 4.29Å; V6-M85 WeakPolarHBondContact O-CA 2.91Å; V7-M85 HydrophobicContact CG2-CE 4.16Å; L56-M85 PolarHBondContact N-O 3.22Å; K57-M85 HydrophobicContact CB-CB 3.64Å; K57-M85 PolarHBondContact N-O 2.97Å; K57-M85 PolarHBondContact O-N 3.33Å
86	V	97.5	Very high	96.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.8	-171.3	-50.6	0	0	0	0	112.5	P5 V6 I8 L49 D53 V54 I55 F84 K88	P5-V86 CarbonylContact C-O 3.55Å; P5-V86 VanDerWaalsContact CA-O 3.31Å; P5-V86 WeakPolarHBondContact CA-O 3.35Å; V6-V86 PolarHBondContact N-O 3.49Å; V6-V86 PolarHBondContact O-N 2.98Å; I8-V86 HydrophobicContact CD1-CG1 4.5Å; I8-V86 HydrophobicContact CD1-CG2 3.62Å; I8-V86 HydrophobicContact CG1-CG2 4.1Å; L49-V86 HydrophobicContact CD1-CG1 4.36Å; D53-V86 HydrophobicContact CB-CB 4.39Å; V54-V86 CarbonylContact O-C 3.59Å; V54-V86 WeakPolarHBondContact O-CA 3.45Å; I55-V86 HydrophobicContact CD1-CG1 3.46Å; I55-V86 VanDerWaalsContact CD1-CG1 3.46Å; F84-V86 HydrophobicContact CB-CG1 3.68Å; V86-K88 HydrophobicContact CG2-CD 3.89Å; V86-K88 HydrophobicContact CG2-CG 4.36Å
87	K	96.8	Very high	96.6	Very high	77 Å²	77	57.4 Å²	57.4	34%	0.335	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.9	157.7	-73.6	177	175.3	-177.2	0	108.6	D53 V54 L56 R89 D90	D53-K87 WeakPolarHBondContact CA-O 3.5Å; V54-K87 HydrophobicContact CB-CB 4.49Å; V54-K87 PolarHBondContact N-O 3.1Å; V54-K87 PolarHBondContact O-N 3.27Å; L56-K87 HydrophobicContact CD1-CD 4.25Å; L56-K87 HydrophobicContact CD1-CG 3.9Å; L56-K87 HydrophobicContact CD2-CD 4.38Å; L56-K87 HydrophobicContact CG-CG 4.39Å; K87-R89 PolarHBondContact O-N 2.97Å; K87-D90 HydrophobicContact CB-CB 3.81Å
88	K	96	Very high	96.5	Very high	42 Å²	42	55.7 Å²	55.7	18%	0.183	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	126.1	-174.8	-70.5	-66.5	-59.7	171.4	0	110.9	L3 V6 I8 G48 E50 D53 V86 D90	L3-K88 HydrophobicContact CD1-CB 4.38Å; V6-K88 HydrophobicContact CG2-CG 4.42Å; I8-K88 HydrophobicContact CD1-CD 4.32Å; G48-K88 PolarHBondContact O-NZ 3Å; E50-K88 WeakPolarHBondContact OE2-CE 3.48Å; E50-K88 IonicContact OE2-NZ 2.79Å; E50-K88 PolarHBondContact OE2-NZ 2.98Å; D53-K88 VanDerWaalsContact OD1-CA 3.3Å; D53-K88 WeakPolarHBondContact OD1-CA 3.42Å; D53-K88 WeakPolarHBondContact OD1-CD 3.38Å; D53-K88 WeakPolarHBondContact OD1-CE 3.36Å; D53-K88 IonicContact OD1-NZ 2.88Å; D53-K88 PolarHBondContact OD1-NZ 2.95Å; D53-K88 IonicContact OD2-NZ 3.88Å; D53-K88 PolarHBondContact OD2-NZ 3.1Å; V86-K88 HydrophobicContact CG2-CD 3.89Å; V86-K88 HydrophobicContact CG2-CG 4.36Å; K88-D90 PolarHBondContact O-N 3.31Å; K88-D90 VanDerWaalsContact O-N 3.15Å
89	R	93.8	Very high	96.4	Very high	168 Å²	168	58.4 Å²	58.4	63%	0.634	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	34.3	174	-54	179.4	-171.8	147.8	-4.4	114.9	E50 G52 D53 K87 F91	E50-R89 VanDerWaalsContact CD-NH2 3.26Å; E50-R89 IonicContact OE1-CZ 3.37Å; E50-R89 IonicContact OE1-NE 3.12Å; E50-R89 IonicContact OE1-NH2 2.96Å; E50-R89 PolarHBondContact OE1-NH2 2.95Å; E50-R89 IonicContact OE2-CZ 3.97Å; E50-R89 IonicContact OE2-NE 2.74Å; E50-R89 PolarHBondContact OE2-NE 3.46Å; E50-R89 VanDerWaalsContact OE2-NE 3.12Å; E50-R89 IonicContact OE2-NH2 2.73Å; E50-R89 PolarHBondContact OE2-NH2 3.14Å; G52-R89 CarbonylContact O-C 3.47Å; G52-R89 WeakPolarHBondContact O-CA 3.48Å; D53-R89 PolarHBondContact OD1-N 3.34Å; K87-R89 PolarHBondContact O-N 2.97Å; R89-F91 VanDerWaalsContact C-N 3.32Å
90	D	95.6	Very high	96.2	Very high	103 Å²	103	61.2 Å²	61.2	55%	0.551	31%	0.31	S	S	*	.			trans	-80	-15.5	-179.5	-162.8	46	0	0	0	112.3	G52 V54 K87 K88	G52-D90 PolarHBondContact O-N 3.05Å; G52-D90 VanDerWaalsContact O-N 3.12Å; V54-D90 HydrophobicContact CB-CB 4.25Å; V54-D90 HydrophobicContact CG2-CB 3.81Å; K87-D90 HydrophobicContact CB-CB 3.81Å; K88-D90 PolarHBondContact O-N 3.31Å; K88-D90 VanDerWaalsContact O-N 3.15Å
91	F	96.6	Very high	96	Very high	38 Å²	38	65.3 Å²	65.3	17%	0.167	33%	0.328	C	S	.	.	S	Bend	trans	-113.8	131.7	178.4	-170.9	-90.7	0	0	0	112.9	L31 P32 F34 G52 V54 R89 V93 Y96	L31-F91 HydrophobicContact CD2-CE2 4.4Å; L31-F91 HydrophobicContact CD2-CZ 4.45Å; P32-F91 HydrophobicContact CG-CD2 3.76Å; P32-F91 HydrophobicContact CG-CE2 4.05Å; F34-F91 HydrophobicContact CB-CB 3.96Å; F34-F91 HydrophobicContact CB-CD1 4.23Å; F34-F91 HydrophobicContact CB-CG 4.02Å; F34-F91 AromaticContact CD1-CD1 3.8Å; F34-F91 HydrophobicContact CD1-CD1 3.8Å; F34-F91 HydrophobicContact CD1-CD2 4.07Å; F34-F91 AromaticContact CD1-CE1 3.75Å; F34-F91 HydrophobicContact CD1-CE1 3.75Å; F34-F91 HydrophobicContact CD1-CE2 4.01Å; F34-F91 AromaticContact CD1-CG 3.96Å; F34-F91 HydrophobicContact CD1-CG 3.96Å; F34-F91 AromaticContact CD1-CZ 3.85Å; F34-F91 HydrophobicContact CD1-CZ 3.85Å; F34-F91 AromaticContact CD2-CD1 3.44Å; F34-F91 HydrophobicContact CD2-CD1 3.44Å; F34-F91 VanDerWaalsContact CD2-CD1 3.44Å; F34-F91 AromaticContact CD2-CE1 3.77Å; F34-F91 HydrophobicContact CD2-CE1 3.77Å; F34-F91 HydrophobicContact CD2-CG 4.11Å; F34-F91 AromaticContact CE1-CD1 3.99Å; F34-F91 HydrophobicContact CE1-CD1 3.99Å; F34-F91 AromaticContact CE1-CE1 3.45Å; F34-F91 HydrophobicContact CE1-CE1 3.45Å; F34-F91 VanDerWaalsContact CE1-CE1 3.45Å; F34-F91 HydrophobicContact CE1-CE2 4.05Å; F34-F91 HydrophobicContact CE1-CG 4.49Å; F34-F91 AromaticContact CE1-CZ 3.48Å; F34-F91 HydrophobicContact CE1-CZ 3.48Å; F34-F91 VanDerWaalsContact CE1-CZ 3.48Å; F34-F91 AromaticContact CE2-CD1 3.62Å; F34-F91 HydrophobicContact CE2-CD1 3.62Å; F34-F91 AromaticContact CE2-CE1 3.45Å; F34-F91 HydrophobicContact CE2-CE1 3.45Å; F34-F91 VanDerWaalsContact CE2-CE1 3.45Å; F34-F91 HydrophobicContact CE2-CZ 4.33Å; F34-F91 HydrophobicContact CG-CB 4.23Å; F34-F91 AromaticContact CG-CD1 3.55Å; F34-F91 HydrophobicContact CG-CD1 3.55Å; F34-F91 HydrophobicContact CG-CD2 4.32Å; F34-F91 AromaticContact CG-CE1 3.92Å; F34-F91 HydrophobicContact CG-CE1 3.92Å; F34-F91 AromaticContact CG-CG 3.77Å; F34-F91 HydrophobicContact CG-CG 3.77Å; F34-F91 HydrophobicContact CG-CZ 4.44Å; F34-F91 AromaticContact CZ-CD1 3.9Å; F34-F91 HydrophobicContact CZ-CD1 3.9Å; F34-F91 AromaticContact CZ-CE1 3.28Å; F34-F91 HydrophobicContact CZ-CE1 3.28Å; F34-F91 AromaticContact CZ-CZ 3.75Å; F34-F91 HydrophobicContact CZ-CZ 3.75Å; G52-F91 VanDerWaalsContact CA-O 3.23Å; G52-F91 WeakPolarHBondContact CA-O 3.33Å; G52-F91 PolarHBondContact O-N 3.46Å; V54-F91 HydrophobicContact CG2-CB 3.67Å; R89-F91 VanDerWaalsContact C-N 3.32Å; F91-V93 HydrophobicContact CD1-CG2 3.96Å; F91-V93 PolarHBondContact O-N 3.11Å; F91-Y96 HydrophobicContact CE1-CD2 4.37Å; F91-Y96 HydrophobicContact CE1-CG 4.02Å; F91-Y96 AromaticContact CZ-CD2 3.98Å; F91-Y96 HydrophobicContact CZ-CD2 3.98Å; F91-Y96 HydrophobicContact CZ-CG 4.1Å
92	N	96.8	Very high	95.7	Very high	104 Å²	104	66.6 Å²	66.6	56%	0.556	33%	0.33	S	S	*	.			trans	-85	89.5	177.8	-171.1	-19.6	0	0	0	111.8	V94 A95 Y96	N92-V94 VanDerWaalsContact C-N 3.29Å; N92-V94 PolarHBondContact O-N 3.18Å; N92-V94 PolarHBondContact OD1-N 3.43Å; N92-A95 HydrophobicContact CB-CB 4.18Å; N92-A95 PolarHBondContact O-N 3.27Å; N92-A95 PolarHBondContact OD1-N 2.94Å; N92-Y96 PolarHBondContact O-N 3.2Å; N92-Y96 VanDerWaalsContact O-N 3.16Å
93	V	96.6	Very high	95.3	Very high	15 Å²	15	71.4 Å²	71.4	9%	0.091	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-33	179.2	-178	0	0	0	0	112.6	F34 P51 G52 F91 Y96 N97	F34-V93 HydrophobicContact CD2-CG2 3.96Å; F34-V93 HydrophobicContact CE2-CG2 3.96Å; P51-V93 HydrophobicContact CB-CG2 4.33Å; G52-V93 VanDerWaalsContact CA-CG2 3.5Å; G52-V93 VanDerWaalsContact N-CG2 3.29Å; F91-V93 HydrophobicContact CD1-CG2 3.96Å; F91-V93 PolarHBondContact O-N 3.11Å; V93-Y96 PolarHBondContact O-N 3.32Å; V93-N97 WeakPolarHBondContact O-CB 3.36Å; V93-N97 VanDerWaalsContact O-CG 3.29Å; V93-N97 PolarHBondContact O-N 3.39Å; V93-N97 PolarHBondContact O-ND2 3.43Å
94	V	96.3	Very high	94.9	Very high	95 Å²	95	72.4 Å²	72.4	58%	0.576	37%	0.37	S	S	*	.	H	α-helix	trans	-66.2	-50.2	-178.9	179.3	0	0	0	0	110.3	N92 Y96 N97 Q98	N92-V94 VanDerWaalsContact C-N 3.29Å; N92-V94 PolarHBondContact O-N 3.18Å; N92-V94 PolarHBondContact OD1-N 3.43Å; V94-Y96 VanDerWaalsContact C-N 3.33Å; V94-Y96 PolarHBondContact O-N 2.87Å; V94-N97 PolarHBondContact O-N 2.89Å; V94-Q98 WeakPolarHBondContact O-CG 3.28Å; V94-Q98 PolarHBondContact O-N 2.82Å
95	A	95.8	Very high	94.3	Very high	36 Å²	36	74.8 Å²	74.8	30%	0.298	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-43.1	177.2	0	0	0	0	0	111.5	N92 N97 Q98 T99	N92-A95 HydrophobicContact CB-CB 4.18Å; N92-A95 PolarHBondContact O-N 3.27Å; N92-A95 PolarHBondContact OD1-N 2.94Å; A95-N97 PolarHBondContact O-N 2.84Å; A95-Q98 PolarHBondContact O-N 2.95Å; A95-T99 PolarHBondContact O-N 3.24Å; A95-T99 PolarHBondContact O-OG1 2.96Å
96	Y	96.4	Very high	93.6	Very high	39 Å²	39	76.6 Å²	76.6	15%	0.153	41%	0.409	C	S	.	.	H	α-helix	trans	-56.2	-48.2	175.1	172.5	-96.1	0	0	0	112.2	L31 F34 H36 F91 N92 V93 V94 Q98 T99 M100	L31-Y96 HydrophobicContact CD1-CD2 4.43Å; L31-Y96 HydrophobicContact CD1-CE2 3.6Å; L31-Y96 HydrophobicContact CD2-CE2 4.49Å; F34-Y96 HydrophobicContact CZ-CD1 4.1Å; F34-Y96 HydrophobicContact CZ-CE1 4.15Å; F34-Y96 HydrophobicContact CZ-CG 4.28Å; H36-Y96 AromaticContact CE1-CD1 3.94Å; H36-Y96 AromaticContact CE1-CE1 3.73Å; H36-Y96 AromaticContact ND1-CE1 3.87Å; F91-Y96 HydrophobicContact CE1-CD2 4.37Å; F91-Y96 HydrophobicContact CE1-CG 4.02Å; F91-Y96 AromaticContact CZ-CD2 3.98Å; F91-Y96 HydrophobicContact CZ-CD2 3.98Å; F91-Y96 HydrophobicContact CZ-CG 4.1Å; N92-Y96 PolarHBondContact O-N 3.2Å; N92-Y96 VanDerWaalsContact O-N 3.16Å; V93-Y96 PolarHBondContact O-N 3.32Å; V94-Y96 VanDerWaalsContact C-N 3.33Å; V94-Y96 PolarHBondContact O-N 2.87Å; Y96-Q98 PolarHBondContact O-N 3.12Å; Y96-T99 PolarHBondContact O-N 3.23Å; Y96-M100 HydrophobicContact CD1-CG 4.43Å; Y96-M100 HydrophobicContact CD2-CE 4.23Å; Y96-M100 HydrophobicContact CD2-CG 4.43Å; Y96-M100 HydrophobicContact CE1-CG 4.02Å; Y96-M100 HydrophobicContact CE2-CE 3.33Å; Y96-M100 HydrophobicContact CE2-CG 4.03Å; Y96-M100 WeakPolarHBondContact O-CG 2.97Å; Y96-M100 PolarHBondContact O-N 3.33Å
97	N	95.3	Very high	92.4	Very high	54 Å²	54	83.3 Å²	83.3	29%	0.289	45%	0.445	S	S	.	.	H	α-helix	trans	-62.5	-41.7	179	-75.2	-28.4	0	0	0	112.3	H36 V93 V94 A95 M100 Q101	H36-N97 PolarHBondContact CE1-OD1 2.81Å; V93-N97 WeakPolarHBondContact O-CB 3.36Å; V93-N97 VanDerWaalsContact O-CG 3.29Å; V93-N97 PolarHBondContact O-N 3.39Å; V93-N97 PolarHBondContact O-ND2 3.43Å; V94-N97 PolarHBondContact O-N 2.89Å; A95-N97 PolarHBondContact O-N 2.84Å; N97-M100 PolarHBondContact O-N 3.5Å; N97-Q101 WeakPolarHBondContact O-CB 3.18Å; N97-Q101 WeakPolarHBondContact O-CG 3.47Å; N97-Q101 PolarHBondContact O-N 2.75Å
98	Q	94.8	Very high	90.9	Very high	101 Å²	101	88.7 Å²	88.7	47%	0.472	46%	0.463	S	S	.	.	H	α-helix	trans	-62.4	-45.5	177.1	-71.4	175	-50.5	0	0	111.6	V94 A95 Y96 M100 Q101 Q102	V94-Q98 WeakPolarHBondContact O-CG 3.28Å; V94-Q98 PolarHBondContact O-N 2.82Å; A95-Q98 PolarHBondContact O-N 2.95Å; Y96-Q98 PolarHBondContact O-N 3.12Å; Q98-M100 PolarHBondContact O-N 3.26Å; Q98-Q101 PolarHBondContact O-N 3.01Å; Q98-Q102 WeakPolarHBondContact O-CG 3.3Å; Q98-Q102 PolarHBondContact O-N 3.16Å
99	T	94.1	Very high	89.1	Confident	74 Å²	74	92.3 Å²	92.3	45%	0.454	49%	0.491	S	S	.	.	H	α-helix	trans	-60.6	-46	176.6	-61.3	0	0	0	0	111.2	A95 Y96 Q101 Q102 I103	A95-T99 PolarHBondContact O-N 3.24Å; A95-T99 PolarHBondContact O-OG1 2.96Å; Y96-T99 PolarHBondContact O-N 3.23Å; T99-Q101 VanDerWaalsContact C-N 3.32Å; T99-Q101 PolarHBondContact O-N 2.79Å; T99-Q102 PolarHBondContact O-N 3.44Å; T99-I103 HydrophobicContact CG2-CD1 3.96Å; T99-I103 WeakPolarHBondContact O-CG1 3.42Å; T99-I103 PolarHBondContact O-N 3.34Å
100	M	92	Very high	87.3	Confident	85 Å²	85	91.7 Å²	91.7	42%	0.419	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-37.5	178.6	-71	-62	176.8	0	0	112.5	Y96 N97 Q98 A104	Y96-M100 HydrophobicContact CD1-CG 4.43Å; Y96-M100 HydrophobicContact CD2-CE 4.23Å; Y96-M100 HydrophobicContact CD2-CG 4.43Å; Y96-M100 HydrophobicContact CE1-CG 4.02Å; Y96-M100 HydrophobicContact CE2-CE 3.33Å; Y96-M100 HydrophobicContact CE2-CG 4.03Å; Y96-M100 WeakPolarHBondContact O-CG 2.97Å; Y96-M100 PolarHBondContact O-N 3.33Å; N97-M100 PolarHBondContact O-N 3.5Å; Q98-M100 PolarHBondContact O-N 3.26Å; M100-A104 WeakPolarHBondContact O-CB 3.45Å; M100-A104 PolarHBondContact O-N 2.8Å
101	Q	92.2	Very high	85.5	Confident	131 Å²	131	94.3 Å²	94.3	61%	0.612	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-39.4	174.5	-73.6	168.4	8.4	0	0	112.4	N97 Q98 T99 A104 A105	N97-Q101 WeakPolarHBondContact O-CB 3.18Å; N97-Q101 WeakPolarHBondContact O-CG 3.47Å; N97-Q101 PolarHBondContact O-N 2.75Å; Q98-Q101 PolarHBondContact O-N 3.01Å; T99-Q101 VanDerWaalsContact C-N 3.32Å; T99-Q101 PolarHBondContact O-N 2.79Å; Q101-A104 PolarHBondContact O-N 2.79Å; Q101-A105 WeakPolarHBondContact O-CB 3.46Å; Q101-A105 PolarHBondContact O-N 3.05Å
102	Q	90.8	Very high	83.4	Confident	123 Å²	123	98.6 Å²	98.6	58%	0.575	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-46.7	176.7	-72	170.3	40.5	0	0	111.2	Q98 T99 A104 A105 S106	Q98-Q102 WeakPolarHBondContact O-CG 3.3Å; Q98-Q102 PolarHBondContact O-N 3.16Å; T99-Q102 PolarHBondContact O-N 3.44Å; Q102-A104 VanDerWaalsContact C-N 3.31Å; Q102-A104 PolarHBondContact O-N 3.35Å; Q102-A105 PolarHBondContact O-N 3.22Å; Q102-A105 VanDerWaalsContact O-N 3.11Å; Q102-S106 PolarHBondContact O-N 3.48Å; Q102-S106 PolarHBondContact O-OG 3.42Å; Q102-S106 VanDerWaalsContact O-OG 3.12Å
103	I	90.2	Very high	81.2	Confident	102 Å²	102	100.8 Å²	100.8	52%	0.523	55%	0.553	S	S	.	*	H	α-helix	trans	-59.9	-43.3	176.7	-64.5	167	0	0	0	110.7	T99 A105 S106 N107	T99-I103 HydrophobicContact CG2-CD1 3.96Å; T99-I103 WeakPolarHBondContact O-CG1 3.42Å; T99-I103 PolarHBondContact O-N 3.34Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 2.99Å; I103-S106 PolarHBondContact O-N 3.27Å; I103-N107 PolarHBondContact O-N 3.24Å
104	A	89.4	Confident	79	Confident	68 Å²	68	104.6 Å²	104.6	56%	0.562	58%	0.581	S	S	*	*	H	α-helix	trans	-64.6	-35	176.3	0	0	0	0	0	112.8	M100 Q101 Q102	M100-A104 WeakPolarHBondContact O-CB 3.45Å; M100-A104 PolarHBondContact O-N 2.8Å; Q101-A104 PolarHBondContact O-N 2.79Å; Q102-A104 VanDerWaalsContact C-N 3.31Å; Q102-A104 PolarHBondContact O-N 3.35Å
105	A	86	Confident	76.6	Confident	49 Å²	49	107.3 Å²	107.3	41%	0.405	59%	0.592	S	S	.	*	H	α-helix	trans	-73.3	-37.4	177.2	0	0	0	0	0	112.7	Q101 Q102 I103 N107 R108	Q101-A105 WeakPolarHBondContact O-CB 3.46Å; Q101-A105 PolarHBondContact O-N 3.05Å; Q102-A105 PolarHBondContact O-N 3.22Å; Q102-A105 VanDerWaalsContact O-N 3.11Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 2.99Å; A105-N107 VanDerWaalsContact C-N 3.29Å; A105-N107 PolarHBondContact O-N 3.44Å; A105-R108 PolarHBondContact O-N 3.16Å
106	S	83	Confident	74.5	Confident	105 Å²	105	110.8 Å²	110.8	73%	0.734	61%	0.614	S	S	*	*	H	α-helix	trans	-69.1	-26.5	178	-62.4	0	0	0	0	113.1	Q102 I103 R108	Q102-S106 PolarHBondContact O-N 3.48Å; Q102-S106 PolarHBondContact O-OG 3.42Å; Q102-S106 VanDerWaalsContact O-OG 3.12Å; I103-S106 PolarHBondContact O-N 3.27Å; S106-R108 VanDerWaalsContact C-N 3.3Å; S106-R108 PolarHBondContact O-N 3.02Å
107	N	72.1	Confident	72.3	Confident	141 Å²	141	115.3 Å²	115.3	75%	0.754	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	19.7	179.7	-149.7	29.5	0	0	0	113.6	I103 A105	I103-N107 PolarHBondContact O-N 3.24Å; A105-N107 VanDerWaalsContact C-N 3.29Å; A105-N107 PolarHBondContact O-N 3.44Å
108	R	64.8	Low	70.2	Confident	189 Å²	189	121.4 Å²	121.4	71%	0.713	68%	0.675	S	S	*	*	S	Bend	trans	-70	128.1	167.5	-70.6	-173.9	-150.4	-123.2	2.6	108.5	A105 S106 I110	A105-R108 PolarHBondContact O-N 3.16Å; S106-R108 VanDerWaalsContact C-N 3.3Å; S106-R108 PolarHBondContact O-N 3.02Å; R108-I110 PolarHBondContact O-N 3.18Å
109	P	58.7	Low	68.2	Low	119 Å²	119	122.3 Å²	122.3	77%	0.773	69%	0.69	S	S	*	*			trans	-57.4	119.6	169.7	18.8	-23.6	0	0	0	108.2	D111	P109-D111 PolarHBondContact O-N 3.38Å
110	I	56.3	Low	65.9	Low	155 Å²	155	130.6 Å²	130.6	80%	0.795	71%	0.712	S	S	*	*			trans	-61.8	103.4	166.6	9.3	172.1	0	0	0	106.4	R108 V112	R108-I110 PolarHBondContact O-N 3.18Å; I110-V112 VanDerWaalsContact C-N 3.29Å; I110-V112 HydrophobicContact CB-CG2 4.34Å; I110-V112 PolarHBondContact O-N 3.01Å
111	D	57.1	Low	63.9	Low	158 Å²	158	130.5 Å²	130.5	85%	0.845	73%	0.726	S	S	*	*			trans	-65.2	93.9	164.4	-97.4	-56.2	0	0	0	107.7	P109 N113	P109-D111 PolarHBondContact O-N 3.38Å; D111-N113 VanDerWaalsContact C-N 3.35Å; D111-N113 PolarHBondContact O-N 3.28Å
112	V	53.2	Low	62	Low	128 Å²	128	132.6 Å²	132.6	78%	0.776	74%	0.735	S	S	*	*			trans	-86.3	82.7	168.3	-179.3	0	0	0	0	107	I110	I110-V112 VanDerWaalsContact C-N 3.29Å; I110-V112 HydrophobicContact CB-CG2 4.34Å; I110-V112 PolarHBondContact O-N 3.01Å
113	N	50	Low	60.2	Low	150 Å²	150	133.7 Å²	133.7	80%	0.802	74%	0.743	S	S	*	*			trans	-142.7	119.3	156.9	-163.4	40.4	0	0	0	110.8	D111	D111-N113 VanDerWaalsContact C-N 3.35Å; D111-N113 PolarHBondContact O-N 3.28Å
114	S	50.4	Low	58.4	Low	95 Å²	95	133.6 Å²	133.6	66%	0.664	75%	0.748	S	S	*	*			trans	-63.2	150.4	176.3	-64.8	0	0	0	0	112.4
115	N	46	Very low	56.8	Low	152 Å²	152	139.4 Å²	139.4	81%	0.813	76%	0.763	S	S	*	*			trans	87.3	124.2	162.5	-65.7	-14.8	0	0	0	119
116	S	52.4	Low	55.1	Low	108 Å²	108	143.5 Å²	143.5	76%	0.755	77%	0.774	S	S	*	*			trans	90.2	116.5	158.2	-58	0	0	0	0	117.2	E118	S116-E118 PolarHBondContact O-N 3.11Å
117	P	49.9	Very low	53.5	Low	135 Å²	135	146 Å²	146	88%	0.877	77%	0.774	S	S	*	*			trans	-78	101.3	168.3	31.4	-27.3	0	0	0	108.3
118	E	50.5	Low	52.4	Low	181 Å²	181	146.9 Å²	146.9	85%	0.846	78%	0.777	S	S	*	*			trans	-86.8	138.4	161.7	-91.3	-169.6	112.6	0	0	110.3	S116 R120	S116-E118 PolarHBondContact O-N 3.11Å; E118-R120 PolarHBondContact O-N 2.85Å
119	P	53.7	Low	51.8	Low	121 Å²	121	150.1 Å²	150.1	79%	0.786	79%	0.79	S	S	*	*			trans	-66.3	123.7	-179.5	27.7	-32.5	0	0	0	109.6	A121	P119-A121 PolarHBondContact O-N 2.85Å
120	R	45.6	Very low	51.7	Low	247 Å²	247	155.1 Å²	155.1	93%	0.932	79%	0.793	S	S	*	*			trans	-54.9	105.1	173.2	-178.9	177.2	173.3	145.8	-2	109.3	E118 E122	E118-R120 PolarHBondContact O-N 2.85Å; R120-E122 PolarHBondContact O-N 3.17Å
121	A	49.8	Very low	51.4	Low	84 Å²	84	156.1 Å²	156.1	69%	0.694	79%	0.794	S	S	*	*			trans	-59.6	121.1	172.1	0	0	0	0	0	109.3	P119 I123	P119-A121 PolarHBondContact O-N 2.85Å; A121-I123 PolarHBondContact O-N 3.49Å
122	E	53.3	Low	50.9	Low	174 Å²	174	152.5 Å²	152.5	81%	0.813	79%	0.794	S	S	*	*			trans	-62.9	113.5	166.4	-167.5	167.1	-154.2	0	0	107.3	R120 V124	R120-E122 PolarHBondContact O-N 3.17Å; E122-V124 VanDerWaalsContact C-N 3.29Å; E122-V124 PolarHBondContact O-N 2.97Å
123	I	52.1	Low	50.7	Low	146 Å²	146	149.4 Å²	149.4	75%	0.749	79%	0.788	S	S	*	*			trans	-73.2	94.3	173.8	-59.8	170.5	0	0	0	106	A121 E125	A121-I123 PolarHBondContact O-N 3.49Å; I123-E125 HydrophobicContact CG2-CG 4.25Å; I123-E125 PolarHBondContact O-N 2.75Å
124	V	51.4	Low	51.1	Low	101 Å²	101	147.4 Å²	147.4	61%	0.612	78%	0.783	S	S	*	*			trans	-73.6	103.1	161.4	-177	0	0	0	0	105.8	E122 E126	E122-V124 VanDerWaalsContact C-N 3.29Å; E122-V124 PolarHBondContact O-N 2.97Å; V124-E126 HydrophobicContact CG1-CB 4.18Å; V124-E126 PolarHBondContact O-N 2.89Å
125	E	57.5	Low	51.6	Low	190 Å²	190	149.4 Å²	149.4	89%	0.888	79%	0.791	S	S	*	*			trans	-68.9	69.6	171.5	-96.6	178.9	166.3	0	0	109.9	I123	I123-E125 HydrophobicContact CG2-CG 4.25Å; I123-E125 PolarHBondContact O-N 2.75Å
126	E	50.3	Low	52.1	Low	135 Å²	135	151.1 Å²	151.1	63%	0.631	79%	0.792	S	S	*	*			trans	-144.1	125.8	168.1	-141.4	179.3	163.6	0	0	106.6	V124	V124-E126 HydrophobicContact CG1-CB 4.18Å; V124-E126 PolarHBondContact O-N 2.89Å
127	H	48.5	Very low	52.7	Low	158 Å²	158	155 Å²	155	73%	0.731	80%	0.795	S	S	*	*	S	Bend	trans	104.3	0.5	168.3	-50.4	87.9	0	0	0	121.2	W129	H127-W129 PolarHBondContact O-N 2.99Å
128	L	48.9	Very low	53	Low	159 Å²	159	155.9 Å²	155.9	83%	0.832	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-83.9	4.7	-173.8	-70.4	175.1	0	0	0	117.9	R130	L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 2.88Å
129	W	51.9	Low	53.8	Low	257 Å²	257	153.4 Å²	153.4	97%	0.973	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-78.4	2.1	-176.3	-66.9	110.7	0	0	0	116.2	H127	H127-W129 PolarHBondContact O-N 2.99Å
130	R	56.1	Low	54.3	Low	223 Å²	223	152.2 Å²	152.2	84%	0.842	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-108.8	-9.4	-170.3	-64.4	-164.6	-173.4	-81.4	0.3	117	L128	L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 2.88Å
131	H	51.8	Low	55.6	Low	177 Å²	177	144 Å²	144	82%	0.819	75%	0.752	S	S	*	*	S	Bend	trans	-142.7	118.7	178.3	-78.1	-82.1	0	0	0	111.4
132	G	45.4	Very low	56.3	Low	81 Å²	81	148.6 Å²	148.6	84%	0.835	76%	0.757	S	S	*	*			trans	42	96.6	159.6	0	0	0	0	0	117
133	G	50	Low	57	Low	63 Å²	63	144.1 Å²	144.1	65%	0.649	74%	0.744	S	S	*	*			trans	-58.1	166.4	174.3	0	0	0	0	0	113.9	T135	G133-T135 PolarHBondContact O-N 3.45Å
134	P	57.9	Low	57.9	Low	108 Å²	108	143.3 Å²	143.3	70%	0.701	73%	0.733	S	S	*	*			trans	-56.3	121.1	-173.2	-22	32.4	0	0	0	112	F136	P134-F136 HydrophobicContact CB-CE2 4.42Å; P134-F136 WeakPolarHBondContact O-CD2 3.3Å; P134-F136 PolarHBondContact O-N 3.12Å
135	T	60.6	Low	58.8	Low	137 Å²	137	145.3 Å²	145.3	84%	0.84	73%	0.733	S	S	*	*			trans	-73	104	168.8	50.5	0	0	0	0	108.8	G133 K137	G133-T135 PolarHBondContact O-N 3.45Å; T135-K137 PolarHBondContact O-N 2.96Å
136	F	56.6	Low	59.4	Low	188 Å²	188	140.8 Å²	140.8	83%	0.825	71%	0.714	S	S	*	*			trans	-69.4	123.7	171.3	-67.3	-89.2	0	0	0	109.3	P134 N138	P134-F136 HydrophobicContact CB-CE2 4.42Å; P134-F136 WeakPolarHBondContact O-CD2 3.3Å; P134-F136 PolarHBondContact O-N 3.12Å; F136-N138 PolarHBondContact O-N 2.98Å
137	K	65.5	Low	60.2	Low	190 Å²	190	139.8 Å²	139.8	83%	0.826	71%	0.713	S	S	*	*			trans	-65.1	131.4	168.3	-68.2	-176.9	-178.3	-178.7	0	108.2	T135 V139	T135-K137 PolarHBondContact O-N 2.96Å; K137-V139 PolarHBondContact O-N 2.83Å
138	N	56.6	Low	61.2	Low	153 Å²	153	137.8 Å²	137.8	82%	0.818	70%	0.703	S	S	*	*			trans	-68.2	95.5	-179.5	-141.7	70.9	0	0	0	109.6	F136 Q140	F136-N138 PolarHBondContact O-N 2.98Å; N138-Q140 PolarHBondContact O-N 2.51Å
139	V	67	Low	62.3	Low	129 Å²	129	138.3 Å²	138.3	78%	0.782	70%	0.701	S	S	*	*			trans	-84.2	104.8	175.3	-179.1	0	0	0	0	108.2	K137 P141	K137-V139 PolarHBondContact O-N 2.83Å; V139-P141 WeakPolarHBondContact O-CD 3.35Å
140	Q	64.2	Low	63	Low	97 Å²	97	132.8 Å²	132.8	45%	0.453	69%	0.686	S	S	.	*			trans	-77.5	119.6	171.2	-84.2	-178.4	-13.9	0	0	110	N138 Y144	N138-Q140 PolarHBondContact O-N 2.51Å; Q140-Y144 HydrophobicContact CG-CD1 4.23Å
141	P	71.7	Confident	63	Low	73 Å²	73	127.5 Å²	127.5	47%	0.474	68%	0.675	S	S	.	*			trans	-64.7	151.1	175.5	25.7	-31.4	0	0	0	110.6	V139 S143 Y144	V139-P141 WeakPolarHBondContact O-CD 3.35Å; P141-S143 PolarHBondContact O-N 3.38Å; P141-S143 VanDerWaalsContact O-N 3.09Å; P141-Y144 VanDerWaalsContact O-CB 3.23Å; P141-Y144 WeakPolarHBondContact O-CB 3.31Å; P141-Y144 PolarHBondContact O-N 2.82Å
142	K	66	Low	63	Low	182 Å²	182	124.3 Å²	124.3	79%	0.791	67%	0.669	S	S	*	*	H	α-helix	trans	-55.6	-30.1	-178.9	-69	-176.4	179.5	179.1	0	113.4	Y144 K145 I146	K142-Y144 PolarHBondContact O-N 3.47Å; K142-K145 PolarHBondContact O-N 2.87Å; K142-I146 WeakPolarHBondContact O-CG1 3.27Å; K142-I146 PolarHBondContact O-N 3.49Å
143	S	66.2	Low	63.4	Low	79 Å²	79	129.7 Å²	129.7	55%	0.552	67%	0.673	S	S	*	*	H	α-helix	trans	-58.6	-35.2	174	48.6	0	0	0	0	112.5	P141 I146 L147	P141-S143 PolarHBondContact O-N 3.38Å; P141-S143 VanDerWaalsContact O-N 3.09Å; S143-I146 PolarHBondContact O-N 3.38Å; S143-L147 PolarHBondContact O-N 2.92Å; S143-L147 VanDerWaalsContact O-N 3.12Å
144	Y	71.8	Confident	63.3	Low	130 Å²	130	131.7 Å²	131.7	51%	0.51	68%	0.677	S	S	.	*	H	α-helix	trans	-65.7	-44	177.4	-155.7	-86.5	0	0	0	111.3	Q140 P141 K142 I146 L147 E148	Q140-Y144 HydrophobicContact CG-CD1 4.23Å; P141-Y144 VanDerWaalsContact O-CB 3.23Å; P141-Y144 WeakPolarHBondContact O-CB 3.31Å; P141-Y144 PolarHBondContact O-N 2.82Å; K142-Y144 PolarHBondContact O-N 3.47Å; Y144-I146 VanDerWaalsContact C-N 3.31Å; Y144-I146 PolarHBondContact O-N 3.2Å; Y144-L147 PolarHBondContact O-N 2.76Å; Y144-E148 PolarHBondContact O-N 3.25Å
145	K	70.4	Confident	62.7	Low	142 Å²	142	132.3 Å²	132.3	62%	0.617	68%	0.684	S	S	*	*	H	α-helix	trans	-61.4	-36.3	175	-88.3	-165.6	173.1	-172.5	0	113.4	K142 Q149	K142-K145 PolarHBondContact O-N 2.87Å; K145-Q149 PolarHBondContact O-N 3.1Å
146	I	70.6	Confident	62	Low	96 Å²	96	134.3 Å²	134.3	49%	0.492	69%	0.686	S	S	.	*	H	α-helix	trans	-69.1	-42.5	178.9	-65.4	168.1	0	0	0	110.2	K142 S143 Y144 E148 Q149 Q150	K142-I146 WeakPolarHBondContact O-CG1 3.27Å; K142-I146 PolarHBondContact O-N 3.49Å; S143-I146 PolarHBondContact O-N 3.38Å; Y144-I146 VanDerWaalsContact C-N 3.31Å; Y144-I146 PolarHBondContact O-N 3.2Å; I146-E148 VanDerWaalsContact C-N 3.31Å; I146-E148 PolarHBondContact O-N 3.23Å; I146-Q149 PolarHBondContact O-N 2.79Å; I146-Q150 WeakPolarHBondContact O-CG 3.34Å; I146-Q150 PolarHBondContact O-N 2.73Å
147	L	67.5	Low	61	Low	114 Å²	114	128.5 Å²	128.5	60%	0.597	68%	0.679	S	S	*	*	H	α-helix	trans	-62.6	-40	177.7	-135.6	87.9	0	0	0	111.7	S143 Y144 Q149 Q150 L151	S143-L147 PolarHBondContact O-N 2.92Å; S143-L147 VanDerWaalsContact O-N 3.12Å; Y144-L147 PolarHBondContact O-N 2.76Å; L147-Q149 VanDerWaalsContact C-N 3.31Å; L147-Q149 PolarHBondContact O-N 3.36Å; L147-Q150 PolarHBondContact O-N 3.17Å; L147-Q150 VanDerWaalsContact O-N 3.11Å; L147-L151 PolarHBondContact O-N 2.65Å
148	E	69.5	Low	59.9	Low	115 Å²	115	124.4 Å²	124.4	54%	0.537	68%	0.68	S	S	.	*	H	α-helix	trans	-66.2	-31.5	-179.3	-152.5	175.9	157.9	0	0	112.8	Y144 I146 Q150	Y144-E148 PolarHBondContact O-N 3.25Å; I146-E148 VanDerWaalsContact C-N 3.31Å; I146-E148 PolarHBondContact O-N 3.23Å; E148-Q150 VanDerWaalsContact C-N 3.31Å
149	Q	70.8	Confident	59.3	Low	170 Å²	170	123.3 Å²	123.3	79%	0.794	68%	0.675	S	S	*	*	H	α-helix	trans	-74.3	-19.5	173.5	-77	-180	-10.4	0	0	113.9	K145 I146 L147	K145-Q149 PolarHBondContact O-N 3.1Å; I146-Q149 PolarHBondContact O-N 2.79Å; L147-Q149 VanDerWaalsContact C-N 3.31Å; L147-Q149 PolarHBondContact O-N 3.36Å
150	Q	66.8	Low	58.1	Low	141 Å²	141	125.8 Å²	125.8	66%	0.659	68%	0.683	S	S	*	*	H	α-helix	trans	-93.3	-9.1	-180	-69.6	173.4	-23.4	0	0	112.8	I146 L147 E148	I146-Q150 WeakPolarHBondContact O-CG 3.34Å; I146-Q150 PolarHBondContact O-N 2.73Å; L147-Q150 PolarHBondContact O-N 3.17Å; L147-Q150 VanDerWaalsContact O-N 3.11Å; E148-Q150 VanDerWaalsContact C-N 3.31Å
151	L	56.7	Low	57.1	Low	113 Å²	113	128.8 Å²	128.8	59%	0.592	69%	0.692	S	S	*	*	S	Bend	trans	-74.6	129.8	175.4	-77.2	165.1	0	0	0	110	L147 Q153	L147-L151 PolarHBondContact O-N 2.65Å; L151-Q153 PolarHBondContact O-N 2.78Å; L151-Q153 VanDerWaalsContact O-N 3.14Å
152	P	51.8	Low	55.7	Low	109 Å²	109	134 Å²	134	71%	0.708	71%	0.71	S	S	*	*			trans	-54.6	122.4	166.1	-17.7	28.7	0	0	0	108.2	S154	P152-S154 VanDerWaalsContact C-N 3.28Å; P152-S154 PolarHBondContact O-N 2.74Å
153	Q	53.1	Low	54.6	Low	194 Å²	194	132.3 Å²	132.3	91%	0.907	71%	0.707	S	S	*	*			trans	-64.2	94.4	172	-76.7	-161.9	-15.9	0	0	108.5	L151 S155	L151-Q153 PolarHBondContact O-N 2.78Å; L151-Q153 VanDerWaalsContact O-N 3.14Å; Q153-S155 PolarHBondContact O-N 3.41Å; Q153-S155 VanDerWaalsContact O-N 3.12Å
154	S	47.5	Very low	54.1	Low	105 Å²	105	135 Å²	135	73%	0.734	72%	0.72	S	S	*	*			trans	-62.4	110.8	163	-49.8	0	0	0	0	107.2	P152 M156	P152-S154 VanDerWaalsContact C-N 3.28Å; P152-S154 PolarHBondContact O-N 2.74Å; S154-M156 VanDerWaalsContact C-N 3.31Å; S154-M156 PolarHBondContact O-N 2.96Å
155	S	46.5	Very low	53.3	Low	122 Å²	122	130.8 Å²	130.8	85%	0.853	72%	0.716	S	S	*	*			trans	-62	84.8	173.6	39.6	0	0	0	0	110.9	Q153	Q153-S155 PolarHBondContact O-N 3.41Å; Q153-S155 VanDerWaalsContact O-N 3.12Å
156	M	44.7	Very low	52.7	Low	178 Å²	178	130.2 Å²	130.2	88%	0.877	73%	0.727	S	S	*	*			trans	-109.3	101.2	163	-79	-79.8	-160.9	0	0	107.5	S154 A158	S154-M156 VanDerWaalsContact C-N 3.31Å; S154-M156 PolarHBondContact O-N 2.96Å; M156-A158 PolarHBondContact O-N 3.21Å
157	G	36.1	Very low	52	Low	67 Å²	67	130 Å²	130	69%	0.691	74%	0.739	S	S	*	*			trans	-59.7	118.7	175.8	0	0	0	0	0	110.8	N159	G157-N159 PolarHBondContact O-N 3.15Å
158	A	43	Very low	51.4	Low	103 Å²	103	130.2 Å²	130.2	85%	0.851	75%	0.748	S	S	*	*			trans	-74.4	82.4	162.5	0	0	0	0	0	107.8	M156	M156-A158 PolarHBondContact O-N 3.21Å
159	N	43.1	Very low	50.8	Low	131 Å²	131	127.2 Å²	127.2	70%	0.701	75%	0.748	S	S	*	*			trans	-63.8	135.5	159.5	-77.6	-40	0	0	0	108	G157 Y161	G157-N159 PolarHBondContact O-N 3.15Å; N159-Y161 HydrophobicContact CB-CD1 4.43Å; N159-Y161 WeakPolarHBondContact O-CD1 3.38Å; N159-Y161 VanDerWaalsContact O-CE1 3.29Å; N159-Y161 WeakPolarHBondContact O-CE1 3.46Å; N159-Y161 PolarHBondContact O-N 2.79Å
160	N	42.7	Very low	50.3	Low	180 Å²	180	121.8 Å²	121.8	96%	0.963	73%	0.728	S	S	*	*			trans	-66.9	91.8	174.7	-139.1	12.6	0	0	0	108
161	Y	42.2	Very low	50	Low	160 Å²	160	119.1 Å²	119.1	63%	0.627	72%	0.721	S	S	*	*			trans	-105.5	105.6	169.3	45.5	-95.4	0	0	0	108.7	N159 M163	N159-Y161 HydrophobicContact CB-CD1 4.43Å; N159-Y161 WeakPolarHBondContact O-CD1 3.38Å; N159-Y161 VanDerWaalsContact O-CE1 3.29Å; N159-Y161 WeakPolarHBondContact O-CE1 3.46Å; N159-Y161 PolarHBondContact O-N 2.79Å; Y161-M163 HydrophobicContact CD2-CE 3.89Å; Y161-M163 HydrophobicContact CD2-CG 3.55Å; Y161-M163 HydrophobicContact CE2-CE 4.05Å; Y161-M163 HydrophobicContact CE2-CG 4.11Å; Y161-M163 PolarHBondContact O-N 2.87Å
162	E	42	Very low	50.1	Low	183 Å²	183	122.4 Å²	122.4	86%	0.855	73%	0.731	S	S	*	*			trans	-57.7	97.8	166.8	-160.2	168.2	105.6	0	0	107.9	T164	E162-T164 PolarHBondContact O-N 3.38Å
163	M	44.1	Very low	50.6	Low	146 Å²	146	123.8 Å²	123.8	72%	0.719	73%	0.733	S	S	*	*			trans	-91.5	94	179	-83.3	-87.5	-159.8	0	0	109.1	Y161 G165	Y161-M163 HydrophobicContact CD2-CE 3.89Å; Y161-M163 HydrophobicContact CD2-CG 3.55Å; Y161-M163 HydrophobicContact CE2-CE 4.05Å; Y161-M163 HydrophobicContact CE2-CG 4.11Å; Y161-M163 PolarHBondContact O-N 2.87Å; M163-G165 PolarHBondContact O-N 3.45Å
164	T	54.7	Low	50.6	Low	137 Å²	137	120.3 Å²	120.3	84%	0.84	71%	0.711	S	S	*	*			trans	-72.7	32.1	160.4	55.3	0	0	0	0	111.9	E162	E162-T164 PolarHBondContact O-N 3.38Å
165	G	56	Low	51.1	Low	41 Å²	41	118.1 Å²	118.1	42%	0.423	70%	0.696	S	S	.	*	S	Bend	trans	-102.5	153	-177.2	0	0	0	0	0	111.9	M163 A167	M163-G165 PolarHBondContact O-N 3.45Å; G165-A167 PolarHBondContact O-N 3.12Å
166	P	58.1	Low	51.6	Low	130 Å²	130	120.1 Å²	120.1	84%	0.844	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55.4	141	173.7	24.6	-32	0	0	0	109.9
167	A	55	Low	52.4	Low	91 Å²	91	119 Å²	119	75%	0.752	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-50.9	137	179	0	0	0	0	0	110.2	G165 G169	G165-A167 PolarHBondContact O-N 3.12Å; A167-G169 PolarHBondContact O-N 2.99Å
168	P	55.2	Low	53.5	Low	119 Å²	119	121.6 Å²	121.6	77%	0.773	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-56.7	131.4	178.1	23.2	-32.3	0	0	0	109.3
169	G	56.8	Low	54	Low	52 Å²	52	125.5 Å²	125.5	54%	0.536	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-53.1	144	177.6	0	0	0	0	0	111.4	A167 V171	A167-G169 PolarHBondContact O-N 2.99Å; G169-V171 PolarHBondContact O-N 3.36Å
170	S	61.3	Low	54.4	Low	55 Å²	55	122.9 Å²	122.9	39%	0.385	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-47.9	140.1	175	-179.7	0	0	0	0	110.4	F172 D173	S170-F172 PolarHBondContact O-N 3.39Å; S170-F172 PolarHBondContact OG-N 3.08Å; S170-D173 WeakPolarHBondContact O-CB 3.45Å; S170-D173 PolarHBondContact O-N 3.35Å
171	V	60.1	Low	55.2	Low	86 Å²	86	119.9 Å²	119.9	52%	0.521	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.6	-18.9	173.1	87.9	0	0	0	0	111.7	G169	G169-V171 PolarHBondContact O-N 3.36Å
172	F	58.8	Low	55.5	Low	182 Å²	182	121.8 Å²	121.8	80%	0.798	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-15.6	175.1	-63.3	-81.9	0	0	0	113.8	S170 R174	S170-F172 PolarHBondContact O-N 3.39Å; S170-F172 PolarHBondContact OG-N 3.08Å; F172-R174 VanDerWaalsContact C-N 3.32Å
173	D	61.7	Low	56	Low	137 Å²	137	121.3 Å²	121.3	73%	0.733	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-12.3	170.8	-93.3	-84.1	0	0	0	112.2	S170 S175	S170-D173 WeakPolarHBondContact O-CB 3.45Å; S170-D173 PolarHBondContact O-N 3.35Å; D173-S175 PolarHBondContact O-N 2.89Å
174	R	52.7	Low	56.2	Low	122 Å²	122	122.2 Å²	122.2	46%	0.46	67%	0.673	S	S	.	*	S	Bend	trans	-69.9	126.8	179.4	-62.2	-176.1	-166.5	-178.9	2.9	109.6	F172 E178	F172-R174 VanDerWaalsContact C-N 3.32Å; R174-E178 HydrophobicContact CB-CB 4.31Å
175	S	58.9	Low	56	Low	58 Å²	58	120.4 Å²	120.4	41%	0.406	67%	0.671	S	S	.	*			trans	-51.7	145.3	165.9	61.2	0	0	0	0	109.5	D173 D177 E178	D173-S175 PolarHBondContact O-N 2.89Å; S175-D177 PolarHBondContact O-N 3.3Å; S175-E178 PolarHBondContact N-OE2 3.46Å; S175-E178 PolarHBondContact O-N 3.17Å; S175-E178 WeakPolarHBondContact OG-CG 3.43Å; S175-E178 PolarHBondContact OG-OE2 3.47Å
176	M	56.1	Low	55.9	Low	164 Å²	164	124 Å²	124	81%	0.808	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-58.4	-24.9	-177.5	-165.7	164.7	127.1	0	0	111.9
177	D	62.9	Low	55.7	Low	155 Å²	155	126.5 Å²	126.5	83%	0.829	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-76	-15.6	177.1	-56.9	-76.3	0	0	0	114.4	S175 R179	S175-D177 PolarHBondContact O-N 3.3Å; D177-R179 VanDerWaalsContact C-N 3.35Å
178	E	59.2	Low	55.6	Low	121 Å²	121	131 Å²	131	57%	0.565	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-89.4	2.1	175.1	-81.1	176.7	112.4	0	0	113.6	R174 S175 S180	R174-E178 HydrophobicContact CB-CB 4.31Å; S175-E178 PolarHBondContact N-OE2 3.46Å; S175-E178 PolarHBondContact O-N 3.17Å; S175-E178 WeakPolarHBondContact OG-CG 3.43Å; S175-E178 PolarHBondContact OG-OE2 3.47Å; E178-S180 PolarHBondContact O-N 3.28Å
179	R	51.9	Low	55.6	Low	186 Å²	186	131.4 Å²	131.4	70%	0.702	69%	0.692	S	S	*	*	S	Bend	trans	-69.8	117	173.4	-72.9	-173.9	177	-158	0.2	109.2	D177	D177-R179 VanDerWaalsContact C-N 3.35Å
180	S	51.9	Low	55.6	Low	75 Å²	75	136.6 Å²	136.6	52%	0.524	71%	0.706	S	S	.	*			trans	-44.6	140.2	179.5	-43.1	0	0	0	0	112	E178 Y182	E178-S180 PolarHBondContact O-N 3.28Å; S180-Y182 PolarHBondContact O-N 3.29Å
181	P	59.3	Low	55.2	Low	117 Å²	117	142.4 Å²	142.4	76%	0.76	73%	0.726	S	S	*	*	S	Bend	trans	-69.2	18.4	-176.8	27.3	-34.6	0	0	0	115	L183	P181-L183 VanDerWaalsContact C-N 3.32Å; P181-L183 PolarHBondContact O-N 2.9Å
182	Y	49.8	Very low	55	Low	201 Å²	201	147 Å²	147	79%	0.788	74%	0.739	S	S	*	*			trans	-79.4	81.4	178.7	-67.8	-76.4	0	0	0	110.4	S180	S180-Y182 PolarHBondContact O-N 3.29Å
183	L	51.3	Low	54.7	Low	172 Å²	172	143.3 Å²	143.3	90%	0.901	74%	0.743	S	S	*	*			trans	170.8	60.5	143.3	-89.4	156.6	0	0	0	107.7	P181 A185	P181-L183 VanDerWaalsContact C-N 3.32Å; P181-L183 PolarHBondContact O-N 2.9Å; L183-A185 PolarHBondContact O-N 3.11Å
184	Q	49.2	Very low	54.1	Low	166 Å²	166	145.9 Å²	145.9	78%	0.776	74%	0.743	S	S	*	*			trans	-74.5	109.1	151.7	-78.1	-175.6	-26	0	0	106.3	T186	Q184-T186 HydrophobicContact CB-CG2 4.19Å; Q184-T186 PolarHBondContact O-N 3.48Å
185	A	49	Very low	54.1	Low	99 Å²	99	143.8 Å²	143.8	82%	0.818	76%	0.76	S	S	*	*			trans	-66.1	89.4	170.4	0	0	0	0	0	108.1	L183	L183-A185 PolarHBondContact O-N 3.11Å
186	T	55.4	Low	53.8	Low	117 Å²	117	149.3 Å²	149.3	72%	0.718	78%	0.78	S	S	*	*			trans	-99.9	46.7	175.9	50.8	0	0	0	0	110.6	Q184	Q184-T186 HydrophobicContact CB-CG2 4.19Å; Q184-T186 PolarHBondContact O-N 3.48Å
187	E	54.1	Low	53.6	Low	182 Å²	182	151 Å²	151	85%	0.85	81%	0.807	S	S	*	*	S	Bend	trans	-143.2	148.9	164.9	-73.2	-154.4	152.4	0	0	112.2	T189	E187-T189 PolarHBondContact O-N 2.79Å
188	Q	52.2	Low	53.1	Low	185 Å²	185	150.8 Å²	150.8	86%	0.864	81%	0.806	S	S	*	*			trans	-58.3	120.9	-169.5	-65.7	177.8	-22.8	0	0	110.4	I190	Q188-I190 PolarHBondContact O-N 2.98Å; Q188-I190 VanDerWaalsContact O-N 3.09Å
189	T	55.1	Low	52.8	Low	127 Å²	127	152.4 Å²	152.4	78%	0.779	82%	0.819	S	S	*	*			trans	-52.8	117.6	164.1	-79.8	0	0	0	0	107.6	E187 Q191	E187-T189 PolarHBondContact O-N 2.79Å; T189-Q191 PolarHBondContact O-N 2.88Å
190	I	57.7	Low	52.8	Low	162 Å²	162	150.5 Å²	150.5	83%	0.831	83%	0.826	S	S	*	*			trans	-58.9	108.7	170.7	-61.8	178.4	0	0	0	106.5	Q188 K192	Q188-I190 PolarHBondContact O-N 2.98Å; Q188-I190 VanDerWaalsContact O-N 3.09Å; I190-K192 PolarHBondContact O-N 2.91Å
191	Q	52.8	Low	52.9	Low	176 Å²	176	154.9 Å²	154.9	82%	0.822	84%	0.843	S	S	*	*			trans	-62.8	126.5	174.8	-70.7	178.5	-37.1	0	0	108.3	T189 A193	T189-Q191 PolarHBondContact O-N 2.88Å; Q191-A193 PolarHBondContact O-N 2.96Å; Q191-A193 VanDerWaalsContact O-N 3.16Å
192	K	54.7	Low	52.5	Low	182 Å²	182	157.3 Å²	157.3	79%	0.791	85%	0.848	S	S	*	*			trans	-55.9	117.2	166.5	-72.8	175.4	175	-177.8	0	108.2	I190 Y194	I190-K192 PolarHBondContact O-N 2.91Å; K192-Y194 PolarHBondContact O-N 3.12Å; K192-Y194 VanDerWaalsContact O-N 3.14Å
193	A	52.2	Low	52.7	Low	105 Å²	105	154.4 Å²	154.4	87%	0.868	85%	0.852	S	S	*	*			trans	-67.2	106.4	163.9	0	0	0	0	0	108.4	Q191	Q191-A193 PolarHBondContact O-N 2.96Å; Q191-A193 VanDerWaalsContact O-N 3.16Å
194	Y	50.8	Low	52.8	Low	191 Å²	191	153.1 Å²	153.1	75%	0.749	85%	0.849	S	S	*	*			trans	-86	117.8	157.2	-96.3	-100.4	0	0	0	107	K192	K192-Y194 PolarHBondContact O-N 3.12Å; K192-Y194 VanDerWaalsContact O-N 3.14Å
195	G	52	Low	53	Low	79 Å²	79	152.2 Å²	152.2	81%	0.814	86%	0.855	S	S	*	*			trans	-96.8	102.8	162.4	0	0	0	0	0	108.2
196	E	52.2	Low	53.4	Low	174 Å²	174	156.6 Å²	156.6	81%	0.813	86%	0.858	S	S	*	*			trans	-116.7	131.8	152.2	-85.8	176.9	91.2	0	0	106.2
197	S	51.2	Low	53.2	Low	199 Å²	199	160.2 Å²	160.2	100%	1.392	87%	0.87	S	S	*	*			trans	-92.6	0	158.9	-57.4	0	0	0	0	108.5

Retrieved 197 of 197 residues in 66.8 ms (Link to these results)

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