A0A087YRK5_POEFO Loading...

Claudin 2

AlphaFold DB , UniProt , Accession A0A087YRK5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 262 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	89.4	Confident	91.8	Very high	42 Å²	42	45.3 Å²	45.3	21%	0.207	26%	0.256	C	S	.	.				0	-76.1	0	-159.7	-172.3	110.1	0	0	114.4	G3 T4 L5 V75 I78 S158	M1-G3 PolarHBondContact O-N 2.89Å; M1-T4 VanDerWaalsContact CA-OG1 3.29Å; M1-T4 WeakPolarHBondContact CA-OG1 3.08Å; M1-T4 PolarHBondContact N-OG1 2.93Å; M1-T4 PolarHBondContact O-N 3.08Å; M1-T4 VanDerWaalsContact O-N 3.08Å; M1-T4 PolarHBondContact O-OG1 2.98Å; M1-L5 WeakPolarHBondContact O-CB 3.34Å; M1-L5 PolarHBondContact O-N 3.43Å; M1-V75 HydrophobicContact SD-CG2 4.07Å; M1-I78 HydrophobicContact CB-CD1 4.48Å; M1-I78 HydrophobicContact SD-CD1 3.49Å; M1-I78 WeakPolarHBondContact SD-CD1 3.36Å; M1-S158 PolarHBondContact N-OG 3.35Å
2	M	92.8	Very high	91.6	Very high	136 Å²	136	48.3 Å²	48.3	67%	0.67	26%	0.261	S	S	*	.	H	α-helix	trans	-59.8	-46.1	-169.6	-73.8	-58.1	-168.4	0	0	113.6	T4 L5 V6	M2-T4 VanDerWaalsContact C-N 3.35Å; M2-T4 PolarHBondContact O-N 2.96Å; M2-L5 PolarHBondContact O-N 3.46Å; M2-V6 WeakPolarHBondContact O-CG2 3.35Å; M2-V6 PolarHBondContact O-N 2.04Å
3	G	92.7	Very high	91.4	Very high	22 Å²	22	45.2 Å²	45.2	23%	0.227	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-34.6	174.2	0	0	0	0	0	114	M1 A7 S154	M1-G3 PolarHBondContact O-N 2.89Å; G3-A7 VanDerWaalsContact O-CB 3.27Å; G3-A7 WeakPolarHBondContact O-CB 3.46Å; G3-A7 PolarHBondContact O-N 2.89Å; G3-S154 WeakPolarHBondContact CA-OG 3.43Å
4	T	92.3	Very high	91.1	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-71.8	-34.7	176.5	53.5	0	0	0	0	111.9	M1 M2 T8 S154	M1-T4 VanDerWaalsContact CA-OG1 3.29Å; M1-T4 WeakPolarHBondContact CA-OG1 3.08Å; M1-T4 PolarHBondContact N-OG1 2.93Å; M1-T4 PolarHBondContact O-N 3.08Å; M1-T4 VanDerWaalsContact O-N 3.08Å; M1-T4 PolarHBondContact O-OG1 2.98Å; M2-T4 VanDerWaalsContact C-N 3.35Å; M2-T4 PolarHBondContact O-N 2.96Å; T4-T8 VanDerWaalsContact O-CB 3.31Å; T4-T8 WeakPolarHBondContact O-CB 3.46Å; T4-T8 PolarHBondContact O-N 2.91Å; T4-T8 PolarHBondContact O-OG1 3.18Å; T4-S154 WeakPolarHBondContact CG2-OG 3.07Å; T4-S154 PolarHBondContact N-OG 3.07Å; T4-S154 VanDerWaalsContact N-OG 3.11Å
5	L	93.9	Very high	90.8	Very high	66 Å²	66	44.1 Å²	44.1	35%	0.346	24%	0.235	S	C	.	.	H	α-helix	trans	-66.3	-49	172.2	-173.3	161.3	0	0	0	111	M1 M2 A7 T8 V9	M1-L5 WeakPolarHBondContact O-CB 3.34Å; M1-L5 PolarHBondContact O-N 3.43Å; M2-L5 PolarHBondContact O-N 3.46Å; L5-A7 PolarHBondContact O-N 2.81Å; L5-T8 WeakPolarHBondContact O-CB 3.31Å; L5-T8 PolarHBondContact O-N 3.23Å; L5-T8 VanDerWaalsContact O-N 3.1Å; L5-V9 HydrophobicContact CD2-CG2 4.39Å; L5-V9 WeakPolarHBondContact O-CG2 3.47Å; L5-V9 PolarHBondContact O-N 2.87Å; L5-V9 VanDerWaalsContact O-N 3.11Å
6	V	94	Very high	90.2	Very high	63 Å²	63	41.4 Å²	41.4	38%	0.382	22%	0.221	S	C	.	.	H	α-helix	trans	-58.8	-47.5	176.9	168	0	0	0	0	111	M2 T8 V9 L10	M2-V6 WeakPolarHBondContact O-CG2 3.35Å; M2-V6 PolarHBondContact O-N 2.04Å; V6-T8 VanDerWaalsContact C-N 3.32Å; V6-T8 PolarHBondContact O-N 2.78Å; V6-V9 PolarHBondContact O-N 2.98Å; V6-L10 HydrophobicContact CG1-CD1 3.54Å; V6-L10 HydrophobicContact CG1-CG 4.25Å; V6-L10 WeakPolarHBondContact O-CB 3.43Å; V6-L10 PolarHBondContact O-N 3.42Å
7	A	91.9	Very high	89.3	Confident	1 Å²	1	42 Å²	42	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-37.2	174.4	0	0	0	0	0	112.3	G3 L5 V9 W13 C147	G3-A7 VanDerWaalsContact O-CB 3.27Å; G3-A7 WeakPolarHBondContact O-CB 3.46Å; G3-A7 PolarHBondContact O-N 2.89Å; L5-A7 PolarHBondContact O-N 2.81Å; A7-V9 VanDerWaalsContact C-N 3.28Å; A7-V9 PolarHBondContact O-N 2.84Å; A7-W13 PolarHBondContact O-NE1 3.41Å; A7-C147 HydrophobicContact CB-CB 4.24Å
8	T	91.6	Very high	88.1	Confident	10 Å²	10	43.3 Å²	43.3	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-32	177.4	-61.3	0	0	0	0	112.6	T4 L5 V6 L33 W34 M67	T4-T8 VanDerWaalsContact O-CB 3.31Å; T4-T8 WeakPolarHBondContact O-CB 3.46Å; T4-T8 PolarHBondContact O-N 2.91Å; T4-T8 PolarHBondContact O-OG1 3.18Å; L5-T8 WeakPolarHBondContact O-CB 3.31Å; L5-T8 PolarHBondContact O-N 3.23Å; L5-T8 VanDerWaalsContact O-N 3.1Å; V6-T8 VanDerWaalsContact C-N 3.32Å; V6-T8 PolarHBondContact O-N 2.78Å; T8-L33 HydrophobicContact CG2-CD2 4.25Å; T8-W34 PolarHBondContact O-NE1 3.32Å; T8-M67 HydrophobicContact CG2-CB 4.15Å
9	V	91.1	Very high	86.6	Confident	82 Å²	82	47.1 Å²	47.1	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-92.1	-37.6	-175.3	176.2	0	0	0	0	113	L5 V6 A7	L5-V9 HydrophobicContact CD2-CG2 4.39Å; L5-V9 WeakPolarHBondContact O-CG2 3.47Å; L5-V9 PolarHBondContact O-N 2.87Å; L5-V9 VanDerWaalsContact O-N 3.11Å; V6-V9 PolarHBondContact O-N 2.98Å; A7-V9 VanDerWaalsContact C-N 3.28Å; A7-V9 PolarHBondContact O-N 2.84Å
10	L	91.6	Very high	85	Confident	63 Å²	63	45.9 Å²	45.9	33%	0.33	25%	0.254	S	S	.	.			trans	-75.9	147.2	-171	-78	178.2	0	0	0	114.5	V6 Y12 C147	V6-L10 HydrophobicContact CG1-CD1 3.54Å; V6-L10 HydrophobicContact CG1-CG 4.25Å; V6-L10 WeakPolarHBondContact O-CB 3.43Å; V6-L10 PolarHBondContact O-N 3.42Å; L10-Y12 VanDerWaalsContact C-N 3.28Å; L10-Y12 HydrophobicContact CB-CD2 4.25Å; L10-Y12 HydrophobicContact CD2-CD2 4.44Å; L10-Y12 HydrophobicContact CD2-CE2 4.4Å; L10-Y12 PolarHBondContact O-N 2.77Å; L10-C147 WeakPolarHBondContact CB-SG 3.4Å
11	P	88.1	Confident	83.6	Confident	12 Å²	12	49.7 Å²	49.7	8%	0.078	28%	0.284	C	S	.	.	S	Bend	trans	-84.6	19	-178.7	35.3	-36.4	0	0	0	116	M30 R31 G32 M35	P11-M30 CarbonylContact O-C 3.47Å; P11-R31 CarbonylContact C-O 3.59Å; P11-R31 CarbonylContact O-C 3.59Å; P11-R31 PolarHBondContact O-N 2.85Å; P11-R31 VanDerWaalsContact O-O 3.06Å; P11-G32 VanDerWaalsContact CA-CA 3.47Å; P11-G32 PolarHBondContact O-N 2.68Å; P11-M35 HydrophobicContact CB-CG 3.9Å; P11-M35 HydrophobicContact CB-SD 4.44Å; P11-M35 HydrophobicContact CG-SD 4.47Å
12	Y	89.3	Confident	81.7	Confident	82 Å²	82	53.4 Å²	53.4	32%	0.322	31%	0.305	S	S	.	.			trans	-108.4	49.4	-174.5	-54.3	-76	0	0	0	112.8	L10 I15 M30 G145 E146 C147	L10-Y12 VanDerWaalsContact C-N 3.28Å; L10-Y12 HydrophobicContact CB-CD2 4.25Å; L10-Y12 HydrophobicContact CD2-CD2 4.44Å; L10-Y12 HydrophobicContact CD2-CE2 4.4Å; L10-Y12 PolarHBondContact O-N 2.77Å; Y12-I15 HydrophobicContact CD1-CD1 4.45Å; Y12-M30 HydrophobicContact CD1-CB 4.44Å; Y12-M30 HydrophobicContact CD1-CG 4.31Å; Y12-M30 HydrophobicContact CD1-SD 3.83Å; Y12-M30 HydrophobicContact CE1-CG 4.12Å; Y12-M30 HydrophobicContact CE1-SD 3.96Å; Y12-G145 CarbonylContact O-C 3.56Å; Y12-G145 VanDerWaalsContact O-C 3.24Å; Y12-G145 VanDerWaalsContact O-CA 3.29Å; Y12-G145 WeakPolarHBondContact O-CA 3.27Å; Y12-E146 PolarHBondContact O-N 3.09Å; Y12-C147 VanDerWaalsContact O-CB 3.28Å; Y12-C147 WeakPolarHBondContact O-CB 3.27Å; Y12-C147 PolarHBondContact O-N 3.13Å; Y12-C147 VanDerWaalsContact O-N 3.09Å
13	W	89.4	Confident	79.9	Confident	8 Å²	8	55 Å²	55	3%	0.03	31%	0.314	C	S	.	.	S	Bend	trans	-85.3	-46.8	172	-75.6	57.7	0	0	0	111.5	A7 R31 L33 M67 T123 G145 L148	A7-W13 PolarHBondContact O-NE1 3.41Å; W13-R31 WeakPolarHBondContact CB-O 3.46Å; W13-R31 PolarHBondContact N-O 2.86Å; W13-L33 HydrophobicContact CD2-CD1 4.41Å; W13-L33 HydrophobicContact CE3-CD1 4.46Å; W13-L33 HydrophobicContact CH2-CD1 3.92Å; W13-L33 HydrophobicContact CH2-CD2 4.43Å; W13-L33 HydrophobicContact CZ2-CB 4.47Å; W13-L33 HydrophobicContact CZ2-CD1 3.87Å; W13-L33 HydrophobicContact CZ2-CD2 3.98Å; W13-L33 HydrophobicContact CZ2-CG 4.33Å; W13-L33 HydrophobicContact CZ3-CD1 4.23Å; W13-M67 HydrophobicContact CH2-CE 3.52Å; W13-M67 HydrophobicContact CH2-CG 4.09Å; W13-M67 HydrophobicContact CZ2-CE 3.81Å; W13-M67 HydrophobicContact CZ2-CG 4.27Å; W13-T123 HydrophobicContact CE3-CG2 4.03Å; W13-T123 HydrophobicContact CZ3-CG2 4.02Å; W13-T123 WeakPolarHBondContact CZ3-OG1 3.48Å; W13-G145 WeakPolarHBondContact O-CA 3.48Å; W13-G145 PolarHBondContact O-N 3.31Å; W13-L148 HydrophobicContact CD2-CD2 4.36Å; W13-L148 HydrophobicContact CE3-CD2 3.68Å; W13-L148 HydrophobicContact CE3-CG 4.46Å; W13-L148 HydrophobicContact CZ3-CD2 4.05Å; W13-L148 WeakPolarHBondContact O-CD1 3.45Å
14	Q	87.5	Confident	78.3	Confident	39 Å²	39	59.9 Å²	59.9	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.2	177.6	-53.3	176.9	-22.3	0	0	108.8	R31 V127 Y142	Q14-R31 HydrophobicContact CB-CB 4.24Å; Q14-R31 PolarHBondContact N-O 2.84Å; Q14-R31 PolarHBondContact O-N 3.42Å; Q14-V127 HydrophobicContact CG-CG2 3.78Å; Q14-Y142 HydrophobicContact CB-CD1 3.88Å
15	I	86.3	Confident	76.7	Confident	35 Å²	35	62.5 Å²	62.5	18%	0.179	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.9	-176.7	-59	-175.7	0	0	0	107.8	Y12 N29 M30 Y142 E143	Y12-I15 HydrophobicContact CD1-CD1 4.45Å; I15-N29 CarbonylContact C-O 3.58Å; I15-N29 WeakPolarHBondContact CA-O 3.48Å; I15-M30 HydrophobicContact CB-SD 4.11Å; I15-M30 HydrophobicContact CD1-SD 3.92Å; I15-M30 HydrophobicContact CG1-SD 3.65Å; I15-M30 HydrophobicContact CG2-CE 3.96Å; I15-M30 HydrophobicContact CG2-SD 3.7Å; I15-Y142 CarbonylContact O-C 3.36Å; I15-Y142 WeakPolarHBondContact O-CA 3.41Å; I15-E143 HydrophobicContact CB-CB 4.49Å; I15-E143 PolarHBondContact N-O 3.16Å; I15-E143 PolarHBondContact O-N 3.02Å
16	S	82.1	Confident	75.4	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	123.1	173.8	-171.9	0	0	0	0	111.3	H18 A28 N29 K141	S16-H18 PolarHBondContact O-N 3.03Å; S16-A28 CarbonylContact O-C 3.15Å; S16-A28 WeakPolarHBondContact O-CA 3.46Å; S16-N29 PolarHBondContact N-O 2.77Å; S16-N29 PolarHBondContact O-N 2.96Å; S16-K141 WeakPolarHBondContact CB-O 3.35Å; S16-K141 PolarHBondContact OG-O 3.21Å
17	A	74.8	Confident	74.7	Confident	51 Å²	51	61 Å²	61	42%	0.421	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	93	171.9	0	0	0	0	0	109.6	I19	A17-I19 PolarHBondContact O-N 3.26Å; A17-I19 VanDerWaalsContact O-N 3.1Å
18	H	67.8	Low	74.2	Confident	65 Å²	65	61.8 Å²	61.8	30%	0.301	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	101.5	174.8	-165.9	54.3	0	0	0	110.8	S16 G20 V27 G139 M140	S16-H18 PolarHBondContact O-N 3.03Å; H18-G20 PolarHBondContact O-N 2.61Å; H18-V27 WeakPolarHBondContact CA-O 3.43Å; H18-V27 WeakPolarHBondContact CB-O 3.38Å; H18-V27 PolarHBondContact N-O 2.87Å; H18-V27 PolarHBondContact O-N 3.38Å; H18-G139 WeakPolarHBondContact CA-O 3.48Å; H18-G139 PolarHBondContact ND1-O 2.78Å; H18-M140 VanDerWaalsContact CE1-SD 3.56Å; H18-M140 PolarHBondContact ND1-SD 2.77Å
19	I	58.2	Low	74	Confident	115 Å²	115	62.8 Å²	62.8	59%	0.59	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	92.2	168	-54.2	173.2	0	0	0	106.8	A17	A17-I19 PolarHBondContact O-N 3.26Å; A17-I19 VanDerWaalsContact O-N 3.1Å
20	G	55.8	Low	73.8	Confident	23 Å²	23	60.3 Å²	60.3	24%	0.237	34%	0.344	C	S	.	.			trans	-65.3	161.2	173.4	0	0	0	0	0	111.8	H18 N22	H18-G20 PolarHBondContact O-N 2.61Å; G20-N22 PolarHBondContact O-N 2.78Å; G20-N22 VanDerWaalsContact O-N 3.08Å
21	S	54.3	Low	73.7	Confident	126 Å²	126	61.4 Å²	61.4	88%	0.881	34%	0.344	S	S	*	.	S	Bend	trans	-66	-8.4	177.7	49.1	0	0	0	0	114.4
22	N	49.5	Very low	73.7	Confident	120 Å²	120	61.1 Å²	61.1	64%	0.642	34%	0.343	S	S	*	.	S	Bend	trans	-88.9	110.5	165.2	-82	-59.7	0	0	0	110.3	G20 V24 T25	G20-N22 PolarHBondContact O-N 2.78Å; G20-N22 VanDerWaalsContact O-N 3.08Å; N22-V24 PolarHBondContact O-N 3.35Å; N22-T25 PolarHBondContact O-N 3.17Å
23	I	55.3	Low	73.6	Confident	169 Å²	169	57.4 Å²	57.4	87%	0.867	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-10.5	-176.2	-62.9	164.1	0	0	0	113.9
24	V	60.2	Low	73.6	Confident	126 Å²	126	61.7 Å²	61.7	76%	0.764	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-18.3	-168.7	-174.6	0	0	0	0	113.8	N22	N22-V24 PolarHBondContact O-N 3.35Å
25	T	59.1	Low	73.7	Confident	56 Å²	56	62.4 Å²	62.4	34%	0.344	35%	0.349	S	S	.	.			trans	-132.7	108.5	-175.6	53.9	0	0	0	0	112	N22	N22-T25 PolarHBondContact O-N 3.17Å
26	V	65.6	Low	73.8	Confident	71 Å²	71	62.4 Å²	62.4	43%	0.43	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.3	167.5	-179.5	0	0	0	0	108.2	S41	V26-S41 PolarHBondContact N-OG 3.26Å; V26-S41 PolarHBondContact O-N 2.96Å; V26-S41 PolarHBondContact O-OG 3.36Å
27	V	78.8	Confident	74.1	Confident	25 Å²	25	62.4 Å²	62.4	15%	0.152	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	119	-176.4	-176.4	0	0	0	0	109.3	H18 V38 Y39 Q40	H18-V27 WeakPolarHBondContact CA-O 3.43Å; H18-V27 WeakPolarHBondContact CB-O 3.38Å; H18-V27 PolarHBondContact N-O 2.87Å; H18-V27 PolarHBondContact O-N 3.38Å; V27-V38 HydrophobicContact CG1-CG1 3.41Å; V27-V38 VanDerWaalsContact CG1-CG1 3.41Å; V27-Y39 CarbonylContact C-O 3.53Å; V27-Y39 WeakPolarHBondContact CA-O 3.34Å; V27-Q40 HydrophobicContact CG1-CG 4.21Å; V27-Q40 HydrophobicContact CG2-CG 4.07Å
28	A	82.8	Confident	74.7	Confident	19 Å²	19	61.8 Å²	61.8	16%	0.157	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	116.6	176.9	0	0	0	0	0	110.2	S16 M30 Y39	S16-A28 CarbonylContact O-C 3.15Å; S16-A28 WeakPolarHBondContact O-CA 3.46Å; A28-M30 HydrophobicContact CB-CE 4.11Å; A28-Y39 PolarHBondContact N-O 3.01Å; A28-Y39 PolarHBondContact O-N 3.48Å
29	N	86	Confident	75.6	Confident	31 Å²	31	64.3 Å²	64.3	17%	0.166	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.8	177.8	-65.2	-13.1	0	0	0	109.7	I15 S16	I15-N29 CarbonylContact C-O 3.58Å; I15-N29 WeakPolarHBondContact CA-O 3.48Å; S16-N29 PolarHBondContact N-O 2.77Å; S16-N29 PolarHBondContact O-N 2.96Å
30	M	88.4	Confident	76.9	Confident	30 Å²	30	61.6 Å²	61.6	15%	0.148	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109	-179.8	-54.3	-68.4	174.8	0	0	108.2	P11 Y12 I15 A28 C37	P11-M30 CarbonylContact O-C 3.47Å; Y12-M30 HydrophobicContact CD1-CB 4.44Å; Y12-M30 HydrophobicContact CD1-CG 4.31Å; Y12-M30 HydrophobicContact CD1-SD 3.83Å; Y12-M30 HydrophobicContact CE1-CG 4.12Å; Y12-M30 HydrophobicContact CE1-SD 3.96Å; I15-M30 HydrophobicContact CB-SD 4.11Å; I15-M30 HydrophobicContact CD1-SD 3.92Å; I15-M30 HydrophobicContact CG1-SD 3.65Å; I15-M30 HydrophobicContact CG2-CE 3.96Å; I15-M30 HydrophobicContact CG2-SD 3.7Å; A28-M30 HydrophobicContact CB-CE 4.11Å; M30-C37 HydrophobicContact CB-CB 4.24Å; M30-C37 PolarHBondContact N-O 3.19Å; M30-C37 PolarHBondContact O-N 3.12Å
31	R	87.9	Confident	78.1	Confident	85 Å²	85	63.6 Å²	63.6	32%	0.321	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.2	179.9	-75.6	-176.7	170.7	-147.6	-19.5	111.1	P11 W13 Q14 E36 Y142	P11-R31 CarbonylContact C-O 3.59Å; P11-R31 CarbonylContact O-C 3.59Å; P11-R31 PolarHBondContact O-N 2.85Å; P11-R31 VanDerWaalsContact O-O 3.06Å; W13-R31 WeakPolarHBondContact CB-O 3.46Å; W13-R31 PolarHBondContact N-O 2.86Å; Q14-R31 HydrophobicContact CB-CB 4.24Å; Q14-R31 PolarHBondContact N-O 2.84Å; Q14-R31 PolarHBondContact O-N 3.42Å; R31-E36 HydrophobicContact CG-CG 3.87Å; R31-E36 IonicContact CZ-OE1 3.2Å; R31-E36 IonicContact CZ-OE2 3.34Å; R31-E36 IonicContact NE-OE1 2.77Å; R31-E36 PolarHBondContact NE-OE1 2.87Å; R31-E36 IonicContact NE-OE2 3.21Å; R31-E36 PolarHBondContact NE-OE2 3.46Å; R31-E36 VanDerWaalsContact NH2-CD 3.32Å; R31-E36 IonicContact NH2-OE1 2.78Å; R31-E36 PolarHBondContact NH2-OE1 2.74Å; R31-E36 IonicContact NH2-OE2 3.03Å; R31-E36 PolarHBondContact NH2-OE2 3.27Å; R31-Y142 HydrophobicContact CG-CE1 4.47Å; R31-Y142 PolarHBondContact NE-OH 2.76Å
32	G	89.8	Confident	79.3	Confident	6 Å²	6	62.3 Å²	62.3	6%	0.062	33%	0.329	C	S	.	.			trans	-104.9	177.3	172.9	0	0	0	0	0	113.9	P11 M35	P11-G32 VanDerWaalsContact CA-CA 3.47Å; P11-G32 PolarHBondContact O-N 2.68Å; G32-M35 VanDerWaalsContact CA-O 3.27Å; G32-M35 WeakPolarHBondContact CA-O 3.38Å; G32-M35 PolarHBondContact N-O 3.1Å
33	L	87.1	Confident	80.8	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.026	33%	0.325	C	S	.	.	S	Bend	trans	-71.9	-33.8	173.9	-147.1	67.6	0	0	0	111.9	T8 W13 L60 R64 M67	T8-L33 HydrophobicContact CG2-CD2 4.25Å; W13-L33 HydrophobicContact CD2-CD1 4.41Å; W13-L33 HydrophobicContact CE3-CD1 4.46Å; W13-L33 HydrophobicContact CH2-CD1 3.92Å; W13-L33 HydrophobicContact CH2-CD2 4.43Å; W13-L33 HydrophobicContact CZ2-CB 4.47Å; W13-L33 HydrophobicContact CZ2-CD1 3.87Å; W13-L33 HydrophobicContact CZ2-CD2 3.98Å; W13-L33 HydrophobicContact CZ2-CG 4.33Å; W13-L33 HydrophobicContact CZ3-CD1 4.23Å; L33-L60 WeakPolarHBondContact O-CD2 3.46Å; L33-R64 HydrophobicContact CD2-CG 4.25Å; L33-R64 HydrophobicContact CG-CG 3.82Å; L33-R64 PolarHBondContact O-NE 3.46Å; L33-R64 PolarHBondContact O-NH2 2.65Å; L33-M67 HydrophobicContact CD2-CB 3.97Å; L33-M67 HydrophobicContact CD2-CG 4.02Å
34	W	88.8	Confident	82.1	Confident	97 Å²	97	53 Å²	53	37%	0.367	30%	0.299	S	S	.	.	S	Bend	trans	-113.9	-24.2	-175	-57.4	93.2	0	0	0	115.4	T8 Y50 V68	T8-W34 PolarHBondContact O-NE1 3.32Å; W34-Y50 WeakPolarHBondContact O-CD2 3.49Å; W34-Y50 PolarHBondContact O-N 3.14Å; W34-Y50 VanDerWaalsContact O-N 3.16Å; W34-V68 HydrophobicContact CH2-CG2 4.11Å; W34-V68 HydrophobicContact CZ2-CG2 3.77Å
35	M	89.1	Confident	83.4	Confident	55 Å²	55	52.3 Å²	52.3	27%	0.271	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	153.9	-174.8	70.3	-166.2	80.2	0	0	110.7	P11 G32 E48	P11-M35 HydrophobicContact CB-CG 3.9Å; P11-M35 HydrophobicContact CB-SD 4.44Å; P11-M35 HydrophobicContact CG-SD 4.47Å; G32-M35 VanDerWaalsContact CA-O 3.27Å; G32-M35 WeakPolarHBondContact CA-O 3.38Å; G32-M35 PolarHBondContact N-O 3.1Å; M35-E48 CarbonylContact C-O 3.58Å; M35-E48 VanDerWaalsContact CA-O 3.31Å; M35-E48 WeakPolarHBondContact CA-O 3.25Å
36	E	88.3	Confident	84.8	Confident	34 Å²	34	55.9 Å²	55.9	16%	0.159	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128.4	172.1	-168	157.3	166.9	0	0	108.6	R31 C47 E48 Y50	R31-E36 HydrophobicContact CG-CG 3.87Å; R31-E36 IonicContact CZ-OE1 3.2Å; R31-E36 IonicContact CZ-OE2 3.34Å; R31-E36 IonicContact NE-OE1 2.77Å; R31-E36 PolarHBondContact NE-OE1 2.87Å; R31-E36 IonicContact NE-OE2 3.21Å; R31-E36 PolarHBondContact NE-OE2 3.46Å; R31-E36 VanDerWaalsContact NH2-CD 3.32Å; R31-E36 IonicContact NH2-OE1 2.78Å; R31-E36 PolarHBondContact NH2-OE1 2.74Å; R31-E36 IonicContact NH2-OE2 3.03Å; R31-E36 PolarHBondContact NH2-OE2 3.27Å; E36-C47 CarbonylContact O-C 3.59Å; E36-C47 WeakPolarHBondContact O-CA 3.35Å; E36-E48 PolarHBondContact N-O 3.17Å; E36-E48 PolarHBondContact O-N 3.13Å; E36-Y50 HydrophobicContact CB-CE1 4.15Å; E36-Y50 HydrophobicContact CB-CE2 4.47Å; E36-Y50 WeakPolarHBondContact OE2-CE1 3.35Å; E36-Y50 PolarHBondContact OE2-OH 2.91Å
37	C	88.9	Confident	85.9	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.1	-179.6	-61.9	0	0	0	0	110.8	M30 F45 Q46 C47	M30-C37 HydrophobicContact CB-CB 4.24Å; M30-C37 PolarHBondContact N-O 3.19Å; M30-C37 PolarHBondContact O-N 3.12Å; C37-F45 HydrophobicContact CB-CE2 3.91Å; C37-F45 HydrophobicContact CB-CZ 3.8Å; C37-Q46 CarbonylContact C-O 3.56Å; C37-Q46 WeakPolarHBondContact CA-O 3.33Å; C37-C47 HydrophobicContact CB-CB 4.11Å; C37-C47 WeakPolarHBondContact CB-SG 3.39Å; C37-C47 WeakPolarHBondContact SG-CB 3.43Å; C37-C47 CovalentContact SG-SG 2.04Å; C37-C47 PolarHBondContact SG-SG 2.7Å
38	V	88	Confident	86.4	Confident	39 Å²	39	60.9 Å²	60.9	24%	0.236	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121	-178.7	-179.9	0	0	0	0	108.5	V27 Q40 F45 Q46	V27-V38 HydrophobicContact CG1-CG1 3.41Å; V27-V38 VanDerWaalsContact CG1-CG1 3.41Å; V38-Q40 HydrophobicContact CG1-CG 4.39Å; V38-F45 WeakPolarHBondContact O-CA 3.29Å; V38-Q46 PolarHBondContact N-O 3.06Å; V38-Q46 PolarHBondContact O-N 3.24Å
39	Y	86.4	Confident	86.6	Confident	118 Å²	118	63.9 Å²	63.9	46%	0.463	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.1	173.9	177.6	-99.8	0	0	0	109.8	V27 A28 F45	V27-Y39 CarbonylContact C-O 3.53Å; V27-Y39 WeakPolarHBondContact CA-O 3.34Å; A28-Y39 PolarHBondContact N-O 3.01Å; A28-Y39 PolarHBondContact O-N 3.48Å; Y39-F45 HydrophobicContact CD2-CB 4.48Å; Y39-F45 HydrophobicContact CD2-CD2 4.12Å
40	Q	85.3	Confident	86.4	Confident	58 Å²	58	64.6 Å²	64.6	27%	0.271	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	148.3	175.1	-59.5	-162.2	10.3	0	0	111.6	V27 V38 T42 G43 A44	V27-Q40 HydrophobicContact CG1-CG 4.21Å; V27-Q40 HydrophobicContact CG2-CG 4.07Å; V38-Q40 HydrophobicContact CG1-CG 4.39Å; Q40-T42 WeakPolarHBondContact CB-OG1 3.35Å; Q40-T42 PolarHBondContact O-N 3.11Å; Q40-G43 PolarHBondContact O-N 3.5Å; Q40-A44 HydrophobicContact CB-CB 4.46Å; Q40-A44 PolarHBondContact N-O 3.06Å
41	S	79.8	Confident	85.4	Confident	65 Å²	65	69.2 Å²	69.2	46%	0.455	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-9.6	174.1	59.1	0	0	0	0	114.8	V26 G43	V26-S41 PolarHBondContact N-OG 3.26Å; V26-S41 PolarHBondContact O-N 2.96Å; V26-S41 PolarHBondContact O-OG 3.36Å; S41-G43 VanDerWaalsContact C-N 3.27Å
42	T	80.3	Confident	84.2	Confident	98 Å²	98	69.1 Å²	69.1	60%	0.601	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.8	170.9	52.2	0	0	0	0	113.9	Q40 A44	Q40-T42 WeakPolarHBondContact CB-OG1 3.35Å; Q40-T42 PolarHBondContact O-N 3.11Å; T42-A44 VanDerWaalsContact C-N 3.33Å
43	G	80.7	Confident	82.5	Confident	55 Å²	55	73.9 Å²	73.9	57%	0.567	40%	0.399	S	S	*	.	S	Bend	trans	85.3	0.7	-176.2	0	0	0	0	0	114.3	Q40 S41	Q40-G43 PolarHBondContact O-N 3.5Å; S41-G43 VanDerWaalsContact C-N 3.27Å
44	A	82.9	Confident	81	Confident	38 Å²	38	82.4 Å²	82.4	31%	0.314	44%	0.444	S	S	.	.			trans	-76.3	123.5	174.1	0	0	0	0	0	110.9	Q40 T42	Q40-A44 HydrophobicContact CB-CB 4.46Å; Q40-A44 PolarHBondContact N-O 3.06Å; T42-A44 VanDerWaalsContact C-N 3.33Å
45	F	88.4	Confident	79.3	Confident	112 Å²	112	82.1 Å²	82.1	49%	0.491	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.4	171.5	-175	-109.8	0	0	0	109	C37 V38 Y39 C47	C37-F45 HydrophobicContact CB-CE2 3.91Å; C37-F45 HydrophobicContact CB-CZ 3.8Å; V38-F45 WeakPolarHBondContact O-CA 3.29Å; Y39-F45 HydrophobicContact CD2-CB 4.48Å; Y39-F45 HydrophobicContact CD2-CD2 4.12Å; F45-C47 WeakPolarHBondContact CE1-SG 3.49Å; F45-C47 VanDerWaalsContact CZ-SG 3.54Å
46	Q	86.8	Confident	78.3	Confident	131 Å²	131	80.8 Å²	80.8	61%	0.612	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.9	-178.1	-67.3	-177	84.1	0	0	109.3	C37 V38	C37-Q46 CarbonylContact C-O 3.56Å; C37-Q46 WeakPolarHBondContact CA-O 3.33Å; V38-Q46 PolarHBondContact N-O 3.06Å; V38-Q46 PolarHBondContact O-N 3.24Å
47	C	90.1	Very high	77.7	Confident	64 Å²	64	82.9 Å²	82.9	43%	0.432	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.6	173.3	-65	0	0	0	0	110	E36 C37 F45	E36-C47 CarbonylContact O-C 3.59Å; E36-C47 WeakPolarHBondContact O-CA 3.35Å; C37-C47 HydrophobicContact CB-CB 4.11Å; C37-C47 WeakPolarHBondContact CB-SG 3.39Å; C37-C47 WeakPolarHBondContact SG-CB 3.43Å; C37-C47 CovalentContact SG-SG 2.04Å; C37-C47 PolarHBondContact SG-SG 2.7Å; F45-C47 WeakPolarHBondContact CE1-SG 3.49Å; F45-C47 VanDerWaalsContact CZ-SG 3.54Å
48	E	88	Confident	77.3	Confident	138 Å²	138	86.1 Å²	86.1	65%	0.645	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.1	172.5	-162.6	-177.8	131.2	0	0	110	M35 E36	M35-E48 CarbonylContact C-O 3.58Å; M35-E48 VanDerWaalsContact CA-O 3.31Å; M35-E48 WeakPolarHBondContact CA-O 3.25Å; E36-E48 PolarHBondContact N-O 3.17Å; E36-E48 PolarHBondContact O-N 3.13Å
49	T	87	Confident	77	Confident	82 Å²	82	88.5 Å²	88.5	50%	0.503	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.2	172.8	-56.3	0	0	0	0	109.5	N51	T49-N51 VanDerWaalsContact C-N 3.3Å; T49-N51 VanDerWaalsContact O-CG 3.26Å; T49-N51 PolarHBondContact O-N 3.14Å; T49-N51 PolarHBondContact O-ND2 2.75Å; T49-N51 VanDerWaalsContact O-ND2 3.07Å
50	Y	82.8	Confident	76.9	Confident	46 Å²	46	84.7 Å²	84.7	18%	0.18	50%	0.498	C	S	.	.			trans	-70.1	81.9	179.8	-67.3	-65.8	0	0	0	112.4	W34 E36 S52 L56	W34-Y50 WeakPolarHBondContact O-CD2 3.49Å; W34-Y50 PolarHBondContact O-N 3.14Å; W34-Y50 VanDerWaalsContact O-N 3.16Å; E36-Y50 HydrophobicContact CB-CE1 4.15Å; E36-Y50 HydrophobicContact CB-CE2 4.47Å; E36-Y50 WeakPolarHBondContact OE2-CE1 3.35Å; E36-Y50 PolarHBondContact OE2-OH 2.91Å; Y50-S52 PolarHBondContact O-N 3.49Å; Y50-L56 HydrophobicContact CD1-CD1 3.9Å; Y50-L56 HydrophobicContact CE1-CD1 4.33Å; Y50-L56 HydrophobicContact CG-CD1 4.05Å
51	N	67.4	Low	77	Confident	127 Å²	127	86.9 Å²	86.9	68%	0.679	51%	0.508	S	S	*	.			trans	-68.4	-27.7	-171.6	-65.3	-53.3	0	0	0	114.4	T49	T49-N51 VanDerWaalsContact C-N 3.3Å; T49-N51 VanDerWaalsContact O-CG 3.26Å; T49-N51 PolarHBondContact O-N 3.14Å; T49-N51 PolarHBondContact O-ND2 2.75Å; T49-N51 VanDerWaalsContact O-ND2 3.07Å
52	S	62.2	Low	77.5	Confident	82 Å²	82	86.1 Å²	86.1	57%	0.573	51%	0.506	S	S	*	.			trans	-109	93	-171.5	-67.3	0	0	0	0	112.7	Y50 L54 A55	Y50-S52 PolarHBondContact O-N 3.49Å; S52-L54 PolarHBondContact O-N 3.12Å; S52-L54 VanDerWaalsContact O-N 3.17Å; S52-A55 PolarHBondContact O-N 3.39Å
53	M	55.2	Low	78	Confident	107 Å²	107	81.8 Å²	81.8	53%	0.527	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-56.5	-29.5	175.5	-68.9	-72	-170.7	0	0	113.5	A55	M53-A55 VanDerWaalsContact C-N 3.3Å; M53-A55 PolarHBondContact O-N 3.33Å
54	L	54.5	Low	78.5	Confident	184 Å²	184	79.8 Å²	79.8	96%	0.963	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-78.7	-7.2	-173.2	-151.3	73.1	0	0	0	114.6	S52	S52-L54 PolarHBondContact O-N 3.12Å; S52-L54 VanDerWaalsContact O-N 3.17Å
55	A	53.7	Low	79	Confident	91 Å²	91	80.3 Å²	80.3	75%	0.752	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-120.6	8.5	-179.7	0	0	0	0	0	113.1	S52 M53	S52-A55 PolarHBondContact O-N 3.39Å; M53-A55 VanDerWaalsContact C-N 3.3Å; M53-A55 PolarHBondContact O-N 3.33Å
56	L	66.9	Low	79.2	Confident	27 Å²	27	77.1 Å²	77.1	14%	0.141	45%	0.447	C	S	.	.	S	Bend	trans	-96.1	140	-175.6	-166.4	76.6	0	0	0	110.2	Y50 A58 L60 R64	Y50-L56 HydrophobicContact CD1-CD1 3.9Å; Y50-L56 HydrophobicContact CE1-CD1 4.33Å; Y50-L56 HydrophobicContact CG-CD1 4.05Å; L56-A58 PolarHBondContact O-N 3.01Å; L56-L60 HydrophobicContact CD1-CD1 4.46Å; L56-L60 HydrophobicContact CD2-CB 4.43Å; L56-L60 HydrophobicContact CD2-CD2 4.27Å; L56-L60 HydrophobicContact CG-CB 4.38Å; L56-R64 VanDerWaalsContact CD2-CZ 3.46Å; L56-R64 VanDerWaalsContact CD2-NH1 3.29Å
57	P	75.8	Confident	79.5	Confident	78 Å²	78	70.9 Å²	70.9	51%	0.506	42%	0.418	S	S	.	.			trans	-60.4	137.2	176.6	22.6	-33	0	0	0	112.1	D59 L60 Q61	P57-D59 VanDerWaalsContact C-N 3.25Å; P57-D59 PolarHBondContact O-N 2.91Å; P57-L60 HydrophobicContact CG-CB 4.16Å; P57-L60 HydrophobicContact CG-CD1 4.45Å; P57-L60 WeakPolarHBondContact O-CB 3.43Å; P57-L60 PolarHBondContact O-N 3.35Å; P57-Q61 PolarHBondContact O-N 2.82Å
58	A	80.3	Confident	79.8	Confident	69 Å²	69	70.8 Å²	70.8	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-58.3	-34.4	-172.6	0	0	0	0	0	113.2	L56 L60 Q61 A62	L56-A58 PolarHBondContact O-N 3.01Å; A58-L60 VanDerWaalsContact C-N 3.25Å; A58-L60 PolarHBondContact O-N 3.24Å; A58-Q61 CarbonylContact O-C 3.24Å; A58-Q61 WeakPolarHBondContact O-CB 3.31Å; A58-Q61 PolarHBondContact O-N 2.93Å; A58-Q61 VanDerWaalsContact O-N 3.12Å; A58-A62 WeakPolarHBondContact O-CB 3.48Å; A58-A62 PolarHBondContact O-N 2.9Å
59	D	83.3	Confident	80.1	Confident	89 Å²	89	68.2 Å²	68.2	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-65.5	-29.3	179.1	-48.7	-53.2	0	0	0	112.4	P57 S63	P57-D59 VanDerWaalsContact C-N 3.25Å; P57-D59 PolarHBondContact O-N 2.91Å; D59-S63 WeakPolarHBondContact O-CB 3.44Å; D59-S63 PolarHBondContact O-N 2.72Å; D59-S63 PolarHBondContact O-OG 3.47Å
60	L	83.6	Confident	80.6	Confident	38 Å²	38	64.3 Å²	64.3	20%	0.199	38%	0.381	C	S	.	.	H	α-helix	trans	-76	-34.5	175.3	-144.7	160.7	0	0	0	110.6	L33 L56 P57 A58 S63 R64	L33-L60 WeakPolarHBondContact O-CD2 3.46Å; L56-L60 HydrophobicContact CD1-CD1 4.46Å; L56-L60 HydrophobicContact CD2-CB 4.43Å; L56-L60 HydrophobicContact CD2-CD2 4.27Å; L56-L60 HydrophobicContact CG-CB 4.38Å; P57-L60 HydrophobicContact CG-CB 4.16Å; P57-L60 HydrophobicContact CG-CD1 4.45Å; P57-L60 WeakPolarHBondContact O-CB 3.43Å; P57-L60 PolarHBondContact O-N 3.35Å; A58-L60 VanDerWaalsContact C-N 3.25Å; A58-L60 PolarHBondContact O-N 3.24Å; L60-S63 WeakPolarHBondContact CA-OG 3.28Å; L60-S63 PolarHBondContact O-OG 3.42Å; L60-S63 VanDerWaalsContact O-OG 3.14Å; L60-R64 VanDerWaalsContact O-CG 3.29Å; L60-R64 WeakPolarHBondContact O-CG 3.47Å; L60-R64 PolarHBondContact O-N 3.23Å; L60-R64 VanDerWaalsContact O-N 3.14Å
61	Q	88.3	Confident	81.2	Confident	103 Å²	103	63.6 Å²	63.6	48%	0.481	38%	0.381	S	S	.	.	H	α-helix	trans	-68.5	-39.9	169.8	-169.6	178.4	3.4	0	0	112.2	P57 A58 R64 A65	P57-Q61 PolarHBondContact O-N 2.82Å; A58-Q61 CarbonylContact O-C 3.24Å; A58-Q61 WeakPolarHBondContact O-CB 3.31Å; A58-Q61 PolarHBondContact O-N 2.93Å; A58-Q61 VanDerWaalsContact O-N 3.12Å; Q61-R64 WeakPolarHBondContact O-CB 3.29Å; Q61-A65 PolarHBondContact O-N 3.1Å; Q61-A65 VanDerWaalsContact O-N 3.13Å
62	A	89.5	Confident	82.5	Confident	50 Å²	50	61.3 Å²	61.3	41%	0.413	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-45.4	176.9	0	0	0	0	0	111.9	A58 R64 A65 L66	A58-A62 WeakPolarHBondContact O-CB 3.48Å; A58-A62 PolarHBondContact O-N 2.9Å; A62-R64 PolarHBondContact O-N 3.09Å; A62-A65 PolarHBondContact O-N 2.91Å; A62-A65 VanDerWaalsContact O-N 3.17Å; A62-L66 WeakPolarHBondContact O-CG 3.44Å; A62-L66 PolarHBondContact O-N 2.73Å
63	S	90.6	Very high	84.1	Confident	7 Å²	7	59.1 Å²	59.1	5%	0.049	35%	0.354	C	S	.	.	H	α-helix	trans	-65.6	-36	177.6	50.5	0	0	0	0	113.3	D59 L60 M67	D59-S63 WeakPolarHBondContact O-CB 3.44Å; D59-S63 PolarHBondContact O-N 2.72Å; D59-S63 PolarHBondContact O-OG 3.47Å; L60-S63 WeakPolarHBondContact CA-OG 3.28Å; L60-S63 PolarHBondContact O-OG 3.42Å; L60-S63 VanDerWaalsContact O-OG 3.14Å; S63-M67 WeakPolarHBondContact O-CB 3.19Å; S63-M67 PolarHBondContact O-N 2.98Å
64	R	91.4	Very high	86.1	Confident	13 Å²	13	54.1 Å²	54.1	5%	0.049	33%	0.329	C	S	.	.	H	α-helix	trans	-54.6	-52.7	166.1	-76.8	171.9	-173.3	-179.5	4.7	111.8	L33 L56 L60 Q61 A62 L66 M67 V68	L33-R64 HydrophobicContact CD2-CG 4.25Å; L33-R64 HydrophobicContact CG-CG 3.82Å; L33-R64 PolarHBondContact O-NE 3.46Å; L33-R64 PolarHBondContact O-NH2 2.65Å; L56-R64 VanDerWaalsContact CD2-CZ 3.46Å; L56-R64 VanDerWaalsContact CD2-NH1 3.29Å; L60-R64 VanDerWaalsContact O-CG 3.29Å; L60-R64 WeakPolarHBondContact O-CG 3.47Å; L60-R64 PolarHBondContact O-N 3.23Å; L60-R64 VanDerWaalsContact O-N 3.14Å; Q61-R64 WeakPolarHBondContact O-CB 3.29Å; A62-R64 PolarHBondContact O-N 3.09Å; R64-L66 PolarHBondContact O-N 3.08Å; R64-M67 PolarHBondContact O-N 2.93Å; R64-V68 WeakPolarHBondContact O-CG2 3.44Å; R64-V68 PolarHBondContact O-N 3.24Å
65	A	92.3	Very high	88	Confident	49 Å²	49	49.3 Å²	49.3	41%	0.405	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-46.5	-177.8	0	0	0	0	0	111.7	Q61 A62 M67 V68 I69	Q61-A65 PolarHBondContact O-N 3.1Å; Q61-A65 VanDerWaalsContact O-N 3.13Å; A62-A65 PolarHBondContact O-N 2.91Å; A62-A65 VanDerWaalsContact O-N 3.17Å; A65-M67 PolarHBondContact O-N 3.32Å; A65-V68 PolarHBondContact O-N 3.47Å; A65-I69 WeakPolarHBondContact O-CB 3.46Å; A65-I69 WeakPolarHBondContact O-CD1 3.44Å; A65-I69 WeakPolarHBondContact O-CG1 3.49Å; A65-I69 PolarHBondContact O-N 3.28Å
66	L	93.8	Very high	90	Very high	45 Å²	45	49.6 Å²	49.6	24%	0.236	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-43.3	178.2	-70.2	171.1	0	0	0	112.5	A62 R64 S70 L115 I118 P119	A62-L66 WeakPolarHBondContact O-CG 3.44Å; A62-L66 PolarHBondContact O-N 2.73Å; R64-L66 PolarHBondContact O-N 3.08Å; L66-S70 VanDerWaalsContact O-CB 3.29Å; L66-S70 WeakPolarHBondContact O-CB 3.29Å; L66-S70 PolarHBondContact O-N 3.39Å; L66-L115 HydrophobicContact CD2-CD2 3.73Å; L66-I118 HydrophobicContact CD1-CB 4.42Å; L66-I118 HydrophobicContact CD1-CG2 3.88Å; L66-P119 HydrophobicContact CB-CG 4.09Å
67	M	93.9	Very high	91.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-44.5	176.2	-83	-60.3	-167.4	0	0	112.8	T8 W13 L33 S63 R64 A65 S70 V71 P119 V120	T8-M67 HydrophobicContact CG2-CB 4.15Å; W13-M67 HydrophobicContact CH2-CE 3.52Å; W13-M67 HydrophobicContact CH2-CG 4.09Å; W13-M67 HydrophobicContact CZ2-CE 3.81Å; W13-M67 HydrophobicContact CZ2-CG 4.27Å; L33-M67 HydrophobicContact CD2-CB 3.97Å; L33-M67 HydrophobicContact CD2-CG 4.02Å; S63-M67 WeakPolarHBondContact O-CB 3.19Å; S63-M67 PolarHBondContact O-N 2.98Å; R64-M67 PolarHBondContact O-N 2.93Å; A65-M67 PolarHBondContact O-N 3.32Å; M67-S70 WeakPolarHBondContact O-CB 3.41Å; M67-S70 PolarHBondContact O-N 2.9Å; M67-V71 WeakPolarHBondContact O-CG2 2.95Å; M67-V71 PolarHBondContact O-N 2.97Å; M67-P119 HydrophobicContact CE-CG 4.16Å; M67-P119 HydrophobicContact CG-CG 4.07Å; M67-P119 HydrophobicContact SD-CG 4.37Å; M67-V120 HydrophobicContact CE-CG2 3.63Å
68	V	94.7	Very high	92.1	Very high	61 Å²	61	48.6 Å²	48.6	37%	0.37	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-44.4	177.4	171.9	0	0	0	0	111.1	W34 R64 A65 S70 V71 V72	W34-V68 HydrophobicContact CH2-CG2 4.11Å; W34-V68 HydrophobicContact CZ2-CG2 3.77Å; R64-V68 WeakPolarHBondContact O-CG2 3.44Å; R64-V68 PolarHBondContact O-N 3.24Å; A65-V68 PolarHBondContact O-N 3.47Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-S70 PolarHBondContact O-N 2.97Å; V68-V71 PolarHBondContact O-N 3.36Å; V68-V72 WeakPolarHBondContact O-CG2 3.31Å; V68-V72 PolarHBondContact O-N 2.96Å
69	I	95.6	Very high	92.6	Very high	85 Å²	85	46.8 Å²	46.8	44%	0.436	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-41.5	176.4	-66.7	164.7	0	0	0	110.6	A65 V71 V72 L73 L115	A65-I69 WeakPolarHBondContact O-CB 3.46Å; A65-I69 WeakPolarHBondContact O-CD1 3.44Å; A65-I69 WeakPolarHBondContact O-CG1 3.49Å; A65-I69 PolarHBondContact O-N 3.28Å; I69-V71 PolarHBondContact O-N 3.02Å; I69-V72 PolarHBondContact O-N 3.32Å; I69-L73 HydrophobicContact CG2-CD1 3.77Å; I69-L73 HydrophobicContact CG2-CG 4.24Å; I69-L73 WeakPolarHBondContact O-CB 3.48Å; I69-L73 VanDerWaalsContact O-CG 3.29Å; I69-L73 WeakPolarHBondContact O-CG 3.28Å; I69-L73 PolarHBondContact O-N 2.88Å; I69-L115 HydrophobicContact CG2-CD1 4.15Å
70	S	96.1	Very high	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-43	174.1	173.7	0	0	0	0	112.7	L66 M67 V68 S74 A112 S116	L66-S70 VanDerWaalsContact O-CB 3.29Å; L66-S70 WeakPolarHBondContact O-CB 3.29Å; L66-S70 PolarHBondContact O-N 3.39Å; M67-S70 WeakPolarHBondContact O-CB 3.41Å; M67-S70 PolarHBondContact O-N 2.9Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-S70 PolarHBondContact O-N 2.97Å; S70-S74 WeakPolarHBondContact O-CB 3.42Å; S70-S74 PolarHBondContact O-N 2.92Å; S70-S74 PolarHBondContact O-OG 2.96Å; S70-A112 WeakPolarHBondContact CB-O 3.36Å; S70-A112 WeakPolarHBondContact O-CB 3.13Å; S70-A112 PolarHBondContact OG-O 3.46Å; S70-S116 WeakPolarHBondContact OG-CB 3.29Å; S70-S116 PolarHBondContact OG-OG 3.01Å
71	V	95.1	Very high	93.2	Very high	30 Å²	30	44.8 Å²	44.8	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-44.5	177.1	172.4	0	0	0	0	111.2	M67 V68 I69 S74 V75	M67-V71 WeakPolarHBondContact O-CG2 2.95Å; M67-V71 PolarHBondContact O-N 2.97Å; V68-V71 PolarHBondContact O-N 3.36Å; I69-V71 PolarHBondContact O-N 3.02Å; V71-S74 WeakPolarHBondContact O-CB 3.19Å; V71-S74 PolarHBondContact O-N 3.5Å; V71-V75 WeakPolarHBondContact O-CG2 3.37Å; V71-V75 PolarHBondContact O-N 2.97Å
72	V	96.4	Very high	93.1	Very high	80 Å²	80	42.2 Å²	42.2	49%	0.485	26%	0.259	S	S	.	.	H	α-helix	trans	-61.3	-47.1	176.6	172.1	0	0	0	0	111.3	V68 I69 S74 V75 L76	V68-V72 WeakPolarHBondContact O-CG2 3.31Å; V68-V72 PolarHBondContact O-N 2.96Å; I69-V72 PolarHBondContact O-N 3.32Å; V72-S74 VanDerWaalsContact C-N 3.3Å; V72-S74 PolarHBondContact O-N 2.68Å; V72-V75 PolarHBondContact O-N 3.16Å; V72-L76 HydrophobicContact CG1-CD1 4.09Å; V72-L76 WeakPolarHBondContact O-CG 3.35Å; V72-L76 PolarHBondContact O-N 3.47Å
73	L	95.8	Very high	92.9	Very high	36 Å²	36	44 Å²	44	19%	0.188	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-34.9	176	-70	171.7	0	0	0	112.2	I69 L76 A77 L108 A112 L115	I69-L73 HydrophobicContact CG2-CD1 3.77Å; I69-L73 HydrophobicContact CG2-CG 4.24Å; I69-L73 WeakPolarHBondContact O-CB 3.48Å; I69-L73 VanDerWaalsContact O-CG 3.29Å; I69-L73 WeakPolarHBondContact O-CG 3.28Å; I69-L73 PolarHBondContact O-N 2.88Å; L73-L76 PolarHBondContact O-N 3.48Å; L73-A77 WeakPolarHBondContact O-CB 3.45Å; L73-A77 PolarHBondContact O-N 2.85Å; L73-L108 HydrophobicContact CD2-CD2 4.03Å; L73-A112 HydrophobicContact CB-CB 3.83Å; L73-L115 HydrophobicContact CD1-CD1 3.42Å; L73-L115 VanDerWaalsContact CD1-CD1 3.42Å
74	S	95.8	Very high	92.3	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-42	173.8	-62.6	0	0	0	0	112.2	S70 V71 V72 I78	S70-S74 WeakPolarHBondContact O-CB 3.42Å; S70-S74 PolarHBondContact O-N 2.92Å; S70-S74 PolarHBondContact O-OG 2.96Å; V71-S74 WeakPolarHBondContact O-CB 3.19Å; V71-S74 PolarHBondContact O-N 3.5Å; V72-S74 VanDerWaalsContact C-N 3.3Å; V72-S74 PolarHBondContact O-N 2.68Å; S74-I78 WeakPolarHBondContact O-CD1 3.27Å; S74-I78 VanDerWaalsContact O-CG1 3.31Å; S74-I78 WeakPolarHBondContact O-CG1 3.36Å; S74-I78 PolarHBondContact O-N 2.99Å; S74-I78 VanDerWaalsContact O-N 3.12Å
75	V	95.3	Very high	91.6	Very high	84 Å²	84	49.1 Å²	49.1	51%	0.509	29%	0.289	S	S	.	.	H	α-helix	trans	-68.5	-44.5	178.4	173.4	0	0	0	0	110.8	M1 V71 V72 A77 I78 G79	M1-V75 HydrophobicContact SD-CG2 4.07Å; V71-V75 WeakPolarHBondContact O-CG2 3.37Å; V71-V75 PolarHBondContact O-N 2.97Å; V72-V75 PolarHBondContact O-N 3.16Å; V75-A77 VanDerWaalsContact C-N 3.35Å; V75-A77 PolarHBondContact O-N 3.05Å; V75-I78 PolarHBondContact O-N 3.29Å; V75-G79 PolarHBondContact O-N 2.92Å
76	L	94.8	Very high	90.2	Very high	97 Å²	97	54.9 Å²	54.9	51%	0.508	31%	0.307	S	S	.	.	H	α-helix	trans	-61.6	-41.9	175.4	-68.2	172.7	0	0	0	112	V72 L73 I78 G79 M80	V72-L76 HydrophobicContact CG1-CD1 4.09Å; V72-L76 WeakPolarHBondContact O-CG 3.35Å; V72-L76 PolarHBondContact O-N 3.47Å; L73-L76 PolarHBondContact O-N 3.48Å; L76-I78 PolarHBondContact O-N 2.99Å; L76-G79 PolarHBondContact O-N 3.01Å; L76-M80 WeakPolarHBondContact O-CG 3.43Å; L76-M80 PolarHBondContact O-N 3.43Å
77	A	94.5	Very high	88.6	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-42.9	175.9	0	0	0	0	0	112.7	L73 V75 M80 A81 G105 L108 F109	L73-A77 WeakPolarHBondContact O-CB 3.45Å; L73-A77 PolarHBondContact O-N 2.85Å; V75-A77 VanDerWaalsContact C-N 3.35Å; V75-A77 PolarHBondContact O-N 3.05Å; A77-M80 PolarHBondContact O-N 3.28Å; A77-A81 VanDerWaalsContact O-CB 3.31Å; A77-A81 WeakPolarHBondContact O-CB 3.36Å; A77-A81 PolarHBondContact O-N 3.15Å; A77-G105 WeakPolarHBondContact CB-O 3.48Å; A77-L108 HydrophobicContact CB-CB 3.74Å; A77-F109 HydrophobicContact CB-CB 3.91Å; A77-F109 HydrophobicContact CB-CD2 3.81Å; A77-F109 HydrophobicContact CB-CG 4.33Å
78	I	92.8	Very high	87.2	Confident	82 Å²	82	60.4 Å²	60.4	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-65.8	-39	176.6	-69.9	164.6	0	0	0	111.1	M1 S74 V75 L76 A81 S82 F109	M1-I78 HydrophobicContact CB-CD1 4.48Å; M1-I78 HydrophobicContact SD-CD1 3.49Å; M1-I78 WeakPolarHBondContact SD-CD1 3.36Å; S74-I78 WeakPolarHBondContact O-CD1 3.27Å; S74-I78 VanDerWaalsContact O-CG1 3.31Å; S74-I78 WeakPolarHBondContact O-CG1 3.36Å; S74-I78 PolarHBondContact O-N 2.99Å; S74-I78 VanDerWaalsContact O-N 3.12Å; V75-I78 PolarHBondContact O-N 3.29Å; L76-I78 PolarHBondContact O-N 2.99Å; I78-A81 PolarHBondContact O-N 3.42Å; I78-S82 WeakPolarHBondContact O-CB 3.48Å; I78-S82 PolarHBondContact O-N 3.42Å; I78-S82 PolarHBondContact O-OG 3.35Å; I78-F109 HydrophobicContact CD1-CE2 4.42Å; I78-F109 HydrophobicContact CG1-CE2 4.33Å
79	G	91.5	Very high	85.3	Confident	31 Å²	31	63.7 Å²	63.7	32%	0.32	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-46.5	172.8	0	0	0	0	0	112.9	V75 L76 S82 L83	V75-G79 PolarHBondContact O-N 2.92Å; L76-G79 PolarHBondContact O-N 3.01Å; G79-S82 PolarHBondContact O-N 3.39Å; G79-S82 PolarHBondContact O-OG 3.32Å; G79-L83 WeakPolarHBondContact O-CG 3.49Å; G79-L83 PolarHBondContact O-N 3.28Å; G79-L83 VanDerWaalsContact O-N 3.16Å
80	M	89.8	Confident	83.4	Confident	60 Å²	60	64.6 Å²	64.6	30%	0.296	38%	0.375	S	S	.	.	H	α-helix	trans	-65.1	-40.8	176.7	-67.2	-65.6	-77.6	0	0	111.9	L76 A77 S82 L83 G84 V101 A104 L108	L76-M80 WeakPolarHBondContact O-CG 3.43Å; L76-M80 PolarHBondContact O-N 3.43Å; A77-M80 PolarHBondContact O-N 3.28Å; M80-S82 PolarHBondContact O-N 2.72Å; M80-L83 PolarHBondContact O-N 3.44Å; M80-G84 PolarHBondContact O-N 3.13Å; M80-V101 HydrophobicContact CE-CB 4.38Å; M80-V101 HydrophobicContact CE-CG1 3.97Å; M80-V101 HydrophobicContact CE-CG2 4.23Å; M80-V101 WeakPolarHBondContact O-CG1 3.27Å; M80-V101 HydrophobicContact SD-CG1 4.36Å; M80-A104 HydrophobicContact CE-CB 4.22Å; M80-L108 HydrophobicContact CG-CD1 4.19Å
81	A	88.8	Confident	81.5	Confident	25 Å²	25	67.8 Å²	67.8	21%	0.207	39%	0.391	C	S	.	.	H	α-helix	trans	-64	-39.9	176.7	0	0	0	0	0	112.5	A77 I78 G84 M85	A77-A81 VanDerWaalsContact O-CB 3.31Å; A77-A81 WeakPolarHBondContact O-CB 3.36Å; A77-A81 PolarHBondContact O-N 3.15Å; I78-A81 PolarHBondContact O-N 3.42Å; A81-G84 PolarHBondContact O-N 3.25Å; A81-M85 PolarHBondContact O-N 3.35Å; A81-M85 VanDerWaalsContact O-N 3.15Å
82	S	87.6	Confident	79.6	Confident	49 Å²	49	74.1 Å²	74.1	34%	0.343	42%	0.419	S	S	.	.	H	α-helix	trans	-70.2	-34	178.8	70.1	0	0	0	0	113	I78 G79 M80 G84 T88	I78-S82 WeakPolarHBondContact O-CB 3.48Å; I78-S82 PolarHBondContact O-N 3.42Å; I78-S82 PolarHBondContact O-OG 3.35Å; G79-S82 PolarHBondContact O-N 3.39Å; G79-S82 PolarHBondContact O-OG 3.32Å; M80-S82 PolarHBondContact O-N 2.72Å; S82-G84 VanDerWaalsContact C-N 3.35Å; S82-T88 PolarHBondContact O-OG1 3.2Å
83	L	84.9	Confident	77.9	Confident	87 Å²	87	78.3 Å²	78.3	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-67.5	-34	169.9	-66	172.5	0	0	0	112.6	G79 M80 T88 V101	G79-L83 WeakPolarHBondContact O-CG 3.49Å; G79-L83 PolarHBondContact O-N 3.28Å; G79-L83 VanDerWaalsContact O-N 3.16Å; M80-L83 PolarHBondContact O-N 3.44Å; L83-T88 HydrophobicContact CD2-CG2 4.28Å; L83-V101 HydrophobicContact CB-CG1 4.02Å
84	G	76.5	Confident	76.3	Confident	10 Å²	10	78 Å²	78	10%	0.103	44%	0.441	C	S	.	.	H	α-helix	trans	-69.6	-28.4	176.4	0	0	0	0	0	114.9	M80 A81 S82 K98	M80-G84 PolarHBondContact O-N 3.13Å; A81-G84 PolarHBondContact O-N 3.25Å; S82-G84 VanDerWaalsContact C-N 3.35Å; G84-K98 WeakPolarHBondContact O-CE 3.46Å; G84-K98 WeakPolarHBondContact O-CG 3.39Å
85	M	77.3	Confident	75	Confident	118 Å²	118	80.6 Å²	80.6	58%	0.581	47%	0.468	S	S	*	.	S	Bend	trans	-65.1	141.8	-177.5	-77.1	-167.7	-73.7	0	0	113.4	A81 C87 T88 K98	A81-M85 PolarHBondContact O-N 3.35Å; A81-M85 VanDerWaalsContact O-N 3.15Å; M85-C87 PolarHBondContact O-N 3.47Å; M85-C87 VanDerWaalsContact O-N 3.15Å; M85-T88 PolarHBondContact O-N 3.31Å; M85-K98 WeakPolarHBondContact O-CE 3.36Å; M85-K98 PolarHBondContact O-NZ 3.36Å
86	Q	64	Low	73.9	Confident	169 Å²	169	82 Å²	82	79%	0.79	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.8	-173.8	-67.6	-175.1	3.3	0	0	113.3	T88 K98	Q86-T88 PolarHBondContact O-N 3.47Å; Q86-T88 VanDerWaalsContact O-N 3.11Å; Q86-K98 PolarHBondContact O-NZ 2.83Å; Q86-K98 VanDerWaalsContact O-NZ 3.09Å
87	C	58.8	Low	73.1	Confident	125 Å²	125	80.7 Å²	80.7	85%	0.845	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.2	178.7	-53.9	0	0	0	0	115.3	M85 L89	M85-C87 PolarHBondContact O-N 3.47Å; M85-C87 VanDerWaalsContact O-N 3.15Å; C87-L89 PolarHBondContact O-N 3.01Å
88	T	64.4	Low	72.4	Confident	37 Å²	37	82 Å²	82	23%	0.227	48%	0.478	C	S	.	.			trans	-88.6	106.5	-179.2	-53.9	0	0	0	0	110.8	S82 L83 M85 Q86 C90 K98	S82-T88 PolarHBondContact O-OG1 3.2Å; L83-T88 HydrophobicContact CD2-CG2 4.28Å; M85-T88 PolarHBondContact O-N 3.31Å; Q86-T88 PolarHBondContact O-N 3.47Å; Q86-T88 VanDerWaalsContact O-N 3.11Å; T88-C90 HydrophobicContact CG2-CB 4.16Å; T88-C90 PolarHBondContact O-N 2.77Å; T88-K98 PolarHBondContact O-NZ 3.04Å
89	L	55.3	Low	71.8	Confident	130 Å²	130	79.4 Å²	79.4	68%	0.681	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-68	-9	-176	-70	168.2	0	0	0	115	C87 L91 E92	C87-L89 PolarHBondContact O-N 3.01Å; L89-L91 PolarHBondContact O-N 3.06Å; L89-E92 WeakPolarHBondContact CD2-OE2 3.37Å
90	C	56	Low	71.4	Confident	104 Å²	104	84.6 Å²	84.6	70%	0.703	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-65.7	1.5	-170.8	-53.9	0	0	0	0	116.2	T88	T88-C90 HydrophobicContact CG2-CB 4.16Å; T88-C90 PolarHBondContact O-N 2.77Å
91	L	56.3	Low	71.3	Confident	67 Å²	67	83.2 Å²	83.2	35%	0.351	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-149.3	45.2	-174	-146.8	77.9	0	0	0	113	L89 D93 A94 V97 K98	L89-L91 PolarHBondContact O-N 3.06Å; L91-D93 VanDerWaalsContact C-N 3.29Å; L91-D93 PolarHBondContact O-N 3.21Å; L91-A94 HydrophobicContact CD2-CB 4.32Å; L91-A94 HydrophobicContact CG-CB 4.18Å; L91-A94 PolarHBondContact O-N 2.86Å; L91-V97 HydrophobicContact CD2-CB 3.98Å; L91-V97 HydrophobicContact CD2-CG1 3.91Å; L91-K98 HydrophobicContact CD2-CB 4.21Å
92	E	56.2	Low	71.2	Confident	162 Å²	162	83 Å²	83	76%	0.757	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.7	-172.8	-160.6	127.9	96.2	0	0	114.5	L89	L89-E92 WeakPolarHBondContact CD2-OE2 3.37Å
93	D	59	Low	71.3	Confident	169 Å²	169	81.3 Å²	81.3	90%	0.904	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	1.9	-170.8	-155	23.3	0	0	0	114.3	L91	L91-D93 VanDerWaalsContact C-N 3.29Å; L91-D93 PolarHBondContact O-N 3.21Å
94	A	62.8	Low	71.7	Confident	29 Å²	29	79.1 Å²	79.1	24%	0.24	46%	0.455	C	S	.	.			trans	-138.6	57.3	-169	0	0	0	0	0	114.5	L91 T96 V97 K98	L91-A94 HydrophobicContact CD2-CB 4.32Å; L91-A94 HydrophobicContact CG-CB 4.18Å; L91-A94 PolarHBondContact O-N 2.86Å; A94-T96 VanDerWaalsContact C-N 3.27Å; A94-T96 PolarHBondContact O-N 2.85Å; A94-T96 VanDerWaalsContact O-N 3.13Å; A94-V97 HydrophobicContact CB-CB 4Å; A94-V97 HydrophobicContact CB-CG2 3.95Å; A94-V97 WeakPolarHBondContact O-CA 3.29Å; A94-V97 WeakPolarHBondContact O-CB 3.22Å; A94-V97 PolarHBondContact O-N 3.43Å; A94-K98 PolarHBondContact O-N 3.08Å
95	G	67.8	Low	72.5	Confident	56 Å²	56	78.7 Å²	78.7	58%	0.577	45%	0.45	S	S	*	.	H	α-helix	trans	-53.7	-33.2	-177.6	0	0	0	0	0	115.9	K98 S99	G95-K98 WeakPolarHBondContact O-CB 3.42Å; G95-K98 PolarHBondContact O-N 3.17Å; G95-S99 PolarHBondContact O-N 3.4Å
96	T	73.3	Confident	73.3	Confident	112 Å²	112	73 Å²	73	69%	0.687	42%	0.423	S	S	*	.	H	α-helix	trans	-73.6	-26.9	174.9	48.9	0	0	0	0	113.6	A94 S99 R100	A94-T96 VanDerWaalsContact C-N 3.27Å; A94-T96 PolarHBondContact O-N 2.85Å; A94-T96 VanDerWaalsContact O-N 3.13Å; T96-S99 PolarHBondContact O-OG 2.89Å; T96-R100 VanDerWaalsContact O-CG 3.24Å; T96-R100 WeakPolarHBondContact O-CG 3.41Å; T96-R100 PolarHBondContact O-N 2.88Å
97	V	78.3	Confident	74.7	Confident	71 Å²	71	68.7 Å²	68.7	43%	0.43	41%	0.407	S	S	.	.	H	α-helix	trans	-75.5	-35	171.6	-177.6	0	0	0	0	109.6	L91 A94 R100 V101	L91-V97 HydrophobicContact CD2-CB 3.98Å; L91-V97 HydrophobicContact CD2-CG1 3.91Å; A94-V97 HydrophobicContact CB-CB 4Å; A94-V97 HydrophobicContact CB-CG2 3.95Å; A94-V97 WeakPolarHBondContact O-CA 3.29Å; A94-V97 WeakPolarHBondContact O-CB 3.22Å; A94-V97 PolarHBondContact O-N 3.43Å; V97-R100 WeakPolarHBondContact O-CB 3.27Å; V97-R100 PolarHBondContact O-N 3.11Å; V97-V101 HydrophobicContact CG1-CG2 4.29Å; V97-V101 WeakPolarHBondContact O-CB 3.39Å; V97-V101 WeakPolarHBondContact O-CG2 3.33Å; V97-V101 PolarHBondContact O-N 2.75Å
98	K	78.8	Confident	76.5	Confident	30 Å²	30	65.3 Å²	65.3	13%	0.13	38%	0.38	C	S	.	.	H	α-helix	trans	-61.4	-46.5	178.7	-165.8	160.2	-175.9	168.4	0	113	G84 M85 Q86 T88 L91 A94 G95 V101 A102	G84-K98 WeakPolarHBondContact O-CE 3.46Å; G84-K98 WeakPolarHBondContact O-CG 3.39Å; M85-K98 WeakPolarHBondContact O-CE 3.36Å; M85-K98 PolarHBondContact O-NZ 3.36Å; Q86-K98 PolarHBondContact O-NZ 2.83Å; Q86-K98 VanDerWaalsContact O-NZ 3.09Å; T88-K98 PolarHBondContact O-NZ 3.04Å; L91-K98 HydrophobicContact CD2-CB 4.21Å; A94-K98 PolarHBondContact O-N 3.08Å; G95-K98 WeakPolarHBondContact O-CB 3.42Å; G95-K98 PolarHBondContact O-N 3.17Å; K98-V101 PolarHBondContact O-N 2.98Å; K98-A102 PolarHBondContact O-N 2.84Å
99	S	79.8	Confident	78	Confident	26 Å²	26	65.3 Å²	65.3	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-68.7	-34.7	175	60.7	0	0	0	0	113	G95 T96 A102 G103	G95-S99 PolarHBondContact O-N 3.4Å; T96-S99 PolarHBondContact O-OG 2.89Å; S99-A102 PolarHBondContact O-N 2.92Å; S99-G103 PolarHBondContact O-N 3.41Å
100	R	84.8	Confident	79.9	Confident	141 Å²	141	61.8 Å²	61.8	53%	0.532	36%	0.359	S	S	.	.	H	α-helix	trans	-61.3	-42.3	171.2	-74.5	-71	-166.4	-144.9	-5.3	112.6	T96 V97 G103 A104 E173	T96-R100 VanDerWaalsContact O-CG 3.24Å; T96-R100 WeakPolarHBondContact O-CG 3.41Å; T96-R100 PolarHBondContact O-N 2.88Å; V97-R100 WeakPolarHBondContact O-CB 3.27Å; V97-R100 PolarHBondContact O-N 3.11Å; R100-G103 PolarHBondContact O-N 2.91Å; R100-A104 WeakPolarHBondContact O-CB 3.29Å; R100-A104 PolarHBondContact O-N 3.27Å; R100-E173 IonicContact CZ-OE1 3.58Å; R100-E173 IonicContact CZ-OE2 3.09Å; R100-E173 VanDerWaalsContact NH1-CD 3.28Å; R100-E173 IonicContact NH1-OE1 3.94Å; R100-E173 IonicContact NH1-OE2 2.71Å; R100-E173 PolarHBondContact NH1-OE2 3.49Å; R100-E173 IonicContact NH2-OE1 2.86Å; R100-E173 PolarHBondContact NH2-OE1 2.82Å; R100-E173 IonicContact NH2-OE2 2.74Å; R100-E173 PolarHBondContact NH2-OE2 2.93Å
101	V	87.3	Confident	81.9	Confident	30 Å²	30	58.8 Å²	58.8	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-65.9	-43	177.2	164.2	0	0	0	0	111.3	M80 L83 V97 K98 A104 G105	M80-V101 HydrophobicContact CE-CB 4.38Å; M80-V101 HydrophobicContact CE-CG1 3.97Å; M80-V101 HydrophobicContact CE-CG2 4.23Å; M80-V101 WeakPolarHBondContact O-CG1 3.27Å; M80-V101 HydrophobicContact SD-CG1 4.36Å; L83-V101 HydrophobicContact CB-CG1 4.02Å; V97-V101 HydrophobicContact CG1-CG2 4.29Å; V97-V101 WeakPolarHBondContact O-CB 3.39Å; V97-V101 WeakPolarHBondContact O-CG2 3.33Å; V97-V101 PolarHBondContact O-N 2.75Å; K98-V101 PolarHBondContact O-N 2.98Å; V101-A104 PolarHBondContact O-N 3.34Å; V101-G105 PolarHBondContact O-N 3.46Å
102	A	87.3	Confident	83.8	Confident	22 Å²	22	55.6 Å²	55.6	18%	0.182	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-49	173.5	0	0	0	0	0	112.1	K98 S99 A104 G105 G106	K98-A102 PolarHBondContact O-N 2.84Å; S99-A102 PolarHBondContact O-N 2.92Å; A102-A104 PolarHBondContact O-N 3.14Å; A102-G105 WeakPolarHBondContact O-CA 3.38Å; A102-G105 PolarHBondContact O-N 3.32Å; A102-G105 VanDerWaalsContact O-N 3.13Å; A102-G106 PolarHBondContact O-N 3.01Å; A102-G106 VanDerWaalsContact O-N 3.09Å
103	G	89.5	Confident	85.7	Confident	13 Å²	13	47.9 Å²	47.9	13%	0.134	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-39.2	179.2	0	0	0	0	0	113	S99 R100 G105 G106 V107 C169	S99-G103 PolarHBondContact O-N 3.41Å; R100-G103 PolarHBondContact O-N 2.91Å; G103-G105 VanDerWaalsContact C-N 3.31Å; G103-G105 PolarHBondContact O-N 2.63Å; G103-G106 PolarHBondContact O-N 3.38Å; G103-G106 VanDerWaalsContact O-N 3.16Å; G103-V107 WeakPolarHBondContact O-CG2 3.41Å; G103-V107 PolarHBondContact O-N 3.49Å; G103-C169 VanDerWaalsContact CA-SG 3.58Å; G103-C169 PolarHBondContact N-SG 3.14Å
104	A	91.9	Very high	87.5	Confident	40 Å²	40	45.3 Å²	45.3	33%	0.331	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-39.4	172.7	0	0	0	0	0	111.9	M80 R100 V101 A102 V107 L108	M80-A104 HydrophobicContact CE-CB 4.22Å; R100-A104 WeakPolarHBondContact O-CB 3.29Å; R100-A104 PolarHBondContact O-N 3.27Å; V101-A104 PolarHBondContact O-N 3.34Å; A102-A104 PolarHBondContact O-N 3.14Å; A104-V107 PolarHBondContact O-N 3.32Å; A104-L108 WeakPolarHBondContact O-CB 3.45Å; A104-L108 VanDerWaalsContact O-CG 3.27Å; A104-L108 WeakPolarHBondContact O-CG 3.29Å; A104-L108 PolarHBondContact O-N 3.23Å
105	G	93.1	Very high	89	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-45	171.1	0	0	0	0	0	112.8	A77 V101 A102 G103 V107 L108 F109	A77-G105 WeakPolarHBondContact CB-O 3.48Å; V101-G105 PolarHBondContact O-N 3.46Å; A102-G105 WeakPolarHBondContact O-CA 3.38Å; A102-G105 PolarHBondContact O-N 3.32Å; A102-G105 VanDerWaalsContact O-N 3.13Å; G103-G105 VanDerWaalsContact C-N 3.31Å; G103-G105 PolarHBondContact O-N 2.63Å; G105-V107 PolarHBondContact O-N 3.16Å; G105-L108 PolarHBondContact O-N 2.91Å; G105-F109 PolarHBondContact O-N 2.7Å
106	G	93.9	Very high	90.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.9	-45.4	175	0	0	0	0	0	113.5	A102 G103 F109 L110 G162	A102-G106 PolarHBondContact O-N 3.01Å; A102-G106 VanDerWaalsContact O-N 3.09Å; G103-G106 PolarHBondContact O-N 3.38Å; G103-G106 VanDerWaalsContact O-N 3.16Å; G106-F109 PolarHBondContact O-N 2.97Å; G106-L110 PolarHBondContact O-N 3.02Å; G106-G162 CarbonylContact C-O 3.6Å; G106-G162 WeakPolarHBondContact O-CA 3.34Å
107	V	95.1	Very high	91.4	Very high	77 Å²	77	39.3 Å²	39.3	47%	0.467	22%	0.216	S	C	.	.	H	α-helix	trans	-66.8	-39.2	178.2	174.7	0	0	0	0	111.9	G103 A104 G105 F109 L110 A111 S166	G103-V107 WeakPolarHBondContact O-CG2 3.41Å; G103-V107 PolarHBondContact O-N 3.49Å; A104-V107 PolarHBondContact O-N 3.32Å; G105-V107 PolarHBondContact O-N 3.16Å; V107-F109 VanDerWaalsContact C-N 3.31Å; V107-F109 PolarHBondContact O-N 3.01Å; V107-L110 WeakPolarHBondContact O-CB 3.31Å; V107-L110 PolarHBondContact O-N 3.36Å; V107-A111 WeakPolarHBondContact O-CB 3.3Å; V107-A111 PolarHBondContact O-N 2.76Å; V107-S166 PolarHBondContact N-OG 2.92Å
108	L	95.6	Very high	92.2	Very high	54 Å²	54	39.1 Å²	39.1	28%	0.283	21%	0.212	S	C	.	.	H	α-helix	trans	-63.7	-36.9	173.3	-71.3	167.8	0	0	0	111.8	L73 A77 M80 A104 G105 A111 A112	L73-L108 HydrophobicContact CD2-CD2 4.03Å; A77-L108 HydrophobicContact CB-CB 3.74Å; M80-L108 HydrophobicContact CG-CD1 4.19Å; A104-L108 WeakPolarHBondContact O-CB 3.45Å; A104-L108 VanDerWaalsContact O-CG 3.27Å; A104-L108 WeakPolarHBondContact O-CG 3.29Å; A104-L108 PolarHBondContact O-N 3.23Å; G105-L108 PolarHBondContact O-N 2.91Å; L108-A111 PolarHBondContact O-N 2.73Å; L108-A112 VanDerWaalsContact O-CB 3.31Å; L108-A112 WeakPolarHBondContact O-CB 3.46Å; L108-A112 PolarHBondContact O-N 2.92Å
109	F	95.8	Very high	92.9	Very high	37 Å²	37	37.8 Å²	37.8	16%	0.162	21%	0.206	C	C	.	.	H	α-helix	trans	-72.3	-35.8	177.9	-149.9	-122.2	0	0	0	112.5	A77 I78 G105 G106 V107 G113 S158	A77-F109 HydrophobicContact CB-CB 3.91Å; A77-F109 HydrophobicContact CB-CD2 3.81Å; A77-F109 HydrophobicContact CB-CG 4.33Å; I78-F109 HydrophobicContact CD1-CE2 4.42Å; I78-F109 HydrophobicContact CG1-CE2 4.33Å; G105-F109 PolarHBondContact O-N 2.7Å; G106-F109 PolarHBondContact O-N 2.97Å; V107-F109 VanDerWaalsContact C-N 3.31Å; V107-F109 PolarHBondContact O-N 3.01Å; F109-G113 PolarHBondContact O-N 3Å; F109-S158 WeakPolarHBondContact CD1-O 3.31Å
110	L	96.4	Very high	93.5	Very high	57 Å²	57	36.7 Å²	36.7	30%	0.298	20%	0.198	S	C	.	.	H	α-helix	trans	-58.3	-51.5	167.5	-84.3	166.7	0	0	0	111.5	G106 V107 A112 G113 F114 M159	G106-L110 PolarHBondContact O-N 3.02Å; V107-L110 WeakPolarHBondContact O-CB 3.31Å; V107-L110 PolarHBondContact O-N 3.36Å; L110-A112 PolarHBondContact O-N 3.38Å; L110-G113 PolarHBondContact O-N 3.41Å; L110-F114 PolarHBondContact O-N 3.46Å; L110-M159 HydrophobicContact CD2-CB 4.35Å; L110-M159 VanDerWaalsContact CD2-O 3.22Å; L110-M159 WeakPolarHBondContact CD2-O 3.48Å
111	A	96.6	Very high	93.9	Very high	40 Å²	40	32.8 Å²	32.8	33%	0.331	19%	0.193	S	C	.	.	H	α-helix	trans	-61.9	-42.5	179.9	0	0	0	0	0	111.8	V107 L108 F114 L115	V107-A111 WeakPolarHBondContact O-CB 3.3Å; V107-A111 PolarHBondContact O-N 2.76Å; L108-A111 PolarHBondContact O-N 2.73Å; A111-F114 PolarHBondContact O-N 3.12Å; A111-L115 WeakPolarHBondContact O-CB 3.29Å; A111-L115 WeakPolarHBondContact O-CD1 3.48Å; A111-L115 VanDerWaalsContact O-CG 3.29Å; A111-L115 WeakPolarHBondContact O-CG 3.35Å; A111-L115 PolarHBondContact O-N 3.48Å
112	A	96.6	Very high	94.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-44.9	174.1	0	0	0	0	0	112.5	S70 L73 L108 L110 L115 S116	S70-A112 WeakPolarHBondContact CB-O 3.36Å; S70-A112 WeakPolarHBondContact O-CB 3.13Å; S70-A112 PolarHBondContact OG-O 3.46Å; L73-A112 HydrophobicContact CB-CB 3.83Å; L108-A112 VanDerWaalsContact O-CB 3.31Å; L108-A112 WeakPolarHBondContact O-CB 3.46Å; L108-A112 PolarHBondContact O-N 2.92Å; L110-A112 PolarHBondContact O-N 3.38Å; A112-L115 PolarHBondContact O-N 3.16Å; A112-S116 PolarHBondContact O-N 2.87Å; A112-S116 VanDerWaalsContact O-N 3.14Å; A112-S116 PolarHBondContact O-OG 3.04Å
113	G	96.1	Very high	94.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-48.9	174.9	0	0	0	0	0	111.9	F109 L110 L115 S116 L117	F109-G113 PolarHBondContact O-N 3Å; L110-G113 PolarHBondContact O-N 3.41Å; G113-L115 PolarHBondContact O-N 3.26Å; G113-S116 PolarHBondContact O-N 2.62Å; G113-S116 PolarHBondContact O-OG 3.45Å; G113-L117 PolarHBondContact O-N 2.96Å
114	F	96.5	Very high	94.4	Very high	116 Å²	116	38.7 Å²	38.7	51%	0.509	21%	0.21	S	C	.	.	H	α-helix	trans	-61.9	-43.2	177.6	-172.3	-106.6	0	0	0	112.9	L110 A111 S116 L117 I118 M159	L110-F114 PolarHBondContact O-N 3.46Å; A111-F114 PolarHBondContact O-N 3.12Å; F114-S116 VanDerWaalsContact C-N 3.28Å; F114-S116 PolarHBondContact O-N 3.19Å; F114-L117 WeakPolarHBondContact O-CB 3.31Å; F114-L117 PolarHBondContact O-N 2.85Å; F114-L117 VanDerWaalsContact O-N 3.07Å; F114-I118 HydrophobicContact CD1-CD1 4.08Å; F114-I118 HydrophobicContact CE1-CD1 3.82Å; F114-I118 HydrophobicContact CE1-CG1 4.34Å; F114-I118 HydrophobicContact CZ-CD1 4.46Å; F114-I118 PolarHBondContact O-N 3.31Å; F114-I118 VanDerWaalsContact O-N 3.16Å; F114-M159 HydrophobicContact CB-SD 4.47Å; F114-M159 HydrophobicContact CD2-CE 4.34Å
115	L	95.6	Very high	94.3	Very high	40 Å²	40	41 Å²	41	21%	0.209	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-27	178.4	-76.7	163.8	0	0	0	113.9	L66 I69 L73 A111 A112 G113 P119	L66-L115 HydrophobicContact CD2-CD2 3.73Å; I69-L115 HydrophobicContact CG2-CD1 4.15Å; L73-L115 HydrophobicContact CD1-CD1 3.42Å; L73-L115 VanDerWaalsContact CD1-CD1 3.42Å; A111-L115 WeakPolarHBondContact O-CB 3.29Å; A111-L115 WeakPolarHBondContact O-CD1 3.48Å; A111-L115 VanDerWaalsContact O-CG 3.29Å; A111-L115 WeakPolarHBondContact O-CG 3.35Å; A111-L115 PolarHBondContact O-N 3.48Å; A112-L115 PolarHBondContact O-N 3.16Å; G113-L115 PolarHBondContact O-N 3.26Å; L115-P119 WeakPolarHBondContact O-CD 3.07Å
116	S	95.2	Very high	94.1	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-84.3	-25	170.8	51.8	0	0	0	0	113.3	S70 A112 G113 F114 P119 V120 S155	S70-S116 WeakPolarHBondContact OG-CB 3.29Å; S70-S116 PolarHBondContact OG-OG 3.01Å; A112-S116 PolarHBondContact O-N 2.87Å; A112-S116 VanDerWaalsContact O-N 3.14Å; A112-S116 PolarHBondContact O-OG 3.04Å; G113-S116 PolarHBondContact O-N 2.62Å; G113-S116 PolarHBondContact O-OG 3.45Å; F114-S116 VanDerWaalsContact C-N 3.28Å; F114-S116 PolarHBondContact O-N 3.19Å; S116-P119 WeakPolarHBondContact O-CD 3.48Å; S116-P119 WeakPolarHBondContact O-CG 3.46Å; S116-V120 VanDerWaalsContact O-CG2 3.31Å; S116-V120 WeakPolarHBondContact O-CG2 3.28Å; S116-S155 WeakPolarHBondContact OG-CB 3.35Å
117	L	95.5	Very high	93.8	Very high	30 Å²	30	44.1 Å²	44.1	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-70.4	-33.1	175.8	-176	62.2	0	0	0	112.8	G113 F114 S121 L152 M159	G113-L117 PolarHBondContact O-N 2.96Å; F114-L117 WeakPolarHBondContact O-CB 3.31Å; F114-L117 PolarHBondContact O-N 2.85Å; F114-L117 VanDerWaalsContact O-N 3.07Å; L117-S121 VanDerWaalsContact O-CB 3.29Å; L117-S121 WeakPolarHBondContact O-CB 3.29Å; L117-S121 PolarHBondContact O-N 3.47Å; L117-S121 PolarHBondContact O-OG 3.45Å; L117-L152 HydrophobicContact CD1-CD1 3.56Å; L117-M159 HydrophobicContact CD2-SD 4Å
118	I	95	Very high	93.5	Very high	66 Å²	66	43.2 Å²	43.2	34%	0.338	22%	0.223	S	C	.	.	H	α-helix	trans	-56.8	-59.7	176.8	-65.8	165.2	0	0	0	112.2	L66 F114 V120 S121 W122	L66-I118 HydrophobicContact CD1-CB 4.42Å; L66-I118 HydrophobicContact CD1-CG2 3.88Å; F114-I118 HydrophobicContact CD1-CD1 4.08Å; F114-I118 HydrophobicContact CE1-CD1 3.82Å; F114-I118 HydrophobicContact CE1-CG1 4.34Å; F114-I118 HydrophobicContact CZ-CD1 4.46Å; F114-I118 PolarHBondContact O-N 3.31Å; F114-I118 VanDerWaalsContact O-N 3.16Å; I118-V120 VanDerWaalsContact C-N 3.32Å; I118-V120 PolarHBondContact O-N 2.99Å; I118-S121 PolarHBondContact O-N 2.93Å; I118-W122 WeakPolarHBondContact O-CB 3.44Å; I118-W122 PolarHBondContact O-N 2.86Å
119	P	93.1	Very high	93.1	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.019	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-30.5	-177.8	26.4	-35.3	0	0	0	113.2	L66 M67 L115 S116 T123	L66-P119 HydrophobicContact CB-CG 4.09Å; M67-P119 HydrophobicContact CE-CG 4.16Å; M67-P119 HydrophobicContact CG-CG 4.07Å; M67-P119 HydrophobicContact SD-CG 4.37Å; L115-P119 WeakPolarHBondContact O-CD 3.07Å; S116-P119 WeakPolarHBondContact O-CD 3.48Å; S116-P119 WeakPolarHBondContact O-CG 3.46Å; P119-T123 WeakPolarHBondContact O-CB 3.42Å; P119-T123 WeakPolarHBondContact O-CG2 3.36Å; P119-T123 PolarHBondContact O-N 3.47Å; P119-T123 PolarHBondContact O-OG1 3.43Å
120	V	92.7	Very high	92.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-46.2	173	170.8	0	0	0	0	110.7	M67 S116 I118 T123 T124 L148 L152	M67-V120 HydrophobicContact CE-CG2 3.63Å; S116-V120 VanDerWaalsContact O-CG2 3.31Å; S116-V120 WeakPolarHBondContact O-CG2 3.28Å; I118-V120 VanDerWaalsContact C-N 3.32Å; I118-V120 PolarHBondContact O-N 2.99Å; V120-T123 PolarHBondContact O-OG1 2.93Å; V120-T124 VanDerWaalsContact O-CB 3.31Å; V120-T124 WeakPolarHBondContact O-CB 3.31Å; V120-T124 PolarHBondContact O-N 2.98Å; V120-T124 PolarHBondContact O-OG1 3.16Å; V120-L148 HydrophobicContact CB-CD2 4.36Å; V120-L148 HydrophobicContact CG1-CD2 4.05Å; V120-L148 HydrophobicContact CG2-CD2 4.39Å; V120-L152 HydrophobicContact CG1-CB 3.97Å; V120-L152 HydrophobicContact CG1-CD1 4.21Å
121	S	93.6	Very high	91.8	Very high	60 Å²	60	45.9 Å²	45.9	42%	0.42	23%	0.234	S	C	.	.	H	α-helix	trans	-64	-43.3	177.5	-57.3	0	0	0	0	111.8	L117 I118 T124 H125	L117-S121 VanDerWaalsContact O-CB 3.29Å; L117-S121 WeakPolarHBondContact O-CB 3.29Å; L117-S121 PolarHBondContact O-N 3.47Å; L117-S121 PolarHBondContact O-OG 3.45Å; I118-S121 PolarHBondContact O-N 2.93Å; S121-T124 PolarHBondContact O-N 3.38Å; S121-H125 WeakPolarHBondContact O-CB 3.2Å; S121-H125 PolarHBondContact O-N 3.02Å
122	W	92.8	Very high	91.1	Very high	126 Å²	126	53.5 Å²	53.5	48%	0.477	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-53.2	177.8	-171.4	-90.1	0	0	0	112	I118 T124 H125 E126	I118-W122 WeakPolarHBondContact O-CB 3.44Å; I118-W122 PolarHBondContact O-N 2.86Å; W122-T124 VanDerWaalsContact C-N 3.28Å; W122-T124 PolarHBondContact O-N 3.46Å; W122-H125 WeakPolarHBondContact O-CB 3.27Å; W122-H125 PolarHBondContact O-N 2.89Å; W122-E126 WeakPolarHBondContact O-CG 3.43Å; W122-E126 PolarHBondContact O-N 2.85Å
123	T	90.2	Very high	90.4	Very high	18 Å²	18	55.5 Å²	55.5	11%	0.11	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-29.8	-179.5	49.7	0	0	0	0	112.9	W13 P119 V120 V127 L148	W13-T123 HydrophobicContact CE3-CG2 4.03Å; W13-T123 HydrophobicContact CZ3-CG2 4.02Å; W13-T123 WeakPolarHBondContact CZ3-OG1 3.48Å; P119-T123 WeakPolarHBondContact O-CB 3.42Å; P119-T123 WeakPolarHBondContact O-CG2 3.36Å; P119-T123 PolarHBondContact O-N 3.47Å; P119-T123 PolarHBondContact O-OG1 3.43Å; V120-T123 PolarHBondContact O-OG1 2.93Å; T123-V127 VanDerWaalsContact O-CG2 3.29Å; T123-V127 WeakPolarHBondContact O-CG2 3.31Å; T123-V127 PolarHBondContact O-N 2.95Å; T123-V127 VanDerWaalsContact O-N 3.16Å; T123-L148 VanDerWaalsContact OG1-CD2 3.28Å; T123-L148 WeakPolarHBondContact OG1-CD2 3.46Å
124	T	90.6	Very high	89.6	Confident	44 Å²	44	61.4 Å²	61.4	27%	0.27	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-43.8	169.3	-56.3	0	0	0	0	111.6	V120 S121 W122 V127 V128 I144	V120-T124 VanDerWaalsContact O-CB 3.31Å; V120-T124 WeakPolarHBondContact O-CB 3.31Å; V120-T124 PolarHBondContact O-N 2.98Å; V120-T124 PolarHBondContact O-OG1 3.16Å; S121-T124 PolarHBondContact O-N 3.38Å; W122-T124 VanDerWaalsContact C-N 3.28Å; W122-T124 PolarHBondContact O-N 3.46Å; T124-V127 PolarHBondContact O-N 3.07Å; T124-V128 VanDerWaalsContact O-CG2 3.3Å; T124-V128 WeakPolarHBondContact O-CG2 3.44Å; T124-V128 PolarHBondContact O-N 2.71Å; T124-I144 HydrophobicContact CG2-CD1 4.32Å
125	H	91.1	Very high	88.6	Confident	88 Å²	88	62.9 Å²	62.9	41%	0.407	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-47.1	176.2	171.5	-91.8	0	0	0	112.1	S121 W122 V127 V128 Q129	S121-H125 WeakPolarHBondContact O-CB 3.2Å; S121-H125 PolarHBondContact O-N 3.02Å; W122-H125 WeakPolarHBondContact O-CB 3.27Å; W122-H125 PolarHBondContact O-N 2.89Å; H125-V127 VanDerWaalsContact C-N 3.34Å; H125-V127 PolarHBondContact O-N 2.89Å; H125-V128 PolarHBondContact O-N 3.24Å; H125-V128 VanDerWaalsContact O-N 3.15Å; H125-Q129 VanDerWaalsContact CE1-CD 3.41Å; H125-Q129 PolarHBondContact CE1-NE2 3.25Å; H125-Q129 PolarHBondContact NE2-NE2 3.44Å; H125-Q129 PolarHBondContact O-N 3.01Å
126	E	88.9	Confident	87.7	Confident	67 Å²	67	63.5 Å²	63.5	31%	0.313	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-41.2	178.7	-65	-50.7	96.9	0	0	112.4	W122 Q129 T130	W122-E126 WeakPolarHBondContact O-CG 3.43Å; W122-E126 PolarHBondContact O-N 2.85Å; E126-Q129 PolarHBondContact O-N 3.43Å; E126-T130 VanDerWaalsContact O-CB 3.25Å; E126-T130 WeakPolarHBondContact O-CB 3.49Å; E126-T130 PolarHBondContact O-N 3.42Å; E126-T130 PolarHBondContact O-OG1 2.91Å
127	V	87.1	Confident	86.6	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-62.1	-44.4	174	165.5	0	0	0	0	111.1	Q14 T123 T124 H125 T130 F131 Y142 I144	Q14-V127 HydrophobicContact CG-CG2 3.78Å; T123-V127 VanDerWaalsContact O-CG2 3.29Å; T123-V127 WeakPolarHBondContact O-CG2 3.31Å; T123-V127 PolarHBondContact O-N 2.95Å; T123-V127 VanDerWaalsContact O-N 3.16Å; T124-V127 PolarHBondContact O-N 3.07Å; H125-V127 VanDerWaalsContact C-N 3.34Å; H125-V127 PolarHBondContact O-N 2.89Å; V127-T130 WeakPolarHBondContact O-CB 3.25Å; V127-T130 PolarHBondContact O-N 2.92Å; V127-F131 HydrophobicContact CG1-CD2 3.93Å; V127-F131 HydrophobicContact CG1-CE2 3.79Å; V127-F131 VanDerWaalsContact O-CD2 3.31Å; V127-F131 WeakPolarHBondContact O-CD2 3.33Å; V127-F131 PolarHBondContact O-N 3.2Å; V127-Y142 WeakPolarHBondContact CG1-O 3.12Å; V127-I144 HydrophobicContact CB-CG1 4.49Å; V127-I144 HydrophobicContact CG1-CG1 3.59Å
128	V	87.8	Confident	85.2	Confident	57 Å²	57	70.7 Å²	70.7	35%	0.345	38%	0.38	S	S	.	.	H	α-helix	trans	-65.8	-42.6	178.3	170.2	0	0	0	0	111.9	T124 H125 T130 F131 Y132	T124-V128 VanDerWaalsContact O-CG2 3.3Å; T124-V128 WeakPolarHBondContact O-CG2 3.44Å; T124-V128 PolarHBondContact O-N 2.71Å; H125-V128 PolarHBondContact O-N 3.24Å; H125-V128 VanDerWaalsContact O-N 3.15Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 3.47Å; V128-F131 WeakPolarHBondContact O-CB 3.45Å; V128-F131 PolarHBondContact O-N 3.48Å; V128-Y132 HydrophobicContact CG1-CD2 3.9Å; V128-Y132 HydrophobicContact CG1-CE2 3.84Å; V128-Y132 VanDerWaalsContact O-CD2 3.27Å; V128-Y132 WeakPolarHBondContact O-CD2 3.4Å; V128-Y132 PolarHBondContact O-N 3.4Å
129	Q	87.4	Confident	83.8	Confident	101 Å²	101	68.5 Å²	68.5	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-39.1	173.7	-69.8	-149.4	-4	0	0	112.1	H125 E126 F131 Y132 S133	H125-Q129 VanDerWaalsContact CE1-CD 3.41Å; H125-Q129 PolarHBondContact CE1-NE2 3.25Å; H125-Q129 PolarHBondContact NE2-NE2 3.44Å; H125-Q129 PolarHBondContact O-N 3.01Å; E126-Q129 PolarHBondContact O-N 3.43Å; Q129-F131 VanDerWaalsContact C-N 3.32Å; Q129-F131 PolarHBondContact O-N 3.2Å; Q129-Y132 PolarHBondContact O-N 2.95Å; Q129-S133 WeakPolarHBondContact O-CB 3.49Å; Q129-S133 PolarHBondContact O-N 3.25Å; Q129-S133 PolarHBondContact O-OG 3.5Å
130	T	83.1	Confident	82.6	Confident	35 Å²	35	72.4 Å²	72.4	22%	0.215	39%	0.393	C	S	.	.	H	α-helix	trans	-60.1	-39.6	175.2	-63.9	0	0	0	0	111.8	E126 V127 V128 I136 Y142	E126-T130 VanDerWaalsContact O-CB 3.25Å; E126-T130 WeakPolarHBondContact O-CB 3.49Å; E126-T130 PolarHBondContact O-N 3.42Å; E126-T130 PolarHBondContact O-OG1 2.91Å; V127-T130 WeakPolarHBondContact O-CB 3.25Å; V127-T130 PolarHBondContact O-N 2.92Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 3.47Å; T130-I136 HydrophobicContact CG2-CD1 3.79Å; T130-Y142 HydrophobicContact CG2-CD2 4.25Å
131	F	81.9	Confident	81.8	Confident	69 Å²	69	75.6 Å²	75.6	30%	0.303	41%	0.407	S	S	.	.	H	α-helix	trans	-64	-45.9	176.8	-92.1	-62.6	0	0	0	114.1	V127 V128 Q129 K141 Y142 E143	V127-F131 HydrophobicContact CG1-CD2 3.93Å; V127-F131 HydrophobicContact CG1-CE2 3.79Å; V127-F131 VanDerWaalsContact O-CD2 3.31Å; V127-F131 WeakPolarHBondContact O-CD2 3.33Å; V127-F131 PolarHBondContact O-N 3.2Å; V128-F131 WeakPolarHBondContact O-CB 3.45Å; V128-F131 PolarHBondContact O-N 3.48Å; Q129-F131 VanDerWaalsContact C-N 3.32Å; Q129-F131 PolarHBondContact O-N 3.2Å; F131-K141 HydrophobicContact CD1-CB 4.25Å; F131-K141 HydrophobicContact CD1-CD 4.12Å; F131-K141 HydrophobicContact CE1-CB 4.15Å; F131-K141 PolarHBondContact O-NZ 3.36Å; F131-Y142 WeakPolarHBondContact CE2-O 3.38Å; F131-Y142 WeakPolarHBondContact CZ-O 3.34Å; F131-E143 HydrophobicContact CE1-CG 4.49Å; F131-E143 HydrophobicContact CZ-CB 4.35Å; F131-E143 HydrophobicContact CZ-CG 3.74Å
132	Y	83.1	Confident	81.1	Confident	199 Å²	199	74.6 Å²	74.6	78%	0.78	39%	0.394	S	S	*	.	H	α-helix	trans	-83.5	-14.3	-175.5	-72.7	-65.7	0	0	0	113.8	V128 Q129	V128-Y132 HydrophobicContact CG1-CD2 3.9Å; V128-Y132 HydrophobicContact CG1-CE2 3.84Å; V128-Y132 VanDerWaalsContact O-CD2 3.27Å; V128-Y132 WeakPolarHBondContact O-CD2 3.4Å; V128-Y132 PolarHBondContact O-N 3.4Å; Q129-Y132 PolarHBondContact O-N 2.95Å
133	S	81.1	Confident	80.8	Confident	42 Å²	42	74 Å²	74	29%	0.294	40%	0.397	S	S	.	.			trans	-67.5	122	179	-72	0	0	0	0	112.3	Q129 N135	Q129-S133 WeakPolarHBondContact O-CB 3.49Å; Q129-S133 PolarHBondContact O-N 3.25Å; Q129-S133 PolarHBondContact O-OG 3.5Å; S133-N135 PolarHBondContact O-N 3.45Å
134	P	79	Confident	80.8	Confident	124 Å²	124	75.5 Å²	75.5	81%	0.805	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.6	180	29.8	-36	0	0	0	113.5	I136	P134-I136 VanDerWaalsContact C-N 3.26Å; P134-I136 PolarHBondContact O-N 3.07Å
135	N	76.6	Confident	80.7	Confident	147 Å²	147	73.4 Å²	73.4	79%	0.786	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-6.4	-177	-63.4	-18.4	0	0	0	113.9	S133	S133-N135 PolarHBondContact O-N 3.45Å
136	I	76.1	Confident	80.6	Confident	53 Å²	53	76 Å²	76	27%	0.272	40%	0.403	S	S	.	.	S	Bend	trans	-113.1	117.5	-171.8	-59.6	-179.9	0	0	0	110.1	T130 P134 M140 K141	T130-I136 HydrophobicContact CG2-CD1 3.79Å; P134-I136 VanDerWaalsContact C-N 3.26Å; P134-I136 PolarHBondContact O-N 3.07Å; I136-M140 HydrophobicContact CG2-CB 4Å; I136-K141 HydrophobicContact CG2-CG 4.42Å
137	P	72.8	Confident	80.8	Confident	93 Å²	93	73 Å²	73	60%	0.604	39%	0.389	S	S	*	.			trans	-55.8	148	176.7	-26.7	35.3	0	0	0	112.8	G139 M140	P137-G139 PolarHBondContact O-N 3.37Å; P137-G139 VanDerWaalsContact O-N 3.12Å; P137-M140 PolarHBondContact O-N 2.94Å
138	A	66.3	Low	81	Confident	89 Å²	89	73.1 Å²	73.1	74%	0.736	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-55.2	-36.1	-174.8	0	0	0	0	0	113.9	M140	A138-M140 PolarHBondContact O-N 3.49Å
139	G	64.9	Low	81.2	Confident	21 Å²	21	76.7 Å²	76.7	22%	0.216	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-78.1	11.7	175.9	0	0	0	0	0	115.8	H18 P137	H18-G139 WeakPolarHBondContact CA-O 3.48Å; H18-G139 PolarHBondContact ND1-O 2.78Å; P137-G139 PolarHBondContact O-N 3.37Å; P137-G139 VanDerWaalsContact O-N 3.12Å
140	M	68	Low	81.5	Confident	85 Å²	85	76.1 Å²	76.1	42%	0.419	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-128.4	19.8	176	-79.4	-67.9	-103.2	0	0	112.6	H18 I136 P137 A138	H18-M140 VanDerWaalsContact CE1-SD 3.56Å; H18-M140 PolarHBondContact ND1-SD 2.77Å; I136-M140 HydrophobicContact CG2-CB 4Å; P137-M140 PolarHBondContact O-N 2.94Å; A138-M140 PolarHBondContact O-N 3.49Å
141	K	76.4	Confident	82	Confident	68 Å²	68	74.4 Å²	74.4	30%	0.296	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-83.3	140.8	177	-63.3	-169.5	173.6	-157.6	0	110.5	S16 F131 I136	S16-K141 WeakPolarHBondContact CB-O 3.35Å; S16-K141 PolarHBondContact OG-O 3.21Å; F131-K141 HydrophobicContact CD1-CB 4.25Å; F131-K141 HydrophobicContact CD1-CD 4.12Å; F131-K141 HydrophobicContact CE1-CB 4.15Å; F131-K141 PolarHBondContact O-NZ 3.36Å; I136-K141 HydrophobicContact CG2-CG 4.42Å
142	Y	78.6	Confident	82.7	Confident	39 Å²	39	74.3 Å²	74.3	15%	0.153	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-100.9	128.3	176.7	-73.4	-91.5	0	0	0	109.7	Q14 I15 R31 V127 T130 F131	Q14-Y142 HydrophobicContact CB-CD1 3.88Å; I15-Y142 CarbonylContact O-C 3.36Å; I15-Y142 WeakPolarHBondContact O-CA 3.41Å; R31-Y142 HydrophobicContact CG-CE1 4.47Å; R31-Y142 PolarHBondContact NE-OH 2.76Å; V127-Y142 WeakPolarHBondContact CG1-O 3.12Å; T130-Y142 HydrophobicContact CG2-CD2 4.25Å; F131-Y142 WeakPolarHBondContact CE2-O 3.38Å; F131-Y142 WeakPolarHBondContact CZ-O 3.34Å
143	E	86.7	Confident	83.3	Confident	114 Å²	114	68.6 Å²	68.6	53%	0.533	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	154.4	170.3	-75.4	168.2	176.5	0	0	111.8	I15 F131 G145	I15-E143 HydrophobicContact CB-CB 4.49Å; I15-E143 PolarHBondContact N-O 3.16Å; I15-E143 PolarHBondContact O-N 3.02Å; F131-E143 HydrophobicContact CE1-CG 4.49Å; F131-E143 HydrophobicContact CZ-CB 4.35Å; F131-E143 HydrophobicContact CZ-CG 3.74Å; E143-G145 PolarHBondContact O-N 3.16Å
144	I	88.4	Confident	83.9	Confident	49 Å²	49	67.4 Å²	67.4	25%	0.251	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	113.5	176.6	-57.9	174.5	0	0	0	108.2	T124 V127 L148 Y149	T124-I144 HydrophobicContact CG2-CD1 4.32Å; V127-I144 HydrophobicContact CB-CG1 4.49Å; V127-I144 HydrophobicContact CG1-CG1 3.59Å; I144-L148 HydrophobicContact CG2-CB 3.93Å; I144-L148 HydrophobicContact CG2-CD1 3.74Å; I144-L148 HydrophobicContact CG2-CG 4.47Å; I144-Y149 HydrophobicContact CB-CE2 4.1Å; I144-Y149 HydrophobicContact CG2-CD2 4.15Å; I144-Y149 HydrophobicContact CG2-CE2 3.45Å; I144-Y149 VanDerWaalsContact CG2-CE2 3.45Å
145	G	88.7	Confident	84.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.329	C	S	.	.			trans	-75.1	154.4	-179.7	0	0	0	0	0	113.5	Y12 W13 E143 C147 L148	Y12-G145 CarbonylContact O-C 3.56Å; Y12-G145 VanDerWaalsContact O-C 3.24Å; Y12-G145 VanDerWaalsContact O-CA 3.29Å; Y12-G145 WeakPolarHBondContact O-CA 3.27Å; W13-G145 WeakPolarHBondContact O-CA 3.48Å; W13-G145 PolarHBondContact O-N 3.31Å; E143-G145 PolarHBondContact O-N 3.16Å; G145-C147 PolarHBondContact O-N 2.96Å; G145-C147 VanDerWaalsContact O-N 3.08Å; G145-L148 WeakPolarHBondContact O-CB 3.49Å; G145-L148 PolarHBondContact O-N 3.41Å
146	E	90.4	Very high	85.6	Confident	144 Å²	144	58.4 Å²	58.4	67%	0.673	31%	0.312	S	S	*	.	H	α-helix	trans	-56.9	-28.9	-175.1	-61.1	-172.9	121.2	0	0	113.8	Y12 L148 Y149 L150	Y12-E146 PolarHBondContact O-N 3.09Å; E146-L148 VanDerWaalsContact C-N 3.27Å; E146-L148 PolarHBondContact O-N 2.99Å; E146-Y149 PolarHBondContact O-N 3.45Å; E146-L150 PolarHBondContact O-N 3.24Å; E146-L150 VanDerWaalsContact O-N 3.13Å
147	C	91.4	Very high	86.6	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.02	33%	0.326	C	S	.	.	H	α-helix	trans	-69.8	-21.6	178.6	-68	0	0	0	0	113.5	A7 L10 Y12 G145 G151	A7-C147 HydrophobicContact CB-CB 4.24Å; L10-C147 WeakPolarHBondContact CB-SG 3.4Å; Y12-C147 VanDerWaalsContact O-CB 3.28Å; Y12-C147 WeakPolarHBondContact O-CB 3.27Å; Y12-C147 PolarHBondContact O-N 3.13Å; Y12-C147 VanDerWaalsContact O-N 3.09Å; G145-C147 PolarHBondContact O-N 2.96Å; G145-C147 VanDerWaalsContact O-N 3.08Å; C147-G151 PolarHBondContact O-N 2.83Å
148	L	91.8	Very high	87.6	Confident	3 Å²	3	57 Å²	57	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-41.9	171.7	-76.4	171.8	0	0	0	111.3	W13 V120 T123 I144 G145 E146 G151 L152	W13-L148 HydrophobicContact CD2-CD2 4.36Å; W13-L148 HydrophobicContact CE3-CD2 3.68Å; W13-L148 HydrophobicContact CE3-CG 4.46Å; W13-L148 HydrophobicContact CZ3-CD2 4.05Å; W13-L148 WeakPolarHBondContact O-CD1 3.45Å; V120-L148 HydrophobicContact CB-CD2 4.36Å; V120-L148 HydrophobicContact CG1-CD2 4.05Å; V120-L148 HydrophobicContact CG2-CD2 4.39Å; T123-L148 VanDerWaalsContact OG1-CD2 3.28Å; T123-L148 WeakPolarHBondContact OG1-CD2 3.46Å; I144-L148 HydrophobicContact CG2-CB 3.93Å; I144-L148 HydrophobicContact CG2-CD1 3.74Å; I144-L148 HydrophobicContact CG2-CG 4.47Å; G145-L148 WeakPolarHBondContact O-CB 3.49Å; G145-L148 PolarHBondContact O-N 3.41Å; E146-L148 VanDerWaalsContact C-N 3.27Å; E146-L148 PolarHBondContact O-N 2.99Å; L148-G151 PolarHBondContact O-N 2.98Å; L148-L152 VanDerWaalsContact O-CB 3.27Å; L148-L152 WeakPolarHBondContact O-CB 3.42Å; L148-L152 PolarHBondContact O-N 2.76Å
149	Y	92.9	Very high	89	Confident	133 Å²	133	55.2 Å²	55.2	52%	0.522	28%	0.276	S	S	.	.	H	α-helix	trans	-66.2	-41.6	176.1	-64.1	-79.6	0	0	0	112	I144 E146 T153	I144-Y149 HydrophobicContact CB-CE2 4.1Å; I144-Y149 HydrophobicContact CG2-CD2 4.15Å; I144-Y149 HydrophobicContact CG2-CE2 3.45Å; I144-Y149 VanDerWaalsContact CG2-CE2 3.45Å; E146-Y149 PolarHBondContact O-N 3.45Å; Y149-T153 VanDerWaalsContact O-CB 3.28Å; Y149-T153 WeakPolarHBondContact O-CB 3.32Å; Y149-T153 PolarHBondContact O-N 2.93Å; Y149-T153 PolarHBondContact O-OG1 3.06Å
150	L	94.3	Very high	90.5	Very high	88 Å²	88	59.9 Å²	59.9	46%	0.461	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-41.2	173.7	-68	172.6	0	0	0	112	E146 S154	E146-L150 PolarHBondContact O-N 3.24Å; E146-L150 VanDerWaalsContact O-N 3.13Å; L150-S154 VanDerWaalsContact O-CB 3.22Å; L150-S154 WeakPolarHBondContact O-CB 3.22Å; L150-S154 PolarHBondContact O-N 3.47Å; L150-S154 PolarHBondContact O-OG 3.47Å
151	G	93.7	Very high	91.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-55.4	173.6	0	0	0	0	0	111.7	C147 L148 T153 S154 S155	C147-G151 PolarHBondContact O-N 2.83Å; L148-G151 PolarHBondContact O-N 2.98Å; G151-T153 PolarHBondContact O-N 3.49Å; G151-S154 PolarHBondContact O-N 3.15Å; G151-S154 PolarHBondContact O-OG 3.03Å; G151-S155 WeakPolarHBondContact O-CB 3.32Å; G151-S155 PolarHBondContact O-N 3.48Å; G151-S155 PolarHBondContact O-OG 2.88Å
152	L	94.8	Very high	92.6	Very high	67 Å²	67	53.9 Å²	53.9	35%	0.351	28%	0.275	S	S	.	.	H	α-helix	trans	-56.4	-49.8	178.3	-174.4	70.6	0	0	0	112.3	L117 V120 L148 S154 S155 L156	L117-L152 HydrophobicContact CD1-CD1 3.56Å; V120-L152 HydrophobicContact CG1-CB 3.97Å; V120-L152 HydrophobicContact CG1-CD1 4.21Å; L148-L152 VanDerWaalsContact O-CB 3.27Å; L148-L152 WeakPolarHBondContact O-CB 3.42Å; L148-L152 PolarHBondContact O-N 2.76Å; L152-S154 VanDerWaalsContact C-N 3.34Å; L152-S154 PolarHBondContact O-N 3.15Å; L152-S155 PolarHBondContact O-N 2.96Å; L152-S155 PolarHBondContact O-OG 3.09Å; L152-L156 HydrophobicContact CD1-CD1 4.45Å; L152-L156 HydrophobicContact CG-CD1 4.2Å; L152-L156 WeakPolarHBondContact O-CB 2.98Å; L152-L156 VanDerWaalsContact O-CG 3.27Å; L152-L156 WeakPolarHBondContact O-CG 3.18Å; L152-L156 PolarHBondContact O-N 3.13Å
153	T	95.8	Very high	93.4	Very high	79 Å²	79	53 Å²	53	49%	0.485	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-43.1	-179	-57.2	0	0	0	0	110.7	Y149 G151 I157	Y149-T153 VanDerWaalsContact O-CB 3.28Å; Y149-T153 WeakPolarHBondContact O-CB 3.32Å; Y149-T153 PolarHBondContact O-N 2.93Å; Y149-T153 PolarHBondContact O-OG1 3.06Å; G151-T153 PolarHBondContact O-N 3.49Å; T153-I157 HydrophobicContact CG2-CD1 3.84Å; T153-I157 WeakPolarHBondContact O-CB 3.46Å; T153-I157 VanDerWaalsContact O-CG1 3.25Å; T153-I157 WeakPolarHBondContact O-CG1 3.33Å; T153-I157 PolarHBondContact O-N 3.11Å
154	S	94.9	Very high	93.7	Very high	16 Å²	16	53.5 Å²	53.5	11%	0.112	28%	0.283	C	S	.	.	H	α-helix	trans	-77.5	-26.5	-178.3	67.6	0	0	0	0	114.1	G3 T4 L150 G151 L152 S158	G3-S154 WeakPolarHBondContact CA-OG 3.43Å; T4-S154 WeakPolarHBondContact CG2-OG 3.07Å; T4-S154 PolarHBondContact N-OG 3.07Å; T4-S154 VanDerWaalsContact N-OG 3.11Å; L150-S154 VanDerWaalsContact O-CB 3.22Å; L150-S154 WeakPolarHBondContact O-CB 3.22Å; L150-S154 PolarHBondContact O-N 3.47Å; L150-S154 PolarHBondContact O-OG 3.47Å; G151-S154 PolarHBondContact O-N 3.15Å; G151-S154 PolarHBondContact O-OG 3.03Å; L152-S154 VanDerWaalsContact C-N 3.34Å; L152-S154 PolarHBondContact O-N 3.15Å; S154-S158 VanDerWaalsContact O-CB 3.29Å; S154-S158 WeakPolarHBondContact O-CB 3.44Å; S154-S158 PolarHBondContact O-N 3.26Å; S154-S158 PolarHBondContact O-OG 2.89Å
155	S	95.3	Very high	93.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-71.5	-43.7	171	63.4	0	0	0	0	111	S116 G151 L152 S158 M159	S116-S155 WeakPolarHBondContact OG-CB 3.35Å; G151-S155 WeakPolarHBondContact O-CB 3.32Å; G151-S155 PolarHBondContact O-N 3.48Å; G151-S155 PolarHBondContact O-OG 2.88Å; L152-S155 PolarHBondContact O-N 2.96Å; L152-S155 PolarHBondContact O-OG 3.09Å; S155-S158 PolarHBondContact O-N 3.28Å; S155-M159 WeakPolarHBondContact O-CG 3.47Å; S155-M159 PolarHBondContact O-N 3.34Å
156	L	96.1	Very high	93.9	Very high	83 Å²	83	55.6 Å²	55.6	44%	0.435	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-47.1	173.9	-70	172.3	0	0	0	112.3	L152 S158 M159 L160	L152-L156 HydrophobicContact CD1-CD1 4.45Å; L152-L156 HydrophobicContact CG-CD1 4.2Å; L152-L156 WeakPolarHBondContact O-CB 2.98Å; L152-L156 VanDerWaalsContact O-CG 3.27Å; L152-L156 WeakPolarHBondContact O-CG 3.18Å; L152-L156 PolarHBondContact O-N 3.13Å; L156-S158 VanDerWaalsContact C-N 3.29Å; L156-S158 PolarHBondContact O-N 3.04Å; L156-M159 PolarHBondContact O-N 3.05Å; L156-L160 WeakPolarHBondContact O-CG 3.32Å; L156-L160 PolarHBondContact O-N 2.93Å
157	I	95.9	Very high	93.9	Very high	109 Å²	109	53 Å²	53	56%	0.559	29%	0.288	S	S	*	.	H	α-helix	trans	-62.1	-37.8	174.9	-69.1	168.2	0	0	0	111.2	T153 L160 G161	T153-I157 HydrophobicContact CG2-CD1 3.84Å; T153-I157 WeakPolarHBondContact O-CB 3.46Å; T153-I157 VanDerWaalsContact O-CG1 3.25Å; T153-I157 WeakPolarHBondContact O-CG1 3.33Å; T153-I157 PolarHBondContact O-N 3.11Å; I157-L160 PolarHBondContact O-N 3.47Å; I157-G161 PolarHBondContact O-N 2.91Å
158	S	95.1	Very high	93.7	Very high	7 Å²	7	56.4 Å²	56.4	5%	0.049	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-40.7	176.4	-55.7	0	0	0	0	111.6	M1 F109 S154 S155 L156 G161 G162	M1-S158 PolarHBondContact N-OG 3.35Å; F109-S158 WeakPolarHBondContact CD1-O 3.31Å; S154-S158 VanDerWaalsContact O-CB 3.29Å; S154-S158 WeakPolarHBondContact O-CB 3.44Å; S154-S158 PolarHBondContact O-N 3.26Å; S154-S158 PolarHBondContact O-OG 2.89Å; S155-S158 PolarHBondContact O-N 3.28Å; L156-S158 VanDerWaalsContact C-N 3.29Å; L156-S158 PolarHBondContact O-N 3.04Å; S158-G161 PolarHBondContact O-N 3.35Å; S158-G162 PolarHBondContact O-N 2.94Å
159	M	95.8	Very high	93.3	Very high	51 Å²	51	57 Å²	57	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-44.1	174	-71.4	178.5	66.8	0	0	112	L110 F114 L117 S155 L156 G162 G163	L110-M159 HydrophobicContact CD2-CB 4.35Å; L110-M159 VanDerWaalsContact CD2-O 3.22Å; L110-M159 WeakPolarHBondContact CD2-O 3.48Å; F114-M159 HydrophobicContact CB-SD 4.47Å; F114-M159 HydrophobicContact CD2-CE 4.34Å; L117-M159 HydrophobicContact CD2-SD 4Å; S155-M159 WeakPolarHBondContact O-CG 3.47Å; S155-M159 PolarHBondContact O-N 3.34Å; L156-M159 PolarHBondContact O-N 3.05Å; M159-G162 PolarHBondContact O-N 3.33Å; M159-G163 PolarHBondContact O-N 3.29Å
160	L	96.3	Very high	92.7	Very high	120 Å²	120	58.6 Å²	58.6	63%	0.628	32%	0.322	S	S	*	.	H	α-helix	trans	-62.6	-45.9	176.9	-71.1	170.4	0	0	0	111.7	L156 I157 G163 L164	L156-L160 WeakPolarHBondContact O-CG 3.32Å; L156-L160 PolarHBondContact O-N 2.93Å; I157-L160 PolarHBondContact O-N 3.47Å; L160-G163 PolarHBondContact O-N 3.48Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 3.44Å
161	G	94.3	Very high	92	Very high	27 Å²	27	58.8 Å²	58.8	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-44.6	175.9	0	0	0	0	0	112.9	I157 S158 L164 L165	I157-G161 PolarHBondContact O-N 2.91Å; S158-G161 PolarHBondContact O-N 3.35Å; G161-L164 PolarHBondContact O-N 3.18Å; G161-L165 WeakPolarHBondContact O-CB 3.31Å; G161-L165 WeakPolarHBondContact O-CG 3.33Å; G161-L165 PolarHBondContact O-N 2.91Å
162	G	94.2	Very high	90.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.7	-37.7	176.7	0	0	0	0	0	112.8	G106 S158 M159 S166	G106-G162 CarbonylContact C-O 3.6Å; G106-G162 WeakPolarHBondContact O-CA 3.34Å; S158-G162 PolarHBondContact O-N 2.94Å; M159-G162 PolarHBondContact O-N 3.33Å; G162-S166 VanDerWaalsContact O-CB 3.31Å; G162-S166 WeakPolarHBondContact O-CB 3.24Å; G162-S166 PolarHBondContact O-N 3.24Å; G162-S166 PolarHBondContact O-OG 3.36Å
163	G	94.3	Very high	89.6	Confident	20 Å²	20	63.7 Å²	63.7	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-48.8	175.2	0	0	0	0	0	112.4	M159 L160 S166 V167	M159-G163 PolarHBondContact O-N 3.29Å; L160-G163 PolarHBondContact O-N 3.48Å; G163-S166 PolarHBondContact O-N 3.01Å; G163-V167 WeakPolarHBondContact O-CG2 3.49Å; G163-V167 PolarHBondContact O-N 3.42Å
164	L	93.8	Very high	88.1	Confident	125 Å²	125	67.3 Å²	67.3	65%	0.654	36%	0.359	S	S	*	.	H	α-helix	trans	-60.6	-49.7	176.5	-70.1	168.9	0	0	0	111.6	L160 G161 S166 V167 S168	L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 3.44Å; G161-L164 PolarHBondContact O-N 3.18Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 3.42Å; L164-V167 PolarHBondContact O-N 2.68Å; L164-S168 PolarHBondContact O-N 3.3Å; L164-S168 PolarHBondContact O-OG 3.49Å
165	L	90.9	Very high	86.4	Confident	86 Å²	86	68.1 Å²	68.1	45%	0.45	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-41.8	176.1	-73.8	171	0	0	0	112.3	G161 C169	G161-L165 WeakPolarHBondContact O-CB 3.31Å; G161-L165 WeakPolarHBondContact O-CG 3.33Å; G161-L165 PolarHBondContact O-N 2.91Å; L165-C169 PolarHBondContact O-N 2.9Å; L165-C169 PolarHBondContact O-SG 3.37Å
166	S	91.1	Very high	84.3	Confident	6 Å²	6	70.6 Å²	70.6	4%	0.042	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-55.5	176.2	-58.4	0	0	0	0	110.7	V107 G162 G163 L164 S168 C169 W170	V107-S166 PolarHBondContact N-OG 2.92Å; G162-S166 VanDerWaalsContact O-CB 3.31Å; G162-S166 WeakPolarHBondContact O-CB 3.24Å; G162-S166 PolarHBondContact O-N 3.24Å; G162-S166 PolarHBondContact O-OG 3.36Å; G163-S166 PolarHBondContact O-N 3.01Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 3.42Å; S166-S168 VanDerWaalsContact C-N 3.32Å; S166-S168 PolarHBondContact O-N 3.28Å; S166-C169 WeakPolarHBondContact O-CB 3.4Å; S166-C169 PolarHBondContact O-N 3.18Å; S166-W170 PolarHBondContact O-N 3.04Å
167	V	90.3	Very high	82.1	Confident	89 Å²	89	77.4 Å²	77.4	54%	0.539	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-40.8	-175.8	169.9	0	0	0	0	111.8	G163 L164 C169 W170 V171	G163-V167 WeakPolarHBondContact O-CG2 3.49Å; G163-V167 PolarHBondContact O-N 3.42Å; L164-V167 PolarHBondContact O-N 2.68Å; V167-C169 VanDerWaalsContact C-N 3.29Å; V167-C169 PolarHBondContact O-N 3.35Å; V167-W170 PolarHBondContact O-N 3.33Å; V167-V171 HydrophobicContact CG1-CG2 4.48Å; V167-V171 WeakPolarHBondContact O-CG2 3.49Å; V167-V171 PolarHBondContact O-N 3.37Å
168	S	87.2	Confident	79.7	Confident	76 Å²	76	75.5 Å²	75.5	53%	0.531	42%	0.422	S	S	.	.	H	α-helix	trans	-55.4	-44.1	173.4	-65.7	0	0	0	0	112.4	L164 S166 V171 E172	L164-S168 PolarHBondContact O-N 3.3Å; L164-S168 PolarHBondContact O-OG 3.49Å; S166-S168 VanDerWaalsContact C-N 3.32Å; S166-S168 PolarHBondContact O-N 3.28Å; S168-V171 PolarHBondContact O-N 3.25Å; S168-E172 PolarHBondContact O-N 3.05Å; S168-E172 VanDerWaalsContact O-N 3.1Å
169	C	81.7	Confident	77.3	Confident	16 Å²	16	84.4 Å²	84.4	11%	0.108	46%	0.455	C	S	.	.	H	α-helix	trans	-72.1	-32.8	-179.7	-58.4	0	0	0	0	112.9	G103 L165 S166 V167 E172 E173	G103-C169 VanDerWaalsContact CA-SG 3.58Å; G103-C169 PolarHBondContact N-SG 3.14Å; L165-C169 PolarHBondContact O-N 2.9Å; L165-C169 PolarHBondContact O-SG 3.37Å; S166-C169 WeakPolarHBondContact O-CB 3.4Å; S166-C169 PolarHBondContact O-N 3.18Å; V167-C169 VanDerWaalsContact C-N 3.29Å; V167-C169 PolarHBondContact O-N 3.35Å; C169-E172 PolarHBondContact O-N 3Å; C169-E173 PolarHBondContact O-N 3.1Å
170	W	80.6	Confident	75	Confident	166 Å²	166	93.7 Å²	93.7	63%	0.629	49%	0.487	S	S	*	.	H	α-helix	trans	-63.8	-42.6	171.9	-72.9	99.5	0	0	0	111.4	S166 V167 E172 E173 E174	S166-W170 PolarHBondContact O-N 3.04Å; V167-W170 PolarHBondContact O-N 3.33Å; W170-E172 PolarHBondContact O-N 2.71Å; W170-E173 WeakPolarHBondContact O-CB 3.4Å; W170-E173 PolarHBondContact O-N 3.14Å; W170-E173 VanDerWaalsContact O-N 3.14Å; W170-E174 PolarHBondContact O-N 3.14Å; W170-E174 VanDerWaalsContact O-N 3.14Å
171	V	79.6	Confident	72.7	Confident	91 Å²	91	96.2 Å²	96.2	55%	0.552	50%	0.495	S	S	*	.	H	α-helix	trans	-65.6	-36.8	178	172	0	0	0	0	112	V167 S168 E173 G175	V167-V171 HydrophobicContact CG1-CG2 4.48Å; V167-V171 WeakPolarHBondContact O-CG2 3.49Å; V167-V171 PolarHBondContact O-N 3.37Å; S168-V171 PolarHBondContact O-N 3.25Å; V171-E173 VanDerWaalsContact C-N 3.32Å; V171-E173 PolarHBondContact O-N 3.5Å; V171-G175 PolarHBondContact O-N 2.74Å
172	E	70.6	Confident	70.4	Confident	108 Å²	108	97.7 Å²	97.7	51%	0.505	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-33.6	171.9	-72.9	-171	127.7	0	0	112.8	S168 C169 W170 G176	S168-E172 PolarHBondContact O-N 3.05Å; S168-E172 VanDerWaalsContact O-N 3.1Å; C169-E172 PolarHBondContact O-N 3Å; W170-E172 PolarHBondContact O-N 2.71Å; E172-G176 PolarHBondContact O-N 2.86Å
173	E	68.1	Low	68.3	Low	63 Å²	63	105.8 Å²	105.8	29%	0.294	55%	0.553	S	S	.	*	H	α-helix	trans	-69	-47.5	178.3	-118	-114.3	116.4	0	0	112.6	R100 C169 W170 V171 G176	R100-E173 IonicContact CZ-OE1 3.58Å; R100-E173 IonicContact CZ-OE2 3.09Å; R100-E173 VanDerWaalsContact NH1-CD 3.28Å; R100-E173 IonicContact NH1-OE1 3.94Å; R100-E173 IonicContact NH1-OE2 2.71Å; R100-E173 PolarHBondContact NH1-OE2 3.49Å; R100-E173 IonicContact NH2-OE1 2.86Å; R100-E173 PolarHBondContact NH2-OE1 2.82Å; R100-E173 IonicContact NH2-OE2 2.74Å; R100-E173 PolarHBondContact NH2-OE2 2.93Å; C169-E173 PolarHBondContact O-N 3.1Å; W170-E173 WeakPolarHBondContact O-CB 3.4Å; W170-E173 PolarHBondContact O-N 3.14Å; W170-E173 VanDerWaalsContact O-N 3.14Å; V171-E173 VanDerWaalsContact C-N 3.32Å; V171-E173 PolarHBondContact O-N 3.5Å; E173-G176 PolarHBondContact O-N 3.35Å
174	E	64.8	Low	65.8	Low	155 Å²	155	108.4 Å²	108.4	72%	0.724	58%	0.579	S	S	*	*	H	α-helix	trans	-66.6	-43.6	175.1	-64.6	-164.1	119.9	0	0	111	W170 G176 R177	W170-E174 PolarHBondContact O-N 3.14Å; W170-E174 VanDerWaalsContact O-N 3.14Å; E174-G176 VanDerWaalsContact C-N 3.28Å; E174-G176 PolarHBondContact O-N 3.36Å; E174-R177 PolarHBondContact O-N 3.02Å
175	G	57.5	Low	63.5	Low	32 Å²	32	112.4 Å²	112.4	33%	0.33	59%	0.587	S	S	.	*	H	α-helix	trans	-58.2	-38.2	174	0	0	0	0	0	112.8	V171 R177 G178 R179	V171-G175 PolarHBondContact O-N 2.74Å; G175-R177 VanDerWaalsContact C-N 3.26Å; G175-R177 PolarHBondContact O-N 2.83Å; G175-G178 PolarHBondContact O-N 2.8Å; G175-R179 WeakPolarHBondContact O-CB 3.49Å; G175-R179 PolarHBondContact O-N 3.3Å
176	G	52.5	Low	61.3	Low	52 Å²	52	114.2 Å²	114.2	54%	0.536	60%	0.604	S	S	.	*	H	α-helix	trans	-64.1	-24.8	178.7	0	0	0	0	0	114.5	E172 E173 E174	E172-G176 PolarHBondContact O-N 2.86Å; E173-G176 PolarHBondContact O-N 3.35Å; E174-G176 VanDerWaalsContact C-N 3.28Å; E174-G176 PolarHBondContact O-N 3.36Å
177	R	49	Very low	58.9	Low	227 Å²	227	123.6 Å²	123.6	86%	0.857	64%	0.64	S	S	*	*	H	α-helix	trans	-79.3	-23.4	171.4	-70.3	-175.7	174.2	-170	-1.9	113.2	E174 G175	E174-R177 PolarHBondContact O-N 3.02Å; G175-R177 VanDerWaalsContact C-N 3.26Å; G175-R177 PolarHBondContact O-N 2.83Å
178	G	46.8	Very low	56.6	Low	68 Å²	68	124.4 Å²	124.4	70%	0.701	65%	0.647	S	S	*	*	H	α-helix	trans	-100.1	-30.3	-179.9	0	0	0	0	0	115.7	G175	G175-G178 PolarHBondContact O-N 2.8Å
179	R	44.9	Very low	54.7	Low	194 Å²	194	126.8 Å²	126.8	73%	0.732	66%	0.661	S	S	*	*			trans	-108.1	69.4	-171.8	-74.7	-172.9	169.8	179.4	-2.8	113.7	G175	G175-R179 WeakPolarHBondContact O-CB 3.49Å; G175-R179 PolarHBondContact O-N 3.3Å
180	R	46.8	Very low	53	Low	247 Å²	247	132.6 Å²	132.6	93%	0.932	70%	0.695	S	S	*	*	S	Bend	trans	-81.6	10.7	152.3	-85.7	-163.7	174.1	-149.5	-0.8	113.7
181	H	47.5	Very low	51.6	Low	173 Å²	173	128.2 Å²	128.2	80%	0.801	70%	0.702	S	S	*	*	S	Bend	trans	-129.4	134.8	166.1	-83.9	97.5	0	0	0	109.9
182	G	46.9	Very low	49.5	Very low	57 Å²	57	131 Å²	131	59%	0.588	72%	0.719	S	S	*	*	S	Bend	trans	92	52.3	161.7	0	0	0	0	0	118
183	L	49.9	Very low	47.9	Very low	171 Å²	171	129 Å²	129	90%	0.895	73%	0.727	S	S	*	*			trans	-157.4	40.1	135.7	-136.9	78.6	0	0	0	114
184	G	41.5	Very low	46.4	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	76%	0.756	S	S	*	*			trans	-76.5	133.1	168.2	0	0	0	0	0	110.8
185	Y	44.9	Very low	44.8	Very low	209 Å²	209	133.2 Å²	133.2	82%	0.82	76%	0.763	S	S	*	*			trans	-58.9	142.7	163.8	-85.6	-94.8	0	0	0	109.6	Y187	Y185-Y187 VanDerWaalsContact C-N 3.26Å; Y185-Y187 PolarHBondContact O-N 3.19Å
186	P	44.8	Very low	43.4	Very low	124 Å²	124	135.2 Å²	135.2	81%	0.805	78%	0.784	S	S	*	*			trans	-78.2	69.6	-173.4	33.1	-37	0	0	0	112.5
187	Y	41.5	Very low	42.4	Very low	204 Å²	204	140 Å²	140	80%	0.8	80%	0.803	S	S	*	*			trans	-81.7	127.2	159.3	-83.9	-80.3	0	0	0	109.4	Y185 P189	Y185-Y187 VanDerWaalsContact C-N 3.26Å; Y185-Y187 PolarHBondContact O-N 3.19Å; Y187-P189 WeakPolarHBondContact O-CD 3.49Å
188	P	41.7	Very low	41.6	Very low	105 Å²	105	133.1 Å²	133.1	68%	0.682	80%	0.803	S	S	*	*			trans	-70.2	125.1	-178.6	27.6	-33.4	0	0	0	110.4	V190	P188-V190 PolarHBondContact O-N 3.11Å; P188-V190 VanDerWaalsContact O-N 3.11Å
189	P	46.7	Very low	40.8	Very low	127 Å²	127	134.6 Å²	134.6	83%	0.825	81%	0.808	S	S	*	*			trans	-72	108.4	178.5	28.2	-33.1	0	0	0	110.3	Y187 G191	Y187-P189 WeakPolarHBondContact O-CD 3.49Å; P189-G191 PolarHBondContact O-N 3.29Å
190	V	46.1	Very low	40.1	Very low	137 Å²	137	137 Å²	137	83%	0.83	82%	0.818	S	S	*	*			trans	-62.9	118.9	165.5	176.9	0	0	0	0	107.8	P188 V192	P188-V190 PolarHBondContact O-N 3.11Å; P188-V190 VanDerWaalsContact O-N 3.11Å; V190-V192 PolarHBondContact O-N 3.24Å
191	G	51	Low	39.7	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	81%	0.813	S	S	*	*			trans	-69.5	118.3	-166.2	0	0	0	0	0	114	P189	P189-G191 PolarHBondContact O-N 3.29Å
192	V	37.1	Very low	39	Very low	148 Å²	148	130.1 Å²	130.1	90%	0.897	82%	0.815	S	S	*	*			trans	-133.4	128.8	160.2	-178	0	0	0	0	108.2	V190	V190-V192 PolarHBondContact O-N 3.24Å
193	G	36.8	Very low	38.7	Very low	67 Å²	67	132.6 Å²	132.6	69%	0.691	82%	0.824	S	S	*	*			trans	-163.1	130.1	171.1	0	0	0	0	0	111.5
194	M	35.3	Very low	37.9	Very low	180 Å²	180	133.4 Å²	133.4	89%	0.887	82%	0.823	S	S	*	*			trans	-166.4	121.4	154.3	-153.9	73.4	99.3	0	0	111
195	S	31.1	Very low	37.6	Very low	127 Å²	127	136.4 Å²	136.4	89%	0.888	83%	0.827	S	S	*	*			trans	162.9	130.8	139.7	-77	0	0	0	0	110.8
196	G	29.6	Very low	36.7	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	82%	0.819	S	S	*	*			cis	161.4	122.8	-10.7	0	0	0	0	0	113.6
197	T	31.4	Very low	36.1	Very low	151 Å²	151	139.5 Å²	139.5	93%	0.926	82%	0.822	S	S	*	*			trans	-139.9	131.9	159.5	41.4	0	0	0	0	107.9
198	G	31.5	Very low	35.8	Very low	83 Å²	83	137 Å²	137	86%	0.856	82%	0.817	S	S	*	*			trans	-100.4	148.8	-158.3	0	0	0	0	0	115.9
199	A	29.3	Very low	35.4	Very low	99 Å²	99	137.2 Å²	137.2	82%	0.818	82%	0.819	S	S	*	*			trans	-143.2	111.4	164.2	0	0	0	0	0	111.6
200	R	30.6	Very low	34.9	Very low	246 Å²	246	136.9 Å²	136.9	93%	0.928	82%	0.815	S	S	*	*			trans	43.3	118.1	160.3	-64.5	-177.8	-175.9	148.6	5	120.1	T202	R200-T202 PolarHBondContact O-N 3.49Å
201	T	37.5	Very low	34.6	Very low	138 Å²	138	138.5 Å²	138.5	85%	0.847	82%	0.817	S	S	*	*			trans	-54.9	123.2	159.9	-46.8	0	0	0	0	113.4
202	T	34.7	Very low	33.8	Very low	136 Å²	136	144 Å²	144	83%	0.834	82%	0.823	S	S	*	*			trans	-136.4	117.5	145.9	31.4	0	0	0	0	108.7	R200	R200-T202 PolarHBondContact O-N 3.49Å
203	S	40.4	Very low	33.5	Very low	110 Å²	110	145.8 Å²	145.8	77%	0.769	82%	0.824	S	S	*	*			trans	-79.8	121.3	177.2	-178.3	0	0	0	0	110.4
204	Q	33.2	Very low	33.2	Very low	187 Å²	187	146.3 Å²	146.3	87%	0.874	83%	0.829	S	S	*	*			trans	-139.5	135.7	153.7	-76.8	-154.7	0.2	0	0	111	Y206	Q204-Y206 PolarHBondContact O-N 3.15Å
205	T	34.4	Very low	32.9	Very low	138 Å²	138	142.3 Å²	142.3	85%	0.847	83%	0.825	S	S	*	*			trans	-65.8	126.3	-177.8	-50.2	0	0	0	0	111.6	R207	T205-R207 PolarHBondContact O-N 3.45Å; T205-R207 VanDerWaalsContact O-N 3.15Å
206	Y	25.6	Very low	32.9	Very low	170 Å²	170	142.5 Å²	142.5	67%	0.667	82%	0.82	S	S	*	*			trans	-67.7	109.1	173.8	-177.4	-99.6	0	0	0	111	Q204 H208	Q204-Y206 PolarHBondContact O-N 3.15Å; Y206-H208 AromaticContact CD1-CD2 3.74Å; Y206-H208 AromaticContact CD1-NE2 3.92Å; Y206-H208 HydrophobicContact CE1-CB 4.41Å; Y206-H208 AromaticContact CE1-CD2 3.61Å; Y206-H208 AromaticContact CE1-CE1 3.81Å; Y206-H208 AromaticContact CE1-CG 3.69Å; Y206-H208 AromaticContact CE1-ND1 3.82Å; Y206-H208 AromaticContact CE1-NE2 3.68Å
207	R	33.3	Very low	32.9	Very low	228 Å²	228	146.1 Å²	146.1	86%	0.86	82%	0.822	S	S	*	*			trans	-79.3	120.4	160.9	-91.4	-174	171.7	176.5	-2.2	108.7	T205 P209	T205-R207 PolarHBondContact O-N 3.45Å; T205-R207 VanDerWaalsContact O-N 3.15Å; R207-P209 WeakPolarHBondContact O-CD 3.44Å
208	H	35.4	Very low	32.7	Very low	150 Å²	150	144.2 Å²	144.2	69%	0.694	81%	0.81	S	S	*	*			trans	-63.3	137.6	161.1	-77.8	-100.6	0	0	0	110.4	Y206	Y206-H208 AromaticContact CD1-CD2 3.74Å; Y206-H208 AromaticContact CD1-NE2 3.92Å; Y206-H208 HydrophobicContact CE1-CB 4.41Å; Y206-H208 AromaticContact CE1-CD2 3.61Å; Y206-H208 AromaticContact CE1-CE1 3.81Å; Y206-H208 AromaticContact CE1-CG 3.69Å; Y206-H208 AromaticContact CE1-ND1 3.82Å; Y206-H208 AromaticContact CE1-NE2 3.68Å
209	P	33.4	Very low	32.5	Very low	111 Å²	111	144.6 Å²	144.6	72%	0.721	81%	0.805	S	S	*	*			trans	-117.1	88.5	161.9	34.7	-20.4	0	0	0	110.3	R207	R207-P209 WeakPolarHBondContact O-CD 3.44Å
210	T	34.7	Very low	32.5	Very low	120 Å²	120	145.3 Å²	145.3	74%	0.736	81%	0.805	S	S	*	*			trans	-121.9	147.9	154.6	45.8	0	0	0	0	108.5
211	L	40.6	Very low	32.3	Very low	170 Å²	170	145.6 Å²	145.6	89%	0.89	81%	0.806	S	S	*	*			trans	55.7	89.2	-179.9	-66.1	167.6	0	0	0	115.9
212	Q	33	Very low	31.7	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	80%	0.799	S	S	*	*				-137.1	115.7	129	-153.1	170.7	3.1	0	0	110.7
213	M	31.4	Very low	31.3	Very low	187 Å²	187	146.1 Å²	146.1	92%	0.921	80%	0.797	S	S	*	*			trans	-89.4	133.8	175.8	-178.5	162.1	177.2	0	0	109.2
214	G	31.2	Very low	30.7	Very low	78 Å²	78	146.8 Å²	146.8	80%	0.804	80%	0.797	S	S	*	*			trans	68	88.3	165.8	0	0	0	0	0	116.5
215	A	28.5	Very low	30.4	Very low	96 Å²	96	145.9 Å²	145.9	79%	0.793	80%	0.795	S	S	*	*			trans	-136.5	120.6	155.2	0	0	0	0	0	109.6
216	V	31.3	Very low	30	Very low	130 Å²	130	144.9 Å²	144.9	79%	0.788	79%	0.788	S	S	*	*			trans	-68.4	138.8	174.2	172.4	0	0	0	0	109.3
217	N	29.2	Very low	30	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	80%	0.797	S	S	*	*			trans	-150.3	103.7	145.4	-111.2	-41.2	0	0	0	113.9
218	T	28.2	Very low	29.7	Very low	111 Å²	111	141.4 Å²	141.4	68%	0.681	79%	0.789	S	S	*	*				36.2	122.4	118.7	-28.7	0	0	0	0	118.6
219	A	27.3	Very low	29.2	Very low	91 Å²	91	141 Å²	141	75%	0.752	80%	0.797	S	S	*	*			trans	-40.7	137	172.3	0	0	0	0	0	116.1
220	S	27.9	Very low	28.8	Very low	115 Å²	115	140.6 Å²	140.6	80%	0.804	80%	0.797	S	S	*	*				175	131.1	100.4	44.7	0	0	0	0	112.7
221	R	26.8	Very low	28.3	Very low	252 Å²	252	140.4 Å²	140.4	95%	0.951	80%	0.796	S	S	*	*			trans	-150.4	106.2	154.6	-164.7	170	-171.6	160.4	4.2	110.4
222	T	24.3	Very low	27.6	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	79%	0.788	S	S	*	*			trans	-80.9	162.7	-179.7	-19.1	0	0	0	0	111.7
223	Q	28	Very low	27.2	Very low	169 Å²	169	136.5 Å²	136.5	79%	0.79	79%	0.785	S	S	*	*			trans	74.2	109.8	164.3	-66.8	167.2	-22	0	0	116.1
224	T	27.3	Very low	26.9	Very low	123 Å²	123	132.6 Å²	132.6	76%	0.755	78%	0.776	S	S	*	*				56.7	122.8	84.8	54.1	0	0	0	0	114.1
225	M	25.6	Very low	26.7	Very low	169 Å²	169	134.2 Å²	134.2	83%	0.833	77%	0.774	S	S	*	*			cis	74.4	126.7	22	-151.6	-143.9	-116.7	0	0	116
226	V	27.6	Very low	26.6	Very low	117 Å²	117	134 Å²	134	71%	0.709	77%	0.773	S	S	*	*			trans	70.4	144.3	175.5	-161.2	0	0	0	0	112.4
227	R	25.7	Very low	26.3	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	78%	0.78	S	S	*	*			cis	-142	174.2	23.6	-146.1	151.4	-173.3	133.4	1	108.7
228	S	25.7	Very low	26.2	Very low	100 Å²	100	134 Å²	134	70%	0.699	78%	0.781	S	S	*	*			cis	-155.1	165	28.4	-54.2	0	0	0	0	109.3
229	T	25.6	Very low	26.2	Very low	141 Å²	141	133.5 Å²	133.5	87%	0.865	79%	0.788	S	S	*	*				-142.1	170.9	55.3	34	0	0	0	0	115.1
230	S	25.4	Very low	27.2	Very low	102 Å²	102	135.6 Å²	135.6	71%	0.713	79%	0.794	S	S	*	*			trans	-84.6	178.9	177.1	59.4	0	0	0	0	111.9
231	T	24.5	Very low	27.2	Very low	116 Å²	116	133.9 Å²	133.9	71%	0.712	79%	0.794	S	S	*	*			cis	-156.6	172.7	21.7	-23.2	0	0	0	0	107.2
232	S	25.7	Very low	27.4	Very low	103 Å²	103	126.6 Å²	126.6	72%	0.72	79%	0.788	S	S	*	*			cis	-154.7	-172.8	21.6	-50.4	0	0	0	0	112
233	E	24.2	Very low	28.5	Very low	176 Å²	176	127.4 Å²	127.4	82%	0.822	80%	0.795	S	S	*	*			trans	-73.8	170.6	164.5	-56	122.3	105.1	0	0	112.3
234	S	25.8	Very low	28.4	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	80%	0.797	S	S	*	*			cis	-163.5	163.3	30.2	56.6	0	0	0	0	116
235	S	25.7	Very low	28.7	Very low	111 Å²	111	122 Å²	122	78%	0.776	80%	0.8	S	S	*	*			trans	56.8	120.3	147.9	-59.5	0	0	0	0	124.1
236	A	26.9	Very low	29.4	Very low	93 Å²	93	120.7 Å²	120.7	77%	0.769	80%	0.804	S	S	*	*				42.9	149.1	128.1	0	0	0	0	0	121.9
237	Q	25.6	Very low	29.5	Very low	200 Å²	200	118.4 Å²	118.4	94%	0.935	80%	0.804	S	S	*	*			cis	-167.2	157	5.9	-123.2	168.8	3.3	0	0	109
238	G	25.6	Very low	29.7	Very low	80 Å²	80	112.4 Å²	112.4	83%	0.825	80%	0.802	S	S	*	*			trans	150.9	144.7	163.4	0	0	0	0	0	118.4
239	A	28.9	Very low	29.8	Very low	99 Å²	99	117.9 Å²	117.9	82%	0.818	81%	0.814	S	S	*	*			trans	-165.2	-173.5	174	0	0	0	0	0	108.4
240	P	48.5	Very low	30.1	Very low	135 Å²	135	120.6 Å²	120.6	88%	0.877	81%	0.814	S	S	*	*			cis	-132.1	-171.6	-12.3	41.6	-24.2	0	0	0	113.9
241	G	27.1	Very low	30.9	Very low	79 Å²	79	120.8 Å²	120.8	81%	0.814	81%	0.812	S	S	*	*			trans	171.5	144.7	165.7	0	0	0	0	0	116.3
242	A	30.8	Very low	31.3	Very low	99 Å²	99	121.6 Å²	121.6	82%	0.818	82%	0.817	S	S	*	*			trans	-164.8	-167.3	179.8	0	0	0	0	0	109.9
243	P	47.7	Very low	31.7	Very low	133 Å²	133	120.9 Å²	120.9	86%	0.864	82%	0.817	S	S	*	*			cis	-130.5	-169.8	-24.8	39.8	-22.6	0	0	0	113.2
244	G	27.2	Very low	32.3	Very low	80 Å²	80	117.6 Å²	117.6	83%	0.825	82%	0.82	S	S	*	*			trans	176.9	133.7	161.9	0	0	0	0	0	117.7
245	A	32.1	Very low	32.7	Very low	99 Å²	99	116.2 Å²	116.2	82%	0.818	82%	0.823	S	S	*	*			trans	-163.5	141.3	170.8	0	0	0	0	0	111.2
246	P	40.3	Very low	33.3	Very low	141 Å²	141	120.8 Å²	120.8	92%	0.916	82%	0.824	S	S	*	*				-151.5	-176.3	102.9	38.3	-19.5	0	0	0	113.9
247	G	29.6	Very low	33.6	Very low	70 Å²	70	123.6 Å²	123.6	72%	0.722	83%	0.826	S	S	*	*			cis	160.2	88	-12.9	0	0	0	0	0	116.7
248	A	31.6	Very low	34.1	Very low	98 Å²	98	120.8 Å²	120.8	81%	0.81	82%	0.816	S	S	*	*			trans	64.6	132.2	156.5	0	0	0	0	0	123.4
249	K	28	Very low	35	Very low	215 Å²	215	123.5 Å²	123.5	94%	0.935	82%	0.817	S	S	*	*				-175.7	167.4	119.9	-98.8	166	-173.1	179.3	0	114.3
250	K	31.7	Very low	35.4	Very low	199 Å²	199	122.2 Å²	122.2	87%	0.865	81%	0.814	S	S	*	*			trans	-112.7	178.8	-175.6	-121.6	-179.4	-177.5	179.2	0	109.7
251	P	41.6	Very low	34.8	Very low	105 Å²	105	126.8 Å²	126.8	68%	0.682	82%	0.815	S	S	*	*			cis	-155.3	177.5	45.9	42.1	-19.4	0	0	0	120.3
252	T	33.1	Very low	35.4	Very low	134 Å²	134	133.5 Å²	133.5	82%	0.822	84%	0.84	S	S	*	*			trans	62.1	159.2	155.4	37.1	0	0	0	0	119.7
253	A	34	Very low	35.6	Very low	87 Å²	87	135.3 Å²	135.3	72%	0.719	84%	0.841	S	S	*	*			cis	-132.7	139	4.7	0	0	0	0	0	110.1
254	A	37.1	Very low	35	Very low	107 Å²	107	135.4 Å²	135.4	88%	0.884	84%	0.84	S	S	*	*				71.6	119.7	87.8	0	0	0	0	0	115
255	G	32.8	Very low	35.4	Very low	76 Å²	76	138.4 Å²	138.4	78%	0.784	84%	0.841	S	S	*	*			trans	-137	161.4	166.5	0	0	0	0	0	109.4
256	Y	40	Very low	35.6	Very low	207 Å²	207	140.8 Å²	140.8	81%	0.812	84%	0.842	S	S	*	*			trans	-147.5	143.3	177.5	61.9	-86.3	0	0	0	111	I258	Y256-I258 HydrophobicContact CD2-CG1 4.07Å; Y256-I258 HydrophobicContact CE2-CD1 3.98Å; Y256-I258 HydrophobicContact CE2-CG1 3.89Å
257	D	32.3	Very low	35.3	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	84%	0.837	S	S	*	*			trans	-78	152.1	170.5	-95.5	-63.8	0	0	0	111
258	I	37.1	Very low	35.7	Very low	141 Å²	141	145.5 Å²	145.5	72%	0.723	85%	0.845	S	S	*	*			trans	-120	95.8	164.6	-58.1	179.2	0	0	0	108.2	Y256	Y256-I258 HydrophobicContact CD2-CG1 4.07Å; Y256-I258 HydrophobicContact CE2-CD1 3.98Å; Y256-I258 HydrophobicContact CE2-CG1 3.89Å
259	T	43.3	Very low	36	Very low	137 Å²	137	148.9 Å²	148.9	84%	0.84	85%	0.848	S	S	*	*			trans	-130.9	121.5	155.6	48.5	0	0	0	0	108.3
260	G	36.9	Very low	36.6	Very low	72 Å²	72	143.8 Å²	143.8	74%	0.742	84%	0.841	S	S	*	*			trans	-166.9	117.7	-176.9	0	0	0	0	0	109
261	Y	37.3	Very low	37	Very low	231 Å²	231	139.2 Å²	139.2	91%	0.906	84%	0.839	S	S	*	*			trans	-99.8	164.4	173.4	-88.7	-101.3	0	0	0	109.7
262	V	38.5	Very low	36.6	Very low	221 Å²	221	142.3 Å²	142.3	100%	1.339	85%	0.853	S	S	*	*			trans	82.3	0	-176	-169.1	0	0	0	0	113.1

Retrieved 262 of 262 residues in 48.6 ms (Link to these results)

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