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General transcription factor IIH subunit 3

Component of the general transcription and DNA repair factor IIH (TFIIH) core complex, which is involved in general and transcription-coupled nucleotide excision repair (NER) of damaged DNA and, when complexed to CAK, in RNA transcription by RNA polymerase II. In NER, TFIIH acts by opening DNA around the lesion to allow the excision of the damaged oligonucleotide and its replacement by a new DNA fragment. In transcription, TFIIH has an essential role in transcription initiation. When the pre-initiation complex (PIC) has been established, TFIIH is required for promoter opening and promoter escape. Phosphorylation of the C-terminal tail (CTD) of the largest subunit of RNA polymerase II by the kinase module CAK controls the initiation of transcription.

AlphaFold DB , UniProt , Accession A0A5K4F918, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 273 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	48.5	Very low	74.3	Confident	180 Å²	180	83.1 Å²	83.1	89%	0.887	44%	0.439	S	S	*	.				0	100.5	0	-75.9	-163.5	166.4	0	0	110.5	S3 N6 N24	M1-S3 PolarHBondContact O-N 3.3Å; M1-N6 PolarHBondContact O-ND2 3.26Å; M1-N24 PolarHBondContact N-O 2.9Å
2	L	54.7	Low	75.7	Confident	76 Å²	76	76.9 Å²	76.9	40%	0.398	41%	0.41	S	S	.	.			trans	-70.1	77.8	160	-105.6	88.3	0	0	0	108.6	P23 D25	L2-P23 HydrophobicContact CD1-CB 4.2Å; L2-P23 HydrophobicContact CD1-CG 4Å; L2-P23 HydrophobicContact CG-CB 4.18Å; L2-P23 HydrophobicContact CG-CG 3.77Å; L2-D25 WeakPolarHBondContact CD1-OD1 3.4Å
3	S	64.3	Low	76.8	Confident	40 Å²	40	73.9 Å²	73.9	28%	0.28	40%	0.396	S	S	.	.			trans	-70.5	131.8	168.9	-179.4	0	0	0	0	108	M1 H5 N6	M1-S3 PolarHBondContact O-N 3.3Å; S3-H5 PolarHBondContact O-N 3.32Å; S3-H5 VanDerWaalsContact O-N 3.08Å; S3-H5 WeakPolarHBondContact OG-CB 3.2Å; S3-H5 PolarHBondContact OG-CD2 3.43Å; S3-H5 PolarHBondContact OG-N 3.18Å; S3-N6 PolarHBondContact O-N 2.56Å; S3-N6 VanDerWaalsContact O-N 3.14Å
4	P	61.1	Low	77.5	Confident	55 Å²	55	69.4 Å²	69.4	36%	0.357	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.3	171.4	27.7	-35.3	0	0	0	111	N6 R82 E85	P4-N6 VanDerWaalsContact C-N 3.34Å; P4-R82 WeakPolarHBondContact O-CD 3.08Å; P4-R82 PolarHBondContact O-NE 3.18Å; P4-R82 PolarHBondContact O-NH1 2.88Å; P4-E85 WeakPolarHBondContact CA-OE2 3.48Å; P4-E85 WeakPolarHBondContact CB-OE2 3.49Å
5	H	68.3	Low	77.8	Confident	129 Å²	129	67.3 Å²	67.3	60%	0.597	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.5	-179.7	-57.3	-72.4	0	0	0	114.7	S3 E7 R82	S3-H5 PolarHBondContact O-N 3.32Å; S3-H5 VanDerWaalsContact O-N 3.08Å; S3-H5 WeakPolarHBondContact OG-CB 3.2Å; S3-H5 PolarHBondContact OG-CD2 3.43Å; S3-H5 PolarHBondContact OG-N 3.18Å; H5-E7 PolarHBondContact O-N 3.22Å; H5-R82 PolarHBondContact O-NH2 3.45Å
6	N	76.3	Confident	78	Confident	38 Å²	38	66.9 Å²	66.9	20%	0.203	37%	0.368	C	S	.	.			trans	-66.3	120	179.4	-72	-16.7	0	0	0	110.3	M1 S3 P4 P23 Y78 R82	M1-N6 PolarHBondContact O-ND2 3.26Å; S3-N6 PolarHBondContact O-N 2.56Å; S3-N6 VanDerWaalsContact O-N 3.14Å; P4-N6 VanDerWaalsContact C-N 3.34Å; N6-P23 WeakPolarHBondContact ND2-CB 3.24Å; N6-Y78 WeakPolarHBondContact CB-OH 3.37Å; N6-Y78 PolarHBondContact O-OH 3Å; N6-Y78 VanDerWaalsContact O-OH 3.08Å; N6-R82 PolarHBondContact O-NE 3.09Å
7	E	82.6	Confident	78.4	Confident	174 Å²	174	70.5 Å²	70.5	81%	0.813	38%	0.379	S	S	*	.			trans	-88.2	-21.1	-179.7	-59.7	-175.6	163.7	0	0	112.5	H5	H5-E7 PolarHBondContact O-N 3.22Å
8	L	87.7	Confident	79	Confident	104 Å²	104	69.2 Å²	69.2	55%	0.545	37%	0.372	S	S	.	.			trans	-107.8	133.4	-179.8	-179	64	0	0	0	109.9	V10 H22	L8-V10 HydrophobicContact CD2-CG2 4.23Å; L8-V10 HydrophobicContact CG-CG2 4.17Å; L8-H22 PolarHBondContact O-CD2 3.47Å
9	A	89.9	Confident	79.5	Confident	33 Å²	33	70.6 Å²	70.6	27%	0.273	37%	0.374	S	S	.	.			trans	-122.3	134.4	164.2	0	0	0	0	0	109.2	F20 H22 Y78	A9-F20 HydrophobicContact CB-CD1 4.48Å; A9-F20 HydrophobicContact CB-CE1 4.27Å; A9-H22 CarbonylContact C-O 3.47Å; A9-H22 WeakPolarHBondContact CA-O 3.16Å; A9-Y78 HydrophobicContact CB-CD1 3.75Å; A9-Y78 HydrophobicContact CB-CE1 3.68Å; A9-Y78 HydrophobicContact CB-CE2 4.49Å; A9-Y78 HydrophobicContact CB-CG 4.19Å
10	V	91.6	Very high	80	Confident	46 Å²	46	70.3 Å²	70.3	28%	0.279	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.2	176.2	-176	0	0	0	0	107.6	L8 I21 H22	L8-V10 HydrophobicContact CD2-CG2 4.23Å; L8-V10 HydrophobicContact CG-CG2 4.17Å; V10-I21 HydrophobicContact CB-CB 4.25Å; V10-I21 HydrophobicContact CG1-CB 4.05Å; V10-I21 HydrophobicContact CG1-CD1 4.27Å; V10-I21 HydrophobicContact CG1-CG2 4.37Å; V10-I21 WeakPolarHBondContact O-CA 3.4Å; V10-I21 PolarHBondContact O-N 3.22Å; V10-H22 HydrophobicContact CB-CB 4Å; V10-H22 HydrophobicContact CG2-CB 4.07Å; V10-H22 PolarHBondContact N-O 3.02Å; V10-H22 PolarHBondContact O-N 2.86Å; V10-H22 VanDerWaalsContact O-N 3.09Å
11	I	92.4	Very high	80.4	Confident	39 Å²	39	67.6 Å²	67.6	20%	0.2	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.6	-179.6	-57	175.5	0	0	0	108.2	V13 I18 F20 A71 K74 A75	I11-V13 HydrophobicContact CG2-CG2 4.19Å; I11-I18 HydrophobicContact CG2-CG2 3.6Å; I11-F20 HydrophobicContact CD1-CD1 4.22Å; I11-F20 HydrophobicContact CD1-CE1 3.6Å; I11-F20 HydrophobicContact CD1-CZ 3.92Å; I11-F20 HydrophobicContact CG1-CD1 3.65Å; I11-F20 HydrophobicContact CG1-CE1 3.55Å; I11-F20 HydrophobicContact CG1-CG 4.4Å; I11-F20 HydrophobicContact CG1-CZ 4.24Å; I11-A71 HydrophobicContact CG2-CB 4.22Å; I11-K74 HydrophobicContact CD1-CB 4.08Å; I11-A75 HydrophobicContact CD1-CB 4.02Å
12	G	91	Very high	82.2	Confident	9 Å²	9	61.2 Å²	61.2	9%	0.093	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.2	169.5	0	0	0	0	0	110.2	K19	G12-K19 PolarHBondContact N-O 3.34Å; G12-K19 PolarHBondContact O-N 2.88Å
13	V	89.6	Confident	83.5	Confident	38 Å²	38	57.9 Å²	57.9	23%	0.23	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.5	-178.6	-164.5	0	0	0	0	108.3	I11 I18 I66 A71	I11-V13 HydrophobicContact CG2-CG2 4.19Å; V13-I18 HydrophobicContact CG1-CG1 4.16Å; V13-I66 HydrophobicContact CB-CG2 4.03Å; V13-I66 HydrophobicContact CG1-CG2 3.25Å; V13-A71 HydrophobicContact CG1-CB 4.4Å; V13-A71 HydrophobicContact CG2-CB 3.42Å; V13-A71 VanDerWaalsContact CG2-CB 3.42Å
14	T	86.9	Confident	84	Confident	11 Å²	11	57.4 Å²	57.4	7%	0.067	30%	0.3	C	S	.	.			trans	-119	165.4	169.8	62.3	0	0	0	0	109.2	S16 K17 L55 C59	T14-S16 PolarHBondContact O-N 2.85Å; T14-S16 VanDerWaalsContact O-N 3.13Å; T14-K17 PolarHBondContact N-O 2.92Å; T14-K17 PolarHBondContact O-N 3.43Å; T14-K17 PolarHBondContact OG1-N 3.16Å; T14-K17 PolarHBondContact OG1-O 3.27Å; T14-K17 VanDerWaalsContact OG1-O 3.09Å; T14-L55 HydrophobicContact CG2-CD1 4.28Å; T14-L55 HydrophobicContact CG2-CD2 4.03Å; T14-L55 HydrophobicContact CG2-CG 3.69Å; T14-C59 HydrophobicContact CG2-CB 4.48Å
15	P	81.6	Confident	84.4	Confident	37 Å²	37	60.7 Å²	60.7	24%	0.24	32%	0.315	C	S	.	.	S	Bend	trans	-52.5	-33.1	175.9	-27.8	33.3	0	0	0	114	S63 Q65 I66	P15-S63 WeakPolarHBondContact CG-O 3.41Å; P15-Q65 VanDerWaalsContact CA-O 3.28Å; P15-Q65 WeakPolarHBondContact CA-O 3.24Å; P15-Q65 VanDerWaalsContact CB-O 3.3Å; P15-Q65 WeakPolarHBondContact CB-O 3.32Å; P15-I66 HydrophobicContact CG-CG1 4.32Å
16	S	80.9	Confident	84.3	Confident	62 Å²	62	59.9 Å²	59.9	43%	0.434	31%	0.314	S	S	.	.	S	Bend	trans	-98.1	-28	-176	58.2	0	0	0	0	114.4	T14	T14-S16 PolarHBondContact O-N 2.85Å; T14-S16 VanDerWaalsContact O-N 3.13Å
17	K	86	Confident	83.7	Confident	127 Å²	127	66.6 Å²	66.6	55%	0.552	35%	0.345	S	S	*	.			trans	-145.7	149.9	-169.8	-63.7	-178.5	-176.2	173.2	0	112.8	T14	T14-K17 PolarHBondContact N-O 2.92Å; T14-K17 PolarHBondContact O-N 3.43Å; T14-K17 PolarHBondContact OG1-N 3.16Å; T14-K17 PolarHBondContact OG1-O 3.27Å; T14-K17 VanDerWaalsContact OG1-O 3.09Å
18	I	88.5	Confident	82.7	Confident	48 Å²	48	62.4 Å²	62.4	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.3	171.9	-53.1	170.3	0	0	0	107.4	I11 V13 A71 K74	I11-I18 HydrophobicContact CG2-CG2 3.6Å; V13-I18 HydrophobicContact CG1-CG1 4.16Å; I18-A71 HydrophobicContact CG2-CB 4.09Å; I18-K74 HydrophobicContact CG2-CD 3.79Å
19	K	89	Confident	81.5	Confident	96 Å²	96	60 Å²	60	42%	0.417	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	138.4	-175	-174	177.1	176.5	-177.6	0	111.4	G12 I21 L55	G12-K19 PolarHBondContact N-O 3.34Å; G12-K19 PolarHBondContact O-N 2.88Å; K19-I21 PolarHBondContact O-N 3.31Å; K19-L55 HydrophobicContact CB-CD1 4.16Å
20	F	88.6	Confident	80	Confident	63 Å²	63	65.3 Å²	65.3	28%	0.276	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	118.1	166.4	-75.3	-85.6	0	0	0	109.2	A9 I11 K74 Y78	A9-F20 HydrophobicContact CB-CD1 4.48Å; A9-F20 HydrophobicContact CB-CE1 4.27Å; I11-F20 HydrophobicContact CD1-CD1 4.22Å; I11-F20 HydrophobicContact CD1-CE1 3.6Å; I11-F20 HydrophobicContact CD1-CZ 3.92Å; I11-F20 HydrophobicContact CG1-CD1 3.65Å; I11-F20 HydrophobicContact CG1-CE1 3.55Å; I11-F20 HydrophobicContact CG1-CG 4.4Å; I11-F20 HydrophobicContact CG1-CZ 4.24Å; F20-K74 HydrophobicContact CE2-CB 4.25Å; F20-K74 HydrophobicContact CE2-CD 4.18Å; F20-K74 HydrophobicContact CE2-CG 4.45Å; F20-K74 HydrophobicContact CZ-CB 4Å; F20-Y78 HydrophobicContact CE1-CD2 4.41Å
21	I	88.3	Confident	78.5	Confident	15 Å²	15	65.4 Å²	65.4	8%	0.077	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-38.4	170.1	-64.8	171.2	0	0	0	109.2	V10 K19 V48 L51 A52	V10-I21 HydrophobicContact CB-CB 4.25Å; V10-I21 HydrophobicContact CG1-CB 4.05Å; V10-I21 HydrophobicContact CG1-CD1 4.27Å; V10-I21 HydrophobicContact CG1-CG2 4.37Å; V10-I21 WeakPolarHBondContact O-CA 3.4Å; V10-I21 PolarHBondContact O-N 3.22Å; K19-I21 PolarHBondContact O-N 3.31Å; I21-V48 HydrophobicContact CG2-CB 4.21Å; I21-V48 HydrophobicContact CG2-CG1 3.91Å; I21-V48 HydrophobicContact CG2-CG2 4.21Å; I21-L51 HydrophobicContact CG2-CB 3.93Å; I21-L51 HydrophobicContact CG2-CD1 4.13Å; I21-L51 WeakPolarHBondContact O-CD1 3.21Å; I21-A52 HydrophobicContact CD1-CB 4.17Å
22	H	86.3	Confident	76.9	Confident	45 Å²	45	67.8 Å²	67.8	21%	0.208	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.4	172.1	-174.6	79.6	0	0	0	109.5	L8 A9 V10	L8-H22 PolarHBondContact O-CD2 3.47Å; A9-H22 CarbonylContact C-O 3.47Å; A9-H22 WeakPolarHBondContact CA-O 3.16Å; V10-H22 HydrophobicContact CB-CB 4Å; V10-H22 HydrophobicContact CG2-CB 4.07Å; V10-H22 PolarHBondContact N-O 3.02Å; V10-H22 PolarHBondContact O-N 2.86Å; V10-H22 VanDerWaalsContact O-N 3.09Å
23	P	82.8	Confident	75.3	Confident	7 Å²	7	70.4 Å²	70.4	5%	0.045	40%	0.397	C	S	.	.	S	Bend	cis	-65.3	150.8	-7.5	29	-35.8	0	0	0	112.6	L2 N6 Y78	L2-P23 HydrophobicContact CD1-CB 4.2Å; L2-P23 HydrophobicContact CD1-CG 4Å; L2-P23 HydrophobicContact CG-CB 4.18Å; L2-P23 HydrophobicContact CG-CG 3.77Å; N6-P23 WeakPolarHBondContact ND2-CB 3.24Å; P23-Y78 HydrophobicContact CG-CE2 4.19Å
24	N	74.6	Confident	74.1	Confident	29 Å²	29	73.5 Å²	73.5	16%	0.155	41%	0.413	C	S	.	.			trans	-122.6	150.4	178.4	-172.2	20.5	0	0	0	110.1	M1 L26 L51	M1-N24 PolarHBondContact N-O 2.9Å; N24-L26 WeakPolarHBondContact ND2-CB 3.36Å; N24-L26 VanDerWaalsContact ND2-CD1 3.26Å; N24-L26 WeakPolarHBondContact ND2-CD1 3.43Å; N24-L26 PolarHBondContact OD1-N 3.14Å; N24-L51 HydrophobicContact CB-CD1 4.31Å; N24-L51 VanDerWaalsContact ND2-CD1 3.3Å; N24-L51 WeakPolarHBondContact ND2-CD1 3.27Å
25	D	68.7	Low	73.4	Confident	124 Å²	124	81.1 Å²	81.1	66%	0.663	45%	0.453	S	S	*	.	S	Bend	trans	-85.4	-22.3	178.8	-65.1	-38.7	0	0	0	112.5	L2	L2-D25 WeakPolarHBondContact CD1-OD1 3.4Å
26	L	67.4	Low	73	Confident	112 Å²	112	83.5 Å²	83.5	59%	0.586	49%	0.485	S	S	*	.	S	Bend	trans	-64	140.6	177.9	-67.5	145.5	0	0	0	111.3	N24 L51	N24-L26 WeakPolarHBondContact ND2-CB 3.36Å; N24-L26 VanDerWaalsContact ND2-CD1 3.26Å; N24-L26 WeakPolarHBondContact ND2-CD1 3.43Å; N24-L26 PolarHBondContact OD1-N 3.14Å; L26-L51 HydrophobicContact CD1-CD2 4.28Å
27	E	63.5	Low	72.6	Confident	179 Å²	179	85.7 Å²	85.7	84%	0.836	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-63	138.2	170.4	-73.3	-174.1	158.9	0	0	110.4
28	P	61.4	Low	72.2	Confident	87 Å²	87	84.3 Å²	84.3	57%	0.565	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-59.4	129.2	176.4	17.7	-25.4	0	0	0	110.1	T30 C43	P28-T30 PolarHBondContact O-N 3.44Å; P28-C43 WeakPolarHBondContact CB-SG 3.44Å
29	P	61.6	Low	71.7	Confident	52 Å²	52	86.6 Å²	86.6	34%	0.338	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-60.4	126.8	169.6	25.2	-31.2	0	0	0	108.8	S31 C43 T47	P29-S31 VanDerWaalsContact C-N 3.28Å; P29-S31 PolarHBondContact O-N 2.97Å; P29-C43 PolarHBondContact O-SG 3.36Å; P29-T47 WeakPolarHBondContact CD-OG1 3.29Å
30	T	59.8	Low	71.2	Confident	145 Å²	145	85.4 Å²	85.4	89%	0.89	51%	0.507	S	S	*	.			trans	-63.9	91.5	168.9	41.7	0	0	0	0	107.9	P28	P28-T30 PolarHBondContact O-N 3.44Å
31	S	58.8	Low	70.9	Confident	48 Å²	48	87.5 Å²	87.5	34%	0.336	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-81.1	140.2	174.3	20.2	0	0	0	0	108.5	P29 S33	P29-S31 VanDerWaalsContact C-N 3.28Å; P29-S31 PolarHBondContact O-N 2.97Å; S31-S33 PolarHBondContact O-N 2.89Å
32	A	59.1	Low	70.5	Confident	89 Å²	89	87.3 Å²	87.3	74%	0.736	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-58	124.8	170.3	0	0	0	0	0	108.7	N34	A32-N34 PolarHBondContact O-N 3.46Å
33	S	57.8	Low	70.3	Confident	64 Å²	64	86.2 Å²	86.2	45%	0.448	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-60	131.4	178.3	-169.1	0	0	0	0	109.6	S31 D39	S31-S33 PolarHBondContact O-N 2.89Å; S33-D39 WeakPolarHBondContact CB-OD1 3.29Å; S33-D39 PolarHBondContact OG-OD1 3.44Å
34	N	64.3	Low	70.2	Confident	103 Å²	103	89.8 Å²	89.8	55%	0.551	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-90.7	124.5	162.5	-70.8	-39.2	0	0	0	106.5	A32 G36 Q37	A32-N34 PolarHBondContact O-N 3.46Å; N34-G36 PolarHBondContact O-N 3.39Å; N34-Q37 PolarHBondContact O-N 2.91Å
35	D	73	Confident	70.7	Confident	171 Å²	171	93 Å²	93	91%	0.914	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.2	129	-179.1	-80.8	-30.2	0	0	0	111.9
36	G	72.2	Confident	71.5	Confident	88 Å²	88	89.6 Å²	89.6	91%	0.907	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	-2.8	177.4	0	0	0	0	0	116	N34	N34-G36 PolarHBondContact O-N 3.39Å
37	Q	72.7	Confident	72.4	Confident	107 Å²	107	85.4 Å²	85.4	50%	0.5	51%	0.513	S	S	.	.	S	Bend	trans	-98.1	147.9	171.5	-64.6	-175.3	2.4	0	0	111.5	N34 D39 S42	N34-Q37 PolarHBondContact O-N 2.91Å; Q37-D39 PolarHBondContact O-N 3.48Å; Q37-S42 PolarHBondContact OE1-OG 3.48Å
38	N	78.6	Confident	73.5	Confident	98 Å²	98	78.8 Å²	78.8	52%	0.524	49%	0.485	S	S	.	.			trans	-70.7	120	168.5	-178.4	-68.2	0	0	0	109.1	A40 L41 S42	N38-A40 VanDerWaalsContact C-N 3.29Å; N38-A40 PolarHBondContact O-N 2.75Å; N38-A40 WeakPolarHBondContact OD1-CB 3.45Å; N38-A40 PolarHBondContact OD1-N 2.9Å; N38-L41 HydrophobicContact CB-CB 4.25Å; N38-L41 HydrophobicContact CB-CD1 4.13Å; N38-L41 HydrophobicContact CB-CG 4.21Å; N38-L41 PolarHBondContact O-N 3.25Å; N38-L41 VanDerWaalsContact O-N 3.16Å; N38-L41 PolarHBondContact OD1-N 2.86Å; N38-S42 PolarHBondContact O-N 2.99Å
39	D	78	Confident	74.8	Confident	97 Å²	97	83.4 Å²	83.4	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-56.6	-40.9	-175.4	-67.1	-30.1	0	0	0	113	S33 Q37 S42 C43	S33-D39 WeakPolarHBondContact CB-OD1 3.29Å; S33-D39 PolarHBondContact OG-OD1 3.44Å; Q37-D39 PolarHBondContact O-N 3.48Å; D39-S42 PolarHBondContact O-N 2.98Å; D39-C43 WeakPolarHBondContact O-CB 3.26Å; D39-C43 PolarHBondContact O-N 3.31Å
40	A	78.8	Confident	76	Confident	70 Å²	70	86.4 Å²	86.4	58%	0.579	50%	0.5	S	S	*	.	H	α-helix	trans	-66.1	-42.3	-179.6	0	0	0	0	0	111.6	N38 M44	N38-A40 VanDerWaalsContact C-N 3.29Å; N38-A40 PolarHBondContact O-N 2.75Å; N38-A40 WeakPolarHBondContact OD1-CB 3.45Å; N38-A40 PolarHBondContact OD1-N 2.9Å; A40-M44 WeakPolarHBondContact O-CB 3.15Å; A40-M44 PolarHBondContact O-N 3.25Å
41	L	81.1	Confident	77.4	Confident	108 Å²	108	80.7 Å²	80.7	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-69.2	-40.6	177.1	-66.8	-179.7	0	0	0	112	N38 M44 N45	N38-L41 HydrophobicContact CB-CB 4.25Å; N38-L41 HydrophobicContact CB-CD1 4.13Å; N38-L41 HydrophobicContact CB-CG 4.21Å; N38-L41 PolarHBondContact O-N 3.25Å; N38-L41 VanDerWaalsContact O-N 3.16Å; N38-L41 PolarHBondContact OD1-N 2.86Å; L41-M44 HydrophobicContact CD2-CE 3.92Å; L41-M44 PolarHBondContact O-N 3.25Å; L41-N45 VanDerWaalsContact O-CB 3.24Å; L41-N45 WeakPolarHBondContact O-CB 3.32Å; L41-N45 PolarHBondContact O-N 2.89Å
42	S	81	Confident	78.8	Confident	11 Å²	11	80 Å²	80	8%	0.077	46%	0.462	C	S	.	.	H	α-helix	trans	-63.5	-46.6	177.2	-172.9	0	0	0	0	111	Q37 N38 D39 M44 N45 N46	Q37-S42 PolarHBondContact OE1-OG 3.48Å; N38-S42 PolarHBondContact O-N 2.99Å; D39-S42 PolarHBondContact O-N 2.98Å; S42-M44 PolarHBondContact O-N 3.21Å; S42-N45 PolarHBondContact O-N 3.46Å; S42-N46 WeakPolarHBondContact O-CB 3.32Å; S42-N46 PolarHBondContact O-N 3.17Å; S42-N46 PolarHBondContact O-ND2 3.04Å; S42-N46 VanDerWaalsContact O-ND2 3.14Å
43	C	81	Confident	80.2	Confident	21 Å²	21	81 Å²	81	14%	0.142	45%	0.454	C	S	.	.	H	α-helix	trans	-60.3	-46.3	176.1	-178.2	0	0	0	0	112.1	P28 P29 D39 N46 T47	P28-C43 WeakPolarHBondContact CB-SG 3.44Å; P29-C43 PolarHBondContact O-SG 3.36Å; D39-C43 WeakPolarHBondContact O-CB 3.26Å; D39-C43 PolarHBondContact O-N 3.31Å; C43-N46 PolarHBondContact O-N 3.46Å; C43-T47 WeakPolarHBondContact O-CB 3.27Å; C43-T47 PolarHBondContact O-N 3.18Å; C43-T47 PolarHBondContact O-OG1 2.84Å
44	M	81.3	Confident	81.7	Confident	83 Å²	83	81 Å²	81	41%	0.409	45%	0.454	S	S	.	.	H	α-helix	trans	-61.6	-46.3	176.3	180	-176.8	72	0	0	111.7	A40 L41 S42 N46 T47 V48	A40-M44 WeakPolarHBondContact O-CB 3.15Å; A40-M44 PolarHBondContact O-N 3.25Å; L41-M44 HydrophobicContact CD2-CE 3.92Å; L41-M44 PolarHBondContact O-N 3.25Å; S42-M44 PolarHBondContact O-N 3.21Å; M44-N46 PolarHBondContact O-N 2.96Å; M44-T47 PolarHBondContact O-N 3.33Å; M44-V48 HydrophobicContact CG-CG2 4.29Å; M44-V48 WeakPolarHBondContact O-CB 3.27Å; M44-V48 VanDerWaalsContact O-CG2 3.29Å; M44-V48 WeakPolarHBondContact O-CG2 3.15Å; M44-V48 PolarHBondContact O-N 2.95Å
45	N	85.2	Confident	82.7	Confident	97 Å²	97	76.7 Å²	76.7	52%	0.519	43%	0.431	S	S	.	.	H	α-helix	trans	-59.3	-46.3	178	-179.2	43.9	0	0	0	111.4	L41 S42 T47 V48 R49	L41-N45 VanDerWaalsContact O-CB 3.24Å; L41-N45 WeakPolarHBondContact O-CB 3.32Å; L41-N45 PolarHBondContact O-N 2.89Å; S42-N45 PolarHBondContact O-N 3.46Å; N45-T47 PolarHBondContact O-N 3.32Å; N45-V48 PolarHBondContact O-N 3.42Å; N45-R49 WeakPolarHBondContact O-CB 3.26Å; N45-R49 PolarHBondContact O-N 2.88Å
46	N	85.2	Confident	83.3	Confident	52 Å²	52	73.2 Å²	73.2	28%	0.278	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-43.3	176.8	-70.4	-29.3	0	0	0	111.6	S42 C43 M44 R49 Q50	S42-N46 WeakPolarHBondContact O-CB 3.32Å; S42-N46 PolarHBondContact O-N 3.17Å; S42-N46 PolarHBondContact O-ND2 3.04Å; S42-N46 VanDerWaalsContact O-ND2 3.14Å; C43-N46 PolarHBondContact O-N 3.46Å; M44-N46 PolarHBondContact O-N 2.96Å; N46-R49 PolarHBondContact O-N 3.45Å; N46-Q50 WeakPolarHBondContact O-CB 3.23Å; N46-Q50 VanDerWaalsContact O-CG 3.24Å; N46-Q50 WeakPolarHBondContact O-CG 3.45Å; N46-Q50 PolarHBondContact O-N 2.84Å
47	T	85.2	Confident	84	Confident	24 Å²	24	73.7 Å²	73.7	15%	0.147	40%	0.401	C	S	.	.	H	α-helix	trans	-63.5	-50.1	178.3	-55.4	0	0	0	0	111.6	P29 C43 M44 N45 R49 Q50 L51	P29-T47 WeakPolarHBondContact CD-OG1 3.29Å; C43-T47 WeakPolarHBondContact O-CB 3.27Å; C43-T47 PolarHBondContact O-N 3.18Å; C43-T47 PolarHBondContact O-OG1 2.84Å; M44-T47 PolarHBondContact O-N 3.33Å; N45-T47 PolarHBondContact O-N 3.32Å; T47-R49 VanDerWaalsContact C-N 3.32Å; T47-R49 PolarHBondContact O-N 2.79Å; T47-Q50 PolarHBondContact O-N 3.48Å; T47-L51 HydrophobicContact CG2-CD1 3.92Å; T47-L51 HydrophobicContact CG2-CG 4.47Å; T47-L51 WeakPolarHBondContact O-CB 3.42Å; T47-L51 VanDerWaalsContact O-CG 3.27Å; T47-L51 WeakPolarHBondContact O-CG 3.39Å; T47-L51 PolarHBondContact O-N 3.05Å
48	V	87.6	Confident	84.5	Confident	40 Å²	40	71.4 Å²	71.4	24%	0.242	40%	0.397	C	S	.	.	H	α-helix	trans	-60.1	-44.3	178.3	170.4	0	0	0	0	110.3	I21 M44 N45 L51 A52	I21-V48 HydrophobicContact CG2-CB 4.21Å; I21-V48 HydrophobicContact CG2-CG1 3.91Å; I21-V48 HydrophobicContact CG2-CG2 4.21Å; M44-V48 HydrophobicContact CG-CG2 4.29Å; M44-V48 WeakPolarHBondContact O-CB 3.27Å; M44-V48 VanDerWaalsContact O-CG2 3.29Å; M44-V48 WeakPolarHBondContact O-CG2 3.15Å; M44-V48 PolarHBondContact O-N 2.95Å; N45-V48 PolarHBondContact O-N 3.42Å; V48-L51 PolarHBondContact O-N 3.43Å; V48-A52 VanDerWaalsContact O-CB 3.23Å; V48-A52 WeakPolarHBondContact O-CB 3.3Å; V48-A52 PolarHBondContact O-N 3.48Å
49	R	88.3	Confident	84.4	Confident	183 Å²	183	68 Å²	68	69%	0.691	38%	0.381	S	S	*	.	H	α-helix	trans	-62.4	-46	177.6	-174.7	-178.2	-179.4	99.3	0.1	112.2	N45 N46 T47 A52 L53	N45-R49 WeakPolarHBondContact O-CB 3.26Å; N45-R49 PolarHBondContact O-N 2.88Å; N46-R49 PolarHBondContact O-N 3.45Å; T47-R49 VanDerWaalsContact C-N 3.32Å; T47-R49 PolarHBondContact O-N 2.79Å; R49-A52 PolarHBondContact O-N 3.12Å; R49-L53 VanDerWaalsContact O-CB 3.32Å; R49-L53 WeakPolarHBondContact O-CB 3.41Å; R49-L53 PolarHBondContact O-N 3Å
50	Q	87.9	Confident	83.9	Confident	115 Å²	115	69 Å²	69	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-43.2	178.8	-76.7	175.3	-3.8	0	0	111.9	N46 T47 L53 S54	N46-Q50 WeakPolarHBondContact O-CB 3.23Å; N46-Q50 VanDerWaalsContact O-CG 3.24Å; N46-Q50 WeakPolarHBondContact O-CG 3.45Å; N46-Q50 PolarHBondContact O-N 2.84Å; T47-Q50 PolarHBondContact O-N 3.48Å; Q50-L53 PolarHBondContact O-N 2.96Å; Q50-S54 VanDerWaalsContact O-CB 3.29Å; Q50-S54 WeakPolarHBondContact O-CB 3.27Å; Q50-S54 PolarHBondContact O-N 2.84Å
51	L	87.7	Confident	83.3	Confident	25 Å²	25	68.7 Å²	68.7	13%	0.131	39%	0.389	C	S	.	.	H	α-helix	trans	-68.7	-39.8	177.9	-69.2	172.3	0	0	0	112.4	I21 N24 L26 T47 V48 S54 L55	I21-L51 HydrophobicContact CG2-CB 3.93Å; I21-L51 HydrophobicContact CG2-CD1 4.13Å; I21-L51 WeakPolarHBondContact O-CD1 3.21Å; N24-L51 HydrophobicContact CB-CD1 4.31Å; N24-L51 VanDerWaalsContact ND2-CD1 3.3Å; N24-L51 WeakPolarHBondContact ND2-CD1 3.27Å; L26-L51 HydrophobicContact CD1-CD2 4.28Å; T47-L51 HydrophobicContact CG2-CD1 3.92Å; T47-L51 HydrophobicContact CG2-CG 4.47Å; T47-L51 WeakPolarHBondContact O-CB 3.42Å; T47-L51 VanDerWaalsContact O-CG 3.27Å; T47-L51 WeakPolarHBondContact O-CG 3.39Å; T47-L51 PolarHBondContact O-N 3.05Å; V48-L51 PolarHBondContact O-N 3.43Å; L51-S54 PolarHBondContact O-N 3.1Å; L51-L55 WeakPolarHBondContact O-CB 3.35Å; L51-L55 PolarHBondContact O-N 3.01Å
52	A	88.5	Confident	82.4	Confident	35 Å²	35	70.4 Å²	70.4	29%	0.289	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-46.7	173.9	0	0	0	0	0	110.7	I21 V48 R49 L55 V56	I21-A52 HydrophobicContact CD1-CB 4.17Å; V48-A52 VanDerWaalsContact O-CB 3.23Å; V48-A52 WeakPolarHBondContact O-CB 3.3Å; V48-A52 PolarHBondContact O-N 3.48Å; R49-A52 PolarHBondContact O-N 3.12Å; A52-L55 PolarHBondContact O-N 3.44Å; A52-V56 WeakPolarHBondContact O-CG2 3.42Å; A52-V56 PolarHBondContact O-N 3.21Å
53	L	88.9	Confident	81.6	Confident	109 Å²	109	72.5 Å²	72.5	57%	0.571	42%	0.419	S	S	*	.	H	α-helix	trans	-60.2	-48.5	176	-178.4	62.1	0	0	0	111.2	R49 Q50 L55 V56 T57	R49-L53 VanDerWaalsContact O-CB 3.32Å; R49-L53 WeakPolarHBondContact O-CB 3.41Å; R49-L53 PolarHBondContact O-N 3Å; Q50-L53 PolarHBondContact O-N 2.96Å; L53-L55 VanDerWaalsContact C-N 3.28Å; L53-L55 PolarHBondContact O-N 3.49Å; L53-V56 PolarHBondContact O-N 3.17Å; L53-T57 HydrophobicContact CD1-CG2 3.97Å; L53-T57 HydrophobicContact CG-CG2 4.27Å; L53-T57 WeakPolarHBondContact O-CG2 3.33Å; L53-T57 PolarHBondContact O-N 3.22Å; L53-T57 PolarHBondContact O-OG1 3.37Å; L53-T57 VanDerWaalsContact O-OG1 3.05Å
54	S	88.7	Confident	80.7	Confident	63 Å²	63	75.1 Å²	75.1	44%	0.441	43%	0.434	S	S	.	.	H	α-helix	trans	-56.6	-42.5	177	176.8	0	0	0	0	112.1	Q50 L51 T57 S58	Q50-S54 VanDerWaalsContact O-CB 3.29Å; Q50-S54 WeakPolarHBondContact O-CB 3.27Å; Q50-S54 PolarHBondContact O-N 2.84Å; L51-S54 PolarHBondContact O-N 3.1Å; S54-T57 WeakPolarHBondContact CA-OG1 3.21Å; S54-T57 PolarHBondContact O-OG1 3.21Å; S54-T57 VanDerWaalsContact O-OG1 3.12Å; S54-S58 WeakPolarHBondContact O-CB 3.47Å; S54-S58 PolarHBondContact O-N 3.08Å; S54-S58 PolarHBondContact O-OG 3.09Å
55	L	86.1	Confident	80.1	Confident	14 Å²	14	76 Å²	76	7%	0.073	44%	0.437	C	S	.	.	H	α-helix	trans	-64.4	-44.5	178.5	-175.8	67.6	0	0	0	111.4	T14 K19 L51 A52 L53 S58	T14-L55 HydrophobicContact CG2-CD1 4.28Å; T14-L55 HydrophobicContact CG2-CD2 4.03Å; T14-L55 HydrophobicContact CG2-CG 3.69Å; K19-L55 HydrophobicContact CB-CD1 4.16Å; L51-L55 WeakPolarHBondContact O-CB 3.35Å; L51-L55 PolarHBondContact O-N 3.01Å; A52-L55 PolarHBondContact O-N 3.44Å; L53-L55 VanDerWaalsContact C-N 3.28Å; L53-L55 PolarHBondContact O-N 3.49Å; L55-S58 PolarHBondContact O-OG 2.9Å
56	V	84.8	Confident	79.4	Confident	97 Å²	97	73 Å²	73	59%	0.588	42%	0.421	S	S	*	.	H	α-helix	trans	-65.5	-47.9	177.5	174.6	0	0	0	0	110.9	A52 L53 S58 C59	A52-V56 WeakPolarHBondContact O-CG2 3.42Å; A52-V56 PolarHBondContact O-N 3.21Å; L53-V56 PolarHBondContact O-N 3.17Å; V56-S58 VanDerWaalsContact C-N 3.29Å; V56-S58 PolarHBondContact O-N 3.18Å; V56-C59 WeakPolarHBondContact O-CB 3.33Å; V56-C59 PolarHBondContact O-N 3.14Å; V56-C59 VanDerWaalsContact O-N 3.12Å
57	T	86.9	Confident	79.2	Confident	99 Å²	99	73.6 Å²	73.6	61%	0.607	43%	0.426	S	S	*	.	H	α-helix	trans	-67.9	-28.3	179.9	56.8	0	0	0	0	113	L53 S54 C59	L53-T57 HydrophobicContact CD1-CG2 3.97Å; L53-T57 HydrophobicContact CG-CG2 4.27Å; L53-T57 WeakPolarHBondContact O-CG2 3.33Å; L53-T57 PolarHBondContact O-N 3.22Å; L53-T57 PolarHBondContact O-OG1 3.37Å; L53-T57 VanDerWaalsContact O-OG1 3.05Å; S54-T57 WeakPolarHBondContact CA-OG1 3.21Å; S54-T57 PolarHBondContact O-OG1 3.21Å; S54-T57 VanDerWaalsContact O-OG1 3.12Å; T57-C59 PolarHBondContact O-N 3.45Å
58	S	83.4	Confident	79.3	Confident	59 Å²	59	73.4 Å²	73.4	41%	0.413	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.2	175.3	75.5	0	0	0	0	113.5	S54 L55 V56	S54-S58 WeakPolarHBondContact O-CB 3.47Å; S54-S58 PolarHBondContact O-N 3.08Å; S54-S58 PolarHBondContact O-OG 3.09Å; L55-S58 PolarHBondContact O-OG 2.9Å; V56-S58 VanDerWaalsContact C-N 3.29Å; V56-S58 PolarHBondContact O-N 3.18Å
59	C	76.5	Confident	79.4	Confident	27 Å²	27	71.8 Å²	71.8	18%	0.182	42%	0.415	C	S	.	.			trans	-91.9	103.2	-179.7	-160.3	0	0	0	0	109.7	T14 V56 T57	T14-C59 HydrophobicContact CG2-CB 4.48Å; V56-C59 WeakPolarHBondContact O-CB 3.33Å; V56-C59 PolarHBondContact O-N 3.14Å; V56-C59 VanDerWaalsContact O-N 3.12Å; T57-C59 PolarHBondContact O-N 3.45Å
60	S	68.7	Low	79.5	Confident	117 Å²	117	64.3 Å²	64.3	82%	0.818	40%	0.395	S	S	*	.			trans	-81.1	-5.2	171.6	-47.5	0	0	0	0	113.2	T62	S60-T62 PolarHBondContact O-N 2.76Å
61	S	64.8	Low	79.7	Confident	64 Å²	64	59.3 Å²	59.3	45%	0.448	37%	0.373	S	S	.	.			trans	-78.7	121.5	-172.4	-57	0	0	0	0	111	S63	S61-S63 PolarHBondContact O-N 3.35Å
62	T	62	Low	80	Confident	143 Å²	143	58.3 Å²	58.3	88%	0.877	37%	0.368	S	S	*	.			trans	-72.7	-5.9	169.8	-37.1	0	0	0	0	112.8	S60 T64	S60-T62 PolarHBondContact O-N 2.76Å; T62-T64 PolarHBondContact O-N 3.12Å
63	S	65.6	Low	80.3	Confident	56 Å²	56	59.8 Å²	59.8	39%	0.392	37%	0.37	S	S	.	.			trans	-64.1	126.5	178.4	-178	0	0	0	0	110.1	P15 S61 Q65	P15-S63 WeakPolarHBondContact CG-O 3.41Å; S61-S63 PolarHBondContact O-N 3.35Å; S63-Q65 PolarHBondContact O-N 3.47Å; S63-Q65 WeakPolarHBondContact OG-CB 3.5Å; S63-Q65 PolarHBondContact OG-N 2.92Å
64	T	62.1	Low	80.4	Confident	76 Å²	76	58.8 Å²	58.8	47%	0.466	36%	0.361	S	S	.	.			trans	-84.5	4.8	172.5	56	0	0	0	0	112.4	T62 I66 D121	T62-T64 PolarHBondContact O-N 3.12Å; T64-I66 PolarHBondContact O-N 3.37Å; T64-D121 PolarHBondContact OG1-OD2 2.79Å
65	Q	67.7	Low	80.6	Confident	100 Å²	100	56.9 Å²	56.9	47%	0.467	35%	0.349	S	S	.	.			trans	-84.2	107.4	-175	-58.7	-175.3	-0.2	0	0	111.3	P15 S63 N123	P15-Q65 VanDerWaalsContact CA-O 3.28Å; P15-Q65 WeakPolarHBondContact CA-O 3.24Å; P15-Q65 VanDerWaalsContact CB-O 3.3Å; P15-Q65 WeakPolarHBondContact CB-O 3.32Å; S63-Q65 PolarHBondContact O-N 3.47Å; S63-Q65 WeakPolarHBondContact OG-CB 3.5Å; S63-Q65 PolarHBondContact OG-N 2.92Å; Q65-N123 VanDerWaalsContact CD-ND2 3.27Å; Q65-N123 PolarHBondContact OE1-ND2 3.45Å
66	I	71.7	Confident	80.9	Confident	34 Å²	34	56.4 Å²	56.4	17%	0.174	35%	0.347	C	S	.	.			trans	-102.8	128.2	-176.6	-58.2	-169.5	0	0	0	110.7	V13 P15 T64 L68 S120 Q126	V13-I66 HydrophobicContact CB-CG2 4.03Å; V13-I66 HydrophobicContact CG1-CG2 3.25Å; P15-I66 HydrophobicContact CG-CG1 4.32Å; T64-I66 PolarHBondContact O-N 3.37Å; I66-L68 HydrophobicContact CG2-CG 4.11Å; I66-L68 PolarHBondContact O-N 3.01Å; I66-S120 VanDerWaalsContact CD1-OG 3.28Å; I66-S120 WeakPolarHBondContact CD1-OG 3.46Å; I66-Q126 PolarHBondContact O-NE2 3.01Å; I66-Q126 PolarHBondContact O-OE1 3.36Å
67	V	80.8	Confident	81.3	Confident	65 Å²	65	55.3 Å²	55.3	39%	0.394	34%	0.343	S	S	.	.			trans	-79.6	79.3	174.1	-171.3	0	0	0	0	111.1	Q126	V67-Q126 VanDerWaalsContact CA-OE1 3.28Å
68	L	86.9	Confident	81.4	Confident	20 Å²	20	52.5 Å²	52.5	11%	0.105	32%	0.321	C	S	.	.	H	α-helix	trans	-69.8	-32.8	-179.5	-82.4	161.3	0	0	0	113.3	I66 G70 A71 I72 I116 K118 L130	I66-L68 HydrophobicContact CG2-CG 4.11Å; I66-L68 PolarHBondContact O-N 3.01Å; L68-G70 VanDerWaalsContact C-N 3.33Å; L68-G70 PolarHBondContact O-N 3.28Å; L68-A71 WeakPolarHBondContact O-CB 3.39Å; L68-A71 PolarHBondContact O-N 2.91Å; L68-I72 PolarHBondContact O-N 2.88Å; L68-I72 VanDerWaalsContact O-N 3.08Å; L68-I116 HydrophobicContact CD2-CG2 4.02Å; L68-K118 HydrophobicContact CD1-CD 4.18Å; L68-L130 HydrophobicContact CB-CD1 4.07Å
69	A	89.8	Confident	81.6	Confident	7 Å²	7	51 Å²	51	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-54.3	-48	-178.5	0	0	0	0	0	112.1	A71 I72 I73 A129	A69-A71 PolarHBondContact O-N 3.32Å; A69-I72 PolarHBondContact O-N 3.16Å; A69-I73 WeakPolarHBondContact O-CG1 3.46Å; A69-I73 PolarHBondContact O-N 2.79Å; A69-A129 VanDerWaalsContact CB-C 3.48Å; A69-A129 HydrophobicContact CB-CB 3.71Å; A69-A129 WeakPolarHBondContact CB-O 3.16Å
70	G	90.5	Very high	82.2	Confident	25 Å²	25	53 Å²	53	26%	0.258	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-29.8	179.2	0	0	0	0	0	113.5	L68 K74	L68-G70 VanDerWaalsContact C-N 3.33Å; L68-G70 PolarHBondContact O-N 3.28Å; G70-K74 WeakPolarHBondContact O-CB 3.33Å; G70-K74 VanDerWaalsContact O-CG 3.29Å; G70-K74 WeakPolarHBondContact O-CG 3.33Å; G70-K74 PolarHBondContact O-N 3.47Å
71	A	92	Very high	83.1	Confident	10 Å²	10	53.4 Å²	53.4	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-74	-43	177.4	0	0	0	0	0	111.6	I11 V13 I18 L68 A69 K74 A75	I11-A71 HydrophobicContact CG2-CB 4.22Å; V13-A71 HydrophobicContact CG1-CB 4.4Å; V13-A71 HydrophobicContact CG2-CB 3.42Å; V13-A71 VanDerWaalsContact CG2-CB 3.42Å; I18-A71 HydrophobicContact CG2-CB 4.09Å; L68-A71 WeakPolarHBondContact O-CB 3.39Å; L68-A71 PolarHBondContact O-N 2.91Å; A69-A71 PolarHBondContact O-N 3.32Å; A71-K74 PolarHBondContact O-N 3.31Å; A71-A75 PolarHBondContact O-N 2.98Å
72	I	94.1	Very high	84	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-46.6	175.1	-65.3	166.2	0	0	0	110	L68 A69 K74 A75 L76 I116 L130 I144	L68-I72 PolarHBondContact O-N 2.88Å; L68-I72 VanDerWaalsContact O-N 3.08Å; A69-I72 PolarHBondContact O-N 3.16Å; I72-K74 VanDerWaalsContact C-N 3.34Å; I72-K74 PolarHBondContact O-N 3.29Å; I72-A75 WeakPolarHBondContact O-CB 3.18Å; I72-A75 PolarHBondContact O-N 3.4Å; I72-A75 VanDerWaalsContact O-N 3.13Å; I72-L76 HydrophobicContact CG2-CD1 4.11Å; I72-L76 HydrophobicContact CG2-CG 4.35Å; I72-L76 WeakPolarHBondContact O-CG 3.35Å; I72-L76 PolarHBondContact O-N 3.22Å; I72-I116 HydrophobicContact CD1-CD1 3.85Å; I72-I116 HydrophobicContact CG1-CD1 4.01Å; I72-L130 HydrophobicContact CD1-CD1 3.43Å; I72-L130 VanDerWaalsContact CD1-CD1 3.43Å; I72-I144 HydrophobicContact CG2-CD1 4.36Å
73	I	93.9	Very high	85	Confident	65 Å²	65	46.2 Å²	46.2	33%	0.333	25%	0.25	S	C	.	.	H	α-helix	trans	-60.4	-43.5	176.7	-64.7	-59.3	0	0	0	111.4	A69 A75 L76 C77 S133	A69-I73 WeakPolarHBondContact O-CG1 3.46Å; A69-I73 PolarHBondContact O-N 2.79Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.22Å; I73-L76 HydrophobicContact CD1-CD1 4.39Å; I73-L76 PolarHBondContact O-N 2.93Å; I73-C77 WeakPolarHBondContact O-CB 3.42Å; I73-C77 PolarHBondContact O-N 2.89Å; I73-C77 PolarHBondContact O-SG 2.69Å; I73-S133 WeakPolarHBondContact CG1-OG 3.21Å
74	K	92.4	Very high	85.8	Confident	89 Å²	89	50.9 Å²	50.9	39%	0.387	26%	0.259	S	S	.	.	H	α-helix	trans	-60.4	-40.4	174.9	-79.6	177.1	-174.7	-64.6	0	112.3	I11 I18 F20 G70 A71 I72 C77 Y78	I11-K74 HydrophobicContact CD1-CB 4.08Å; I18-K74 HydrophobicContact CG2-CD 3.79Å; F20-K74 HydrophobicContact CE2-CB 4.25Å; F20-K74 HydrophobicContact CE2-CD 4.18Å; F20-K74 HydrophobicContact CE2-CG 4.45Å; F20-K74 HydrophobicContact CZ-CB 4Å; G70-K74 WeakPolarHBondContact O-CB 3.33Å; G70-K74 VanDerWaalsContact O-CG 3.29Å; G70-K74 WeakPolarHBondContact O-CG 3.33Å; G70-K74 PolarHBondContact O-N 3.47Å; A71-K74 PolarHBondContact O-N 3.31Å; I72-K74 VanDerWaalsContact C-N 3.34Å; I72-K74 PolarHBondContact O-N 3.29Å; K74-C77 PolarHBondContact O-N 3.38Å; K74-Y78 WeakPolarHBondContact O-CB 3.36Å; K74-Y78 PolarHBondContact O-N 3.09Å
75	A	92.5	Very high	86.6	Confident	23 Å²	23	50.6 Å²	50.6	19%	0.19	25%	0.252	C	S	.	.	H	α-helix	trans	-64	-43.7	175.3	0	0	0	0	0	111.6	I11 A71 I72 I73 Y78 Y79 I114	I11-A75 HydrophobicContact CD1-CB 4.02Å; A71-A75 PolarHBondContact O-N 2.98Å; I72-A75 WeakPolarHBondContact O-CB 3.18Å; I72-A75 PolarHBondContact O-N 3.4Å; I72-A75 VanDerWaalsContact O-N 3.13Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.22Å; A75-Y78 WeakPolarHBondContact O-CB 3.34Å; A75-Y78 PolarHBondContact O-N 2.92Å; A75-Y79 PolarHBondContact O-N 2.81Å; A75-I114 HydrophobicContact CB-CD1 4.03Å; A75-I114 HydrophobicContact CB-CG1 4.36Å
76	L	92.8	Very high	86.9	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-42.4	175.7	-66.7	175.6	0	0	0	111.9	I72 I73 Y78 Y79 L80 I114 T136 A137 L140 V142	I72-L76 HydrophobicContact CG2-CD1 4.11Å; I72-L76 HydrophobicContact CG2-CG 4.35Å; I72-L76 WeakPolarHBondContact O-CG 3.35Å; I72-L76 PolarHBondContact O-N 3.22Å; I73-L76 HydrophobicContact CD1-CD1 4.39Å; I73-L76 PolarHBondContact O-N 2.93Å; L76-Y78 VanDerWaalsContact C-N 3.3Å; L76-Y78 PolarHBondContact O-N 3.1Å; L76-Y79 WeakPolarHBondContact O-CB 3.41Å; L76-Y79 PolarHBondContact O-N 3.47Å; L76-L80 WeakPolarHBondContact O-CG 3.21Å; L76-L80 PolarHBondContact O-N 2.82Å; L76-I114 HydrophobicContact CD2-CD1 3.92Å; L76-I114 HydrophobicContact CG-CD1 4.32Å; L76-T136 HydrophobicContact CD1-CG2 3.95Å; L76-A137 HydrophobicContact CD1-CB 4.14Å; L76-A137 HydrophobicContact CD2-CB 4.01Å; L76-L140 HydrophobicContact CD2-CD1 4.14Å; L76-V142 HydrophobicContact CD2-CB 4.25Å; L76-V142 HydrophobicContact CD2-CG1 4.44Å; L76-V142 HydrophobicContact CD2-CG2 4.07Å
77	C	91.4	Very high	86.8	Confident	74 Å²	74	51.7 Å²	51.7	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-39.1	173.8	-69.2	0	0	0	0	111.9	I73 K74 R81	I73-C77 WeakPolarHBondContact O-CB 3.42Å; I73-C77 PolarHBondContact O-N 2.89Å; I73-C77 PolarHBondContact O-SG 2.69Å; K74-C77 PolarHBondContact O-N 3.38Å; C77-R81 VanDerWaalsContact O-CB 3.31Å; C77-R81 WeakPolarHBondContact O-CB 3.46Å; C77-R81 PolarHBondContact O-N 3.08Å
78	Y	89.6	Confident	85.8	Confident	39 Å²	39	52.9 Å²	52.9	15%	0.153	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-45.5	175.4	-174.7	-96.2	0	0	0	111.3	N6 A9 F20 P23 K74 A75 L76 R81 R82	N6-Y78 WeakPolarHBondContact CB-OH 3.37Å; N6-Y78 PolarHBondContact O-OH 3Å; N6-Y78 VanDerWaalsContact O-OH 3.08Å; A9-Y78 HydrophobicContact CB-CD1 3.75Å; A9-Y78 HydrophobicContact CB-CE1 3.68Å; A9-Y78 HydrophobicContact CB-CE2 4.49Å; A9-Y78 HydrophobicContact CB-CG 4.19Å; F20-Y78 HydrophobicContact CE1-CD2 4.41Å; P23-Y78 HydrophobicContact CG-CE2 4.19Å; K74-Y78 WeakPolarHBondContact O-CB 3.36Å; K74-Y78 PolarHBondContact O-N 3.09Å; A75-Y78 WeakPolarHBondContact O-CB 3.34Å; A75-Y78 PolarHBondContact O-N 2.92Å; L76-Y78 VanDerWaalsContact C-N 3.3Å; L76-Y78 PolarHBondContact O-N 3.1Å; Y78-R81 PolarHBondContact O-N 2.73Å; Y78-R82 PolarHBondContact O-N 2.81Å
79	Y	88.8	Confident	84.2	Confident	29 Å²	29	57.2 Å²	57.2	11%	0.114	30%	0.299	C	S	.	.	H	α-helix	trans	-58.7	-50.7	174.3	167	-116.2	0	0	0	112.3	A75 L76 R81 R82 C83 I110 P112 V142	A75-Y79 PolarHBondContact O-N 2.81Å; L76-Y79 WeakPolarHBondContact O-CB 3.41Å; L76-Y79 PolarHBondContact O-N 3.47Å; Y79-R81 VanDerWaalsContact C-N 3.3Å; Y79-R81 PolarHBondContact O-N 2.94Å; Y79-R82 WeakPolarHBondContact O-CB 3Å; Y79-R82 PolarHBondContact O-N 3.1Å; Y79-R82 VanDerWaalsContact O-N 3.09Å; Y79-C83 WeakPolarHBondContact CE2-SG 3.45Å; Y79-C83 PolarHBondContact O-N 2.99Å; Y79-C83 PolarHBondContact O-SG 3.38Å; Y79-I110 HydrophobicContact CE2-CG2 4.32Å; Y79-P112 HydrophobicContact CD2-CB 3.53Å; Y79-P112 HydrophobicContact CD2-CG 3.98Å; Y79-P112 HydrophobicContact CE1-CG 4.13Å; Y79-P112 HydrophobicContact CE2-CB 3.52Å; Y79-P112 HydrophobicContact CE2-CG 3.45Å; Y79-P112 VanDerWaalsContact CE2-CG 3.45Å; Y79-P112 HydrophobicContact CG-CB 4.06Å; Y79-V142 HydrophobicContact CD1-CG2 4.05Å; Y79-V142 HydrophobicContact CE1-CG2 4Å
80	L	88.2	Confident	82.5	Confident	68 Å²	68	61.4 Å²	61.4	36%	0.356	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-38.5	179.8	-70.3	174.1	0	0	0	112.3	L76 R82 C83 R84 L140	L76-L80 WeakPolarHBondContact O-CG 3.21Å; L76-L80 PolarHBondContact O-N 2.82Å; L80-R82 VanDerWaalsContact C-N 3.35Å; L80-C83 PolarHBondContact O-N 3.01Å; L80-R84 PolarHBondContact O-N 2.86Å; L80-L140 HydrophobicContact CD1-CD1 4.28Å; L80-L140 HydrophobicContact CD2-CD1 4.23Å; L80-L140 HydrophobicContact CD2-CD2 4.18Å; L80-L140 HydrophobicContact CG-CD1 4.37Å
81	R	86.9	Confident	80.7	Confident	125 Å²	125	69 Å²	69	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-45.2	173.3	178.7	179.7	172.3	-178.3	-3.2	111.1	C77 Y78 Y79 R84 E85	C77-R81 VanDerWaalsContact O-CB 3.31Å; C77-R81 WeakPolarHBondContact O-CB 3.46Å; C77-R81 PolarHBondContact O-N 3.08Å; Y78-R81 PolarHBondContact O-N 2.73Å; Y79-R81 VanDerWaalsContact C-N 3.3Å; Y79-R81 PolarHBondContact O-N 2.94Å; R81-R84 PolarHBondContact O-N 2.92Å; R81-E85 HydrophobicContact CG-CG 4.47Å; R81-E85 IonicContact CZ-OE1 3.39Å; R81-E85 IonicContact NE-OE1 3.53Å; R81-E85 PolarHBondContact NE-OE1 3.12Å; R81-E85 IonicContact NH2-OE1 3.44Å; R81-E85 PolarHBondContact NH2-OE1 2.89Å; R81-E85 VanDerWaalsContact NH2-OE1 3.1Å; R81-E85 WeakPolarHBondContact O-CG 3.32Å; R81-E85 PolarHBondContact O-N 3.48Å
82	R	83.5	Confident	78.8	Confident	29 Å²	29	77.1 Å²	77.1	11%	0.109	38%	0.381	C	S	.	.	H	α-helix	trans	-61.4	-45.5	178	-171.7	78.1	173.6	99.7	8.6	111.6	P4 H5 N6 Y78 Y79 L80 R84 E85 L86 I110	P4-R82 WeakPolarHBondContact O-CD 3.08Å; P4-R82 PolarHBondContact O-NE 3.18Å; P4-R82 PolarHBondContact O-NH1 2.88Å; H5-R82 PolarHBondContact O-NH2 3.45Å; N6-R82 PolarHBondContact O-NE 3.09Å; Y78-R82 PolarHBondContact O-N 2.81Å; Y79-R82 WeakPolarHBondContact O-CB 3Å; Y79-R82 PolarHBondContact O-N 3.1Å; Y79-R82 VanDerWaalsContact O-N 3.09Å; L80-R82 VanDerWaalsContact C-N 3.35Å; R82-R84 VanDerWaalsContact C-N 3.3Å; R82-R84 PolarHBondContact O-N 3.35Å; R82-E85 PolarHBondContact O-N 3.5Å; R82-L86 HydrophobicContact CG-CD1 4.08Å; R82-L86 PolarHBondContact O-N 2.77Å; R82-I110 HydrophobicContact CG-CD1 3.94Å
83	C	83.2	Confident	76.8	Confident	27 Å²	27	84 Å²	84	18%	0.182	42%	0.417	C	S	.	.	H	α-helix	trans	-57	-44.7	175.2	-68.1	0	0	0	0	111.7	Y79 L80 L86 Q87	Y79-C83 WeakPolarHBondContact CE2-SG 3.45Å; Y79-C83 PolarHBondContact O-N 2.99Å; Y79-C83 PolarHBondContact O-SG 3.38Å; L80-C83 PolarHBondContact O-N 3.01Å; C83-L86 PolarHBondContact O-N 3.33Å; C83-Q87 PolarHBondContact O-N 2.66Å
84	R	82.7	Confident	74.5	Confident	155 Å²	155	86.9 Å²	86.9	59%	0.585	43%	0.433	S	S	*	.	H	α-helix	trans	-64.5	-38.8	177.6	179.3	179.9	168.8	-170.3	-5.1	112.8	L80 R81 R82 L86 Q87 R91	L80-R84 PolarHBondContact O-N 2.86Å; R81-R84 PolarHBondContact O-N 2.92Å; R82-R84 VanDerWaalsContact C-N 3.3Å; R82-R84 PolarHBondContact O-N 3.35Å; R84-L86 VanDerWaalsContact C-N 3.35Å; R84-Q87 CarbonylContact O-C 3.44Å; R84-R91 VanDerWaalsContact NE-NH2 3.11Å
85	E	79.5	Confident	72.3	Confident	69 Å²	69	90.8 Å²	90.8	32%	0.322	46%	0.458	S	S	.	.	H	α-helix	trans	-72.4	-27.1	-179.8	-74.1	173.3	175.3	0	0	112.8	P4 R81 R82	P4-E85 WeakPolarHBondContact CA-OE2 3.48Å; P4-E85 WeakPolarHBondContact CB-OE2 3.49Å; R81-E85 HydrophobicContact CG-CG 4.47Å; R81-E85 IonicContact CZ-OE1 3.39Å; R81-E85 IonicContact NE-OE1 3.53Å; R81-E85 PolarHBondContact NE-OE1 3.12Å; R81-E85 IonicContact NH2-OE1 3.44Å; R81-E85 PolarHBondContact NH2-OE1 2.89Å; R81-E85 VanDerWaalsContact NH2-OE1 3.1Å; R81-E85 WeakPolarHBondContact O-CG 3.32Å; R81-E85 PolarHBondContact O-N 3.48Å; R82-E85 PolarHBondContact O-N 3.5Å
86	L	74.7	Confident	70.2	Confident	56 Å²	56	94.4 Å²	94.4	29%	0.293	48%	0.482	S	S	.	.	H	α-helix	trans	-81.1	-23.1	175.4	-77.7	158.9	0	0	0	113.6	R82 C83 R84 P88 I110	R82-L86 HydrophobicContact CG-CD1 4.08Å; R82-L86 PolarHBondContact O-N 2.77Å; C83-L86 PolarHBondContact O-N 3.33Å; R84-L86 VanDerWaalsContact C-N 3.35Å; L86-P88 WeakPolarHBondContact O-CD 3.24Å; L86-I110 HydrophobicContact CD1-CD1 3.13Å; L86-I110 HydrophobicContact CD1-CG1 3.69Å
87	Q	69.5	Low	68.1	Low	101 Å²	101	100.5 Å²	100.5	47%	0.472	51%	0.514	S	S	.	.			trans	-120.3	64.4	176.3	-63.3	-179.8	10.1	0	0	112.2	C83 R84 S89 S107	C83-Q87 PolarHBondContact O-N 2.66Å; R84-Q87 CarbonylContact O-C 3.44Å; Q87-S89 VanDerWaalsContact C-N 3.28Å; Q87-S89 PolarHBondContact O-N 3.4Å; Q87-S107 PolarHBondContact NE2-OG 3Å
88	P	58.7	Low	65.8	Low	91 Å²	91	104.5 Å²	104.5	59%	0.591	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-69.7	-24.6	179.2	24.1	-28.8	0	0	0	113.2	L86 T90	L86-P88 WeakPolarHBondContact O-CD 3.24Å; P88-T90 PolarHBondContact O-N 3.4Å
89	S	54	Low	63.6	Low	110 Å²	110	110.6 Å²	110.6	77%	0.769	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-86.2	-4.9	-160.4	-47.1	0	0	0	0	117	Q87	Q87-S89 VanDerWaalsContact C-N 3.28Å; Q87-S89 PolarHBondContact O-N 3.4Å
90	T	53.4	Low	61.3	Low	96 Å²	96	112.5 Å²	112.5	59%	0.589	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-92.9	-4.6	-173.1	52.1	0	0	0	0	115.2	P88 H92 L93	P88-T90 PolarHBondContact O-N 3.4Å; T90-H92 VanDerWaalsContact C-N 3.25Å; T90-H92 PolarHBondContact O-N 2.93Å; T90-L93 PolarHBondContact O-N 2.72Å
91	R	53.1	Low	59.3	Low	184 Å²	184	113.5 Å²	113.5	69%	0.694	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-17.9	-177.7	-75.4	-175.1	173.9	-176.7	-10.5	115.6	R84	R84-R91 VanDerWaalsContact NE-NH2 3.11Å
92	H	51.1	Low	57.1	Low	180 Å²	180	114 Å²	114	83%	0.833	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-7.4	-175.7	-149.7	-69.1	0	0	0	113.8	T90	T90-H92 VanDerWaalsContact C-N 3.25Å; T90-H92 PolarHBondContact O-N 2.93Å
93	L	52.2	Low	55.2	Low	149 Å²	149	117.5 Å²	117.5	78%	0.78	60%	0.603	S	S	*	*	S	Bend	trans	-131.6	115.9	172.4	-102.7	89.6	0	0	0	109	T90	T90-L93 PolarHBondContact O-N 2.72Å
94	D	46.8	Very low	53	Low	126 Å²	126	120.3 Å²	120.3	67%	0.674	62%	0.623	S	S	*	*			trans	93.8	95.3	161.1	-135.3	-17.8	0	0	0	117.2	S96	D94-S96 PolarHBondContact O-N 3.26Å; D94-S96 PolarHBondContact OD1-N 2.95Å
95	D	46.8	Very low	51	Low	171 Å²	171	122.3 Å²	122.3	91%	0.914	64%	0.639	S	S	*	*	S	Bend	trans	-83.4	10.1	173.1	-163.9	31.7	0	0	0	111.9
96	S	47.9	Very low	49.2	Very low	99 Å²	99	123 Å²	123	69%	0.692	67%	0.665	S	S	*	*			trans	-123.7	-0.6	-171.6	-62.5	0	0	0	0	115.2	D94 E98	D94-S96 PolarHBondContact O-N 3.26Å; D94-S96 PolarHBondContact OD1-N 2.95Å; S96-E98 PolarHBondContact O-N 2.87Å; S96-E98 VanDerWaalsContact O-N 3.09Å
97	L	48.1	Very low	47.9	Very low	132 Å²	132	122.4 Å²	122.4	69%	0.691	67%	0.666	S	S	*	*	S	Bend	trans	-78.7	102.6	166.2	-142.8	71.4	0	0	0	107.3	M99	L97-M99 PolarHBondContact O-N 3.34Å
98	E	43	Very low	47.3	Very low	158 Å²	158	125.4 Å²	125.4	74%	0.738	68%	0.679	S	S	*	*			trans	-30.8	127.7	153	-64.9	-177	158.4	0	0	107.2	S96 T100	S96-E98 PolarHBondContact O-N 2.87Å; S96-E98 VanDerWaalsContact O-N 3.09Å; E98-T100 PolarHBondContact O-N 3.01Å; E98-T100 PolarHBondContact O-OG1 2.89Å
99	M	43.8	Very low	47.6	Very low	167 Å²	167	127.5 Å²	127.5	82%	0.823	68%	0.679	S	S	*	*			trans	-67.4	42.1	178	-165.4	-178.6	-175.5	0	0	110.2	L97 M101	L97-M99 PolarHBondContact O-N 3.34Å; M99-M101 PolarHBondContact O-N 3.03Å
100	T	40.5	Very low	48.7	Very low	69 Å²	69	125 Å²	125	42%	0.423	66%	0.657	S	S	.	*			trans	-51	91.8	141.1	-16.2	0	0	0	0	104.6	E98 E102	E98-T100 PolarHBondContact O-N 3.01Å; E98-T100 PolarHBondContact O-OG1 2.89Å; T100-E102 HydrophobicContact CG2-CG 3.51Å; T100-E102 WeakPolarHBondContact CG2-OE1 3.42Å; T100-E102 PolarHBondContact O-N 2.82Å
101	M	46	Very low	50.2	Low	90 Å²	90	124.3 Å²	124.3	44%	0.443	66%	0.656	S	S	.	*			trans	-64.4	59.6	163	-148.9	174.9	76.1	0	0	106	M99 I103	M99-M101 PolarHBondContact O-N 3.03Å; M101-I103 PolarHBondContact O-N 2.89Å
102	E	40.2	Very low	51.9	Low	136 Å²	136	116.6 Å²	116.6	64%	0.636	63%	0.63	S	S	*	*			trans	-69.6	79.6	168.1	-74.6	-175.7	-173.4	0	0	104.5	T100 S104	T100-E102 HydrophobicContact CG2-CG 3.51Å; T100-E102 WeakPolarHBondContact CG2-OE1 3.42Å; T100-E102 PolarHBondContact O-N 2.82Å; E102-S104 PolarHBondContact O-N 2.9Å; E102-S104 PolarHBondContact O-OG 2.79Å
103	I	44.4	Very low	53.8	Low	101 Å²	101	114.1 Å²	114.1	52%	0.518	61%	0.613	S	S	.	*			trans	10.1	74.7	135.3	-56.6	160.1	0	0	0	110.8	M101 E105 K109	M101-I103 PolarHBondContact O-N 2.89Å; I103-E105 PolarHBondContact O-N 3.06Å; I103-K109 HydrophobicContact CG2-CD 3.65Å; I103-K109 HydrophobicContact CG2-CG 4.49Å
104	S	36.3	Very low	55.8	Low	87 Å²	87	108.1 Å²	108.1	61%	0.608	58%	0.582	S	S	*	*			trans	-72.2	113.9	171.8	-67.4	0	0	0	0	105.7	E102 G106 S107	E102-S104 PolarHBondContact O-N 2.9Å; E102-S104 PolarHBondContact O-OG 2.79Å; S104-G106 PolarHBondContact O-N 2.76Å; S104-S107 PolarHBondContact O-N 3.39Å
105	E	41.7	Very low	58.1	Low	196 Å²	196	105.8 Å²	105.8	92%	0.916	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-8.6	-171.2	-65	-175.3	141	0	0	114.7	I103	I103-E105 PolarHBondContact O-N 3.06Å
106	G	40.7	Very low	60.3	Low	84 Å²	84	98.3 Å²	98.3	87%	0.866	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-9.6	-179.3	0	0	0	0	0	116.5	S104	S104-G106 PolarHBondContact O-N 2.76Å
107	S	48.6	Very low	62.4	Low	44 Å²	44	97.7 Å²	97.7	31%	0.308	52%	0.517	S	S	.	.	S	Bend	trans	-102.1	132.7	179.2	-177.5	0	0	0	0	108.9	Q87 S104 K109	Q87-S107 PolarHBondContact NE2-OG 3Å; S104-S107 PolarHBondContact O-N 3.39Å; S107-K109 WeakPolarHBondContact O-CA 3.45Å; S107-K109 PolarHBondContact O-N 3.17Å
108	E	55.1	Low	64.4	Low	163 Å²	163	91.9 Å²	91.9	76%	0.762	49%	0.486	S	S	*	.			trans	-41.7	96	-179.7	-64.9	-162.7	160.5	0	0	111.5	I110	E108-I110 VanDerWaalsContact C-N 3.34Å; E108-I110 PolarHBondContact O-N 2.84Å
109	K	66.4	Low	66.4	Low	135 Å²	135	86.7 Å²	86.7	59%	0.587	47%	0.47	S	S	*	.			trans	-73.4	95.1	-171.6	-172.1	-174.2	-175.5	173.1	0	107.5	I103 S107 S111	I103-K109 HydrophobicContact CG2-CD 3.65Å; I103-K109 HydrophobicContact CG2-CG 4.49Å; S107-K109 WeakPolarHBondContact O-CA 3.45Å; S107-K109 PolarHBondContact O-N 3.17Å; K109-S111 PolarHBondContact O-N 2.71Å; K109-S111 VanDerWaalsContact O-N 3.17Å
110	I	77.1	Confident	68.2	Low	58 Å²	58	79.7 Å²	79.7	30%	0.297	44%	0.437	S	S	.	.			trans	-56.1	124.3	172.6	-49.7	168.8	0	0	0	107.2	Y79 R82 L86 E108 P112	Y79-I110 HydrophobicContact CE2-CG2 4.32Å; R82-I110 HydrophobicContact CG-CD1 3.94Å; L86-I110 HydrophobicContact CD1-CD1 3.13Å; L86-I110 HydrophobicContact CD1-CG1 3.69Å; E108-I110 VanDerWaalsContact C-N 3.34Å; E108-I110 PolarHBondContact O-N 2.84Å; I110-P112 WeakPolarHBondContact O-CD 3.36Å
111	S	83.5	Confident	70.1	Confident	81 Å²	81	80.8 Å²	80.8	57%	0.566	44%	0.44	S	S	*	.			trans	-98.5	87.4	171.5	179.9	0	0	0	0	108.3	K109	K109-S111 PolarHBondContact O-N 2.71Å; K109-S111 VanDerWaalsContact O-N 3.17Å
112	P	89.3	Confident	71.6	Confident	23 Å²	23	79.2 Å²	79.2	15%	0.149	43%	0.434	C	S	.	.			trans	-66.7	151.9	179.3	32.7	-40.1	0	0	0	111.2	Y79 I110 V142 P143	Y79-P112 HydrophobicContact CD2-CB 3.53Å; Y79-P112 HydrophobicContact CD2-CG 3.98Å; Y79-P112 HydrophobicContact CE1-CG 4.13Å; Y79-P112 HydrophobicContact CE2-CB 3.52Å; Y79-P112 HydrophobicContact CE2-CG 3.45Å; Y79-P112 VanDerWaalsContact CE2-CG 3.45Å; Y79-P112 HydrophobicContact CG-CB 4.06Å; I110-P112 WeakPolarHBondContact O-CD 3.36Å; P112-V142 HydrophobicContact CB-CG1 4.11Å; P112-V142 HydrophobicContact CB-CG2 4.17Å; P112-V142 HydrophobicContact CG-CB 4.45Å; P112-V142 HydrophobicContact CG-CG1 4.34Å; P112-V142 HydrophobicContact CG-CG2 3.76Å; P112-P143 WeakPolarHBondContact O-CD 3.49Å
113	R	91	Very high	73.4	Confident	128 Å²	128	74.1 Å²	74.1	48%	0.483	41%	0.411	S	S	.	.			trans	-151.5	145.1	170.3	54.7	-178	163.2	-173.7	-4.9	108.7	P143 L202	R113-P143 HydrophobicContact CB-CG 4.29Å; R113-L202 PolarHBondContact NH1-O 2.93Å
114	I	94.8	Very high	75	Confident	23 Å²	23	71.3 Å²	71.3	12%	0.118	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.3	174.6	-63.4	173	0	0	0	107.1	A75 L76 I116 V142 P143 I144 D145	A75-I114 HydrophobicContact CB-CD1 4.03Å; A75-I114 HydrophobicContact CB-CG1 4.36Å; L76-I114 HydrophobicContact CD2-CD1 3.92Å; L76-I114 HydrophobicContact CG-CD1 4.32Å; I114-I116 HydrophobicContact CG2-CG1 4Å; I114-V142 HydrophobicContact CD1-CG1 3.84Å; I114-V142 HydrophobicContact CG1-CG1 3.8Å; I114-P143 PolarHBondContact N-O 2.8Å; I114-I144 HydrophobicContact CB-CG1 4.29Å; I114-I144 CarbonylContact O-C 3.58Å; I114-I144 WeakPolarHBondContact O-CA 3.31Å; I114-D145 PolarHBondContact O-N 3.22Å
115	L	94.4	Very high	77.2	Confident	76 Å²	76	69.8 Å²	69.8	40%	0.398	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.4	170	176.3	63.7	0	0	0	109	I117 D145 C147 L197 F201	L115-I117 HydrophobicContact CD2-CD1 4.48Å; L115-I117 HydrophobicContact CD2-CG1 4.46Å; L115-I117 HydrophobicContact CG-CG1 4.3Å; L115-D145 CarbonylContact C-O 3.55Å; L115-D145 WeakPolarHBondContact CA-O 3.41Å; L115-D145 HydrophobicContact CD1-CB 3.75Å; L115-C147 HydrophobicContact CD1-CB 4.38Å; L115-L197 HydrophobicContact CD2-CD2 4.14Å; L115-F201 HydrophobicContact CD1-CB 4.29Å; L115-F201 HydrophobicContact CD1-CD1 3.64Å; L115-F201 HydrophobicContact CD1-CD2 4.22Å; L115-F201 HydrophobicContact CD1-CE1 3.89Å; L115-F201 HydrophobicContact CD1-CE2 4.43Å; L115-F201 HydrophobicContact CD1-CG 3.79Å; L115-F201 HydrophobicContact CD1-CZ 4.26Å; L115-F201 HydrophobicContact CD2-CB 4.29Å
116	I	94	Very high	79.1	Confident	15 Å²	15	62 Å²	62	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	118.5	175.5	-56.5	-179.8	0	0	0	108.2	L68 I72 I114 I144 D145 T146 C147 L173	L68-I116 HydrophobicContact CD2-CG2 4.02Å; I72-I116 HydrophobicContact CD1-CD1 3.85Å; I72-I116 HydrophobicContact CG1-CD1 4.01Å; I114-I116 HydrophobicContact CG2-CG1 4Å; I116-I144 HydrophobicContact CD1-CG2 3.51Å; I116-I144 HydrophobicContact CG1-CG2 3.96Å; I116-D145 PolarHBondContact N-O 3.02Å; I116-T146 HydrophobicContact CB-CG2 4.36Å; I116-T146 HydrophobicContact CD1-CG2 4.46Å; I116-T146 WeakPolarHBondContact O-CA 3.3Å; I116-C147 PolarHBondContact O-N 3.21Å; I116-L173 HydrophobicContact CD1-CD2 4.16Å; I116-L173 HydrophobicContact CG2-CD1 4.35Å; I116-L173 HydrophobicContact CG2-CD2 4.49Å
117	I	92.3	Very high	81.2	Confident	86 Å²	86	59.6 Å²	59.6	44%	0.441	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	112.4	169.3	-57.6	174.1	0	0	0	107.3	L115 C147 L149 L197	L115-I117 HydrophobicContact CD2-CD1 4.48Å; L115-I117 HydrophobicContact CD2-CG1 4.46Å; L115-I117 HydrophobicContact CG-CG1 4.3Å; I117-C147 CarbonylContact C-O 3.6Å; I117-C147 WeakPolarHBondContact CA-O 3Å; I117-C147 HydrophobicContact CG1-CB 4.21Å; I117-L149 HydrophobicContact CG2-CD1 3.72Å; I117-L149 HydrophobicContact CG2-CD2 4.45Å; I117-L149 HydrophobicContact CG2-CG 3.95Å; I117-L197 HydrophobicContact CD1-CD1 4.49Å; I117-L197 HydrophobicContact CD1-CD2 4.19Å
118	K	89	Confident	83	Confident	9 Å²	9	60.6 Å²	60.6	4%	0.039	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.9	-176.3	-172.8	-177	-178.9	-135.5	0	110.5	L68 S120 D121 D122 C147 L149 L173	L68-K118 HydrophobicContact CD1-CD 4.18Å; K118-S120 WeakPolarHBondContact CE-O 3.21Å; K118-S120 WeakPolarHBondContact CE-OG 3.39Å; K118-S120 PolarHBondContact NZ-O 3.31Å; K118-D121 WeakPolarHBondContact CE-O 3.44Å; K118-D121 PolarHBondContact NZ-O 2.71Å; K118-D122 IonicContact NZ-OD1 2.58Å; K118-D122 PolarHBondContact NZ-OD1 2.78Å; K118-C147 PolarHBondContact N-O 3.25Å; K118-L149 PolarHBondContact O-N 2.82Å; K118-L173 HydrophobicContact CB-CD1 3.8Å; K118-L173 HydrophobicContact CD-CD1 3.46Å; K118-L173 VanDerWaalsContact CD-CD1 3.46Å; K118-L173 HydrophobicContact CD-CG 4.34Å; K118-L173 HydrophobicContact CG-CD1 4.24Å
119	A	85.5	Confident	84.6	Confident	49 Å²	49	55.3 Å²	55.3	41%	0.405	30%	0.304	S	S	.	.			trans	-129.8	50	172.1	0	0	0	0	0	109.9	L149 L151	A119-L149 HydrophobicContact CB-CB 4.14Å; A119-L149 HydrophobicContact CB-CD1 4.25Å; A119-L151 WeakPolarHBondContact O-CD1 3.49Å
120	S	80.7	Confident	85.7	Confident	20 Å²	20	49.2 Å²	49.2	14%	0.14	28%	0.278	C	S	.	.	S	Bend	trans	-148.3	167	179	78	0	0	0	0	110.6	I66 K118	I66-S120 VanDerWaalsContact CD1-OG 3.28Å; I66-S120 WeakPolarHBondContact CD1-OG 3.46Å; K118-S120 WeakPolarHBondContact CE-O 3.21Å; K118-S120 WeakPolarHBondContact CE-OG 3.39Å; K118-S120 PolarHBondContact NZ-O 3.31Å
121	D	80.2	Confident	86.2	Confident	92 Å²	92	46.7 Å²	46.7	49%	0.492	27%	0.265	S	S	.	.			trans	-73.5	159.9	175.9	-55.4	-47.9	0	0	0	111.8	T64 K118	T64-D121 PolarHBondContact OG1-OD2 2.79Å; K118-D121 WeakPolarHBondContact CE-O 3.44Å; K118-D121 PolarHBondContact NZ-O 2.71Å
122	D	77.9	Confident	86.5	Confident	58 Å²	58	46.9 Å²	46.9	31%	0.31	26%	0.26	S	S	.	.			trans	-79.3	147.7	171.8	-91.3	-12.2	0	0	0	111.7	K118 S170 S171 L172	K118-D122 IonicContact NZ-OD1 2.58Å; K118-D122 PolarHBondContact NZ-OD1 2.78Å; D122-S170 PolarHBondContact OD1-OG 2.83Å; D122-S170 WeakPolarHBondContact OD2-CA 3.37Å; D122-S170 WeakPolarHBondContact OD2-CB 3.49Å; D122-S170 PolarHBondContact OD2-OG 3.29Å; D122-S171 PolarHBondContact OD2-N 3.02Å; D122-L172 HydrophobicContact CB-CD1 4.47Å
123	N	79.1	Confident	86.7	Confident	29 Å²	29	46.1 Å²	46.1	16%	0.155	26%	0.255	C	S	.	.			trans	-127.6	114.3	173.9	-170.7	1.6	0	0	0	110.3	Q65 S125 Q126	Q65-N123 VanDerWaalsContact CD-ND2 3.27Å; Q65-N123 PolarHBondContact OE1-ND2 3.45Å; N123-S125 VanDerWaalsContact CG-OG 3.24Å; N123-S125 PolarHBondContact ND2-OG 2.84Å; N123-S125 PolarHBondContact O-N 3.24Å; N123-S125 PolarHBondContact OD1-N 2.79Å; N123-S125 VanDerWaalsContact OD1-N 3.13Å; N123-S125 PolarHBondContact OD1-OG 2.92Å; N123-S125 VanDerWaalsContact OD1-OG 3.06Å; N123-Q126 HydrophobicContact CB-CG 4.46Å; N123-Q126 PolarHBondContact O-N 3.28Å
124	S	78.2	Confident	86.9	Confident	41 Å²	41	40 Å²	40	29%	0.287	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-67.2	-19.8	179.4	55.1	0	0	0	0	113	Q126 Y127 K235	S124-Q126 PolarHBondContact O-N 3.24Å; S124-Y127 WeakPolarHBondContact O-CB 3.4Å; S124-Y127 PolarHBondContact O-N 3.39Å; S124-K235 WeakPolarHBondContact CB-O 3.04Å; S124-K235 PolarHBondContact OG-O 2.83Å
125	S	81.1	Confident	86.8	Confident	56 Å²	56	43.3 Å²	43.3	39%	0.392	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-66.1	-25.9	174	77.9	0	0	0	0	114	N123	N123-S125 VanDerWaalsContact CG-OG 3.24Å; N123-S125 PolarHBondContact ND2-OG 2.84Å; N123-S125 PolarHBondContact O-N 3.24Å; N123-S125 PolarHBondContact OD1-N 2.79Å; N123-S125 VanDerWaalsContact OD1-N 3.13Å; N123-S125 PolarHBondContact OD1-OG 2.92Å; N123-S125 VanDerWaalsContact OD1-OG 3.06Å
126	Q	82.4	Confident	86.8	Confident	32 Å²	32	42.7 Å²	42.7	15%	0.15	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-96.1	-0	179.9	-57.3	-172.2	19	0	0	113.4	I66 V67 N123 S124 L128 A129 L130	I66-Q126 PolarHBondContact O-NE2 3.01Å; I66-Q126 PolarHBondContact O-OE1 3.36Å; V67-Q126 VanDerWaalsContact CA-OE1 3.28Å; N123-Q126 HydrophobicContact CB-CG 4.46Å; N123-Q126 PolarHBondContact O-N 3.28Å; S124-Q126 PolarHBondContact O-N 3.24Å; Q126-L128 VanDerWaalsContact C-N 3.28Å; Q126-L128 PolarHBondContact O-N 2.96Å; Q126-A129 PolarHBondContact O-N 3.09Å; Q126-L130 WeakPolarHBondContact O-CB 3.49Å; Q126-L130 PolarHBondContact O-N 2.95Å
127	Y	85	Confident	86.9	Confident	34 Å²	34	42 Å²	42	13%	0.133	24%	0.241	C	C	.	.	H	α-helix	trans	-44.5	-53.5	179.5	175.8	-101.6	0	0	0	112	S124 A129 L130 M131 L172 Q175 A230	S124-Y127 WeakPolarHBondContact O-CB 3.4Å; S124-Y127 PolarHBondContact O-N 3.39Å; Y127-A129 PolarHBondContact O-N 2.95Å; Y127-L130 PolarHBondContact O-N 3.39Å; Y127-M131 HydrophobicContact CD1-CG 4.36Å; Y127-M131 HydrophobicContact CD2-CG 3.86Å; Y127-M131 HydrophobicContact CE1-CG 4.06Å; Y127-M131 HydrophobicContact CE2-CG 3.54Å; Y127-M131 HydrophobicContact CE2-SD 4.19Å; Y127-M131 HydrophobicContact CG-CG 4.27Å; Y127-M131 WeakPolarHBondContact O-CB 3.49Å; Y127-M131 VanDerWaalsContact O-CG 3.25Å; Y127-M131 WeakPolarHBondContact O-CG 3.38Å; Y127-M131 PolarHBondContact O-N 3.41Å; Y127-L172 HydrophobicContact CD2-CD2 3.43Å; Y127-L172 VanDerWaalsContact CD2-CD2 3.43Å; Y127-L172 HydrophobicContact CE2-CD2 3.93Å; Y127-Q175 PolarHBondContact OH-OE1 3.32Å; Y127-A230 HydrophobicContact CD1-CB 3.63Å; Y127-A230 HydrophobicContact CD2-CB 4.47Å; Y127-A230 HydrophobicContact CE1-CB 4.44Å; Y127-A230 HydrophobicContact CG-CB 3.65Å
128	L	85.2	Confident	86.9	Confident	65 Å²	65	41.6 Å²	41.6	34%	0.34	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-46.6	-174.2	-175.8	64.5	0	0	0	112.6	Q126 L130 N132 F232	Q126-L128 VanDerWaalsContact C-N 3.28Å; Q126-L128 PolarHBondContact O-N 2.96Å; L128-L130 VanDerWaalsContact C-N 3.32Å; L128-L130 PolarHBondContact O-N 3.25Å; L128-N132 WeakPolarHBondContact O-CB 3Å; L128-N132 PolarHBondContact O-N 3.45Å; L128-N132 PolarHBondContact O-ND2 3.2Å; L128-F232 HydrophobicContact CD1-CE2 4.28Å; L128-F232 HydrophobicContact CD1-CZ 3.64Å; L128-F232 HydrophobicContact CD2-CD1 4.48Å; L128-F232 HydrophobicContact CD2-CE1 3.41Å; L128-F232 VanDerWaalsContact CD2-CE1 3.41Å; L128-F232 HydrophobicContact CD2-CE2 4.43Å; L128-F232 HydrophobicContact CD2-CZ 3.39Å; L128-F232 HydrophobicContact CG-CZ 4.08Å
129	A	88.5	Confident	87.1	Confident	52 Å²	52	49.5 Å²	49.5	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-65.4	-40.4	-179.9	0	0	0	0	0	111.1	A69 Q126 Y127 S133	A69-A129 VanDerWaalsContact CB-C 3.48Å; A69-A129 HydrophobicContact CB-CB 3.71Å; A69-A129 WeakPolarHBondContact CB-O 3.16Å; Q126-A129 PolarHBondContact O-N 3.09Å; Y127-A129 PolarHBondContact O-N 2.95Å; A129-S133 PolarHBondContact O-N 3.06Å; A129-S133 PolarHBondContact O-OG 3.35Å
130	L	90	Very high	87.4	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-51.8	177.5	-179	60.4	0	0	0	110.8	L68 I72 Q126 Y127 L128 N132 S133 V134 L172	L68-L130 HydrophobicContact CB-CD1 4.07Å; I72-L130 HydrophobicContact CD1-CD1 3.43Å; I72-L130 VanDerWaalsContact CD1-CD1 3.43Å; Q126-L130 WeakPolarHBondContact O-CB 3.49Å; Q126-L130 PolarHBondContact O-N 2.95Å; Y127-L130 PolarHBondContact O-N 3.39Å; L128-L130 VanDerWaalsContact C-N 3.32Å; L128-L130 PolarHBondContact O-N 3.25Å; L130-N132 PolarHBondContact O-N 3.06Å; L130-S133 WeakPolarHBondContact O-CA 3.22Å; L130-S133 VanDerWaalsContact O-CB 3.31Å; L130-S133 WeakPolarHBondContact O-CB 3.37Å; L130-S133 PolarHBondContact O-N 3.39Å; L130-V134 WeakPolarHBondContact O-CG2 3.49Å; L130-V134 PolarHBondContact O-N 2.92Å; L130-L172 HydrophobicContact CD2-CB 3.82Å; L130-L172 HydrophobicContact CD2-CD1 4.13Å
131	M	89.1	Confident	87.9	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-39.2	-178.4	-67.7	-56	-72.3	0	0	112.5	Y127 S133 V134 F135 Q175 L179	Y127-M131 HydrophobicContact CD1-CG 4.36Å; Y127-M131 HydrophobicContact CD2-CG 3.86Å; Y127-M131 HydrophobicContact CE1-CG 4.06Å; Y127-M131 HydrophobicContact CE2-CG 3.54Å; Y127-M131 HydrophobicContact CE2-SD 4.19Å; Y127-M131 HydrophobicContact CG-CG 4.27Å; Y127-M131 WeakPolarHBondContact O-CB 3.49Å; Y127-M131 VanDerWaalsContact O-CG 3.25Å; Y127-M131 WeakPolarHBondContact O-CG 3.38Å; Y127-M131 PolarHBondContact O-N 3.41Å; M131-S133 VanDerWaalsContact C-N 3.25Å; M131-S133 PolarHBondContact O-N 3.39Å; M131-V134 CarbonylContact O-C 3.53Å; M131-V134 WeakPolarHBondContact O-CB 3.42Å; M131-V134 PolarHBondContact O-N 3.41Å; M131-V134 VanDerWaalsContact O-N 3.13Å; M131-F135 HydrophobicContact CB-CD2 4.41Å; M131-F135 HydrophobicContact CB-CE2 3.97Å; M131-F135 HydrophobicContact CE-CE1 4.43Å; M131-F135 HydrophobicContact CE-CE2 4.41Å; M131-F135 HydrophobicContact CE-CZ 3.94Å; M131-F135 WeakPolarHBondContact O-CD2 3.42Å; M131-F135 WeakPolarHBondContact O-CG 3.37Å; M131-F135 PolarHBondContact O-N 3.29Å; M131-Q175 HydrophobicContact CE-CB 4.19Å; M131-Q175 VanDerWaalsContact CE-OE1 3.26Å; M131-Q175 HydrophobicContact SD-CB 4.35Å; M131-L179 HydrophobicContact CE-CD1 3.33Å
132	N	89.9	Confident	88.4	Confident	85 Å²	85	51.2 Å²	51.2	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-36.8	173.6	-72	-11.3	0	0	0	112.2	L128 L130 T136	L128-N132 WeakPolarHBondContact O-CB 3Å; L128-N132 PolarHBondContact O-N 3.45Å; L128-N132 PolarHBondContact O-ND2 3.2Å; L130-N132 PolarHBondContact O-N 3.06Å; N132-T136 PolarHBondContact O-N 2.93Å; N132-T136 PolarHBondContact O-OG1 3.45Å
133	S	92.9	Very high	89.1	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-38.4	175.6	-51	0	0	0	0	111.5	I73 A129 L130 M131 T136 A137	I73-S133 WeakPolarHBondContact CG1-OG 3.21Å; A129-S133 PolarHBondContact O-N 3.06Å; A129-S133 PolarHBondContact O-OG 3.35Å; L130-S133 WeakPolarHBondContact O-CA 3.22Å; L130-S133 VanDerWaalsContact O-CB 3.31Å; L130-S133 WeakPolarHBondContact O-CB 3.37Å; L130-S133 PolarHBondContact O-N 3.39Å; M131-S133 VanDerWaalsContact C-N 3.25Å; M131-S133 PolarHBondContact O-N 3.39Å; S133-T136 WeakPolarHBondContact O-CB 3.28Å; S133-T136 PolarHBondContact O-N 3.32Å; S133-A137 PolarHBondContact O-N 3.13Å
134	V	94	Very high	89.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.9	-46.6	174.8	170.8	0	0	0	0	111.4	L130 M131 T136 A137 Q138 I144 A176 L179 T180	L130-V134 WeakPolarHBondContact O-CG2 3.49Å; L130-V134 PolarHBondContact O-N 2.92Å; M131-V134 CarbonylContact O-C 3.53Å; M131-V134 WeakPolarHBondContact O-CB 3.42Å; M131-V134 PolarHBondContact O-N 3.41Å; M131-V134 VanDerWaalsContact O-N 3.13Å; V134-T136 PolarHBondContact O-N 3.3Å; V134-A137 CarbonylContact O-C 3.58Å; V134-A137 WeakPolarHBondContact O-CA 3.42Å; V134-A137 WeakPolarHBondContact O-CB 3.29Å; V134-A137 PolarHBondContact O-N 3.42Å; V134-Q138 PolarHBondContact O-N 2.89Å; V134-I144 HydrophobicContact CG2-CD1 4.16Å; V134-A176 HydrophobicContact CG1-CB 4.11Å; V134-A176 HydrophobicContact CG2-CB 3.54Å; V134-L179 HydrophobicContact CG1-CB 4.14Å; V134-L179 HydrophobicContact CG1-CD1 4.03Å; V134-T180 HydrophobicContact CG1-CG2 3.99Å
135	F	93.6	Very high	90.5	Very high	92 Å²	92	46 Å²	46	40%	0.404	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-34.6	176	-66.2	-49.8	0	0	0	111.7	M131 Q138 K139 L179	M131-F135 HydrophobicContact CB-CD2 4.41Å; M131-F135 HydrophobicContact CB-CE2 3.97Å; M131-F135 HydrophobicContact CE-CE1 4.43Å; M131-F135 HydrophobicContact CE-CE2 4.41Å; M131-F135 HydrophobicContact CE-CZ 3.94Å; M131-F135 WeakPolarHBondContact O-CD2 3.42Å; M131-F135 WeakPolarHBondContact O-CG 3.37Å; M131-F135 PolarHBondContact O-N 3.29Å; F135-Q138 PolarHBondContact O-N 2.64Å; F135-K139 WeakPolarHBondContact O-CB 3.43Å; F135-K139 PolarHBondContact O-N 2.78Å; F135-L179 HydrophobicContact CD1-CD1 4.24Å; F135-L179 HydrophobicContact CE1-CD1 3.6Å; F135-L179 HydrophobicContact CE1-CD2 4.3Å; F135-L179 HydrophobicContact CZ-CD1 4.22Å
136	T	94.7	Very high	91	Very high	63 Å²	63	43.3 Å²	43.3	39%	0.387	22%	0.218	S	C	.	.	H	α-helix	trans	-64.4	-44.8	172.1	-53.6	0	0	0	0	111	L76 N132 S133 V134 Q138 K139 L140	L76-T136 HydrophobicContact CD1-CG2 3.95Å; N132-T136 PolarHBondContact O-N 2.93Å; N132-T136 PolarHBondContact O-OG1 3.45Å; S133-T136 WeakPolarHBondContact O-CB 3.28Å; S133-T136 PolarHBondContact O-N 3.32Å; V134-T136 PolarHBondContact O-N 3.3Å; T136-Q138 VanDerWaalsContact C-N 3.34Å; T136-Q138 PolarHBondContact O-N 2.8Å; T136-K139 PolarHBondContact O-N 2.79Å; T136-L140 HydrophobicContact CG2-CD1 4.27Å; T136-L140 WeakPolarHBondContact O-CG 3.44Å; T136-L140 PolarHBondContact O-N 2.68Å
137	A	94.6	Very high	91.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-40.9	175	0	0	0	0	0	112.3	L76 S133 V134 L140 H141 V142 I144 T180	L76-A137 HydrophobicContact CD1-CB 4.14Å; L76-A137 HydrophobicContact CD2-CB 4.01Å; S133-A137 PolarHBondContact O-N 3.13Å; V134-A137 CarbonylContact O-C 3.58Å; V134-A137 WeakPolarHBondContact O-CA 3.42Å; V134-A137 WeakPolarHBondContact O-CB 3.29Å; V134-A137 PolarHBondContact O-N 3.42Å; A137-L140 CarbonylContact O-C 3.58Å; A137-L140 PolarHBondContact O-N 2.91Å; A137-H141 PolarHBondContact O-N 3.33Å; A137-H141 VanDerWaalsContact O-N 3.08Å; A137-V142 HydrophobicContact CB-CB 4.42Å; A137-V142 PolarHBondContact O-N 3.44Å; A137-I144 HydrophobicContact CB-CD1 3.68Å; A137-I144 HydrophobicContact CB-CG1 4.13Å; A137-T180 HydrophobicContact CB-CG2 4.25Å
138	Q	94.3	Very high	91.6	Very high	78 Å²	78	40.4 Å²	40.4	36%	0.364	21%	0.206	S	C	.	.	H	α-helix	trans	-61	-46.1	175.9	-176.9	-177.6	7.8	0	0	111.4	V134 F135 T136 L140 H141 L179 T180	V134-Q138 PolarHBondContact O-N 2.89Å; F135-Q138 PolarHBondContact O-N 2.64Å; T136-Q138 VanDerWaalsContact C-N 3.34Å; T136-Q138 PolarHBondContact O-N 2.8Å; Q138-L140 PolarHBondContact O-N 2.95Å; Q138-H141 PolarHBondContact O-N 2.67Å; Q138-L179 VanDerWaalsContact CD-O 3.24Å; Q138-L179 WeakPolarHBondContact CG-O 3.36Å; Q138-L179 PolarHBondContact NE2-O 3.46Å; Q138-T180 HydrophobicContact CB-CG2 4.21Å
139	K	93.2	Very high	91.7	Very high	176 Å²	176	38.7 Å²	38.7	77%	0.765	20%	0.197	S	C	*	.	H	α-helix	trans	-62.2	-33.5	176.2	-175.7	173.8	-179.4	177.9	0	112.3	F135 T136 H141	F135-K139 WeakPolarHBondContact O-CB 3.43Å; F135-K139 PolarHBondContact O-N 2.78Å; T136-K139 PolarHBondContact O-N 2.79Å; K139-H141 PolarHBondContact O-N 3.27Å
140	L	91.2	Very high	91	Very high	35 Å²	35	37.9 Å²	37.9	18%	0.183	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.9	175.3	-64.8	175.9	0	0	0	113.2	L76 L80 T136 A137 Q138 V142	L76-L140 HydrophobicContact CD2-CD1 4.14Å; L80-L140 HydrophobicContact CD1-CD1 4.28Å; L80-L140 HydrophobicContact CD2-CD1 4.23Å; L80-L140 HydrophobicContact CD2-CD2 4.18Å; L80-L140 HydrophobicContact CG-CD1 4.37Å; T136-L140 HydrophobicContact CG2-CD1 4.27Å; T136-L140 WeakPolarHBondContact O-CG 3.44Å; T136-L140 PolarHBondContact O-N 2.68Å; A137-L140 CarbonylContact O-C 3.58Å; A137-L140 PolarHBondContact O-N 2.91Å; Q138-L140 PolarHBondContact O-N 2.95Å; L140-V142 HydrophobicContact CB-CG2 3.9Å; L140-V142 PolarHBondContact O-N 2.97Å
141	H	90	Very high	90	Very high	158 Å²	158	42.7 Å²	42.7	73%	0.731	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	36.2	-176.1	-56.6	-68.7	0	0	0	113.6	A137 Q138 K139 P143	A137-H141 PolarHBondContact O-N 3.33Å; A137-H141 VanDerWaalsContact O-N 3.08Å; Q138-H141 PolarHBondContact O-N 2.67Å; K139-H141 PolarHBondContact O-N 3.27Å; H141-P143 WeakPolarHBondContact O-CD 3.42Å
142	V	92.2	Very high	88.6	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.018	25%	0.249	C	C	.	.			trans	-96	108.1	176.6	-176.1	0	0	0	0	109.1	L76 Y79 P112 I114 A137 L140 I144	L76-V142 HydrophobicContact CD2-CB 4.25Å; L76-V142 HydrophobicContact CD2-CG1 4.44Å; L76-V142 HydrophobicContact CD2-CG2 4.07Å; Y79-V142 HydrophobicContact CD1-CG2 4.05Å; Y79-V142 HydrophobicContact CE1-CG2 4Å; P112-V142 HydrophobicContact CB-CG1 4.11Å; P112-V142 HydrophobicContact CB-CG2 4.17Å; P112-V142 HydrophobicContact CG-CB 4.45Å; P112-V142 HydrophobicContact CG-CG1 4.34Å; P112-V142 HydrophobicContact CG-CG2 3.76Å; I114-V142 HydrophobicContact CD1-CG1 3.84Å; I114-V142 HydrophobicContact CG1-CG1 3.8Å; A137-V142 HydrophobicContact CB-CB 4.42Å; A137-V142 PolarHBondContact O-N 3.44Å; L140-V142 HydrophobicContact CB-CG2 3.9Å; L140-V142 PolarHBondContact O-N 2.97Å; V142-I144 PolarHBondContact O-N 3.47Å
143	P	92	Very high	86.9	Confident	16 Å²	16	50.6 Å²	50.6	10%	0.104	26%	0.258	C	S	.	.			trans	-65.9	133.2	176.7	27	-33.9	0	0	0	110.5	P112 R113 I114 H141	P112-P143 WeakPolarHBondContact O-CD 3.49Å; R113-P143 HydrophobicContact CB-CG 4.29Å; I114-P143 PolarHBondContact N-O 2.8Å; H141-P143 WeakPolarHBondContact O-CD 3.42Å
144	I	93.6	Very high	84.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	107.7	173.8	-58.5	177.6	0	0	0	108.4	I72 I114 I116 V134 A137 V142 T146 A177 T180 G182	I72-I144 HydrophobicContact CG2-CD1 4.36Å; I114-I144 HydrophobicContact CB-CG1 4.29Å; I114-I144 CarbonylContact O-C 3.58Å; I114-I144 WeakPolarHBondContact O-CA 3.31Å; I116-I144 HydrophobicContact CD1-CG2 3.51Å; I116-I144 HydrophobicContact CG1-CG2 3.96Å; V134-I144 HydrophobicContact CG2-CD1 4.16Å; A137-I144 HydrophobicContact CB-CD1 3.68Å; A137-I144 HydrophobicContact CB-CG1 4.13Å; V142-I144 PolarHBondContact O-N 3.47Å; I144-T146 HydrophobicContact CG2-CG2 3.93Å; I144-A177 WeakPolarHBondContact O-CA 2.97Å; I144-T180 HydrophobicContact CB-CG2 4.36Å; I144-T180 HydrophobicContact CD1-CG2 3.99Å; I144-T180 HydrophobicContact CG1-CG2 3.98Å; I144-T180 PolarHBondContact N-OG1 3.43Å; I144-G182 WeakPolarHBondContact O-CA 3.34Å
145	D	92.1	Very high	81.9	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.011	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	139	169.6	-63.7	-40.9	0	0	0	110.2	I114 L115 I116 G182 I183 F201 R208	I114-D145 PolarHBondContact O-N 3.22Å; L115-D145 CarbonylContact C-O 3.55Å; L115-D145 WeakPolarHBondContact CA-O 3.41Å; L115-D145 HydrophobicContact CD1-CB 3.75Å; I116-D145 PolarHBondContact N-O 3.02Å; D145-G182 WeakPolarHBondContact OD1-CA 2.91Å; D145-I183 CarbonylContact C-O 3.52Å; D145-I183 WeakPolarHBondContact CA-O 3.38Å; D145-I183 PolarHBondContact OD1-N 3.26Å; D145-F201 HydrophobicContact CB-CD1 3.62Å; D145-F201 HydrophobicContact CB-CE1 3.71Å; D145-R208 IonicContact OD1-CZ 2.77Å; D145-R208 IonicContact OD1-NH1 3.4Å; D145-R208 PolarHBondContact OD1-NH1 2.83Å; D145-R208 IonicContact OD1-NH2 3.41Å; D145-R208 PolarHBondContact OD1-NH2 3.48Å; D145-R208 IonicContact OD2-CZ 3.1Å; D145-R208 IonicContact OD2-NH1 2.66Å; D145-R208 PolarHBondContact OD2-NH1 3.42Å; D145-R208 IonicContact OD2-NH2 3.45Å; D145-R208 PolarHBondContact OD2-NH2 3.3Å
146	T	91.4	Very high	79.5	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.8	-174	59.1	0	0	0	0	109.9	I116 I144 L173 A177 I183 Y184 L185	I116-T146 HydrophobicContact CB-CG2 4.36Å; I116-T146 HydrophobicContact CD1-CG2 4.46Å; I116-T146 WeakPolarHBondContact O-CA 3.3Å; I144-T146 HydrophobicContact CG2-CG2 3.93Å; T146-L173 HydrophobicContact CG2-CB 3.93Å; T146-L173 HydrophobicContact CG2-CD1 4.39Å; T146-L173 HydrophobicContact CG2-CD2 3.97Å; T146-L173 HydrophobicContact CG2-CG 4.32Å; T146-A177 HydrophobicContact CG2-CB 4.44Å; T146-I183 PolarHBondContact N-O 3.02Å; T146-I183 PolarHBondContact OG1-O 3.32Å; T146-Y184 WeakPolarHBondContact OG1-CA 3.48Å; T146-Y184 WeakPolarHBondContact OG1-CD2 3.28Å; T146-L185 PolarHBondContact O-N 3.05Å
147	C	90.7	Very high	76.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	107	178.7	-178.7	0	0	0	0	107.7	L115 I116 I117 K118 L185 V187 F201	L115-C147 HydrophobicContact CD1-CB 4.38Å; I116-C147 PolarHBondContact O-N 3.21Å; I117-C147 CarbonylContact C-O 3.6Å; I117-C147 WeakPolarHBondContact CA-O 3Å; I117-C147 HydrophobicContact CG1-CB 4.21Å; K118-C147 PolarHBondContact N-O 3.25Å; C147-L185 CarbonylContact C-O 3.56Å; C147-L185 WeakPolarHBondContact CA-O 3.49Å; C147-V187 WeakPolarHBondContact SG-CG2 3.37Å; C147-F201 HydrophobicContact CB-CE2 3.72Å; C147-F201 HydrophobicContact CB-CZ 3.79Å
148	V	89.7	Confident	74.3	Confident	5 Å²	5	75.1 Å²	75.1	3%	0.03	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.7	-179.5	-173.3	0	0	0	0	109.1	G168 L173 Y184 L185 Q186 V187	V148-G168 WeakPolarHBondContact CG1-O 3.48Å; V148-L173 HydrophobicContact CG2-CD1 4.06Å; V148-Y184 HydrophobicContact CG2-CE2 3.6Å; V148-L185 PolarHBondContact N-O 3.28Å; V148-Q186 WeakPolarHBondContact O-CA 3.39Å; V148-V187 PolarHBondContact O-N 3.46Å
149	L	87.8	Confident	71.6	Confident	29 Å²	29	77.8 Å²	77.8	15%	0.152	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	113.2	176.1	-56	-175.5	0	0	0	108.4	I117 K118 A119 L151 V187 L193	I117-L149 HydrophobicContact CG2-CD1 3.72Å; I117-L149 HydrophobicContact CG2-CD2 4.45Å; I117-L149 HydrophobicContact CG2-CG 3.95Å; K118-L149 PolarHBondContact O-N 2.82Å; A119-L149 HydrophobicContact CB-CB 4.14Å; A119-L149 HydrophobicContact CB-CD1 4.25Å; L149-L151 PolarHBondContact O-N 3.4Å; L149-L151 VanDerWaalsContact O-N 3.1Å; L149-V187 HydrophobicContact CD2-CB 4.04Å; L149-V187 HydrophobicContact CD2-CG2 3.91Å; L149-L193 HydrophobicContact CD1-CD2 4.36Å; L149-L193 HydrophobicContact CD2-CD1 3.64Å; L149-L193 HydrophobicContact CD2-CD2 4.2Å
150	S	74.7	Confident	69	Low	35 Å²	35	73.5 Å²	73.5	25%	0.245	42%	0.416	C	S	.	.			trans	-69.3	107	170.1	-57.2	0	0	0	0	108.9	Q186	S150-Q186 WeakPolarHBondContact OG-CG 3.29Å; S150-Q186 PolarHBondContact OG-NE2 3.26Å
151	L	68.3	Low	66.5	Low	108 Å²	108	83 Å²	83	57%	0.565	45%	0.45	S	S	*	.			trans	-68.6	136	168.7	-70.7	168.9	0	0	0	108.1	A119 L149 Q153	A119-L151 WeakPolarHBondContact O-CD1 3.49Å; L149-L151 PolarHBondContact O-N 3.4Å; L149-L151 VanDerWaalsContact O-N 3.1Å; L151-Q153 PolarHBondContact O-N 2.95Å
152	P	59.5	Low	64.2	Low	120 Å²	120	79 Å²	79	78%	0.779	44%	0.439	S	S	*	.			trans	-60.7	107.1	167.3	-11.8	25.2	0	0	0	106.6	Q154	P152-Q154 PolarHBondContact O-N 3.24Å
153	Q	53.4	Low	61.6	Low	136 Å²	136	80.1 Å²	80.1	64%	0.636	45%	0.451	S	S	*	.			trans	-64.7	109.6	162.9	-70.7	-175.1	-2.1	0	0	104.6	L151 S155	L151-Q153 PolarHBondContact O-N 2.95Å; Q153-S155 PolarHBondContact O-N 2.92Å; Q153-S155 VanDerWaalsContact O-N 3.09Å
154	Q	42.2	Very low	59.1	Low	153 Å²	153	85.4 Å²	85.4	72%	0.715	49%	0.485	S	S	*	.			trans	-46.2	123.8	168.2	179.6	168.3	-2.5	0	0	106.3	P152 D156	P152-Q154 PolarHBondContact O-N 3.24Å; Q154-D156 PolarHBondContact O-N 3.41Å
155	S	40.8	Very low	56.7	Low	116 Å²	116	90.2 Å²	90.2	81%	0.811	52%	0.519	S	S	*	.			trans	-63.5	73.3	-179.9	53.8	0	0	0	0	109.5	Q153	Q153-S155 PolarHBondContact O-N 2.92Å; Q153-S155 VanDerWaalsContact O-N 3.09Å
156	D	43.5	Very low	54.5	Low	102 Å²	102	93.2 Å²	93.2	55%	0.545	54%	0.54	S	S	.	.			trans	-109.2	100.1	175.1	-79.9	-27.6	0	0	0	108.1	Q154	Q154-D156 PolarHBondContact O-N 3.41Å
157	N	37.6	Very low	52.6	Low	132 Å²	132	98.6 Å²	98.6	71%	0.706	57%	0.569	S	S	*	*			trans	77.3	98.3	139.5	-58.4	-57.1	0	0	0	118.3	N159	N157-N159 PolarHBondContact O-N 2.77Å
158	L	41.8	Very low	51.2	Low	173 Å²	173	100.1 Å²	100.1	91%	0.906	58%	0.584	S	S	*	*	S	Bend		65.6	-7.6	119.6	-147.1	69.7	0	0	0	120
159	N	37.9	Very low	50.5	Low	135 Å²	135	104.3 Å²	104.3	72%	0.722	60%	0.603	S	S	*	*			trans	-115.4	88.7	168.8	-79.7	-28.8	0	0	0	109	N157 R161	N157-N159 PolarHBondContact O-N 2.77Å; N159-R161 PolarHBondContact O-N 2.96Å
160	G	38.9	Very low	50.1	Low	86 Å²	86	103 Å²	103	89%	0.887	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	42.4	169.4	0	0	0	0	0	114.2
161	R	38.5	Very low	50.5	Low	233 Å²	233	102.5 Å²	102.5	88%	0.879	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	4	171.2	-73	-174.8	173.5	-133.4	0.3	112.5	N159 G163	N159-R161 PolarHBondContact O-N 2.96Å; R161-G163 PolarHBondContact O-N 3.31Å
162	C	42.5	Very low	51.4	Low	75 Å²	75	97.6 Å²	97.6	51%	0.507	57%	0.567	S	S	.	*	S	Bend	trans	-71.3	91.2	163	-145.6	0	0	0	0	106.3
163	G	36.2	Very low	52.7	Low	27 Å²	27	91.9 Å²	91.9	28%	0.278	53%	0.53	S	S	.	.			trans	-55	152	178.3	0	0	0	0	0	109.8	R161 S165 S166	R161-G163 PolarHBondContact O-N 3.31Å; G163-S165 PolarHBondContact O-N 3.39Å; G163-S166 PolarHBondContact O-N 3.06Å
164	P	40.5	Very low	54.3	Low	126 Å²	126	86.5 Å²	86.5	82%	0.818	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-55.4	-10.4	176.3	21.4	-31.9	0	0	0	113.8	L167	P164-L167 WeakPolarHBondContact O-CB 3.29Å
165	S	41.9	Very low	56.5	Low	101 Å²	101	79.4 Å²	79.4	71%	0.706	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-77	-18.8	175.5	49.4	0	0	0	0	115.2	G163 L167	G163-S165 PolarHBondContact O-N 3.39Å; S165-L167 VanDerWaalsContact C-N 3.28Å; S165-L167 PolarHBondContact O-N 3.44Å
166	S	47.3	Very low	58.9	Low	65 Å²	65	73.9 Å²	73.9	46%	0.455	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-89.5	9	-179.6	-46.1	0	0	0	0	113.5	G163 G168	G163-S166 PolarHBondContact O-N 3.06Å; S166-G168 PolarHBondContact O-N 3.46Å
167	L	51.2	Low	61	Low	114 Å²	114	69.1 Å²	69.1	60%	0.597	41%	0.408	S	S	*	.	S	Bend	trans	-68.4	58.3	-169.5	-159.7	102.5	0	0	0	112.6	P164 S165 H169 Q186	P164-L167 WeakPolarHBondContact O-CB 3.29Å; S165-L167 VanDerWaalsContact C-N 3.28Å; S165-L167 PolarHBondContact O-N 3.44Å; L167-H169 PolarHBondContact O-CD2 3.32Å; L167-H169 PolarHBondContact O-N 3.49Å; L167-Q186 PolarHBondContact O-NE2 3.11Å
168	G	62	Low	63.5	Low	31 Å²	31	65.2 Å²	65.2	32%	0.32	39%	0.387	S	S	.	.	S	Bend	trans	61.5	-0.1	178.4	0	0	0	0	0	115.8	V148 S166	V148-G168 WeakPolarHBondContact CG1-O 3.48Å; S166-G168 PolarHBondContact O-N 3.46Å
169	H	73.1	Confident	65.8	Low	94 Å²	94	59.1 Å²	59.1	44%	0.435	36%	0.355	S	S	.	.			trans	-77.5	137.9	177	-69	-87.2	0	0	0	110	L167 Y184 Q186	L167-H169 PolarHBondContact O-CD2 3.32Å; L167-H169 PolarHBondContact O-N 3.49Å; H169-Y184 WeakPolarHBondContact CA-OH 3.43Å; H169-Q186 PolarHBondContact CD2-OE1 3.04Å; H169-Q186 PolarHBondContact CE1-OE1 3.32Å; H169-Q186 PolarHBondContact ND1-OE1 2.75Å; H169-Q186 PolarHBondContact NE2-OE1 2.94Å
170	S	81.3	Confident	68.2	Low	1 Å²	1	53.6 Å²	53.6	1%	0.007	33%	0.326	C	S	.	.			trans	-107.1	102.5	172.1	172.9	0	0	0	0	109.7	D122 L172 L173 Q174 Y184	D122-S170 PolarHBondContact OD1-OG 2.83Å; D122-S170 WeakPolarHBondContact OD2-CA 3.37Å; D122-S170 WeakPolarHBondContact OD2-CB 3.49Å; D122-S170 PolarHBondContact OD2-OG 3.29Å; S170-L172 PolarHBondContact O-N 3.23Å; S170-L173 PolarHBondContact O-N 2.89Å; S170-L173 WeakPolarHBondContact OG-CB 3.48Å; S170-L173 WeakPolarHBondContact OG-CG 3.44Å; S170-L173 PolarHBondContact OG-N 2.71Å; S170-Q174 WeakPolarHBondContact O-CB 3.4Å; S170-Q174 PolarHBondContact O-N 3.26Å; S170-Y184 PolarHBondContact N-OH 2.98Å
171	S	82.5	Confident	70.5	Confident	24 Å²	24	52 Å²	52	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-33.7	177.7	57.5	0	0	0	0	111.1	D122 Q174 Q175	D122-S171 PolarHBondContact OD2-N 3.02Å; S171-Q174 PolarHBondContact O-N 2.66Å; S171-Q175 WeakPolarHBondContact O-CG 3.39Å; S171-Q175 PolarHBondContact O-N 2.74Å
172	L	86	Confident	72.8	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-45.4	179.7	-54.9	-168.2	0	0	0	112.4	D122 Y127 L130 S170 Q174 Q175 A176	D122-L172 HydrophobicContact CB-CD1 4.47Å; Y127-L172 HydrophobicContact CD2-CD2 3.43Å; Y127-L172 VanDerWaalsContact CD2-CD2 3.43Å; Y127-L172 HydrophobicContact CE2-CD2 3.93Å; L130-L172 HydrophobicContact CD2-CB 3.82Å; L130-L172 HydrophobicContact CD2-CD1 4.13Å; S170-L172 PolarHBondContact O-N 3.23Å; L172-Q174 VanDerWaalsContact C-N 3.33Å; L172-Q175 PolarHBondContact O-N 3.17Å; L172-A176 PolarHBondContact O-N 2.7Å
173	L	87.8	Confident	75	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-73.6	-29.1	177.5	-71.4	-173.8	0	0	0	112.2	I116 K118 T146 V148 S170 A176 A177 Y184	I116-L173 HydrophobicContact CD1-CD2 4.16Å; I116-L173 HydrophobicContact CG2-CD1 4.35Å; I116-L173 HydrophobicContact CG2-CD2 4.49Å; K118-L173 HydrophobicContact CB-CD1 3.8Å; K118-L173 HydrophobicContact CD-CD1 3.46Å; K118-L173 VanDerWaalsContact CD-CD1 3.46Å; K118-L173 HydrophobicContact CD-CG 4.34Å; K118-L173 HydrophobicContact CG-CD1 4.24Å; T146-L173 HydrophobicContact CG2-CB 3.93Å; T146-L173 HydrophobicContact CG2-CD1 4.39Å; T146-L173 HydrophobicContact CG2-CD2 3.97Å; T146-L173 HydrophobicContact CG2-CG 4.32Å; V148-L173 HydrophobicContact CG2-CD1 4.06Å; S170-L173 PolarHBondContact O-N 2.89Å; S170-L173 WeakPolarHBondContact OG-CB 3.48Å; S170-L173 WeakPolarHBondContact OG-CG 3.44Å; S170-L173 PolarHBondContact OG-N 2.71Å; L173-A176 WeakPolarHBondContact O-CB 3.41Å; L173-A176 PolarHBondContact O-N 2.93Å; L173-A177 PolarHBondContact O-N 3.46Å; L173-Y184 HydrophobicContact CB-CD2 4.33Å; L173-Y184 HydrophobicContact CB-CE2 4.19Å
174	Q	87.9	Confident	77.5	Confident	24 Å²	24	38 Å²	38	11%	0.112	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-44.7	172.6	-164.4	-176.9	-6.8	0	0	110.8	S170 S171 L172 A176 A177 D178 Y184 V225	S170-Q174 WeakPolarHBondContact O-CB 3.4Å; S170-Q174 PolarHBondContact O-N 3.26Å; S171-Q174 PolarHBondContact O-N 2.66Å; L172-Q174 VanDerWaalsContact C-N 3.33Å; Q174-A176 VanDerWaalsContact C-N 3.34Å; Q174-A177 PolarHBondContact O-N 2.97Å; Q174-D178 WeakPolarHBondContact O-CB 3.37Å; Q174-D178 PolarHBondContact O-N 3.41Å; Q174-Y184 HydrophobicContact CB-CD2 3.95Å; Q174-Y184 HydrophobicContact CB-CE2 4.12Å; Q174-Y184 HydrophobicContact CB-CG 4.29Å; Q174-Y184 HydrophobicContact CG-CD1 4.41Å; Q174-Y184 HydrophobicContact CG-CD2 4.39Å; Q174-Y184 HydrophobicContact CG-CG 4.22Å; Q174-V225 HydrophobicContact CB-CG1 4.37Å; Q174-V225 HydrophobicContact CG-CB 4.38Å; Q174-V225 HydrophobicContact CG-CG1 4.1Å; Q174-V225 HydrophobicContact CG-CG2 3.96Å
175	Q	88	Confident	79.8	Confident	3 Å²	3	32.9 Å²	32.9	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-43	170.5	-69.6	179.1	40.2	0	0	111.8	Y127 M131 S171 L172 A177 D178 L179 V225 D226 F227	Y127-Q175 PolarHBondContact OH-OE1 3.32Å; M131-Q175 HydrophobicContact CE-CB 4.19Å; M131-Q175 VanDerWaalsContact CE-OE1 3.26Å; M131-Q175 HydrophobicContact SD-CB 4.35Å; S171-Q175 WeakPolarHBondContact O-CG 3.39Å; S171-Q175 PolarHBondContact O-N 2.74Å; L172-Q175 PolarHBondContact O-N 3.17Å; Q175-A177 PolarHBondContact O-N 3.26Å; Q175-D178 PolarHBondContact O-N 3.13Å; Q175-L179 WeakPolarHBondContact O-CB 3.35Å; Q175-L179 VanDerWaalsContact O-CG 3.29Å; Q175-L179 WeakPolarHBondContact O-CG 3.4Å; Q175-L179 PolarHBondContact O-N 3.29Å; Q175-V225 HydrophobicContact CB-CG1 4.19Å; Q175-V225 HydrophobicContact CG-CG1 3.56Å; Q175-D226 PolarHBondContact NE2-O 3.17Å; Q175-F227 HydrophobicContact CG-CD1 3.96Å; Q175-F227 HydrophobicContact CG-CE1 4.24Å
176	A	89.7	Confident	81.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-44.1	-179.5	0	0	0	0	0	113	V134 L172 L173 Q174 T180	V134-A176 HydrophobicContact CG1-CB 4.11Å; V134-A176 HydrophobicContact CG2-CB 3.54Å; L172-A176 PolarHBondContact O-N 2.7Å; L173-A176 WeakPolarHBondContact O-CB 3.41Å; L173-A176 PolarHBondContact O-N 2.93Å; Q174-A176 VanDerWaalsContact C-N 3.34Å; A176-T180 WeakPolarHBondContact O-CG2 3.17Å; A176-T180 PolarHBondContact O-N 2.58Å; A176-T180 PolarHBondContact O-OG1 2.89Å
177	A	89.5	Confident	83.7	Confident	2 Å²	2	26.8 Å²	26.8	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-66	-45.8	176.4	0	0	0	0	0	111.2	I144 T146 L173 Q174 Q175 T180 G181 G182	I144-A177 WeakPolarHBondContact O-CA 2.97Å; T146-A177 HydrophobicContact CG2-CB 4.44Å; L173-A177 PolarHBondContact O-N 3.46Å; Q174-A177 PolarHBondContact O-N 2.97Å; Q175-A177 PolarHBondContact O-N 3.26Å; A177-T180 PolarHBondContact O-N 3.08Å; A177-T180 PolarHBondContact O-OG1 3.23Å; A177-G181 CarbonylContact O-C 3.55Å; A177-G181 PolarHBondContact O-N 3.48Å; A177-G182 PolarHBondContact O-N 2.74Å
178	D	88.6	Confident	85.1	Confident	50 Å²	50	26.1 Å²	26.1	27%	0.267	16%	0.163	S	C	.	.	H	α-helix	trans	-65	-45.4	-177.7	-168.8	57.9	0	0	0	112.7	Q174 Q175 T180 G181 R217 V225	Q174-D178 WeakPolarHBondContact O-CB 3.37Å; Q174-D178 PolarHBondContact O-N 3.41Å; Q175-D178 PolarHBondContact O-N 3.13Å; D178-T180 VanDerWaalsContact C-N 3.29Å; D178-T180 PolarHBondContact O-N 2.87Å; D178-G181 PolarHBondContact O-N 3.44Å; D178-R217 IonicContact OD1-CZ 2.72Å; D178-R217 IonicContact OD1-NE 3.4Å; D178-R217 PolarHBondContact OD1-NE 3.26Å; D178-R217 IonicContact OD1-NH2 2.75Å; D178-R217 PolarHBondContact OD1-NH2 2.82Å; D178-V225 HydrophobicContact CB-CG2 4.06Å
179	L	89.9	Confident	86.2	Confident	45 Å²	45	33 Å²	33	24%	0.236	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-34.2	178.9	-73.4	172.1	0	0	0	113.3	M131 V134 F135 Q138 Q175	M131-L179 HydrophobicContact CE-CD1 3.33Å; V134-L179 HydrophobicContact CG1-CB 4.14Å; V134-L179 HydrophobicContact CG1-CD1 4.03Å; F135-L179 HydrophobicContact CD1-CD1 4.24Å; F135-L179 HydrophobicContact CE1-CD1 3.6Å; F135-L179 HydrophobicContact CE1-CD2 4.3Å; F135-L179 HydrophobicContact CZ-CD1 4.22Å; Q138-L179 VanDerWaalsContact CD-O 3.24Å; Q138-L179 WeakPolarHBondContact CG-O 3.36Å; Q138-L179 PolarHBondContact NE2-O 3.46Å; Q175-L179 WeakPolarHBondContact O-CB 3.35Å; Q175-L179 VanDerWaalsContact O-CG 3.29Å; Q175-L179 WeakPolarHBondContact O-CG 3.4Å; Q175-L179 PolarHBondContact O-N 3.29Å
180	T	89.6	Confident	86.8	Confident	20 Å²	20	32 Å²	32	12%	0.123	18%	0.18	C	C	.	.	H	α-helix	trans	-93.7	-3	-178.7	61.1	0	0	0	0	113.3	V134 A137 Q138 I144 A176 A177 D178 G182	V134-T180 HydrophobicContact CG1-CG2 3.99Å; A137-T180 HydrophobicContact CB-CG2 4.25Å; Q138-T180 HydrophobicContact CB-CG2 4.21Å; I144-T180 HydrophobicContact CB-CG2 4.36Å; I144-T180 HydrophobicContact CD1-CG2 3.99Å; I144-T180 HydrophobicContact CG1-CG2 3.98Å; I144-T180 PolarHBondContact N-OG1 3.43Å; A176-T180 WeakPolarHBondContact O-CG2 3.17Å; A176-T180 PolarHBondContact O-N 2.58Å; A176-T180 PolarHBondContact O-OG1 2.89Å; A177-T180 PolarHBondContact O-N 3.08Å; A177-T180 PolarHBondContact O-OG1 3.23Å; D178-T180 VanDerWaalsContact C-N 3.29Å; D178-T180 PolarHBondContact O-N 2.87Å; T180-G182 VanDerWaalsContact C-N 3.25Å; T180-G182 PolarHBondContact O-N 3.04Å
181	G	86.3	Confident	87.1	Confident	51 Å²	51	37.3 Å²	37.3	53%	0.526	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	21.7	-173.7	0	0	0	0	0	113.9	A177 D178	A177-G181 CarbonylContact O-C 3.55Å; A177-G181 PolarHBondContact O-N 3.48Å; D178-G181 PolarHBondContact O-N 3.44Å
182	G	87.5	Confident	87.2	Confident	12 Å²	12	36.9 Å²	36.9	12%	0.124	22%	0.217	C	C	.	.			trans	-83.3	-177.4	173.5	0	0	0	0	0	113.2	I144 D145 A177 T180	I144-G182 WeakPolarHBondContact O-CA 3.34Å; D145-G182 WeakPolarHBondContact OD1-CA 2.91Å; A177-G182 PolarHBondContact O-N 2.74Å; T180-G182 VanDerWaalsContact C-N 3.25Å; T180-G182 PolarHBondContact O-N 3.04Å
183	I	88.2	Confident	87.4	Confident	11 Å²	11	38.5 Å²	38.5	6%	0.056	23%	0.225	C	C	.	.			trans	-104.2	133.7	178.9	-58.8	163.9	0	0	0	109.8	D145 T146 V200 F201 R208 L213	D145-I183 CarbonylContact C-O 3.52Å; D145-I183 WeakPolarHBondContact CA-O 3.38Å; D145-I183 PolarHBondContact OD1-N 3.26Å; T146-I183 PolarHBondContact N-O 3.02Å; T146-I183 PolarHBondContact OG1-O 3.32Å; I183-V200 HydrophobicContact CD1-CG1 3.98Å; I183-V200 HydrophobicContact CG2-CG1 3.82Å; I183-F201 HydrophobicContact CB-CE1 4.11Å; I183-F201 HydrophobicContact CG2-CE1 4.22Å; I183-R208 HydrophobicContact CD1-CG 4.35Å; I183-L213 HydrophobicContact CD1-CD1 3.59Å; I183-L213 HydrophobicContact CG1-CD1 4.12Å
184	Y	89.5	Confident	87.6	Confident	19 Å²	19	43.6 Å²	43.6	8%	0.075	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.6	164.5	178.4	-86.7	0	0	0	109.7	T146 V148 H169 S170 L173 Q174 Q186 S216	T146-Y184 WeakPolarHBondContact OG1-CA 3.48Å; T146-Y184 WeakPolarHBondContact OG1-CD2 3.28Å; V148-Y184 HydrophobicContact CG2-CE2 3.6Å; H169-Y184 WeakPolarHBondContact CA-OH 3.43Å; S170-Y184 PolarHBondContact N-OH 2.98Å; L173-Y184 HydrophobicContact CB-CD2 4.33Å; L173-Y184 HydrophobicContact CB-CE2 4.19Å; Q174-Y184 HydrophobicContact CB-CD2 3.95Å; Q174-Y184 HydrophobicContact CB-CE2 4.12Å; Q174-Y184 HydrophobicContact CB-CG 4.29Å; Q174-Y184 HydrophobicContact CG-CD1 4.41Å; Q174-Y184 HydrophobicContact CG-CD2 4.39Å; Q174-Y184 HydrophobicContact CG-CG 4.22Å; Y184-Q186 HydrophobicContact CE1-CB 4.36Å; Y184-S216 VanDerWaalsContact O-CB 3.24Å; Y184-S216 WeakPolarHBondContact O-CB 3.05Å
185	L	87.8	Confident	87.8	Confident	19 Å²	19	49 Å²	49	10%	0.099	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.1	173.1	-177.4	68.2	0	0	0	110.2	T146 C147 V148 Y196 V200 F201 P214	T146-L185 PolarHBondContact O-N 3.05Å; C147-L185 CarbonylContact C-O 3.56Å; C147-L185 WeakPolarHBondContact CA-O 3.49Å; V148-L185 PolarHBondContact N-O 3.28Å; L185-Y196 HydrophobicContact CD2-CD1 3.92Å; L185-Y196 HydrophobicContact CD2-CG 4.19Å; L185-V200 HydrophobicContact CD2-CB 4.4Å; L185-V200 HydrophobicContact CD2-CG1 4.45Å; L185-V200 HydrophobicContact CD2-CG2 4.06Å; L185-F201 HydrophobicContact CB-CE2 4.18Å; L185-F201 HydrophobicContact CB-CZ 3.74Å; L185-F201 HydrophobicContact CD2-CE2 3.97Å; L185-F201 HydrophobicContact CD2-CZ 4.36Å; L185-P214 HydrophobicContact CD1-CB 4.15Å; L185-P214 HydrophobicContact CD1-CG 4.49Å
186	Q	86.1	Confident	87.8	Confident	37 Å²	37	51.7 Å²	51.7	17%	0.173	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.8	163.1	-178.9	164.4	-20.5	0	0	109.2	V148 S150 L167 H169 Y184 P188	V148-Q186 WeakPolarHBondContact O-CA 3.39Å; S150-Q186 WeakPolarHBondContact OG-CG 3.29Å; S150-Q186 PolarHBondContact OG-NE2 3.26Å; L167-Q186 PolarHBondContact O-NE2 3.11Å; H169-Q186 PolarHBondContact CD2-OE1 3.04Å; H169-Q186 PolarHBondContact CE1-OE1 3.32Å; H169-Q186 PolarHBondContact ND1-OE1 2.75Å; H169-Q186 PolarHBondContact NE2-OE1 2.94Å; Y184-Q186 HydrophobicContact CE1-CB 4.36Å; Q186-P188 WeakPolarHBondContact O-CD 3.33Å
187	V	85.7	Confident	87.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	112.6	-177.3	176.8	0	0	0	0	109	C147 V148 L149 R189 L193 Y196	C147-V187 WeakPolarHBondContact SG-CG2 3.37Å; V148-V187 PolarHBondContact O-N 3.46Å; L149-V187 HydrophobicContact CD2-CB 4.04Å; L149-V187 HydrophobicContact CD2-CG2 3.91Å; V187-R189 VanDerWaalsContact C-N 3.32Å; V187-R189 WeakPolarHBondContact CG1-O 3.34Å; V187-R189 PolarHBondContact O-N 3Å; V187-L193 HydrophobicContact CG2-CD1 4.02Å; V187-Y196 HydrophobicContact CG1-CD2 3.81Å; V187-Y196 HydrophobicContact CG1-CE2 4.01Å
188	P	81.2	Confident	88	Confident	101 Å²	101	57.9 Å²	57.9	66%	0.656	32%	0.319	S	S	*	.	S	Bend	trans	-71.2	-29.4	-177.8	28.9	-35.6	0	0	0	112.2	Q186 Y196	Q186-P188 WeakPolarHBondContact O-CD 3.33Å; P188-Y196 HydrophobicContact CG-CE2 4.41Å; P188-Y196 VanDerWaalsContact CG-OH 3.27Å; P188-Y196 WeakPolarHBondContact CG-OH 3.31Å
189	R	84	Confident	87.9	Confident	174 Å²	174	58.6 Å²	58.6	66%	0.657	33%	0.328	S	S	*	.			trans	-136.9	111.7	179.6	-171.2	-174.4	-59.2	163.6	2.8	110.8	V187 S191 G192	V187-R189 VanDerWaalsContact C-N 3.32Å; V187-R189 WeakPolarHBondContact CG1-O 3.34Å; V187-R189 PolarHBondContact O-N 3Å; R189-S191 PolarHBondContact O-N 3.28Å; R189-G192 PolarHBondContact O-N 3.49Å
190	V	84.9	Confident	87.8	Confident	73 Å²	73	56.5 Å²	56.5	44%	0.442	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-61.6	-30.7	-178.8	-173.6	0	0	0	0	112.2	G192 L193	V190-G192 PolarHBondContact O-N 2.99Å; V190-G192 VanDerWaalsContact O-N 3.17Å; V190-L193 WeakPolarHBondContact O-CB 3.45Å; V190-L193 PolarHBondContact O-N 2.67Å
191	S	88.1	Confident	87.8	Confident	114 Å²	114	56 Å²	56	80%	0.797	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-59.6	-27.2	175.5	-43.1	0	0	0	0	113.4	R189	R189-S191 PolarHBondContact O-N 3.28Å
192	G	85.8	Confident	87.9	Confident	15 Å²	15	58.7 Å²	58.7	16%	0.155	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-93.4	11.2	176.5	0	0	0	0	0	113.9	R189 V190 I194 Q195 Y196	R189-G192 PolarHBondContact O-N 3.49Å; V190-G192 PolarHBondContact O-N 2.99Å; V190-G192 VanDerWaalsContact O-N 3.17Å; G192-I194 VanDerWaalsContact C-N 3.3Å; G192-I194 PolarHBondContact O-N 3.08Å; G192-Q195 VanDerWaalsContact O-CB 3.32Å; G192-Q195 WeakPolarHBondContact O-CB 3.41Å; G192-Q195 PolarHBondContact O-N 3.36Å; G192-Y196 WeakPolarHBondContact O-CD2 3.45Å; G192-Y196 PolarHBondContact O-N 3.04Å
193	L	89.9	Confident	87.8	Confident	38 Å²	38	59.3 Å²	59.3	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-52.9	-45.6	-171.5	176.9	59.1	0	0	0	112.7	L149 V187 V190 Q195 Y196 L197	L149-L193 HydrophobicContact CD1-CD2 4.36Å; L149-L193 HydrophobicContact CD2-CD1 3.64Å; L149-L193 HydrophobicContact CD2-CD2 4.2Å; V187-L193 HydrophobicContact CG2-CD1 4.02Å; V190-L193 WeakPolarHBondContact O-CB 3.45Å; V190-L193 PolarHBondContact O-N 2.67Å; L193-Q195 VanDerWaalsContact C-N 3.26Å; L193-Q195 PolarHBondContact O-N 2.79Å; L193-Y196 PolarHBondContact O-N 2.99Å; L193-Y196 VanDerWaalsContact O-N 3.17Å; L193-L197 HydrophobicContact CD1-CD1 4.18Å; L193-L197 HydrophobicContact CD1-CD2 4.37Å; L193-L197 HydrophobicContact CD1-CG 4Å; L193-L197 HydrophobicContact CG-CD1 3.94Å; L193-L197 HydrophobicContact CG-CG 4.21Å; L193-L197 WeakPolarHBondContact O-CG 3.46Å; L193-L197 PolarHBondContact O-N 2.79Å
194	I	91.3	Very high	87.6	Confident	108 Å²	108	61.2 Å²	61.2	55%	0.554	33%	0.331	S	S	*	.	H	α-helix	trans	-60.6	-37.4	179.9	-172.2	58.2	0	0	0	112.2	G192 L197 L198	G192-I194 VanDerWaalsContact C-N 3.3Å; G192-I194 PolarHBondContact O-N 3.08Å; I194-L197 PolarHBondContact O-N 2.84Å; I194-L198 HydrophobicContact CD1-CD1 4.06Å; I194-L198 HydrophobicContact CD1-CG 4.05Å; I194-L198 HydrophobicContact CG1-CD1 3.89Å; I194-L198 HydrophobicContact CG1-CG 4.3Å; I194-L198 WeakPolarHBondContact O-CB 3.46Å; I194-L198 VanDerWaalsContact O-CG 3.27Å; I194-L198 WeakPolarHBondContact O-CG 3.35Å; I194-L198 PolarHBondContact O-N 2.99Å
195	Q	91.5	Very high	87	Confident	136 Å²	136	62 Å²	62	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-63.2	-46.3	177.2	-175.1	179.3	4	0	0	110.4	G192 L193 L198 S199	G192-Q195 VanDerWaalsContact O-CB 3.32Å; G192-Q195 WeakPolarHBondContact O-CB 3.41Å; G192-Q195 PolarHBondContact O-N 3.36Å; L193-Q195 VanDerWaalsContact C-N 3.26Å; L193-Q195 PolarHBondContact O-N 2.79Å; Q195-L198 PolarHBondContact O-N 3.41Å; Q195-S199 VanDerWaalsContact O-CB 3.27Å; Q195-S199 WeakPolarHBondContact O-CB 3.45Å; Q195-S199 PolarHBondContact O-N 3.48Å; Q195-S199 PolarHBondContact O-OG 3.21Å
196	Y	89.5	Confident	86.7	Confident	60 Å²	60	69.5 Å²	69.5	24%	0.235	37%	0.371	C	S	.	.	H	α-helix	trans	-63.8	-41.4	176.6	-66.9	-69	0	0	0	112.6	L185 V187 P188 G192 L193 L198 S199 V200	L185-Y196 HydrophobicContact CD2-CD1 3.92Å; L185-Y196 HydrophobicContact CD2-CG 4.19Å; V187-Y196 HydrophobicContact CG1-CD2 3.81Å; V187-Y196 HydrophobicContact CG1-CE2 4.01Å; P188-Y196 HydrophobicContact CG-CE2 4.41Å; P188-Y196 VanDerWaalsContact CG-OH 3.27Å; P188-Y196 WeakPolarHBondContact CG-OH 3.31Å; G192-Y196 WeakPolarHBondContact O-CD2 3.45Å; G192-Y196 PolarHBondContact O-N 3.04Å; L193-Y196 PolarHBondContact O-N 2.99Å; L193-Y196 VanDerWaalsContact O-N 3.17Å; Y196-L198 VanDerWaalsContact C-N 3.35Å; Y196-L198 PolarHBondContact O-N 3.32Å; Y196-S199 PolarHBondContact O-N 3.4Å; Y196-V200 WeakPolarHBondContact O-CB 3.42Å; Y196-V200 PolarHBondContact O-N 3.05Å
197	L	91.5	Very high	86.5	Confident	38 Å²	38	72.9 Å²	72.9	20%	0.199	39%	0.389	C	S	.	.	I	π-helix	trans	-59.9	-45.5	176.5	-69.1	178	0	0	0	111.6	L115 I117 L193 I194 F201 L202	L115-L197 HydrophobicContact CD2-CD2 4.14Å; I117-L197 HydrophobicContact CD1-CD1 4.49Å; I117-L197 HydrophobicContact CD1-CD2 4.19Å; L193-L197 HydrophobicContact CD1-CD1 4.18Å; L193-L197 HydrophobicContact CD1-CD2 4.37Å; L193-L197 HydrophobicContact CD1-CG 4Å; L193-L197 HydrophobicContact CG-CD1 3.94Å; L193-L197 HydrophobicContact CG-CG 4.21Å; L193-L197 WeakPolarHBondContact O-CG 3.46Å; L193-L197 PolarHBondContact O-N 2.79Å; I194-L197 PolarHBondContact O-N 2.84Å; L197-F201 HydrophobicContact CD2-CD2 3.93Å; L197-F201 HydrophobicContact CD2-CE2 4.45Å; L197-F201 PolarHBondContact O-N 3.06Å; L197-L202 PolarHBondContact O-N 3.35Å; L197-L202 VanDerWaalsContact O-N 3.1Å
198	L	90.5	Very high	86.2	Confident	94 Å²	94	74.1 Å²	74.1	49%	0.492	39%	0.393	S	S	.	.	I	π-helix	trans	-74.8	-36.1	-179.7	-65.4	174.6	0	0	0	112.9	I194 Q195 Y196 L202	I194-L198 HydrophobicContact CD1-CD1 4.06Å; I194-L198 HydrophobicContact CD1-CG 4.05Å; I194-L198 HydrophobicContact CG1-CD1 3.89Å; I194-L198 HydrophobicContact CG1-CG 4.3Å; I194-L198 WeakPolarHBondContact O-CB 3.46Å; I194-L198 VanDerWaalsContact O-CG 3.27Å; I194-L198 WeakPolarHBondContact O-CG 3.35Å; I194-L198 PolarHBondContact O-N 2.99Å; Q195-L198 PolarHBondContact O-N 3.41Å; Y196-L198 VanDerWaalsContact C-N 3.35Å; Y196-L198 PolarHBondContact O-N 3.32Å; L198-L202 HydrophobicContact CD2-CD2 3.9Å; L198-L202 WeakPolarHBondContact O-CB 3.43Å
199	S	87.3	Confident	86	Confident	65 Å²	65	75.4 Å²	75.4	46%	0.455	40%	0.4	S	S	.	.	I	π-helix	trans	-82.1	-34.9	-175.9	70.3	0	0	0	0	113.4	Q195 Y196	Q195-S199 VanDerWaalsContact O-CB 3.27Å; Q195-S199 WeakPolarHBondContact O-CB 3.45Å; Q195-S199 PolarHBondContact O-N 3.48Å; Q195-S199 PolarHBondContact O-OG 3.21Å; Y196-S199 PolarHBondContact O-N 3.4Å
200	V	87	Confident	85.9	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.006	40%	0.404	C	S	.	.	I	π-helix	trans	-103	-46.1	-172.3	-177.6	0	0	0	0	112.3	I183 L185 Y196 L213 P214	I183-V200 HydrophobicContact CD1-CG1 3.98Å; I183-V200 HydrophobicContact CG2-CG1 3.82Å; L185-V200 HydrophobicContact CD2-CB 4.4Å; L185-V200 HydrophobicContact CD2-CG1 4.45Å; L185-V200 HydrophobicContact CD2-CG2 4.06Å; Y196-V200 WeakPolarHBondContact O-CB 3.42Å; Y196-V200 PolarHBondContact O-N 3.05Å; V200-L213 HydrophobicContact CG1-CD2 4.4Å; V200-P214 HydrophobicContact CG2-CG 3.91Å
201	F	89.6	Confident	85.6	Confident	10 Å²	10	72.1 Å²	72.1	4%	0.044	40%	0.4	C	S	.	.	I	π-helix	trans	-98.6	-21.2	-168	-62.2	-68.3	0	0	0	114.2	L115 D145 C147 I183 L185 L197	L115-F201 HydrophobicContact CD1-CB 4.29Å; L115-F201 HydrophobicContact CD1-CD1 3.64Å; L115-F201 HydrophobicContact CD1-CD2 4.22Å; L115-F201 HydrophobicContact CD1-CE1 3.89Å; L115-F201 HydrophobicContact CD1-CE2 4.43Å; L115-F201 HydrophobicContact CD1-CG 3.79Å; L115-F201 HydrophobicContact CD1-CZ 4.26Å; L115-F201 HydrophobicContact CD2-CB 4.29Å; D145-F201 HydrophobicContact CB-CD1 3.62Å; D145-F201 HydrophobicContact CB-CE1 3.71Å; C147-F201 HydrophobicContact CB-CE2 3.72Å; C147-F201 HydrophobicContact CB-CZ 3.79Å; I183-F201 HydrophobicContact CB-CE1 4.11Å; I183-F201 HydrophobicContact CG2-CE1 4.22Å; L185-F201 HydrophobicContact CB-CE2 4.18Å; L185-F201 HydrophobicContact CB-CZ 3.74Å; L185-F201 HydrophobicContact CD2-CE2 3.97Å; L185-F201 HydrophobicContact CD2-CZ 4.36Å; L197-F201 HydrophobicContact CD2-CD2 3.93Å; L197-F201 HydrophobicContact CD2-CE2 4.45Å; L197-F201 PolarHBondContact O-N 3.06Å
202	L	89	Confident	84.9	Confident	107 Å²	107	75.4 Å²	75.4	56%	0.56	41%	0.408	S	S	*	.	S	Bend	trans	-66.4	-43.5	176.7	-167.3	69.1	0	0	0	113.9	R113 L197 L198	R113-L202 PolarHBondContact NH1-O 2.93Å; L197-L202 PolarHBondContact O-N 3.35Å; L197-L202 VanDerWaalsContact O-N 3.1Å; L198-L202 HydrophobicContact CD2-CD2 3.9Å; L198-L202 WeakPolarHBondContact O-CB 3.43Å
203	P	86.3	Confident	84.3	Confident	25 Å²	25	77 Å²	77	16%	0.162	41%	0.413	C	S	.	.	S	Bend	trans	-54.7	143.2	-179.7	-26.2	35.6	0	0	0	113	L211	P203-L211 HydrophobicContact CB-CD1 3.58Å; P203-L211 HydrophobicContact CG-CD1 3.64Å
204	S	83	Confident	83.3	Confident	51 Å²	51	78.1 Å²	78.1	36%	0.357	42%	0.422	S	S	.	.			trans	-64.8	151.9	177.1	72.3	0	0	0	0	111.2	K206 M207 R208	S204-K206 PolarHBondContact O-N 2.92Å; S204-K206 VanDerWaalsContact O-N 3.12Å; S204-M207 PolarHBondContact O-N 3.13Å; S204-M207 WeakPolarHBondContact OG-CG 3.42Å; S204-R208 PolarHBondContact O-N 3.33Å
205	S	77.6	Confident	81.8	Confident	37 Å²	37	76.8 Å²	76.8	26%	0.259	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-56	-33.7	-177.6	-48.9	0	0	0	0	113.1	M207 R208	S205-M207 VanDerWaalsContact C-N 3.34Å; S205-M207 PolarHBondContact O-N 2.75Å; S205-R208 PolarHBondContact O-N 3.23Å
206	K	80.3	Confident	80.1	Confident	175 Å²	175	72.2 Å²	72.2	76%	0.761	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-67.5	-31.3	178.2	-62.6	-178.3	-177.4	178.7	0	113.2	S204 T209	S204-K206 PolarHBondContact O-N 2.92Å; S204-K206 VanDerWaalsContact O-N 3.12Å; K206-T209 PolarHBondContact O-OG1 2.97Å
207	M	82	Confident	78.3	Confident	109 Å²	109	77.6 Å²	77.6	54%	0.537	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-82.6	-16.8	-177.2	-67.1	173.9	72.5	0	0	112.9	S204 S205 T209 S210 L211	S204-M207 PolarHBondContact O-N 3.13Å; S204-M207 WeakPolarHBondContact OG-CG 3.42Å; S205-M207 VanDerWaalsContact C-N 3.34Å; S205-M207 PolarHBondContact O-N 2.75Å; M207-T209 PolarHBondContact O-N 3.05Å; M207-S210 PolarHBondContact O-N 2.76Å; M207-L211 PolarHBondContact O-N 3.48Å
208	R	80.8	Confident	75.9	Confident	25 Å²	25	79.8 Å²	79.8	9%	0.094	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-59.8	-32.2	-175.6	-68.8	175.7	-177.3	-175.9	-2.7	113.6	D145 I183 S204 S205 S210 L211 L213	D145-R208 IonicContact OD1-CZ 2.77Å; D145-R208 IonicContact OD1-NH1 3.4Å; D145-R208 PolarHBondContact OD1-NH1 2.83Å; D145-R208 IonicContact OD1-NH2 3.41Å; D145-R208 PolarHBondContact OD1-NH2 3.48Å; D145-R208 IonicContact OD2-CZ 3.1Å; D145-R208 IonicContact OD2-NH1 2.66Å; D145-R208 PolarHBondContact OD2-NH1 3.42Å; D145-R208 IonicContact OD2-NH2 3.45Å; D145-R208 PolarHBondContact OD2-NH2 3.3Å; I183-R208 HydrophobicContact CD1-CG 4.35Å; S204-R208 PolarHBondContact O-N 3.33Å; S205-R208 PolarHBondContact O-N 3.23Å; R208-S210 PolarHBondContact O-N 3.2Å; R208-L211 PolarHBondContact O-N 3.2Å; R208-L213 HydrophobicContact CB-CD1 4.16Å; R208-L213 HydrophobicContact CG-CD1 4.33Å
209	T	76.4	Confident	73.7	Confident	129 Å²	129	77.4 Å²	77.4	79%	0.791	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-67.3	-22.1	177.6	54.5	0	0	0	0	113.1	K206 M207	K206-T209 PolarHBondContact O-OG1 2.97Å; M207-T209 PolarHBondContact O-N 3.05Å
210	S	82	Confident	71.6	Confident	106 Å²	106	80.2 Å²	80.2	74%	0.741	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-96.6	-9	178.9	-54	0	0	0	0	113	M207 R208	M207-S210 PolarHBondContact O-N 2.76Å; R208-S210 PolarHBondContact O-N 3.2Å
211	L	77.4	Confident	69.5	Low	71 Å²	71	87.4 Å²	87.4	37%	0.372	49%	0.486	S	S	.	.	S	Bend	trans	-100.2	138.9	-178.3	-65.9	174.6	0	0	0	110.3	P203 M207 R208 L213	P203-L211 HydrophobicContact CB-CD1 3.58Å; P203-L211 HydrophobicContact CG-CD1 3.64Å; M207-L211 PolarHBondContact O-N 3.48Å; R208-L211 PolarHBondContact O-N 3.2Å; L211-L213 HydrophobicContact CB-CD2 4.25Å; L211-L213 HydrophobicContact CB-CG 4.4Å; L211-L213 PolarHBondContact O-N 3.35Å; L211-L213 VanDerWaalsContact O-N 3.16Å
212	L	74	Confident	67.6	Low	183 Å²	183	88.8 Å²	88.8	96%	0.958	50%	0.497	S	S	*	.			trans	-77.5	97.8	165.9	-66.6	172.8	0	0	0	108.1
213	L	74	Confident	65.9	Low	49 Å²	49	92.6 Å²	92.6	26%	0.257	51%	0.51	S	S	.	.			trans	-84.8	150.7	176	-62.9	174.4	0	0	0	110.2	I183 V200 R208 L211 D215	I183-L213 HydrophobicContact CD1-CD1 3.59Å; I183-L213 HydrophobicContact CG1-CD1 4.12Å; V200-L213 HydrophobicContact CG1-CD2 4.4Å; R208-L213 HydrophobicContact CB-CD1 4.16Å; R208-L213 HydrophobicContact CG-CD1 4.33Å; L211-L213 HydrophobicContact CB-CD2 4.25Å; L211-L213 HydrophobicContact CB-CG 4.4Å; L211-L213 PolarHBondContact O-N 3.35Å; L211-L213 VanDerWaalsContact O-N 3.16Å; L213-D215 PolarHBondContact O-N 3.06Å
214	P	69.1	Low	64.9	Low	61 Å²	61	94.3 Å²	94.3	40%	0.396	53%	0.532	S	S	.	.			trans	-51	136.1	169.3	-23.1	33	0	0	0	109.6	L185 V200 S216	L185-P214 HydrophobicContact CD1-CB 4.15Å; L185-P214 HydrophobicContact CD1-CG 4.49Å; V200-P214 HydrophobicContact CG2-CG 3.91Å; P214-S216 PolarHBondContact O-N 3.13Å
215	D	58.8	Low	64.2	Low	81 Å²	81	93.2 Å²	93.2	43%	0.433	52%	0.523	S	S	.	.			trans	-64.9	98.1	-166.6	-162.2	-7.6	0	0	0	111.8	L213 R217 S218 S219	L213-D215 PolarHBondContact O-N 3.06Å; D215-R217 PolarHBondContact OD1-N 3.27Å; D215-S218 VanDerWaalsContact CG-C 3.41Å; D215-S218 VanDerWaalsContact OD1-CA 3.29Å; D215-S218 WeakPolarHBondContact OD1-CA 3.38Å; D215-S218 PolarHBondContact OD1-N 3.28Å; D215-S218 PolarHBondContact OD1-OG 2.66Å; D215-S218 WeakPolarHBondContact OD2-CA 3.12Å; D215-S218 PolarHBondContact OD2-OG 3.02Å; D215-S219 PolarHBondContact OD1-N 2.88Å; D215-S219 WeakPolarHBondContact OD2-CA 3.26Å; D215-S219 PolarHBondContact OD2-N 2.99Å
216	S	55.8	Low	64.1	Low	40 Å²	40	93.5 Å²	93.5	28%	0.28	52%	0.522	S	S	.	.	S	Bend	trans	-88.8	-14	177.4	62.7	0	0	0	0	112.6	Y184 P214	Y184-S216 VanDerWaalsContact O-CB 3.24Å; Y184-S216 WeakPolarHBondContact O-CB 3.05Å; P214-S216 PolarHBondContact O-N 3.13Å
217	R	50.9	Low	64	Low	172 Å²	172	90.7 Å²	90.7	65%	0.649	51%	0.509	S	S	*	.	S	Bend	trans	-123.6	-32.7	-167.7	-78.3	-177.1	153	171.2	-5.1	114.6	D178 D215	D178-R217 IonicContact OD1-CZ 2.72Å; D178-R217 IonicContact OD1-NE 3.4Å; D178-R217 PolarHBondContact OD1-NE 3.26Å; D178-R217 IonicContact OD1-NH2 2.75Å; D178-R217 PolarHBondContact OD1-NH2 2.82Å; D215-R217 PolarHBondContact OD1-N 3.27Å
218	S	43.1	Very low	64.1	Low	85 Å²	85	90.3 Å²	90.3	59%	0.594	50%	0.502	S	S	*	.			trans	-121	12.7	-171.6	68.8	0	0	0	0	114.5	D215 S220	D215-S218 VanDerWaalsContact CG-C 3.41Å; D215-S218 VanDerWaalsContact OD1-CA 3.29Å; D215-S218 WeakPolarHBondContact OD1-CA 3.38Å; D215-S218 PolarHBondContact OD1-N 3.28Å; D215-S218 PolarHBondContact OD1-OG 2.66Å; D215-S218 WeakPolarHBondContact OD2-CA 3.12Å; D215-S218 PolarHBondContact OD2-OG 3.02Å; S218-S220 PolarHBondContact O-N 3.21Å
219	S	43.3	Very low	64	Low	44 Å²	44	90.4 Å²	90.4	31%	0.308	51%	0.508	S	S	.	.			trans	-60.5	113.6	170.1	89.5	0	0	0	0	104.5	D215 L221 S222	D215-S219 PolarHBondContact OD1-N 2.88Å; D215-S219 WeakPolarHBondContact OD2-CA 3.26Å; D215-S219 PolarHBondContact OD2-N 2.99Å; S219-L221 PolarHBondContact O-N 3.34Å; S219-S222 PolarHBondContact O-N 2.68Å; S219-S222 PolarHBondContact O-OG 3.13Å; S219-S222 WeakPolarHBondContact OG-CA 3.05Å; S219-S222 WeakPolarHBondContact OG-CB 3.34Å; S219-S222 PolarHBondContact OG-N 3.15Å; S219-S222 PolarHBondContact OG-OG 3.46Å
220	S	42.9	Very low	64.4	Low	124 Å²	124	84.6 Å²	84.6	87%	0.867	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-5.5	-175.1	172.3	0	0	0	0	112.5	S218	S218-S220 PolarHBondContact O-N 3.21Å
221	L	44.1	Very low	64.7	Low	152 Å²	152	79.6 Å²	79.6	80%	0.796	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-15.3	171.8	-80.3	99.7	0	0	0	114.8	S219 F223	S219-L221 PolarHBondContact O-N 3.34Å; L221-F223 VanDerWaalsContact C-N 3.26Å; L221-F223 WeakPolarHBondContact O-CD2 3.46Å; L221-F223 PolarHBondContact O-N 3.05Å
222	S	49.8	Very low	65	Low	38 Å²	38	78.3 Å²	78.3	27%	0.266	43%	0.43	S	S	.	.	S	Bend	trans	-75.4	92	164.1	57.9	0	0	0	0	106.4	S219 G224	S219-S222 PolarHBondContact O-N 2.68Å; S219-S222 PolarHBondContact O-OG 3.13Å; S219-S222 WeakPolarHBondContact OG-CA 3.05Å; S219-S222 WeakPolarHBondContact OG-CB 3.34Å; S219-S222 PolarHBondContact OG-N 3.15Å; S219-S222 PolarHBondContact OG-OG 3.46Å; S222-G224 PolarHBondContact O-N 3.43Å; S222-G224 VanDerWaalsContact O-N 3.11Å
223	F	52.3	Low	65.4	Low	188 Å²	188	73 Å²	73	83%	0.825	41%	0.407	S	S	*	.			trans	-29.6	122.5	152	-69.6	-92.3	0	0	0	107.5	L221	L221-F223 VanDerWaalsContact C-N 3.26Å; L221-F223 WeakPolarHBondContact O-CD2 3.46Å; L221-F223 PolarHBondContact O-N 3.05Å
224	G	64.6	Low	65.8	Low	61 Å²	61	75.6 Å²	75.6	63%	0.629	42%	0.418	S	S	*	.			trans	-47	161.7	180	0	0	0	0	0	111.2	S222 D226	S222-G224 PolarHBondContact O-N 3.43Å; S222-G224 VanDerWaalsContact O-N 3.11Å; G224-D226 PolarHBondContact O-N 2.63Å
225	V	70.1	Confident	66.4	Low	27 Å²	27	76.1 Å²	76.1	16%	0.164	41%	0.414	C	S	.	.			trans	-44.6	120.7	-178.8	-174.4	0	0	0	0	110.1	Q174 Q175 D178 F227	Q174-V225 HydrophobicContact CB-CG1 4.37Å; Q174-V225 HydrophobicContact CG-CB 4.38Å; Q174-V225 HydrophobicContact CG-CG1 4.1Å; Q174-V225 HydrophobicContact CG-CG2 3.96Å; Q175-V225 HydrophobicContact CB-CG1 4.19Å; Q175-V225 HydrophobicContact CG-CG1 3.56Å; D178-V225 HydrophobicContact CB-CG2 4.06Å; V225-F227 HydrophobicContact CB-CD2 4.23Å; V225-F227 HydrophobicContact CB-CE1 4.22Å; V225-F227 HydrophobicContact CB-CE2 3.64Å; V225-F227 HydrophobicContact CB-CZ 3.63Å; V225-F227 HydrophobicContact CG1-CD1 4.2Å; V225-F227 HydrophobicContact CG1-CD2 4.47Å; V225-F227 HydrophobicContact CG1-CE1 3.78Å; V225-F227 HydrophobicContact CG1-CE2 4.09Å; V225-F227 HydrophobicContact CG1-CZ 3.72Å; V225-F227 HydrophobicContact CG2-CZ 4.3Å; V225-F227 WeakPolarHBondContact O-CD2 3.43Å; V225-F227 WeakPolarHBondContact O-CE2 3.38Å; V225-F227 PolarHBondContact O-N 3.45Å
226	D	74.3	Confident	67.5	Low	44 Å²	44	79.9 Å²	79.9	24%	0.235	42%	0.422	C	S	.	.			trans	-74.3	99.6	179.7	177.9	4.4	0	0	0	108.7	Q175 G224 R228	Q175-D226 PolarHBondContact NE2-O 3.17Å; G224-D226 PolarHBondContact O-N 2.63Å; D226-R228 VanDerWaalsContact C-N 3.29Å; D226-R228 VanDerWaalsContact CG-NE 3.34Å; D226-R228 PolarHBondContact O-N 3.44Å; D226-R228 VanDerWaalsContact OD1-CB 3.26Å; D226-R228 WeakPolarHBondContact OD1-CB 3.04Å; D226-R228 WeakPolarHBondContact OD1-CG 3.25Å; D226-R228 IonicContact OD1-CZ 3.85Å; D226-R228 PolarHBondContact OD1-N 3.09Å; D226-R228 VanDerWaalsContact OD1-N 3.13Å; D226-R228 IonicContact OD1-NE 2.88Å; D226-R228 PolarHBondContact OD1-NE 3.35Å; D226-R228 IonicContact OD1-NH2 4Å; D226-R228 IonicContact OD2-CZ 3.24Å; D226-R228 VanDerWaalsContact OD2-CZ 3.24Å; D226-R228 IonicContact OD2-NE 3.02Å; D226-R228 PolarHBondContact OD2-NE 3.46Å; D226-R228 IonicContact OD2-NH2 2.66Å; D226-R228 PolarHBondContact OD2-NH2 3.21Å
227	F	78.4	Confident	68.8	Low	115 Å²	115	80.5 Å²	80.5	50%	0.504	42%	0.422	S	S	.	.			trans	-86.8	14.2	-178.9	-67.3	-72.7	0	0	0	114.1	Q175 V225 A229	Q175-F227 HydrophobicContact CG-CD1 3.96Å; Q175-F227 HydrophobicContact CG-CE1 4.24Å; V225-F227 HydrophobicContact CB-CD2 4.23Å; V225-F227 HydrophobicContact CB-CE1 4.22Å; V225-F227 HydrophobicContact CB-CE2 3.64Å; V225-F227 HydrophobicContact CB-CZ 3.63Å; V225-F227 HydrophobicContact CG1-CD1 4.2Å; V225-F227 HydrophobicContact CG1-CD2 4.47Å; V225-F227 HydrophobicContact CG1-CE1 3.78Å; V225-F227 HydrophobicContact CG1-CE2 4.09Å; V225-F227 HydrophobicContact CG1-CZ 3.72Å; V225-F227 HydrophobicContact CG2-CZ 4.3Å; V225-F227 WeakPolarHBondContact O-CD2 3.43Å; V225-F227 WeakPolarHBondContact O-CE2 3.38Å; V225-F227 PolarHBondContact O-N 3.45Å; F227-A229 PolarHBondContact O-N 2.98Å
228	R	83.3	Confident	70.5	Confident	102 Å²	102	73.8 Å²	73.8	39%	0.385	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-58.4	133	177	-72.6	-179.6	-59.7	167.4	2.2	110.8	D226 L237 I238	D226-R228 VanDerWaalsContact C-N 3.29Å; D226-R228 VanDerWaalsContact CG-NE 3.34Å; D226-R228 PolarHBondContact O-N 3.44Å; D226-R228 VanDerWaalsContact OD1-CB 3.26Å; D226-R228 WeakPolarHBondContact OD1-CB 3.04Å; D226-R228 WeakPolarHBondContact OD1-CG 3.25Å; D226-R228 IonicContact OD1-CZ 3.85Å; D226-R228 PolarHBondContact OD1-N 3.09Å; D226-R228 VanDerWaalsContact OD1-N 3.13Å; D226-R228 IonicContact OD1-NE 2.88Å; D226-R228 PolarHBondContact OD1-NE 3.35Å; D226-R228 IonicContact OD1-NH2 4Å; D226-R228 IonicContact OD2-CZ 3.24Å; D226-R228 VanDerWaalsContact OD2-CZ 3.24Å; D226-R228 IonicContact OD2-NE 3.02Å; D226-R228 PolarHBondContact OD2-NE 3.46Å; D226-R228 IonicContact OD2-NH2 2.66Å; D226-R228 PolarHBondContact OD2-NH2 3.21Å; R228-L237 HydrophobicContact CB-CB 4.32Å; R228-I238 WeakPolarHBondContact CB-O 3.21Å
229	A	79.4	Confident	72.4	Confident	27 Å²	27	76.3 Å²	76.3	22%	0.223	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	148.2	-179.8	0	0	0	0	0	111.3	F227 L237 I238 V250	F227-A229 PolarHBondContact O-N 2.98Å; A229-L237 WeakPolarHBondContact O-CA 3.4Å; A229-I238 VanDerWaalsContact O-CG1 3.3Å; A229-I238 WeakPolarHBondContact O-CG1 3.45Å; A229-I238 PolarHBondContact O-N 3.37Å; A229-V250 HydrophobicContact CB-CG1 4.42Å; A229-V250 HydrophobicContact CB-CG2 4.07Å
230	A	85.2	Confident	74.5	Confident	6 Å²	6	81.3 Å²	81.3	5%	0.05	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.2	171.2	0	0	0	0	0	111.1	Y127 R236 L237	Y127-A230 HydrophobicContact CD1-CB 3.63Å; Y127-A230 HydrophobicContact CD2-CB 4.47Å; Y127-A230 HydrophobicContact CE1-CB 4.44Å; Y127-A230 HydrophobicContact CG-CB 3.65Å; A230-R236 CarbonylContact C-O 3.59Å; A230-R236 WeakPolarHBondContact CA-O 3.3Å; A230-L237 HydrophobicContact CB-CD2 4.14Å
231	C	87.4	Confident	76.7	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.007	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-61.5	135.6	174.9	170	0	0	0	0	111.3	C233 K235 R236 I238 V250 C252	C231-C233 VanDerWaalsContact C-N 3.31Å; C231-C233 PolarHBondContact O-N 2.57Å; C231-C233 PolarHBondContact SG-N 3.49Å; C231-C233 VanDerWaalsContact SG-N 3.37Å; C231-K235 WeakPolarHBondContact O-CA 3.07Å; C231-K235 PolarHBondContact O-N 2.93Å; C231-R236 PolarHBondContact N-O 3.39Å; C231-I238 HydrophobicContact CB-CD1 3.86Å; C231-I238 HydrophobicContact CB-CG1 4.09Å; C231-I238 HydrophobicContact CB-CG2 4.19Å; C231-V250 CarbonylContact C-O 3.58Å; C231-V250 WeakPolarHBondContact CA-O 3.38Å; C231-C252 HydrophobicContact CB-CB 4.44Å; C231-C252 PolarHBondContact SG-N 3.44Å; C231-C252 VanDerWaalsContact SG-N 3.36Å; C231-C252 VanDerWaalsContact SG-SG 3.67Å
232	F	84.1	Confident	78.9	Confident	45 Å²	45	75.5 Å²	75.5	20%	0.197	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-26.9	-179.2	-85.9	-116.6	0	0	0	113.5	L128 K235 V250 F251	L128-F232 HydrophobicContact CD1-CE2 4.28Å; L128-F232 HydrophobicContact CD1-CZ 3.64Å; L128-F232 HydrophobicContact CD2-CD1 4.48Å; L128-F232 HydrophobicContact CD2-CE1 3.41Å; L128-F232 VanDerWaalsContact CD2-CE1 3.41Å; L128-F232 HydrophobicContact CD2-CE2 4.43Å; L128-F232 HydrophobicContact CD2-CZ 3.39Å; L128-F232 HydrophobicContact CG-CZ 4.08Å; F232-K235 PolarHBondContact O-NZ 3.35Å; F232-V250 PolarHBondContact N-O 3.28Å; F232-F251 HydrophobicContact CB-CD1 4.28Å; F232-F251 HydrophobicContact CB-CE1 3.9Å
233	C	82.4	Confident	80.7	Confident	71 Å²	71	77.7 Å²	77.7	48%	0.48	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-53.5	-179.5	-51.8	0	0	0	0	112.2	C231	C231-C233 VanDerWaalsContact C-N 3.31Å; C231-C233 PolarHBondContact O-N 2.57Å; C231-C233 PolarHBondContact SG-N 3.49Å; C231-C233 VanDerWaalsContact SG-N 3.37Å
234	H	81.9	Confident	82.5	Confident	104 Å²	104	68.8 Å²	68.8	48%	0.481	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-7	-171.1	-52.9	114.3	0	0	0	113.7	R236	H234-R236 VanDerWaalsContact C-N 3.26Å; H234-R236 HydrophobicContact CB-CG 4.24Å; H234-R236 PolarHBondContact O-N 2.82Å
235	K	81.7	Confident	83.5	Confident	72 Å²	72	70.8 Å²	70.8	31%	0.313	36%	0.362	S	S	.	.			trans	57.1	35.2	-172.1	-49.9	-53.1	-175	-158.4	0	114.1	S124 C231 F232	S124-K235 WeakPolarHBondContact CB-O 3.04Å; S124-K235 PolarHBondContact OG-O 2.83Å; C231-K235 WeakPolarHBondContact O-CA 3.07Å; C231-K235 PolarHBondContact O-N 2.93Å; F232-K235 PolarHBondContact O-NZ 3.35Å
236	R	82.8	Confident	84.5	Confident	160 Å²	160	73.9 Å²	73.9	60%	0.604	38%	0.381	S	S	*	.			trans	-103	145.3	174.2	-67.6	-173.5	-69.6	168.9	-1.7	110.2	A230 C231 H234 I238	A230-R236 CarbonylContact C-O 3.59Å; A230-R236 WeakPolarHBondContact CA-O 3.3Å; C231-R236 PolarHBondContact N-O 3.39Å; H234-R236 VanDerWaalsContact C-N 3.26Å; H234-R236 HydrophobicContact CB-CG 4.24Å; H234-R236 PolarHBondContact O-N 2.82Å; R236-I238 PolarHBondContact O-N 2.96Å
237	L	82.7	Confident	85.1	Confident	53 Å²	53	73.8 Å²	73.8	28%	0.277	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	130	172.7	-60.3	176.9	0	0	0	109.3	R228 A229 A230	R228-L237 HydrophobicContact CB-CB 4.32Å; A229-L237 WeakPolarHBondContact O-CA 3.4Å; A230-L237 HydrophobicContact CB-CD2 4.14Å
238	I	86.1	Confident	85.5	Confident	31 Å²	31	74.4 Å²	74.4	16%	0.159	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.5	179.8	50.7	162.4	0	0	0	109.7	R228 A229 C231 R236 V250 C252	R228-I238 WeakPolarHBondContact CB-O 3.21Å; A229-I238 VanDerWaalsContact O-CG1 3.3Å; A229-I238 WeakPolarHBondContact O-CG1 3.45Å; A229-I238 PolarHBondContact O-N 3.37Å; C231-I238 HydrophobicContact CB-CD1 3.86Å; C231-I238 HydrophobicContact CB-CG1 4.09Å; C231-I238 HydrophobicContact CB-CG2 4.19Å; R236-I238 PolarHBondContact O-N 2.96Å; I238-V250 HydrophobicContact CD1-CG1 3.65Å; I238-V250 HydrophobicContact CG1-CG1 4.48Å; I238-C252 HydrophobicContact CG2-CB 4.39Å
239	D	84.5	Confident	85.7	Confident	137 Å²	137	69.7 Å²	69.7	73%	0.733	37%	0.374	S	S	*	.	S	Bend	trans	-87.7	-47.9	179.1	-167.4	22.7	0	0	0	111.1
240	I	87.3	Confident	86.2	Confident	150 Å²	150	69.5 Å²	69.5	77%	0.769	37%	0.37	S	S	*	.	S	Bend	trans	-115.2	134.1	175.4	-56.2	172.1	0	0	0	108.4
241	G	88.2	Confident	86.4	Confident	30 Å²	30	69.6 Å²	69.6	31%	0.309	37%	0.369	S	S	.	.			trans	-161.2	173.3	175.7	0	0	0	0	0	113	F251	G241-F251 CarbonylContact C-O 3.59Å; G241-F251 WeakPolarHBondContact CA-O 3.21Å
242	Y	89.9	Confident	86.5	Confident	124 Å²	124	71.5 Å²	71.5	49%	0.486	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.3	179.2	-60.5	-87.1	0	0	0	109.8	V250 F251 E253 F254	Y242-V250 CarbonylContact O-C 3.52Å; Y242-V250 WeakPolarHBondContact O-CA 3.47Å; Y242-F251 PolarHBondContact N-O 3.22Å; Y242-F251 PolarHBondContact O-N 3.45Å; Y242-E253 VanDerWaalsContact CD2-C 3.42Å; Y242-F254 HydrophobicContact CD1-CB 4.19Å; Y242-F254 AromaticContact CD1-CD2 3.93Å; Y242-F254 HydrophobicContact CD1-CD2 3.93Å; Y242-F254 HydrophobicContact CD2-CB 4.1Å; Y242-F254 HydrophobicContact CE1-CB 3.9Å; Y242-F254 HydrophobicContact CE1-CD2 4.08Å; Y242-F254 HydrophobicContact CE1-CG 4.4Å; Y242-F254 HydrophobicContact CE2-CB 3.81Å; Y242-F254 VanDerWaalsContact CE2-N 3.31Å; Y242-F254 HydrophobicContact CG-CB 4.28Å; Y242-F254 HydrophobicContact CG-CD2 4.43Å
243	V	88.4	Confident	86.7	Confident	84 Å²	84	76.4 Å²	76.4	51%	0.509	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.8	-179.1	-173.7	0	0	0	0	109.6	S249 V250	V243-S249 WeakPolarHBondContact CA-O 3.41Å; V243-V250 HydrophobicContact CG2-CG1 4.3Å; V243-V250 HydrophobicContact CG2-CG2 4.16Å
244	C	88.9	Confident	87	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.402	C	S	.	.			trans	-74.9	124.4	170.5	-179.7	0	0	0	0	110.3	V246 C247 L248 S249 F251 C258 C261 F265	C244-V246 PolarHBondContact O-N 2.87Å; C244-C247 WeakPolarHBondContact CB-SG 3.36Å; C244-C247 PolarHBondContact SG-SG 3.36Å; C244-L248 WeakPolarHBondContact O-CA 3.45Å; C244-L248 PolarHBondContact O-N 2.98Å; C244-S249 PolarHBondContact N-O 2.85Å; C244-F251 HydrophobicContact CB-CE2 4.21Å; C244-C258 HydrophobicContact CB-CB 4.42Å; C244-C261 VanDerWaalsContact SG-SG 3.62Å; C244-F265 HydrophobicContact CB-CE1 3.9Å; C244-F265 HydrophobicContact CB-CZ 3.88Å
245	S	87.4	Confident	87.1	Confident	103 Å²	103	76.1 Å²	76.1	72%	0.72	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.2	178	54	0	0	0	0	114.2
246	V	89.2	Confident	87.3	Confident	93 Å²	93	76 Å²	76	56%	0.564	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-50.8	-177.6	-176.2	0	0	0	0	111.8	C244 T263	C244-V246 PolarHBondContact O-N 2.87Å; V246-T263 HydrophobicContact CG2-CG2 4Å
247	C	88.3	Confident	87.6	Confident	42 Å²	42	72.4 Å²	72.4	28%	0.284	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	1	-175.4	63.3	0	0	0	0	114.4	C244 S249 C258 C261	C244-C247 WeakPolarHBondContact CB-SG 3.36Å; C244-C247 PolarHBondContact SG-SG 3.36Å; C247-S249 PolarHBondContact O-N 2.94Å; C247-S249 PolarHBondContact O-OG 2.79Å; C247-S249 VanDerWaalsContact SG-CB 3.56Å; C247-S249 PolarHBondContact SG-OG 3.47Å; C247-C258 PolarHBondContact SG-SG 2.83Å; C247-C261 HydrophobicContact CB-CB 4.06Å
248	L	87.2	Confident	87.8	Confident	127 Å²	127	69.9 Å²	69.9	67%	0.665	38%	0.384	S	S	*	.			trans	52.4	20.3	-176.8	-56.3	178.4	0	0	0	114.1	C244	C244-L248 WeakPolarHBondContact O-CA 3.45Å; C244-L248 PolarHBondContact O-N 2.98Å
249	S	86.8	Confident	87.8	Confident	3 Å²	3	71.8 Å²	71.8	2%	0.021	40%	0.398	C	S	.	.			trans	-77.2	135.9	178.1	-61.8	0	0	0	0	110	V243 C244 C247 F251	V243-S249 WeakPolarHBondContact CA-O 3.41Å; C244-S249 PolarHBondContact N-O 2.85Å; C247-S249 PolarHBondContact O-N 2.94Å; C247-S249 PolarHBondContact O-OG 2.79Å; C247-S249 VanDerWaalsContact SG-CB 3.56Å; C247-S249 PolarHBondContact SG-OG 3.47Å; S249-F251 WeakPolarHBondContact O-CE2 3.14Å
250	V	89	Confident	87.9	Confident	23 Å²	23	68.9 Å²	68.9	14%	0.139	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.2	-175.7	-167	0	0	0	0	110.5	A229 C231 F232 I238 Y242 V243	A229-V250 HydrophobicContact CB-CG1 4.42Å; A229-V250 HydrophobicContact CB-CG2 4.07Å; C231-V250 CarbonylContact C-O 3.58Å; C231-V250 WeakPolarHBondContact CA-O 3.38Å; F232-V250 PolarHBondContact N-O 3.28Å; I238-V250 HydrophobicContact CD1-CG1 3.65Å; I238-V250 HydrophobicContact CG1-CG1 4.48Å; Y242-V250 CarbonylContact O-C 3.52Å; Y242-V250 WeakPolarHBondContact O-CA 3.47Å; V243-V250 HydrophobicContact CG2-CG1 4.3Å; V243-V250 HydrophobicContact CG2-CG2 4.16Å
251	F	89.5	Confident	88	Confident	9 Å²	9	63.9 Å²	63.9	4%	0.039	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.4	-177.2	-52.9	-65.8	0	0	0	111.5	F232 G241 Y242 C244 S249 C258 P259	F232-F251 HydrophobicContact CB-CD1 4.28Å; F232-F251 HydrophobicContact CB-CE1 3.9Å; G241-F251 CarbonylContact C-O 3.59Å; G241-F251 WeakPolarHBondContact CA-O 3.21Å; Y242-F251 PolarHBondContact N-O 3.22Å; Y242-F251 PolarHBondContact O-N 3.45Å; C244-F251 HydrophobicContact CB-CE2 4.21Å; S249-F251 WeakPolarHBondContact O-CE2 3.14Å; F251-C258 VanDerWaalsContact CZ-SG 3.59Å; F251-P259 HydrophobicContact CD1-CG 3.92Å; F251-P259 HydrophobicContact CE1-CG 3.33Å; F251-P259 HydrophobicContact CE2-CG 4.47Å; F251-P259 HydrophobicContact CZ-CG 3.65Å
252	C	90.2	Very high	87.9	Confident	41 Å²	41	68.3 Å²	68.3	28%	0.277	38%	0.38	S	S	.	.	S	Bend	trans	-80.4	-20.9	178.5	54.4	0	0	0	0	113.5	C231 I238	C231-C252 HydrophobicContact CB-CB 4.44Å; C231-C252 PolarHBondContact SG-N 3.44Å; C231-C252 VanDerWaalsContact SG-N 3.36Å; C231-C252 VanDerWaalsContact SG-SG 3.67Å; I238-C252 HydrophobicContact CG2-CB 4.39Å
253	E	89	Confident	87.8	Confident	147 Å²	147	64.7 Å²	64.7	69%	0.687	37%	0.371	S	S	*	.	S	Bend	trans	-133.2	151.9	-179	-69.5	177	-173.3	0	0	109.3	Y242	Y242-E253 VanDerWaalsContact CD2-C 3.42Å
254	F	87.1	Confident	87.8	Confident	94 Å²	94	65.1 Å²	65.1	41%	0.412	38%	0.376	S	S	.	.			trans	-73.2	134.3	175.7	178.7	-101.5	0	0	0	110	Y242 F265 L267	Y242-F254 HydrophobicContact CD1-CB 4.19Å; Y242-F254 AromaticContact CD1-CD2 3.93Å; Y242-F254 HydrophobicContact CD1-CD2 3.93Å; Y242-F254 HydrophobicContact CD2-CB 4.1Å; Y242-F254 HydrophobicContact CE1-CB 3.9Å; Y242-F254 HydrophobicContact CE1-CD2 4.08Å; Y242-F254 HydrophobicContact CE1-CG 4.4Å; Y242-F254 HydrophobicContact CE2-CB 3.81Å; Y242-F254 VanDerWaalsContact CE2-N 3.31Å; Y242-F254 HydrophobicContact CG-CB 4.28Å; Y242-F254 HydrophobicContact CG-CD2 4.43Å; F254-F265 HydrophobicContact CE2-CD2 4.35Å; F254-L267 HydrophobicContact CE1-CD2 4.2Å; F254-L267 HydrophobicContact CZ-CD2 3.79Å; F254-L267 HydrophobicContact CZ-CG 4.28Å
255	N	85.1	Confident	87.5	Confident	76 Å²	76	67.4 Å²	67.4	41%	0.406	39%	0.386	S	S	.	.			trans	-133.6	132.7	171.6	-172.9	-20	0	0	0	107.5	I257 F265	N255-I257 VanDerWaalsContact CG-O 3.24Å; N255-I257 PolarHBondContact O-N 3.42Å; N255-I257 VanDerWaalsContact O-N 3.1Å; N255-I257 PolarHBondContact OD1-N 3.14Å; N255-I257 PolarHBondContact OD1-O 3.12Å; N255-F265 WeakPolarHBondContact O-CD2 3.5Å; N255-F265 WeakPolarHBondContact O-CE2 3.38Å
256	P	85.9	Confident	87.1	Confident	70 Å²	70	70.9 Å²	70.9	46%	0.455	40%	0.395	S	S	.	.	S	Bend	trans	-59.4	-19.6	178.9	23.4	-37	0	0	0	114.3	P264 F265	P256-P264 WeakPolarHBondContact O-CA 3.19Å; P256-F265 PolarHBondContact O-N 3.07Å
257	I	88.4	Confident	86.3	Confident	83 Å²	83	71.5 Å²	71.5	43%	0.426	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-124.4	135	177.7	-57.8	170.2	0	0	0	108.6	N255 P259	N255-I257 VanDerWaalsContact CG-O 3.24Å; N255-I257 PolarHBondContact O-N 3.42Å; N255-I257 VanDerWaalsContact O-N 3.1Å; N255-I257 PolarHBondContact OD1-N 3.14Å; N255-I257 PolarHBondContact OD1-O 3.12Å; I257-P259 WeakPolarHBondContact O-CD 3.05Å
258	C	88	Confident	85.6	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	42%	0.416	C	S	.	.			trans	-67.2	120.2	174.4	-179.6	0	0	0	0	110.6	C244 C247 F251 T260 C261 N262 T263 F265	C244-C258 HydrophobicContact CB-CB 4.42Å; C247-C258 PolarHBondContact SG-SG 2.83Å; F251-C258 VanDerWaalsContact CZ-SG 3.59Å; C258-T260 PolarHBondContact O-N 3.26Å; C258-T260 VanDerWaalsContact O-N 3.12Å; C258-C261 VanDerWaalsContact CB-SG 3.51Å; C258-C261 PolarHBondContact SG-SG 3.36Å; C258-N262 WeakPolarHBondContact O-CA 3.16Å; C258-N262 PolarHBondContact O-N 2.83Å; C258-T263 PolarHBondContact N-O 2.99Å; C258-F265 HydrophobicContact CB-CE1 4.36Å; C258-F265 HydrophobicContact CB-CE2 4.28Å; C258-F265 HydrophobicContact CB-CZ 3.73Å
259	P	85.1	Confident	84.9	Confident	71 Å²	71	73 Å²	73	46%	0.461	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.9	-179.3	29.4	-37.6	0	0	0	113.7	F251 I257	F251-P259 HydrophobicContact CD1-CG 3.92Å; F251-P259 HydrophobicContact CE1-CG 3.33Å; F251-P259 HydrophobicContact CE2-CG 4.47Å; F251-P259 HydrophobicContact CZ-CG 3.65Å; I257-P259 WeakPolarHBondContact O-CD 3.05Å
260	T	86.1	Confident	84.2	Confident	77 Å²	77	78.7 Å²	78.7	47%	0.472	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-44.7	-178.4	-52.1	0	0	0	0	112.7	C258	C258-T260 PolarHBondContact O-N 3.26Å; C258-T260 VanDerWaalsContact O-N 3.12Å
261	C	89.5	Confident	82.9	Confident	44 Å²	44	85.1 Å²	85.1	30%	0.297	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-0.9	-177.9	65.3	0	0	0	0	114.2	C244 C247 C258 T263	C244-C261 VanDerWaalsContact SG-SG 3.62Å; C247-C261 HydrophobicContact CB-CB 4.06Å; C258-C261 VanDerWaalsContact CB-SG 3.51Å; C258-C261 PolarHBondContact SG-SG 3.36Å; C261-T263 PolarHBondContact O-N 2.88Å; C261-T263 PolarHBondContact SG-OG1 3.1Å
262	N	87.6	Confident	81.8	Confident	124 Å²	124	91.9 Å²	91.9	66%	0.663	52%	0.518	S	S	*	.			trans	55.7	19.1	-177.5	-67.1	-30.1	0	0	0	115.2	C258	C258-N262 WeakPolarHBondContact O-CA 3.16Å; C258-N262 PolarHBondContact O-N 2.83Å
263	T	87.7	Confident	79.6	Confident	47 Å²	47	101.3 Å²	101.3	29%	0.288	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-76.4	128.4	174.5	-47	0	0	0	0	109.8	V246 C258 C261	V246-T263 HydrophobicContact CG2-CG2 4Å; C258-T263 PolarHBondContact N-O 2.99Å; C261-T263 PolarHBondContact O-N 2.88Å; C261-T263 PolarHBondContact SG-OG1 3.1Å
264	P	87.6	Confident	79.1	Confident	94 Å²	94	99 Å²	99	61%	0.61	56%	0.555	S	S	*	*	B	Isolated β-bridge	trans	-71.7	138.2	171.4	29.7	-33.9	0	0	0	110.5	P256	P256-P264 WeakPolarHBondContact O-CA 3.19Å
265	F	83.6	Confident	78.7	Confident	48 Å²	48	99.3 Å²	99.3	21%	0.211	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-82.7	127.8	174.4	-61.1	-57	0	0	0	110.5	C244 F254 N255 P256 C258 L267	C244-F265 HydrophobicContact CB-CE1 3.9Å; C244-F265 HydrophobicContact CB-CZ 3.88Å; F254-F265 HydrophobicContact CE2-CD2 4.35Å; N255-F265 WeakPolarHBondContact O-CD2 3.5Å; N255-F265 WeakPolarHBondContact O-CE2 3.38Å; P256-F265 PolarHBondContact O-N 3.07Å; C258-F265 HydrophobicContact CB-CE1 4.36Å; C258-F265 HydrophobicContact CB-CE2 4.28Å; C258-F265 HydrophobicContact CB-CZ 3.73Å; F265-L267 PolarHBondContact O-N 3.04Å
266	L	77.3	Confident	78.4	Confident	175 Å²	175	100.6 Å²	100.6	92%	0.916	57%	0.571	S	S	*	*			trans	-72.6	99.9	173.5	-161.9	79	0	0	0	108.3
267	L	73.6	Confident	77.9	Confident	106 Å²	106	102.4 Å²	102.4	56%	0.555	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-70	129.6	171.9	-72.4	130.5	0	0	0	108.3	F254 F265 A269	F254-L267 HydrophobicContact CE1-CD2 4.2Å; F254-L267 HydrophobicContact CZ-CD2 3.79Å; F254-L267 HydrophobicContact CZ-CG 4.28Å; F265-L267 PolarHBondContact O-N 3.04Å; L267-A269 PolarHBondContact O-N 3.1Å
268	P	73.8	Confident	77.3	Confident	114 Å²	114	103.6 Å²	103.6	74%	0.74	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-54.6	127.5	168.2	-20.4	30.9	0	0	0	108.2	V270	P268-V270 PolarHBondContact O-N 3.2Å; P268-V270 VanDerWaalsContact O-N 3.1Å
269	A	72.2	Confident	76.6	Confident	87 Å²	87	110.5 Å²	110.5	72%	0.719	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-56.4	122.5	168.5	0	0	0	0	0	106.9	L267 Q271	L267-A269 PolarHBondContact O-N 3.1Å; A269-Q271 VanDerWaalsContact C-N 3.28Å; A269-Q271 PolarHBondContact O-N 2.8Å
270	V	72	Confident	75.9	Confident	123 Å²	123	113.3 Å²	113.3	75%	0.745	64%	0.638	S	S	*	*			trans	-62.5	97.2	174	-178.6	0	0	0	0	106.2	P268 N272	P268-V270 PolarHBondContact O-N 3.2Å; P268-V270 VanDerWaalsContact O-N 3.1Å; V270-N272 VanDerWaalsContact C-N 3.32Å; V270-N272 PolarHBondContact O-N 2.93Å
271	Q	62.5	Low	75.2	Confident	158 Å²	158	116.1 Å²	116.1	74%	0.738	65%	0.651	S	S	*	*			trans	-72.2	99.2	167.2	-75.5	-178.1	-13.4	0	0	105.4	A269 M273	A269-Q271 VanDerWaalsContact C-N 3.28Å; A269-Q271 PolarHBondContact O-N 2.8Å; Q271-M273 VanDerWaalsContact C-N 3.34Å; Q271-M273 PolarHBondContact O-N 3.05Å
272	N	65.8	Low	74	Confident	150 Å²	150	122.1 Å²	122.1	80%	0.802	68%	0.681	S	S	*	*			trans	-57.3	101.3	165.3	-65.1	-26	0	0	0	107.1	V270	V270-N272 VanDerWaalsContact C-N 3.32Å; V270-N272 PolarHBondContact O-N 2.93Å
273	M	44	Very low	72.7	Confident	239 Å²	239	121.9 Å²	121.9	100%	1.177	68%	0.682	S	S	*	*			trans	-100.2	0	157.3	-73.9	-168.3	-163.1	0	0	108.4	Q271	Q271-M273 VanDerWaalsContact C-N 3.34Å; Q271-M273 PolarHBondContact O-N 3.05Å

Retrieved 273 of 273 residues in 520.3 ms (Link to these results)

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