A0A077ZAR6_TRITR Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1

Subunit of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). All subunits are required for a maximal enzyme activity.

AlphaFold DB , UniProt , Accession A0A077ZAR6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 479 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	52.7	Low	67.4	Low	226 Å²	226	127.1 Å²	127.1	100%	1.113	75%	0.747	S	S	*	*				0	116.6	0	-163.4	174.3	-171.8	0	0	107.4
2	K	63.5	Low	68.7	Low	205 Å²	205	133.9 Å²	133.9	89%	0.891	76%	0.76	S	S	*	*			trans	-89.4	128.2	169.5	-73.6	-176.9	177.8	-179.6	0	106.6
3	I	66.6	Low	70	Confident	108 Å²	108	131.1 Å²	131.1	55%	0.554	74%	0.74	S	S	*	*			trans	-105.6	119.5	171.4	-59.1	173.4	0	0	0	105.2	I5	I3-I5 HydrophobicContact CB-CG1 4.32Å; I3-I5 HydrophobicContact CG2-CG1 3.8Å; I3-I5 PolarHBondContact O-N 2.97Å
4	D	73.2	Confident	71.4	Confident	156 Å²	156	137.6 Å²	137.6	83%	0.834	75%	0.747	S	S	*	*			trans	-74.6	94.6	172.7	-70	-29.9	0	0	0	108.2	P6	D4-P6 WeakPolarHBondContact O-CD 3.33Å
5	I	68.2	Low	72.6	Confident	90 Å²	90	135.5 Å²	135.5	46%	0.462	73%	0.734	S	S	.	*			trans	-88.9	115.8	175.5	-60.1	174.8	0	0	0	107	I3 A7 I13	I3-I5 HydrophobicContact CB-CG1 4.32Å; I3-I5 HydrophobicContact CG2-CG1 3.8Å; I3-I5 PolarHBondContact O-N 2.97Å; I5-A7 PolarHBondContact O-N 3.04Å; I5-I13 HydrophobicContact CG2-CD1 3.33Å
6	P	69.4	Low	73.8	Confident	98 Å²	98	136.1 Å²	136.1	64%	0.636	74%	0.735	S	S	*	*			trans	-59.8	127.9	176.2	23.1	-31.1	0	0	0	108.9	D4 T8	D4-P6 WeakPolarHBondContact O-CD 3.33Å; P6-T8 PolarHBondContact O-N 3Å; P6-T8 PolarHBondContact O-OG1 3.13Å
7	A	63.5	Low	74.9	Confident	111 Å²	111	135.9 Å²	135.9	92%	0.917	73%	0.732	S	S	*	*			trans	-58.3	101.2	178.7	0	0	0	0	0	109	I5	I5-A7 PolarHBondContact O-N 3.04Å
8	T	61.1	Low	75.8	Confident	58 Å²	58	136.2 Å²	136.2	36%	0.356	73%	0.728	S	S	.	*			trans	-132.1	93.3	178	-14.2	0	0	0	0	109.4	P6 G10 K11	P6-T8 PolarHBondContact O-N 3Å; P6-T8 PolarHBondContact O-OG1 3.13Å; T8-G10 PolarHBondContact O-N 3.35Å; T8-K11 HydrophobicContact CG2-CB 4.39Å; T8-K11 HydrophobicContact CG2-CD 3.37Å; T8-K11 HydrophobicContact CG2-CG 3.69Å; T8-K11 PolarHBondContact O-N 3Å
9	A	68.7	Low	76.7	Confident	108 Å²	108	136.3 Å²	136.3	89%	0.893	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	130	169.2	0	0	0	0	0	109.2	K11	A9-K11 PolarHBondContact O-N 3.27Å
10	G	74	Confident	77.4	Confident	88 Å²	88	134.6 Å²	134.6	91%	0.907	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.6	-3.3	175	0	0	0	0	0	117.2	T8	T8-G10 PolarHBondContact O-N 3.35Å
11	K	80.1	Confident	78.1	Confident	150 Å²	150	134.4 Å²	134.4	65%	0.652	71%	0.709	S	S	*	*			trans	-89.7	142.7	173.9	-64.9	-166.6	-173.6	168.8	0	111.9	T8 A9	T8-K11 HydrophobicContact CG2-CB 4.39Å; T8-K11 HydrophobicContact CG2-CD 3.37Å; T8-K11 HydrophobicContact CG2-CG 3.69Å; T8-K11 PolarHBondContact O-N 3Å; A9-K11 PolarHBondContact O-N 3.27Å
12	K	83.9	Confident	79.9	Confident	209 Å²	209	125.8 Å²	125.8	91%	0.909	67%	0.674	S	S	*	*			trans	-86.8	134.4	172.6	-65.7	178.1	-178	173.9	0	109.5
13	I	85.7	Confident	81	Confident	97 Å²	97	119.8 Å²	119.8	50%	0.497	67%	0.67	S	S	.	*			trans	-119.2	133	176.4	-57.7	176.4	0	0	0	108	I5 L15	I5-I13 HydrophobicContact CG2-CD1 3.33Å; I13-L15 HydrophobicContact CG2-CD2 3.95Å; I13-L15 HydrophobicContact CG2-CG 4.17Å
14	R	88.7	Confident	82.1	Confident	222 Å²	222	117.1 Å²	117.1	84%	0.838	66%	0.66	S	S	*	*			trans	-95.7	117.1	173.9	-174.1	178.8	-179.8	-175	-1.3	108.6
15	L	89.4	Confident	82.9	Confident	106 Å²	106	112.9 Å²	112.9	56%	0.555	64%	0.637	S	S	*	*			trans	-110.2	135.9	174.2	-61.7	175.6	0	0	0	109.1	I13	I13-L15 HydrophobicContact CG2-CD2 3.95Å; I13-L15 HydrophobicContact CG2-CG 4.17Å
16	I	92.2	Very high	83.9	Confident	145 Å²	145	113.1 Å²	113.1	74%	0.744	64%	0.638	S	S	*	*			trans	-113.7	120.2	171.6	-58.6	176.4	0	0	0	105.9
17	I	91.8	Very high	84.8	Confident	133 Å²	133	109.6 Å²	109.6	68%	0.682	62%	0.616	S	S	*	*			trans	-116.6	122.1	-179	-58	173.1	0	0	0	106.8	M19	I17-M19 HydrophobicContact CG2-CG 4Å; I17-M19 HydrophobicContact CG2-SD 4.4Å
18	E	92.4	Very high	86	Confident	142 Å²	142	109.6 Å²	109.6	66%	0.664	60%	0.595	S	S	*	*			trans	-109.9	132	173.6	-173.2	174.5	-179.8	0	0	108.6	M20	E18-M20 VanDerWaalsContact OE1-CE 3.31Å; E18-M20 WeakPolarHBondContact OE1-CE 3.4Å
19	M	91.8	Very high	87.4	Confident	137 Å²	137	109.1 Å²	109.1	68%	0.675	59%	0.593	S	S	*	*			trans	-133.2	129.3	179.4	-62.9	-175.2	-62.5	0	0	108.8	I17	I17-M19 HydrophobicContact CG2-CG 4Å; I17-M19 HydrophobicContact CG2-SD 4.4Å
20	M	92	Very high	88.3	Confident	103 Å²	103	107.5 Å²	107.5	51%	0.507	57%	0.572	S	S	.	*			trans	-105.1	125.5	175.4	-67	-88.3	176.7	0	0	107.8	E18 V306 N308	E18-M20 VanDerWaalsContact OE1-CE 3.31Å; E18-M20 WeakPolarHBondContact OE1-CE 3.4Å; M20-V306 HydrophobicContact CB-CG2 4.36Å; M20-N308 VanDerWaalsContact CE-OD1 3.29Å; M20-N308 WeakPolarHBondContact CE-OD1 3.49Å
21	H	90.9	Very high	89	Confident	131 Å²	131	109.9 Å²	109.9	61%	0.606	56%	0.555	S	S	*	*			trans	-118.7	122	177.3	-60.9	-81.6	0	0	0	110	C24	H21-C24 VanDerWaalsContact CB-SG 3.52Å
22	A	90.1	Very high	89.2	Confident	45 Å²	45	104 Å²	104	37%	0.372	53%	0.53	S	S	.	.	S	Bend	trans	-89.2	147.7	173.2	0	0	0	0	0	111	C24 V250	A22-C24 VanDerWaalsContact C-N 3.32Å; A22-C24 PolarHBondContact O-N 3.46Å; A22-V250 HydrophobicContact CB-CG1 3.62Å; A22-V250 HydrophobicContact CB-CG2 4.1Å
23	G	86.5	Confident	89.2	Confident	79 Å²	79	96.6 Å²	96.6	81%	0.814	50%	0.503	S	S	*	.	S	Bend	trans	73.8	11.8	172	0	0	0	0	0	116.3
24	C	89.8	Confident	88.8	Confident	51 Å²	51	93.3 Å²	93.3	35%	0.345	49%	0.485	S	S	.	.			trans	-83.3	-13.1	-179.5	-63.8	0	0	0	0	114.9	H21 A22 Y41	H21-C24 VanDerWaalsContact CB-SG 3.52Å; A22-C24 VanDerWaalsContact C-N 3.32Å; A22-C24 PolarHBondContact O-N 3.46Å; C24-Y41 HydrophobicContact CB-CD2 4.31Å; C24-Y41 HydrophobicContact CB-CE2 4.01Å
25	L	90.5	Very high	88.1	Confident	67 Å²	67	89.3 Å²	89.3	35%	0.351	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	116.2	177.3	-67.1	179.2	0	0	0	109.6	Y41 F105 F111	L25-Y41 HydrophobicContact CD2-CD2 3.98Å; L25-Y41 HydrophobicContact CD2-CG 4.3Å; L25-F105 HydrophobicContact CD2-CE1 4.14Å; L25-F105 HydrophobicContact CD2-CZ 3.88Å; L25-F111 HydrophobicContact CB-CE1 3.81Å; L25-F111 HydrophobicContact CD1-CE1 3.98Å; L25-F111 HydrophobicContact CD1-CZ 4.42Å
26	I	90.4	Very high	87.3	Confident	95 Å²	95	88.1 Å²	88.1	49%	0.487	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124	-176.4	-56.5	173.4	0	0	0	108.5	F28 V40	I26-F28 PolarHBondContact O-N 3.17Å; I26-V40 PolarHBondContact N-O 3.23Å; I26-V40 PolarHBondContact O-N 2.75Å
27	P	88.3	Confident	86.5	Confident	25 Å²	25	82.4 Å²	82.4	16%	0.162	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	125.7	174.7	23.5	-30.7	0	0	0	111	P29 A142	P27-P29 CarbonylContact C-O 3.57Å; P27-A142 VanDerWaalsContact CB-CA 3.49Å; P27-A142 HydrophobicContact CB-CB 3.53Å
28	F	88.6	Confident	86.2	Confident	110 Å²	110	78 Å²	78	48%	0.482	41%	0.413	S	S	.	.	S	Bend	trans	-144.3	109.9	177.1	-169.7	-97.1	0	0	0	110	I26 L38 V40 H104	I26-F28 PolarHBondContact O-N 3.17Å; F28-L38 PolarHBondContact N-O 2.96Å; F28-L38 WeakPolarHBondContact O-CB 3.05Å; F28-V40 HydrophobicContact CB-CB 4.24Å; F28-V40 HydrophobicContact CB-CG2 3.54Å; F28-V40 HydrophobicContact CD1-CG2 4.15Å; F28-V40 HydrophobicContact CG-CG2 4.06Å; F28-H104 AromaticContact CD1-CE1 3.84Å; F28-H104 AromaticContact CD1-NE2 3.9Å; F28-H104 PolarHBondContact O-NE2 3.33Å
29	P	89	Confident	86.1	Confident	49 Å²	49	71.2 Å²	71.2	32%	0.318	38%	0.381	S	S	.	.	S	Bend	cis	-67.9	153.6	5.5	29.7	-35.2	0	0	0	113	P27 Y31 I32 A142	P27-P29 CarbonylContact C-O 3.57Å; P29-Y31 PolarHBondContact O-N 2.94Å; P29-I32 HydrophobicContact CG-CG2 3.92Å; P29-A142 WeakPolarHBondContact O-CB 3.21Å
30	T	89	Confident	86.1	Confident	73 Å²	73	65 Å²	65	45%	0.448	35%	0.351	S	S	.	.	S	Bend	trans	-65.6	-27.7	178.7	-47.9	0	0	0	0	112.3	A142 I143	T30-A142 CarbonylContact O-C 3.49Å; T30-A142 WeakPolarHBondContact O-CA 3.22Å; T30-I143 PolarHBondContact O-N 3.34Å
31	Y	88.6	Confident	86.2	Confident	138 Å²	138	63.7 Å²	63.7	54%	0.541	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.1	177.8	-63.2	-86.3	0	0	0	109.2	P29 I143	P29-Y31 PolarHBondContact O-N 2.94Å; Y31-I143 CarbonylContact C-O 3.56Å; Y31-I143 VanDerWaalsContact CA-O 3.28Å; Y31-I143 WeakPolarHBondContact CA-O 3.06Å; Y31-I143 HydrophobicContact CD1-CB 3.85Å; Y31-I143 HydrophobicContact CD1-CG2 3.98Å; Y31-I143 HydrophobicContact CE1-CB 4.05Å; Y31-I143 HydrophobicContact CE1-CD1 4.13Å; Y31-I143 HydrophobicContact CE1-CG2 3.99Å
32	I	83.9	Confident	86.3	Confident	27 Å²	27	60.8 Å²	60.8	14%	0.138	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.8	-177.9	54.4	166.3	0	0	0	111	P29 E36 A142 I143 L144 K145	P29-I32 HydrophobicContact CG-CG2 3.92Å; I32-E36 HydrophobicContact CB-CB 3.86Å; I32-E36 WeakPolarHBondContact CD1-O 3.44Å; I32-E36 HydrophobicContact CG2-CB 3.89Å; I32-A142 HydrophobicContact CB-CB 4.06Å; I32-A142 HydrophobicContact CD1-CB 3.63Å; I32-A142 HydrophobicContact CG1-CB 3.46Å; I32-A142 VanDerWaalsContact CG1-CB 3.46Å; I32-A142 HydrophobicContact CG2-CB 3.57Å; I32-I143 PolarHBondContact N-O 3.37Å; I32-L144 CarbonylContact O-C 3.52Å; I32-K145 WeakPolarHBondContact O-CB 3.26Å; I32-K145 PolarHBondContact O-N 3.04Å
33	T	83.7	Confident	86.4	Confident	54 Å²	54	59.4 Å²	59.4	33%	0.331	32%	0.322	S	S	.	.			trans	-70.5	168.7	164	66.2	0	0	0	0	110.3	K35 E36	T33-K35 PolarHBondContact O-N 3.31Å; T33-E36 WeakPolarHBondContact CG2-OE1 3.24Å; T33-E36 PolarHBondContact N-OE2 2.88Å; T33-E36 PolarHBondContact O-N 3.21Å; T33-E36 VanDerWaalsContact OG1-CD 3.29Å; T33-E36 PolarHBondContact OG1-OE1 3.34Å
34	Q	77.4	Confident	86.7	Confident	27 Å²	27	57.4 Å²	57.4	13%	0.126	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-17.7	-179.5	-170.7	172.9	-38.8	0	0	114.7	L144 Y153 F209	Q34-L144 HydrophobicContact CB-CD1 4.35Å; Q34-Y153 VanDerWaalsContact NE2-CB 3.28Å; Q34-F209 HydrophobicContact CB-CE1 4.46Å; Q34-F209 HydrophobicContact CG-CE1 3.7Å; Q34-F209 HydrophobicContact CG-CZ 3.84Å
35	K	74	Confident	86.8	Confident	139 Å²	139	55 Å²	55	60%	0.604	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-14.2	-174.3	-66.7	-177.9	179.7	177	0	115.3	T33 R158	T33-K35 PolarHBondContact O-N 3.31Å; K35-R158 PolarHBondContact O-NH1 3.23Å
36	E	73.1	Confident	86.9	Confident	80 Å²	80	52.8 Å²	52.8	37%	0.374	27%	0.267	S	S	.	.			trans	-95.5	144.9	-172.1	-73.2	158.4	-141.8	0	0	111.8	I32 T33	I32-E36 HydrophobicContact CB-CB 3.86Å; I32-E36 WeakPolarHBondContact CD1-O 3.44Å; I32-E36 HydrophobicContact CG2-CB 3.89Å; T33-E36 WeakPolarHBondContact CG2-OE1 3.24Å; T33-E36 PolarHBondContact N-OE2 2.88Å; T33-E36 PolarHBondContact O-N 3.21Å; T33-E36 VanDerWaalsContact OG1-CD 3.29Å; T33-E36 PolarHBondContact OG1-OE1 3.34Å
37	K	75.5	Confident	86.9	Confident	25 Å²	25	50.3 Å²	50.3	11%	0.109	26%	0.26	C	S	.	.			trans	-150.4	59.5	-168.4	-62.6	-171.5	-177	-178.4	0	114	E106 T107 N108 S160	K37-E106 HydrophobicContact CB-CG 4.11Å; K37-E106 CarbonylContact O-C 3.49Å; K37-E106 VanDerWaalsContact O-CA 3.22Å; K37-E106 WeakPolarHBondContact O-CA 3.29Å; K37-E106 WeakPolarHBondContact O-CG 3.43Å; K37-T107 PolarHBondContact O-N 2.71Å; K37-N108 HydrophobicContact CD-CB 4.11Å; K37-N108 VanDerWaalsContact CD-CG 3.48Å; K37-N108 WeakPolarHBondContact CD-OD1 3.36Å; K37-S160 PolarHBondContact NZ-O 2.84Å
38	L	84.9	Confident	87.1	Confident	40 Å²	40	56 Å²	56	21%	0.209	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.8	-175.1	-66.9	170.3	0	0	0	113	F28 E69 E106	F28-L38 PolarHBondContact N-O 2.96Å; F28-L38 WeakPolarHBondContact O-CB 3.05Å; L38-E69 HydrophobicContact CD2-CG 3.74Å; L38-E106 HydrophobicContact CD2-CB 4.2Å
39	A	89.6	Confident	87.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.5	172.2	0	0	0	0	0	112	H104 F105 T107 F111	A39-H104 PolarHBondContact O-CD2 3.41Å; A39-F105 PolarHBondContact N-O 2.94Å; A39-F105 PolarHBondContact O-N 2.88Å; A39-T107 HydrophobicContact CB-CG2 3.47Å; A39-T107 VanDerWaalsContact CB-CG2 3.47Å; A39-F111 HydrophobicContact CB-CZ 4.05Å
40	V	92.8	Very high	87.6	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	131	176.9	170.6	0	0	0	0	109.4	I26 F28 V42 K102 I103 H104	I26-V40 PolarHBondContact N-O 3.23Å; I26-V40 PolarHBondContact O-N 2.75Å; F28-V40 HydrophobicContact CB-CB 4.24Å; F28-V40 HydrophobicContact CB-CG2 3.54Å; F28-V40 HydrophobicContact CD1-CG2 4.15Å; F28-V40 HydrophobicContact CG-CG2 4.06Å; V40-V42 HydrophobicContact CG1-CG2 3.96Å; V40-K102 HydrophobicContact CG1-CD 4.42Å; V40-K102 HydrophobicContact CG1-CG 3.96Å; V40-I103 CarbonylContact C-O 3.57Å; V40-I103 VanDerWaalsContact CA-O 3.31Å; V40-I103 WeakPolarHBondContact CA-O 3.49Å; V40-H104 HydrophobicContact CG2-CB 3.87Å; V40-H104 VanDerWaalsContact CG2-CD2 3.5Å; V40-H104 WeakPolarHBondContact CG2-CD2 3.25Å
41	Y	93.4	Very high	87.8	Confident	76 Å²	76	59.7 Å²	59.7	30%	0.298	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.3	166.3	178.9	-110.6	0	0	0	109.7	C24 L25 K102 I103	C24-Y41 HydrophobicContact CB-CD2 4.31Å; C24-Y41 HydrophobicContact CB-CE2 4.01Å; L25-Y41 HydrophobicContact CD2-CD2 3.98Å; L25-Y41 HydrophobicContact CD2-CG 4.3Å; Y41-K102 WeakPolarHBondContact O-CA 3.17Å; Y41-I103 PolarHBondContact N-O 2.86Å; Y41-I103 PolarHBondContact O-N 2.89Å
42	V	93.5	Very high	88.1	Confident	69 Å²	69	57.7 Å²	57.7	42%	0.418	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.1	172.1	-175.5	0	0	0	0	108.2	V40 Y100 L101 K102	V40-V42 HydrophobicContact CG1-CG2 3.96Å; V42-Y100 HydrophobicContact CG1-CD1 4.48Å; V42-L101 CarbonylContact C-O 3.6Å; V42-L101 WeakPolarHBondContact CA-O 3.25Å; V42-K102 HydrophobicContact CG2-CG 4.39Å
43	G	92.3	Very high	88.6	Confident	16 Å²	16	57.6 Å²	57.6	17%	0.165	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	-154	179.5	0	0	0	0	0	111.6	Y100 L101	G43-Y100 WeakPolarHBondContact O-CA 3.07Å; G43-L101 PolarHBondContact N-O 2.82Å; G43-L101 PolarHBondContact O-N 3.4Å
44	S	92.6	Very high	89.1	Confident	38 Å²	38	62.7 Å²	62.7	27%	0.266	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.9	177	178.8	0	0	0	0	111.2	Y46 V99	S44-Y46 WeakPolarHBondContact CB-O 3.35Å; S44-Y46 PolarHBondContact OG-N 3.28Å; S44-Y46 PolarHBondContact OG-O 2.89Å; S44-V99 CarbonylContact C-O 3.55Å; S44-V99 WeakPolarHBondContact CA-O 3.31Å; S44-V99 PolarHBondContact OG-O 3.32Å
45	H	91.5	Very high	90	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.329	C	S	.	.	S	Bend	trans	-68	-36.5	169.4	-79.4	-81.8	0	0	0	112	Q56 S72 H74 I75 Y87 V99 Y100	H45-Q56 PolarHBondContact O-NE2 2.94Å; H45-S72 WeakPolarHBondContact NE2-CB 3.22Å; H45-H74 AromaticContact CD2-CE1 3.84Å; H45-H74 AromaticContact CD2-NE2 3.92Å; H45-H74 AromaticContact NE2-CE1 3.32Å; H45-H74 PolarHBondContact NE2-CE1 2.83Å; H45-H74 VanDerWaalsContact NE2-CE1 3.32Å; H45-H74 AromaticContact NE2-NE2 3.78Å; H45-I75 HydrophobicContact CB-CD1 3.96Å; H45-Y87 AromaticContact CE1-CD1 3.54Å; H45-Y87 AromaticContact CE1-CE1 3.44Å; H45-Y87 VanDerWaalsContact CE1-CE1 3.44Å; H45-Y87 WeakPolarHBondContact CE1-CE1 3.34Å; H45-Y87 AromaticContact ND1-CD1 3.53Å; H45-Y87 AromaticContact ND1-CE1 3.9Å; H45-Y87 AromaticContact ND1-CG 3.95Å; H45-V99 PolarHBondContact N-O 3.38Å; H45-Y100 PolarHBondContact CD2-O 3.45Å
46	Y	92.4	Very high	90.9	Very high	21 Å²	21	60.6 Å²	60.6	8%	0.082	31%	0.306	C	S	.	.	S	Bend	trans	-103.4	145.8	-177.3	-57	-55.3	0	0	0	111.3	S44 Y48 I75 Y90 I93 K97 V99	S44-Y46 WeakPolarHBondContact CB-O 3.35Å; S44-Y46 PolarHBondContact OG-N 3.28Å; S44-Y46 PolarHBondContact OG-O 2.89Å; Y46-Y48 PolarHBondContact O-N 3.38Å; Y46-I75 HydrophobicContact CE2-CD1 4.11Å; Y46-Y90 AromaticContact CD1-CD2 3.96Å; Y46-Y90 HydrophobicContact CD1-CD2 3.96Å; Y46-Y90 AromaticContact CE1-CD2 3.49Å; Y46-Y90 HydrophobicContact CE1-CD2 3.49Å; Y46-Y90 VanDerWaalsContact CE1-CD2 3.49Å; Y46-Y90 HydrophobicContact CE1-CE2 4.02Å; Y46-Y90 AromaticContact CE1-CG 3.8Å; Y46-Y90 HydrophobicContact CE1-CG 3.8Å; Y46-I93 HydrophobicContact CD1-CD1 3.6Å; Y46-I93 HydrophobicContact CD1-CG1 4.03Å; Y46-I93 HydrophobicContact CD1-CG2 4.19Å; Y46-I93 HydrophobicContact CE1-CD1 4.02Å; Y46-I93 HydrophobicContact CE1-CG1 4.12Å; Y46-I93 HydrophobicContact CG-CD1 4.49Å; Y46-I93 HydrophobicContact CG-CG2 4.15Å; Y46-K97 HydrophobicContact CD2-CB 4.37Å; Y46-K97 HydrophobicContact CD2-CD 3.8Å; Y46-K97 HydrophobicContact CD2-CG 3.82Å; Y46-K97 HydrophobicContact CE2-CD 3.61Å; Y46-K97 VanDerWaalsContact CE2-CE 3.5Å; Y46-K97 HydrophobicContact CE2-CG 4.04Å; Y46-V99 HydrophobicContact CD2-CB 4.11Å; Y46-V99 HydrophobicContact CD2-CG2 3.86Å; Y46-V99 HydrophobicContact CE2-CB 4.02Å; Y46-V99 HydrophobicContact CE2-CG2 3.53Å
47	A	91.8	Very high	91.9	Very high	42 Å²	42	62.6 Å²	62.6	35%	0.347	31%	0.313	S	S	.	.			trans	-69.3	121.2	170.7	0	0	0	0	0	108.2	L49 Q56	A47-L49 HydrophobicContact CB-CD1 3.92Å; A47-L49 HydrophobicContact CB-CG 4.06Å; A47-L49 PolarHBondContact O-N 3.43Å; A47-Q56 VanDerWaalsContact N-NE2 3.13Å
48	Y	92	Very high	92.8	Very high	145 Å²	145	63.5 Å²	63.5	57%	0.569	32%	0.319	S	S	*	.			trans	-75.4	93.1	-179.1	-172.9	-106.7	0	0	0	109.9	Y46 Y96 T98	Y46-Y48 PolarHBondContact O-N 3.38Å; Y48-Y96 AromaticContact CE1-CD1 3.95Å; Y48-Y96 HydrophobicContact CE1-CD1 3.95Å; Y48-Y96 HydrophobicContact CE1-CE1 4.42Å; Y48-Y96 AromaticContact CE2-CD1 3.9Å; Y48-Y96 HydrophobicContact CE2-CD1 3.9Å; Y48-Y96 HydrophobicContact CE2-CG 4.4Å; Y48-Y96 AromaticContact CZ-CD1 3.55Å; Y48-T98 WeakPolarHBondContact CD2-OG1 3.18Å; Y48-T98 WeakPolarHBondContact CE2-OG1 3.5Å
49	L	93.7	Very high	93.3	Very high	72 Å²	72	65.7 Å²	65.7	38%	0.377	33%	0.33	S	S	.	.			trans	-127.8	148	-173.3	-65.2	174.9	0	0	0	111.7	A47 Y51 V53 Y96	A47-L49 HydrophobicContact CB-CD1 3.92Å; A47-L49 HydrophobicContact CB-CG 4.06Å; A47-L49 PolarHBondContact O-N 3.43Å; L49-Y51 PolarHBondContact O-N 2.84Å; L49-V53 HydrophobicContact CD1-CG2 3.84Å; L49-Y96 PolarHBondContact O-N 3.3Å
50	P	94.6	Very high	93.5	Very high	60 Å²	60	66.9 Å²	66.9	39%	0.39	34%	0.337	S	S	.	.	S	Bend	trans	-78.1	1	176	34.6	-37.9	0	0	0	113.4	Y96	P50-Y96 HydrophobicContact CB-CE1 3.9Å; P50-Y96 HydrophobicContact CB-CE2 4.18Å; P50-Y96 WeakPolarHBondContact CB-OH 3.12Å
51	Y	93.4	Very high	93.5	Very high	177 Å²	177	75.8 Å²	75.8	69%	0.694	37%	0.37	S	S	*	.	S	Bend	trans	-114.8	150.1	-176.9	-53.2	-69.7	0	0	0	110.6	L49 V53	L49-Y51 PolarHBondContact O-N 2.84Å; Y51-V53 PolarHBondContact O-N 3.27Å
52	T	94.5	Very high	93.3	Very high	96 Å²	96	72.8 Å²	72.8	59%	0.589	36%	0.359	S	S	*	.			trans	-66.7	124.5	170.7	-52.5	0	0	0	0	109.6	I93	T52-I93 WeakPolarHBondContact CA-O 3.43Å; T52-I93 WeakPolarHBondContact CG2-O 3.28Å
53	V	94.2	Very high	92.8	Very high	26 Å²	26	75.2 Å²	75.2	16%	0.158	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119	178.8	-177	0	0	0	0	108.9	L49 Y51 Q56 N92 I93	L49-V53 HydrophobicContact CD1-CG2 3.84Å; Y51-V53 PolarHBondContact O-N 3.27Å; V53-Q56 HydrophobicContact CG1-CB 4.08Å; V53-N92 WeakPolarHBondContact O-CA 3.33Å; V53-N92 PolarHBondContact O-N 2.98Å; V53-I93 HydrophobicContact CB-CB 4.21Å; V53-I93 HydrophobicContact CB-CD1 4.36Å; V53-I93 HydrophobicContact CG1-CD1 4.46Å; V53-I93 PolarHBondContact N-O 2.82Å; V53-I93 PolarHBondContact O-N 3.25Å
54	K	94.8	Very high	92.1	Very high	160 Å²	160	76 Å²	76	70%	0.696	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	-55.3	179.4	-173.1	175.8	-179	176.2	0	111.5	E91 N92	K54-E91 CarbonylContact O-C 3.48Å; K54-E91 VanDerWaalsContact O-CA 3.25Å; K54-E91 WeakPolarHBondContact O-CA 3.33Å; K54-N92 PolarHBondContact O-N 3.41Å
55	N	94.7	Very high	91.2	Very high	97 Å²	97	79.6 Å²	79.6	52%	0.519	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.8	179.8	-71	-6.8	0	0	0	109.9	Y90	N55-Y90 CarbonylContact C-O 3.55Å; N55-Y90 WeakPolarHBondContact CA-O 3.01Å
56	Q	93.7	Very high	90.3	Very high	25 Å²	25	81 Å²	81	12%	0.117	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	138.8	173.7	-169.4	-171.8	-37.4	0	0	111.2	H45 A47 V53 P89 Y90 I93	H45-Q56 PolarHBondContact O-NE2 2.94Å; A47-Q56 VanDerWaalsContact N-NE2 3.13Å; V53-Q56 HydrophobicContact CG1-CB 4.08Å; Q56-P89 CarbonylContact O-C 3.59Å; Q56-P89 WeakPolarHBondContact O-CA 3.23Å; Q56-Y90 PolarHBondContact N-O 2.7Å; Q56-Y90 PolarHBondContact O-N 2.92Å; Q56-I93 HydrophobicContact CB-CD1 3.48Å; Q56-I93 VanDerWaalsContact CB-CD1 3.48Å; Q56-I93 HydrophobicContact CG-CD1 4.37Å
57	K	94.5	Very high	89.7	Confident	123 Å²	123	86 Å²	86	54%	0.535	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.9	169	-176	-179.3	-178.1	177.9	0	108.5	I59 I86	K57-I59 HydrophobicContact CD-CD1 4.37Å; K57-I59 HydrophobicContact CD-CG1 4.45Å; K57-I59 HydrophobicContact CG-CG1 4.29Å; K57-I86 HydrophobicContact CD-CG2 4.39Å; K57-I86 HydrophobicContact CG-CG2 4.22Å
58	L	94.6	Very high	89.5	Confident	44 Å²	44	84.2 Å²	84.2	23%	0.23	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.4	175.9	168.4	69.7	0	0	0	109	V60 Y87 L101	L58-V60 HydrophobicContact CD1-CG2 4.36Å; L58-V60 HydrophobicContact CD2-CG2 4.32Å; L58-V60 HydrophobicContact CG-CG2 4.12Å; L58-Y87 HydrophobicContact CD2-CD2 3.9Å; L58-Y87 HydrophobicContact CD2-CG 4.44Å; L58-Y87 HydrophobicContact CG-CD2 4.17Å; L58-Y87 PolarHBondContact N-O 2.97Å; L58-Y87 PolarHBondContact O-N 3.36Å; L58-L101 HydrophobicContact CD2-CD2 3.79Å
59	I	94.7	Very high	89.2	Confident	86 Å²	86	83.4 Å²	83.4	44%	0.441	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	115.5	179.8	-57.3	176.4	0	0	0	107.4	K57 T84 I86	K57-I59 HydrophobicContact CD-CD1 4.37Å; K57-I59 HydrophobicContact CD-CG1 4.45Å; K57-I59 HydrophobicContact CG-CG1 4.29Å; I59-T84 HydrophobicContact CG2-CG2 3.45Å; I59-T84 VanDerWaalsContact CG2-CG2 3.45Å; I59-I86 HydrophobicContact CG1-CG1 4.49Å
60	V	93.8	Very high	89.1	Confident	24 Å²	24	82.6 Å²	82.6	15%	0.145	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.8	178.1	-176.2	0	0	0	0	108.8	L58 L62 T84 I85 Y87 L101 I103	L58-V60 HydrophobicContact CD1-CG2 4.36Å; L58-V60 HydrophobicContact CD2-CG2 4.32Å; L58-V60 HydrophobicContact CG-CG2 4.12Å; V60-L62 HydrophobicContact CG1-CD2 4.18Å; V60-T84 CarbonylContact O-C 3.53Å; V60-T84 WeakPolarHBondContact O-CA 3.34Å; V60-I85 HydrophobicContact CB-CB 4.46Å; V60-I85 PolarHBondContact N-O 3.5Å; V60-I85 PolarHBondContact O-N 3.31Å; V60-Y87 HydrophobicContact CG2-CD2 4.27Å; V60-Y87 HydrophobicContact CG2-CE2 4.07Å; V60-L101 HydrophobicContact CG2-CD2 4.34Å; V60-I103 HydrophobicContact CB-CD1 4.27Å; V60-I103 HydrophobicContact CG1-CD1 3.76Å; V60-I103 HydrophobicContact CG2-CD1 4.17Å
61	R	92.6	Very high	89	Confident	194 Å²	194	81.8 Å²	81.8	73%	0.732	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	120.8	174.6	-65	178.7	179.5	176	0	108.8	T84	R61-T84 HydrophobicContact CG-CG2 4.44Å
62	L	90.2	Very high	88.9	Confident	13 Å²	13	74.2 Å²	74.2	7%	0.068	37%	0.374	C	S	.	.			trans	-85.1	158.8	177.3	-56.3	-179.9	0	0	0	110.8	V60 P68 R83 I85 I103 F105	V60-L62 HydrophobicContact CG1-CD2 4.18Å; L62-P68 HydrophobicContact CD1-CB 4.09Å; L62-P68 HydrophobicContact CD1-CG 4.2Å; L62-R83 PolarHBondContact N-O 3.06Å; L62-I85 HydrophobicContact CD1-CD1 4.12Å; L62-I103 HydrophobicContact CD2-CG2 3.98Å; L62-F105 HydrophobicContact CD1-CB 4.28Å; L62-F105 HydrophobicContact CD2-CB 4.42Å; L62-F105 HydrophobicContact CD2-CD1 4.22Å; L62-F105 HydrophobicContact CD2-CD2 4.32Å; L62-F105 HydrophobicContact CD2-CG 4.08Å
63	F	82.2	Confident	88.8	Confident	121 Å²	121	75 Å²	75	53%	0.531	37%	0.369	S	S	.	.	S	Bend	trans	-69.7	-46.6	177	-174.4	-88	0	0	0	111.8	N108 A109	F63-N108 HydrophobicContact CE1-CB 3.94Å; F63-A109 HydrophobicContact CD2-CB 4.26Å; F63-A109 HydrophobicContact CE2-CB 4.15Å
64	S	78.3	Confident	88.5	Confident	32 Å²	32	79.3 Å²	79.3	22%	0.224	39%	0.388	C	S	.	.	S	Bend	trans	-97.3	149.3	179.3	-175.4	0	0	0	0	111.5	G66 E106	S64-G66 PolarHBondContact O-N 2.83Å; S64-G66 PolarHBondContact OG-N 2.9Å; S64-G66 VanDerWaalsContact OG-N 3.17Å; S64-E106 VanDerWaalsContact CB-O 3.32Å; S64-E106 WeakPolarHBondContact CB-O 3.34Å
65	D	72.3	Confident	88.2	Confident	114 Å²	114	72.9 Å²	72.9	61%	0.61	36%	0.361	S	S	*	.	S	Bend	trans	-75.4	-8.9	169.5	-72.1	-42.2	0	0	0	112.8	R83	D65-R83 WeakPolarHBondContact OD1-CB 3.4Å
66	G	73.1	Confident	87.9	Confident	29 Å²	29	74 Å²	74	30%	0.299	36%	0.363	S	S	.	.	S	Bend	trans	-55.5	154.5	177.6	0	0	0	0	0	113.3	S64 P68	S64-G66 PolarHBondContact O-N 2.83Å; S64-G66 PolarHBondContact OG-N 2.9Å; S64-G66 VanDerWaalsContact OG-N 3.17Å; G66-P68 WeakPolarHBondContact O-CD 3.46Å
67	L	80	Confident	87.8	Confident	126 Å²	126	75.6 Å²	75.6	66%	0.66	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-62.2	124.2	171.9	-164.4	86.7	0	0	0	108.1	E69	L67-E69 PolarHBondContact O-N 2.68Å
68	P	87.2	Confident	87.7	Confident	4 Å²	4	70.7 Å²	70.7	3%	0.026	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-60.9	133.2	169.8	26	-33.6	0	0	0	108.9	L62 G66 S70 Y71 I85 I103 H104 F105	L62-P68 HydrophobicContact CD1-CB 4.09Å; L62-P68 HydrophobicContact CD1-CG 4.2Å; G66-P68 WeakPolarHBondContact O-CD 3.46Å; P68-S70 PolarHBondContact O-N 2.93Å; P68-Y71 HydrophobicContact CB-CD1 4.39Å; P68-Y71 HydrophobicContact CG-CD1 3.65Å; P68-Y71 HydrophobicContact CG-CE1 4.11Å; P68-Y71 HydrophobicContact CG-CG 4.48Å; P68-I85 HydrophobicContact CG-CD1 4.33Å; P68-I103 HydrophobicContact CB-CG2 4.46Å; P68-H104 CarbonylContact C-O 3.41Å; P68-H104 WeakPolarHBondContact CA-O 3.41Å; P68-H104 WeakPolarHBondContact CB-O 3.29Å; P68-F105 HydrophobicContact CB-CB 4.21Å
69	E	87.1	Confident	87.6	Confident	128 Å²	128	72.6 Å²	72.6	60%	0.598	37%	0.369	S	S	*	.	S	Bend	trans	-51.6	-43.7	176.2	-70.5	-64.8	164.1	0	0	111.3	L38 L67 H104	L38-E69 HydrophobicContact CD2-CG 3.74Å; L67-E69 PolarHBondContact O-N 2.68Å; E69-H104 HydrophobicContact CB-CB 4.14Å; E69-H104 WeakPolarHBondContact CB-ND1 3.44Å; E69-H104 PolarHBondContact N-O 3.2Å
70	S	91.5	Very high	87.3	Confident	56 Å²	56	73 Å²	73	39%	0.392	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	150.7	171.9	62.1	0	0	0	0	111.7	P68 H104	P68-S70 PolarHBondContact O-N 2.93Å; S70-H104 PolarHBondContact N-O 2.79Å; S70-H104 PolarHBondContact O-N 2.98Å; S70-H104 WeakPolarHBondContact OG-CB 3.4Å
71	Y	92.2	Very high	87	Confident	42 Å²	42	76.1 Å²	76.1	17%	0.165	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	148.2	171.1	63	-81	0	0	0	110	P68 K73 V78 I85 K102	P68-Y71 HydrophobicContact CB-CD1 4.39Å; P68-Y71 HydrophobicContact CG-CD1 3.65Å; P68-Y71 HydrophobicContact CG-CE1 4.11Å; P68-Y71 HydrophobicContact CG-CG 4.48Å; Y71-K73 HydrophobicContact CD2-CD 4.46Å; Y71-K73 HydrophobicContact CD2-CG 3.83Å; Y71-K73 HydrophobicContact CE1-CD 4.5Å; Y71-K73 VanDerWaalsContact CE1-CE 3.42Å; Y71-K73 HydrophobicContact CE2-CD 3.79Å; Y71-K73 HydrophobicContact CE2-CG 3.55Å; Y71-K73 PolarHBondContact O-N 3.26Å; Y71-K73 VanDerWaalsContact OH-CE 3.29Å; Y71-K73 WeakPolarHBondContact OH-CE 3.42Å; Y71-K73 PolarHBondContact OH-NZ 3.37Å; Y71-V78 HydrophobicContact CD2-CG1 4.33Å; Y71-V78 HydrophobicContact CE2-CG1 3.88Å; Y71-I85 HydrophobicContact CD2-CD1 4.37Å; Y71-I85 HydrophobicContact CD2-CG2 4.29Å; Y71-I85 HydrophobicContact CE2-CG2 4.45Å; Y71-I85 HydrophobicContact CG-CD1 4.18Å; Y71-K102 CarbonylContact C-O 3.57Å; Y71-K102 WeakPolarHBondContact CA-O 3.41Å
72	S	91.7	Very high	86.7	Confident	18 Å²	18	68.7 Å²	68.7	13%	0.126	37%	0.372	C	S	.	.			trans	-58.8	121.7	178.4	-68.7	0	0	0	0	111.8	H45 Y87 K102	H45-S72 WeakPolarHBondContact NE2-CB 3.22Å; S72-Y87 VanDerWaalsContact O-CE1 3.23Å; S72-Y87 WeakPolarHBondContact O-CE1 3.22Å; S72-Y87 PolarHBondContact O-OH 3.37Å; S72-K102 PolarHBondContact N-O 2.91Å; S72-K102 PolarHBondContact OG-N 2.82Å; S72-K102 PolarHBondContact OG-O 2.94Å
73	K	90.6	Very high	86.6	Confident	112 Å²	112	74.3 Å²	74.3	49%	0.487	39%	0.392	S	S	.	.			trans	-119.2	7	173.7	-52.1	-172.1	-151.7	-164.3	0	113.9	Y71 I75 Q76	Y71-K73 HydrophobicContact CD2-CD 4.46Å; Y71-K73 HydrophobicContact CD2-CG 3.83Å; Y71-K73 HydrophobicContact CE1-CD 4.5Å; Y71-K73 VanDerWaalsContact CE1-CE 3.42Å; Y71-K73 HydrophobicContact CE2-CD 3.79Å; Y71-K73 HydrophobicContact CE2-CG 3.55Å; Y71-K73 PolarHBondContact O-N 3.26Å; Y71-K73 VanDerWaalsContact OH-CE 3.29Å; Y71-K73 WeakPolarHBondContact OH-CE 3.42Å; Y71-K73 PolarHBondContact OH-NZ 3.37Å; K73-I75 VanDerWaalsContact C-N 3.27Å; K73-I75 PolarHBondContact O-N 3.39Å; K73-Q76 PolarHBondContact O-NE2 3.18Å
74	H	89	Confident	87.1	Confident	118 Å²	118	70 Å²	70	55%	0.546	38%	0.376	S	S	.	.	S	Bend	trans	-71.4	-21.1	-171.8	61.5	-85.7	0	0	0	113.1	H45 V99 Y100	H45-H74 AromaticContact CD2-CE1 3.84Å; H45-H74 AromaticContact CD2-NE2 3.92Å; H45-H74 AromaticContact NE2-CE1 3.32Å; H45-H74 PolarHBondContact NE2-CE1 2.83Å; H45-H74 VanDerWaalsContact NE2-CE1 3.32Å; H45-H74 AromaticContact NE2-NE2 3.78Å; H74-V99 VanDerWaalsContact NE2-CG1 3.34Å; H74-V99 WeakPolarHBondContact NE2-CG1 3.32Å; H74-Y100 PolarHBondContact CE1-O 2.82Å
75	I	88.2	Confident	87.8	Confident	25 Å²	25	68.5 Å²	68.5	13%	0.128	37%	0.365	C	S	.	.	S	Bend	trans	-107.1	113.2	168.8	-56.6	167.2	0	0	0	107.9	H45 Y46 K73 V78 Y90 V99	H45-I75 HydrophobicContact CB-CD1 3.96Å; Y46-I75 HydrophobicContact CE2-CD1 4.11Å; K73-I75 VanDerWaalsContact C-N 3.27Å; K73-I75 PolarHBondContact O-N 3.39Å; I75-V78 WeakPolarHBondContact O-CG2 3.32Å; I75-Y90 HydrophobicContact CB-CE1 4.47Å; I75-Y90 HydrophobicContact CG2-CD1 4.11Å; I75-Y90 HydrophobicContact CG2-CE1 3.33Å; I75-Y90 HydrophobicContact CG2-CE2 4.45Å; I75-Y90 WeakPolarHBondContact CG2-OH 3.38Å; I75-Y90 PolarHBondContact O-OH 2.79Å; I75-V99 HydrophobicContact CD1-CB 3.85Å; I75-V99 HydrophobicContact CD1-CG1 3.49Å; I75-V99 VanDerWaalsContact CD1-CG1 3.49Å; I75-V99 HydrophobicContact CD1-CG2 4.23Å; I75-V99 HydrophobicContact CG1-CG1 4.46Å
76	Q	88.3	Confident	88.9	Confident	119 Å²	119	64.7 Å²	64.7	56%	0.556	35%	0.345	S	S	*	.	S	Bend	trans	-92	152.3	172.9	-67.3	-63.7	-29.6	0	0	110.4	K73	K73-Q76 PolarHBondContact O-NE2 3.18Å
77	P	92.1	Very high	89.9	Confident	60 Å²	60	63.3 Å²	63.3	39%	0.39	33%	0.331	S	S	.	.			cis	-84.2	141.7	3.8	32.4	-34.5	0	0	0	113.8	G88	P77-G88 PolarHBondContact O-N 2.94Å
78	V	91.6	Very high	90.4	Very high	20 Å²	20	57.6 Å²	57.6	12%	0.121	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.8	170.7	-169.7	0	0	0	0	110.2	Y71 I75 I85 I86 Y87	Y71-V78 HydrophobicContact CD2-CG1 4.33Å; Y71-V78 HydrophobicContact CE2-CG1 3.88Å; I75-V78 WeakPolarHBondContact O-CG2 3.32Å; V78-I85 HydrophobicContact CG1-CG2 3.85Å; V78-I86 WeakPolarHBondContact CA-O 2.86Å; V78-Y87 HydrophobicContact CB-CD1 4.23Å; V78-Y87 HydrophobicContact CB-CE1 4.23Å; V78-Y87 HydrophobicContact CG1-CD1 3.75Å; V78-Y87 HydrophobicContact CG1-CE1 3.46Å; V78-Y87 VanDerWaalsContact CG1-CE1 3.46Å; V78-Y87 HydrophobicContact CG2-CD1 3.55Å; V78-Y87 HydrophobicContact CG2-CE1 3.69Å
79	T	92.1	Very high	90.6	Very high	83 Å²	83	61.5 Å²	61.5	51%	0.509	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	143.7	174.5	56.9	0	0	0	0	110.5	I86	T79-I86 PolarHBondContact N-O 2.8Å; T79-I86 PolarHBondContact O-N 3.45Å
80	R	88.7	Confident	90.9	Very high	96 Å²	96	56 Å²	56	36%	0.362	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.6	175.5	-173.1	-172.3	75.5	95.3	-3.4	109	G82 T84 I85	R80-G82 PolarHBondContact NH1-O 2.95Å; R80-T84 WeakPolarHBondContact CA-O 3.35Å; R80-I85 HydrophobicContact CG-CG1 4.17Å
81	S	87.6	Confident	91	Very high	88 Å²	88	59.7 Å²	59.7	62%	0.615	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	107.3	171.7	-174.8	0	0	0	0	108.9	R83 T84	S81-R83 PolarHBondContact O-N 2.75Å; S81-T84 PolarHBondContact N-O 3.2Å; S81-T84 PolarHBondContact O-N 3.35Å
82	G	86.1	Confident	91	Very high	39 Å²	39	63 Å²	63	40%	0.402	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	-127.8	-173.7	0	0	0	0	0	112.5	R80 T84	R80-G82 PolarHBondContact NH1-O 2.95Å; G82-T84 PolarHBondContact O-N 2.9Å
83	R	89.2	Confident	91.1	Very high	130 Å²	130	62.4 Å²	62.4	49%	0.491	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-3.6	172.8	63.9	-177.7	-174.7	173.7	-0.9	116.1	L62 D65 S81	L62-R83 PolarHBondContact N-O 3.06Å; D65-R83 WeakPolarHBondContact OD1-CB 3.4Å; S81-R83 PolarHBondContact O-N 2.75Å
84	T	92.7	Very high	91.3	Very high	31 Å²	31	60.2 Å²	60.2	19%	0.19	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128.4	-174.5	-52.9	0	0	0	0	111.4	I59 V60 R61 R80 S81 G82 I86	I59-T84 HydrophobicContact CG2-CG2 3.45Å; I59-T84 VanDerWaalsContact CG2-CG2 3.45Å; V60-T84 CarbonylContact O-C 3.53Å; V60-T84 WeakPolarHBondContact O-CA 3.34Å; R61-T84 HydrophobicContact CG-CG2 4.44Å; R80-T84 WeakPolarHBondContact CA-O 3.35Å; S81-T84 PolarHBondContact N-O 3.2Å; S81-T84 PolarHBondContact O-N 3.35Å; G82-T84 PolarHBondContact O-N 2.9Å; T84-I86 HydrophobicContact CG2-CG1 4.17Å
85	I	93.3	Very high	91.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.9	171.7	-52.4	171	0	0	0	108.6	V60 L62 P68 Y71 V78 R80 Y87 I103	V60-I85 HydrophobicContact CB-CB 4.46Å; V60-I85 PolarHBondContact N-O 3.5Å; V60-I85 PolarHBondContact O-N 3.31Å; L62-I85 HydrophobicContact CD1-CD1 4.12Å; P68-I85 HydrophobicContact CG-CD1 4.33Å; Y71-I85 HydrophobicContact CD2-CD1 4.37Å; Y71-I85 HydrophobicContact CD2-CG2 4.29Å; Y71-I85 HydrophobicContact CE2-CG2 4.45Å; Y71-I85 HydrophobicContact CG-CD1 4.18Å; V78-I85 HydrophobicContact CG1-CG2 3.85Å; R80-I85 HydrophobicContact CG-CG1 4.17Å; I85-Y87 HydrophobicContact CB-CE2 4.2Å; I85-Y87 HydrophobicContact CG2-CD2 4.15Å; I85-Y87 HydrophobicContact CG2-CE1 4.27Å; I85-Y87 HydrophobicContact CG2-CE2 3.49Å; I85-Y87 VanDerWaalsContact CG2-CE2 3.49Å; I85-I103 HydrophobicContact CD1-CD1 4.36Å; I85-I103 HydrophobicContact CD1-CG2 4.34Å
86	I	94.6	Very high	91.8	Very high	35 Å²	35	62.5 Å²	62.5	18%	0.179	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122	-178.9	-58.2	174.4	0	0	0	108.6	K57 I59 V78 T79 T84	K57-I86 HydrophobicContact CD-CG2 4.39Å; K57-I86 HydrophobicContact CG-CG2 4.22Å; I59-I86 HydrophobicContact CG1-CG1 4.49Å; V78-I86 WeakPolarHBondContact CA-O 2.86Å; T79-I86 PolarHBondContact N-O 2.8Å; T79-I86 PolarHBondContact O-N 3.45Å; T84-I86 HydrophobicContact CG2-CG1 4.17Å
87	Y	94.2	Very high	92	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	130	174.7	-65.9	-78.5	0	0	0	109.9	H45 L58 V60 S72 V78 I85 L101	H45-Y87 AromaticContact CE1-CD1 3.54Å; H45-Y87 AromaticContact CE1-CE1 3.44Å; H45-Y87 VanDerWaalsContact CE1-CE1 3.44Å; H45-Y87 WeakPolarHBondContact CE1-CE1 3.34Å; H45-Y87 AromaticContact ND1-CD1 3.53Å; H45-Y87 AromaticContact ND1-CE1 3.9Å; H45-Y87 AromaticContact ND1-CG 3.95Å; L58-Y87 HydrophobicContact CD2-CD2 3.9Å; L58-Y87 HydrophobicContact CD2-CG 4.44Å; L58-Y87 HydrophobicContact CG-CD2 4.17Å; L58-Y87 PolarHBondContact N-O 2.97Å; L58-Y87 PolarHBondContact O-N 3.36Å; V60-Y87 HydrophobicContact CG2-CD2 4.27Å; V60-Y87 HydrophobicContact CG2-CE2 4.07Å; S72-Y87 VanDerWaalsContact O-CE1 3.23Å; S72-Y87 WeakPolarHBondContact O-CE1 3.22Å; S72-Y87 PolarHBondContact O-OH 3.37Å; V78-Y87 HydrophobicContact CB-CD1 4.23Å; V78-Y87 HydrophobicContact CB-CE1 4.23Å; V78-Y87 HydrophobicContact CG1-CD1 3.75Å; V78-Y87 HydrophobicContact CG1-CE1 3.46Å; V78-Y87 VanDerWaalsContact CG1-CE1 3.46Å; V78-Y87 HydrophobicContact CG2-CD1 3.55Å; V78-Y87 HydrophobicContact CG2-CE1 3.69Å; I85-Y87 HydrophobicContact CB-CE2 4.2Å; I85-Y87 HydrophobicContact CG2-CD2 4.15Å; I85-Y87 HydrophobicContact CG2-CE1 4.27Å; I85-Y87 HydrophobicContact CG2-CE2 3.49Å; I85-Y87 VanDerWaalsContact CG2-CE2 3.49Å; Y87-L101 HydrophobicContact CE1-CD1 4.13Å; Y87-L101 HydrophobicContact CE2-CD1 3.77Å; Y87-L101 HydrophobicContact CE2-CD2 4.17Å; Y87-L101 VanDerWaalsContact CZ-CD1 3.46Å; Y87-L101 VanDerWaalsContact OH-CD1 3.29Å; Y87-L101 WeakPolarHBondContact OH-CD1 2.87Å
88	G	90.3	Very high	92	Very high	6 Å²	6	61 Å²	61	6%	0.062	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87.4	-172.6	-177.2	0	0	0	0	0	113.6	P77	P77-G88 PolarHBondContact O-N 2.94Å
89	P	92.3	Very high	92	Very high	85 Å²	85	61.8 Å²	61.8	55%	0.552	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-70.7	143.1	20.6	29	-35.6	0	0	0	113.9	Q56	Q56-P89 CarbonylContact O-C 3.59Å; Q56-P89 WeakPolarHBondContact O-CA 3.23Å
90	Y	92.5	Very high	92	Very high	14 Å²	14	66 Å²	66	6%	0.055	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.1	170.5	-56.3	-49.4	0	0	0	109.4	Y46 N55 Q56 I75	Y46-Y90 AromaticContact CD1-CD2 3.96Å; Y46-Y90 HydrophobicContact CD1-CD2 3.96Å; Y46-Y90 AromaticContact CE1-CD2 3.49Å; Y46-Y90 HydrophobicContact CE1-CD2 3.49Å; Y46-Y90 VanDerWaalsContact CE1-CD2 3.49Å; Y46-Y90 HydrophobicContact CE1-CE2 4.02Å; Y46-Y90 AromaticContact CE1-CG 3.8Å; Y46-Y90 HydrophobicContact CE1-CG 3.8Å; N55-Y90 CarbonylContact C-O 3.55Å; N55-Y90 WeakPolarHBondContact CA-O 3.01Å; Q56-Y90 PolarHBondContact N-O 2.7Å; Q56-Y90 PolarHBondContact O-N 2.92Å; I75-Y90 HydrophobicContact CB-CE1 4.47Å; I75-Y90 HydrophobicContact CG2-CD1 4.11Å; I75-Y90 HydrophobicContact CG2-CE1 3.33Å; I75-Y90 HydrophobicContact CG2-CE2 4.45Å; I75-Y90 WeakPolarHBondContact CG2-OH 3.38Å; I75-Y90 PolarHBondContact O-OH 2.79Å
91	E	93.5	Very high	92.2	Very high	132 Å²	132	61.5 Å²	61.5	62%	0.617	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	149.7	-177	-56.7	-168.3	163.5	0	0	111.9	K54 I93	K54-E91 CarbonylContact O-C 3.48Å; K54-E91 VanDerWaalsContact O-CA 3.25Å; K54-E91 WeakPolarHBondContact O-CA 3.33Å; E91-I93 PolarHBondContact O-N 3.38Å
92	N	92.9	Very high	92.6	Very high	112 Å²	112	62.3 Å²	62.3	60%	0.599	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.4	55.5	171.7	-57.3	-48.2	0	0	0	114.1	V53 K54 P94	V53-N92 WeakPolarHBondContact O-CA 3.33Å; V53-N92 PolarHBondContact O-N 2.98Å; K54-N92 PolarHBondContact O-N 3.41Å; N92-P94 WeakPolarHBondContact O-CD 3.44Å
93	I	93.5	Very high	92.9	Very high	6 Å²	6	60.5 Å²	60.5	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.8	179.6	-56.6	159.3	0	0	0	108.8	Y46 T52 V53 Q56 E91 K97	Y46-I93 HydrophobicContact CD1-CD1 3.6Å; Y46-I93 HydrophobicContact CD1-CG1 4.03Å; Y46-I93 HydrophobicContact CD1-CG2 4.19Å; Y46-I93 HydrophobicContact CE1-CD1 4.02Å; Y46-I93 HydrophobicContact CE1-CG1 4.12Å; Y46-I93 HydrophobicContact CG-CD1 4.49Å; Y46-I93 HydrophobicContact CG-CG2 4.15Å; T52-I93 WeakPolarHBondContact CA-O 3.43Å; T52-I93 WeakPolarHBondContact CG2-O 3.28Å; V53-I93 HydrophobicContact CB-CB 4.21Å; V53-I93 HydrophobicContact CB-CD1 4.36Å; V53-I93 HydrophobicContact CG1-CD1 4.46Å; V53-I93 PolarHBondContact N-O 2.82Å; V53-I93 PolarHBondContact O-N 3.25Å; Q56-I93 HydrophobicContact CB-CD1 3.48Å; Q56-I93 VanDerWaalsContact CB-CD1 3.48Å; Q56-I93 HydrophobicContact CG-CD1 4.37Å; E91-I93 PolarHBondContact O-N 3.38Å; I93-K97 HydrophobicContact CG2-CB 3.93Å; I93-K97 HydrophobicContact CG2-CD 4.03Å
94	P	94.8	Very high	93.1	Very high	66 Å²	66	55.4 Å²	55.4	43%	0.429	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-66.9	157.9	177.6	26.4	-33.5	0	0	0	112	N92 K97	N92-P94 WeakPolarHBondContact O-CD 3.44Å; P94-K97 HydrophobicContact CG-CB 4.17Å; P94-K97 HydrophobicContact CG-CD 3.99Å; P94-K97 HydrophobicContact CG-CG 4.48Å; P94-K97 PolarHBondContact O-N 2.92Å
95	P	94.5	Very high	93	Very high	55 Å²	55	54.8 Å²	54.8	36%	0.357	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	145	174.1	-26.1	35	0	0	0	112.7	K97	P95-K97 PolarHBondContact O-N 3.49Å
96	Y	93.7	Very high	92.7	Very high	135 Å²	135	58.6 Å²	58.6	53%	0.529	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	16.8	175.4	-54.6	-67.4	0	0	0	116.3	Y48 L49 P50 T98	Y48-Y96 AromaticContact CE1-CD1 3.95Å; Y48-Y96 HydrophobicContact CE1-CD1 3.95Å; Y48-Y96 HydrophobicContact CE1-CE1 4.42Å; Y48-Y96 AromaticContact CE2-CD1 3.9Å; Y48-Y96 HydrophobicContact CE2-CD1 3.9Å; Y48-Y96 HydrophobicContact CE2-CG 4.4Å; Y48-Y96 AromaticContact CZ-CD1 3.55Å; L49-Y96 PolarHBondContact O-N 3.3Å; P50-Y96 HydrophobicContact CB-CE1 3.9Å; P50-Y96 HydrophobicContact CB-CE2 4.18Å; P50-Y96 WeakPolarHBondContact CB-OH 3.12Å; Y96-T98 PolarHBondContact O-N 2.97Å
97	K	92.5	Very high	92	Very high	80 Å²	80	57.2 Å²	57.2	35%	0.348	28%	0.284	S	S	.	.			trans	-66.8	123.7	175.3	-166.4	178	-174.3	-174.4	0	110.7	Y46 I93 P94 P95	Y46-K97 HydrophobicContact CD2-CB 4.37Å; Y46-K97 HydrophobicContact CD2-CD 3.8Å; Y46-K97 HydrophobicContact CD2-CG 3.82Å; Y46-K97 HydrophobicContact CE2-CD 3.61Å; Y46-K97 VanDerWaalsContact CE2-CE 3.5Å; Y46-K97 HydrophobicContact CE2-CG 4.04Å; I93-K97 HydrophobicContact CG2-CB 3.93Å; I93-K97 HydrophobicContact CG2-CD 4.03Å; P94-K97 HydrophobicContact CG-CB 4.17Å; P94-K97 HydrophobicContact CG-CD 3.99Å; P94-K97 HydrophobicContact CG-CG 4.48Å; P94-K97 PolarHBondContact O-N 2.92Å; P95-K97 PolarHBondContact O-N 3.49Å
98	T	91.2	Very high	91.1	Very high	67 Å²	67	59.3 Å²	59.3	41%	0.411	30%	0.295	S	S	.	.			trans	-122.2	126.6	178.1	-55.2	0	0	0	0	109.7	Y48 Y96	Y48-T98 WeakPolarHBondContact CD2-OG1 3.18Å; Y48-T98 WeakPolarHBondContact CE2-OG1 3.5Å; Y96-T98 PolarHBondContact O-N 2.97Å
99	V	92.1	Very high	90.5	Very high	38 Å²	38	60.6 Å²	60.6	23%	0.23	31%	0.305	C	S	.	.			trans	-136.7	126.1	170.6	-178.1	0	0	0	0	109	S44 H45 Y46 H74 I75 L101	S44-V99 CarbonylContact C-O 3.55Å; S44-V99 WeakPolarHBondContact CA-O 3.31Å; S44-V99 PolarHBondContact OG-O 3.32Å; H45-V99 PolarHBondContact N-O 3.38Å; Y46-V99 HydrophobicContact CD2-CB 4.11Å; Y46-V99 HydrophobicContact CD2-CG2 3.86Å; Y46-V99 HydrophobicContact CE2-CB 4.02Å; Y46-V99 HydrophobicContact CE2-CG2 3.53Å; H74-V99 VanDerWaalsContact NE2-CG1 3.34Å; H74-V99 WeakPolarHBondContact NE2-CG1 3.32Å; I75-V99 HydrophobicContact CD1-CB 3.85Å; I75-V99 HydrophobicContact CD1-CG1 3.49Å; I75-V99 VanDerWaalsContact CD1-CG1 3.49Å; I75-V99 HydrophobicContact CD1-CG2 4.23Å; I75-V99 HydrophobicContact CG1-CG1 4.46Å; V99-L101 PolarHBondContact O-N 3.36Å
100	Y	92.4	Very high	89.8	Confident	171 Å²	171	60.5 Å²	60.5	67%	0.671	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	130	-172.8	-66.9	-70.7	0	0	0	112.8	V42 G43 H45 H74	V42-Y100 HydrophobicContact CG1-CD1 4.48Å; G43-Y100 WeakPolarHBondContact O-CA 3.07Å; H45-Y100 PolarHBondContact CD2-O 3.45Å; H74-Y100 PolarHBondContact CE1-O 2.82Å
101	L	93.1	Very high	89.5	Confident	2 Å²	2	62 Å²	62	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.3	170.5	167.9	63.8	0	0	0	108	V42 G43 L58 V60 Y87 V99 I103	V42-L101 CarbonylContact C-O 3.6Å; V42-L101 WeakPolarHBondContact CA-O 3.25Å; G43-L101 PolarHBondContact N-O 2.82Å; G43-L101 PolarHBondContact O-N 3.4Å; L58-L101 HydrophobicContact CD2-CD2 3.79Å; V60-L101 HydrophobicContact CG2-CD2 4.34Å; Y87-L101 HydrophobicContact CE1-CD1 4.13Å; Y87-L101 HydrophobicContact CE2-CD1 3.77Å; Y87-L101 HydrophobicContact CE2-CD2 4.17Å; Y87-L101 VanDerWaalsContact CZ-CD1 3.46Å; Y87-L101 VanDerWaalsContact OH-CD1 3.29Å; Y87-L101 WeakPolarHBondContact OH-CD1 2.87Å; V99-L101 PolarHBondContact O-N 3.36Å; L101-I103 HydrophobicContact CD1-CD1 4.08Å; L101-I103 HydrophobicContact CD1-CG1 3.85Å; L101-I103 HydrophobicContact CD2-CD1 4.13Å; L101-I103 HydrophobicContact CG-CD1 4.21Å; L101-I103 HydrophobicContact CG-CG1 4.14Å
102	K	94.5	Very high	89.3	Confident	105 Å²	105	56.1 Å²	56.1	46%	0.457	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132.6	172.2	-172.7	177.5	-177.8	-177.3	0	109	V40 Y41 V42 Y71 S72	V40-K102 HydrophobicContact CG1-CD 4.42Å; V40-K102 HydrophobicContact CG1-CG 3.96Å; Y41-K102 WeakPolarHBondContact O-CA 3.17Å; V42-K102 HydrophobicContact CG2-CG 4.39Å; Y71-K102 CarbonylContact C-O 3.57Å; Y71-K102 WeakPolarHBondContact CA-O 3.41Å; S72-K102 PolarHBondContact N-O 2.91Å; S72-K102 PolarHBondContact OG-N 2.82Å; S72-K102 PolarHBondContact OG-O 2.94Å
103	I	93.6	Very high	89.2	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	123.1	176.3	-54	174.2	0	0	0	108	V40 Y41 V60 L62 P68 I85 L101 F105	V40-I103 CarbonylContact C-O 3.57Å; V40-I103 VanDerWaalsContact CA-O 3.31Å; V40-I103 WeakPolarHBondContact CA-O 3.49Å; Y41-I103 PolarHBondContact N-O 2.86Å; Y41-I103 PolarHBondContact O-N 2.89Å; V60-I103 HydrophobicContact CB-CD1 4.27Å; V60-I103 HydrophobicContact CG1-CD1 3.76Å; V60-I103 HydrophobicContact CG2-CD1 4.17Å; L62-I103 HydrophobicContact CD2-CG2 3.98Å; P68-I103 HydrophobicContact CB-CG2 4.46Å; I85-I103 HydrophobicContact CD1-CD1 4.36Å; I85-I103 HydrophobicContact CD1-CG2 4.34Å; L101-I103 HydrophobicContact CD1-CD1 4.08Å; L101-I103 HydrophobicContact CD1-CG1 3.85Å; L101-I103 HydrophobicContact CD2-CD1 4.13Å; L101-I103 HydrophobicContact CG-CD1 4.21Å; L101-I103 HydrophobicContact CG-CG1 4.14Å; I103-F105 HydrophobicContact CG2-CB 4.49Å; I103-F105 HydrophobicContact CG2-CD1 3.92Å
104	H	93.1	Very high	89.3	Confident	23 Å²	23	51.2 Å²	51.2	11%	0.106	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.1	174.9	-174.8	-162.3	0	0	0	107.9	F28 A39 V40 P68 E69 S70	F28-H104 AromaticContact CD1-CE1 3.84Å; F28-H104 AromaticContact CD1-NE2 3.9Å; F28-H104 PolarHBondContact O-NE2 3.33Å; A39-H104 PolarHBondContact O-CD2 3.41Å; V40-H104 HydrophobicContact CG2-CB 3.87Å; V40-H104 VanDerWaalsContact CG2-CD2 3.5Å; V40-H104 WeakPolarHBondContact CG2-CD2 3.25Å; P68-H104 CarbonylContact C-O 3.41Å; P68-H104 WeakPolarHBondContact CA-O 3.41Å; P68-H104 WeakPolarHBondContact CB-O 3.29Å; E69-H104 HydrophobicContact CB-CB 4.14Å; E69-H104 WeakPolarHBondContact CB-ND1 3.44Å; E69-H104 PolarHBondContact N-O 3.2Å; S70-H104 PolarHBondContact N-O 2.79Å; S70-H104 PolarHBondContact O-N 2.98Å; S70-H104 WeakPolarHBondContact OG-CB 3.4Å
105	F	90.4	Very high	89.3	Confident	17 Å²	17	49.3 Å²	49.3	8%	0.075	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	159	-170.8	64.1	-79.3	0	0	0	111.5	L25 A39 L62 P68 I103 T107	L25-F105 HydrophobicContact CD2-CE1 4.14Å; L25-F105 HydrophobicContact CD2-CZ 3.88Å; A39-F105 PolarHBondContact N-O 2.94Å; A39-F105 PolarHBondContact O-N 2.88Å; L62-F105 HydrophobicContact CD1-CB 4.28Å; L62-F105 HydrophobicContact CD2-CB 4.42Å; L62-F105 HydrophobicContact CD2-CD1 4.22Å; L62-F105 HydrophobicContact CD2-CD2 4.32Å; L62-F105 HydrophobicContact CD2-CG 4.08Å; P68-F105 HydrophobicContact CB-CB 4.21Å; I103-F105 HydrophobicContact CG2-CB 4.49Å; I103-F105 HydrophobicContact CG2-CD1 3.92Å; F105-T107 HydrophobicContact CE2-CG2 4.19Å
106	E	85.9	Confident	89.4	Confident	80 Å²	80	48.5 Å²	48.5	37%	0.374	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	133	172	-165.6	-174.3	-179.7	0	0	110.5	K37 L38 S64	K37-E106 HydrophobicContact CB-CG 4.11Å; K37-E106 CarbonylContact O-C 3.49Å; K37-E106 VanDerWaalsContact O-CA 3.22Å; K37-E106 WeakPolarHBondContact O-CA 3.29Å; K37-E106 WeakPolarHBondContact O-CG 3.43Å; L38-E106 HydrophobicContact CD2-CB 4.2Å; S64-E106 VanDerWaalsContact CB-O 3.32Å; S64-E106 WeakPolarHBondContact CB-O 3.34Å
107	T	81.4	Confident	89.6	Confident	6 Å²	6	42 Å²	42	4%	0.037	21%	0.211	C	C	.	.			trans	-143.2	131.6	176.9	-179.9	0	0	0	0	111.5	K37 A39 F105 A109 F111	K37-T107 PolarHBondContact O-N 2.71Å; A39-T107 HydrophobicContact CB-CG2 3.47Å; A39-T107 VanDerWaalsContact CB-CG2 3.47Å; F105-T107 HydrophobicContact CE2-CG2 4.19Å; T107-A109 WeakPolarHBondContact OG1-CB 3.47Å; T107-A109 PolarHBondContact OG1-N 3.46Å; T107-F111 HydrophobicContact CG2-CE2 3.81Å; T107-F111 HydrophobicContact CG2-CZ 3.63Å
108	N	75	Confident	89.9	Confident	44 Å²	44	40.7 Å²	40.7	24%	0.235	21%	0.206	C	C	.	.			trans	-102.6	14.5	175.9	-50.2	-14	0	0	0	111.4	K37 F63 S160	K37-N108 HydrophobicContact CD-CB 4.11Å; K37-N108 VanDerWaalsContact CD-CG 3.48Å; K37-N108 WeakPolarHBondContact CD-OD1 3.36Å; F63-N108 HydrophobicContact CE1-CB 3.94Å; N108-S160 WeakPolarHBondContact CB-OG 3.36Å; N108-S160 PolarHBondContact O-OG 2.8Å
109	A	78	Confident	90.2	Very high	33 Å²	33	37.7 Å²	37.7	27%	0.273	19%	0.187	S	C	.	.			trans	-59.8	140.7	177.6	0	0	0	0	0	110.5	F63 T107 F111	F63-A109 HydrophobicContact CD2-CB 4.26Å; F63-A109 HydrophobicContact CE2-CB 4.15Å; T107-A109 WeakPolarHBondContact OG1-CB 3.47Å; T107-A109 PolarHBondContact OG1-N 3.46Å; A109-F111 WeakPolarHBondContact O-CD2 3.25Å; A109-F111 PolarHBondContact O-N 3.2Å
110	Q	77.5	Confident	90.5	Very high	84 Å²	84	37.4 Å²	37.4	39%	0.393	18%	0.184	S	C	.	.			trans	-77.1	105.7	174.1	-60.8	175	19	0	0	107.1	L112	Q110-L112 HydrophobicContact CB-CD1 3.99Å; Q110-L112 HydrophobicContact CB-CG 4.13Å; Q110-L112 PolarHBondContact O-N 3.26Å
111	F	85.5	Confident	90.7	Very high	44 Å²	44	29.2 Å²	29.2	19%	0.193	15%	0.152	C	C	.	.			trans	-78.1	55.3	-178.7	-72.3	-90.5	0	0	0	111.1	L25 A39 T107 A109 H139 R140	L25-F111 HydrophobicContact CB-CE1 3.81Å; L25-F111 HydrophobicContact CD1-CE1 3.98Å; L25-F111 HydrophobicContact CD1-CZ 4.42Å; A39-F111 HydrophobicContact CB-CZ 4.05Å; T107-F111 HydrophobicContact CG2-CE2 3.81Å; T107-F111 HydrophobicContact CG2-CZ 3.63Å; A109-F111 WeakPolarHBondContact O-CD2 3.25Å; A109-F111 PolarHBondContact O-N 3.2Å; F111-H139 CarbonylContact O-C 3.56Å; F111-H139 WeakPolarHBondContact O-CA 3.31Å; F111-R140 PolarHBondContact O-N 3.42Å
112	L	88.9	Confident	90.9	Very high	9 Å²	9	31.6 Å²	31.6	5%	0.047	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	133.1	-178.2	-68.2	167.3	0	0	0	110.4	Q110 V137 H139 V164 Q166 L208 F246	Q110-L112 HydrophobicContact CB-CD1 3.99Å; Q110-L112 HydrophobicContact CB-CG 4.13Å; Q110-L112 PolarHBondContact O-N 3.26Å; L112-V137 HydrophobicContact CB-CG1 4.37Å; L112-V137 HydrophobicContact CD2-CG1 3.74Å; L112-H139 HydrophobicContact CD2-CB 4.49Å; L112-V164 HydrophobicContact CD1-CB 3.99Å; L112-V164 HydrophobicContact CD1-CG1 3.21Å; L112-V164 HydrophobicContact CD1-CG2 3.63Å; L112-V164 HydrophobicContact CD2-CB 4.29Å; L112-V164 HydrophobicContact CD2-CG1 4.03Å; L112-V164 HydrophobicContact CD2-CG2 3.45Å; L112-V164 VanDerWaalsContact CD2-CG2 3.45Å; L112-V164 HydrophobicContact CG-CG1 4.15Å; L112-V164 HydrophobicContact CG-CG2 3.78Å; L112-Q166 HydrophobicContact CD1-CG 4.25Å; L112-L208 HydrophobicContact CD2-CD1 3.97Å; L112-F246 HydrophobicContact CB-CE2 3.73Å; L112-F246 HydrophobicContact CB-CZ 3.78Å; L112-F246 HydrophobicContact CD1-CE2 4.3Å
113	V	92.3	Very high	91	Very high	16 Å²	16	26.6 Å²	26.6	10%	0.097	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.2	175.6	179.7	0	0	0	0	107.7	A115 V137 Q138 R140 V250 E252	V113-A115 PolarHBondContact O-N 2.88Å; V113-V137 WeakPolarHBondContact O-CA 3.43Å; V113-Q138 PolarHBondContact N-O 3.29Å; V113-Q138 PolarHBondContact O-N 3.33Å; V113-R140 HydrophobicContact CB-CG 4.11Å; V113-R140 HydrophobicContact CG2-CB 4.09Å; V113-R140 HydrophobicContact CG2-CG 3.95Å; V113-V250 HydrophobicContact CG1-CG1 4.44Å; V113-E252 VanDerWaalsContact CG1-CD 3.47Å; V113-E252 HydrophobicContact CG1-CG 3.54Å; V113-E252 WeakPolarHBondContact CG1-OE1 3.4Å
114	V	94.5	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	104.1	169.7	-167.8	0	0	0	0	106.5	S116 H117 M135 E136 V137 L245 F246 V250 D251 E252	V114-S116 WeakPolarHBondContact CG1-O 3.45Å; V114-H117 HydrophobicContact CG1-CB 3.8Å; V114-M135 HydrophobicContact CG1-CB 4.42Å; V114-M135 HydrophobicContact CG1-CG 4.33Å; V114-E136 CarbonylContact C-O 3.56Å; V114-E136 WeakPolarHBondContact CA-O 3.07Å; V114-V137 HydrophobicContact CG2-CG2 4.3Å; V114-L245 HydrophobicContact CG2-CD1 3.88Å; V114-F246 HydrophobicContact CG2-CE1 3.65Å; V114-F246 HydrophobicContact CG2-CZ 3.86Å; V114-V250 PolarHBondContact N-O 3.12Å; V114-D251 HydrophobicContact CB-CB 4.16Å; V114-E252 PolarHBondContact O-N 3.37Å
115	A	95.6	Very high	91	Very high	26 Å²	26	28.3 Å²	28.3	22%	0.215	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-35.4	-176.6	0	0	0	0	0	111.5	V113 E136	V113-A115 PolarHBondContact O-N 2.88Å; A115-E136 PolarHBondContact N-O 2.73Å
116	S	96.9	Very high	91.2	Very high	37 Å²	37	34 Å²	34	26%	0.259	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	133.8	173.3	-171.7	0	0	0	0	109.4	V114 E136	V114-S116 WeakPolarHBondContact CG1-O 3.45Å; S116-E136 PolarHBondContact O-N 2.93Å
117	H	97.4	Very high	91.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	115.9	177.9	-178.4	-165.6	0	0	0	109.2	V114 E133 N134 D251 N253 F254 I255	V114-H117 HydrophobicContact CG1-CB 3.8Å; H117-E133 IonicContact CE1-OE1 3.98Å; H117-E133 IonicContact NE2-OE1 2.66Å; H117-E133 PolarHBondContact NE2-OE1 2.84Å; H117-E133 IonicContact NE2-OE2 3.22Å; H117-N134 WeakPolarHBondContact CA-O 3.43Å; H117-D251 WeakPolarHBondContact CB-OD1 3.04Å; H117-D251 VanDerWaalsContact CB-OD2 3.22Å; H117-D251 WeakPolarHBondContact CB-OD2 3.27Å; H117-D251 IonicContact CG-OD2 2.65Å; H117-D251 IonicContact ND1-OD2 3.53Å; H117-D251 PolarHBondContact ND1-OD2 2.82Å; H117-N253 PolarHBondContact N-O 3.39Å; H117-F254 HydrophobicContact CB-CD2 4.18Å; H117-F254 AromaticContact CE1-CD2 3.79Å; H117-F254 AromaticContact CE1-CE2 3.56Å; H117-F254 AromaticContact CG-CD2 3.8Å; H117-F254 AromaticContact ND1-CD2 3.3Å; H117-F254 VanDerWaalsContact ND1-CD2 3.3Å; H117-F254 WeakPolarHBondContact ND1-CD2 3.41Å; H117-F254 AromaticContact ND1-CE2 3.59Å; H117-F254 WeakPolarHBondContact O-CA 3.32Å; H117-I255 PolarHBondContact O-N 3.21Å
118	E	97.9	Very high	92.1	Very high	52 Å²	52	34.6 Å²	34.6	24%	0.243	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	112.7	173.1	180	177.1	-142.8	0	0	109.3	I120 E133 N134 I255 K257	E118-I120 HydrophobicContact CG-CD1 4.46Å; E118-I120 HydrophobicContact CG-CG1 4.09Å; E118-E133 WeakPolarHBondContact O-CA 3.4Å; E118-N134 HydrophobicContact CB-CB 4.29Å; E118-N134 PolarHBondContact N-O 3.45Å; E118-N134 PolarHBondContact O-N 2.99Å; E118-I255 CarbonylContact C-O 3.56Å; E118-I255 WeakPolarHBondContact CA-O 3.44Å; E118-K257 VanDerWaalsContact OE1-CD 3.27Å; E118-K257 WeakPolarHBondContact OE1-CD 3.35Å; E118-K257 WeakPolarHBondContact OE1-CE 3.15Å; E118-K257 IonicContact OE1-NZ 3.62Å; E118-K257 PolarHBondContact OE1-NZ 2.84Å
119	R	97.8	Very high	93.1	Very high	3 Å²	3	32.5 Å²	32.5	1%	0.011	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	122	175.2	-179.6	175.9	-174.5	126.7	-1.7	109.6	L121 E133 Y220 D243 F254 I255 L256 K257	R119-L121 HydrophobicContact CG-CD2 4.35Å; R119-E133 HydrophobicContact CB-CG 4.28Å; R119-E133 WeakPolarHBondContact CD-OE1 3.46Å; R119-E133 HydrophobicContact CG-CG 4.02Å; R119-E133 IonicContact CZ-OE1 3.23Å; R119-E133 IonicContact NE-OE1 2.77Å; R119-E133 IonicContact NH1-OE1 3.32Å; R119-E133 PolarHBondContact NH1-OE1 3.08Å; R119-Y220 PolarHBondContact NH2-OH 2.83Å; R119-D243 VanDerWaalsContact NH1-N 3.17Å; R119-D243 IonicContact NH2-OD2 3.9Å; R119-F254 HydrophobicContact CB-CE2 3.86Å; R119-F254 HydrophobicContact CB-CZ 4.14Å; R119-I255 PolarHBondContact N-O 3.49Å; R119-L256 HydrophobicContact CB-CD1 4.13Å; R119-L256 HydrophobicContact CG-CD1 3.92Å; R119-L256 CarbonylContact O-C 3.57Å; R119-L256 WeakPolarHBondContact O-CA 3.48Å; R119-K257 PolarHBondContact O-N 3.21Å
120	I	97.9	Very high	94.1	Very high	32 Å²	32	32.5 Å²	32.5	16%	0.164	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.8	-179.6	-54	175.1	0	0	0	108	E118 V131 E132 K257 I259	E118-I120 HydrophobicContact CG-CD1 4.46Å; E118-I120 HydrophobicContact CG-CG1 4.09Å; I120-V131 WeakPolarHBondContact O-CA 3.22Å; I120-E132 HydrophobicContact CB-CB 4.42Å; I120-E132 PolarHBondContact N-O 3.33Å; I120-E132 PolarHBondContact O-N 2.9Å; I120-K257 CarbonylContact C-O 3.54Å; I120-K257 WeakPolarHBondContact CA-O 3.35Å; I120-K257 HydrophobicContact CG1-CB 4.41Å; I120-I259 HydrophobicContact CG2-CD1 3.59Å; I120-I259 HydrophobicContact CG2-CG1 4.15Å
121	L	97.2	Very high	95.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	108.5	174.1	-58.9	-178.5	0	0	0	108.2	R119 V131 M239 L256 K257 I258 I259 F313	R119-L121 HydrophobicContact CG-CD2 4.35Å; L121-V131 HydrophobicContact CD2-CB 4.09Å; L121-V131 HydrophobicContact CD2-CG1 3.73Å; L121-V131 HydrophobicContact CD2-CG2 3.58Å; L121-M239 HydrophobicContact CD1-SD 4.02Å; L121-M239 HydrophobicContact CD2-CE 4.2Å; L121-M239 HydrophobicContact CD2-SD 4.32Å; L121-L256 HydrophobicContact CD1-CD1 3.8Å; L121-L256 HydrophobicContact CG-CD1 3.92Å; L121-K257 PolarHBondContact N-O 3.46Å; L121-I258 HydrophobicContact CB-CG2 4.39Å; L121-I258 HydrophobicContact CD1-CG1 4.37Å; L121-I258 CarbonylContact O-C 3.52Å; L121-I258 WeakPolarHBondContact O-CA 3.46Å; L121-I259 PolarHBondContact O-N 2.85Å; L121-F313 HydrophobicContact CD1-CE1 4.04Å; L121-F313 HydrophobicContact CD1-CZ 3.83Å
122	E	97.3	Very high	95.7	Very high	52 Å²	52	28.7 Å²	28.7	24%	0.243	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	113.9	174.4	-176.6	170	-171.2	0	0	110.9	I129 A130 I259 R295	E122-I129 CarbonylContact O-C 3.51Å; E122-I129 WeakPolarHBondContact O-CA 3.34Å; E122-A130 HydrophobicContact CB-CB 4.37Å; E122-A130 PolarHBondContact N-O 2.92Å; E122-A130 PolarHBondContact O-N 2.85Å; E122-I259 HydrophobicContact CB-CB 4.27Å; E122-I259 HydrophobicContact CB-CD1 4.43Å; E122-I259 HydrophobicContact CG-CB 4.24Å; E122-I259 HydrophobicContact CG-CG2 4.24Å; E122-R295 IonicContact OE1-CZ 3.83Å; E122-R295 IonicContact OE1-NH1 3.65Å; E122-R295 PolarHBondContact OE1-NH1 3.2Å
123	V	96.4	Very high	96	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123	-179.4	-178.8	0	0	0	0	109.9	I129 L228 L237 I259 L260	V123-I129 HydrophobicContact CG1-CG1 4.48Å; V123-I129 HydrophobicContact CG2-CG2 4.31Å; V123-L228 HydrophobicContact CG1-CD2 4.48Å; V123-L237 HydrophobicContact CG2-CD1 4.25Å; V123-L237 HydrophobicContact CG2-CD2 3.94Å; V123-I259 PolarHBondContact N-O 2.88Å; V123-L260 HydrophobicContact CG2-CD2 4.48Å
124	S	94.7	Very high	96.3	Very high	20 Å²	20	29.5 Å²	29.5	14%	0.14	16%	0.162	C	C	.	.			trans	-115.7	125.1	172.6	-175.5	0	0	0	0	111.4	W126 G127 N128	S124-W126 PolarHBondContact O-N 3.03Å; S124-W126 WeakPolarHBondContact OG-CB 3.49Å; S124-W126 PolarHBondContact OG-N 2.89Å; S124-G127 PolarHBondContact O-N 3.44Å; S124-N128 WeakPolarHBondContact CB-O 3.4Å; S124-N128 PolarHBondContact N-O 3.49Å; S124-N128 VanDerWaalsContact N-O 3.1Å
125	H	93.5	Very high	96.3	Very high	39 Å²	39	29.6 Å²	29.6	18%	0.181	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-4	171.6	-77.5	-92.2	0	0	0	113.2	F235 P261 Y317 W319	H125-F235 AromaticContact CE1-CD1 3.52Å; H125-F235 AromaticContact CE1-CD2 3.89Å; H125-F235 AromaticContact CE1-CE1 3.37Å; H125-F235 WeakPolarHBondContact CE1-CE1 3.39Å; H125-F235 AromaticContact CE1-CE2 3.76Å; H125-F235 AromaticContact CE1-CG 3.78Å; H125-F235 AromaticContact CE1-CZ 3.49Å; H125-F235 VanDerWaalsContact CE1-CZ 3.49Å; H125-F235 WeakPolarHBondContact CE1-CZ 3.45Å; H125-F235 AromaticContact ND1-CE1 3.74Å; H125-F235 AromaticContact ND1-CZ 3.84Å; H125-P261 WeakPolarHBondContact CD2-CG 3.22Å; H125-P261 WeakPolarHBondContact NE2-CG 3.39Å; H125-Y317 PolarHBondContact CE1-OH 3Å; H125-Y317 AromaticContact NE2-CE2 3.59Å; H125-Y317 AromaticContact NE2-CZ 3.68Å; H125-Y317 PolarHBondContact NE2-OH 3.11Å; H125-W319 HydrophobicContact CB-CH2 4.12Å; H125-W319 HydrophobicContact CB-CZ3 4.05Å; H125-W319 AromaticContact CE1-CE3 3.99Å; H125-W319 AromaticContact CG-CE3 4Å; H125-W319 AromaticContact CG-CZ3 3.83Å; H125-W319 AromaticContact ND1-CE3 3.95Å; H125-W319 AromaticContact ND1-CZ3 3.99Å
126	W	92.9	Very high	96.3	Very high	137 Å²	137	33.1 Å²	33.1	52%	0.519	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-21.4	174.1	-69.5	101.9	0	0	0	113.8	S124 I324 E327 P328	S124-W126 PolarHBondContact O-N 3.03Å; S124-W126 WeakPolarHBondContact OG-CB 3.49Å; S124-W126 PolarHBondContact OG-N 2.89Å; W126-I324 HydrophobicContact CD2-CD1 4.39Å; W126-I324 HydrophobicContact CD2-CG1 4.4Å; W126-I324 HydrophobicContact CE3-CD1 4.39Å; W126-I324 HydrophobicContact CH2-CG1 4.05Å; W126-I324 HydrophobicContact CZ2-CG1 3.79Å; W126-I324 HydrophobicContact CZ3-CD1 4.48Å; W126-I324 HydrophobicContact CZ3-CG1 4.45Å; W126-E327 HydrophobicContact CZ2-CB 4.3Å; W126-E327 PolarHBondContact NE1-OE2 2.73Å; W126-P328 HydrophobicContact CH2-CG 3.78Å; W126-P328 HydrophobicContact CZ2-CG 4.11Å
127	G	91	Very high	96.1	Very high	37 Å²	37	31.3 Å²	31.3	38%	0.381	16%	0.162	S	C	.	.	S	Bend	trans	158.9	-19.6	170.7	0	0	0	0	0	117.8	S124 S224	S124-G127 PolarHBondContact O-N 3.44Å; G127-S224 WeakPolarHBondContact O-CB 3.46Å; G127-S224 PolarHBondContact O-N 2.92Å; G127-S224 PolarHBondContact O-OG 2.83Å; G127-S224 VanDerWaalsContact O-OG 3.08Å
128	N	95.8	Very high	95.8	Very high	61 Å²	61	33.9 Å²	33.9	33%	0.326	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	165.6	-175.2	64.8	-17.5	0	0	0	112.8	S124 V222	S124-N128 WeakPolarHBondContact CB-O 3.4Å; S124-N128 PolarHBondContact N-O 3.49Å; S124-N128 VanDerWaalsContact N-O 3.1Å; N128-V222 CarbonylContact C-O 3.56Å; N128-V222 WeakPolarHBondContact CA-O 3.25Å; N128-V222 WeakPolarHBondContact CB-O 3.39Å
129	I	97.4	Very high	95.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.9	167.3	-56.3	170.2	0	0	0	105.9	E122 V123 V222 L237 M239	E122-I129 CarbonylContact O-C 3.51Å; E122-I129 WeakPolarHBondContact O-CA 3.34Å; V123-I129 HydrophobicContact CG1-CG1 4.48Å; V123-I129 HydrophobicContact CG2-CG2 4.31Å; I129-V222 HydrophobicContact CB-CG2 3.91Å; I129-V222 PolarHBondContact N-O 2.86Å; I129-V222 PolarHBondContact O-N 2.91Å; I129-L237 HydrophobicContact CD1-CD1 3.66Å; I129-M239 HydrophobicContact CD1-SD 4.21Å; I129-M239 HydrophobicContact CG2-CE 4.5Å; I129-M239 HydrophobicContact CG2-SD 4.05Å
130	A	97.8	Very high	95	Very high	33 Å²	33	37.3 Å²	37.3	27%	0.273	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.4	176.4	0	0	0	0	0	109.2	E122 N221	E122-A130 HydrophobicContact CB-CB 4.37Å; E122-A130 PolarHBondContact N-O 2.92Å; E122-A130 PolarHBondContact O-N 2.85Å; A130-N221 WeakPolarHBondContact CB-OD1 3.2Å
131	V	97.9	Very high	94.5	Very high	2 Å²	2	36 Å²	36	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126	176	-175.4	0	0	0	0	108.1	I120 L121 E133 G219 Y220 M239	I120-V131 WeakPolarHBondContact O-CA 3.22Å; L121-V131 HydrophobicContact CD2-CB 4.09Å; L121-V131 HydrophobicContact CD2-CG1 3.73Å; L121-V131 HydrophobicContact CD2-CG2 3.58Å; V131-E133 HydrophobicContact CG1-CG 4.42Å; V131-G219 CarbonylContact O-C 3.52Å; V131-G219 WeakPolarHBondContact O-CA 3.31Å; V131-Y220 HydrophobicContact CB-CD1 4.22Å; V131-Y220 HydrophobicContact CB-CD2 4.21Å; V131-Y220 HydrophobicContact CB-CE1 3.83Å; V131-Y220 HydrophobicContact CB-CE2 3.84Å; V131-Y220 HydrophobicContact CB-CG 4.4Å; V131-Y220 HydrophobicContact CG1-CD1 4.45Å; V131-Y220 HydrophobicContact CG1-CE1 3.67Å; V131-Y220 HydrophobicContact CG1-CE2 4.29Å; V131-Y220 HydrophobicContact CG2-CD2 4.38Å; V131-Y220 HydrophobicContact CG2-CE2 3.83Å; V131-Y220 PolarHBondContact N-O 3.46Å; V131-Y220 PolarHBondContact O-N 2.85Å; V131-M239 HydrophobicContact CG2-CE 4.07Å
132	E	97.8	Very high	94	Very high	46 Å²	46	36.4 Å²	36.4	22%	0.215	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.8	172.9	-173	179.2	130	0	0	109.3	I120 N134 Y178 R180 T217	I120-E132 HydrophobicContact CB-CB 4.42Å; I120-E132 PolarHBondContact N-O 3.33Å; I120-E132 PolarHBondContact O-N 2.9Å; E132-N134 PolarHBondContact OE1-ND2 2.76Å; E132-Y178 WeakPolarHBondContact CG-OH 3.22Å; E132-Y178 PolarHBondContact OE2-OH 2.83Å; E132-R180 IonicContact OE1-NH2 3.14Å; E132-R180 PolarHBondContact OE1-NH2 2.88Å; E132-R180 IonicContact OE2-CZ 2.62Å; E132-R180 IonicContact OE2-NH2 3.82Å; E132-R180 PolarHBondContact OE2-NH2 3.42Å; E132-T217 HydrophobicContact CG-CG2 3.39Å
133	E	97	Very high	93.6	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.5	178.1	-65.4	-164.1	149.4	0	0	110.2	H117 E118 R119 V131 M135 M168 T217 V218 L245	H117-E133 IonicContact CE1-OE1 3.98Å; H117-E133 IonicContact NE2-OE1 2.66Å; H117-E133 PolarHBondContact NE2-OE1 2.84Å; H117-E133 IonicContact NE2-OE2 3.22Å; E118-E133 WeakPolarHBondContact O-CA 3.4Å; R119-E133 HydrophobicContact CB-CG 4.28Å; R119-E133 WeakPolarHBondContact CD-OE1 3.46Å; R119-E133 HydrophobicContact CG-CG 4.02Å; R119-E133 IonicContact CZ-OE1 3.23Å; R119-E133 IonicContact NE-OE1 2.77Å; R119-E133 IonicContact NH1-OE1 3.32Å; R119-E133 PolarHBondContact NH1-OE1 3.08Å; V131-E133 HydrophobicContact CG1-CG 4.42Å; E133-M135 HydrophobicContact CB-CE 4.11Å; E133-M168 WeakPolarHBondContact OE2-CE 3.44Å; E133-T217 CarbonylContact O-C 3.5Å; E133-T217 VanDerWaalsContact O-CA 3.24Å; E133-T217 WeakPolarHBondContact O-CA 3.5Å; E133-V218 PolarHBondContact N-O 2.82Å; E133-V218 PolarHBondContact O-N 2.9Å; E133-L245 WeakPolarHBondContact OE2-CD2 3.4Å
134	N	97.3	Very high	93.2	Very high	41 Å²	41	38.3 Å²	38.3	22%	0.219	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.5	173.5	-67	-53.5	0	0	0	108.7	H117 E118 E132 T217	H117-N134 WeakPolarHBondContact CA-O 3.43Å; E118-N134 HydrophobicContact CB-CB 4.29Å; E118-N134 PolarHBondContact N-O 3.45Å; E118-N134 PolarHBondContact O-N 2.99Å; E132-N134 PolarHBondContact OE1-ND2 2.76Å; N134-T217 WeakPolarHBondContact OD1-CB 3.43Å; N134-T217 WeakPolarHBondContact OD1-CG2 3.45Å; N134-T217 PolarHBondContact OD1-OG1 2.77Å
135	M	94.6	Very high	92.9	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.015	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.9	-174.5	-73.3	176.9	-90.3	0	0	111.5	V114 E133 V137 M168 A215 Y216 V218 L245	V114-M135 HydrophobicContact CG1-CB 4.42Å; V114-M135 HydrophobicContact CG1-CG 4.33Å; E133-M135 HydrophobicContact CB-CE 4.11Å; M135-V137 HydrophobicContact CB-CG2 4.31Å; M135-M168 HydrophobicContact CE-CE 3.51Å; M135-M168 HydrophobicContact SD-CE 4.13Å; M135-A215 VanDerWaalsContact O-CA 3.3Å; M135-A215 WeakPolarHBondContact O-CA 3.22Å; M135-Y216 HydrophobicContact CB-CE1 4.46Å; M135-Y216 HydrophobicContact CB-CE2 4.22Å; M135-Y216 HydrophobicContact CE-CD2 4.02Å; M135-Y216 HydrophobicContact CE-CE2 3.24Å; M135-Y216 PolarHBondContact N-O 3.33Å; M135-Y216 PolarHBondContact O-N 2.87Å; M135-Y216 HydrophobicContact SD-CE2 3.91Å; M135-Y216 PolarHBondContact SD-OH 2.88Å; M135-V218 HydrophobicContact CE-CB 4.31Å; M135-V218 HydrophobicContact CE-CG2 3.9Å; M135-L245 HydrophobicContact SD-CD1 4.34Å; M135-L245 HydrophobicContact SD-CD2 3.93Å
136	E	95.4	Very high	92.7	Very high	99 Å²	99	44.4 Å²	44.4	46%	0.463	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	109.6	163.3	-65.1	-165.8	171.8	0	0	109.4	V114 A115 S116 A215	V114-E136 CarbonylContact C-O 3.56Å; V114-E136 WeakPolarHBondContact CA-O 3.07Å; A115-E136 PolarHBondContact N-O 2.73Å; S116-E136 PolarHBondContact O-N 2.93Å; E136-A215 HydrophobicContact CG-CB 4.18Å
137	V	92.9	Very high	92.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.5	-178.5	-177.3	0	0	0	0	109.9	L112 V113 V114 M135 L208 K213 T214 Y216	L112-V137 HydrophobicContact CB-CG1 4.37Å; L112-V137 HydrophobicContact CD2-CG1 3.74Å; V113-V137 WeakPolarHBondContact O-CA 3.43Å; V114-V137 HydrophobicContact CG2-CG2 4.3Å; M135-V137 HydrophobicContact CB-CG2 4.31Å; V137-L208 HydrophobicContact CG1-CD1 4.42Å; V137-K213 CarbonylContact O-C 3.6Å; V137-K213 VanDerWaalsContact O-CA 3.26Å; V137-K213 WeakPolarHBondContact O-CA 3.3Å; V137-T214 HydrophobicContact CB-CG2 4.12Å; V137-T214 PolarHBondContact N-O 2.89Å; V137-T214 PolarHBondContact O-N 2.62Å; V137-Y216 HydrophobicContact CB-CE1 4.29Å; V137-Y216 HydrophobicContact CG2-CE1 3.59Å
138	Q	91.6	Very high	92.3	Very high	54 Å²	54	45.2 Å²	45.2	25%	0.252	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.1	178.6	-172.6	-178.6	20.4	0	0	110.9	V113 R140 K213	V113-Q138 PolarHBondContact N-O 3.29Å; V113-Q138 PolarHBondContact O-N 3.33Å; Q138-R140 HydrophobicContact CG-CG 4.34Å; Q138-R140 PolarHBondContact O-N 3.02Å; Q138-K213 HydrophobicContact CB-CB 4.23Å; Q138-K213 HydrophobicContact CG-CB 4.23Å
139	H	89.7	Confident	92	Very high	15 Å²	15	44 Å²	44	7%	0.069	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	103.9	169.3	-170	-58.2	0	0	0	110	F111 L112 G141 L208 F209 G210 G211 W212	F111-H139 CarbonylContact O-C 3.56Å; F111-H139 WeakPolarHBondContact O-CA 3.31Å; L112-H139 HydrophobicContact CD2-CB 4.49Å; H139-G141 PolarHBondContact ND1-N 3.04Å; H139-G141 VanDerWaalsContact ND1-N 3.2Å; H139-L208 HydrophobicContact CB-CB 4.22Å; H139-L208 PolarHBondContact CD2-O 3.05Å; H139-L208 VanDerWaalsContact CD2-O 3.26Å; H139-F209 WeakPolarHBondContact CB-O 3.32Å; H139-G210 WeakPolarHBondContact ND1-CA 3.09Å; H139-G211 PolarHBondContact O-N 2.98Å; H139-W212 PolarHBondContact N-O 3.33Å
140	R	89	Confident	91.5	Very high	112 Å²	112	49.8 Å²	49.8	42%	0.423	26%	0.26	S	S	.	.			trans	-89.8	7.7	-177.9	-69.4	-155.7	174.5	-175	2.7	115.6	F111 V113 Q138 E252	F111-R140 PolarHBondContact O-N 3.42Å; V113-R140 HydrophobicContact CB-CG 4.11Å; V113-R140 HydrophobicContact CG2-CB 4.09Å; V113-R140 HydrophobicContact CG2-CG 3.95Å; Q138-R140 HydrophobicContact CG-CG 4.34Å; Q138-R140 PolarHBondContact O-N 3.02Å; R140-E252 IonicContact CZ-OE1 3.88Å; R140-E252 IonicContact CZ-OE2 3.87Å; R140-E252 IonicContact NE-OE1 2.58Å; R140-E252 VanDerWaalsContact NH1-CD 3.32Å; R140-E252 IonicContact NH1-OE1 3.34Å; R140-E252 PolarHBondContact NH1-OE1 3Å; R140-E252 IonicContact NH1-OE2 3.11Å; R140-E252 PolarHBondContact NH1-OE2 2.9Å; R140-E252 IonicContact NH2-OE1 3.77Å; R140-E252 IonicContact NH2-OE2 2.64Å; R140-E252 PolarHBondContact NH2-OE2 3.18Å
141	G	86.4	Confident	91	Very high	3 Å²	3	52.5 Å²	52.5	3%	0.031	27%	0.27	C	S	.	.	S	Bend	trans	-68	-171.2	169.3	0	0	0	0	0	112.7	H139 I143	H139-G141 PolarHBondContact ND1-N 3.04Å; H139-G141 VanDerWaalsContact ND1-N 3.2Å; G141-I143 PolarHBondContact O-N 2.74Å
142	A	87.6	Confident	90.5	Very high	9 Å²	9	56 Å²	56	7%	0.074	29%	0.288	C	S	.	.	S	Bend	trans	-59.3	133.6	-179.3	0	0	0	0	0	111.7	P27 P29 T30 I32 G210	P27-A142 VanDerWaalsContact CB-CA 3.49Å; P27-A142 HydrophobicContact CB-CB 3.53Å; P29-A142 WeakPolarHBondContact O-CB 3.21Å; T30-A142 CarbonylContact O-C 3.49Å; T30-A142 WeakPolarHBondContact O-CA 3.22Å; I32-A142 HydrophobicContact CB-CB 4.06Å; I32-A142 HydrophobicContact CD1-CB 3.63Å; I32-A142 HydrophobicContact CG1-CB 3.46Å; I32-A142 VanDerWaalsContact CG1-CB 3.46Å; I32-A142 HydrophobicContact CG2-CB 3.57Å; A142-G210 VanDerWaalsContact O-CA 3.32Å; A142-G210 WeakPolarHBondContact O-CA 3.11Å
143	I	89.6	Confident	89.7	Confident	66 Å²	66	54.6 Å²	54.6	34%	0.338	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.7	-173.3	-60	172.9	0	0	0	109.8	T30 Y31 I32 G141 K145 G210	T30-I143 PolarHBondContact O-N 3.34Å; Y31-I143 CarbonylContact C-O 3.56Å; Y31-I143 VanDerWaalsContact CA-O 3.28Å; Y31-I143 WeakPolarHBondContact CA-O 3.06Å; Y31-I143 HydrophobicContact CD1-CB 3.85Å; Y31-I143 HydrophobicContact CD1-CG2 3.98Å; Y31-I143 HydrophobicContact CE1-CB 4.05Å; Y31-I143 HydrophobicContact CE1-CD1 4.13Å; Y31-I143 HydrophobicContact CE1-CG2 3.99Å; I32-I143 PolarHBondContact N-O 3.37Å; G141-I143 PolarHBondContact O-N 2.74Å; I143-K145 PolarHBondContact O-N 3.49Å; I143-G210 WeakPolarHBondContact CA-O 3.45Å
144	L	87.6	Confident	89.1	Confident	26 Å²	26	59.4 Å²	59.4	14%	0.136	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	121.2	177.4	-176.2	66	0	0	0	111	I32 Q34 F148 F209 G210 W212	I32-L144 CarbonylContact O-C 3.52Å; Q34-L144 HydrophobicContact CB-CD1 4.35Å; L144-F148 HydrophobicContact CD2-CB 4Å; L144-F209 HydrophobicContact CB-CB 4.14Å; L144-F209 HydrophobicContact CD1-CD1 4.02Å; L144-F209 HydrophobicContact CD1-CE1 4.48Å; L144-F209 HydrophobicContact CD2-CB 4.27Å; L144-F209 HydrophobicContact CD2-CD1 4.46Å; L144-F209 HydrophobicContact CD2-CG 4.23Å; L144-G210 PolarHBondContact N-O 2.76Å; L144-W212 HydrophobicContact CD2-CZ2 4.13Å
145	K	88.5	Confident	88.5	Confident	133 Å²	133	65.1 Å²	65.1	58%	0.578	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-95.1	125.5	173.1	-166.7	-178.9	175.4	-177.6	0	109.7	I32 I143	I32-K145 WeakPolarHBondContact O-CB 3.26Å; I32-K145 PolarHBondContact O-N 3.04Å; I143-K145 PolarHBondContact O-N 3.49Å
146	G	88.4	Confident	87.6	Confident	54 Å²	54	66.2 Å²	66.2	56%	0.557	33%	0.328	S	S	*	.	S	Bend	trans	85.1	-173.7	178.6	0	0	0	0	0	113.4
147	P	88.8	Confident	86.4	Confident	122 Å²	122	71.1 Å²	71.1	79%	0.792	34%	0.344	S	S	*	.			trans	-73.3	145.9	-176.3	30.1	-34.5	0	0	0	111.8
148	F	87.9	Confident	85.2	Confident	69 Å²	69	76.6 Å²	76.6	30%	0.303	36%	0.364	S	S	.	.			trans	-77.1	127.6	166.6	171.9	-107.6	0	0	0	110	L144 R150 Y153 P207 F209 W212	L144-F148 HydrophobicContact CD2-CB 4Å; F148-R150 HydrophobicContact CE1-CB 4.11Å; F148-R150 HydrophobicContact CZ-CB 4.45Å; F148-Y153 HydrophobicContact CE2-CD2 4.28Å; F148-Y153 HydrophobicContact CE2-CG 4.02Å; F148-Y153 HydrophobicContact CZ-CD1 4.42Å; F148-Y153 HydrophobicContact CZ-CG 4.11Å; F148-P207 HydrophobicContact CE2-CG 4.38Å; F148-P207 HydrophobicContact CZ-CG 4.08Å; F148-F209 HydrophobicContact CD2-CD2 4.1Å; F148-F209 AromaticContact CD2-CE2 3.64Å; F148-F209 HydrophobicContact CD2-CE2 3.64Å; F148-F209 HydrophobicContact CD2-CZ 4.15Å; F148-F209 HydrophobicContact CE2-CD2 4.18Å; F148-F209 AromaticContact CE2-CE2 3.37Å; F148-F209 HydrophobicContact CE2-CE2 3.37Å; F148-F209 AromaticContact CE2-CZ 3.92Å; F148-F209 HydrophobicContact CE2-CZ 3.92Å; F148-F209 HydrophobicContact CZ-CE2 4.42Å; F148-W212 HydrophobicContact CB-CH2 4.14Å; F148-W212 HydrophobicContact CB-CZ2 4.18Å; F148-W212 HydrophobicContact CD1-CH2 4.24Å; F148-W212 HydrophobicContact CD2-CH2 4.33Å; F148-W212 AromaticContact CG-CH2 3.96Å; F148-W212 HydrophobicContact CG-CH2 3.96Å; F148-W212 HydrophobicContact CG-CZ2 4.46Å
149	S	88.3	Confident	83.4	Confident	35 Å²	35	83.8 Å²	83.8	25%	0.245	40%	0.398	C	S	.	.			trans	-112.8	109.9	176.8	171.7	0	0	0	0	109.9	L151 D152 Y153	S149-L151 PolarHBondContact O-N 2.87Å; S149-D152 WeakPolarHBondContact CB-OD2 3.41Å; S149-D152 PolarHBondContact O-N 3.46Å; S149-D152 VanDerWaalsContact OG-CG 3.27Å; S149-D152 PolarHBondContact OG-N 3.18Å; S149-D152 PolarHBondContact OG-OD2 2.89Å; S149-Y153 WeakPolarHBondContact O-CB 3.44Å; S149-Y153 PolarHBondContact O-N 2.98Å
150	R	87.4	Confident	82	Confident	122 Å²	122	84.8 Å²	84.8	46%	0.46	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-35	176.7	-176.3	60.6	176.3	-171.6	-3	111.7	F148 Y153 Q154	F148-R150 HydrophobicContact CE1-CB 4.11Å; F148-R150 HydrophobicContact CZ-CB 4.45Å; R150-Y153 PolarHBondContact O-N 2.79Å; R150-Q154 HydrophobicContact CG-CG 4.43Å; R150-Q154 WeakPolarHBondContact O-CB 3.41Å; R150-Q154 WeakPolarHBondContact O-CG 3.43Å; R150-Q154 PolarHBondContact O-N 3.44Å
151	L	88.3	Confident	80.7	Confident	91 Å²	91	83.2 Å²	83.2	48%	0.476	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-49.6	177.2	179.6	65.9	0	0	0	111.1	S149 Y153 Q154 R155	S149-L151 PolarHBondContact O-N 2.87Å; L151-Y153 VanDerWaalsContact C-N 3.27Å; L151-Y153 PolarHBondContact O-N 3.4Å; L151-Q154 PolarHBondContact O-N 3.19Å; L151-R155 HydrophobicContact CD1-CG 4.42Å; L151-R155 WeakPolarHBondContact O-CB 3.4Å; L151-R155 WeakPolarHBondContact O-CG 3.33Å; L151-R155 PolarHBondContact O-N 3.31Å
152	D	85.7	Confident	79	Confident	76 Å²	76	84.3 Å²	84.3	41%	0.406	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-36.5	178.2	-65.2	-45.1	0	0	0	111	S149 R155 D156	S149-D152 WeakPolarHBondContact CB-OD2 3.41Å; S149-D152 PolarHBondContact O-N 3.46Å; S149-D152 VanDerWaalsContact OG-CG 3.27Å; S149-D152 PolarHBondContact OG-N 3.18Å; S149-D152 PolarHBondContact OG-OD2 2.89Å; D152-R155 PolarHBondContact O-N 2.96Å; D152-D156 WeakPolarHBondContact O-CB 3.4Å; D152-D156 PolarHBondContact O-N 3.35Å
153	Y	82.6	Confident	77.4	Confident	15 Å²	15	84.2 Å²	84.2	6%	0.059	41%	0.406	C	S	.	.	H	α-helix	trans	-64.5	-39.9	175.7	177.4	-96.9	0	0	0	112.8	Q34 F148 S149 R150 L151 R161 S163 P207 F209	Q34-Y153 VanDerWaalsContact NE2-CB 3.28Å; F148-Y153 HydrophobicContact CE2-CD2 4.28Å; F148-Y153 HydrophobicContact CE2-CG 4.02Å; F148-Y153 HydrophobicContact CZ-CD1 4.42Å; F148-Y153 HydrophobicContact CZ-CG 4.11Å; S149-Y153 WeakPolarHBondContact O-CB 3.44Å; S149-Y153 PolarHBondContact O-N 2.98Å; R150-Y153 PolarHBondContact O-N 2.79Å; L151-Y153 VanDerWaalsContact C-N 3.27Å; L151-Y153 PolarHBondContact O-N 3.4Å; Y153-R161 HydrophobicContact CE2-CB 4.37Å; Y153-S163 WeakPolarHBondContact OH-CB 3.5Å; Y153-S163 PolarHBondContact OH-OG 2.85Å; Y153-P207 HydrophobicContact CE1-CG 4.48Å; Y153-P207 HydrophobicContact CE2-CB 4.24Å; Y153-F209 HydrophobicContact CD2-CE2 4.15Å; Y153-F209 AromaticContact CD2-CZ 3.88Å; Y153-F209 HydrophobicContact CD2-CZ 3.88Å; Y153-F209 HydrophobicContact CE2-CE2 4.46Å; Y153-F209 HydrophobicContact CE2-CZ 4.35Å
154	Q	83.8	Confident	76.2	Confident	103 Å²	103	81.3 Å²	81.3	48%	0.481	39%	0.391	S	S	.	.	H	α-helix	trans	-74.6	-34.3	177.4	-74.6	176.7	-50.1	0	0	112.8	R150 L151 D156 R161	R150-Q154 HydrophobicContact CG-CG 4.43Å; R150-Q154 WeakPolarHBondContact O-CB 3.41Å; R150-Q154 WeakPolarHBondContact O-CG 3.43Å; R150-Q154 PolarHBondContact O-N 3.44Å; L151-Q154 PolarHBondContact O-N 3.19Å; Q154-D156 VanDerWaalsContact C-N 3.29Å; Q154-R161 PolarHBondContact O-NH2 2.62Å
155	R	84.5	Confident	75.1	Confident	161 Å²	161	83.9 Å²	83.9	61%	0.608	40%	0.402	S	S	*	.	H	α-helix	trans	-73.5	-19.7	175.1	-74.3	179.1	173.3	-178.7	-2.2	113.2	L151 D152 Y157	L151-R155 HydrophobicContact CD1-CG 4.42Å; L151-R155 WeakPolarHBondContact O-CB 3.4Å; L151-R155 WeakPolarHBondContact O-CG 3.33Å; L151-R155 PolarHBondContact O-N 3.31Å; D152-R155 PolarHBondContact O-N 2.96Å; R155-Y157 WeakPolarHBondContact O-CD2 3.3Å; R155-Y157 WeakPolarHBondContact O-CE2 3.31Å; R155-Y157 PolarHBondContact O-N 2.81Å
156	D	76.3	Confident	74.1	Confident	25 Å²	25	77.7 Å²	77.7	13%	0.134	38%	0.375	C	S	.	.			trans	-72.1	99.8	176.1	-164.2	-2.2	0	0	0	110	D152 Q154 R158 R161	D152-D156 WeakPolarHBondContact O-CB 3.4Å; D152-D156 PolarHBondContact O-N 3.35Å; Q154-D156 VanDerWaalsContact C-N 3.29Å; D156-R158 VanDerWaalsContact C-N 3.26Å; D156-R158 VanDerWaalsContact OD1-CB 3.24Å; D156-R158 WeakPolarHBondContact OD1-CB 3.35Å; D156-R158 WeakPolarHBondContact OD1-CD 3.5Å; D156-R158 WeakPolarHBondContact OD1-CG 3.29Å; D156-R158 PolarHBondContact OD1-N 2.84Å; D156-R158 VanDerWaalsContact OD1-N 3.13Å; D156-R158 IonicContact OD1-NE 3.95Å; D156-R161 VanDerWaalsContact O-CZ 3.28Å; D156-R161 PolarHBondContact O-NE 2.85Å; D156-R161 PolarHBondContact O-NH2 2.66Å
157	Y	69.2	Low	73.4	Confident	202 Å²	202	79 Å²	79	79%	0.792	37%	0.366	S	S	*	.			trans	-84.8	5.7	176.8	-68.5	-79.3	0	0	0	113.1	R155 E159	R155-Y157 WeakPolarHBondContact O-CD2 3.3Å; R155-Y157 WeakPolarHBondContact O-CE2 3.31Å; R155-Y157 PolarHBondContact O-N 2.81Å; Y157-E159 PolarHBondContact O-N 3Å
158	R	66.9	Low	73.3	Confident	115 Å²	115	73.3 Å²	73.3	43%	0.434	33%	0.329	S	S	.	.			trans	-57.1	129.3	174.8	-71	169.3	178.1	-172.6	-6.8	109.5	K35 D156 S160	K35-R158 PolarHBondContact O-NH1 3.23Å; D156-R158 VanDerWaalsContact C-N 3.26Å; D156-R158 VanDerWaalsContact OD1-CB 3.24Å; D156-R158 WeakPolarHBondContact OD1-CB 3.35Å; D156-R158 WeakPolarHBondContact OD1-CD 3.5Å; D156-R158 WeakPolarHBondContact OD1-CG 3.29Å; D156-R158 PolarHBondContact OD1-N 2.84Å; D156-R158 VanDerWaalsContact OD1-N 3.13Å; D156-R158 IonicContact OD1-NE 3.95Å; R158-S160 PolarHBondContact O-N 2.64Å
159	E	55.4	Low	73.4	Confident	206 Å²	206	72.8 Å²	72.8	96%	0.963	33%	0.329	S	S	*	.	S	Bend	trans	-54.8	-37.6	-178.1	-68.1	-178.9	164.5	0	0	112.3	Y157 R161	Y157-E159 PolarHBondContact O-N 3Å; E159-R161 PolarHBondContact O-N 2.85Å
160	S	59	Low	73.7	Confident	35 Å²	35	71.2 Å²	71.2	25%	0.245	32%	0.318	C	S	.	.	S	Bend	trans	-98.2	83	176.1	-174.3	0	0	0	0	109.8	K37 N108 R158	K37-S160 PolarHBondContact NZ-O 2.84Å; N108-S160 WeakPolarHBondContact CB-OG 3.36Å; N108-S160 PolarHBondContact O-OG 2.8Å; R158-S160 PolarHBondContact O-N 2.64Å
161	R	62.2	Low	74	Confident	80 Å²	80	66.2 Å²	66.2	30%	0.302	30%	0.301	S	S	.	.			trans	-70	146.3	166	-67.7	-179	174.1	175.4	-3.1	108.7	Y153 Q154 D156 E159 S163	Y153-R161 HydrophobicContact CE2-CB 4.37Å; Q154-R161 PolarHBondContact O-NH2 2.62Å; D156-R161 VanDerWaalsContact O-CZ 3.28Å; D156-R161 PolarHBondContact O-NE 2.85Å; D156-R161 PolarHBondContact O-NH2 2.66Å; E159-R161 PolarHBondContact O-N 2.85Å; R161-S163 VanDerWaalsContact CB-OG 3.25Å; R161-S163 WeakPolarHBondContact CB-OG 3.3Å; R161-S163 PolarHBondContact O-N 3.22Å
162	P	50.8	Low	74.2	Confident	26 Å²	26	64 Å²	64	17%	0.169	30%	0.296	C	S	.	.	S	Bend	trans	-66	2.6	169.2	27.9	-33	0	0	0	112.7	V164 L208 F209	P162-V164 PolarHBondContact O-N 3.34Å; P162-L208 VanDerWaalsContact O-O 3.11Å; P162-F209 HydrophobicContact CB-CD1 4.33Å; P162-F209 HydrophobicContact CB-CE1 4.03Å; P162-F209 HydrophobicContact CB-CZ 4.5Å; P162-F209 HydrophobicContact CG-CD1 4.09Å; P162-F209 HydrophobicContact CG-CE1 3.31Å; P162-F209 HydrophobicContact CG-CE2 4.5Å; P162-F209 HydrophobicContact CG-CZ 3.58Å
163	S	54.8	Low	74.6	Confident	7 Å²	7	61.5 Å²	61.5	5%	0.049	29%	0.285	C	S	.	.			trans	-76.2	120.3	171.2	50.7	0	0	0	0	111.7	Y153 R161 H165	Y153-S163 WeakPolarHBondContact OH-CB 3.5Å; Y153-S163 PolarHBondContact OH-OG 2.85Å; R161-S163 VanDerWaalsContact CB-OG 3.25Å; R161-S163 WeakPolarHBondContact CB-OG 3.3Å; R161-S163 PolarHBondContact O-N 3.22Å; S163-H165 PolarHBondContact O-N 3.11Å
164	V	62.8	Low	75.2	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	29%	0.286	C	S	.	.			trans	-69.7	116.1	175.2	171.4	0	0	0	0	110	L112 P162 Q166 L208	L112-V164 HydrophobicContact CD1-CB 3.99Å; L112-V164 HydrophobicContact CD1-CG1 3.21Å; L112-V164 HydrophobicContact CD1-CG2 3.63Å; L112-V164 HydrophobicContact CD2-CB 4.29Å; L112-V164 HydrophobicContact CD2-CG1 4.03Å; L112-V164 HydrophobicContact CD2-CG2 3.45Å; L112-V164 VanDerWaalsContact CD2-CG2 3.45Å; L112-V164 HydrophobicContact CG-CG1 4.15Å; L112-V164 HydrophobicContact CG-CG2 3.78Å; P162-V164 PolarHBondContact O-N 3.34Å; V164-Q166 HydrophobicContact CG1-CG 3.55Å; V164-L208 HydrophobicContact CB-CD1 4.4Å; V164-L208 HydrophobicContact CG2-CB 4.05Å; V164-L208 HydrophobicContact CG2-CD1 4.32Å
165	H	65.5	Low	75.7	Confident	81 Å²	81	58.9 Å²	58.9	38%	0.375	28%	0.28	S	S	.	.			trans	-107.1	120.2	159.2	-66.2	-62.1	0	0	0	105.9	S163 L201	S163-H165 PolarHBondContact O-N 3.11Å; H165-L201 HydrophobicContact CB-CD1 4.15Å
166	Q	68.1	Low	76.3	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.009	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.8	179.6	-76.4	167.1	-28.4	0	0	109.4	L112 V164 I202 Y216 F246	L112-Q166 HydrophobicContact CD1-CG 4.25Å; V164-Q166 HydrophobicContact CG1-CG 3.55Å; Q166-I202 PolarHBondContact N-O 2.83Å; Q166-I202 PolarHBondContact O-N 2.99Å; Q166-Y216 PolarHBondContact OE1-OH 2.83Å; Q166-Y216 VanDerWaalsContact OE1-OH 3.07Å; Q166-F246 HydrophobicContact CB-CB 4.18Å; Q166-F246 HydrophobicContact CG-CB 4.01Å; Q166-F246 HydrophobicContact CG-CD1 3.98Å; Q166-F246 HydrophobicContact CG-CG 4.05Å
167	F	72.8	Confident	77.2	Confident	83 Å²	83	57.2 Å²	57.2	36%	0.364	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	110.7	169.6	-64.9	-82	0	0	0	108.2	Q199 L201 H244 F246	F167-Q199 HydrophobicContact CD1-CG 4.19Å; F167-L201 HydrophobicContact CD1-CB 4.31Å; F167-L201 HydrophobicContact CD1-CD1 3.86Å; F167-L201 HydrophobicContact CE1-CB 4.28Å; F167-L201 HydrophobicContact CE1-CD1 3.52Å; F167-L201 HydrophobicContact CE1-CG 4.37Å; F167-L201 HydrophobicContact CE2-CD1 4.35Å; F167-L201 HydrophobicContact CG-CD1 4.44Å; F167-L201 HydrophobicContact CZ-CD1 3.78Å; F167-H244 PolarHBondContact O-CE1 3.45Å; F167-H244 PolarHBondContact O-ND1 3.07Å; F167-F246 WeakPolarHBondContact O-CA 3.47Å
168	M	86.9	Confident	78.5	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	139.6	169.6	-175.3	172.3	-106.9	0	0	108.4	E133 M135 L170 L200 I202 V218 H244 L245	E133-M168 WeakPolarHBondContact OE2-CE 3.44Å; M135-M168 HydrophobicContact CE-CE 3.51Å; M135-M168 HydrophobicContact SD-CE 4.13Å; M168-L170 HydrophobicContact CG-CD2 3.8Å; M168-L170 HydrophobicContact CG-CG 4.44Å; M168-L170 HydrophobicContact SD-CD2 3.76Å; M168-L200 HydrophobicContact CB-CB 4.35Å; M168-L200 PolarHBondContact N-O 3.05Å; M168-L200 PolarHBondContact O-N 3.16Å; M168-I202 HydrophobicContact CB-CD1 4.38Å; M168-I202 HydrophobicContact SD-CD1 4.34Å; M168-V218 HydrophobicContact SD-CB 4.29Å; M168-V218 HydrophobicContact SD-CG1 3.92Å; M168-V218 HydrophobicContact SD-CG2 4.24Å; M168-H244 WeakPolarHBondContact CG-O 3.24Å; M168-L245 WeakPolarHBondContact CA-O 3.34Å; M168-L245 HydrophobicContact CE-CB 4.46Å; M168-L245 HydrophobicContact CE-CD2 3.54Å
169	L	90.3	Very high	79.9	Confident	57 Å²	57	46.4 Å²	46.4	30%	0.298	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	109.9	175.7	-67.8	172.6	0	0	0	107.6	Q199 H244	L169-Q199 HydrophobicContact CD2-CB 4.19Å; L169-Q199 HydrophobicContact CD2-CG 4.22Å; L169-H244 HydrophobicContact CB-CB 4.08Å; L169-H244 PolarHBondContact N-O 2.81Å
170	L	93.8	Very high	81.9	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	157.7	177.2	-55.8	-179.8	0	0	0	110	M168 A174 V177 A197 V198 L200 Y220	M168-L170 HydrophobicContact CG-CD2 3.8Å; M168-L170 HydrophobicContact CG-CG 4.44Å; M168-L170 HydrophobicContact SD-CD2 3.76Å; L170-A174 HydrophobicContact CB-CB 4.01Å; L170-A174 HydrophobicContact CD1-CB 4.46Å; L170-V177 HydrophobicContact CD1-CG1 3.89Å; L170-V177 HydrophobicContact CD1-CG2 3.9Å; L170-A197 WeakPolarHBondContact O-CA 3.19Å; L170-V198 HydrophobicContact CB-CB 4.09Å; L170-V198 HydrophobicContact CB-CG1 4.44Å; L170-V198 HydrophobicContact CD1-CG1 4.45Å; L170-V198 PolarHBondContact N-O 2.94Å; L170-V198 PolarHBondContact O-N 3.26Å; L170-L200 HydrophobicContact CD1-CB 4.21Å; L170-L200 HydrophobicContact CD1-CD2 4.1Å; L170-L200 HydrophobicContact CG-CB 4.42Å; L170-Y220 HydrophobicContact CD1-CD1 4.33Å; L170-Y220 HydrophobicContact CD2-CD1 3.93Å; L170-Y220 HydrophobicContact CD2-CE1 3.65Å
171	P	93.7	Very high	83.5	Confident	16 Å²	16	40.6 Å²	40.6	10%	0.104	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	149.2	172.4	-24.9	34.4	0	0	0	112.9	S173 A174 Y220 V222 Y227	P171-S173 PolarHBondContact O-N 3.11Å; P171-S173 VanDerWaalsContact O-N 3.12Å; P171-A174 WeakPolarHBondContact O-CB 3.4Å; P171-A174 PolarHBondContact O-N 3.3Å; P171-Y220 HydrophobicContact CG-CE2 4.21Å; P171-V222 HydrophobicContact CB-CG1 4.46Å; P171-Y227 VanDerWaalsContact CB-OH 3.27Å; P171-Y227 WeakPolarHBondContact CB-OH 3.48Å
172	A	93.6	Very high	85	Confident	45 Å²	45	42.3 Å²	42.3	37%	0.372	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.9	-179.1	0	0	0	0	0	114	A174	A172-A174 VanDerWaalsContact C-N 3.35Å
173	S	93.9	Very high	87.2	Confident	24 Å²	24	47.5 Å²	47.5	17%	0.168	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	6.3	-179.7	57.8	0	0	0	0	114.1	P171 S175 E226	P171-S173 PolarHBondContact O-N 3.11Å; P171-S173 VanDerWaalsContact O-N 3.12Å; S173-S175 PolarHBondContact O-N 2.86Å; S173-E226 WeakPolarHBondContact CB-OE1 3.5Å; S173-E226 WeakPolarHBondContact CB-OE2 3.47Å; S173-E226 PolarHBondContact OG-OE2 3.39Å
174	A	95.5	Very high	89.1	Confident	10 Å²	10	48.7 Å²	48.7	8%	0.083	27%	0.271	C	S	.	.			trans	-62.9	123.3	177.7	0	0	0	0	0	111.4	L170 P171 A172 V177 Y220 N221	L170-A174 HydrophobicContact CB-CB 4.01Å; L170-A174 HydrophobicContact CD1-CB 4.46Å; P171-A174 WeakPolarHBondContact O-CB 3.4Å; P171-A174 PolarHBondContact O-N 3.3Å; A172-A174 VanDerWaalsContact C-N 3.35Å; A174-V177 HydrophobicContact CB-CG2 4.44Å; A174-Y220 HydrophobicContact CB-CD2 3.82Å; A174-Y220 HydrophobicContact CB-CE2 4.48Å; A174-Y220 HydrophobicContact CB-CG 4.31Å; A174-N221 CarbonylContact C-O 3.6Å; A174-N221 WeakPolarHBondContact CA-O 3.3Å
175	S	94.9	Very high	90.7	Very high	52 Å²	52	54 Å²	54	36%	0.364	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	166.6	174.4	58.6	0	0	0	0	111	S173 V177 N221	S173-S175 PolarHBondContact O-N 2.86Å; S175-V177 PolarHBondContact O-N 2.85Å; S175-V177 VanDerWaalsContact O-N 3.16Å; S175-N221 PolarHBondContact N-O 2.9Å; S175-N221 PolarHBondContact O-N 3.16Å; S175-N221 PolarHBondContact OG-O 3.42Å
176	D	95.7	Very high	92.1	Very high	114 Å²	114	50.2 Å²	50.2	61%	0.61	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.9	39.4	176.4	-49.6	-37.6	0	0	0	114.4	Y178 N221	D176-Y178 PolarHBondContact O-N 2.82Å; D176-N221 PolarHBondContact OD2-ND2 3.11Å
177	V	96.5	Very high	93.3	Very high	37 Å²	37	55 Å²	55	22%	0.224	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	125.1	-178	-174.7	0	0	0	0	110.1	L170 A174 S175 M191 L200 G219	L170-V177 HydrophobicContact CD1-CG1 3.89Å; L170-V177 HydrophobicContact CD1-CG2 3.9Å; A174-V177 HydrophobicContact CB-CG2 4.44Å; S175-V177 PolarHBondContact O-N 2.85Å; S175-V177 VanDerWaalsContact O-N 3.16Å; V177-M191 HydrophobicContact CB-SD 4.39Å; V177-M191 HydrophobicContact CG2-CE 4.09Å; V177-M191 HydrophobicContact CG2-SD 4.14Å; V177-L200 HydrophobicContact CG1-CD1 4.36Å; V177-L200 HydrophobicContact CG1-CD2 3.93Å; V177-G219 CarbonylContact C-O 3.58Å; V177-G219 VanDerWaalsContact CA-O 3.3Å; V177-G219 WeakPolarHBondContact CA-O 3.45Å
178	Y	96.6	Very high	94.2	Very high	84 Å²	84	53.7 Å²	53.7	33%	0.329	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.7	172.9	64.5	-92.9	0	0	0	111.7	E132 D176 R180 T217 V218 G219	E132-Y178 WeakPolarHBondContact CG-OH 3.22Å; E132-Y178 PolarHBondContact OE2-OH 2.83Å; D176-Y178 PolarHBondContact O-N 2.82Å; Y178-R180 HydrophobicContact CD2-CG 4.27Å; Y178-R180 HydrophobicContact CE2-CG 4.38Å; Y178-T217 HydrophobicContact CE2-CG2 4.31Å; Y178-V218 WeakPolarHBondContact O-CA 3.09Å; Y178-G219 VanDerWaalsContact CZ-CA 3.5Å; Y178-G219 PolarHBondContact N-O 2.82Å; Y178-G219 PolarHBondContact O-N 2.75Å
179	Y	95.7	Very high	94.5	Very high	7 Å²	7	55.9 Å²	55.9	3%	0.027	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	111.4	178.5	172.2	-130.7	0	0	0	109.3	N185 V186 I202 Y216 V218	Y179-N185 PolarHBondContact O-OD1 2.85Å; Y179-V186 HydrophobicContact CD1-CB 3.6Å; Y179-V186 HydrophobicContact CD1-CG1 3.9Å; Y179-V186 WeakPolarHBondContact CD1-O 3.3Å; Y179-V186 HydrophobicContact CE1-CB 3.37Å; Y179-V186 HydrophobicContact CE1-CG1 3.25Å; Y179-V186 HydrophobicContact CE1-CG2 4.14Å; Y179-V186 HydrophobicContact CG-CB 4.39Å; Y179-V186 PolarHBondContact O-N 2.78Å; Y179-V186 VanDerWaalsContact O-N 3.11Å; Y179-I202 HydrophobicContact CD1-CG2 4.14Å; Y179-I202 HydrophobicContact CD2-CD1 4.5Å; Y179-I202 HydrophobicContact CD2-CG2 4.04Å; Y179-I202 HydrophobicContact CE1-CG2 3.55Å; Y179-I202 HydrophobicContact CE2-CG2 3.44Å; Y179-I202 VanDerWaalsContact CE2-CG2 3.44Å; Y179-I202 HydrophobicContact CG-CG2 4.38Å; Y179-I202 WeakPolarHBondContact OH-CG2 3.28Å; Y179-Y216 HydrophobicContact CD2-CD2 4.15Å; Y179-Y216 AromaticContact CE2-CD2 3.55Å; Y179-Y216 HydrophobicContact CE2-CD2 3.55Å; Y179-Y216 HydrophobicContact CE2-CE2 4.36Å; Y179-Y216 AromaticContact CE2-CG 3.67Å; Y179-Y216 HydrophobicContact CE2-CG 3.67Å; Y179-V218 HydrophobicContact CD2-CG2 4.09Å
180	R	96.4	Very high	94.6	Very high	95 Å²	95	62.5 Å²	62.5	36%	0.358	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	158.4	-176.2	66.5	179.6	-176.4	-164.3	-5.6	111	E132 Y178 G184 Y216 T217	E132-R180 IonicContact OE1-NH2 3.14Å; E132-R180 PolarHBondContact OE1-NH2 2.88Å; E132-R180 IonicContact OE2-CZ 2.62Å; E132-R180 IonicContact OE2-NH2 3.82Å; E132-R180 PolarHBondContact OE2-NH2 3.42Å; Y178-R180 HydrophobicContact CD2-CG 4.27Å; Y178-R180 HydrophobicContact CE2-CG 4.38Å; R180-G184 CarbonylContact C-O 3.58Å; R180-G184 WeakPolarHBondContact CA-O 3.19Å; R180-G184 WeakPolarHBondContact CB-O 3.48Å; R180-Y216 CarbonylContact O-C 3.51Å; R180-Y216 WeakPolarHBondContact O-CA 3.32Å; R180-T217 HydrophobicContact CG-CG2 4.36Å; R180-T217 PolarHBondContact N-O 2.9Å; R180-T217 PolarHBondContact O-N 2.95Å
181	D	94.3	Very high	94.6	Very high	24 Å²	24	67.1 Å²	67.1	13%	0.128	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	-176.5	163.6	64.6	5.4	0	0	0	110.2	I183 G184 V186 R205	D181-I183 PolarHBondContact O-N 3.41Å; D181-I183 VanDerWaalsContact O-N 3.09Å; D181-I183 WeakPolarHBondContact OD1-CG1 3.3Å; D181-I183 PolarHBondContact OD1-N 2.94Å; D181-G184 PolarHBondContact N-O 3.09Å; D181-G184 PolarHBondContact O-N 3.21Å; D181-G184 PolarHBondContact OD1-N 3.2Å; D181-V186 HydrophobicContact CB-CG2 3.99Å; D181-R205 IonicContact OD1-CZ 3.4Å; D181-R205 IonicContact OD1-NE 3Å; D181-R205 IonicContact OD1-NH2 3.88Å; D181-R205 PolarHBondContact OD1-NH2 3.33Å; D181-R205 IonicContact OD2-CZ 3.46Å; D181-R205 IonicContact OD2-NE 3.23Å; D181-R205 PolarHBondContact OD2-NE 2.76Å; D181-R205 IonicContact OD2-NH2 3.36Å; D181-R205 PolarHBondContact OD2-NH2 2.88Å
182	S	93.3	Very high	94.6	Very high	116 Å²	116	74.2 Å²	74.2	81%	0.811	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.5	-178.8	56.2	0	0	0	0	114.1
183	I	95.4	Very high	94.5	Very high	135 Å²	135	79.1 Å²	79.1	69%	0.692	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-2.4	-178.8	62.5	169.8	0	0	0	113.3	D181	D181-I183 PolarHBondContact O-N 3.41Å; D181-I183 VanDerWaalsContact O-N 3.09Å; D181-I183 WeakPolarHBondContact OD1-CG1 3.3Å; D181-I183 PolarHBondContact OD1-N 2.94Å
184	G	95.8	Very high	94.5	Very high	31 Å²	31	80.9 Å²	80.9	32%	0.32	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	138.7	-156.4	171.1	0	0	0	0	0	114.5	R180 D181	R180-G184 CarbonylContact C-O 3.58Å; R180-G184 WeakPolarHBondContact CA-O 3.19Å; R180-G184 WeakPolarHBondContact CB-O 3.48Å; D181-G184 PolarHBondContact N-O 3.09Å; D181-G184 PolarHBondContact O-N 3.21Å; D181-G184 PolarHBondContact OD1-N 3.2Å
185	N	96.3	Very high	94.3	Very high	115 Å²	115	86.3 Å²	86.3	62%	0.615	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	143.1	-176.4	-171.1	57.6	0	0	0	111.8	Y179 R205	Y179-N185 PolarHBondContact O-OD1 2.85Å; N185-R205 PolarHBondContact O-NH2 3.16Å
186	V	93.9	Very high	94.2	Very high	3 Å²	3	89.7 Å²	89.7	2%	0.018	47%	0.472	C	S	.	.			trans	-114.6	111.3	174.2	-175	0	0	0	0	108.6	Y179 D181 T188 R205	Y179-V186 HydrophobicContact CD1-CB 3.6Å; Y179-V186 HydrophobicContact CD1-CG1 3.9Å; Y179-V186 WeakPolarHBondContact CD1-O 3.3Å; Y179-V186 HydrophobicContact CE1-CB 3.37Å; Y179-V186 HydrophobicContact CE1-CG1 3.25Å; Y179-V186 HydrophobicContact CE1-CG2 4.14Å; Y179-V186 HydrophobicContact CG-CB 4.39Å; Y179-V186 PolarHBondContact O-N 2.78Å; Y179-V186 VanDerWaalsContact O-N 3.11Å; D181-V186 HydrophobicContact CB-CG2 3.99Å; V186-T188 VanDerWaalsContact C-N 3.3Å; V186-T188 VanDerWaalsContact CG1-OG1 3.25Å; V186-T188 WeakPolarHBondContact CG1-OG1 3.2Å; V186-T188 PolarHBondContact O-N 2.88Å; V186-R205 HydrophobicContact CG1-CG 4.22Å; V186-R205 HydrophobicContact CG2-CG 4.42Å
187	S	94.2	Very high	94.1	Very high	101 Å²	101	84.9 Å²	84.9	71%	0.706	45%	0.448	S	S	*	.			trans	-80.6	-6.6	-175.7	54.5	0	0	0	0	114.4	S189	S187-S189 PolarHBondContact O-N 2.77Å
188	T	91.9	Very high	93.9	Very high	56 Å²	56	83.1 Å²	83.1	34%	0.344	44%	0.438	S	S	.	.			trans	-84.5	59.6	179.2	48.7	0	0	0	0	111.6	V186 Q203	V186-T188 VanDerWaalsContact C-N 3.3Å; V186-T188 VanDerWaalsContact CG1-OG1 3.25Å; V186-T188 WeakPolarHBondContact CG1-OG1 3.2Å; V186-T188 PolarHBondContact O-N 2.88Å; T188-Q203 WeakPolarHBondContact O-CB 3.27Å; T188-Q203 PolarHBondContact O-N 2.88Å; T188-Q203 PolarHBondContact OG1-O 2.96Å
189	S	92.5	Very high	93.8	Very high	48 Å²	48	81.6 Å²	81.6	34%	0.336	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.7	172.2	60.1	0	0	0	0	110.9	S187 L201	S187-S189 PolarHBondContact O-N 2.77Å; S189-L201 CarbonylContact C-O 3.58Å; S189-L201 WeakPolarHBondContact CA-O 3.35Å
190	R	93.2	Very high	93.7	Very high	196 Å²	196	81.4 Å²	81.4	74%	0.74	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	128.4	171.6	-59.4	-176.8	-177.5	175.2	-0.6	109.3	L201	R190-L201 HydrophobicContact CB-CB 4.2Å; R190-L201 HydrophobicContact CB-CD2 4.29Å; R190-L201 HydrophobicContact CG-CD2 4.35Å; R190-L201 PolarHBondContact N-O 2.87Å; R190-L201 PolarHBondContact O-N 2.93Å
191	M	93.5	Very high	93.5	Very high	101 Å²	101	78.5 Å²	78.5	50%	0.498	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.6	177.2	-175.1	-176.3	168.8	0	0	109.2	V177 V198 Q199 L200	V177-M191 HydrophobicContact CB-SD 4.39Å; V177-M191 HydrophobicContact CG2-CE 4.09Å; V177-M191 HydrophobicContact CG2-SD 4.14Å; M191-V198 HydrophobicContact CE-CB 4.32Å; M191-V198 HydrophobicContact CE-CG1 3.33Å; M191-V198 HydrophobicContact CE-CG2 4.02Å; M191-V198 HydrophobicContact CG-CG1 3.55Å; M191-V198 HydrophobicContact SD-CG1 4.1Å; M191-Q199 CarbonylContact C-O 3.56Å; M191-Q199 WeakPolarHBondContact CA-O 3.36Å; M191-L200 HydrophobicContact CB-CD1 4.35Å
192	R	93.8	Very high	93.3	Very high	165 Å²	165	77.4 Å²	77.4	62%	0.623	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.8	173.4	-178.8	-179.3	-178.6	175.5	1.2	108.7	L194 Q199	R192-L194 HydrophobicContact CG-CD2 4.23Å; R192-Q199 HydrophobicContact CB-CB 4.43Å; R192-Q199 PolarHBondContact N-O 3.24Å; R192-Q199 PolarHBondContact O-N 3.22Å
193	Q	92.4	Very high	93.2	Very high	148 Å²	148	75.9 Å²	75.9	69%	0.692	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	124.7	173.7	-164.6	165.7	16.4	0	0	109.5	V198	Q193-V198 HydrophobicContact CG-CG2 4.36Å
194	L	92.3	Very high	92.9	Very high	60 Å²	60	69.6 Å²	69.6	31%	0.314	37%	0.367	S	S	.	.			trans	-103.5	177.1	170.9	-53.1	173.5	0	0	0	108.6	R192 D196 A197 Q199	R192-L194 HydrophobicContact CG-CD2 4.23Å; L194-D196 VanDerWaalsContact C-N 3.32Å; L194-A197 CarbonylContact C-O 3.57Å; L194-A197 VanDerWaalsContact CA-O 3.31Å; L194-A197 WeakPolarHBondContact CA-O 3.38Å; L194-A197 VanDerWaalsContact CB-O 3.22Å; L194-A197 WeakPolarHBondContact CB-O 3.47Å; L194-A197 PolarHBondContact N-O 3.49Å; L194-Q199 HydrophobicContact CD1-CB 4.08Å; L194-Q199 HydrophobicContact CG-CB 4.43Å
195	S	91.2	Very high	92.6	Very high	124 Å²	124	73.9 Å²	73.9	87%	0.867	37%	0.373	S	S	*	.	S	Bend	trans	-69.1	-29.9	179.2	45.6	0	0	0	0	113.6
196	D	92.6	Very high	92.3	Very high	124 Å²	124	72.6 Å²	72.6	66%	0.663	36%	0.362	S	S	*	.	S	Bend	trans	-123.3	-9.7	-169.7	61.5	-29.4	0	0	0	113.4	L194	L194-D196 VanDerWaalsContact C-N 3.32Å
197	A	93.7	Very high	91.9	Very high	13 Å²	13	73.2 Å²	73.2	11%	0.107	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	166.7	-178.5	0	0	0	0	0	111.6	L170 L194	L170-A197 WeakPolarHBondContact O-CA 3.19Å; L194-A197 CarbonylContact C-O 3.57Å; L194-A197 VanDerWaalsContact CA-O 3.31Å; L194-A197 WeakPolarHBondContact CA-O 3.38Å; L194-A197 VanDerWaalsContact CB-O 3.22Å; L194-A197 WeakPolarHBondContact CB-O 3.47Å; L194-A197 PolarHBondContact N-O 3.49Å
198	V	94.3	Very high	91.5	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	117	164.7	168.3	0	0	0	0	107.7	L170 M191 Q193	L170-V198 HydrophobicContact CB-CB 4.09Å; L170-V198 HydrophobicContact CB-CG1 4.44Å; L170-V198 HydrophobicContact CD1-CG1 4.45Å; L170-V198 PolarHBondContact N-O 2.94Å; L170-V198 PolarHBondContact O-N 3.26Å; M191-V198 HydrophobicContact CE-CB 4.32Å; M191-V198 HydrophobicContact CE-CG1 3.33Å; M191-V198 HydrophobicContact CE-CG2 4.02Å; M191-V198 HydrophobicContact CG-CG1 3.55Å; M191-V198 HydrophobicContact SD-CG1 4.1Å; Q193-V198 HydrophobicContact CG-CG2 4.36Å
199	Q	93.4	Very high	91.2	Very high	51 Å²	51	66.1 Å²	66.1	24%	0.238	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	119.4	175	-174.2	177.9	46.1	0	0	109.7	F167 L169 M191 R192 L194	F167-Q199 HydrophobicContact CD1-CG 4.19Å; L169-Q199 HydrophobicContact CD2-CB 4.19Å; L169-Q199 HydrophobicContact CD2-CG 4.22Å; M191-Q199 CarbonylContact C-O 3.56Å; M191-Q199 WeakPolarHBondContact CA-O 3.36Å; R192-Q199 HydrophobicContact CB-CB 4.43Å; R192-Q199 PolarHBondContact N-O 3.24Å; R192-Q199 PolarHBondContact O-N 3.22Å; L194-Q199 HydrophobicContact CD1-CB 4.08Å; L194-Q199 HydrophobicContact CG-CB 4.43Å
200	L	94	Very high	90.8	Very high	4 Å²	4	64 Å²	64	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.4	175.4	-179.5	66.1	0	0	0	109.3	M168 L170 V177 M191 I202 V218	M168-L200 HydrophobicContact CB-CB 4.35Å; M168-L200 PolarHBondContact N-O 3.05Å; M168-L200 PolarHBondContact O-N 3.16Å; L170-L200 HydrophobicContact CD1-CB 4.21Å; L170-L200 HydrophobicContact CD1-CD2 4.1Å; L170-L200 HydrophobicContact CG-CB 4.42Å; V177-L200 HydrophobicContact CG1-CD1 4.36Å; V177-L200 HydrophobicContact CG1-CD2 3.93Å; M191-L200 HydrophobicContact CB-CD1 4.35Å; L200-I202 HydrophobicContact CD2-CD1 3.74Å; L200-I202 HydrophobicContact CD2-CG1 3.87Å; L200-I202 HydrophobicContact CG-CD1 4.16Å; L200-I202 HydrophobicContact CG-CG1 3.73Å; L200-V218 HydrophobicContact CD2-CG1 3.85Å
201	L	92.1	Very high	90.5	Very high	34 Å²	34	56.4 Å²	56.4	18%	0.178	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	119.8	168.5	175.1	70.8	0	0	0	108.6	H165 F167 S189 R190	H165-L201 HydrophobicContact CB-CD1 4.15Å; F167-L201 HydrophobicContact CD1-CB 4.31Å; F167-L201 HydrophobicContact CD1-CD1 3.86Å; F167-L201 HydrophobicContact CE1-CB 4.28Å; F167-L201 HydrophobicContact CE1-CD1 3.52Å; F167-L201 HydrophobicContact CE1-CG 4.37Å; F167-L201 HydrophobicContact CE2-CD1 4.35Å; F167-L201 HydrophobicContact CG-CD1 4.44Å; F167-L201 HydrophobicContact CZ-CD1 3.78Å; S189-L201 CarbonylContact C-O 3.58Å; S189-L201 WeakPolarHBondContact CA-O 3.35Å; R190-L201 HydrophobicContact CB-CB 4.2Å; R190-L201 HydrophobicContact CB-CD2 4.29Å; R190-L201 HydrophobicContact CG-CD2 4.35Å; R190-L201 PolarHBondContact N-O 2.87Å; R190-L201 PolarHBondContact O-N 2.93Å
202	I	90.5	Very high	90.5	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.9	178.1	-56.5	-178.5	0	0	0	108.8	Q166 M168 Y179 L200 Y216 V218	Q166-I202 PolarHBondContact N-O 2.83Å; Q166-I202 PolarHBondContact O-N 2.99Å; M168-I202 HydrophobicContact CB-CD1 4.38Å; M168-I202 HydrophobicContact SD-CD1 4.34Å; Y179-I202 HydrophobicContact CD1-CG2 4.14Å; Y179-I202 HydrophobicContact CD2-CD1 4.5Å; Y179-I202 HydrophobicContact CD2-CG2 4.04Å; Y179-I202 HydrophobicContact CE1-CG2 3.55Å; Y179-I202 HydrophobicContact CE2-CG2 3.44Å; Y179-I202 VanDerWaalsContact CE2-CG2 3.44Å; Y179-I202 HydrophobicContact CG-CG2 4.38Å; Y179-I202 WeakPolarHBondContact OH-CG2 3.28Å; L200-I202 HydrophobicContact CD2-CD1 3.74Å; L200-I202 HydrophobicContact CD2-CG1 3.87Å; L200-I202 HydrophobicContact CG-CD1 4.16Å; L200-I202 HydrophobicContact CG-CG1 3.73Å; I202-Y216 HydrophobicContact CD1-CE2 4.31Å; I202-V218 HydrophobicContact CD1-CG2 3.51Å
203	Q	89.8	Confident	90.4	Very high	83 Å²	83	54.3 Å²	54.3	39%	0.388	28%	0.277	S	S	.	.			trans	-121.7	117.5	171.5	-179.4	179.8	-21.4	0	0	109.4	T188	T188-Q203 WeakPolarHBondContact O-CB 3.27Å; T188-Q203 PolarHBondContact O-N 2.88Å; T188-Q203 PolarHBondContact OG1-O 2.96Å
204	P	90.2	Very high	90.5	Very high	4 Å²	4	48 Å²	48	3%	0.026	25%	0.249	C	C	.	.			trans	-58.7	157.8	172.3	-22.4	32.8	0	0	0	112.1	F206 L208 T214	P204-F206 PolarHBondContact O-N 3.32Å; P204-F206 VanDerWaalsContact O-N 3.08Å; P204-L208 HydrophobicContact CG-CD1 4.45Å; P204-T214 HydrophobicContact CB-CG2 4.35Å; P204-T214 HydrophobicContact CG-CG2 4.27Å
205	R	89.9	Confident	90.6	Very high	121 Å²	121	47.3 Å²	47.3	46%	0.457	25%	0.251	S	S	.	.	S	Bend	trans	-57.9	-27.1	-178.9	-66.3	-164.4	-169.5	-87.1	-3.7	113.8	D181 N185 V186	D181-R205 IonicContact OD1-CZ 3.4Å; D181-R205 IonicContact OD1-NE 3Å; D181-R205 IonicContact OD1-NH2 3.88Å; D181-R205 PolarHBondContact OD1-NH2 3.33Å; D181-R205 IonicContact OD2-CZ 3.46Å; D181-R205 IonicContact OD2-NE 3.23Å; D181-R205 PolarHBondContact OD2-NE 2.76Å; D181-R205 IonicContact OD2-NH2 3.36Å; D181-R205 PolarHBondContact OD2-NH2 2.88Å; N185-R205 PolarHBondContact O-NH2 3.16Å; V186-R205 HydrophobicContact CG1-CG 4.22Å; V186-R205 HydrophobicContact CG2-CG 4.42Å
206	F	88.1	Confident	90.8	Very high	87 Å²	87	41.6 Å²	41.6	38%	0.382	21%	0.211	S	C	.	.	S	Bend	trans	-137.1	150.5	179.2	53.1	-93.4	0	0	0	110.4	P204 L208 W212	P204-F206 PolarHBondContact O-N 3.32Å; P204-F206 VanDerWaalsContact O-N 3.08Å; F206-L208 HydrophobicContact CD2-CD2 4.25Å; F206-L208 HydrophobicContact CE2-CD2 3.72Å; F206-W212 AromaticContact CD2-CE3 3.67Å; F206-W212 HydrophobicContact CD2-CE3 3.67Å; F206-W212 AromaticContact CD2-CZ3 3.96Å; F206-W212 HydrophobicContact CD2-CZ3 3.96Å; F206-W212 HydrophobicContact CE2-CE3 4.03Å
207	P	85.7	Confident	91	Very high	17 Å²	17	36.5 Å²	36.5	11%	0.11	18%	0.184	C	C	.	.			trans	-64.7	138.3	176.1	28.7	-34.9	0	0	0	110.2	F148 Y153 F209 W212	F148-P207 HydrophobicContact CE2-CG 4.38Å; F148-P207 HydrophobicContact CZ-CG 4.08Å; Y153-P207 HydrophobicContact CE1-CG 4.48Å; Y153-P207 HydrophobicContact CE2-CB 4.24Å; P207-F209 HydrophobicContact CB-CE2 4.24Å; P207-F209 HydrophobicContact CG-CE2 4.12Å; P207-F209 PolarHBondContact O-N 2.85Å; P207-W212 WeakPolarHBondContact O-CZ3 3.5Å
208	L	86.1	Confident	91.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.			trans	-88.6	106.1	178.6	-64.5	172.8	0	0	0	110.8	L112 V137 H139 P162 V164 P204 F206 W212 T214	L112-L208 HydrophobicContact CD2-CD1 3.97Å; V137-L208 HydrophobicContact CG1-CD1 4.42Å; H139-L208 HydrophobicContact CB-CB 4.22Å; H139-L208 PolarHBondContact CD2-O 3.05Å; H139-L208 VanDerWaalsContact CD2-O 3.26Å; P162-L208 VanDerWaalsContact O-O 3.11Å; V164-L208 HydrophobicContact CB-CD1 4.4Å; V164-L208 HydrophobicContact CG2-CB 4.05Å; V164-L208 HydrophobicContact CG2-CD1 4.32Å; P204-L208 HydrophobicContact CG-CD1 4.45Å; F206-L208 HydrophobicContact CD2-CD2 4.25Å; F206-L208 HydrophobicContact CE2-CD2 3.72Å; L208-W212 HydrophobicContact CD2-CB 4.13Å; L208-T214 HydrophobicContact CD1-CG2 3.78Å; L208-T214 HydrophobicContact CD2-CG2 4.11Å; L208-T214 HydrophobicContact CG-CG2 4.44Å
209	F	85.4	Confident	91.3	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.035	18%	0.179	C	C	.	.			trans	-87.6	164.8	165.7	-78.3	-91.8	0	0	0	111.1	Q34 H139 L144 F148 Y153 P162 P207 G211 W212	Q34-F209 HydrophobicContact CB-CE1 4.46Å; Q34-F209 HydrophobicContact CG-CE1 3.7Å; Q34-F209 HydrophobicContact CG-CZ 3.84Å; H139-F209 WeakPolarHBondContact CB-O 3.32Å; L144-F209 HydrophobicContact CB-CB 4.14Å; L144-F209 HydrophobicContact CD1-CD1 4.02Å; L144-F209 HydrophobicContact CD1-CE1 4.48Å; L144-F209 HydrophobicContact CD2-CB 4.27Å; L144-F209 HydrophobicContact CD2-CD1 4.46Å; L144-F209 HydrophobicContact CD2-CG 4.23Å; F148-F209 HydrophobicContact CD2-CD2 4.1Å; F148-F209 AromaticContact CD2-CE2 3.64Å; F148-F209 HydrophobicContact CD2-CE2 3.64Å; F148-F209 HydrophobicContact CD2-CZ 4.15Å; F148-F209 HydrophobicContact CE2-CD2 4.18Å; F148-F209 AromaticContact CE2-CE2 3.37Å; F148-F209 HydrophobicContact CE2-CE2 3.37Å; F148-F209 AromaticContact CE2-CZ 3.92Å; F148-F209 HydrophobicContact CE2-CZ 3.92Å; F148-F209 HydrophobicContact CZ-CE2 4.42Å; Y153-F209 HydrophobicContact CD2-CE2 4.15Å; Y153-F209 AromaticContact CD2-CZ 3.88Å; Y153-F209 HydrophobicContact CD2-CZ 3.88Å; Y153-F209 HydrophobicContact CE2-CE2 4.46Å; Y153-F209 HydrophobicContact CE2-CZ 4.35Å; P162-F209 HydrophobicContact CB-CD1 4.33Å; P162-F209 HydrophobicContact CB-CE1 4.03Å; P162-F209 HydrophobicContact CB-CZ 4.5Å; P162-F209 HydrophobicContact CG-CD1 4.09Å; P162-F209 HydrophobicContact CG-CE1 3.31Å; P162-F209 HydrophobicContact CG-CE2 4.5Å; P162-F209 HydrophobicContact CG-CZ 3.58Å; P207-F209 HydrophobicContact CB-CE2 4.24Å; P207-F209 HydrophobicContact CG-CE2 4.12Å; P207-F209 PolarHBondContact O-N 2.85Å; F209-G211 PolarHBondContact O-N 3.02Å; F209-W212 HydrophobicContact CB-CD2 4.16Å; F209-W212 HydrophobicContact CB-CG 4.39Å; F209-W212 HydrophobicContact CD2-CH2 4.31Å; F209-W212 HydrophobicContact CD2-CZ3 4.31Å; F209-W212 WeakPolarHBondContact O-CB 3.39Å; F209-W212 PolarHBondContact O-N 3.12Å
210	G	85.4	Confident	91.4	Very high	4 Å²	4	33.5 Å²	33.5	4%	0.041	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-55.2	132.8	179.6	0	0	0	0	0	113.2	H139 A142 I143 L144 W212	H139-G210 WeakPolarHBondContact ND1-CA 3.09Å; A142-G210 VanDerWaalsContact O-CA 3.32Å; A142-G210 WeakPolarHBondContact O-CA 3.11Å; I143-G210 WeakPolarHBondContact CA-O 3.45Å; L144-G210 PolarHBondContact N-O 2.76Å; G210-W212 VanDerWaalsContact C-N 3.32Å
211	G	87.3	Confident	91.6	Very high	35 Å²	35	34.8 Å²	34.8	36%	0.361	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	-18	-172.8	0	0	0	0	0	114.3	H139 F209	H139-G211 PolarHBondContact O-N 2.98Å; F209-G211 PolarHBondContact O-N 3.02Å
212	W	91.6	Very high	91.9	Very high	77 Å²	77	33.2 Å²	33.2	29%	0.292	17%	0.166	S	C	.	.			trans	-79.8	149.5	179.9	-61.6	14.6	0	0	0	110.7	H139 L144 F148 F206 P207 L208 F209 G210	H139-W212 PolarHBondContact N-O 3.33Å; L144-W212 HydrophobicContact CD2-CZ2 4.13Å; F148-W212 HydrophobicContact CB-CH2 4.14Å; F148-W212 HydrophobicContact CB-CZ2 4.18Å; F148-W212 HydrophobicContact CD1-CH2 4.24Å; F148-W212 HydrophobicContact CD2-CH2 4.33Å; F148-W212 AromaticContact CG-CH2 3.96Å; F148-W212 HydrophobicContact CG-CH2 3.96Å; F148-W212 HydrophobicContact CG-CZ2 4.46Å; F206-W212 AromaticContact CD2-CE3 3.67Å; F206-W212 HydrophobicContact CD2-CE3 3.67Å; F206-W212 AromaticContact CD2-CZ3 3.96Å; F206-W212 HydrophobicContact CD2-CZ3 3.96Å; F206-W212 HydrophobicContact CE2-CE3 4.03Å; P207-W212 WeakPolarHBondContact O-CZ3 3.5Å; L208-W212 HydrophobicContact CD2-CB 4.13Å; F209-W212 HydrophobicContact CB-CD2 4.16Å; F209-W212 HydrophobicContact CB-CG 4.39Å; F209-W212 HydrophobicContact CD2-CH2 4.31Å; F209-W212 HydrophobicContact CD2-CZ3 4.31Å; F209-W212 WeakPolarHBondContact O-CB 3.39Å; F209-W212 PolarHBondContact O-N 3.12Å; G210-W212 VanDerWaalsContact C-N 3.32Å
213	K	93.1	Very high	92.2	Very high	145 Å²	145	34.4 Å²	34.4	63%	0.63	17%	0.174	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.1	178	63.4	177.8	-176.5	170.9	0	110.7	V137 Q138	V137-K213 CarbonylContact O-C 3.6Å; V137-K213 VanDerWaalsContact O-CA 3.26Å; V137-K213 WeakPolarHBondContact O-CA 3.3Å; Q138-K213 HydrophobicContact CB-CB 4.23Å; Q138-K213 HydrophobicContact CG-CB 4.23Å
214	T	93.3	Very high	92.5	Very high	17 Å²	17	31.4 Å²	31.4	10%	0.104	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.4	171.8	-171.7	0	0	0	0	108.8	V137 P204 L208 Y216	V137-T214 HydrophobicContact CB-CG2 4.12Å; V137-T214 PolarHBondContact N-O 2.89Å; V137-T214 PolarHBondContact O-N 2.62Å; P204-T214 HydrophobicContact CB-CG2 4.35Å; P204-T214 HydrophobicContact CG-CG2 4.27Å; L208-T214 HydrophobicContact CD1-CG2 3.78Å; L208-T214 HydrophobicContact CD2-CG2 4.11Å; L208-T214 HydrophobicContact CG-CG2 4.44Å; T214-Y216 HydrophobicContact CG2-CD1 4.03Å; T214-Y216 HydrophobicContact CG2-CE1 4.18Å
215	A	95.1	Very high	92.7	Very high	44 Å²	44	39.2 Å²	39.2	36%	0.364	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.6	172.1	0	0	0	0	0	108.2	M135 E136	M135-A215 VanDerWaalsContact O-CA 3.3Å; M135-A215 WeakPolarHBondContact O-CA 3.22Å; E136-A215 HydrophobicContact CG-CB 4.18Å
216	Y	94.8	Very high	92.9	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.02	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	160.5	178.8	62.8	-94.1	0	0	0	111.4	M135 V137 Q166 Y179 R180 I202 T214 V218	M135-Y216 HydrophobicContact CB-CE1 4.46Å; M135-Y216 HydrophobicContact CB-CE2 4.22Å; M135-Y216 HydrophobicContact CE-CD2 4.02Å; M135-Y216 HydrophobicContact CE-CE2 3.24Å; M135-Y216 PolarHBondContact N-O 3.33Å; M135-Y216 PolarHBondContact O-N 2.87Å; M135-Y216 HydrophobicContact SD-CE2 3.91Å; M135-Y216 PolarHBondContact SD-OH 2.88Å; V137-Y216 HydrophobicContact CB-CE1 4.29Å; V137-Y216 HydrophobicContact CG2-CE1 3.59Å; Q166-Y216 PolarHBondContact OE1-OH 2.83Å; Q166-Y216 VanDerWaalsContact OE1-OH 3.07Å; Y179-Y216 HydrophobicContact CD2-CD2 4.15Å; Y179-Y216 AromaticContact CE2-CD2 3.55Å; Y179-Y216 HydrophobicContact CE2-CD2 3.55Å; Y179-Y216 HydrophobicContact CE2-CE2 4.36Å; Y179-Y216 AromaticContact CE2-CG 3.67Å; Y179-Y216 HydrophobicContact CE2-CG 3.67Å; R180-Y216 CarbonylContact O-C 3.51Å; R180-Y216 WeakPolarHBondContact O-CA 3.32Å; I202-Y216 HydrophobicContact CD1-CE2 4.31Å; T214-Y216 HydrophobicContact CG2-CD1 4.03Å; T214-Y216 HydrophobicContact CG2-CE1 4.18Å; Y216-V218 HydrophobicContact CD2-CG2 3.9Å; Y216-V218 HydrophobicContact CE2-CG2 3.88Å
217	T	96.9	Very high	93.2	Very high	16 Å²	16	34.8 Å²	34.8	10%	0.098	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.8	177.6	-50.2	0	0	0	0	109.2	E132 E133 N134 Y178 R180	E132-T217 HydrophobicContact CG-CG2 3.39Å; E133-T217 CarbonylContact O-C 3.5Å; E133-T217 VanDerWaalsContact O-CA 3.24Å; E133-T217 WeakPolarHBondContact O-CA 3.5Å; N134-T217 WeakPolarHBondContact OD1-CB 3.43Å; N134-T217 WeakPolarHBondContact OD1-CG2 3.45Å; N134-T217 PolarHBondContact OD1-OG1 2.77Å; Y178-T217 HydrophobicContact CE2-CG2 4.31Å; R180-T217 HydrophobicContact CG-CG2 4.36Å; R180-T217 PolarHBondContact N-O 2.9Å; R180-T217 PolarHBondContact O-N 2.95Å
218	V	96.5	Very high	93.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.8	168.7	-179.1	0	0	0	0	107.6	E133 M135 M168 Y178 Y179 L200 I202 Y216	E133-V218 PolarHBondContact N-O 2.82Å; E133-V218 PolarHBondContact O-N 2.9Å; M135-V218 HydrophobicContact CE-CB 4.31Å; M135-V218 HydrophobicContact CE-CG2 3.9Å; M168-V218 HydrophobicContact SD-CB 4.29Å; M168-V218 HydrophobicContact SD-CG1 3.92Å; M168-V218 HydrophobicContact SD-CG2 4.24Å; Y178-V218 WeakPolarHBondContact O-CA 3.09Å; Y179-V218 HydrophobicContact CD2-CG2 4.09Å; L200-V218 HydrophobicContact CD2-CG1 3.85Å; I202-V218 HydrophobicContact CD1-CG2 3.51Å; Y216-V218 HydrophobicContact CD2-CG2 3.9Å; Y216-V218 HydrophobicContact CE2-CG2 3.88Å
219	G	97.3	Very high	94.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.1	173	0	0	0	0	0	112.4	V131 V177 Y178	V131-G219 CarbonylContact O-C 3.52Å; V131-G219 WeakPolarHBondContact O-CA 3.31Å; V177-G219 CarbonylContact C-O 3.58Å; V177-G219 VanDerWaalsContact CA-O 3.3Å; V177-G219 WeakPolarHBondContact CA-O 3.45Å; Y178-G219 VanDerWaalsContact CZ-CA 3.5Å; Y178-G219 PolarHBondContact N-O 2.82Å; Y178-G219 PolarHBondContact O-N 2.75Å
220	Y	97.5	Very high	94.5	Very high	2 Å²	2	46 Å²	46	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	158	-177.3	59.3	-84.7	0	0	0	110.4	R119 V131 L170 P171 A174 V222	R119-Y220 PolarHBondContact NH2-OH 2.83Å; V131-Y220 HydrophobicContact CB-CD1 4.22Å; V131-Y220 HydrophobicContact CB-CD2 4.21Å; V131-Y220 HydrophobicContact CB-CE1 3.83Å; V131-Y220 HydrophobicContact CB-CE2 3.84Å; V131-Y220 HydrophobicContact CB-CG 4.4Å; V131-Y220 HydrophobicContact CG1-CD1 4.45Å; V131-Y220 HydrophobicContact CG1-CE1 3.67Å; V131-Y220 HydrophobicContact CG1-CE2 4.29Å; V131-Y220 HydrophobicContact CG2-CD2 4.38Å; V131-Y220 HydrophobicContact CG2-CE2 3.83Å; V131-Y220 PolarHBondContact N-O 3.46Å; V131-Y220 PolarHBondContact O-N 2.85Å; L170-Y220 HydrophobicContact CD1-CD1 4.33Å; L170-Y220 HydrophobicContact CD2-CD1 3.93Å; L170-Y220 HydrophobicContact CD2-CE1 3.65Å; P171-Y220 HydrophobicContact CG-CE2 4.21Å; A174-Y220 HydrophobicContact CB-CD2 3.82Å; A174-Y220 HydrophobicContact CB-CE2 4.48Å; A174-Y220 HydrophobicContact CB-CG 4.31Å; Y220-V222 HydrophobicContact CD2-CG1 3.94Å; Y220-V222 HydrophobicContact CE2-CG1 3.89Å
221	N	97.8	Very high	94.9	Very high	31 Å²	31	49.3 Å²	49.3	17%	0.166	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	147	174.1	-69.6	-38.5	0	0	0	110.2	A130 A174 S175 D176	A130-N221 WeakPolarHBondContact CB-OD1 3.2Å; A174-N221 CarbonylContact C-O 3.6Å; A174-N221 WeakPolarHBondContact CA-O 3.3Å; S175-N221 PolarHBondContact N-O 2.9Å; S175-N221 PolarHBondContact O-N 3.16Å; S175-N221 PolarHBondContact OG-O 3.42Å; D176-N221 PolarHBondContact OD2-ND2 3.11Å
222	V	97.2	Very high	95.2	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.3	165.9	-65.1	0	0	0	0	110	N128 I129 P171 Y220 Y227 M239	N128-V222 CarbonylContact C-O 3.56Å; N128-V222 WeakPolarHBondContact CA-O 3.25Å; N128-V222 WeakPolarHBondContact CB-O 3.39Å; I129-V222 HydrophobicContact CB-CG2 3.91Å; I129-V222 PolarHBondContact N-O 2.86Å; I129-V222 PolarHBondContact O-N 2.91Å; P171-V222 HydrophobicContact CB-CG1 4.46Å; Y220-V222 HydrophobicContact CD2-CG1 3.94Å; Y220-V222 HydrophobicContact CE2-CG1 3.89Å; V222-Y227 HydrophobicContact CB-CD2 4.13Å; V222-Y227 HydrophobicContact CB-CE2 3.74Å; V222-Y227 HydrophobicContact CG1-CE2 4.11Å; V222-Y227 HydrophobicContact CG2-CD2 3.67Å; V222-Y227 HydrophobicContact CG2-CE2 3.69Å; V222-M239 HydrophobicContact CG2-CE 4.19Å
223	P	97.3	Very high	95.3	Very high	25 Å²	25	50 Å²	50	16%	0.162	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.5	175.2	25.2	-32.9	0	0	0	111.3	Y225 E226	P223-Y225 VanDerWaalsContact C-N 3.3Å; P223-Y225 HydrophobicContact CB-CD1 3.71Å; P223-Y225 HydrophobicContact CB-CE1 3.26Å; P223-Y225 HydrophobicContact CG-CE1 3.89Å; P223-Y225 HydrophobicContact CG-CE2 4.47Å; P223-Y225 PolarHBondContact O-N 2.58Å; P223-E226 HydrophobicContact CG-CG 3.97Å; P223-E226 PolarHBondContact O-N 2.66Å
224	S	95.5	Very high	95.3	Very high	21 Å²	21	50.9 Å²	50.9	15%	0.147	26%	0.257	C	S	.	.	H	α-helix	trans	-66.9	-30.1	-175	64	0	0	0	0	113.2	G127 E226 Y227 L228	G127-S224 WeakPolarHBondContact O-CB 3.46Å; G127-S224 PolarHBondContact O-N 2.92Å; G127-S224 PolarHBondContact O-OG 2.83Å; G127-S224 VanDerWaalsContact O-OG 3.08Å; S224-E226 PolarHBondContact O-N 3.39Å; S224-E226 VanDerWaalsContact O-N 3.15Å; S224-Y227 PolarHBondContact O-N 2.93Å; S224-L228 WeakPolarHBondContact O-CA 3.28Å; S224-L228 WeakPolarHBondContact O-CB 3.16Å; S224-L228 PolarHBondContact O-N 2.85Å
225	Y	94.7	Very high	95.4	Very high	167 Å²	167	50.5 Å²	50.5	66%	0.655	25%	0.254	S	S	*	.	H	α-helix	trans	-63.6	-20.7	-176.4	66.8	-103.5	0	0	0	114.1	P223	P223-Y225 VanDerWaalsContact C-N 3.3Å; P223-Y225 HydrophobicContact CB-CD1 3.71Å; P223-Y225 HydrophobicContact CB-CE1 3.26Å; P223-Y225 HydrophobicContact CG-CE1 3.89Å; P223-Y225 HydrophobicContact CG-CE2 4.47Å; P223-Y225 PolarHBondContact O-N 2.58Å
226	E	94.7	Very high	95.3	Very high	69 Å²	69	49 Å²	49	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-79.9	-30.4	179.4	-65.1	-174.4	-177.8	0	0	112.7	S173 P223 S224	S173-E226 WeakPolarHBondContact CB-OE1 3.5Å; S173-E226 WeakPolarHBondContact CB-OE2 3.47Å; S173-E226 PolarHBondContact OG-OE2 3.39Å; P223-E226 HydrophobicContact CG-CG 3.97Å; P223-E226 PolarHBondContact O-N 2.66Å; S224-E226 PolarHBondContact O-N 3.39Å; S224-E226 VanDerWaalsContact O-N 3.15Å
227	Y	95.2	Very high	95.3	Very high	47 Å²	47	48.8 Å²	48.8	18%	0.184	24%	0.24	C	C	.	.	H	α-helix	trans	-118.7	-14.7	-169.9	-61.4	-74.9	0	0	0	113.4	P171 V222 S224 K238 M239	P171-Y227 VanDerWaalsContact CB-OH 3.27Å; P171-Y227 WeakPolarHBondContact CB-OH 3.48Å; V222-Y227 HydrophobicContact CB-CD2 4.13Å; V222-Y227 HydrophobicContact CB-CE2 3.74Å; V222-Y227 HydrophobicContact CG1-CE2 4.11Å; V222-Y227 HydrophobicContact CG2-CD2 3.67Å; V222-Y227 HydrophobicContact CG2-CE2 3.69Å; S224-Y227 PolarHBondContact O-N 2.93Å; Y227-K238 VanDerWaalsContact CD1-O 3.31Å; Y227-K238 WeakPolarHBondContact CD1-O 3.29Å; Y227-K238 PolarHBondContact O-N 2.65Å; Y227-M239 HydrophobicContact CD1-CG 3.8Å; Y227-M239 HydrophobicContact CG-CE 4.39Å; Y227-M239 HydrophobicContact CG-CG 3.95Å
228	L	95.3	Very high	95.1	Very high	18 Å²	18	51.4 Å²	51.4	9%	0.094	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	109.9	-176.9	-166.8	71.8	0	0	0	111.3	V123 S224 F235 L237 Y317	V123-L228 HydrophobicContact CG1-CD2 4.48Å; S224-L228 WeakPolarHBondContact O-CA 3.28Å; S224-L228 WeakPolarHBondContact O-CB 3.16Å; S224-L228 PolarHBondContact O-N 2.85Å; L228-F235 HydrophobicContact CD1-CB 4.33Å; L228-F235 HydrophobicContact CD2-CD1 4.1Å; L228-F235 HydrophobicContact CG-CD1 4.23Å; L228-L237 HydrophobicContact CD1-CB 4.2Å; L228-L237 HydrophobicContact CD1-CD1 4.4Å; L228-Y317 HydrophobicContact CD1-CE1 4.1Å; L228-Y317 WeakPolarHBondContact CD1-OH 3.32Å
229	Y	95	Very high	95	Very high	126 Å²	126	51.8 Å²	51.8	49%	0.494	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.3	176.3	-55.6	-87.6	0	0	0	110.4	F235 C236 K238	Y229-F235 CarbonylContact O-C 3.54Å; Y229-F235 WeakPolarHBondContact O-CA 3.11Å; Y229-C236 PolarHBondContact N-O 2.85Å; Y229-C236 PolarHBondContact O-N 3.22Å; Y229-K238 HydrophobicContact CD2-CB 4.35Å; Y229-K238 HydrophobicContact CE2-CB 3.95Å; Y229-K238 HydrophobicContact CE2-CD 4.39Å
230	H	93.6	Very high	94.8	Very high	117 Å²	117	56.6 Å²	56.6	54%	0.542	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	149.9	-179.4	71.9	51	0	0	0	114.1	R234 F235 R321	H230-R234 CarbonylContact C-O 3.57Å; H230-R234 VanDerWaalsContact CA-O 3.3Å; H230-R234 WeakPolarHBondContact CA-O 3.32Å; H230-F235 HydrophobicContact CB-CD1 3.48Å; H230-F235 VanDerWaalsContact CB-CD1 3.48Å; H230-F235 HydrophobicContact CB-CE1 3.48Å; H230-F235 VanDerWaalsContact CB-CE1 3.48Å; H230-F235 HydrophobicContact CB-CG 4.33Å; H230-F235 HydrophobicContact CB-CZ 4.34Å; H230-R321 PolarHBondContact CE1-NH2 2.98Å; H230-R321 VanDerWaalsContact CE1-NH2 3.28Å; H230-R321 VanDerWaalsContact CG-NH2 3.28Å; H230-R321 PolarHBondContact ND1-NH2 3.3Å; H230-R321 VanDerWaalsContact ND1-NH2 3.11Å; H230-R321 PolarHBondContact NE2-NH2 3.32Å
231	S	93.8	Very high	94.6	Very high	72 Å²	72	56.5 Å²	56.5	50%	0.503	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	99	169.5	-179.2	0	0	0	0	108.1	N233 R234	S231-N233 PolarHBondContact O-N 2.88Å; S231-R234 PolarHBondContact N-O 2.88Å; S231-R234 PolarHBondContact O-N 2.57Å; S231-R234 VanDerWaalsContact O-N 3.12Å
232	G	93.2	Very high	94.4	Very high	47 Å²	47	55 Å²	55	49%	0.485	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	-118.8	-170	0	0	0	0	0	112.1	R321	G232-R321 PolarHBondContact O-NE 3.1Å; G232-R321 VanDerWaalsContact O-NE 3.1Å; G232-R321 PolarHBondContact O-NH2 3.28Å
233	N	93.4	Very high	94.1	Very high	81 Å²	81	55.2 Å²	55.2	43%	0.433	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	5.5	176.8	-69.5	-22.2	0	0	0	113.4	S231 T318 W319	S231-N233 PolarHBondContact O-N 2.88Å; N233-T318 WeakPolarHBondContact O-CA 3.49Å; N233-W319 WeakPolarHBondContact CA-O 3.34Å; N233-W319 WeakPolarHBondContact CB-O 3.46Å; N233-W319 PolarHBondContact O-N 3.13Å
234	R	93.6	Very high	94	Very high	162 Å²	162	54.7 Å²	54.7	61%	0.611	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.6	174.8	-59.2	-175.3	-68.3	-179.6	-0.9	109	H230 S231 T318	H230-R234 CarbonylContact C-O 3.57Å; H230-R234 VanDerWaalsContact CA-O 3.3Å; H230-R234 WeakPolarHBondContact CA-O 3.32Å; S231-R234 PolarHBondContact N-O 2.88Å; S231-R234 PolarHBondContact O-N 2.57Å; S231-R234 VanDerWaalsContact O-N 3.12Å; R234-T318 HydrophobicContact CG-CG2 4.04Å
235	F	94.4	Very high	93.8	Very high	9 Å²	9	53.7 Å²	53.7	4%	0.039	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.3	179.8	-66.8	-87.9	0	0	0	110	H125 L228 Y229 H230 Y316 Y317 W319 R321	H125-F235 AromaticContact CE1-CD1 3.52Å; H125-F235 AromaticContact CE1-CD2 3.89Å; H125-F235 AromaticContact CE1-CE1 3.37Å; H125-F235 WeakPolarHBondContact CE1-CE1 3.39Å; H125-F235 AromaticContact CE1-CE2 3.76Å; H125-F235 AromaticContact CE1-CG 3.78Å; H125-F235 AromaticContact CE1-CZ 3.49Å; H125-F235 VanDerWaalsContact CE1-CZ 3.49Å; H125-F235 WeakPolarHBondContact CE1-CZ 3.45Å; H125-F235 AromaticContact ND1-CE1 3.74Å; H125-F235 AromaticContact ND1-CZ 3.84Å; L228-F235 HydrophobicContact CD1-CB 4.33Å; L228-F235 HydrophobicContact CD2-CD1 4.1Å; L228-F235 HydrophobicContact CG-CD1 4.23Å; Y229-F235 CarbonylContact O-C 3.54Å; Y229-F235 WeakPolarHBondContact O-CA 3.11Å; H230-F235 HydrophobicContact CB-CD1 3.48Å; H230-F235 VanDerWaalsContact CB-CD1 3.48Å; H230-F235 HydrophobicContact CB-CE1 3.48Å; H230-F235 VanDerWaalsContact CB-CE1 3.48Å; H230-F235 HydrophobicContact CB-CG 4.33Å; H230-F235 HydrophobicContact CB-CZ 4.34Å; F235-Y316 WeakPolarHBondContact O-CA 3.39Å; F235-Y317 HydrophobicContact CB-CD1 4.12Å; F235-Y317 HydrophobicContact CB-CD2 4.22Å; F235-Y317 HydrophobicContact CB-CE1 3.65Å; F235-Y317 HydrophobicContact CB-CE2 3.77Å; F235-Y317 HydrophobicContact CB-CG 4.39Å; F235-Y317 VanDerWaalsContact CB-CZ 3.47Å; F235-Y317 HydrophobicContact CD2-CE2 4.11Å; F235-Y317 HydrophobicContact CG-CE2 4.12Å; F235-Y317 PolarHBondContact N-O 3.02Å; F235-Y317 PolarHBondContact O-N 2.9Å; F235-W319 HydrophobicContact CD2-CB 4.01Å; F235-W319 HydrophobicContact CE2-CB 4Å; F235-W319 HydrophobicContact CE2-CE3 4.18Å; F235-W319 WeakPolarHBondContact CE2-O 3.34Å; F235-W319 HydrophobicContact CZ-CE3 4.41Å; F235-R321 HydrophobicContact CZ-CG 4.39Å
236	C	93.9	Very high	93.5	Very high	14 Å²	14	46.4 Å²	46.4	10%	0.095	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	115	174.5	-178.5	0	0	0	0	108.1	Y229 L315 Y316	Y229-C236 PolarHBondContact N-O 2.85Å; Y229-C236 PolarHBondContact O-N 3.22Å; C236-L315 CarbonylContact C-O 3.57Å; C236-L315 WeakPolarHBondContact CA-O 3.44Å; C236-Y316 HydrophobicContact CB-CD1 3.74Å; C236-Y316 HydrophobicContact CB-CE1 3.58Å; C236-Y316 VanDerWaalsContact SG-CE1 3.52Å
237	L	94.5	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.6	169.5	176	71.1	0	0	0	108.2	V123 I129 L228 M239 I258 F313 E314 L315	V123-L237 HydrophobicContact CG2-CD1 4.25Å; V123-L237 HydrophobicContact CG2-CD2 3.94Å; I129-L237 HydrophobicContact CD1-CD1 3.66Å; L228-L237 HydrophobicContact CD1-CB 4.2Å; L228-L237 HydrophobicContact CD1-CD1 4.4Å; L237-M239 HydrophobicContact CD1-CG 3.85Å; L237-M239 HydrophobicContact CD1-SD 3.81Å; L237-M239 HydrophobicContact CG-CG 4.23Å; L237-M239 HydrophobicContact CG-SD 4.45Å; L237-I258 HydrophobicContact CD2-CG2 3.79Å; L237-F313 HydrophobicContact CD2-CE2 4.2Å; L237-F313 HydrophobicContact CD2-CZ 4.15Å; L237-E314 CarbonylContact O-C 3.57Å; L237-E314 WeakPolarHBondContact O-CA 3.28Å; L237-L315 HydrophobicContact CB-CB 4.25Å; L237-L315 HydrophobicContact CD2-CD2 4.13Å; L237-L315 PolarHBondContact N-O 2.82Å; L237-L315 PolarHBondContact O-N 2.88Å
238	K	93.3	Very high	92.7	Very high	71 Å²	71	52 Å²	52	31%	0.309	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	114.8	172.9	-177.6	177.4	179.4	169.9	0	109.3	Y227 Y229 D312 F313 E314	Y227-K238 VanDerWaalsContact CD1-O 3.31Å; Y227-K238 WeakPolarHBondContact CD1-O 3.29Å; Y227-K238 PolarHBondContact O-N 2.65Å; Y229-K238 HydrophobicContact CD2-CB 4.35Å; Y229-K238 HydrophobicContact CE2-CB 3.95Å; Y229-K238 HydrophobicContact CE2-CD 4.39Å; K238-D312 WeakPolarHBondContact CE-OD2 3.4Å; K238-D312 HydrophobicContact CG-CB 4.34Å; K238-F313 WeakPolarHBondContact CA-O 3.09Å; K238-E314 HydrophobicContact CB-CG 4.3Å; K238-E314 HydrophobicContact CD-CG 4.33Å; K238-E314 HydrophobicContact CG-CG 4.06Å; K238-E314 IonicContact NZ-OE1 2.83Å
239	M	93.8	Very high	92.5	Very high	7 Å²	7	51.1 Å²	51.1	3%	0.034	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	164	179.4	-68.5	-170.5	80.1	0	0	110.6	L121 I129 V131 V222 Y227 L237 D312 F313	L121-M239 HydrophobicContact CD1-SD 4.02Å; L121-M239 HydrophobicContact CD2-CE 4.2Å; L121-M239 HydrophobicContact CD2-SD 4.32Å; I129-M239 HydrophobicContact CD1-SD 4.21Å; I129-M239 HydrophobicContact CG2-CE 4.5Å; I129-M239 HydrophobicContact CG2-SD 4.05Å; V131-M239 HydrophobicContact CG2-CE 4.07Å; V222-M239 HydrophobicContact CG2-CE 4.19Å; Y227-M239 HydrophobicContact CD1-CG 3.8Å; Y227-M239 HydrophobicContact CG-CE 4.39Å; Y227-M239 HydrophobicContact CG-CG 3.95Å; L237-M239 HydrophobicContact CD1-CG 3.85Å; L237-M239 HydrophobicContact CD1-SD 3.81Å; L237-M239 HydrophobicContact CG-CG 4.23Å; L237-M239 HydrophobicContact CG-SD 4.45Å; M239-D312 CarbonylContact O-C 3.57Å; M239-D312 VanDerWaalsContact O-CA 3.3Å; M239-D312 WeakPolarHBondContact O-CA 3.24Å; M239-F313 HydrophobicContact CB-CE1 3.89Å; M239-F313 HydrophobicContact CB-CZ 4.12Å; M239-F313 PolarHBondContact N-O 3.23Å; M239-F313 WeakPolarHBondContact O-CD1 3.29Å; M239-F313 WeakPolarHBondContact O-CE1 3.39Å; M239-F313 PolarHBondContact O-N 3.4Å
240	R	93.2	Very high	92.4	Very high	102 Å²	102	46.4 Å²	46.4	39%	0.385	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.3	171.7	-68.7	176.8	-179.8	166.1	2.1	110.5	D243 I310 D312	R240-D243 WeakPolarHBondContact CD-OD1 3.06Å; R240-D243 IonicContact CZ-OD1 2.89Å; R240-D243 IonicContact NE-OD1 3.82Å; R240-D243 IonicContact NH1-OD1 3.69Å; R240-D243 PolarHBondContact NH1-OD1 3.2Å; R240-I310 HydrophobicContact CG-CG2 4.47Å; R240-D312 VanDerWaalsContact CG-OD1 3.29Å; R240-D312 WeakPolarHBondContact CG-OD1 3.43Å
241	L	92.4	Very high	92.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-66.1	-51.9	176.1	-164.5	96.1	0	0	0	110.2	F254 L256 Y276 V278 M305 Q311 F313	L241-F254 HydrophobicContact CD2-CE1 4.05Å; L241-F254 HydrophobicContact CG-CE1 4.1Å; L241-F254 WeakPolarHBondContact O-CZ 3.45Å; L241-L256 HydrophobicContact CD1-CD2 3.72Å; L241-L256 HydrophobicContact CG-CD2 4.11Å; L241-Y276 HydrophobicContact CD2-CE2 3.63Å; L241-Y276 WeakPolarHBondContact CD2-OH 3.38Å; L241-V278 HydrophobicContact CD2-CG1 4.23Å; L241-M305 HydrophobicContact CD2-CE 4.07Å; L241-Q311 PolarHBondContact N-O 3.32Å; L241-F313 HydrophobicContact CB-CD1 4.14Å; L241-F313 HydrophobicContact CD1-CB 4.04Å; L241-F313 HydrophobicContact CD1-CD1 3.91Å; L241-F313 HydrophobicContact CD1-CG 4.13Å
242	V	93.5	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-124.4	141.7	170.2	64.6	0	0	0	0	107.5	F249 F254 M305 H309 I310	V242-F249 HydrophobicContact CG2-CE2 4.26Å; V242-F249 HydrophobicContact CG2-CZ 4.09Å; V242-F254 HydrophobicContact CB-CE2 4.38Å; V242-F254 HydrophobicContact CB-CZ 4.33Å; V242-F254 HydrophobicContact CG2-CE2 4.31Å; V242-M305 HydrophobicContact CB-CE 4.28Å; V242-M305 HydrophobicContact CG1-CE 3.78Å; V242-H309 HydrophobicContact CG1-CB 4.37Å; V242-I310 HydrophobicContact CG1-CG1 4.14Å
243	D	92.9	Very high	92.7	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.027	19%	0.193	C	C	.	.			trans	-108	174.9	176.8	-153.5	-1.7	0	0	0	110.3	R119 R240 L245	R119-D243 VanDerWaalsContact NH1-N 3.17Å; R119-D243 IonicContact NH2-OD2 3.9Å; R240-D243 WeakPolarHBondContact CD-OD1 3.06Å; R240-D243 IonicContact CZ-OD1 2.89Å; R240-D243 IonicContact NE-OD1 3.82Å; R240-D243 IonicContact NH1-OD1 3.69Å; R240-D243 PolarHBondContact NH1-OD1 3.2Å; D243-L245 PolarHBondContact O-N 2.82Å; D243-L245 VanDerWaalsContact O-N 3.16Å
244	H	93.8	Very high	92.9	Very high	13 Å²	13	36.9 Å²	36.9	6%	0.06	17%	0.172	C	C	.	.			trans	-71.3	110.6	-175.5	179.3	-83.4	0	0	0	111.9	F167 M168 L169 D247 E307 I310	F167-H244 PolarHBondContact O-CE1 3.45Å; F167-H244 PolarHBondContact O-ND1 3.07Å; M168-H244 WeakPolarHBondContact CG-O 3.24Å; L169-H244 HydrophobicContact CB-CB 4.08Å; L169-H244 PolarHBondContact N-O 2.81Å; H244-D247 IonicContact CE1-OD1 3.46Å; H244-D247 PolarHBondContact CE1-OD1 2.91Å; H244-D247 IonicContact NE2-OD1 2.87Å; H244-D247 PolarHBondContact NE2-OD1 2.93Å; H244-E307 IonicContact CD2-OE1 3.64Å; H244-I310 HydrophobicContact CB-CD1 4.12Å
245	L	90.9	Very high	93	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.148	C	C	.	.			trans	-82	-55.3	178.3	-53.5	-176.9	0	0	0	112.2	V114 E133 M135 M168 D243 F249	V114-L245 HydrophobicContact CG2-CD1 3.88Å; E133-L245 WeakPolarHBondContact OE2-CD2 3.4Å; M135-L245 HydrophobicContact SD-CD1 4.34Å; M135-L245 HydrophobicContact SD-CD2 3.93Å; M168-L245 WeakPolarHBondContact CA-O 3.34Å; M168-L245 HydrophobicContact CE-CB 4.46Å; M168-L245 HydrophobicContact CE-CD2 3.54Å; D243-L245 PolarHBondContact O-N 2.82Å; D243-L245 VanDerWaalsContact O-N 3.16Å; L245-F249 HydrophobicContact CB-CB 4.29Å; L245-F249 HydrophobicContact CB-CD1 4.18Å; L245-F249 HydrophobicContact CB-CG 4.13Å; L245-F249 HydrophobicContact CD1-CD2 3.95Å; L245-F249 HydrophobicContact CD1-CE2 4.26Å; L245-F249 HydrophobicContact CD1-CG 4.26Å; L245-F249 HydrophobicContact CG-CD1 4.45Å; L245-F249 HydrophobicContact CG-CD2 4.38Å; L245-F249 HydrophobicContact CG-CG 4.34Å
246	F	88.8	Confident	93.1	Very high	13 Å²	13	29.7 Å²	29.7	6%	0.057	15%	0.147	C	C	.	.	S	Bend	trans	-167	158.8	174.8	52	-93.1	0	0	0	108.9	L112 V114 Q166 F167 N248 F249	L112-F246 HydrophobicContact CB-CE2 3.73Å; L112-F246 HydrophobicContact CB-CZ 3.78Å; L112-F246 HydrophobicContact CD1-CE2 4.3Å; V114-F246 HydrophobicContact CG2-CE1 3.65Å; V114-F246 HydrophobicContact CG2-CZ 3.86Å; Q166-F246 HydrophobicContact CB-CB 4.18Å; Q166-F246 HydrophobicContact CG-CB 4.01Å; Q166-F246 HydrophobicContact CG-CD1 3.98Å; Q166-F246 HydrophobicContact CG-CG 4.05Å; F167-F246 WeakPolarHBondContact O-CA 3.47Å; F246-N248 PolarHBondContact O-N 2.85Å; F246-F249 HydrophobicContact CD1-CB 4.23Å; F246-F249 HydrophobicContact CD2-CB 3.78Å; F246-F249 HydrophobicContact CE1-CB 3.97Å; F246-F249 VanDerWaalsContact CE2-CA 3.46Å; F246-F249 HydrophobicContact CE2-CB 3.5Å; F246-F249 HydrophobicContact CG-CB 4.14Å; F246-F249 HydrophobicContact CZ-CB 3.6Å; F246-F249 WeakPolarHBondContact O-CB 3.38Å; F246-F249 WeakPolarHBondContact O-CD1 3.48Å; F246-F249 PolarHBondContact O-N 2.81Å; F246-F249 VanDerWaalsContact O-N 3.11Å
247	D	86.7	Confident	93.2	Very high	102 Å²	102	31.6 Å²	31.6	55%	0.545	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	129.6	-176	-55.3	6.1	0	0	0	112	H244 F249	H244-D247 IonicContact CE1-OD1 3.46Å; H244-D247 PolarHBondContact CE1-OD1 2.91Å; H244-D247 IonicContact NE2-OD1 2.87Å; H244-D247 PolarHBondContact NE2-OD1 2.93Å; D247-F249 VanDerWaalsContact C-N 3.3Å; D247-F249 PolarHBondContact O-N 3.36Å
248	N	86.5	Confident	93.3	Very high	131 Å²	131	31.6 Å²	31.6	70%	0.701	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	33.2	-179	-48.6	-81.6	0	0	0	114.8	F246 E307	F246-N248 PolarHBondContact O-N 2.85Å; N248-E307 PolarHBondContact N-OE2 2.84Å
249	F	91.1	Very high	93.4	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	14%	0.14	C	C	.	.			trans	-59.9	147.4	176.7	74.5	-92	0	0	0	112.6	V242 L245 F246 D247 D251 E307 I310	V242-F249 HydrophobicContact CG2-CE2 4.26Å; V242-F249 HydrophobicContact CG2-CZ 4.09Å; L245-F249 HydrophobicContact CB-CB 4.29Å; L245-F249 HydrophobicContact CB-CD1 4.18Å; L245-F249 HydrophobicContact CB-CG 4.13Å; L245-F249 HydrophobicContact CD1-CD2 3.95Å; L245-F249 HydrophobicContact CD1-CE2 4.26Å; L245-F249 HydrophobicContact CD1-CG 4.26Å; L245-F249 HydrophobicContact CG-CD1 4.45Å; L245-F249 HydrophobicContact CG-CD2 4.38Å; L245-F249 HydrophobicContact CG-CG 4.34Å; F246-F249 HydrophobicContact CD1-CB 4.23Å; F246-F249 HydrophobicContact CD2-CB 3.78Å; F246-F249 HydrophobicContact CE1-CB 3.97Å; F246-F249 VanDerWaalsContact CE2-CA 3.46Å; F246-F249 HydrophobicContact CE2-CB 3.5Å; F246-F249 HydrophobicContact CG-CB 4.14Å; F246-F249 HydrophobicContact CZ-CB 3.6Å; F246-F249 WeakPolarHBondContact O-CB 3.38Å; F246-F249 WeakPolarHBondContact O-CD1 3.48Å; F246-F249 PolarHBondContact O-N 2.81Å; F246-F249 VanDerWaalsContact O-N 3.11Å; D247-F249 VanDerWaalsContact C-N 3.3Å; D247-F249 PolarHBondContact O-N 3.36Å; F249-D251 HydrophobicContact CD2-CB 4.07Å; F249-D251 HydrophobicContact CE2-CB 4.19Å; F249-E307 HydrophobicContact CD1-CB 4.37Å; F249-E307 HydrophobicContact CE1-CB 4.01Å; F249-E307 HydrophobicContact CE1-CG 4.24Å; F249-I310 HydrophobicContact CE1-CD1 4.15Å; F249-I310 HydrophobicContact CE1-CG1 4.47Å; F249-I310 HydrophobicContact CZ-CG1 4.43Å
250	V	93.2	Very high	93.5	Very high	27 Å²	27	28.1 Å²	28.1	16%	0.164	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.4	167	177.2	0	0	0	0	107	A22 V113 V114	A22-V250 HydrophobicContact CB-CG1 3.62Å; A22-V250 HydrophobicContact CB-CG2 4.1Å; V113-V250 HydrophobicContact CG1-CG1 4.44Å; V114-V250 PolarHBondContact N-O 3.12Å
251	D	94.8	Very high	93.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.1	177.9	174.1	3	0	0	0	109.3	V114 H117 F249 N253 F254 N304 M305	V114-D251 HydrophobicContact CB-CB 4.16Å; H117-D251 WeakPolarHBondContact CB-OD1 3.04Å; H117-D251 VanDerWaalsContact CB-OD2 3.22Å; H117-D251 WeakPolarHBondContact CB-OD2 3.27Å; H117-D251 IonicContact CG-OD2 2.65Å; H117-D251 IonicContact ND1-OD2 3.53Å; H117-D251 PolarHBondContact ND1-OD2 2.82Å; F249-D251 HydrophobicContact CD2-CB 4.07Å; F249-D251 HydrophobicContact CE2-CB 4.19Å; D251-N253 PolarHBondContact OD1-N 2.8Å; D251-F254 PolarHBondContact OD1-N 3.13Å; D251-F254 WeakPolarHBondContact OD2-CB 3.38Å; D251-F254 WeakPolarHBondContact OD2-CD2 3.43Å; D251-N304 CarbonylContact O-C 3.58Å; D251-N304 VanDerWaalsContact O-CA 3.28Å; D251-N304 WeakPolarHBondContact O-CA 3.45Å; D251-N304 PolarHBondContact O-N 3.23Å; D251-M305 HydrophobicContact CB-CB 4.04Å; D251-M305 PolarHBondContact N-O 2.85Å; D251-M305 PolarHBondContact O-N 3.36Å
252	E	95.4	Very high	93.5	Very high	54 Å²	54	24.1 Å²	24.1	25%	0.252	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-33.8	-172.1	-69.7	-173.6	163.4	0	0	112.3	V113 V114 R140 S303 N304	V113-E252 VanDerWaalsContact CG1-CD 3.47Å; V113-E252 HydrophobicContact CG1-CG 3.54Å; V113-E252 WeakPolarHBondContact CG1-OE1 3.4Å; V114-E252 PolarHBondContact O-N 3.37Å; R140-E252 IonicContact CZ-OE1 3.88Å; R140-E252 IonicContact CZ-OE2 3.87Å; R140-E252 IonicContact NE-OE1 2.58Å; R140-E252 VanDerWaalsContact NH1-CD 3.32Å; R140-E252 IonicContact NH1-OE1 3.34Å; R140-E252 PolarHBondContact NH1-OE1 3Å; R140-E252 IonicContact NH1-OE2 3.11Å; R140-E252 PolarHBondContact NH1-OE2 2.9Å; R140-E252 IonicContact NH2-OE1 3.77Å; R140-E252 IonicContact NH2-OE2 2.64Å; R140-E252 PolarHBondContact NH2-OE2 3.18Å; E252-S303 VanDerWaalsContact O-CA 3.22Å; E252-S303 WeakPolarHBondContact O-CA 3.45Å; E252-S303 VanDerWaalsContact O-CB 3.3Å; E252-S303 WeakPolarHBondContact O-CB 3.47Å; E252-N304 PolarHBondContact O-N 3.25Å
253	N	96.4	Very high	93.3	Very high	62 Å²	62	27.4 Å²	27.4	33%	0.332	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	89.4	-173.3	-176.7	30.7	0	0	0	110.5	H117 D251	H117-N253 PolarHBondContact N-O 3.39Å; D251-N253 PolarHBondContact OD1-N 2.8Å
254	F	97.1	Very high	93.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.7	178.7	-179.7	-110.8	0	0	0	111.2	H117 R119 L241 V242 D251 L256 S301 K302 M305	H117-F254 HydrophobicContact CB-CD2 4.18Å; H117-F254 AromaticContact CE1-CD2 3.79Å; H117-F254 AromaticContact CE1-CE2 3.56Å; H117-F254 AromaticContact CG-CD2 3.8Å; H117-F254 AromaticContact ND1-CD2 3.3Å; H117-F254 VanDerWaalsContact ND1-CD2 3.3Å; H117-F254 WeakPolarHBondContact ND1-CD2 3.41Å; H117-F254 AromaticContact ND1-CE2 3.59Å; H117-F254 WeakPolarHBondContact O-CA 3.32Å; R119-F254 HydrophobicContact CB-CE2 3.86Å; R119-F254 HydrophobicContact CB-CZ 4.14Å; L241-F254 HydrophobicContact CD2-CE1 4.05Å; L241-F254 HydrophobicContact CG-CE1 4.1Å; L241-F254 WeakPolarHBondContact O-CZ 3.45Å; V242-F254 HydrophobicContact CB-CE2 4.38Å; V242-F254 HydrophobicContact CB-CZ 4.33Å; V242-F254 HydrophobicContact CG2-CE2 4.31Å; D251-F254 PolarHBondContact OD1-N 3.13Å; D251-F254 WeakPolarHBondContact OD2-CB 3.38Å; D251-F254 WeakPolarHBondContact OD2-CD2 3.43Å; F254-L256 HydrophobicContact CE1-CB 3.72Å; F254-L256 HydrophobicContact CZ-CB 3.8Å; F254-S301 CarbonylContact O-C 3.56Å; F254-S301 VanDerWaalsContact O-CA 3.31Å; F254-S301 WeakPolarHBondContact O-CA 3.42Å; F254-K302 WeakPolarHBondContact CA-O 3.31Å; F254-K302 VanDerWaalsContact CB-O 3.31Å; F254-K302 WeakPolarHBondContact CB-O 3.47Å; F254-K302 PolarHBondContact N-O 3.32Å; F254-K302 PolarHBondContact O-N 3.48Å; F254-M305 HydrophobicContact CB-CG 3.81Å; F254-M305 HydrophobicContact CD1-CE 4.49Å; F254-M305 HydrophobicContact CG-CG 4.35Å
255	I	97	Very high	93	Very high	21 Å²	21	30.6 Å²	30.6	11%	0.108	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	120.7	172.9	-58.6	175.1	0	0	0	108.6	H117 E118 R119 K257 V299 I300	H117-I255 PolarHBondContact O-N 3.21Å; E118-I255 CarbonylContact C-O 3.56Å; E118-I255 WeakPolarHBondContact CA-O 3.44Å; R119-I255 PolarHBondContact N-O 3.49Å; I255-K257 HydrophobicContact CG2-CG 4.24Å; I255-V299 HydrophobicContact CG2-CG1 3.91Å; I255-I300 CarbonylContact C-O 3.57Å; I255-I300 WeakPolarHBondContact CA-O 3.23Å
256	L	96.1	Very high	92.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.6	171.2	177.6	62.7	0	0	0	109.4	R119 L121 L241 F254 I258 V299 I300 F313	R119-L256 HydrophobicContact CB-CD1 4.13Å; R119-L256 HydrophobicContact CG-CD1 3.92Å; R119-L256 CarbonylContact O-C 3.57Å; R119-L256 WeakPolarHBondContact O-CA 3.48Å; L121-L256 HydrophobicContact CD1-CD1 3.8Å; L121-L256 HydrophobicContact CG-CD1 3.92Å; L241-L256 HydrophobicContact CD1-CD2 3.72Å; L241-L256 HydrophobicContact CG-CD2 4.11Å; F254-L256 HydrophobicContact CE1-CB 3.72Å; F254-L256 HydrophobicContact CZ-CB 3.8Å; L256-I258 HydrophobicContact CD1-CG1 4.31Å; L256-I258 HydrophobicContact CD2-CD1 4.05Å; L256-I258 HydrophobicContact CD2-CG1 4.19Å; L256-I258 HydrophobicContact CG-CD1 4.36Å; L256-I258 HydrophobicContact CG-CG1 3.95Å; L256-V299 WeakPolarHBondContact O-CA 3.47Å; L256-I300 HydrophobicContact CB-CB 4.4Å; L256-I300 HydrophobicContact CD2-CD1 4.03Å; L256-I300 HydrophobicContact CG-CD1 4.39Å; L256-I300 PolarHBondContact N-O 3.47Å; L256-I300 PolarHBondContact O-N 2.86Å; L256-F313 HydrophobicContact CD2-CD1 4.25Å; L256-F313 HydrophobicContact CD2-CE1 3.87Å; L256-F313 HydrophobicContact CD2-CZ 4.23Å
257	K	96.4	Very high	91.9	Very high	53 Å²	53	35.4 Å²	35.4	23%	0.23	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.1	171.5	-67.4	-172.3	170.9	166.3	0	109.4	E118 R119 I120 L121 I255 V297 V298 V299	E118-K257 VanDerWaalsContact OE1-CD 3.27Å; E118-K257 WeakPolarHBondContact OE1-CD 3.35Å; E118-K257 WeakPolarHBondContact OE1-CE 3.15Å; E118-K257 IonicContact OE1-NZ 3.62Å; E118-K257 PolarHBondContact OE1-NZ 2.84Å; R119-K257 PolarHBondContact O-N 3.21Å; I120-K257 CarbonylContact C-O 3.54Å; I120-K257 WeakPolarHBondContact CA-O 3.35Å; I120-K257 HydrophobicContact CG1-CB 4.41Å; L121-K257 PolarHBondContact N-O 3.46Å; I255-K257 HydrophobicContact CG2-CG 4.24Å; K257-V297 HydrophobicContact CB-CG1 3.98Å; K257-V297 HydrophobicContact CG-CG1 4.42Å; K257-V298 WeakPolarHBondContact CA-O 3.47Å; K257-V299 HydrophobicContact CG-CG1 4.27Å; K257-V299 HydrophobicContact CG-CG2 4.11Å
258	I	95.7	Very high	91.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	105.1	177.1	-47.9	171.3	0	0	0	107.7	L121 L237 L256 L260 V297 V298 I300 F313 L315	L121-I258 HydrophobicContact CB-CG2 4.39Å; L121-I258 HydrophobicContact CD1-CG1 4.37Å; L121-I258 CarbonylContact O-C 3.52Å; L121-I258 WeakPolarHBondContact O-CA 3.46Å; L237-I258 HydrophobicContact CD2-CG2 3.79Å; L256-I258 HydrophobicContact CD1-CG1 4.31Å; L256-I258 HydrophobicContact CD2-CD1 4.05Å; L256-I258 HydrophobicContact CD2-CG1 4.19Å; L256-I258 HydrophobicContact CG-CD1 4.36Å; L256-I258 HydrophobicContact CG-CG1 3.95Å; I258-L260 HydrophobicContact CG2-CD2 4.25Å; I258-L260 PolarHBondContact O-N 3.21Å; I258-V297 WeakPolarHBondContact O-CA 3.5Å; I258-V298 HydrophobicContact CB-CB 4.3Å; I258-V298 PolarHBondContact N-O 2.96Å; I258-V298 PolarHBondContact O-N 3.05Å; I258-I300 HydrophobicContact CD1-CD1 4.15Å; I258-F313 HydrophobicContact CD1-CD2 4.35Å; I258-F313 HydrophobicContact CD1-CE2 3.44Å; I258-F313 VanDerWaalsContact CD1-CE2 3.44Å; I258-F313 HydrophobicContact CD1-CZ 3.55Å; I258-F313 HydrophobicContact CG1-CZ 4.37Å; I258-L315 HydrophobicContact CB-CD2 4.31Å; I258-L315 HydrophobicContact CD1-CD2 3.9Å; I258-L315 HydrophobicContact CG2-CD2 3.69Å
259	I	96.3	Very high	90	Very high	6 Å²	6	32 Å²	32	3%	0.031	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	108.7	177.2	-53.7	174.7	0	0	0	107.3	I120 L121 E122 V123 H286 R295 V297	I120-I259 HydrophobicContact CG2-CD1 3.59Å; I120-I259 HydrophobicContact CG2-CG1 4.15Å; L121-I259 PolarHBondContact O-N 2.85Å; E122-I259 HydrophobicContact CB-CB 4.27Å; E122-I259 HydrophobicContact CB-CD1 4.43Å; E122-I259 HydrophobicContact CG-CB 4.24Å; E122-I259 HydrophobicContact CG-CG2 4.24Å; V123-I259 PolarHBondContact N-O 2.88Å; I259-H286 HydrophobicContact CD1-CB 4.44Å; I259-H286 HydrophobicContact CG2-CB 4.29Å; I259-R295 HydrophobicContact CG2-CB 3.81Å; I259-R295 HydrophobicContact CG2-CG 4.43Å; I259-V297 HydrophobicContact CB-CG2 4.47Å; I259-V297 HydrophobicContact CG1-CG1 4.25Å; I259-V297 HydrophobicContact CG1-CG2 3.98Å; I259-V297 HydrophobicContact CG2-CG2 4.45Å
260	L	95.1	Very high	88.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-88.7	158.5	176.9	-69.3	176.6	0	0	0	110.7	V123 I258 A264 V267 R295 P296 V298 L315 Y317	V123-L260 HydrophobicContact CG2-CD2 4.48Å; I258-L260 HydrophobicContact CG2-CD2 4.25Å; I258-L260 PolarHBondContact O-N 3.21Å; L260-A264 HydrophobicContact CB-CB 3.97Å; L260-A264 HydrophobicContact CD1-CB 4.36Å; L260-V267 HydrophobicContact CD1-CG1 3.94Å; L260-V267 HydrophobicContact CD1-CG2 3.76Å; L260-R295 VanDerWaalsContact O-CB 3.23Å; L260-R295 WeakPolarHBondContact O-CB 3.38Å; L260-R295 WeakPolarHBondContact O-CG 3.38Å; L260-P296 HydrophobicContact CB-CG 4.09Å; L260-P296 PolarHBondContact N-O 3.35Å; L260-V298 HydrophobicContact CD1-CG2 4.28Å; L260-L315 HydrophobicContact CD1-CD2 4.27Å; L260-L315 HydrophobicContact CD2-CD2 3.88Å; L260-L315 HydrophobicContact CG-CD2 4.37Å; L260-Y317 HydrophobicContact CD1-CD1 4.49Å; L260-Y317 HydrophobicContact CD1-CG 4.33Å; L260-Y317 HydrophobicContact CD2-CD1 3.83Å; L260-Y317 HydrophobicContact CD2-CE1 3.8Å; L260-Y317 HydrophobicContact CD2-CG 4.27Å
261	P	93.8	Very high	86.4	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.032	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-57.4	154.2	175.7	-16.9	25.8	0	0	0	112.4	H125 E263 A264 P296 Y317	H125-P261 WeakPolarHBondContact CD2-CG 3.22Å; H125-P261 WeakPolarHBondContact NE2-CG 3.39Å; P261-E263 PolarHBondContact O-N 2.99Å; P261-A264 VanDerWaalsContact O-CB 3.29Å; P261-A264 WeakPolarHBondContact O-CB 3.33Å; P261-A264 PolarHBondContact O-N 3.46Å; P261-A264 VanDerWaalsContact O-N 3.14Å; P261-P296 WeakPolarHBondContact O-CD 3.31Å; P261-Y317 HydrophobicContact CG-CE2 4.45Å
262	E	91.7	Very high	84.3	Confident	13 Å²	13	43.4 Å²	43.4	6%	0.061	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	139.2	177.1	-157.2	-169.1	-151.6	0	0	110.6	A264 T292 V293 R295 W319 R326	E262-A264 PolarHBondContact O-N 2.93Å; E262-T292 WeakPolarHBondContact OE1-CA 3.14Å; E262-T292 PolarHBondContact OE1-N 3.09Å; E262-T292 PolarHBondContact OE1-OG1 2.89Å; E262-V293 PolarHBondContact OE1-N 2.69Å; E262-R295 HydrophobicContact CB-CG 4.4Å; E262-W319 PolarHBondContact O-NE1 2.89Å; E262-R326 IonicContact OE1-NH1 2.79Å; E262-R326 IonicContact OE2-CZ 2.64Å; E262-R326 IonicContact OE2-NE 3.81Å; E262-R326 IonicContact OE2-NH1 2.93Å; E262-R326 PolarHBondContact OE2-NH1 2.92Å
263	E	89.3	Confident	82.6	Confident	68 Å²	68	44.4 Å²	44.4	32%	0.318	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	21.4	-178.4	-46	-170	162.1	0	0	115.7	P261 T265 K323 R326	P261-E263 PolarHBondContact O-N 2.99Å; E263-T265 PolarHBondContact O-N 3.26Å; E263-K323 HydrophobicContact CB-CD 4.23Å; E263-K323 WeakPolarHBondContact OE2-CD 3Å; E263-K323 WeakPolarHBondContact OE2-CE 3.3Å; E263-K323 IonicContact OE2-NZ 3.25Å; E263-K323 PolarHBondContact OE2-NZ 2.76Å; E263-R326 VanDerWaalsContact CD-NH1 3.28Å; E263-R326 IonicContact OE1-CZ 3.41Å; E263-R326 IonicContact OE1-NH1 2.76Å; E263-R326 PolarHBondContact OE1-NH1 3.42Å; E263-R326 IonicContact OE1-NH2 3.9Å
264	A	91.7	Very high	81.3	Confident	11 Å²	11	42.4 Å²	42.4	9%	0.091	23%	0.232	C	C	.	.			trans	-61.4	119	164.1	0	0	0	0	0	109.9	L260 P261 E262 P296 Y317	L260-A264 HydrophobicContact CB-CB 3.97Å; L260-A264 HydrophobicContact CD1-CB 4.36Å; P261-A264 VanDerWaalsContact O-CB 3.29Å; P261-A264 WeakPolarHBondContact O-CB 3.33Å; P261-A264 PolarHBondContact O-N 3.46Å; P261-A264 VanDerWaalsContact O-N 3.14Å; E262-A264 PolarHBondContact O-N 2.93Å; A264-P296 HydrophobicContact CB-CG 4.03Å; A264-Y317 HydrophobicContact CB-CD2 3.94Å
265	T	88	Confident	80.4	Confident	75 Å²	75	44.7 Å²	44.7	46%	0.46	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	170.1	-178.3	54.2	0	0	0	0	111.4	E263 V267 T318	E263-T265 PolarHBondContact O-N 3.26Å; T265-V267 PolarHBondContact O-N 3.1Å; T265-V267 VanDerWaalsContact O-N 3.11Å; T265-T318 VanDerWaalsContact C-OG1 3.29Å; T265-T318 PolarHBondContact N-O 2.81Å; T265-T318 PolarHBondContact O-N 3.24Å; T265-T318 PolarHBondContact O-OG1 3.24Å; T265-T318 PolarHBondContact OG1-O 3.36Å; T265-T318 PolarHBondContact OG1-OG1 3.2Å
266	S	81.4	Confident	79.9	Confident	80 Å²	80	44.9 Å²	44.9	56%	0.559	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	48.9	43.6	175.7	-58	0	0	0	0	113.4	K268 T318	S266-K268 VanDerWaalsContact C-N 3.3Å; S266-K268 PolarHBondContact O-N 2.83Å; S266-T318 WeakPolarHBondContact CB-OG1 3.44Å
267	V	76.3	Confident	79.5	Confident	34 Å²	34	50.2 Å²	50.2	21%	0.206	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	92.3	177.2	-174.6	0	0	0	0	108.4	L260 T265 W269 V298 L315	L260-V267 HydrophobicContact CD1-CG1 3.94Å; L260-V267 HydrophobicContact CD1-CG2 3.76Å; T265-V267 PolarHBondContact O-N 3.1Å; T265-V267 VanDerWaalsContact O-N 3.11Å; V267-W269 PolarHBondContact O-N 3.45Å; V267-V298 HydrophobicContact CG1-CG2 3.58Å; V267-L315 HydrophobicContact CG1-CD1 3.82Å
268	K	70.3	Confident	79.2	Confident	142 Å²	142	48.8 Å²	48.8	62%	0.617	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	89.8	177.9	-73.3	-173.3	-177.7	-176.6	0	107.1	S266 L270 Y316	S266-K268 VanDerWaalsContact C-N 3.3Å; S266-K268 PolarHBondContact O-N 2.83Å; K268-L270 VanDerWaalsContact C-N 3.32Å; K268-L270 PolarHBondContact O-N 3.44Å; K268-Y316 PolarHBondContact N-O 3.33Å
269	W	63.8	Low	79	Confident	20 Å²	20	53.1 Å²	53.1	8%	0.076	30%	0.303	C	S	.	.			trans	-71.2	95.8	160.8	-129.2	71.7	0	0	0	107.8	V267 I271 T274 V278 V298 I300 F313 L315	V267-W269 PolarHBondContact O-N 3.45Å; W269-I271 VanDerWaalsContact C-N 3.27Å; W269-I271 HydrophobicContact CE3-CG1 4.04Å; W269-I271 PolarHBondContact O-N 2.92Å; W269-T274 HydrophobicContact CE3-CG2 4.18Å; W269-T274 HydrophobicContact CH2-CG2 3.17Å; W269-T274 HydrophobicContact CZ2-CG2 4.17Å; W269-T274 HydrophobicContact CZ3-CG2 3.2Å; W269-V278 HydrophobicContact CH2-CG2 3.82Å; W269-V278 HydrophobicContact CZ3-CG2 3.58Å; W269-V298 HydrophobicContact CG-CG1 4.13Å; W269-I300 HydrophobicContact CD2-CD1 4.31Å; W269-I300 HydrophobicContact CD2-CG1 4.38Å; W269-I300 VanDerWaalsContact CE2-CD1 3.43Å; W269-I300 HydrophobicContact CE3-CG1 4.39Å; W269-I300 HydrophobicContact CH2-CB 4.43Å; W269-I300 HydrophobicContact CH2-CD1 3.55Å; W269-I300 HydrophobicContact CH2-CG1 3.53Å; W269-I300 HydrophobicContact CH2-CG2 4.12Å; W269-I300 HydrophobicContact CZ2-CD1 3.04Å; W269-I300 HydrophobicContact CZ2-CG1 3.57Å; W269-I300 HydrophobicContact CZ3-CD1 4.35Å; W269-I300 HydrophobicContact CZ3-CG1 3.95Å; W269-F313 HydrophobicContact CZ2-CD2 4.47Å; W269-L315 HydrophobicContact CG-CD1 4.47Å
270	L	56	Low	78.7	Confident	69 Å²	69	57.1 Å²	57.1	36%	0.361	32%	0.32	S	S	.	.			trans	-73.7	90.8	171.6	-82.5	138.5	0	0	0	106.9	K268 S272 L273 Y316	K268-L270 VanDerWaalsContact C-N 3.32Å; K268-L270 PolarHBondContact O-N 3.44Å; L270-S272 WeakPolarHBondContact CD2-OG 3.32Å; L270-S272 PolarHBondContact O-N 2.81Å; L270-L273 HydrophobicContact CB-CB 4.1Å; L270-L273 HydrophobicContact CB-CD1 3.66Å; L270-L273 HydrophobicContact CB-CG 4.21Å; L270-L273 HydrophobicContact CD1-CD1 3.81Å; L270-L273 HydrophobicContact CG-CD1 4.19Å; L270-L273 WeakPolarHBondContact O-CB 3.31Å; L270-L273 PolarHBondContact O-N 3.04Å; L270-Y316 HydrophobicContact CD1-CD2 3.84Å; L270-Y316 HydrophobicContact CD1-CE2 4.15Å
271	I	52	Low	78.5	Confident	99 Å²	99	61.6 Å²	61.6	51%	0.508	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-52.4	-25	170.5	-62.2	169.2	0	0	0	110.3	W269 L273 T274 K280	W269-I271 VanDerWaalsContact C-N 3.27Å; W269-I271 HydrophobicContact CE3-CG1 4.04Å; W269-I271 PolarHBondContact O-N 2.92Å; I271-L273 PolarHBondContact O-N 3.36Å; I271-T274 PolarHBondContact O-N 3.08Å; I271-T274 PolarHBondContact O-OG1 2.82Å; I271-K280 HydrophobicContact CD1-CD 4.5Å
272	S	50.3	Low	78.3	Confident	100 Å²	100	66.5 Å²	66.5	70%	0.699	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-68	-17.7	173.3	58.9	0	0	0	0	115	L270	L270-S272 WeakPolarHBondContact CD2-OG 3.32Å; L270-S272 PolarHBondContact O-N 2.81Å
273	L	59.6	Low	78.2	Confident	74 Å²	74	70.3 Å²	70.3	39%	0.387	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-101.5	0.6	-179.8	-83.2	158.8	0	0	0	112.8	L270 I271 Y316	L270-L273 HydrophobicContact CB-CB 4.1Å; L270-L273 HydrophobicContact CB-CD1 3.66Å; L270-L273 HydrophobicContact CB-CG 4.21Å; L270-L273 HydrophobicContact CD1-CD1 3.81Å; L270-L273 HydrophobicContact CG-CD1 4.19Å; L270-L273 WeakPolarHBondContact O-CB 3.31Å; L270-L273 PolarHBondContact O-N 3.04Å; I271-L273 PolarHBondContact O-N 3.36Å; L273-Y316 HydrophobicContact CD1-CE2 3.98Å
274	T	69.8	Low	78.4	Confident	20 Å²	20	70.8 Å²	70.8	12%	0.123	39%	0.391	C	S	.	.	S	Bend	trans	-73.5	136.6	169.3	53.6	0	0	0	0	110.2	W269 I271 Y276 V278	W269-T274 HydrophobicContact CE3-CG2 4.18Å; W269-T274 HydrophobicContact CH2-CG2 3.17Å; W269-T274 HydrophobicContact CZ2-CG2 4.17Å; W269-T274 HydrophobicContact CZ3-CG2 3.2Å; I271-T274 PolarHBondContact O-N 3.08Å; I271-T274 PolarHBondContact O-OG1 2.82Å; T274-Y276 WeakPolarHBondContact CB-O 3.46Å; T274-Y276 PolarHBondContact O-N 3.15Å; T274-Y276 VanDerWaalsContact O-N 3.13Å; T274-Y276 PolarHBondContact OG1-O 2.87Å; T274-Y276 VanDerWaalsContact OG1-O 3.12Å; T274-V278 HydrophobicContact CG2-CG2 3.86Å
275	P	78.6	Confident	78.4	Confident	48 Å²	48	78.1 Å²	78.1	31%	0.312	42%	0.417	S	S	.	.	S	Bend	trans	-60	-26.7	-179.1	19.2	-30.4	0	0	0	113.5	Q311	P275-Q311 HydrophobicContact CB-CB 3.72Å; P275-Q311 HydrophobicContact CB-CG 4.24Å; P275-Q311 HydrophobicContact CG-CB 3.57Å
276	Y	86.2	Confident	78.8	Confident	26 Å²	26	78 Å²	78	10%	0.102	41%	0.411	C	S	.	.	S	Bend	trans	-150	163	179.5	42.2	-100.5	0	0	0	110.8	L241 T274 V278 M305 H309 Q311	L241-Y276 HydrophobicContact CD2-CE2 3.63Å; L241-Y276 WeakPolarHBondContact CD2-OH 3.38Å; T274-Y276 WeakPolarHBondContact CB-O 3.46Å; T274-Y276 PolarHBondContact O-N 3.15Å; T274-Y276 VanDerWaalsContact O-N 3.13Å; T274-Y276 PolarHBondContact OG1-O 2.87Å; T274-Y276 VanDerWaalsContact OG1-O 3.12Å; Y276-V278 HydrophobicContact CD2-CG1 3.9Å; Y276-V278 HydrophobicContact CE2-CG1 3.88Å; Y276-V278 PolarHBondContact O-N 2.84Å; Y276-M305 HydrophobicContact CE2-CE 3.83Å; Y276-M305 HydrophobicContact CE2-SD 4.25Å; Y276-M305 VanDerWaalsContact OH-CE 3.28Å; Y276-M305 WeakPolarHBondContact OH-CE 3.49Å; Y276-H309 AromaticContact CD1-CD2 3.91Å; Y276-H309 HydrophobicContact CE1-CB 3.9Å; Y276-H309 AromaticContact CE1-CD2 3.89Å; Y276-H309 VanDerWaalsContact CE1-O 3.24Å; Y276-H309 WeakPolarHBondContact CE1-O 3.35Å; Y276-H309 AromaticContact CZ-CD2 3.98Å; Y276-H309 PolarHBondContact OH-O 2.85Å; Y276-Q311 HydrophobicContact CE1-CB 4.2Å; Y276-Q311 HydrophobicContact CE1-CG 4.37Å
277	P	87.6	Confident	79.4	Confident	111 Å²	111	80.9 Å²	80.9	72%	0.721	41%	0.41	S	S	*	.			trans	-61	129.2	-178.7	-22.2	33.5	0	0	0	112.4	K302	P277-K302 VanDerWaalsContact O-CD 3.32Å; P277-K302 WeakPolarHBondContact O-CD 3.39Å; P277-K302 WeakPolarHBondContact O-CE 3.18Å
278	V	89.6	Confident	80.2	Confident	23 Å²	23	81.5 Å²	81.5	14%	0.139	41%	0.414	C	S	.	.			trans	-132.3	154.8	176.1	-62.8	0	0	0	0	111.1	L241 W269 T274 Y276 I300 K302	L241-V278 HydrophobicContact CD2-CG1 4.23Å; W269-V278 HydrophobicContact CH2-CG2 3.82Å; W269-V278 HydrophobicContact CZ3-CG2 3.58Å; T274-V278 HydrophobicContact CG2-CG2 3.86Å; Y276-V278 HydrophobicContact CD2-CG1 3.9Å; Y276-V278 HydrophobicContact CE2-CG1 3.88Å; Y276-V278 PolarHBondContact O-N 2.84Å; V278-I300 HydrophobicContact CB-CG2 3.56Å; V278-I300 HydrophobicContact CG1-CG2 4.19Å; V278-I300 HydrophobicContact CG2-CG2 3.57Å; V278-K302 HydrophobicContact CG1-CB 4.37Å; V278-K302 HydrophobicContact CG1-CD 4.42Å; V278-K302 HydrophobicContact CG1-CG 4.47Å
279	T	91.8	Very high	81.2	Confident	91 Å²	91	84.9 Å²	84.9	56%	0.558	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	110.5	179.7	-56	0	0	0	0	109.8	S301	T279-S301 WeakPolarHBondContact CB-O 3.34Å; T279-S301 PolarHBondContact N-O 2.87Å; T279-S301 PolarHBondContact O-N 3.11Å; T279-S301 PolarHBondContact O-OG 3.01Å
280	K	89.4	Confident	82.5	Confident	91 Å²	91	87.7 Å²	87.7	40%	0.396	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.5	173.5	-176.3	178.8	179	-175.9	0	110.2	I271	I271-K280 HydrophobicContact CD1-CD 4.5Å
281	R	90.6	Very high	84.2	Confident	94 Å²	94	85.6 Å²	85.6	36%	0.355	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-95.6	165.4	171.7	-67.5	-169.4	-175.3	-178.5	0.3	110.8	V299 S301	R281-V299 HydrophobicContact CB-CB 3.98Å; R281-V299 HydrophobicContact CB-CG1 4.03Å; R281-V299 HydrophobicContact CG-CG1 4.3Å; R281-V299 PolarHBondContact N-O 2.8Å; R281-S301 PolarHBondContact NE-OG 2.84Å
282	P	90.8	Very high	86	Confident	107 Å²	107	84.4 Å²	84.4	70%	0.695	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-53.2	151.3	172.3	-25.5	35.8	0	0	0	111.7	E284	P282-E284 PolarHBondContact O-N 3.28Å
283	L	88.5	Confident	87.8	Confident	93 Å²	93	82.7 Å²	82.7	49%	0.487	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-64.7	132.9	173.4	-118.5	77.9	0	0	0	109.2	P296	L283-P296 HydrophobicContact CD2-CB 4.26Å
284	E	93.4	Very high	89.4	Confident	79 Å²	79	79.4 Å²	79.4	37%	0.369	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	171.7	174.8	-69.3	175	-164.7	0	0	110.1	P282 V297 V299	P282-E284 PolarHBondContact O-N 3.28Å; E284-V297 HydrophobicContact CB-CB 4.1Å; E284-V297 PolarHBondContact N-O 3Å; E284-V297 VanDerWaalsContact N-O 3.09Å; E284-V297 PolarHBondContact O-N 3.03Å; E284-V299 HydrophobicContact CB-CG2 4.31Å; E284-V299 HydrophobicContact CG-CG2 4.08Å
285	R	93.7	Very high	90.6	Very high	165 Å²	165	79.1 Å²	79.1	62%	0.623	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.5	171.3	-71.7	-170.7	178.6	-171.7	1.9	109.9	Y287 V293 R295	R285-Y287 HydrophobicContact CB-CE2 4.28Å; R285-V293 PolarHBondContact NH1-O 3.44Å; R285-R295 WeakPolarHBondContact CA-O 3.33Å
286	H	94.9	Very high	91.3	Very high	72 Å²	72	77.8 Å²	77.8	33%	0.333	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.7	175	-175.6	-95.4	0	0	0	109.7	I259 G294 R295 V297	I259-H286 HydrophobicContact CD1-CB 4.44Å; I259-H286 HydrophobicContact CG2-CB 4.29Å; H286-G294 CarbonylContact O-C 3.52Å; H286-G294 WeakPolarHBondContact O-CA 3.45Å; H286-R295 PolarHBondContact N-O 2.88Å; H286-R295 PolarHBondContact O-N 3.27Å; H286-V297 HydrophobicContact CB-CG2 3.46Å; H286-V297 VanDerWaalsContact CB-CG2 3.46Å
287	Y	95	Very high	91.8	Very high	141 Å²	141	76.8 Å²	76.8	55%	0.553	38%	0.381	S	S	*	.			trans	-119.5	118	178.9	-66.5	-87.4	0	0	0	108.3	R285 V293 G294	R285-Y287 HydrophobicContact CB-CE2 4.28Å; Y287-V293 WeakPolarHBondContact CE1-O 3.48Å; Y287-V293 PolarHBondContact OH-O 3.41Å; Y287-G294 VanDerWaalsContact CE1-CA 3.44Å
288	T	92.3	Very high	92	Very high	47 Å²	47	71.6 Å²	71.6	29%	0.288	35%	0.347	S	S	.	.			trans	-120	-170.6	173.2	-166.2	0	0	0	0	110.6	D291	T288-D291 VanDerWaalsContact CG2-OD2 3.31Å; T288-D291 WeakPolarHBondContact CG2-OD2 3.35Å; T288-D291 PolarHBondContact N-OD2 2.91Å; T288-D291 PolarHBondContact O-N 2.8Å
289	Y	91.7	Very high	92.3	Very high	212 Å²	212	70.5 Å²	70.5	83%	0.831	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	139.5	175.9	-59.4	-79.3	0	0	0	111.4	D291	Y289-D291 PolarHBondContact O-N 2.77Å
290	L	91.7	Very high	92.3	Very high	80 Å²	80	66.1 Å²	66.1	42%	0.419	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	20.5	179	-52.2	176.3	0	0	0	114.9	E327 M330 V331	L290-E327 HydrophobicContact CB-CG 4.18Å; L290-E327 HydrophobicContact CD1-CB 4.18Å; L290-M330 HydrophobicContact CB-CE 4.22Å; L290-M330 WeakPolarHBondContact O-CE 3.42Å; L290-V331 HydrophobicContact CD1-CG2 4.45Å; L290-V331 HydrophobicContact CD2-CG2 3.74Å
291	D	91.1	Very high	92.6	Very high	25 Å²	25	62.3 Å²	62.3	13%	0.134	30%	0.299	C	S	.	.			trans	-91.9	146.8	170.4	-70.6	-22.5	0	0	0	111.6	T288 Y289 R295	T288-D291 VanDerWaalsContact CG2-OD2 3.31Å; T288-D291 WeakPolarHBondContact CG2-OD2 3.35Å; T288-D291 PolarHBondContact N-OD2 2.91Å; T288-D291 PolarHBondContact O-N 2.8Å; Y289-D291 PolarHBondContact O-N 2.77Å; D291-R295 IonicContact OD1-NE 2.71Å; D291-R295 PolarHBondContact OD1-NE 2.92Å; D291-R295 WeakPolarHBondContact OD2-CD 3.49Å; D291-R295 WeakPolarHBondContact OD2-CG 3.47Å; D291-R295 IonicContact OD2-NE 3.86Å
292	T	89.3	Confident	92.8	Very high	73 Å²	73	60.1 Å²	60.1	45%	0.448	29%	0.292	S	S	.	.	S	Bend	trans	-119.2	-43	176.9	55.6	0	0	0	0	113.4	E262 R326 M330	E262-T292 WeakPolarHBondContact OE1-CA 3.14Å; E262-T292 PolarHBondContact OE1-N 3.09Å; E262-T292 PolarHBondContact OE1-OG1 2.89Å; T292-R326 PolarHBondContact OG1-NH2 3Å; T292-M330 HydrophobicContact CG2-SD 3.33Å; T292-M330 WeakPolarHBondContact CG2-SD 3.47Å
293	V	89.4	Confident	92.9	Very high	64 Å²	64	58 Å²	58	39%	0.388	28%	0.28	S	S	.	.	S	Bend	trans	-97.3	-28.9	179.2	-176.9	0	0	0	0	110.7	E262 R285 Y287	E262-V293 PolarHBondContact OE1-N 2.69Å; R285-V293 PolarHBondContact NH1-O 3.44Å; Y287-V293 WeakPolarHBondContact CE1-O 3.48Å; Y287-V293 PolarHBondContact OH-O 3.41Å
294	G	92.6	Very high	93.2	Very high	6 Å²	6	58 Å²	58	6%	0.062	28%	0.28	C	S	.	.			trans	101.5	148.5	-175.2	0	0	0	0	0	112.4	H286 Y287	H286-G294 CarbonylContact O-C 3.52Å; H286-G294 WeakPolarHBondContact O-CA 3.45Å; Y287-G294 VanDerWaalsContact CE1-CA 3.44Å
295	R	94.5	Very high	93.2	Very high	14 Å²	14	54.2 Å²	54.2	5%	0.053	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.8	179.1	-75	176.3	169.3	-127	-16.7	111.4	E122 I259 L260 E262 R285 H286 D291	E122-R295 IonicContact OE1-CZ 3.83Å; E122-R295 IonicContact OE1-NH1 3.65Å; E122-R295 PolarHBondContact OE1-NH1 3.2Å; I259-R295 HydrophobicContact CG2-CB 3.81Å; I259-R295 HydrophobicContact CG2-CG 4.43Å; L260-R295 VanDerWaalsContact O-CB 3.23Å; L260-R295 WeakPolarHBondContact O-CB 3.38Å; L260-R295 WeakPolarHBondContact O-CG 3.38Å; E262-R295 HydrophobicContact CB-CG 4.4Å; R285-R295 WeakPolarHBondContact CA-O 3.33Å; H286-R295 PolarHBondContact N-O 2.88Å; H286-R295 PolarHBondContact O-N 3.27Å; D291-R295 IonicContact OD1-NE 2.71Å; D291-R295 PolarHBondContact OD1-NE 2.92Å; D291-R295 WeakPolarHBondContact OD2-CD 3.49Å; D291-R295 WeakPolarHBondContact OD2-CG 3.47Å; D291-R295 IonicContact OD2-NE 3.86Å
296	P	94.2	Very high	93.2	Very high	20 Å²	20	47.4 Å²	47.4	13%	0.13	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132	176	26.3	-27.1	0	0	0	110.5	L260 P261 A264 L283	L260-P296 HydrophobicContact CB-CG 4.09Å; L260-P296 PolarHBondContact N-O 3.35Å; P261-P296 WeakPolarHBondContact O-CD 3.31Å; A264-P296 HydrophobicContact CB-CG 4.03Å; L283-P296 HydrophobicContact CD2-CB 4.26Å
297	V	95.1	Very high	93.1	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.03	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.5	179.6	-172.7	0	0	0	0	110.3	K257 I258 I259 E284 H286 V299	K257-V297 HydrophobicContact CB-CG1 3.98Å; K257-V297 HydrophobicContact CG-CG1 4.42Å; I258-V297 WeakPolarHBondContact O-CA 3.5Å; I259-V297 HydrophobicContact CB-CG2 4.47Å; I259-V297 HydrophobicContact CG1-CG1 4.25Å; I259-V297 HydrophobicContact CG1-CG2 3.98Å; I259-V297 HydrophobicContact CG2-CG2 4.45Å; E284-V297 HydrophobicContact CB-CB 4.1Å; E284-V297 PolarHBondContact N-O 3Å; E284-V297 VanDerWaalsContact N-O 3.09Å; E284-V297 PolarHBondContact O-N 3.03Å; H286-V297 HydrophobicContact CB-CG2 3.46Å; H286-V297 VanDerWaalsContact CB-CG2 3.46Å; V297-V299 HydrophobicContact CG1-CG2 3.88Å
298	V	93.3	Very high	92.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.4	171.1	-175.6	0	0	0	0	108.9	K257 I258 L260 V267 W269 I300	K257-V298 WeakPolarHBondContact CA-O 3.47Å; I258-V298 HydrophobicContact CB-CB 4.3Å; I258-V298 PolarHBondContact N-O 2.96Å; I258-V298 PolarHBondContact O-N 3.05Å; L260-V298 HydrophobicContact CD1-CG2 4.28Å; V267-V298 HydrophobicContact CG1-CG2 3.58Å; W269-V298 HydrophobicContact CG-CG1 4.13Å; V298-I300 HydrophobicContact CG1-CD1 4.05Å; V298-I300 HydrophobicContact CG1-CG1 4.45Å
299	V	94.2	Very high	93	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125	-178.6	-172.3	0	0	0	0	110.6	I255 L256 K257 R281 E284 V297	I255-V299 HydrophobicContact CG2-CG1 3.91Å; L256-V299 WeakPolarHBondContact O-CA 3.47Å; K257-V299 HydrophobicContact CG-CG1 4.27Å; K257-V299 HydrophobicContact CG-CG2 4.11Å; R281-V299 HydrophobicContact CB-CB 3.98Å; R281-V299 HydrophobicContact CB-CG1 4.03Å; R281-V299 HydrophobicContact CG-CG1 4.3Å; R281-V299 PolarHBondContact N-O 2.8Å; E284-V299 HydrophobicContact CB-CG2 4.31Å; E284-V299 HydrophobicContact CG-CG2 4.08Å; V297-V299 HydrophobicContact CG1-CG2 3.88Å
300	I	93.1	Very high	93.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.1	176.7	-58.1	120.9	0	0	0	108.1	I255 L256 I258 W269 V278 V298	I255-I300 CarbonylContact C-O 3.57Å; I255-I300 WeakPolarHBondContact CA-O 3.23Å; L256-I300 HydrophobicContact CB-CB 4.4Å; L256-I300 HydrophobicContact CD2-CD1 4.03Å; L256-I300 HydrophobicContact CG-CD1 4.39Å; L256-I300 PolarHBondContact N-O 3.47Å; L256-I300 PolarHBondContact O-N 2.86Å; I258-I300 HydrophobicContact CD1-CD1 4.15Å; W269-I300 HydrophobicContact CD2-CD1 4.31Å; W269-I300 HydrophobicContact CD2-CG1 4.38Å; W269-I300 VanDerWaalsContact CE2-CD1 3.43Å; W269-I300 HydrophobicContact CE3-CG1 4.39Å; W269-I300 HydrophobicContact CH2-CB 4.43Å; W269-I300 HydrophobicContact CH2-CD1 3.55Å; W269-I300 HydrophobicContact CH2-CG1 3.53Å; W269-I300 HydrophobicContact CH2-CG2 4.12Å; W269-I300 HydrophobicContact CZ2-CD1 3.04Å; W269-I300 HydrophobicContact CZ2-CG1 3.57Å; W269-I300 HydrophobicContact CZ3-CD1 4.35Å; W269-I300 HydrophobicContact CZ3-CG1 3.95Å; V278-I300 HydrophobicContact CB-CG2 3.56Å; V278-I300 HydrophobicContact CG1-CG2 4.19Å; V278-I300 HydrophobicContact CG2-CG2 3.57Å; V298-I300 HydrophobicContact CG1-CD1 4.05Å; V298-I300 HydrophobicContact CG1-CG1 4.45Å
301	S	94.8	Very high	93.1	Very high	11 Å²	11	36.8 Å²	36.8	8%	0.077	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.9	176.7	54	0	0	0	0	111.2	F254 T279 R281	F254-S301 CarbonylContact O-C 3.56Å; F254-S301 VanDerWaalsContact O-CA 3.31Å; F254-S301 WeakPolarHBondContact O-CA 3.42Å; T279-S301 WeakPolarHBondContact CB-O 3.34Å; T279-S301 PolarHBondContact N-O 2.87Å; T279-S301 PolarHBondContact O-N 3.11Å; T279-S301 PolarHBondContact O-OG 3.01Å; R281-S301 PolarHBondContact NE-OG 2.84Å
302	K	94.6	Very high	93.1	Very high	48 Å²	48	39.2 Å²	39.2	21%	0.209	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	139.7	176.5	-174.3	62.1	175.7	75.3	0	109.5	F254 P277 V278 M305	F254-K302 WeakPolarHBondContact CA-O 3.31Å; F254-K302 VanDerWaalsContact CB-O 3.31Å; F254-K302 WeakPolarHBondContact CB-O 3.47Å; F254-K302 PolarHBondContact N-O 3.32Å; F254-K302 PolarHBondContact O-N 3.48Å; P277-K302 VanDerWaalsContact O-CD 3.32Å; P277-K302 WeakPolarHBondContact O-CD 3.39Å; P277-K302 WeakPolarHBondContact O-CE 3.18Å; V278-K302 HydrophobicContact CG1-CB 4.37Å; V278-K302 HydrophobicContact CG1-CD 4.42Å; V278-K302 HydrophobicContact CG1-CG 4.47Å; K302-M305 HydrophobicContact CB-CG 4.33Å; K302-M305 HydrophobicContact CB-SD 3.96Å; K302-M305 HydrophobicContact CG-CG 4.06Å; K302-M305 HydrophobicContact CG-SD 3.28Å; K302-M305 WeakPolarHBondContact CG-SD 3.37Å
303	S	94.3	Very high	93.2	Very high	63 Å²	63	35.8 Å²	35.8	44%	0.441	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	157	173.9	54.7	0	0	0	0	111.9	E252	E252-S303 VanDerWaalsContact O-CA 3.22Å; E252-S303 WeakPolarHBondContact O-CA 3.45Å; E252-S303 VanDerWaalsContact O-CB 3.3Å; E252-S303 WeakPolarHBondContact O-CB 3.47Å
304	N	93.5	Very high	93.3	Very high	92 Å²	92	35.3 Å²	35.3	49%	0.492	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.5	56.9	174.4	-59.2	-41.4	0	0	0	113.3	D251 E252	D251-N304 CarbonylContact O-C 3.58Å; D251-N304 VanDerWaalsContact O-CA 3.28Å; D251-N304 WeakPolarHBondContact O-CA 3.45Å; D251-N304 PolarHBondContact O-N 3.23Å; E252-N304 PolarHBondContact O-N 3.25Å
305	M	93.9	Very high	93.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	144.7	173.1	-61.7	-66.4	-79.5	0	0	109.9	L241 V242 D251 F254 Y276 K302 H309	L241-M305 HydrophobicContact CD2-CE 4.07Å; V242-M305 HydrophobicContact CB-CE 4.28Å; V242-M305 HydrophobicContact CG1-CE 3.78Å; D251-M305 HydrophobicContact CB-CB 4.04Å; D251-M305 PolarHBondContact N-O 2.85Å; D251-M305 PolarHBondContact O-N 3.36Å; F254-M305 HydrophobicContact CB-CG 3.81Å; F254-M305 HydrophobicContact CD1-CE 4.49Å; F254-M305 HydrophobicContact CG-CG 4.35Å; Y276-M305 HydrophobicContact CE2-CE 3.83Å; Y276-M305 HydrophobicContact CE2-SD 4.25Å; Y276-M305 VanDerWaalsContact OH-CE 3.28Å; Y276-M305 WeakPolarHBondContact OH-CE 3.49Å; K302-M305 HydrophobicContact CB-CG 4.33Å; K302-M305 HydrophobicContact CB-SD 3.96Å; K302-M305 HydrophobicContact CG-CG 4.06Å; K302-M305 HydrophobicContact CG-SD 3.28Å; K302-M305 WeakPolarHBondContact CG-SD 3.37Å; M305-H309 HydrophobicContact CE-CB 3.48Å; M305-H309 VanDerWaalsContact CE-CB 3.48Å; M305-H309 HydrophobicContact SD-CB 4.01Å
306	V	93.9	Very high	93.2	Very high	21 Å²	21	38.5 Å²	38.5	13%	0.127	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	170.6	176.9	-63	0	0	0	0	108.4	M20 N308 H309	M20-V306 HydrophobicContact CB-CG2 4.36Å; V306-N308 HydrophobicContact CG2-CB 4.35Å; V306-N308 PolarHBondContact O-N 3.42Å; V306-N308 VanDerWaalsContact O-N 3.11Å; V306-H309 VanDerWaalsContact CG2-ND1 3.3Å; V306-H309 WeakPolarHBondContact CG2-ND1 3.35Å; V306-H309 PolarHBondContact N-ND1 3.23Å; V306-H309 VanDerWaalsContact O-CB 3.3Å; V306-H309 WeakPolarHBondContact O-CB 3.37Å; V306-H309 PolarHBondContact O-N 2.77Å
307	E	92.1	Very high	93.2	Very high	73 Å²	73	37.7 Å²	37.7	34%	0.341	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-50.7	-37.8	-178.3	-161.4	176.9	158.3	0	0	114.1	H244 N248 F249 H309 I310	H244-E307 IonicContact CD2-OE1 3.64Å; N248-E307 PolarHBondContact N-OE2 2.84Å; F249-E307 HydrophobicContact CD1-CB 4.37Å; F249-E307 HydrophobicContact CE1-CB 4.01Å; F249-E307 HydrophobicContact CE1-CG 4.24Å; E307-H309 PolarHBondContact O-N 3.03Å; E307-I310 HydrophobicContact CG-CD1 3.81Å; E307-I310 WeakPolarHBondContact O-CB 3.3Å; E307-I310 WeakPolarHBondContact O-CD1 2.99Å; E307-I310 WeakPolarHBondContact O-CG1 3.34Å; E307-I310 PolarHBondContact O-N 3.14Å
308	N	92.1	Very high	93.2	Very high	85 Å²	85	39.2 Å²	39.2	46%	0.455	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-65.1	-11	176.7	-58.7	65.4	0	0	0	114.6	M20 V306 I310	M20-N308 VanDerWaalsContact CE-OD1 3.29Å; M20-N308 WeakPolarHBondContact CE-OD1 3.49Å; V306-N308 HydrophobicContact CG2-CB 4.35Å; V306-N308 PolarHBondContact O-N 3.42Å; V306-N308 VanDerWaalsContact O-N 3.11Å; N308-I310 VanDerWaalsContact C-N 3.34Å
309	H	93.5	Very high	93.3	Very high	44 Å²	44	40.2 Å²	40.2	20%	0.204	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-86.7	-2.3	173.2	-66.7	88.7	0	0	0	113	V242 Y276 M305 V306 E307 Q311	V242-H309 HydrophobicContact CG1-CB 4.37Å; Y276-H309 AromaticContact CD1-CD2 3.91Å; Y276-H309 HydrophobicContact CE1-CB 3.9Å; Y276-H309 AromaticContact CE1-CD2 3.89Å; Y276-H309 VanDerWaalsContact CE1-O 3.24Å; Y276-H309 WeakPolarHBondContact CE1-O 3.35Å; Y276-H309 AromaticContact CZ-CD2 3.98Å; Y276-H309 PolarHBondContact OH-O 2.85Å; M305-H309 HydrophobicContact CE-CB 3.48Å; M305-H309 VanDerWaalsContact CE-CB 3.48Å; M305-H309 HydrophobicContact SD-CB 4.01Å; V306-H309 VanDerWaalsContact CG2-ND1 3.3Å; V306-H309 WeakPolarHBondContact CG2-ND1 3.35Å; V306-H309 PolarHBondContact N-ND1 3.23Å; V306-H309 VanDerWaalsContact O-CB 3.3Å; V306-H309 WeakPolarHBondContact O-CB 3.37Å; V306-H309 PolarHBondContact O-N 2.77Å; E307-H309 PolarHBondContact O-N 3.03Å; H309-Q311 PolarHBondContact O-N 3.43Å
310	I	93.4	Very high	93.2	Very high	44 Å²	44	44.7 Å²	44.7	23%	0.226	23%	0.225	C	C	.	.			trans	-65	97.7	172	-62.4	168.2	0	0	0	108.4	R240 V242 H244 F249 E307 N308	R240-I310 HydrophobicContact CG-CG2 4.47Å; V242-I310 HydrophobicContact CG1-CG1 4.14Å; H244-I310 HydrophobicContact CB-CD1 4.12Å; F249-I310 HydrophobicContact CE1-CD1 4.15Å; F249-I310 HydrophobicContact CE1-CG1 4.47Å; F249-I310 HydrophobicContact CZ-CG1 4.43Å; E307-I310 HydrophobicContact CG-CD1 3.81Å; E307-I310 WeakPolarHBondContact O-CB 3.3Å; E307-I310 WeakPolarHBondContact O-CD1 2.99Å; E307-I310 WeakPolarHBondContact O-CG1 3.34Å; E307-I310 PolarHBondContact O-N 3.14Å; N308-I310 VanDerWaalsContact C-N 3.34Å
311	Q	92.2	Very high	93	Very high	84 Å²	84	49.9 Å²	49.9	39%	0.393	25%	0.245	S	C	.	.			trans	-147.4	153.2	-179.7	-65.4	-172.7	45.9	0	0	109	L241 P275 Y276 H309	L241-Q311 PolarHBondContact N-O 3.32Å; P275-Q311 HydrophobicContact CB-CB 3.72Å; P275-Q311 HydrophobicContact CB-CG 4.24Å; P275-Q311 HydrophobicContact CG-CB 3.57Å; Y276-Q311 HydrophobicContact CE1-CB 4.2Å; Y276-Q311 HydrophobicContact CE1-CG 4.37Å; H309-Q311 PolarHBondContact O-N 3.43Å
312	D	91.9	Very high	92.8	Very high	76 Å²	76	52.8 Å²	52.8	41%	0.406	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	148.2	-179.7	-62.8	-18	0	0	0	111.4	K238 M239 R240	K238-D312 WeakPolarHBondContact CE-OD2 3.4Å; K238-D312 HydrophobicContact CG-CB 4.34Å; M239-D312 CarbonylContact O-C 3.57Å; M239-D312 VanDerWaalsContact O-CA 3.3Å; M239-D312 WeakPolarHBondContact O-CA 3.24Å; R240-D312 VanDerWaalsContact CG-OD1 3.29Å; R240-D312 WeakPolarHBondContact CG-OD1 3.43Å
313	F	91.4	Very high	92.6	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	156.8	165.1	74.7	-89.5	0	0	0	109.7	L121 L237 K238 M239 L241 L256 I258 W269 L315	L121-F313 HydrophobicContact CD1-CE1 4.04Å; L121-F313 HydrophobicContact CD1-CZ 3.83Å; L237-F313 HydrophobicContact CD2-CE2 4.2Å; L237-F313 HydrophobicContact CD2-CZ 4.15Å; K238-F313 WeakPolarHBondContact CA-O 3.09Å; M239-F313 HydrophobicContact CB-CE1 3.89Å; M239-F313 HydrophobicContact CB-CZ 4.12Å; M239-F313 PolarHBondContact N-O 3.23Å; M239-F313 WeakPolarHBondContact O-CD1 3.29Å; M239-F313 WeakPolarHBondContact O-CE1 3.39Å; M239-F313 PolarHBondContact O-N 3.4Å; L241-F313 HydrophobicContact CB-CD1 4.14Å; L241-F313 HydrophobicContact CD1-CB 4.04Å; L241-F313 HydrophobicContact CD1-CD1 3.91Å; L241-F313 HydrophobicContact CD1-CG 4.13Å; L256-F313 HydrophobicContact CD2-CD1 4.25Å; L256-F313 HydrophobicContact CD2-CE1 3.87Å; L256-F313 HydrophobicContact CD2-CZ 4.23Å; I258-F313 HydrophobicContact CD1-CD2 4.35Å; I258-F313 HydrophobicContact CD1-CE2 3.44Å; I258-F313 VanDerWaalsContact CD1-CE2 3.44Å; I258-F313 HydrophobicContact CD1-CZ 3.55Å; I258-F313 HydrophobicContact CG1-CZ 4.37Å; W269-F313 HydrophobicContact CZ2-CD2 4.47Å; F313-L315 HydrophobicContact CD2-CB 4.23Å; F313-L315 HydrophobicContact CE2-CB 3.94Å
314	E	91.6	Very high	92.4	Very high	53 Å²	53	53.2 Å²	53.2	25%	0.248	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.9	174.3	-66	-178.7	171.6	0	0	110.1	L237 K238 Y316	L237-E314 CarbonylContact O-C 3.57Å; L237-E314 WeakPolarHBondContact O-CA 3.28Å; K238-E314 HydrophobicContact CB-CG 4.3Å; K238-E314 HydrophobicContact CD-CG 4.33Å; K238-E314 HydrophobicContact CG-CG 4.06Å; K238-E314 IonicContact NZ-OE1 2.83Å; E314-Y316 HydrophobicContact CB-CE2 4.18Å; E314-Y316 PolarHBondContact OE2-OH 3.3Å
315	L	91.8	Very high	92.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119.8	179.9	164.1	65.7	0	0	0	110.1	C236 L237 I258 L260 V267 W269 F313	C236-L315 CarbonylContact C-O 3.57Å; C236-L315 WeakPolarHBondContact CA-O 3.44Å; L237-L315 HydrophobicContact CB-CB 4.25Å; L237-L315 HydrophobicContact CD2-CD2 4.13Å; L237-L315 PolarHBondContact N-O 2.82Å; L237-L315 PolarHBondContact O-N 2.88Å; I258-L315 HydrophobicContact CB-CD2 4.31Å; I258-L315 HydrophobicContact CD1-CD2 3.9Å; I258-L315 HydrophobicContact CG2-CD2 3.69Å; L260-L315 HydrophobicContact CD1-CD2 4.27Å; L260-L315 HydrophobicContact CD2-CD2 3.88Å; L260-L315 HydrophobicContact CG-CD2 4.37Å; V267-L315 HydrophobicContact CG1-CD1 3.82Å; W269-L315 HydrophobicContact CG-CD1 4.47Å; F313-L315 HydrophobicContact CD2-CB 4.23Å; F313-L315 HydrophobicContact CE2-CB 3.94Å
316	Y	93.2	Very high	92.3	Very high	87 Å²	87	56.8 Å²	56.8	34%	0.341	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	134	178	-63.3	-89.9	0	0	0	111.7	F235 C236 K268 L270 L273 E314	F235-Y316 WeakPolarHBondContact O-CA 3.39Å; C236-Y316 HydrophobicContact CB-CD1 3.74Å; C236-Y316 HydrophobicContact CB-CE1 3.58Å; C236-Y316 VanDerWaalsContact SG-CE1 3.52Å; K268-Y316 PolarHBondContact N-O 3.33Å; L270-Y316 HydrophobicContact CD1-CD2 3.84Å; L270-Y316 HydrophobicContact CD1-CE2 4.15Å; L273-Y316 HydrophobicContact CD1-CE2 3.98Å; E314-Y316 HydrophobicContact CB-CE2 4.18Å; E314-Y316 PolarHBondContact OE2-OH 3.3Å
317	Y	93.8	Very high	92.2	Very high	3 Å²	3	57.5 Å²	57.5	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	161.5	173.4	66.7	-84	0	0	0	111	H125 L228 F235 L260 P261 A264 W319	H125-Y317 PolarHBondContact CE1-OH 3Å; H125-Y317 AromaticContact NE2-CE2 3.59Å; H125-Y317 AromaticContact NE2-CZ 3.68Å; H125-Y317 PolarHBondContact NE2-OH 3.11Å; L228-Y317 HydrophobicContact CD1-CE1 4.1Å; L228-Y317 WeakPolarHBondContact CD1-OH 3.32Å; F235-Y317 HydrophobicContact CB-CD1 4.12Å; F235-Y317 HydrophobicContact CB-CD2 4.22Å; F235-Y317 HydrophobicContact CB-CE1 3.65Å; F235-Y317 HydrophobicContact CB-CE2 3.77Å; F235-Y317 HydrophobicContact CB-CG 4.39Å; F235-Y317 VanDerWaalsContact CB-CZ 3.47Å; F235-Y317 HydrophobicContact CD2-CE2 4.11Å; F235-Y317 HydrophobicContact CG-CE2 4.12Å; F235-Y317 PolarHBondContact N-O 3.02Å; F235-Y317 PolarHBondContact O-N 2.9Å; L260-Y317 HydrophobicContact CD1-CD1 4.49Å; L260-Y317 HydrophobicContact CD1-CG 4.33Å; L260-Y317 HydrophobicContact CD2-CD1 3.83Å; L260-Y317 HydrophobicContact CD2-CE1 3.8Å; L260-Y317 HydrophobicContact CD2-CG 4.27Å; P261-Y317 HydrophobicContact CG-CE2 4.45Å; A264-Y317 HydrophobicContact CB-CD2 3.94Å; Y317-W319 HydrophobicContact CD2-CB 4.12Å; Y317-W319 HydrophobicContact CE2-CB 3.96Å
318	T	94.7	Very high	92.3	Very high	38 Å²	38	56.7 Å²	56.7	23%	0.233	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.2	175.2	54.2	0	0	0	0	110.4	N233 R234 T265 S266	N233-T318 WeakPolarHBondContact O-CA 3.49Å; R234-T318 HydrophobicContact CG-CG2 4.04Å; T265-T318 VanDerWaalsContact C-OG1 3.29Å; T265-T318 PolarHBondContact N-O 2.81Å; T265-T318 PolarHBondContact O-N 3.24Å; T265-T318 PolarHBondContact O-OG1 3.24Å; T265-T318 PolarHBondContact OG1-O 3.36Å; T265-T318 PolarHBondContact OG1-OG1 3.2Å; S266-T318 WeakPolarHBondContact CB-OG1 3.44Å
319	W	94.3	Very high	92.4	Very high	21 Å²	21	57.7 Å²	57.7	8%	0.08	28%	0.28	C	S	.	.			trans	-144.2	134.3	178.7	-171.8	82.3	0	0	0	110.1	H125 N233 F235 E262 Y317 K323 I324	H125-W319 HydrophobicContact CB-CH2 4.12Å; H125-W319 HydrophobicContact CB-CZ3 4.05Å; H125-W319 AromaticContact CE1-CE3 3.99Å; H125-W319 AromaticContact CG-CE3 4Å; H125-W319 AromaticContact CG-CZ3 3.83Å; H125-W319 AromaticContact ND1-CE3 3.95Å; H125-W319 AromaticContact ND1-CZ3 3.99Å; N233-W319 WeakPolarHBondContact CA-O 3.34Å; N233-W319 WeakPolarHBondContact CB-O 3.46Å; N233-W319 PolarHBondContact O-N 3.13Å; F235-W319 HydrophobicContact CD2-CB 4.01Å; F235-W319 HydrophobicContact CE2-CB 4Å; F235-W319 HydrophobicContact CE2-CE3 4.18Å; F235-W319 WeakPolarHBondContact CE2-O 3.34Å; F235-W319 HydrophobicContact CZ-CE3 4.41Å; E262-W319 PolarHBondContact O-NE1 2.89Å; Y317-W319 HydrophobicContact CD2-CB 4.12Å; Y317-W319 HydrophobicContact CE2-CB 3.96Å; W319-K323 HydrophobicContact CZ2-CB 4.02Å; W319-I324 HydrophobicContact CH2-CB 3.79Å; W319-I324 HydrophobicContact CH2-CG1 4.27Å
320	Q	93.3	Very high	92.3	Very high	95 Å²	95	57.8 Å²	57.8	44%	0.444	28%	0.282	S	S	.	.			trans	-90.4	118.4	-175.2	-175	-179.1	-8.2	0	0	109.8	S322 K323	Q320-S322 WeakPolarHBondContact CG-OG 3.39Å; Q320-S322 PolarHBondContact NE2-OG 3.12Å; Q320-S322 PolarHBondContact O-N 3.31Å; Q320-S322 VanDerWaalsContact O-N 3.12Å; Q320-K323 HydrophobicContact CB-CD 4.02Å; Q320-K323 HydrophobicContact CB-CG 4.12Å; Q320-K323 VanDerWaalsContact O-CB 3.28Å; Q320-K323 WeakPolarHBondContact O-CB 3.39Å; Q320-K323 WeakPolarHBondContact O-CG 3.14Å; Q320-K323 PolarHBondContact O-N 3.29Å
321	R	89.7	Confident	92.5	Very high	108 Å²	108	59.6 Å²	59.6	41%	0.408	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.1	-173.9	-62.6	-178.7	-172	-154.5	-7.3	114.5	H230 G232 F235 K323 I324	H230-R321 PolarHBondContact CE1-NH2 2.98Å; H230-R321 VanDerWaalsContact CE1-NH2 3.28Å; H230-R321 VanDerWaalsContact CG-NH2 3.28Å; H230-R321 PolarHBondContact ND1-NH2 3.3Å; H230-R321 VanDerWaalsContact ND1-NH2 3.11Å; H230-R321 PolarHBondContact NE2-NH2 3.32Å; G232-R321 PolarHBondContact O-NE 3.1Å; G232-R321 VanDerWaalsContact O-NE 3.1Å; G232-R321 PolarHBondContact O-NH2 3.28Å; F235-R321 HydrophobicContact CZ-CG 4.39Å; R321-K323 PolarHBondContact O-N 2.92Å; R321-K323 VanDerWaalsContact O-N 3.13Å; R321-I324 WeakPolarHBondContact O-CB 3.5Å; R321-I324 VanDerWaalsContact O-CG2 3.32Å; R321-I324 WeakPolarHBondContact O-CG2 3.33Å; R321-I324 PolarHBondContact O-N 3.11Å
322	S	89.8	Confident	92.7	Very high	72 Å²	72	59.1 Å²	59.1	50%	0.503	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-62.4	-18.6	177.7	61.3	0	0	0	0	113.3	Q320 I324 I325	Q320-S322 WeakPolarHBondContact CG-OG 3.39Å; Q320-S322 PolarHBondContact NE2-OG 3.12Å; Q320-S322 PolarHBondContact O-N 3.31Å; Q320-S322 VanDerWaalsContact O-N 3.12Å; S322-I324 PolarHBondContact O-N 3.42Å; S322-I325 WeakPolarHBondContact O-CG2 3.49Å
323	K	90.1	Very high	92.9	Very high	58 Å²	58	59.7 Å²	59.7	25%	0.252	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-72.5	-14.1	179.1	-63.4	179.7	174.6	-166.8	0	113.4	E263 W319 Q320 R321 I325 R326	E263-K323 HydrophobicContact CB-CD 4.23Å; E263-K323 WeakPolarHBondContact OE2-CD 3Å; E263-K323 WeakPolarHBondContact OE2-CE 3.3Å; E263-K323 IonicContact OE2-NZ 3.25Å; E263-K323 PolarHBondContact OE2-NZ 2.76Å; W319-K323 HydrophobicContact CZ2-CB 4.02Å; Q320-K323 HydrophobicContact CB-CD 4.02Å; Q320-K323 HydrophobicContact CB-CG 4.12Å; Q320-K323 VanDerWaalsContact O-CB 3.28Å; Q320-K323 WeakPolarHBondContact O-CB 3.39Å; Q320-K323 WeakPolarHBondContact O-CG 3.14Å; Q320-K323 PolarHBondContact O-N 3.29Å; R321-K323 PolarHBondContact O-N 2.92Å; R321-K323 VanDerWaalsContact O-N 3.13Å; K323-I325 PolarHBondContact O-N 3.21Å; K323-I325 VanDerWaalsContact O-N 3.16Å; K323-R326 VanDerWaalsContact O-CB 3.23Å; K323-R326 WeakPolarHBondContact O-CB 3.42Å; K323-R326 PolarHBondContact O-N 2.99Å; K323-R326 VanDerWaalsContact O-N 3.11Å
324	I	90.4	Very high	93.1	Very high	62 Å²	62	62.7 Å²	62.7	32%	0.318	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-57.3	-31.1	177.4	-157	165.7	0	0	0	112.7	W126 W319 R321 S322 R326 P328	W126-I324 HydrophobicContact CD2-CD1 4.39Å; W126-I324 HydrophobicContact CD2-CG1 4.4Å; W126-I324 HydrophobicContact CE3-CD1 4.39Å; W126-I324 HydrophobicContact CH2-CG1 4.05Å; W126-I324 HydrophobicContact CZ2-CG1 3.79Å; W126-I324 HydrophobicContact CZ3-CD1 4.48Å; W126-I324 HydrophobicContact CZ3-CG1 4.45Å; W319-I324 HydrophobicContact CH2-CB 3.79Å; W319-I324 HydrophobicContact CH2-CG1 4.27Å; R321-I324 WeakPolarHBondContact O-CB 3.5Å; R321-I324 VanDerWaalsContact O-CG2 3.32Å; R321-I324 WeakPolarHBondContact O-CG2 3.33Å; R321-I324 PolarHBondContact O-N 3.11Å; S322-I324 PolarHBondContact O-N 3.42Å; I324-R326 PolarHBondContact O-N 3.47Å; I324-P328 WeakPolarHBondContact O-CD 3.29Å
325	I	92.6	Very high	93.3	Very high	95 Å²	95	62.1 Å²	62.1	49%	0.487	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-72.7	-16.1	-177.2	-157.5	164.7	0	0	0	113.2	S322 K323 E327 P328 M329	S322-I325 WeakPolarHBondContact O-CG2 3.49Å; K323-I325 PolarHBondContact O-N 3.21Å; K323-I325 VanDerWaalsContact O-N 3.16Å; I325-E327 VanDerWaalsContact C-N 3.33Å; I325-E327 PolarHBondContact O-N 2.98Å; I325-P328 WeakPolarHBondContact O-CD 3.49Å; I325-M329 HydrophobicContact CD1-CE 3.89Å; I325-M329 HydrophobicContact CG1-CE 4.04Å; I325-M329 HydrophobicContact CG1-CG 4.28Å; I325-M329 HydrophobicContact CG1-SD 4.42Å; I325-M329 HydrophobicContact CG2-CE 4.21Å; I325-M329 HydrophobicContact CG2-SD 4.08Å; I325-M329 WeakPolarHBondContact O-CB 3.45Å; I325-M329 WeakPolarHBondContact O-CG 3.46Å; I325-M329 PolarHBondContact O-N 2.87Å
326	R	91.8	Very high	93.6	Very high	72 Å²	72	67.5 Å²	67.5	27%	0.272	36%	0.364	S	S	.	.	H	α-helix	trans	-59	-44.6	-178.3	-173.4	-161.9	-174.6	150.5	16.6	111.6	E262 E263 T292 K323 I324 M329 M330	E262-R326 IonicContact OE1-NH1 2.79Å; E262-R326 IonicContact OE2-CZ 2.64Å; E262-R326 IonicContact OE2-NE 3.81Å; E262-R326 IonicContact OE2-NH1 2.93Å; E262-R326 PolarHBondContact OE2-NH1 2.92Å; E263-R326 VanDerWaalsContact CD-NH1 3.28Å; E263-R326 IonicContact OE1-CZ 3.41Å; E263-R326 IonicContact OE1-NH1 2.76Å; E263-R326 PolarHBondContact OE1-NH1 3.42Å; E263-R326 IonicContact OE1-NH2 3.9Å; T292-R326 PolarHBondContact OG1-NH2 3Å; K323-R326 VanDerWaalsContact O-CB 3.23Å; K323-R326 WeakPolarHBondContact O-CB 3.42Å; K323-R326 PolarHBondContact O-N 2.99Å; K323-R326 VanDerWaalsContact O-N 3.11Å; I324-R326 PolarHBondContact O-N 3.47Å; R326-M329 WeakPolarHBondContact O-CB 3.39Å; R326-M329 PolarHBondContact O-N 3.44Å; R326-M330 HydrophobicContact CG-CE 4.07Å; R326-M330 HydrophobicContact CG-CG 4.49Å; R326-M330 HydrophobicContact CG-SD 4.43Å; R326-M330 WeakPolarHBondContact O-CG 3.32Å; R326-M330 PolarHBondContact O-N 2.73Å
327	E	91.7	Very high	93.8	Very high	36 Å²	36	67.3 Å²	67.3	17%	0.168	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-52.7	-177.8	-73	177	-155.7	0	0	112.2	W126 L290 I325 M329 M330 V331	W126-E327 HydrophobicContact CZ2-CB 4.3Å; W126-E327 PolarHBondContact NE1-OE2 2.73Å; L290-E327 HydrophobicContact CB-CG 4.18Å; L290-E327 HydrophobicContact CD1-CB 4.18Å; I325-E327 VanDerWaalsContact C-N 3.33Å; I325-E327 PolarHBondContact O-N 2.98Å; E327-M329 VanDerWaalsContact C-N 3.31Å; E327-M329 PolarHBondContact O-N 3.44Å; E327-M330 HydrophobicContact CB-CE 4.34Å; E327-M330 HydrophobicContact CG-CE 4Å; E327-M330 PolarHBondContact O-N 3.32Å; E327-V331 PolarHBondContact O-N 3Å
328	P	94.3	Very high	93.9	Very high	57 Å²	57	72.2 Å²	72.2	37%	0.37	40%	0.397	S	S	.	.	H	α-helix	trans	-58.7	-37.3	170.8	-26.2	32	0	0	0	114.2	W126 I324 I325 V331 S332	W126-P328 HydrophobicContact CH2-CG 3.78Å; W126-P328 HydrophobicContact CZ2-CG 4.11Å; I324-P328 WeakPolarHBondContact O-CD 3.29Å; I325-P328 WeakPolarHBondContact O-CD 3.49Å; P328-V331 PolarHBondContact O-N 2.9Å; P328-S332 WeakPolarHBondContact O-CB 3.23Å; P328-S332 PolarHBondContact O-N 3.41Å; P328-S332 PolarHBondContact O-OG 2.97Å
329	M	94.2	Very high	94	Very high	106 Å²	106	76.6 Å²	76.6	52%	0.522	41%	0.413	S	S	.	.	H	α-helix	trans	-65.2	-37.4	178.1	-79.4	-176.7	170.9	0	0	112	I325 R326 E327 V331 S332 V333	I325-M329 HydrophobicContact CD1-CE 3.89Å; I325-M329 HydrophobicContact CG1-CE 4.04Å; I325-M329 HydrophobicContact CG1-CG 4.28Å; I325-M329 HydrophobicContact CG1-SD 4.42Å; I325-M329 HydrophobicContact CG2-CE 4.21Å; I325-M329 HydrophobicContact CG2-SD 4.08Å; I325-M329 WeakPolarHBondContact O-CB 3.45Å; I325-M329 WeakPolarHBondContact O-CG 3.46Å; I325-M329 PolarHBondContact O-N 2.87Å; R326-M329 WeakPolarHBondContact O-CB 3.39Å; R326-M329 PolarHBondContact O-N 3.44Å; E327-M329 VanDerWaalsContact C-N 3.31Å; E327-M329 PolarHBondContact O-N 3.44Å; M329-V331 PolarHBondContact O-N 3.48Å; M329-S332 WeakPolarHBondContact O-CB 3.47Å; M329-S332 PolarHBondContact O-N 2.82Å; M329-V333 WeakPolarHBondContact O-CB 3.05Å; M329-V333 VanDerWaalsContact O-CG2 3.29Å; M329-V333 WeakPolarHBondContact O-CG2 3.18Å; M329-V333 PolarHBondContact O-N 3.22Å
330	M	93.3	Very high	94.1	Very high	46 Å²	46	81.6 Å²	81.6	23%	0.227	44%	0.436	C	S	.	.	H	α-helix	trans	-62	-44.1	176.9	-74.6	-175.9	-70	0	0	111.9	L290 T292 R326 E327 S332 V333 A334	L290-M330 HydrophobicContact CB-CE 4.22Å; L290-M330 WeakPolarHBondContact O-CE 3.42Å; T292-M330 HydrophobicContact CG2-SD 3.33Å; T292-M330 WeakPolarHBondContact CG2-SD 3.47Å; R326-M330 HydrophobicContact CG-CE 4.07Å; R326-M330 HydrophobicContact CG-CG 4.49Å; R326-M330 HydrophobicContact CG-SD 4.43Å; R326-M330 WeakPolarHBondContact O-CG 3.32Å; R326-M330 PolarHBondContact O-N 2.73Å; E327-M330 HydrophobicContact CB-CE 4.34Å; E327-M330 HydrophobicContact CG-CE 4Å; E327-M330 PolarHBondContact O-N 3.32Å; M330-S332 VanDerWaalsContact C-N 3.33Å; M330-V333 PolarHBondContact O-N 3.41Å; M330-A334 WeakPolarHBondContact O-CB 3.28Å; M330-A334 PolarHBondContact O-N 3.18Å
331	V	95.8	Very high	94.3	Very high	81 Å²	81	79.6 Å²	79.6	49%	0.491	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-42.4	174.7	-177.9	0	0	0	0	110.7	L290 E327 P328 M329 V333 A334 A335	L290-V331 HydrophobicContact CD1-CG2 4.45Å; L290-V331 HydrophobicContact CD2-CG2 3.74Å; E327-V331 PolarHBondContact O-N 3Å; P328-V331 PolarHBondContact O-N 2.9Å; M329-V331 PolarHBondContact O-N 3.48Å; V331-V333 PolarHBondContact O-N 3.49Å; V331-A334 PolarHBondContact O-N 2.71Å; V331-A335 PolarHBondContact O-N 2.78Å
332	S	96.5	Very high	94.6	Very high	74 Å²	74	78.5 Å²	78.5	52%	0.517	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-42.8	177.9	-57	0	0	0	0	112.5	P328 M329 M330 A335 L336	P328-S332 WeakPolarHBondContact O-CB 3.23Å; P328-S332 PolarHBondContact O-N 3.41Å; P328-S332 PolarHBondContact O-OG 2.97Å; M329-S332 WeakPolarHBondContact O-CB 3.47Å; M329-S332 PolarHBondContact O-N 2.82Å; M330-S332 VanDerWaalsContact C-N 3.33Å; S332-A335 PolarHBondContact O-N 3.04Å; S332-L336 WeakPolarHBondContact O-CB 3.44Å; S332-L336 PolarHBondContact O-N 2.97Å
333	V	96.1	Very high	94.8	Very high	89 Å²	89	79.4 Å²	79.4	54%	0.539	43%	0.432	S	S	.	.	H	α-helix	trans	-66.6	-42.4	177	170.4	0	0	0	0	110.8	M329 M330 V331 A335 L336 V337	M329-V333 WeakPolarHBondContact O-CB 3.05Å; M329-V333 VanDerWaalsContact O-CG2 3.29Å; M329-V333 WeakPolarHBondContact O-CG2 3.18Å; M329-V333 PolarHBondContact O-N 3.22Å; M330-V333 PolarHBondContact O-N 3.41Å; V331-V333 PolarHBondContact O-N 3.49Å; V333-A335 VanDerWaalsContact C-N 3.33Å; V333-A335 PolarHBondContact O-N 3.11Å; V333-L336 PolarHBondContact O-N 2.88Å; V333-V337 HydrophobicContact CG1-CG2 4.42Å; V333-V337 WeakPolarHBondContact O-CG2 3.39Å; V333-V337 PolarHBondContact O-N 3Å
334	A	95.7	Very high	95	Very high	64 Å²	64	79.4 Å²	79.4	53%	0.529	44%	0.437	S	S	.	.	H	α-helix	trans	-60	-43.5	175.9	0	0	0	0	0	111.7	M330 V331 V337 L338	M330-A334 WeakPolarHBondContact O-CB 3.28Å; M330-A334 PolarHBondContact O-N 3.18Å; V331-A334 PolarHBondContact O-N 2.71Å; A334-V337 PolarHBondContact O-N 2.64Å; A334-L338 PolarHBondContact O-N 3.12Å; A334-L338 VanDerWaalsContact O-N 3.11Å
335	A	97	Very high	95	Very high	40 Å²	40	80.4 Å²	80.4	33%	0.331	45%	0.448	S	S	.	.	H	α-helix	trans	-63.5	-42.7	174	0	0	0	0	0	112.1	V331 S332 V333 V337 L338 F339	V331-A335 PolarHBondContact O-N 2.78Å; S332-A335 PolarHBondContact O-N 3.04Å; V333-A335 VanDerWaalsContact C-N 3.33Å; V333-A335 PolarHBondContact O-N 3.11Å; A335-V337 PolarHBondContact O-N 3.16Å; A335-L338 WeakPolarHBondContact O-CB 3.36Å; A335-L338 PolarHBondContact O-N 3.06Å; A335-F339 WeakPolarHBondContact O-CD2 3.44Å; A335-F339 PolarHBondContact O-N 2.8Å
336	L	97.2	Very high	95	Very high	113 Å²	113	81.6 Å²	81.6	59%	0.592	46%	0.46	S	S	*	.	H	α-helix	trans	-61.1	-44.1	177.2	-169.6	161.6	0	0	0	111.4	S332 V333 L338 F339 F340	S332-L336 WeakPolarHBondContact O-CB 3.44Å; S332-L336 PolarHBondContact O-N 2.97Å; V333-L336 PolarHBondContact O-N 2.88Å; L336-L338 VanDerWaalsContact C-N 3.3Å; L336-L338 PolarHBondContact O-N 2.71Å; L336-F339 PolarHBondContact O-N 2.79Å; L336-F340 HydrophobicContact CD2-CB 4.47Å; L336-F340 WeakPolarHBondContact O-CB 3.37Å; L336-F340 PolarHBondContact O-N 3.21Å
337	V	96.9	Very high	94.8	Very high	83 Å²	83	88 Å²	88	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-40.3	176.2	171	0	0	0	0	111.2	V333 A334 A335 F340 S341	V333-V337 HydrophobicContact CG1-CG2 4.42Å; V333-V337 WeakPolarHBondContact O-CG2 3.39Å; V333-V337 PolarHBondContact O-N 3Å; A334-V337 PolarHBondContact O-N 2.64Å; A335-V337 PolarHBondContact O-N 3.16Å; V337-F340 PolarHBondContact O-N 3.21Å; V337-S341 WeakPolarHBondContact O-CB 3.31Å; V337-S341 PolarHBondContact O-N 2.89Å; V337-S341 PolarHBondContact O-OG 3.26Å
338	L	97.1	Very high	94.5	Very high	106 Å²	106	90.4 Å²	90.4	56%	0.555	50%	0.497	S	S	*	.	H	α-helix	trans	-60.4	-51.2	174.1	179.1	67.7	0	0	0	111.3	A334 A335 L336 F340 S341 I342	A334-L338 PolarHBondContact O-N 3.12Å; A334-L338 VanDerWaalsContact O-N 3.11Å; A335-L338 WeakPolarHBondContact O-CB 3.36Å; A335-L338 PolarHBondContact O-N 3.06Å; L336-L338 VanDerWaalsContact C-N 3.3Å; L336-L338 PolarHBondContact O-N 2.71Å; L338-F340 PolarHBondContact O-N 3.32Å; L338-S341 WeakPolarHBondContact O-CB 3.46Å; L338-S341 PolarHBondContact O-N 3.2Å; L338-I342 HydrophobicContact CG-CD1 4.31Å; L338-I342 WeakPolarHBondContact O-CG1 3.32Å; L338-I342 PolarHBondContact O-N 3Å
339	F	96.9	Very high	93.5	Very high	131 Å²	131	93.2 Å²	93.2	58%	0.575	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-40.5	178.4	-76.1	-66.4	0	0	0	112.7	A335 L336 S341 I342 I343	A335-F339 WeakPolarHBondContact O-CD2 3.44Å; A335-F339 PolarHBondContact O-N 2.8Å; L336-F339 PolarHBondContact O-N 2.79Å; F339-S341 VanDerWaalsContact C-N 3.33Å; F339-S341 PolarHBondContact O-N 3.4Å; F339-I342 PolarHBondContact O-N 3.35Å; F339-I343 VanDerWaalsContact O-CG1 3.32Å; F339-I343 WeakPolarHBondContact O-CG1 3.42Å; F339-I343 PolarHBondContact O-N 3.27Å
340	F	96.6	Very high	92.6	Very high	125 Å²	125	96.4 Å²	96.4	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-63.4	-40.8	176	-173.2	-97.2	0	0	0	111.3	L336 V337 L338 I342 I343 V344	L336-F340 HydrophobicContact CD2-CB 4.47Å; L336-F340 WeakPolarHBondContact O-CB 3.37Å; L336-F340 PolarHBondContact O-N 3.21Å; V337-F340 PolarHBondContact O-N 3.21Å; L338-F340 PolarHBondContact O-N 3.32Å; F340-I342 VanDerWaalsContact C-N 3.33Å; F340-I342 PolarHBondContact O-N 2.85Å; F340-I343 PolarHBondContact O-N 2.92Å; F340-V344 HydrophobicContact CD1-CG2 4.03Å; F340-V344 HydrophobicContact CE1-CG2 3.66Å; F340-V344 HydrophobicContact CZ-CG2 4.03Å; F340-V344 WeakPolarHBondContact O-CG2 3.47Å; F340-V344 PolarHBondContact O-N 3.2Å
341	S	96	Very high	91.5	Very high	54 Å²	54	96.9 Å²	96.9	38%	0.378	53%	0.528	S	S	.	.	H	α-helix	trans	-61.4	-42.5	175	-57.3	0	0	0	0	111.3	V337 L338 F339 V344 C345	V337-S341 WeakPolarHBondContact O-CB 3.31Å; V337-S341 PolarHBondContact O-N 2.89Å; V337-S341 PolarHBondContact O-OG 3.26Å; L338-S341 WeakPolarHBondContact O-CB 3.46Å; L338-S341 PolarHBondContact O-N 3.2Å; F339-S341 VanDerWaalsContact C-N 3.33Å; F339-S341 PolarHBondContact O-N 3.4Å; S341-V344 PolarHBondContact O-N 3.24Å; S341-C345 WeakPolarHBondContact O-CB 3.35Å; S341-C345 PolarHBondContact O-N 3.47Å; S341-C345 PolarHBondContact O-SG 2.9Å
342	I	95.8	Very high	90.2	Very high	84 Å²	84	101.3 Å²	101.3	43%	0.431	55%	0.548	S	S	.	.	H	α-helix	trans	-61.4	-46.5	173.9	-66.1	166.1	0	0	0	110.9	L338 F339 F340 V344 C345 V346	L338-I342 HydrophobicContact CG-CD1 4.31Å; L338-I342 WeakPolarHBondContact O-CG1 3.32Å; L338-I342 PolarHBondContact O-N 3Å; F339-I342 PolarHBondContact O-N 3.35Å; F340-I342 VanDerWaalsContact C-N 3.33Å; F340-I342 PolarHBondContact O-N 2.85Å; I342-V344 VanDerWaalsContact C-N 3.31Å; I342-V344 PolarHBondContact O-N 2.71Å; I342-C345 PolarHBondContact O-N 3.22Å; I342-V346 HydrophobicContact CG2-CG2 4.24Å; I342-V346 VanDerWaalsContact O-CG2 3.32Å; I342-V346 WeakPolarHBondContact O-CG2 3.36Å; I342-V346 PolarHBondContact O-N 2.96Å
343	I	94.8	Very high	88.8	Confident	92 Å²	92	100.8 Å²	100.8	47%	0.472	54%	0.544	S	S	.	.	H	α-helix	trans	-58.2	-45.3	177.6	-70.1	165.4	0	0	0	110.7	F339 F340 V346 R347	F339-I343 VanDerWaalsContact O-CG1 3.32Å; F339-I343 WeakPolarHBondContact O-CG1 3.42Å; F339-I343 PolarHBondContact O-N 3.27Å; F340-I343 PolarHBondContact O-N 2.92Å; I343-V346 PolarHBondContact O-N 3.23Å; I343-R347 HydrophobicContact CG2-CG 4.46Å; I343-R347 WeakPolarHBondContact O-CB 3.28Å; I343-R347 WeakPolarHBondContact O-CG 3.32Å; I343-R347 PolarHBondContact O-N 3.25Å
344	V	93.9	Very high	87.3	Confident	57 Å²	57	105 Å²	105	35%	0.345	56%	0.555	S	S	.	*	H	α-helix	trans	-61.6	-50.5	176.1	171.8	0	0	0	0	109.8	F340 S341 I342 V346 R347 L348	F340-V344 HydrophobicContact CD1-CG2 4.03Å; F340-V344 HydrophobicContact CE1-CG2 3.66Å; F340-V344 HydrophobicContact CZ-CG2 4.03Å; F340-V344 WeakPolarHBondContact O-CG2 3.47Å; F340-V344 PolarHBondContact O-N 3.2Å; S341-V344 PolarHBondContact O-N 3.24Å; I342-V344 VanDerWaalsContact C-N 3.31Å; I342-V344 PolarHBondContact O-N 2.71Å; V344-V346 VanDerWaalsContact C-N 3.33Å; V344-V346 PolarHBondContact O-N 3.49Å; V344-R347 CarbonylContact O-C 3.56Å; V344-R347 PolarHBondContact O-N 2.89Å; V344-L348 HydrophobicContact CG1-CD1 4Å; V344-L348 HydrophobicContact CG1-CG 4.2Å; V344-L348 VanDerWaalsContact O-CG 3.31Å; V344-L348 WeakPolarHBondContact O-CG 3.34Å; V344-L348 PolarHBondContact O-N 3.48Å
345	C	91.7	Very high	86	Confident	83 Å²	83	103.9 Å²	103.9	56%	0.561	55%	0.55	S	S	*	.	H	α-helix	trans	-57.1	-41.4	179	-72.2	0	0	0	0	113.4	S341 I342 R347 L348	S341-C345 WeakPolarHBondContact O-CB 3.35Å; S341-C345 PolarHBondContact O-N 3.47Å; S341-C345 PolarHBondContact O-SG 2.9Å; I342-C345 PolarHBondContact O-N 3.22Å; C345-R347 VanDerWaalsContact C-N 3.3Å; C345-R347 PolarHBondContact O-N 3.46Å; C345-L348 PolarHBondContact O-N 2.8Å
346	V	91	Very high	84.8	Confident	121 Å²	121	107.7 Å²	107.7	73%	0.733	56%	0.561	S	S	*	*	H	α-helix	trans	-72.4	-24.8	178.2	176.3	0	0	0	0	112.1	I342 I343 V344	I342-V346 HydrophobicContact CG2-CG2 4.24Å; I342-V346 VanDerWaalsContact O-CG2 3.32Å; I342-V346 WeakPolarHBondContact O-CG2 3.36Å; I342-V346 PolarHBondContact O-N 2.96Å; I343-V346 PolarHBondContact O-N 3.23Å; V344-V346 VanDerWaalsContact C-N 3.33Å; V344-V346 PolarHBondContact O-N 3.49Å
347	R	88.8	Confident	83.6	Confident	206 Å²	206	106.2 Å²	106.2	78%	0.777	55%	0.553	S	S	*	*	H	α-helix	trans	-87.9	-14.8	176.6	-70.9	-81.7	177.6	85.4	-1.2	113.4	I343 V344 C345 D349	I343-R347 HydrophobicContact CG2-CG 4.46Å; I343-R347 WeakPolarHBondContact O-CB 3.28Å; I343-R347 WeakPolarHBondContact O-CG 3.32Å; I343-R347 PolarHBondContact O-N 3.25Å; V344-R347 CarbonylContact O-C 3.56Å; V344-R347 PolarHBondContact O-N 2.89Å; C345-R347 VanDerWaalsContact C-N 3.3Å; C345-R347 PolarHBondContact O-N 3.46Å; R347-D349 PolarHBondContact O-N 3.25Å
348	L	85.8	Confident	82.8	Confident	86 Å²	86	108.5 Å²	108.5	45%	0.45	56%	0.556	S	S	.	*	S	Bend	trans	-79.7	96.3	174.3	-69.6	175.1	0	0	0	109	V344 C345 F350	V344-L348 HydrophobicContact CG1-CD1 4Å; V344-L348 HydrophobicContact CG1-CG 4.2Å; V344-L348 VanDerWaalsContact O-CG 3.31Å; V344-L348 WeakPolarHBondContact O-CG 3.34Å; V344-L348 PolarHBondContact O-N 3.48Å; C345-L348 PolarHBondContact O-N 2.8Å; L348-F350 HydrophobicContact CB-CD2 4.17Å; L348-F350 HydrophobicContact CB-CE1 4.49Å; L348-F350 HydrophobicContact CB-CE2 3.57Å; L348-F350 HydrophobicContact CB-CZ 3.76Å; L348-F350 HydrophobicContact CD1-CE2 4.11Å; L348-F350 HydrophobicContact CD1-CZ 3.79Å; L348-F350 HydrophobicContact CG-CE2 4.49Å; L348-F350 HydrophobicContact CG-CZ 4.34Å; L348-F350 WeakPolarHBondContact O-CD2 3.33Å; L348-F350 PolarHBondContact O-N 2.89Å
349	D	73.3	Confident	82	Confident	117 Å²	117	104.6 Å²	104.6	63%	0.626	54%	0.536	S	S	*	.			trans	-68.5	99.4	171.9	-109.3	-32.1	0	0	0	109.9	R347 L357	R347-D349 PolarHBondContact O-N 3.25Å; D349-L357 WeakPolarHBondContact OD2-CD1 3.23Å
350	F	74.5	Confident	81.2	Confident	173 Å²	173	102.1 Å²	102.1	76%	0.759	53%	0.528	S	S	*	.			trans	-88.8	17.7	169.5	-63.1	-65.2	0	0	0	112.3	L348	L348-F350 HydrophobicContact CB-CD2 4.17Å; L348-F350 HydrophobicContact CB-CE1 4.49Å; L348-F350 HydrophobicContact CB-CE2 3.57Å; L348-F350 HydrophobicContact CB-CZ 3.76Å; L348-F350 HydrophobicContact CD1-CE2 4.11Å; L348-F350 HydrophobicContact CD1-CZ 3.79Å; L348-F350 HydrophobicContact CG-CE2 4.49Å; L348-F350 HydrophobicContact CG-CZ 4.34Å; L348-F350 WeakPolarHBondContact O-CD2 3.33Å; L348-F350 PolarHBondContact O-N 2.89Å
351	S	70	Confident	80.7	Confident	55 Å²	55	102.5 Å²	102.5	39%	0.385	53%	0.532	S	S	.	.			trans	-74.4	126.3	179.3	-176.8	0	0	0	0	111.9	S353	S351-S353 PolarHBondContact OG-O 3.19Å
352	I	68	Low	80.2	Confident	174 Å²	174	100.6 Å²	100.6	89%	0.892	52%	0.518	S	S	*	.	S	Bend	trans	-76.7	-26.7	-179.6	-61.2	171.8	0	0	0	111.1
353	S	67	Low	79.7	Confident	64 Å²	64	97.1 Å²	97.1	45%	0.448	50%	0.5	S	S	.	.			trans	-118	103.3	-177.2	58.4	0	0	0	0	112.4	S351 G355	S351-S353 PolarHBondContact OG-O 3.19Å; S353-G355 PolarHBondContact O-N 3.17Å
354	K	65.5	Low	79.3	Confident	177 Å²	177	98.1 Å²	98.1	77%	0.77	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-5.8	175.6	-66.5	-174.6	177.7	-177.4	0	115.2
355	G	67.6	Low	79.1	Confident	40 Å²	40	97.4 Å²	97.4	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-68.6	-36.9	-177.4	0	0	0	0	0	113.7	S353 L359	S353-G355 PolarHBondContact O-N 3.17Å; G355-L359 PolarHBondContact O-N 3.5Å
356	Q	72	Confident	78.9	Confident	120 Å²	120	93.5 Å²	93.5	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-68.4	-43	-178.2	-77.7	174.6	-38.4	0	0	112.2	K358 L359 D360	Q356-K358 VanDerWaalsContact C-N 3.31Å; Q356-K358 PolarHBondContact O-N 2.87Å; Q356-L359 CarbonylContact O-C 3.59Å; Q356-L359 WeakPolarHBondContact O-CA 3.25Å; Q356-L359 VanDerWaalsContact O-CB 3.24Å; Q356-L359 WeakPolarHBondContact O-CB 3.45Å; Q356-L359 PolarHBondContact O-N 3.44Å; Q356-D360 VanDerWaalsContact O-CG 3.28Å; Q356-D360 PolarHBondContact O-N 3.12Å
357	L	73.2	Confident	78.8	Confident	83 Å²	83	89.4 Å²	89.4	44%	0.435	45%	0.454	S	S	.	.	H	α-helix	trans	-56	-43.3	177.2	-88.7	151.4	0	0	0	113.5	D349 L359 D360 E361	D349-L357 WeakPolarHBondContact OD2-CD1 3.23Å; L357-L359 VanDerWaalsContact C-N 3.3Å; L357-D360 PolarHBondContact O-N 3.26Å; L357-E361 WeakPolarHBondContact O-CB 3.48Å; L357-E361 PolarHBondContact O-N 3.13Å
358	K	79.5	Confident	78.8	Confident	130 Å²	130	85.5 Å²	85.5	57%	0.565	45%	0.445	S	S	*	.	H	α-helix	trans	-71.2	-28.4	176.3	-70.9	-171.4	177.6	-176	0	112.7	Q356 L362 I424	Q356-K358 VanDerWaalsContact C-N 3.31Å; Q356-K358 PolarHBondContact O-N 2.87Å; K358-L362 WeakPolarHBondContact O-CB 3.39Å; K358-L362 WeakPolarHBondContact O-CD1 3.2Å; K358-L362 VanDerWaalsContact O-CG 3.23Å; K358-L362 WeakPolarHBondContact O-CG 3.33Å; K358-L362 PolarHBondContact O-N 3.38Å; K358-I424 HydrophobicContact CB-CD1 3.66Å; K358-I424 HydrophobicContact CD-CD1 4.45Å
359	L	80.6	Confident	79	Confident	25 Å²	25	81.9 Å²	81.9	13%	0.131	43%	0.426	C	S	.	.	H	α-helix	trans	-65.2	-54.3	173.6	-177.5	64.8	0	0	0	108.3	G355 Q356 L357 E361 L362 T363 L421 C425 A428 I479	G355-L359 PolarHBondContact O-N 3.5Å; Q356-L359 CarbonylContact O-C 3.59Å; Q356-L359 WeakPolarHBondContact O-CA 3.25Å; Q356-L359 VanDerWaalsContact O-CB 3.24Å; Q356-L359 WeakPolarHBondContact O-CB 3.45Å; Q356-L359 PolarHBondContact O-N 3.44Å; L357-L359 VanDerWaalsContact C-N 3.3Å; L359-E361 PolarHBondContact O-N 2.9Å; L359-L362 PolarHBondContact O-N 3.43Å; L359-L362 VanDerWaalsContact O-N 3.15Å; L359-T363 PolarHBondContact O-N 2.9Å; L359-T363 PolarHBondContact O-OG1 3.49Å; L359-L421 HydrophobicContact CD1-CD1 3.41Å; L359-L421 VanDerWaalsContact CD1-CD1 3.41Å; L359-L421 HydrophobicContact CD1-CG 4.48Å; L359-C425 HydrophobicContact CD1-CB 4.02Å; L359-A428 HydrophobicContact CD1-CB 4.14Å; L359-I479 HydrophobicContact CD1-CG2 4.06Å; L359-I479 HydrophobicContact CD2-CG2 4.4Å; L359-I479 HydrophobicContact CG-CG2 4.26Å
360	D	80.6	Confident	79.6	Confident	78 Å²	78	76.5 Å²	76.5	42%	0.417	40%	0.397	S	S	.	.	H	α-helix	trans	-56.2	-50.1	-179.1	-62.3	-13.9	0	0	0	111.7	Q356 L357 L362 T363 D364	Q356-D360 VanDerWaalsContact O-CG 3.28Å; Q356-D360 PolarHBondContact O-N 3.12Å; L357-D360 PolarHBondContact O-N 3.26Å; D360-L362 VanDerWaalsContact C-N 3.3Å; D360-L362 PolarHBondContact O-N 2.91Å; D360-T363 VanDerWaalsContact CA-OG1 3.26Å; D360-T363 WeakPolarHBondContact CA-OG1 3.5Å; D360-T363 PolarHBondContact O-N 3.19Å; D360-T363 VanDerWaalsContact O-N 3.11Å; D360-T363 PolarHBondContact O-OG1 3.43Å; D360-D364 PolarHBondContact O-N 3.11Å
361	E	85.3	Confident	80.2	Confident	133 Å²	133	71.5 Å²	71.5	62%	0.621	38%	0.378	S	S	*	.	H	α-helix	trans	-57.8	-39.5	178.4	-175.7	-177.1	-175.9	0	0	112.8	L357 L359 S365	L357-E361 WeakPolarHBondContact O-CB 3.48Å; L357-E361 PolarHBondContact O-N 3.13Å; L359-E361 PolarHBondContact O-N 2.9Å; E361-S365 WeakPolarHBondContact O-CB 3.34Å; E361-S365 PolarHBondContact O-N 3.18Å; E361-S365 VanDerWaalsContact O-N 3.1Å; E361-S365 PolarHBondContact O-OG 2.91Å
362	L	86	Confident	81.1	Confident	15 Å²	15	73 Å²	73	8%	0.079	38%	0.379	C	S	.	.	H	α-helix	trans	-72.3	-40.2	177	-72.7	172.7	0	0	0	111.6	K358 L359 D360 S365 I366 L417 Q420 L421 I424	K358-L362 WeakPolarHBondContact O-CB 3.39Å; K358-L362 WeakPolarHBondContact O-CD1 3.2Å; K358-L362 VanDerWaalsContact O-CG 3.23Å; K358-L362 WeakPolarHBondContact O-CG 3.33Å; K358-L362 PolarHBondContact O-N 3.38Å; L359-L362 PolarHBondContact O-N 3.43Å; L359-L362 VanDerWaalsContact O-N 3.15Å; D360-L362 VanDerWaalsContact C-N 3.3Å; D360-L362 PolarHBondContact O-N 2.91Å; L362-S365 PolarHBondContact O-N 3.09Å; L362-I366 WeakPolarHBondContact O-CB 3.43Å; L362-I366 WeakPolarHBondContact O-CD1 3.27Å; L362-I366 WeakPolarHBondContact O-CG1 3.38Å; L362-I366 PolarHBondContact O-N 2.86Å; L362-L417 HydrophobicContact CD2-CD2 3.81Å; L362-Q420 HydrophobicContact CD1-CB 4.11Å; L362-Q420 HydrophobicContact CD2-CB 4.14Å; L362-L421 HydrophobicContact CB-CD1 4.01Å; L362-L421 HydrophobicContact CD1-CB 4.46Å; L362-L421 HydrophobicContact CD1-CD1 4.13Å; L362-I424 HydrophobicContact CD1-CD1 3.68Å
363	T	84.5	Confident	82	Confident	10 Å²	10	65.2 Å²	65.2	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-62.9	-42.1	174.8	11.4	0	0	0	0	112.1	L359 D360 I366 S367 L476 I479	L359-T363 PolarHBondContact O-N 2.9Å; L359-T363 PolarHBondContact O-OG1 3.49Å; D360-T363 VanDerWaalsContact CA-OG1 3.26Å; D360-T363 WeakPolarHBondContact CA-OG1 3.5Å; D360-T363 PolarHBondContact O-N 3.19Å; D360-T363 VanDerWaalsContact O-N 3.11Å; D360-T363 PolarHBondContact O-OG1 3.43Å; T363-I366 PolarHBondContact O-N 3.28Å; T363-S367 PolarHBondContact O-N 3Å; T363-L476 HydrophobicContact CG2-CD2 4.06Å; T363-I479 HydrophobicContact CG2-CB 3.87Å; T363-I479 HydrophobicContact CG2-CD1 4Å; T363-I479 HydrophobicContact CG2-CG2 3.6Å
364	D	86.7	Confident	82.9	Confident	114 Å²	114	62.9 Å²	62.9	61%	0.61	32%	0.322	S	S	*	.	H	α-helix	trans	-63.1	-46	176.9	-76.5	-10.5	0	0	0	111.2	D360 I366 S367 E368	D360-D364 PolarHBondContact O-N 3.11Å; D364-I366 VanDerWaalsContact C-N 3.29Å; D364-I366 PolarHBondContact O-N 3.36Å; D364-S367 WeakPolarHBondContact O-CB 3.46Å; D364-S367 PolarHBondContact O-N 2.96Å; D364-S367 VanDerWaalsContact O-N 3.1Å; D364-E368 PolarHBondContact O-N 3.1Å
365	S	89.8	Confident	84	Confident	42 Å²	42	57.8 Å²	57.8	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-37.8	175.5	-60.3	0	0	0	0	112.2	E361 L362 L369	E361-S365 WeakPolarHBondContact O-CB 3.34Å; E361-S365 PolarHBondContact O-N 3.18Å; E361-S365 VanDerWaalsContact O-N 3.1Å; E361-S365 PolarHBondContact O-OG 2.91Å; L362-S365 PolarHBondContact O-N 3.09Å; S365-L369 WeakPolarHBondContact O-CG 3.42Å; S365-L369 PolarHBondContact O-N 2.98Å
366	I	87.6	Confident	85	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-37.8	175.2	-71.1	162.9	0	0	0	110.9	L362 T363 D364 L369 H370 L417 L421 V432 L476	L362-I366 WeakPolarHBondContact O-CB 3.43Å; L362-I366 WeakPolarHBondContact O-CD1 3.27Å; L362-I366 WeakPolarHBondContact O-CG1 3.38Å; L362-I366 PolarHBondContact O-N 2.86Å; T363-I366 PolarHBondContact O-N 3.28Å; D364-I366 VanDerWaalsContact C-N 3.29Å; D364-I366 PolarHBondContact O-N 3.36Å; I366-L369 PolarHBondContact O-N 3.17Å; I366-H370 PolarHBondContact O-CD2 3.16Å; I366-H370 PolarHBondContact O-N 3.47Å; I366-L417 HydrophobicContact CD1-CB 4.1Å; I366-L417 HydrophobicContact CG1-CB 3.8Å; I366-L417 HydrophobicContact CG1-CD1 3.84Å; I366-L421 HydrophobicContact CD1-CD2 4.03Å; I366-V432 HydrophobicContact CD1-CG1 4.14Å; I366-V432 HydrophobicContact CD1-CG2 4.06Å; I366-V432 HydrophobicContact CG2-CG1 4.01Å; I366-V432 HydrophobicContact CG2-CG2 4.39Å; I366-L476 HydrophobicContact CB-CD2 4.41Å; I366-L476 HydrophobicContact CG2-CD2 3.84Å
367	S	87.6	Confident	85.7	Confident	35 Å²	35	50.5 Å²	50.5	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-48.7	175.6	-164.4	0	0	0	0	111.1	T363 D364 L369 H370 D371	T363-S367 PolarHBondContact O-N 3Å; D364-S367 WeakPolarHBondContact O-CB 3.46Å; D364-S367 PolarHBondContact O-N 2.96Å; D364-S367 VanDerWaalsContact O-N 3.1Å; S367-L369 VanDerWaalsContact C-N 3.29Å; S367-L369 PolarHBondContact O-N 2.92Å; S367-H370 WeakPolarHBondContact O-CA 3.38Å; S367-H370 WeakPolarHBondContact O-CB 3.38Å; S367-H370 PolarHBondContact O-N 3.3Å; S367-D371 PolarHBondContact O-N 3.45Å
368	E	90	Very high	86.3	Confident	125 Å²	125	50 Å²	50	58%	0.584	26%	0.257	S	S	*	.	H	α-helix	trans	-60	-39.1	179.2	-168.6	178.7	-179.5	0	0	112	D364 H370 D371 Q372	D364-E368 PolarHBondContact O-N 3.1Å; E368-H370 VanDerWaalsContact C-N 3.34Å; E368-H370 PolarHBondContact O-N 3.22Å; E368-D371 PolarHBondContact O-N 2.84Å; E368-Q372 WeakPolarHBondContact O-CG 3.27Å; E368-Q372 PolarHBondContact O-N 2.92Å
369	L	89.6	Confident	86.6	Confident	10 Å²	10	47.4 Å²	47.4	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-70.1	-29.7	175.4	-66.1	174	0	0	0	113.3	S365 I366 S367 R373 Q413 I414 L417	S365-L369 WeakPolarHBondContact O-CG 3.42Å; S365-L369 PolarHBondContact O-N 2.98Å; I366-L369 PolarHBondContact O-N 3.17Å; S367-L369 VanDerWaalsContact C-N 3.29Å; S367-L369 PolarHBondContact O-N 2.92Å; L369-R373 WeakPolarHBondContact O-CG 3.3Å; L369-R373 PolarHBondContact O-N 3.42Å; L369-R373 VanDerWaalsContact O-N 3.09Å; L369-Q413 HydrophobicContact CD1-CB 3.61Å; L369-Q413 HydrophobicContact CD2-CB 4.2Å; L369-I414 HydrophobicContact CB-CD1 3.77Å; L369-I414 HydrophobicContact CB-CG1 3.54Å; L369-I414 HydrophobicContact CD1-CG1 3.71Å; L369-I414 HydrophobicContact CG-CG1 4.29Å; L369-L417 HydrophobicContact CD1-CD1 3.6Å
370	H	86.1	Confident	86.8	Confident	4 Å²	4	47 Å²	47	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-70.4	-37.6	172.1	-93.5	-74.4	0	0	0	111.7	I366 S367 E368 R373 T374 L435 N472	I366-H370 PolarHBondContact O-CD2 3.16Å; I366-H370 PolarHBondContact O-N 3.47Å; S367-H370 WeakPolarHBondContact O-CA 3.38Å; S367-H370 WeakPolarHBondContact O-CB 3.38Å; S367-H370 PolarHBondContact O-N 3.3Å; E368-H370 VanDerWaalsContact C-N 3.34Å; E368-H370 PolarHBondContact O-N 3.22Å; H370-R373 WeakPolarHBondContact O-CB 3.47Å; H370-R373 PolarHBondContact O-N 2.95Å; H370-T374 PolarHBondContact O-N 2.89Å; H370-T374 PolarHBondContact O-OG1 3.4Å; H370-L435 VanDerWaalsContact NE2-CD1 3.32Å; H370-L435 WeakPolarHBondContact NE2-CD1 3.44Å; H370-N472 PolarHBondContact ND1-ND2 3.05Å
371	D	87.3	Confident	87	Confident	68 Å²	68	43.2 Å²	43.2	36%	0.364	22%	0.223	S	C	.	.	H	α-helix	trans	-63.3	-43.5	172.6	-69	-22.1	0	0	0	111	S367 E368 R373 T374 V375	S367-D371 PolarHBondContact O-N 3.45Å; E368-D371 PolarHBondContact O-N 2.84Å; D371-R373 VanDerWaalsContact C-N 3.31Å; D371-R373 PolarHBondContact O-N 3.36Å; D371-T374 WeakPolarHBondContact O-CB 3.38Å; D371-T374 PolarHBondContact O-N 2.92Å; D371-T374 VanDerWaalsContact O-N 3.09Å; D371-V375 WeakPolarHBondContact O-CG2 3.34Å; D371-V375 PolarHBondContact O-N 3.33Å
372	Q	89	Confident	87	Confident	85 Å²	85	40 Å²	40	40%	0.397	21%	0.21	S	C	.	.	H	α-helix	trans	-58.1	-40.3	173	-70.7	176.3	12.7	0	0	112.7	E368 V375 A376 S410	E368-Q372 WeakPolarHBondContact O-CG 3.27Å; E368-Q372 PolarHBondContact O-N 2.92Å; Q372-V375 PolarHBondContact O-N 3.48Å; Q372-A376 WeakPolarHBondContact O-CB 3.35Å; Q372-A376 PolarHBondContact O-N 3.26Å; Q372-S410 PolarHBondContact OE1-OG 2.89Å
373	R	86.9	Confident	87	Confident	12 Å²	12	39.8 Å²	39.8	5%	0.045	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-39.2	174.8	-78.8	167.9	56.6	178	-14.7	112.2	L369 H370 D371 A376 C377 I414 K436	L369-R373 WeakPolarHBondContact O-CG 3.3Å; L369-R373 PolarHBondContact O-N 3.42Å; L369-R373 VanDerWaalsContact O-N 3.09Å; H370-R373 WeakPolarHBondContact O-CB 3.47Å; H370-R373 PolarHBondContact O-N 2.95Å; D371-R373 VanDerWaalsContact C-N 3.31Å; D371-R373 PolarHBondContact O-N 3.36Å; R373-A376 PolarHBondContact O-N 3.46Å; R373-C377 PolarHBondContact O-N 3.24Å; R373-C377 VanDerWaalsContact O-N 3.08Å; R373-C377 PolarHBondContact O-SG 3.16Å; R373-C377 VanDerWaalsContact O-SG 3.42Å; R373-I414 VanDerWaalsContact NH1-CD1 3.32Å; R373-K436 VanDerWaalsContact NH2-C 3.31Å
374	T	86.3	Confident	86.8	Confident	15 Å²	15	39.4 Å²	39.4	9%	0.092	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-48.4	177.5	-56.7	0	0	0	0	110.1	H370 D371 A376 C377 E378 I465 M469	H370-T374 PolarHBondContact O-N 2.89Å; H370-T374 PolarHBondContact O-OG1 3.4Å; D371-T374 WeakPolarHBondContact O-CB 3.38Å; D371-T374 PolarHBondContact O-N 2.92Å; D371-T374 VanDerWaalsContact O-N 3.09Å; T374-A376 VanDerWaalsContact C-N 3.34Å; T374-A376 PolarHBondContact O-N 2.93Å; T374-C377 WeakPolarHBondContact O-CB 3.44Å; T374-C377 PolarHBondContact O-N 2.85Å; T374-C377 VanDerWaalsContact O-N 3.1Å; T374-E378 WeakPolarHBondContact O-CG 3.31Å; T374-E378 PolarHBondContact O-N 2.93Å; T374-I465 HydrophobicContact CG2-CG2 3.67Å; T374-M469 HydrophobicContact CG2-CB 4.49Å; T374-M469 HydrophobicContact CG2-CG 4.45Å; T374-M469 HydrophobicContact CG2-SD 3.96Å
375	V	88.7	Confident	86.6	Confident	69 Å²	69	38.5 Å²	38.5	42%	0.418	20%	0.2	S	C	.	.	H	α-helix	trans	-58.7	-43.1	175.9	172.7	0	0	0	0	111.7	D371 Q372 C377 E378 Q379	D371-V375 WeakPolarHBondContact O-CG2 3.34Å; D371-V375 PolarHBondContact O-N 3.33Å; Q372-V375 PolarHBondContact O-N 3.48Å; V375-C377 VanDerWaalsContact C-N 3.33Å; V375-C377 PolarHBondContact O-N 3.19Å; V375-E378 PolarHBondContact O-N 3.2Å; V375-Q379 HydrophobicContact CG1-CG 4.49Å; V375-Q379 WeakPolarHBondContact O-CG 3.49Å; V375-Q379 PolarHBondContact O-N 3.4Å
376	A	87.8	Confident	86.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-37.7	176.8	0	0	0	0	0	112.6	Q372 R373 T374 W380 E406 L407	Q372-A376 WeakPolarHBondContact O-CB 3.35Å; Q372-A376 PolarHBondContact O-N 3.26Å; R373-A376 PolarHBondContact O-N 3.46Å; T374-A376 VanDerWaalsContact C-N 3.34Å; T374-A376 PolarHBondContact O-N 2.93Å; A376-W380 PolarHBondContact O-N 3.28Å; A376-E406 HydrophobicContact CB-CB 3.97Å; A376-L407 HydrophobicContact CB-CD1 3.96Å
377	C	85.7	Confident	86.2	Confident	7 Å²	7	46.1 Å²	46.1	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-38.9	174.6	-75.3	0	0	0	0	112.6	R373 T374 V375 W380 A381 F461 I465	R373-C377 PolarHBondContact O-N 3.24Å; R373-C377 VanDerWaalsContact O-N 3.08Å; R373-C377 PolarHBondContact O-SG 3.16Å; R373-C377 VanDerWaalsContact O-SG 3.42Å; T374-C377 WeakPolarHBondContact O-CB 3.44Å; T374-C377 PolarHBondContact O-N 2.85Å; T374-C377 VanDerWaalsContact O-N 3.1Å; V375-C377 VanDerWaalsContact C-N 3.33Å; V375-C377 PolarHBondContact O-N 3.19Å; C377-W380 WeakPolarHBondContact O-CB 3.25Å; C377-W380 PolarHBondContact O-N 2.9Å; C377-A381 PolarHBondContact O-N 3.02Å; C377-F461 HydrophobicContact CB-CE1 4.49Å; C377-F461 HydrophobicContact CB-CZ 4.31Å; C377-I465 HydrophobicContact CB-CD1 3.57Å; C377-I465 HydrophobicContact CB-CG1 3.83Å
378	E	86.1	Confident	85.7	Confident	74 Å²	74	45.6 Å²	45.6	35%	0.346	22%	0.223	S	C	.	.	H	α-helix	trans	-66.3	-44.2	175.6	-72	-176.5	156.7	0	0	111.9	T374 V375 W380 A381 D382 I465	T374-E378 WeakPolarHBondContact O-CG 3.31Å; T374-E378 PolarHBondContact O-N 2.93Å; V375-E378 PolarHBondContact O-N 3.2Å; E378-W380 PolarHBondContact O-N 2.79Å; E378-A381 WeakPolarHBondContact O-CB 3.44Å; E378-A381 PolarHBondContact O-N 3.2Å; E378-D382 PolarHBondContact O-N 2.67Å; E378-I465 HydrophobicContact CG-CG2 4.36Å
379	Q	86.9	Confident	85.3	Confident	75 Å²	75	44.5 Å²	44.5	35%	0.35	23%	0.225	S	C	.	.	H	α-helix	trans	-57.4	-36	173.2	-73.1	-179	29.8	0	0	111.8	V375 A383	V375-Q379 HydrophobicContact CG1-CG 4.49Å; V375-Q379 WeakPolarHBondContact O-CG 3.49Å; V375-Q379 PolarHBondContact O-N 3.4Å; Q379-A383 WeakPolarHBondContact O-CB 3.46Å; Q379-A383 PolarHBondContact O-N 3.42Å; Q379-A383 VanDerWaalsContact O-N 3.08Å
380	W	85.3	Confident	85	Confident	15 Å²	15	47.3 Å²	47.3	6%	0.057	25%	0.245	C	C	.	.	H	α-helix	trans	-69.2	-42.7	173.6	176.1	-119.9	0	0	0	112.6	A376 C377 E378 A383 I384 L396 R400 A403 F439 F461	A376-W380 PolarHBondContact O-N 3.28Å; C377-W380 WeakPolarHBondContact O-CB 3.25Å; C377-W380 PolarHBondContact O-N 2.9Å; E378-W380 PolarHBondContact O-N 2.79Å; W380-A383 HydrophobicContact CE3-CB 4.26Å; W380-A383 PolarHBondContact O-N 3.43Å; W380-I384 HydrophobicContact CD2-CD1 4.32Å; W380-I384 HydrophobicContact CD2-CG1 4.41Å; W380-I384 HydrophobicContact CH2-CG1 4.34Å; W380-I384 HydrophobicContact CZ2-CD1 3.96Å; W380-I384 HydrophobicContact CZ2-CG1 4.02Å; W380-I384 WeakPolarHBondContact O-CG1 3.32Å; W380-I384 PolarHBondContact O-N 3.5Å; W380-I384 VanDerWaalsContact O-N 3.08Å; W380-L396 HydrophobicContact CE3-CD1 4.5Å; W380-L396 HydrophobicContact CH2-CD1 3.67Å; W380-L396 HydrophobicContact CH2-CG 3.93Å; W380-L396 HydrophobicContact CZ3-CD1 3.54Å; W380-L396 HydrophobicContact CZ3-CG 4.02Å; W380-L396 WeakPolarHBondContact CZ3-O 3.37Å; W380-R400 HydrophobicContact CE3-CB 3.95Å; W380-R400 HydrophobicContact CE3-CG 4.36Å; W380-R400 HydrophobicContact CH2-CB 3.58Å; W380-R400 HydrophobicContact CH2-CG 3.72Å; W380-R400 HydrophobicContact CZ2-CB 4.45Å; W380-R400 HydrophobicContact CZ2-CG 4.14Å; W380-R400 HydrophobicContact CZ3-CB 3.3Å; W380-R400 HydrophobicContact CZ3-CG 3.86Å; W380-A403 HydrophobicContact CB-CB 3.91Å; W380-F439 AromaticContact CD1-CE2 3.98Å; W380-F439 HydrophobicContact CD2-CZ 4.41Å; W380-F439 HydrophobicContact CG-CE2 4.09Å; W380-F439 HydrophobicContact CG-CZ 4.44Å; W380-F461 AromaticContact CD1-CE1 3.71Å; W380-F461 AromaticContact CD1-CZ 3.98Å
381	A	83.7	Confident	84.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-44	175.4	0	0	0	0	0	111.7	C377 E378 A383 I384 E385 F461 R462	C377-A381 PolarHBondContact O-N 3.02Å; E378-A381 WeakPolarHBondContact O-CB 3.44Å; E378-A381 PolarHBondContact O-N 3.2Å; A381-A383 VanDerWaalsContact C-N 3.31Å; A381-A383 PolarHBondContact O-N 2.95Å; A381-I384 WeakPolarHBondContact O-CB 3.16Å; A381-I384 PolarHBondContact O-N 3.05Å; A381-E385 PolarHBondContact O-N 3.32Å; A381-F461 HydrophobicContact CB-CD1 3.95Å; A381-F461 HydrophobicContact CB-CE1 4.26Å; A381-R462 HydrophobicContact CB-CG 4.06Å
382	D	86	Confident	84.7	Confident	64 Å²	64	55.2 Å²	55.2	34%	0.342	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-37.8	175.4	-70.9	-7.1	0	0	0	111.9	E378 E385 K386 R462	E378-D382 PolarHBondContact O-N 2.67Å; D382-E385 PolarHBondContact O-N 3.48Å; D382-K386 WeakPolarHBondContact O-CB 3.41Å; D382-K386 WeakPolarHBondContact O-CG 3.28Å; D382-K386 PolarHBondContact O-N 3.18Å; D382-R462 IonicContact OD1-CZ 3.99Å; D382-R462 VanDerWaalsContact OD1-CZ 3.25Å; D382-R462 IonicContact OD1-NH1 3.76Å; D382-R462 PolarHBondContact OD1-NH1 3.41Å; D382-R462 IonicContact OD1-NH2 3.93Å; D382-R462 PolarHBondContact OD1-NH2 3.1Å
383	A	85.2	Confident	84.4	Confident	12 Å²	12	54.1 Å²	54.1	10%	0.099	29%	0.285	C	S	.	.	H	α-helix	trans	-66.4	-37	176.2	0	0	0	0	0	112.3	Q379 W380 A381 Y387 L396 A399	Q379-A383 WeakPolarHBondContact O-CB 3.46Å; Q379-A383 PolarHBondContact O-N 3.42Å; Q379-A383 VanDerWaalsContact O-N 3.08Å; W380-A383 HydrophobicContact CE3-CB 4.26Å; W380-A383 PolarHBondContact O-N 3.43Å; A381-A383 VanDerWaalsContact C-N 3.31Å; A381-A383 PolarHBondContact O-N 2.95Å; A383-Y387 WeakPolarHBondContact O-CB 3.5Å; A383-Y387 PolarHBondContact O-N 2.9Å; A383-L396 HydrophobicContact CB-CD1 4.14Å; A383-L396 WeakPolarHBondContact O-CD1 3.42Å; A383-A399 HydrophobicContact CB-CB 3.4Å
384	I	81.3	Confident	84.4	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-64.5	-44	173.4	-66.2	167.4	0	0	0	110.4	W380 A381 Y387 C388 L396 L440 Y454 A458	W380-I384 HydrophobicContact CD2-CD1 4.32Å; W380-I384 HydrophobicContact CD2-CG1 4.41Å; W380-I384 HydrophobicContact CH2-CG1 4.34Å; W380-I384 HydrophobicContact CZ2-CD1 3.96Å; W380-I384 HydrophobicContact CZ2-CG1 4.02Å; W380-I384 WeakPolarHBondContact O-CG1 3.32Å; W380-I384 PolarHBondContact O-N 3.5Å; W380-I384 VanDerWaalsContact O-N 3.08Å; A381-I384 WeakPolarHBondContact O-CB 3.16Å; A381-I384 PolarHBondContact O-N 3.05Å; I384-Y387 WeakPolarHBondContact O-CB 3.41Å; I384-Y387 PolarHBondContact O-N 3.07Å; I384-C388 PolarHBondContact O-N 3.11Å; I384-C388 VanDerWaalsContact O-N 3.17Å; I384-C388 PolarHBondContact O-SG 3.1Å; I384-L396 HydrophobicContact CG1-CD1 4.15Å; I384-L440 HydrophobicContact CD1-CD1 3.93Å; I384-Y454 HydrophobicContact CG2-CD1 4.16Å; I384-A458 HydrophobicContact CG2-CB 4.23Å
385	E	81.9	Confident	84.4	Confident	94 Å²	94	59.9 Å²	59.9	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-41.3	179.1	-168	171.7	176.6	0	0	111.8	A381 D382 Y387 C388 R462	A381-E385 PolarHBondContact O-N 3.32Å; D382-E385 PolarHBondContact O-N 3.48Å; E385-Y387 VanDerWaalsContact C-N 3.32Å; E385-Y387 PolarHBondContact O-N 3.27Å; E385-C388 VanDerWaalsContact O-CB 3.3Å; E385-C388 WeakPolarHBondContact O-CB 3.41Å; E385-C388 PolarHBondContact O-N 3.07Å; E385-C388 VanDerWaalsContact O-N 3.14Å; E385-R462 IonicContact OE2-CZ 2.67Å; E385-R462 IonicContact OE2-NH2 3.43Å; E385-R462 PolarHBondContact OE2-NH2 2.89Å
386	K	84.9	Confident	84.2	Confident	141 Å²	141	57.8 Å²	57.8	61%	0.613	31%	0.313	S	S	*	.	H	α-helix	trans	-62.1	-36.9	171.5	-75.1	176.2	-176.7	175.3	0	112.3	D382 C388 T389 S390	D382-K386 WeakPolarHBondContact O-CB 3.41Å; D382-K386 WeakPolarHBondContact O-CG 3.28Å; D382-K386 PolarHBondContact O-N 3.18Å; K386-C388 VanDerWaalsContact C-N 3.26Å; K386-C388 PolarHBondContact O-N 2.95Å; K386-T389 PolarHBondContact O-N 3.37Å; K386-T389 PolarHBondContact O-OG1 3.49Å; K386-S390 WeakPolarHBondContact O-CB 3.42Å; K386-S390 PolarHBondContact O-N 2.92Å; K386-S390 PolarHBondContact O-OG 2.65Å
387	Y	83.6	Confident	84.2	Confident	61 Å²	61	60.7 Å²	60.7	24%	0.239	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-32.7	175	177.7	-104.6	0	0	0	112.4	A383 I384 E385 T389 K391 A393 L396 Y454	A383-Y387 WeakPolarHBondContact O-CB 3.5Å; A383-Y387 PolarHBondContact O-N 2.9Å; I384-Y387 WeakPolarHBondContact O-CB 3.41Å; I384-Y387 PolarHBondContact O-N 3.07Å; E385-Y387 VanDerWaalsContact C-N 3.32Å; E385-Y387 PolarHBondContact O-N 3.27Å; Y387-T389 PolarHBondContact O-N 2.91Å; Y387-K391 WeakPolarHBondContact O-CA 3.41Å; Y387-K391 PolarHBondContact O-N 2.93Å; Y387-A393 HydrophobicContact CE2-CB 4.17Å; Y387-L396 HydrophobicContact CD1-CD2 4.06Å; Y387-L396 HydrophobicContact CD2-CB 4.17Å; Y387-L396 HydrophobicContact CD2-CD2 4.02Å; Y387-L396 HydrophobicContact CE1-CD2 4.49Å; Y387-L396 HydrophobicContact CE2-CD2 4.47Å; Y387-L396 HydrophobicContact CG-CB 4.45Å; Y387-L396 HydrophobicContact CG-CD2 3.8Å; Y387-Y454 HydrophobicContact CD1-CE1 4.42Å; Y387-Y454 HydrophobicContact CE1-CE1 4.47Å
388	C	78	Confident	84.4	Confident	24 Å²	24	65.3 Å²	65.3	16%	0.162	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-24.6	176.5	-60.7	0	0	0	0	113.1	I384 E385 K386 Y454	I384-C388 PolarHBondContact O-N 3.11Å; I384-C388 VanDerWaalsContact O-N 3.17Å; I384-C388 PolarHBondContact O-SG 3.1Å; E385-C388 VanDerWaalsContact O-CB 3.3Å; E385-C388 WeakPolarHBondContact O-CB 3.41Å; E385-C388 PolarHBondContact O-N 3.07Å; E385-C388 VanDerWaalsContact O-N 3.14Å; K386-C388 VanDerWaalsContact C-N 3.26Å; K386-C388 PolarHBondContact O-N 2.95Å; C388-Y454 VanDerWaalsContact SG-CB 3.51Å
389	T	81.3	Confident	84.4	Confident	102 Å²	102	63.1 Å²	63.1	63%	0.626	36%	0.359	S	S	*	.	H	α-helix	trans	-101.3	-45.8	178.8	52.8	0	0	0	0	112.6	K386 Y387	K386-T389 PolarHBondContact O-N 3.37Å; K386-T389 PolarHBondContact O-OG1 3.49Å; Y387-T389 PolarHBondContact O-N 2.91Å
390	S	83.8	Confident	84.4	Confident	69 Å²	69	64.2 Å²	64.2	48%	0.483	36%	0.36	S	S	.	.	H	α-helix	trans	-83.7	-24.8	-174.8	73.1	0	0	0	0	114.3	K386 D392	K386-S390 WeakPolarHBondContact O-CB 3.42Å; K386-S390 PolarHBondContact O-N 2.92Å; K386-S390 PolarHBondContact O-OG 2.65Å; S390-D392 PolarHBondContact O-N 3.3Å; S390-D392 VanDerWaalsContact O-N 3.12Å; S390-D392 WeakPolarHBondContact OG-CB 3.43Å; S390-D392 PolarHBondContact OG-N 2.92Å; S390-D392 VanDerWaalsContact OG-N 3.17Å
391	K	81	Confident	84.6	Confident	174 Å²	174	70.8 Å²	70.8	76%	0.757	39%	0.389	S	S	*	.			trans	54.1	18.3	-168	-62.4	-178.2	178	178.6	0	114.4	Y387 A393	Y387-K391 WeakPolarHBondContact O-CA 3.41Å; Y387-K391 PolarHBondContact O-N 2.93Å; K391-A393 PolarHBondContact O-N 3.03Å; K391-A393 VanDerWaalsContact O-N 3.15Å
392	D	84.7	Confident	84.9	Confident	65 Å²	65	75.6 Å²	75.6	35%	0.348	41%	0.41	S	S	.	.			trans	-80.2	96.7	179.8	-174.6	-7.5	0	0	0	111.2	S390 T394 A395 L396	S390-D392 PolarHBondContact O-N 3.3Å; S390-D392 VanDerWaalsContact O-N 3.12Å; S390-D392 WeakPolarHBondContact OG-CB 3.43Å; S390-D392 PolarHBondContact OG-N 2.92Å; S390-D392 VanDerWaalsContact OG-N 3.17Å; D392-T394 PolarHBondContact O-N 3.23Å; D392-T394 WeakPolarHBondContact OD1-CA 3.44Å; D392-T394 WeakPolarHBondContact OD1-CB 3.44Å; D392-T394 PolarHBondContact OD1-N 3.28Å; D392-T394 PolarHBondContact OD1-OG1 3.03Å; D392-A395 HydrophobicContact CB-CB 4.12Å; D392-A395 PolarHBondContact OD1-N 3.35Å; D392-A395 VanDerWaalsContact OD1-N 3.12Å; D392-A395 WeakPolarHBondContact OD2-CB 3.43Å; D392-L396 PolarHBondContact O-N 3.2Å
393	A	83.8	Confident	85	Confident	61 Å²	61	72.7 Å²	72.7	50%	0.504	39%	0.394	S	S	.	.	H	α-helix	trans	-66.8	-25.2	178.7	0	0	0	0	0	113.1	Y387 K391 A397	Y387-A393 HydrophobicContact CE2-CB 4.17Å; K391-A393 PolarHBondContact O-N 3.03Å; K391-A393 VanDerWaalsContact O-N 3.15Å; A393-A397 WeakPolarHBondContact O-CB 3.33Å; A393-A397 PolarHBondContact O-N 2.84Å; A393-A397 VanDerWaalsContact O-N 3.1Å
394	T	87.7	Confident	85.1	Confident	101 Å²	101	74.7 Å²	74.7	62%	0.62	40%	0.402	S	S	*	.	H	α-helix	trans	-75	-45.5	-179.3	66	0	0	0	0	110.9	D392 L396 A397 V398	D392-T394 PolarHBondContact O-N 3.23Å; D392-T394 WeakPolarHBondContact OD1-CA 3.44Å; D392-T394 WeakPolarHBondContact OD1-CB 3.44Å; D392-T394 PolarHBondContact OD1-N 3.28Å; D392-T394 PolarHBondContact OD1-OG1 3.03Å; T394-L396 VanDerWaalsContact C-N 3.31Å; T394-L396 PolarHBondContact O-N 3.08Å; T394-A397 PolarHBondContact O-N 3.23Å; T394-V398 WeakPolarHBondContact O-CG2 3.48Å; T394-V398 PolarHBondContact O-N 3.08Å
395	A	85.9	Confident	85.5	Confident	48 Å²	48	80.9 Å²	80.9	40%	0.397	43%	0.431	S	S	.	.	H	α-helix	trans	-59.8	-41.3	174.4	0	0	0	0	0	112	D392 V398 A399	D392-A395 HydrophobicContact CB-CB 4.12Å; D392-A395 PolarHBondContact OD1-N 3.35Å; D392-A395 VanDerWaalsContact OD1-N 3.12Å; D392-A395 WeakPolarHBondContact OD2-CB 3.43Å; A395-V398 PolarHBondContact O-N 3.12Å; A395-A399 WeakPolarHBondContact O-CB 3.37Å; A395-A399 PolarHBondContact O-N 3.22Å
396	L	84.9	Confident	85.9	Confident	25 Å²	25	79.4 Å²	79.4	13%	0.131	42%	0.424	C	S	.	.	H	α-helix	trans	-62.9	-43.8	176	-173.7	70.4	0	0	0	111.7	W380 A383 I384 Y387 D392 T394 V398 A399 R400	W380-L396 HydrophobicContact CE3-CD1 4.5Å; W380-L396 HydrophobicContact CH2-CD1 3.67Å; W380-L396 HydrophobicContact CH2-CG 3.93Å; W380-L396 HydrophobicContact CZ3-CD1 3.54Å; W380-L396 HydrophobicContact CZ3-CG 4.02Å; W380-L396 WeakPolarHBondContact CZ3-O 3.37Å; A383-L396 HydrophobicContact CB-CD1 4.14Å; A383-L396 WeakPolarHBondContact O-CD1 3.42Å; I384-L396 HydrophobicContact CG1-CD1 4.15Å; Y387-L396 HydrophobicContact CD1-CD2 4.06Å; Y387-L396 HydrophobicContact CD2-CB 4.17Å; Y387-L396 HydrophobicContact CD2-CD2 4.02Å; Y387-L396 HydrophobicContact CE1-CD2 4.49Å; Y387-L396 HydrophobicContact CE2-CD2 4.47Å; Y387-L396 HydrophobicContact CG-CB 4.45Å; Y387-L396 HydrophobicContact CG-CD2 3.8Å; D392-L396 PolarHBondContact O-N 3.2Å; T394-L396 VanDerWaalsContact C-N 3.31Å; T394-L396 PolarHBondContact O-N 3.08Å; L396-V398 VanDerWaalsContact C-N 3.34Å; L396-V398 PolarHBondContact O-N 3.42Å; L396-A399 PolarHBondContact O-N 3.17Å; L396-R400 WeakPolarHBondContact O-CB 3.44Å; L396-R400 PolarHBondContact O-N 3.38Å
397	A	86.6	Confident	86	Confident	60 Å²	60	72.9 Å²	72.9	50%	0.496	40%	0.396	S	S	.	.	H	α-helix	trans	-63.6	-38.4	178.2	0	0	0	0	0	112.5	A393 T394 K401	A393-A397 WeakPolarHBondContact O-CB 3.33Å; A393-A397 PolarHBondContact O-N 2.84Å; A393-A397 VanDerWaalsContact O-N 3.1Å; T394-A397 PolarHBondContact O-N 3.23Å; A397-K401 PolarHBondContact O-N 2.94Å; A397-K401 VanDerWaalsContact O-N 3.08Å
398	V	89.6	Confident	86.3	Confident	104 Å²	104	76.8 Å²	76.8	63%	0.63	41%	0.414	S	S	*	.	H	α-helix	trans	-66.1	-49.1	175.5	173.2	0	0	0	0	111	T394 A395 L396 R400 K401 K402	T394-V398 WeakPolarHBondContact O-CG2 3.48Å; T394-V398 PolarHBondContact O-N 3.08Å; A395-V398 PolarHBondContact O-N 3.12Å; L396-V398 VanDerWaalsContact C-N 3.34Å; L396-V398 PolarHBondContact O-N 3.42Å; V398-R400 VanDerWaalsContact C-N 3.28Å; V398-R400 PolarHBondContact O-N 3.14Å; V398-K401 PolarHBondContact O-N 2.88Å; V398-K402 PolarHBondContact O-N 3.25Å
399	A	87.1	Confident	86.9	Confident	28 Å²	28	78.4 Å²	78.4	23%	0.231	43%	0.425	C	S	.	.	H	α-helix	trans	-60	-39.5	177.6	0	0	0	0	0	111.9	A383 A395 L396 K402 A403	A383-A399 HydrophobicContact CB-CB 3.4Å; A395-A399 WeakPolarHBondContact O-CB 3.37Å; A395-A399 PolarHBondContact O-N 3.22Å; L396-A399 PolarHBondContact O-N 3.17Å; A399-K402 PolarHBondContact O-N 3.17Å; A399-A403 WeakPolarHBondContact O-CB 3.47Å; A399-A403 PolarHBondContact O-N 2.94Å
400	R	85.9	Confident	87.3	Confident	99 Å²	99	73.8 Å²	73.8	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-58.7	-50.8	174.3	-168.9	-179.6	163.2	174.9	-3.9	111.7	W380 L396 V398 K402 A403 E404 F439	W380-R400 HydrophobicContact CE3-CB 3.95Å; W380-R400 HydrophobicContact CE3-CG 4.36Å; W380-R400 HydrophobicContact CH2-CB 3.58Å; W380-R400 HydrophobicContact CH2-CG 3.72Å; W380-R400 HydrophobicContact CZ2-CB 4.45Å; W380-R400 HydrophobicContact CZ2-CG 4.14Å; W380-R400 HydrophobicContact CZ3-CB 3.3Å; W380-R400 HydrophobicContact CZ3-CG 3.86Å; L396-R400 WeakPolarHBondContact O-CB 3.44Å; L396-R400 PolarHBondContact O-N 3.38Å; V398-R400 VanDerWaalsContact C-N 3.28Å; V398-R400 PolarHBondContact O-N 3.14Å; R400-K402 VanDerWaalsContact C-N 3.3Å; R400-K402 PolarHBondContact O-N 3.2Å; R400-A403 PolarHBondContact O-N 3.44Å; R400-E404 HydrophobicContact CG-CG 4.43Å; R400-E404 IonicContact CZ-OE1 3.1Å; R400-E404 IonicContact NE-OE1 3.84Å; R400-E404 PolarHBondContact NE-OE1 3.32Å; R400-E404 IonicContact NH2-OE1 2.83Å; R400-E404 PolarHBondContact NH2-OE1 3.18Å; R400-E404 VanDerWaalsContact NH2-OE1 3.1Å; R400-E404 WeakPolarHBondContact O-CB 3.24Å; R400-E404 WeakPolarHBondContact O-CG 3.39Å; R400-E404 PolarHBondContact O-N 3.5Å; R400-F439 HydrophobicContact CG-CZ 4.1Å
401	K	89	Confident	87.5	Confident	152 Å²	152	72.4 Å²	72.4	66%	0.661	39%	0.386	S	S	*	.	H	α-helix	trans	-63	-39.6	-177.4	-169.3	-179.7	178.5	-175.6	0	111	A397 V398 Q405	A397-K401 PolarHBondContact O-N 2.94Å; A397-K401 VanDerWaalsContact O-N 3.08Å; V398-K401 PolarHBondContact O-N 2.88Å; K401-Q405 WeakPolarHBondContact O-CB 3.45Å; K401-Q405 PolarHBondContact O-N 2.97Å
402	K	91	Very high	87.9	Confident	102 Å²	102	69 Å²	69	44%	0.443	37%	0.372	S	S	.	.	H	α-helix	trans	-62.6	-53.4	175.4	-174.3	-176.1	172.7	-160.6	0	111.6	V398 A399 R400 E404 Q405 E406	V398-K402 PolarHBondContact O-N 3.25Å; A399-K402 PolarHBondContact O-N 3.17Å; R400-K402 VanDerWaalsContact C-N 3.3Å; R400-K402 PolarHBondContact O-N 3.2Å; K402-E404 VanDerWaalsContact C-N 3.34Å; K402-E404 PolarHBondContact O-N 3.07Å; K402-Q405 WeakPolarHBondContact O-CB 3.35Å; K402-Q405 PolarHBondContact O-N 2.83Å; K402-Q405 VanDerWaalsContact O-N 3.08Å; K402-E406 WeakPolarHBondContact CE-OE1 3.39Å; K402-E406 IonicContact NZ-OE1 3.77Å; K402-E406 PolarHBondContact O-N 2.98Å
403	A	87.5	Confident	88.2	Confident	2 Å²	2	70 Å²	70	2%	0.017	38%	0.375	C	S	.	.	H	α-helix	trans	-60.9	-41.1	178.9	0	0	0	0	0	112.1	W380 A399 R400 Q405 E406 L407 F439	W380-A403 HydrophobicContact CB-CB 3.91Å; A399-A403 WeakPolarHBondContact O-CB 3.47Å; A399-A403 PolarHBondContact O-N 2.94Å; R400-A403 PolarHBondContact O-N 3.44Å; A403-Q405 VanDerWaalsContact C-N 3.3Å; A403-Q405 PolarHBondContact O-N 3Å; A403-E406 PolarHBondContact O-N 3.49Å; A403-L407 WeakPolarHBondContact O-CB 3.45Å; A403-L407 WeakPolarHBondContact O-CD1 3.32Å; A403-L407 PolarHBondContact O-N 3.2Å; A403-F439 HydrophobicContact CB-CE2 4.16Å
404	E	87.2	Confident	88.5	Confident	54 Å²	54	67.6 Å²	67.6	25%	0.252	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-35.6	174.8	-76.5	-175.3	-173.3	0	0	112.5	R400 K402 K408 F439	R400-E404 HydrophobicContact CG-CG 4.43Å; R400-E404 IonicContact CZ-OE1 3.1Å; R400-E404 IonicContact NE-OE1 3.84Å; R400-E404 PolarHBondContact NE-OE1 3.32Å; R400-E404 IonicContact NH2-OE1 2.83Å; R400-E404 PolarHBondContact NH2-OE1 3.18Å; R400-E404 VanDerWaalsContact NH2-OE1 3.1Å; R400-E404 WeakPolarHBondContact O-CB 3.24Å; R400-E404 WeakPolarHBondContact O-CG 3.39Å; R400-E404 PolarHBondContact O-N 3.5Å; K402-E404 VanDerWaalsContact C-N 3.34Å; K402-E404 PolarHBondContact O-N 3.07Å; E404-K408 WeakPolarHBondContact O-CB 3.31Å; E404-K408 VanDerWaalsContact O-CG 3.24Å; E404-K408 WeakPolarHBondContact O-CG 3.38Å; E404-K408 PolarHBondContact O-N 3.2Å; E404-K408 VanDerWaalsContact O-N 3.1Å; E404-F439 HydrophobicContact CG-CD1 4.19Å; E404-F439 HydrophobicContact CG-CE1 3.41Å; E404-F439 VanDerWaalsContact CG-CE1 3.41Å; E404-F439 HydrophobicContact CG-CE2 4.05Å; E404-F439 HydrophobicContact CG-CZ 3.33Å; E404-F439 VanDerWaalsContact OE1-CE1 3.28Å; E404-F439 WeakPolarHBondContact OE1-CE1 3.47Å
405	Q	90.8	Very high	88.5	Confident	133 Å²	133	64.2 Å²	64.2	62%	0.621	33%	0.334	S	S	*	.	H	α-helix	trans	-72.1	-45.4	178.7	-175.6	173.9	-10.8	0	0	111.8	K401 K402 A403 K408 S409	K401-Q405 WeakPolarHBondContact O-CB 3.45Å; K401-Q405 PolarHBondContact O-N 2.97Å; K402-Q405 WeakPolarHBondContact O-CB 3.35Å; K402-Q405 PolarHBondContact O-N 2.83Å; K402-Q405 VanDerWaalsContact O-N 3.08Å; A403-Q405 VanDerWaalsContact C-N 3.3Å; A403-Q405 PolarHBondContact O-N 3Å; Q405-K408 PolarHBondContact O-N 3.22Å; Q405-S409 WeakPolarHBondContact O-CB 3.26Å; Q405-S409 PolarHBondContact O-N 3.36Å
406	E	89.5	Confident	88.7	Confident	63 Å²	63	64.8 Å²	64.8	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-61.6	-47.1	175.9	-72.2	174.5	177.6	0	0	110.9	A376 K402 A403 K408 S409 S410	A376-E406 HydrophobicContact CB-CB 3.97Å; K402-E406 WeakPolarHBondContact CE-OE1 3.39Å; K402-E406 IonicContact NZ-OE1 3.77Å; K402-E406 PolarHBondContact O-N 2.98Å; A403-E406 PolarHBondContact O-N 3.49Å; E406-K408 VanDerWaalsContact C-N 3.33Å; E406-K408 PolarHBondContact O-N 3.02Å; E406-S409 PolarHBondContact O-N 3.19Å; E406-S410 PolarHBondContact O-N 3.12Å; E406-S410 PolarHBondContact O-OG 3.12Å
407	L	87.7	Confident	88.9	Confident	4 Å²	4	65 Å²	65	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-59.6	-41.1	175.8	-101.1	120	0	0	0	113	A376 A403 T411 Y437 F439	A376-L407 HydrophobicContact CB-CD1 3.96Å; A403-L407 WeakPolarHBondContact O-CB 3.45Å; A403-L407 WeakPolarHBondContact O-CD1 3.32Å; A403-L407 PolarHBondContact O-N 3.2Å; L407-T411 WeakPolarHBondContact O-CB 3.45Å; L407-T411 PolarHBondContact O-N 3.39Å; L407-T411 PolarHBondContact O-OG1 3.48Å; L407-Y437 HydrophobicContact CD2-CD1 4.3Å; L407-Y437 HydrophobicContact CD2-CD2 3.12Å; L407-Y437 HydrophobicContact CD2-CE2 3.73Å; L407-Y437 HydrophobicContact CD2-CG 3.45Å; L407-Y437 VanDerWaalsContact CD2-CG 3.45Å; L407-F439 HydrophobicContact CD1-CD2 3.87Å; L407-F439 HydrophobicContact CD1-CE2 4.35Å
408	K	88.5	Confident	89	Confident	143 Å²	143	64.1 Å²	64.1	62%	0.622	32%	0.317	S	S	*	.	H	α-helix	trans	-64.8	-43.4	176.5	-80.1	174.8	-177.4	175.3	0	111.5	E404 Q405 E406 Q412	E404-K408 WeakPolarHBondContact O-CB 3.31Å; E404-K408 VanDerWaalsContact O-CG 3.24Å; E404-K408 WeakPolarHBondContact O-CG 3.38Å; E404-K408 PolarHBondContact O-N 3.2Å; E404-K408 VanDerWaalsContact O-N 3.1Å; Q405-K408 PolarHBondContact O-N 3.22Å; E406-K408 VanDerWaalsContact C-N 3.33Å; E406-K408 PolarHBondContact O-N 3.02Å; K408-Q412 WeakPolarHBondContact O-CB 3.42Å; K408-Q412 PolarHBondContact O-N 2.86Å
409	S	91.4	Very high	88.9	Confident	58 Å²	58	67.1 Å²	67.1	41%	0.406	32%	0.317	S	S	.	.	H	α-helix	trans	-61	-55.5	178.2	-176.1	0	0	0	0	111.5	Q405 E406 T411 Q412 Q413	Q405-S409 WeakPolarHBondContact O-CB 3.26Å; Q405-S409 PolarHBondContact O-N 3.36Å; E406-S409 PolarHBondContact O-N 3.19Å; S409-T411 VanDerWaalsContact C-N 3.31Å; S409-T411 PolarHBondContact O-N 3Å; S409-Q412 PolarHBondContact O-N 2.76Å; S409-Q412 VanDerWaalsContact O-N 3.15Å; S409-Q413 WeakPolarHBondContact O-CG 3.2Å; S409-Q413 PolarHBondContact O-N 3.15Å
410	S	88.8	Confident	88.9	Confident	5 Å²	5	70.6 Å²	70.6	4%	0.035	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-33.9	-179.3	-52.9	0	0	0	0	111.9	Q372 E406 Q413 I414	Q372-S410 PolarHBondContact OE1-OG 2.89Å; E406-S410 PolarHBondContact O-N 3.12Å; E406-S410 PolarHBondContact O-OG 3.12Å; S410-Q413 PolarHBondContact O-N 3.44Å; S410-I414 WeakPolarHBondContact O-CB 3.34Å; S410-I414 WeakPolarHBondContact O-CD1 3.47Å; S410-I414 VanDerWaalsContact O-CG1 3.22Å; S410-I414 WeakPolarHBondContact O-CG1 3.46Å; S410-I414 PolarHBondContact O-N 2.93Å
411	T	88.3	Confident	88.8	Confident	39 Å²	39	65.9 Å²	65.9	24%	0.239	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-39.4	174.3	-59.5	0	0	0	0	112	L407 S409 S415 Y437	L407-T411 WeakPolarHBondContact O-CB 3.45Å; L407-T411 PolarHBondContact O-N 3.39Å; L407-T411 PolarHBondContact O-OG1 3.48Å; S409-T411 VanDerWaalsContact C-N 3.31Å; S409-T411 PolarHBondContact O-N 3Å; T411-S415 WeakPolarHBondContact O-CB 3.43Å; T411-S415 PolarHBondContact O-N 3.24Å; T411-Y437 HydrophobicContact CG2-CE1 4.04Å
412	Q	90.3	Very high	88.7	Confident	102 Å²	102	65.5 Å²	65.5	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-46.7	176.1	-176.1	54.8	46.3	0	0	110.7	K408 S409 I414 S415 D416	K408-Q412 WeakPolarHBondContact O-CB 3.42Å; K408-Q412 PolarHBondContact O-N 2.86Å; S409-Q412 PolarHBondContact O-N 2.76Å; S409-Q412 VanDerWaalsContact O-N 3.15Å; Q412-I414 PolarHBondContact O-N 3.26Å; Q412-S415 PolarHBondContact NE2-OG 3.25Å; Q412-S415 WeakPolarHBondContact O-CB 3.47Å; Q412-S415 PolarHBondContact O-N 3.09Å; Q412-S415 VanDerWaalsContact O-N 3.07Å; Q412-S415 PolarHBondContact O-OG 2.95Å; Q412-D416 PolarHBondContact NE2-OD1 2.97Å; Q412-D416 PolarHBondContact NE2-OD2 2.96Å; Q412-D416 VanDerWaalsContact NE2-OD2 3.09Å; Q412-D416 PolarHBondContact O-N 2.86Å
413	Q	91.5	Very high	88.4	Confident	88 Å²	88	69.4 Å²	69.4	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-61.3	-43.1	177.1	-66.8	179.5	19.7	0	0	112.2	L369 S409 S410 S415 D416 L417	L369-Q413 HydrophobicContact CD1-CB 3.61Å; L369-Q413 HydrophobicContact CD2-CB 4.2Å; S409-Q413 WeakPolarHBondContact O-CG 3.2Å; S409-Q413 PolarHBondContact O-N 3.15Å; S410-Q413 PolarHBondContact O-N 3.44Å; Q413-S415 VanDerWaalsContact C-N 3.29Å; Q413-S415 PolarHBondContact O-N 3.36Å; Q413-D416 PolarHBondContact O-N 3.11Å; Q413-D416 VanDerWaalsContact O-N 3.16Å; Q413-L417 WeakPolarHBondContact O-CG 3.39Å; Q413-L417 PolarHBondContact O-N 3.49Å
414	I	89	Confident	88.1	Confident	9 Å²	9	72.8 Å²	72.8	5%	0.046	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-40.3	173.4	-70.4	164.1	0	0	0	110.6	L369 R373 S410 Q412 D416 L417 Q418 V432	L369-I414 HydrophobicContact CB-CD1 3.77Å; L369-I414 HydrophobicContact CB-CG1 3.54Å; L369-I414 HydrophobicContact CD1-CG1 3.71Å; L369-I414 HydrophobicContact CG-CG1 4.29Å; R373-I414 VanDerWaalsContact NH1-CD1 3.32Å; S410-I414 WeakPolarHBondContact O-CB 3.34Å; S410-I414 WeakPolarHBondContact O-CD1 3.47Å; S410-I414 VanDerWaalsContact O-CG1 3.22Å; S410-I414 WeakPolarHBondContact O-CG1 3.46Å; S410-I414 PolarHBondContact O-N 2.93Å; Q412-I414 PolarHBondContact O-N 3.26Å; I414-D416 VanDerWaalsContact C-N 3.3Å; I414-D416 PolarHBondContact O-N 2.99Å; I414-L417 PolarHBondContact O-N 3.49Å; I414-Q418 WeakPolarHBondContact O-CB 3.36Å; I414-Q418 PolarHBondContact O-N 3.09Å; I414-V432 HydrophobicContact CG2-CG1 3.99Å
415	S	88.6	Confident	87.8	Confident	31 Å²	31	72.2 Å²	72.2	22%	0.217	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-34.1	178	84.8	0	0	0	0	112.7	T411 Q412 Q413 R419	T411-S415 WeakPolarHBondContact O-CB 3.43Å; T411-S415 PolarHBondContact O-N 3.24Å; Q412-S415 PolarHBondContact NE2-OG 3.25Å; Q412-S415 WeakPolarHBondContact O-CB 3.47Å; Q412-S415 PolarHBondContact O-N 3.09Å; Q412-S415 VanDerWaalsContact O-N 3.07Å; Q412-S415 PolarHBondContact O-OG 2.95Å; Q413-S415 VanDerWaalsContact C-N 3.29Å; Q413-S415 PolarHBondContact O-N 3.36Å; S415-R419 WeakPolarHBondContact O-CG 3.36Å; S415-R419 PolarHBondContact O-N 2.87Å; S415-R419 VanDerWaalsContact O-N 3.13Å
416	D	90.4	Very high	87.5	Confident	60 Å²	60	69.8 Å²	69.8	32%	0.321	34%	0.342	S	S	.	.	H	α-helix	trans	-74.2	-42.9	177.9	-67.8	-37.7	0	0	0	111	Q412 Q413 I414 R419 Q420	Q412-D416 PolarHBondContact NE2-OD1 2.97Å; Q412-D416 PolarHBondContact NE2-OD2 2.96Å; Q412-D416 VanDerWaalsContact NE2-OD2 3.09Å; Q412-D416 PolarHBondContact O-N 2.86Å; Q413-D416 PolarHBondContact O-N 3.11Å; Q413-D416 VanDerWaalsContact O-N 3.16Å; I414-D416 VanDerWaalsContact C-N 3.3Å; I414-D416 PolarHBondContact O-N 2.99Å; D416-R419 WeakPolarHBondContact O-CB 3.5Å; D416-R419 PolarHBondContact O-N 3.37Å; D416-R419 IonicContact OD1-NH1 2.89Å; D416-Q420 PolarHBondContact O-N 3.1Å
417	L	88.6	Confident	87.2	Confident	30 Å²	30	71.3 Å²	71.3	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-63.7	-39.5	171.7	-67.7	180	0	0	0	112	L362 I366 L369 Q413 I414 R419 Q420 L421	L362-L417 HydrophobicContact CD2-CD2 3.81Å; I366-L417 HydrophobicContact CD1-CB 4.1Å; I366-L417 HydrophobicContact CG1-CB 3.8Å; I366-L417 HydrophobicContact CG1-CD1 3.84Å; L369-L417 HydrophobicContact CD1-CD1 3.6Å; Q413-L417 WeakPolarHBondContact O-CG 3.39Å; Q413-L417 PolarHBondContact O-N 3.49Å; I414-L417 PolarHBondContact O-N 3.49Å; L417-R419 VanDerWaalsContact C-N 3.28Å; L417-R419 PolarHBondContact O-N 3.29Å; L417-Q420 CarbonylContact O-C 3.6Å; L417-Q420 WeakPolarHBondContact O-CA 3.46Å; L417-Q420 WeakPolarHBondContact O-CB 3.44Å; L417-Q420 PolarHBondContact O-N 3.01Å; L417-L421 WeakPolarHBondContact O-CB 3.44Å; L417-L421 PolarHBondContact O-N 3.37Å
418	Q	87.4	Confident	86.9	Confident	40 Å²	40	71.3 Å²	71.3	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-60.8	-36.7	175.1	-170.5	-156.1	-13.6	0	0	111.7	I414 Q420 L421 K422 A429 V432	I414-Q418 WeakPolarHBondContact O-CB 3.36Å; I414-Q418 PolarHBondContact O-N 3.09Å; Q418-Q420 VanDerWaalsContact C-N 3.31Å; Q418-L421 PolarHBondContact O-N 2.85Å; Q418-K422 WeakPolarHBondContact O-CB 3.48Å; Q418-K422 PolarHBondContact O-N 3.1Å; Q418-A429 HydrophobicContact CG-CB 4.24Å; Q418-A429 PolarHBondContact NE2-O 3.31Å; Q418-V432 HydrophobicContact CB-CG1 4.29Å; Q418-V432 HydrophobicContact CG-CB 4.32Å; Q418-V432 HydrophobicContact CG-CG1 4.16Å
419	R	87.9	Confident	86.6	Confident	167 Å²	167	64.6 Å²	64.6	63%	0.63	33%	0.325	S	S	*	.	H	α-helix	trans	-66.9	-33.1	174.2	-73.3	170.2	-176.4	-179.5	0.5	112.1	S415 D416 L417	S415-R419 WeakPolarHBondContact O-CG 3.36Å; S415-R419 PolarHBondContact O-N 2.87Å; S415-R419 VanDerWaalsContact O-N 3.13Å; D416-R419 WeakPolarHBondContact O-CB 3.5Å; D416-R419 PolarHBondContact O-N 3.37Å; D416-R419 IonicContact OD1-NH1 2.89Å; L417-R419 VanDerWaalsContact C-N 3.28Å; L417-R419 PolarHBondContact O-N 3.29Å
420	Q	86.6	Confident	86.3	Confident	102 Å²	102	66.9 Å²	66.9	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-70.8	-44.9	173	-61.6	-177.5	21.3	0	0	110.7	L362 D416 L417 Q418 K422 K423	L362-Q420 HydrophobicContact CD1-CB 4.11Å; L362-Q420 HydrophobicContact CD2-CB 4.14Å; D416-Q420 PolarHBondContact O-N 3.1Å; L417-Q420 CarbonylContact O-C 3.6Å; L417-Q420 WeakPolarHBondContact O-CA 3.46Å; L417-Q420 WeakPolarHBondContact O-CB 3.44Å; L417-Q420 PolarHBondContact O-N 3.01Å; Q418-Q420 VanDerWaalsContact C-N 3.31Å; Q420-K422 VanDerWaalsContact C-N 3.29Å; Q420-K422 PolarHBondContact O-N 3Å; Q420-K423 WeakPolarHBondContact O-CB 3.49Å; Q420-K423 PolarHBondContact O-N 3.36Å
421	L	85.6	Confident	86	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-56.9	-41.9	176.5	-164.8	65.6	0	0	0	111.7	L359 L362 I366 L417 Q418 K423 I424 C425 A428 A429 V432	L359-L421 HydrophobicContact CD1-CD1 3.41Å; L359-L421 VanDerWaalsContact CD1-CD1 3.41Å; L359-L421 HydrophobicContact CD1-CG 4.48Å; L362-L421 HydrophobicContact CB-CD1 4.01Å; L362-L421 HydrophobicContact CD1-CB 4.46Å; L362-L421 HydrophobicContact CD1-CD1 4.13Å; I366-L421 HydrophobicContact CD1-CD2 4.03Å; L417-L421 WeakPolarHBondContact O-CB 3.44Å; L417-L421 PolarHBondContact O-N 3.37Å; Q418-L421 PolarHBondContact O-N 2.85Å; L421-K423 PolarHBondContact O-N 3.28Å; L421-K423 VanDerWaalsContact O-N 3.15Å; L421-I424 PolarHBondContact O-N 2.99Å; L421-C425 CarbonylContact O-C 3.58Å; L421-C425 PolarHBondContact O-N 3.32Å; L421-A428 HydrophobicContact CD1-CB 4.39Å; L421-A428 HydrophobicContact CD2-CB 3.93Å; L421-A428 HydrophobicContact CG-CB 4.06Å; L421-A429 HydrophobicContact CB-CB 4.3Å; L421-A429 HydrophobicContact CD2-CB 4.46Å; L421-A429 HydrophobicContact CG-CB 4.37Å; L421-V432 HydrophobicContact CD2-CB 4.43Å; L421-V432 HydrophobicContact CD2-CG2 3.67Å
422	K	86.7	Confident	85.6	Confident	144 Å²	144	67.6 Å²	67.6	63%	0.626	33%	0.328	S	S	*	.	H	α-helix	trans	-60.7	-25.6	178.7	-167.9	175.6	-179.7	-177.6	0	113.4	Q418 Q420 I424 A429	Q418-K422 WeakPolarHBondContact O-CB 3.48Å; Q418-K422 PolarHBondContact O-N 3.1Å; Q420-K422 VanDerWaalsContact C-N 3.29Å; Q420-K422 PolarHBondContact O-N 3Å; K422-I424 VanDerWaalsContact C-N 3.3Å; K422-A429 HydrophobicContact CB-CB 3.64Å; K422-A429 HydrophobicContact CG-CB 4.15Å
423	K	84.3	Confident	85.3	Confident	183 Å²	183	71.5 Å²	71.5	80%	0.796	34%	0.339	S	S	*	.	H	α-helix	trans	-76.7	-19.4	175.8	-63.2	178.2	-178.6	179.9	0	112.6	Q420 L421	Q420-K423 WeakPolarHBondContact O-CB 3.49Å; Q420-K423 PolarHBondContact O-N 3.36Å; L421-K423 PolarHBondContact O-N 3.28Å; L421-K423 VanDerWaalsContact O-N 3.15Å
424	I	80.9	Confident	84.7	Confident	73 Å²	73	74.3 Å²	74.3	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-101.7	-54.2	-178.3	-53.9	-178.3	0	0	0	110.1	K358 L362 L421 K422	K358-I424 HydrophobicContact CB-CD1 3.66Å; K358-I424 HydrophobicContact CD-CD1 4.45Å; L362-I424 HydrophobicContact CD1-CD1 3.68Å; L421-I424 PolarHBondContact O-N 2.99Å; K422-I424 VanDerWaalsContact C-N 3.3Å
425	C	81.4	Confident	84	Confident	43 Å²	43	74.8 Å²	74.8	29%	0.291	35%	0.352	S	S	.	.			trans	-139.9	110.8	-179.9	-177.3	0	0	0	0	110	L359 L421 D427 A428 A429	L359-C425 HydrophobicContact CD1-CB 4.02Å; L421-C425 CarbonylContact O-C 3.58Å; L421-C425 PolarHBondContact O-N 3.32Å; C425-D427 VanDerWaalsContact C-N 3.35Å; C425-D427 PolarHBondContact O-N 3.49Å; C425-A428 HydrophobicContact CB-CB 3.86Å; C425-A429 PolarHBondContact O-N 2.94Å
426	S	84	Confident	82.9	Confident	81 Å²	81	80.6 Å²	80.6	57%	0.566	37%	0.374	S	S	*	.	H	α-helix	trans	-64.8	-38.1	179.8	52.4	0	0	0	0	112.6	A429 E430	S426-A429 PolarHBondContact O-N 3.24Å; S426-E430 PolarHBondContact O-N 2.97Å; S426-E430 VanDerWaalsContact O-N 3.07Å
427	D	84.1	Confident	81.8	Confident	95 Å²	95	83 Å²	83	51%	0.508	38%	0.379	S	S	.	.	H	α-helix	trans	-67.3	-43.4	-178.2	-166.3	33.5	0	0	0	111.7	C425 A429 E430 K431	C425-D427 VanDerWaalsContact C-N 3.35Å; C425-D427 PolarHBondContact O-N 3.49Å; D427-A429 VanDerWaalsContact C-N 3.33Å; D427-A429 PolarHBondContact O-N 3.09Å; D427-E430 PolarHBondContact O-N 2.72Å; D427-E430 VanDerWaalsContact O-N 3.12Å; D427-K431 PolarHBondContact O-N 3.45Å
428	A	80.2	Confident	80.6	Confident	4 Å²	4	86.2 Å²	86.2	3%	0.033	39%	0.392	C	S	.	.	H	α-helix	trans	-58.5	-43.5	172.6	0	0	0	0	0	112	L359 L421 C425 E430 K431 V432 I479	L359-A428 HydrophobicContact CD1-CB 4.14Å; L421-A428 HydrophobicContact CD1-CB 4.39Å; L421-A428 HydrophobicContact CD2-CB 3.93Å; L421-A428 HydrophobicContact CG-CB 4.06Å; C425-A428 HydrophobicContact CB-CB 3.86Å; A428-E430 VanDerWaalsContact C-N 3.29Å; A428-E430 PolarHBondContact O-N 3.42Å; A428-K431 WeakPolarHBondContact O-CB 3.23Å; A428-K431 PolarHBondContact O-N 3.01Å; A428-V432 WeakPolarHBondContact O-CG2 3.45Å; A428-V432 PolarHBondContact O-N 3.01Å; A428-I479 HydrophobicContact CB-CB 4.41Å; A428-I479 HydrophobicContact CB-CD1 4.21Å; A428-I479 HydrophobicContact CB-CG1 4.1Å; A428-I479 HydrophobicContact CB-CG2 3.51Å
429	A	83	Confident	79.4	Confident	3 Å²	3	85.8 Å²	85.8	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-65.2	-29.6	176.9	0	0	0	0	0	113.5	Q418 L421 K422 C425 S426 D427 R433	Q418-A429 HydrophobicContact CG-CB 4.24Å; Q418-A429 PolarHBondContact NE2-O 3.31Å; L421-A429 HydrophobicContact CB-CB 4.3Å; L421-A429 HydrophobicContact CD2-CB 4.46Å; L421-A429 HydrophobicContact CG-CB 4.37Å; K422-A429 HydrophobicContact CB-CB 3.64Å; K422-A429 HydrophobicContact CG-CB 4.15Å; C425-A429 PolarHBondContact O-N 2.94Å; S426-A429 PolarHBondContact O-N 3.24Å; D427-A429 VanDerWaalsContact C-N 3.33Å; D427-A429 PolarHBondContact O-N 3.09Å; A429-R433 PolarHBondContact O-N 3.41Å; A429-R433 VanDerWaalsContact O-N 3.12Å
430	E	84.4	Confident	77.9	Confident	106 Å²	106	80 Å²	80	50%	0.495	37%	0.371	S	S	.	.	H	α-helix	trans	-72.4	-40.1	172.2	-73.2	-150.6	161.4	0	0	112.6	S426 D427 A428 R433 K434	S426-E430 PolarHBondContact O-N 2.97Å; S426-E430 VanDerWaalsContact O-N 3.07Å; D427-E430 PolarHBondContact O-N 2.72Å; D427-E430 VanDerWaalsContact O-N 3.12Å; A428-E430 VanDerWaalsContact C-N 3.29Å; A428-E430 PolarHBondContact O-N 3.42Å; E430-R433 WeakPolarHBondContact O-CB 3.47Å; E430-R433 PolarHBondContact O-N 3.08Å; E430-K434 WeakPolarHBondContact O-CG 3.41Å; E430-K434 PolarHBondContact O-N 3.43Å
431	K	82.9	Confident	76.3	Confident	55 Å²	55	85.8 Å²	85.8	24%	0.239	39%	0.388	C	S	.	.	H	α-helix	trans	-58.7	-47.9	173.7	-72.9	-176.9	-177	-176.5	0	111.1	D427 A428 R433 K434 T475 S478 I479	D427-K431 PolarHBondContact O-N 3.45Å; A428-K431 WeakPolarHBondContact O-CB 3.23Å; A428-K431 PolarHBondContact O-N 3.01Å; K431-R433 VanDerWaalsContact C-N 3.3Å; K431-R433 PolarHBondContact O-N 3.09Å; K431-K434 WeakPolarHBondContact O-CB 3.18Å; K431-K434 PolarHBondContact O-N 3.33Å; K431-K434 VanDerWaalsContact O-N 3.09Å; K431-T475 HydrophobicContact CB-CG2 3.74Å; K431-T475 HydrophobicContact CD-CG2 4.49Å; K431-T475 HydrophobicContact CG-CG2 4.41Å; K431-S478 PolarHBondContact NZ-O 3Å; K431-S478 PolarHBondContact NZ-OG 2.96Å; K431-I479 HydrophobicContact CB-CD1 4.09Å; K431-I479 HydrophobicContact CB-CG1 4.24Å; K431-I479 HydrophobicContact CD-CG1 3.78Å
432	V	80.8	Confident	74.5	Confident	3 Å²	3	94.8 Å²	94.8	2%	0.018	43%	0.427	C	S	.	.	H	α-helix	trans	-61.4	-37.2	175.3	176	0	0	0	0	111.8	I366 I414 Q418 L421 A428 K434 L435 L476 I479	I366-V432 HydrophobicContact CD1-CG1 4.14Å; I366-V432 HydrophobicContact CD1-CG2 4.06Å; I366-V432 HydrophobicContact CG2-CG1 4.01Å; I366-V432 HydrophobicContact CG2-CG2 4.39Å; I414-V432 HydrophobicContact CG2-CG1 3.99Å; Q418-V432 HydrophobicContact CB-CG1 4.29Å; Q418-V432 HydrophobicContact CG-CB 4.32Å; Q418-V432 HydrophobicContact CG-CG1 4.16Å; L421-V432 HydrophobicContact CD2-CB 4.43Å; L421-V432 HydrophobicContact CD2-CG2 3.67Å; A428-V432 WeakPolarHBondContact O-CG2 3.45Å; A428-V432 PolarHBondContact O-N 3.01Å; V432-K434 PolarHBondContact O-N 3.17Å; V432-L435 VanDerWaalsContact O-CB 3.31Å; V432-L435 WeakPolarHBondContact O-CB 3.47Å; V432-L435 WeakPolarHBondContact O-CG 3.48Å; V432-L435 PolarHBondContact O-N 3.42Å; V432-L435 VanDerWaalsContact O-N 3.09Å; V432-L476 HydrophobicContact CG2-CD2 4.36Å; V432-I479 HydrophobicContact CG2-CD1 3.75Å
433	R	82.4	Confident	72.7	Confident	185 Å²	185	99.1 Å²	99.1	70%	0.698	44%	0.44	S	S	*	.	H	α-helix	trans	-60.7	-31.2	176.1	-151.6	177.1	103.5	-178.8	5.4	113.2	A429 E430 K431 L435	A429-R433 PolarHBondContact O-N 3.41Å; A429-R433 VanDerWaalsContact O-N 3.12Å; E430-R433 WeakPolarHBondContact O-CB 3.47Å; E430-R433 PolarHBondContact O-N 3.08Å; K431-R433 VanDerWaalsContact C-N 3.3Å; K431-R433 PolarHBondContact O-N 3.09Å; R433-L435 PolarHBondContact O-N 3.38Å
434	K	79.3	Confident	71	Confident	146 Å²	146	92 Å²	92	64%	0.635	41%	0.413	S	S	*	.	H	α-helix	trans	-76.2	-13.4	-179.1	-69.8	169.7	-176.1	169	0	112	E430 K431 V432 K436	E430-K434 WeakPolarHBondContact O-CG 3.41Å; E430-K434 PolarHBondContact O-N 3.43Å; K431-K434 WeakPolarHBondContact O-CB 3.18Å; K431-K434 PolarHBondContact O-N 3.33Å; K431-K434 VanDerWaalsContact O-N 3.09Å; V432-K434 PolarHBondContact O-N 3.17Å; K434-K436 PolarHBondContact O-N 2.86Å
435	L	74.2	Confident	69.3	Low	19 Å²	19	94.1 Å²	94.1	10%	0.099	43%	0.429	C	S	.	.			trans	-71.9	107.1	179	-55.5	-177.2	0	0	0	111	H370 V432 R433 N472 T475 L476	H370-L435 VanDerWaalsContact NE2-CD1 3.32Å; H370-L435 WeakPolarHBondContact NE2-CD1 3.44Å; V432-L435 VanDerWaalsContact O-CB 3.31Å; V432-L435 WeakPolarHBondContact O-CB 3.47Å; V432-L435 WeakPolarHBondContact O-CG 3.48Å; V432-L435 PolarHBondContact O-N 3.42Å; V432-L435 VanDerWaalsContact O-N 3.09Å; R433-L435 PolarHBondContact O-N 3.38Å; L435-N472 HydrophobicContact CD2-CB 4.46Å; L435-N472 WeakPolarHBondContact CD2-OD1 3.5Å; L435-T475 HydrophobicContact CD2-CG2 3.83Å; L435-L476 HydrophobicContact CD1-CD2 4.34Å; L435-L476 HydrophobicContact CD1-CG 4.38Å
436	K	66.8	Low	67.7	Low	154 Å²	154	96 Å²	96	67%	0.67	45%	0.448	S	S	*	.			trans	-93.9	146.1	-178.5	-68.6	-179.8	-178.8	177.5	0	110.6	R373 K434	R373-K436 VanDerWaalsContact NH2-C 3.31Å; K434-K436 PolarHBondContact O-N 2.86Å
437	Y	66.5	Low	66.1	Low	110 Å²	110	95.6 Å²	95.6	43%	0.431	46%	0.456	S	S	.	.			trans	-96.8	147.9	158.3	58.3	-81.8	0	0	0	108.6	L407 T411 F439	L407-Y437 HydrophobicContact CD2-CD1 4.3Å; L407-Y437 HydrophobicContact CD2-CD2 3.12Å; L407-Y437 HydrophobicContact CD2-CE2 3.73Å; L407-Y437 HydrophobicContact CD2-CG 3.45Å; L407-Y437 VanDerWaalsContact CD2-CG 3.45Å; T411-Y437 HydrophobicContact CG2-CE1 4.04Å; Y437-F439 HydrophobicContact CD2-CB 4.07Å; Y437-F439 HydrophobicContact CE2-CB 4.11Å
438	F	64	Low	64.6	Low	98 Å²	98	100.8 Å²	100.8	43%	0.43	47%	0.474	S	S	.	.			trans	-104.1	109.9	165.4	-79.5	-83	0	0	0	108.3	F461	F438-F461 HydrophobicContact CB-CE2 4.49Å; F438-F461 WeakPolarHBondContact O-CE2 3.43Å
439	F	62.2	Low	63.7	Low	31 Å²	31	104.3 Å²	104.3	14%	0.136	50%	0.495	C	S	.	.			trans	-104.3	132.5	159.8	-164	-101.3	0	0	0	107.5	W380 R400 A403 E404 L407 Y437 R441	W380-F439 AromaticContact CD1-CE2 3.98Å; W380-F439 HydrophobicContact CD2-CZ 4.41Å; W380-F439 HydrophobicContact CG-CE2 4.09Å; W380-F439 HydrophobicContact CG-CZ 4.44Å; R400-F439 HydrophobicContact CG-CZ 4.1Å; A403-F439 HydrophobicContact CB-CE2 4.16Å; E404-F439 HydrophobicContact CG-CD1 4.19Å; E404-F439 HydrophobicContact CG-CE1 3.41Å; E404-F439 VanDerWaalsContact CG-CE1 3.41Å; E404-F439 HydrophobicContact CG-CE2 4.05Å; E404-F439 HydrophobicContact CG-CZ 3.33Å; E404-F439 VanDerWaalsContact OE1-CE1 3.28Å; E404-F439 WeakPolarHBondContact OE1-CE1 3.47Å; L407-F439 HydrophobicContact CD1-CD2 3.87Å; L407-F439 HydrophobicContact CD1-CE2 4.35Å; Y437-F439 HydrophobicContact CD2-CB 4.07Å; Y437-F439 HydrophobicContact CE2-CB 4.11Å; F439-R441 VanDerWaalsContact C-N 3.26Å; F439-R441 PolarHBondContact O-N 3.12Å
440	L	55.7	Low	62.8	Low	46 Å²	46	106.6 Å²	106.6	24%	0.241	51%	0.51	C	S	.	.			trans	-61.2	86.6	176.8	-93.2	157.8	0	0	0	109.6	I384 K442 V457 F461	I384-L440 HydrophobicContact CD1-CD1 3.93Å; L440-K442 PolarHBondContact O-N 3.17Å; L440-V457 HydrophobicContact CD2-CG1 4.38Å; L440-F461 HydrophobicContact CB-CE2 4.4Å; L440-F461 HydrophobicContact CD1-CB 3.87Å; L440-F461 HydrophobicContact CD1-CD1 3.83Å; L440-F461 HydrophobicContact CD1-CD2 3.49Å; L440-F461 VanDerWaalsContact CD1-CD2 3.49Å; L440-F461 HydrophobicContact CD1-CE1 4.23Å; L440-F461 HydrophobicContact CD1-CE2 3.93Å; L440-F461 HydrophobicContact CD1-CG 3.44Å; L440-F461 VanDerWaalsContact CD1-CG 3.44Å; L440-F461 HydrophobicContact CD1-CZ 4.29Å; L440-F461 HydrophobicContact CG-CD2 3.55Å; L440-F461 HydrophobicContact CG-CE2 3.8Å; L440-F461 HydrophobicContact CG-CG 4.06Å; L440-F461 HydrophobicContact CG-CZ 4.49Å
441	R	53	Low	62	Low	223 Å²	223	109.1 Å²	109.1	84%	0.842	52%	0.515	S	S	*	.			trans	-76	-19.9	-168.6	-154.8	171.5	-178.1	-174.6	-0.1	113.4	F439	F439-R441 VanDerWaalsContact C-N 3.26Å; F439-R441 PolarHBondContact O-N 3.12Å
442	K	47	Very low	61.5	Low	189 Å²	189	113.7 Å²	113.7	82%	0.822	54%	0.538	S	S	*	.	S	Bend	trans	-162	109.4	179.6	-70.6	-172.1	174.1	175.8	0	111.7	L440	L440-K442 PolarHBondContact O-N 3.17Å
443	R	48.9	Very low	61.1	Low	234 Å²	234	116.8 Å²	116.8	88%	0.883	55%	0.554	S	S	*	*			trans	171.2	-11.2	137	-101	176.7	169.8	173.9	-3.4	118	V445	R443-V445 PolarHBondContact O-N 3.15Å
444	C	48.4	Very low	60.5	Low	35 Å²	35	109 Å²	109	24%	0.236	53%	0.525	C	S	.	.			trans	-78.7	33.2	-177.7	-57.5	0	0	0	0	114.5	Y454	C444-Y454 HydrophobicContact CB-CE1 3.96Å; C444-Y454 PolarHBondContact O-OH 3.24Å
445	V	46.1	Very low	60.2	Low	116 Å²	116	106.3 Å²	106.3	70%	0.703	52%	0.515	S	S	*	.			trans	-104.5	121.2	-176.2	-179.3	0	0	0	0	109.2	R443	R443-V445 PolarHBondContact O-N 3.15Å
446	A	48.3	Very low	60.3	Low	84 Å²	84	111.2 Å²	111.2	69%	0.694	54%	0.537	S	S	*	.	S	Bend	trans	72.1	82.1	160.4	0	0	0	0	0	117.7	K448	A446-K448 PolarHBondContact O-N 2.83Å; A446-K448 VanDerWaalsContact O-N 3.12Å
447	G	50.5	Low	60.7	Low	71 Å²	71	106.5 Å²	106.5	73%	0.732	52%	0.521	S	S	*	.	S	Bend		77.5	8.4	120.7	0	0	0	0	0	120.3
448	K	52.7	Low	61	Low	205 Å²	205	101.5 Å²	101.5	89%	0.891	50%	0.503	S	S	*	.			trans	-131.8	14.2	176.9	-71.5	-170.3	177	-177	0	115.6	A446	A446-K448 PolarHBondContact O-N 2.83Å; A446-K448 VanDerWaalsContact O-N 3.12Å
449	V	60.5	Low	61.7	Low	77 Å²	77	99.2 Å²	99.2	47%	0.467	50%	0.501	S	S	.	.			trans	-108.4	135.9	-172.2	176.4	0	0	0	0	109	D453 Y454	V449-D453 HydrophobicContact CG1-CB 3.22Å; V449-Y454 HydrophobicContact CB-CD2 4.16Å; V449-Y454 HydrophobicContact CB-CE2 3.81Å; V449-Y454 HydrophobicContact CG1-CD2 3.87Å; V449-Y454 HydrophobicContact CG1-CE2 3.99Å
450	S	63.9	Low	62.6	Low	51 Å²	51	101.3 Å²	101.3	36%	0.357	51%	0.514	S	S	.	.			trans	-67.9	160.4	-175.5	81	0	0	0	0	110.9	Q452 D453 Y454	S450-Q452 PolarHBondContact O-N 2.93Å; S450-Q452 PolarHBondContact OG-N 2.92Å; S450-D453 WeakPolarHBondContact CB-OD2 3.16Å; S450-D453 PolarHBondContact N-OD2 2.8Å; S450-D453 PolarHBondContact O-N 2.82Å; S450-D453 PolarHBondContact OG-N 3.35Å; S450-D453 PolarHBondContact OG-OD1 3.45Å; S450-D453 PolarHBondContact OG-OD2 3.34Å; S450-Y454 PolarHBondContact O-N 2.98Å
451	R	67.2	Low	63.7	Low	159 Å²	159	99.5 Å²	99.5	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-57.7	-35.3	174.3	-178.1	179.5	174.8	179	0.4	111.6	Y454 Q455	R451-Y454 PolarHBondContact O-N 3.07Å; R451-Q455 WeakPolarHBondContact O-CG 3.22Å; R451-Q455 PolarHBondContact O-N 3.46Å
452	Q	72.3	Confident	65.1	Low	151 Å²	151	92.4 Å²	92.4	71%	0.706	48%	0.478	S	S	*	.	H	α-helix	trans	-65.3	-45	178.8	-74.4	177.4	-30.7	0	0	111.2	S450 Y454 Q455 E456	S450-Q452 PolarHBondContact O-N 2.93Å; S450-Q452 PolarHBondContact OG-N 2.92Å; Q452-Y454 VanDerWaalsContact C-N 3.3Å; Q452-Y454 PolarHBondContact O-N 3.38Å; Q452-Q455 PolarHBondContact O-N 3.39Å; Q452-Q455 VanDerWaalsContact O-N 3.16Å; Q452-E456 PolarHBondContact O-N 3.32Å
453	D	73.4	Confident	66.9	Low	68 Å²	68	87.8 Å²	87.8	36%	0.364	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-37.8	179.4	-57.3	-33.5	0	0	0	112	V449 S450 E456 V457	V449-D453 HydrophobicContact CG1-CB 3.22Å; S450-D453 WeakPolarHBondContact CB-OD2 3.16Å; S450-D453 PolarHBondContact N-OD2 2.8Å; S450-D453 PolarHBondContact O-N 2.82Å; S450-D453 PolarHBondContact OG-N 3.35Å; S450-D453 PolarHBondContact OG-OD1 3.45Å; S450-D453 PolarHBondContact OG-OD2 3.34Å; D453-E456 PolarHBondContact O-N 3.42Å; D453-V457 WeakPolarHBondContact O-CB 3.37Å; D453-V457 WeakPolarHBondContact O-CG2 3.37Å; D453-V457 PolarHBondContact O-N 2.89Å
454	Y	69.4	Low	68.5	Low	22 Å²	22	83.3 Å²	83.3	9%	0.086	44%	0.444	C	S	.	.	H	α-helix	trans	-66	-42	175.7	-93.6	-82.8	0	0	0	112.5	I384 Y387 C388 C444 V449 S450 R451 Q452 E456 V457 A458	I384-Y454 HydrophobicContact CG2-CD1 4.16Å; Y387-Y454 HydrophobicContact CD1-CE1 4.42Å; Y387-Y454 HydrophobicContact CE1-CE1 4.47Å; C388-Y454 VanDerWaalsContact SG-CB 3.51Å; C444-Y454 HydrophobicContact CB-CE1 3.96Å; C444-Y454 PolarHBondContact O-OH 3.24Å; V449-Y454 HydrophobicContact CB-CD2 4.16Å; V449-Y454 HydrophobicContact CB-CE2 3.81Å; V449-Y454 HydrophobicContact CG1-CD2 3.87Å; V449-Y454 HydrophobicContact CG1-CE2 3.99Å; S450-Y454 PolarHBondContact O-N 2.98Å; R451-Y454 PolarHBondContact O-N 3.07Å; Q452-Y454 VanDerWaalsContact C-N 3.3Å; Q452-Y454 PolarHBondContact O-N 3.38Å; Y454-E456 VanDerWaalsContact C-N 3.33Å; Y454-V457 PolarHBondContact O-N 2.64Å; Y454-A458 WeakPolarHBondContact O-CB 3.39Å; Y454-A458 PolarHBondContact O-N 2.96Å
455	Q	72.5	Confident	70	Confident	90 Å²	90	82.1 Å²	82.1	42%	0.421	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-40.3	176.6	-73.2	-179.7	-38.7	0	0	111.1	R451 Q452 A458 A459	R451-Q455 WeakPolarHBondContact O-CG 3.22Å; R451-Q455 PolarHBondContact O-N 3.46Å; Q452-Q455 PolarHBondContact O-N 3.39Å; Q452-Q455 VanDerWaalsContact O-N 3.16Å; Q455-A458 PolarHBondContact O-N 3.36Å; Q455-A459 VanDerWaalsContact O-CB 3.31Å; Q455-A459 WeakPolarHBondContact O-CB 3.5Å; Q455-A459 PolarHBondContact O-N 3.42Å
456	E	78.3	Confident	71.8	Confident	121 Å²	121	80.5 Å²	80.5	57%	0.565	42%	0.423	S	S	*	.	H	α-helix	trans	-66.8	-40.4	176.9	-164.8	-178.9	174.1	0	0	111.8	Q452 D453 Y454 A459 N460	Q452-E456 PolarHBondContact O-N 3.32Å; D453-E456 PolarHBondContact O-N 3.42Å; Y454-E456 VanDerWaalsContact C-N 3.33Å; E456-A459 PolarHBondContact O-N 3.26Å; E456-N460 VanDerWaalsContact O-CB 3.27Å; E456-N460 WeakPolarHBondContact O-CB 3.04Å; E456-N460 VanDerWaalsContact O-CG 3.31Å; E456-N460 PolarHBondContact O-N 3.32Å; E456-N460 PolarHBondContact O-ND2 2.96Å; E456-N460 VanDerWaalsContact O-ND2 3.1Å
457	V	74.1	Confident	73.5	Confident	56 Å²	56	80.2 Å²	80.2	34%	0.339	41%	0.409	S	S	.	.	H	α-helix	trans	-64.5	-41.7	174.2	170.4	0	0	0	0	111.3	L440 D453 Y454 F461	L440-V457 HydrophobicContact CD2-CG1 4.38Å; D453-V457 WeakPolarHBondContact O-CB 3.37Å; D453-V457 WeakPolarHBondContact O-CG2 3.37Å; D453-V457 PolarHBondContact O-N 2.89Å; Y454-V457 PolarHBondContact O-N 2.64Å; V457-F461 VanDerWaalsContact O-CB 3.27Å; V457-F461 WeakPolarHBondContact O-CB 3.28Å; V457-F461 PolarHBondContact O-N 3.18Å
458	A	72.4	Confident	74.9	Confident	5 Å²	5	77.6 Å²	77.6	4%	0.041	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-43	176.5	0	0	0	0	0	111.9	I384 Y454 Q455 F461 R462	I384-A458 HydrophobicContact CG2-CB 4.23Å; Y454-A458 WeakPolarHBondContact O-CB 3.39Å; Y454-A458 PolarHBondContact O-N 2.96Å; Q455-A458 PolarHBondContact O-N 3.36Å; A458-F461 WeakPolarHBondContact O-CB 3.43Å; A458-F461 PolarHBondContact O-N 3.49Å; A458-R462 PolarHBondContact O-N 2.92Å
459	A	78.6	Confident	76.3	Confident	49 Å²	49	71 Å²	71	41%	0.405	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-48	176.5	0	0	0	0	0	111.7	Q455 E456 F461 R462 I463	Q455-A459 VanDerWaalsContact O-CB 3.31Å; Q455-A459 WeakPolarHBondContact O-CB 3.5Å; Q455-A459 PolarHBondContact O-N 3.42Å; E456-A459 PolarHBondContact O-N 3.26Å; A459-F461 PolarHBondContact O-N 2.98Å; A459-R462 PolarHBondContact O-N 3.35Å; A459-R462 VanDerWaalsContact O-N 3.16Å; A459-I463 WeakPolarHBondContact O-CG1 3.35Å; A459-I463 PolarHBondContact O-N 2.83Å
460	N	81.6	Confident	77.4	Confident	76 Å²	76	73.8 Å²	73.8	41%	0.406	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-33.2	174.5	-78.6	-39.6	0	0	0	112.3	E456 R464	E456-N460 VanDerWaalsContact O-CB 3.27Å; E456-N460 WeakPolarHBondContact O-CB 3.04Å; E456-N460 VanDerWaalsContact O-CG 3.31Å; E456-N460 PolarHBondContact O-N 3.32Å; E456-N460 PolarHBondContact O-ND2 2.96Å; E456-N460 VanDerWaalsContact O-ND2 3.1Å; N460-R464 WeakPolarHBondContact O-CG 3.48Å; N460-R464 PolarHBondContact O-N 3.1Å
461	F	79.8	Confident	78.3	Confident	7 Å²	7	77.9 Å²	77.9	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-69.1	-44.5	174.5	-174.6	-117.3	0	0	0	111.8	C377 W380 A381 F438 L440 V457 A458 A459 I463 R464 I465	C377-F461 HydrophobicContact CB-CE1 4.49Å; C377-F461 HydrophobicContact CB-CZ 4.31Å; W380-F461 AromaticContact CD1-CE1 3.71Å; W380-F461 AromaticContact CD1-CZ 3.98Å; A381-F461 HydrophobicContact CB-CD1 3.95Å; A381-F461 HydrophobicContact CB-CE1 4.26Å; F438-F461 HydrophobicContact CB-CE2 4.49Å; F438-F461 WeakPolarHBondContact O-CE2 3.43Å; L440-F461 HydrophobicContact CB-CE2 4.4Å; L440-F461 HydrophobicContact CD1-CB 3.87Å; L440-F461 HydrophobicContact CD1-CD1 3.83Å; L440-F461 HydrophobicContact CD1-CD2 3.49Å; L440-F461 VanDerWaalsContact CD1-CD2 3.49Å; L440-F461 HydrophobicContact CD1-CE1 4.23Å; L440-F461 HydrophobicContact CD1-CE2 3.93Å; L440-F461 HydrophobicContact CD1-CG 3.44Å; L440-F461 VanDerWaalsContact CD1-CG 3.44Å; L440-F461 HydrophobicContact CD1-CZ 4.29Å; L440-F461 HydrophobicContact CG-CD2 3.55Å; L440-F461 HydrophobicContact CG-CE2 3.8Å; L440-F461 HydrophobicContact CG-CG 4.06Å; L440-F461 HydrophobicContact CG-CZ 4.49Å; V457-F461 VanDerWaalsContact O-CB 3.27Å; V457-F461 WeakPolarHBondContact O-CB 3.28Å; V457-F461 PolarHBondContact O-N 3.18Å; A458-F461 WeakPolarHBondContact O-CB 3.43Å; A458-F461 PolarHBondContact O-N 3.49Å; A459-F461 PolarHBondContact O-N 2.98Å; F461-I463 PolarHBondContact O-N 2.88Å; F461-R464 PolarHBondContact O-N 3.39Å; F461-R464 VanDerWaalsContact O-N 3.17Å; F461-I465 HydrophobicContact CD1-CD1 3.8Å; F461-I465 HydrophobicContact CE1-CD1 3.57Å; F461-I465 HydrophobicContact CE1-CG1 4.28Å; F461-I465 HydrophobicContact CG-CD1 4.48Å; F461-I465 HydrophobicContact CZ-CD1 4.06Å; F461-I465 HydrophobicContact CZ-CG1 4.31Å; F461-I465 WeakPolarHBondContact O-CG1 3.37Å; F461-I465 PolarHBondContact O-N 3.43Å
462	R	80.8	Confident	79	Confident	74 Å²	74	70.8 Å²	70.8	28%	0.279	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-42.3	174.3	-70	-170.1	-164.9	-96.5	5.1	112.4	A381 D382 E385 A458 A459 R464 I465 N466	A381-R462 HydrophobicContact CB-CG 4.06Å; D382-R462 IonicContact OD1-CZ 3.99Å; D382-R462 VanDerWaalsContact OD1-CZ 3.25Å; D382-R462 IonicContact OD1-NH1 3.76Å; D382-R462 PolarHBondContact OD1-NH1 3.41Å; D382-R462 IonicContact OD1-NH2 3.93Å; D382-R462 PolarHBondContact OD1-NH2 3.1Å; E385-R462 IonicContact OE2-CZ 2.67Å; E385-R462 IonicContact OE2-NH2 3.43Å; E385-R462 PolarHBondContact OE2-NH2 2.89Å; A458-R462 PolarHBondContact O-N 2.92Å; A459-R462 PolarHBondContact O-N 3.35Å; A459-R462 VanDerWaalsContact O-N 3.16Å; R462-R464 VanDerWaalsContact C-N 3.29Å; R462-R464 PolarHBondContact O-N 3.4Å; R462-I465 WeakPolarHBondContact O-CB 3.46Å; R462-I465 PolarHBondContact O-N 2.94Å; R462-I465 VanDerWaalsContact O-N 3.11Å; R462-N466 PolarHBondContact O-N 3.41Å
463	I	84.8	Confident	79.3	Confident	93 Å²	93	66.6 Å²	66.6	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-57.4	-44.6	174.7	-67.1	166.6	0	0	0	110.6	A459 F461 I465 N466 D467	A459-I463 WeakPolarHBondContact O-CG1 3.35Å; A459-I463 PolarHBondContact O-N 2.83Å; F461-I463 PolarHBondContact O-N 2.88Å; I463-I465 VanDerWaalsContact C-N 3.33Å; I463-I465 PolarHBondContact O-N 3.08Å; I463-N466 PolarHBondContact O-N 2.99Å; I463-D467 PolarHBondContact O-N 3.19Å
464	R	82.7	Confident	79.8	Confident	140 Å²	140	70.1 Å²	70.1	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-67.4	-30.7	177.6	-71.8	177.5	-175.8	-169.7	2.2	113.8	N460 F461 R462 A468	N460-R464 WeakPolarHBondContact O-CG 3.48Å; N460-R464 PolarHBondContact O-N 3.1Å; F461-R464 PolarHBondContact O-N 3.39Å; F461-R464 VanDerWaalsContact O-N 3.17Å; R462-R464 VanDerWaalsContact C-N 3.29Å; R462-R464 PolarHBondContact O-N 3.4Å; R464-A468 VanDerWaalsContact O-CB 3.25Å; R464-A468 WeakPolarHBondContact O-CB 3.4Å; R464-A468 PolarHBondContact O-N 3.36Å; R464-A468 VanDerWaalsContact O-N 3.12Å
465	I	81.3	Confident	80.4	Confident	9 Å²	9	70.7 Å²	70.7	5%	0.046	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-49.8	172.9	-68	166.8	0	0	0	109	T374 C377 E378 F461 R462 I463 A468 M469	T374-I465 HydrophobicContact CG2-CG2 3.67Å; C377-I465 HydrophobicContact CB-CD1 3.57Å; C377-I465 HydrophobicContact CB-CG1 3.83Å; E378-I465 HydrophobicContact CG-CG2 4.36Å; F461-I465 HydrophobicContact CD1-CD1 3.8Å; F461-I465 HydrophobicContact CE1-CD1 3.57Å; F461-I465 HydrophobicContact CE1-CG1 4.28Å; F461-I465 HydrophobicContact CG-CD1 4.48Å; F461-I465 HydrophobicContact CZ-CD1 4.06Å; F461-I465 HydrophobicContact CZ-CG1 4.31Å; F461-I465 WeakPolarHBondContact O-CG1 3.37Å; F461-I465 PolarHBondContact O-N 3.43Å; R462-I465 WeakPolarHBondContact O-CB 3.46Å; R462-I465 PolarHBondContact O-N 2.94Å; R462-I465 VanDerWaalsContact O-N 3.11Å; I463-I465 VanDerWaalsContact C-N 3.33Å; I463-I465 PolarHBondContact O-N 3.08Å; I465-A468 PolarHBondContact O-N 2.9Å; I465-M469 WeakPolarHBondContact O-CB 3.5Å; I465-M469 PolarHBondContact O-N 2.95Å
466	N	82.7	Confident	80.7	Confident	82 Å²	82	67.1 Å²	67.1	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-47.2	-179.5	-67.9	-7	0	0	0	112	R462 I463 A468 M469 E470	R462-N466 PolarHBondContact O-N 3.41Å; I463-N466 PolarHBondContact O-N 2.99Å; N466-A468 PolarHBondContact O-N 3.41Å; N466-M469 WeakPolarHBondContact O-CB 3.39Å; N466-M469 PolarHBondContact O-N 3.45Å; N466-M469 VanDerWaalsContact O-N 3.09Å; N466-E470 PolarHBondContact O-N 3.37Å
467	D	84.6	Confident	80.7	Confident	78 Å²	78	70.8 Å²	70.8	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-57.6	-37.7	175	-83.5	8	0	0	0	112.3	I463 K471	I463-D467 PolarHBondContact O-N 3.19Å; D467-K471 WeakPolarHBondContact O-CB 3.4Å; D467-K471 WeakPolarHBondContact O-CD 3.34Å; D467-K471 VanDerWaalsContact O-CG 3.23Å; D467-K471 WeakPolarHBondContact O-CG 3.48Å; D467-K471 PolarHBondContact O-N 3.08Å
468	A	80.5	Confident	81	Confident	17 Å²	17	70.7 Å²	70.7	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-72.4	-39	177.5	0	0	0	0	0	111.3	R464 I465 N466 K471 N472	R464-A468 VanDerWaalsContact O-CB 3.25Å; R464-A468 WeakPolarHBondContact O-CB 3.4Å; R464-A468 PolarHBondContact O-N 3.36Å; R464-A468 VanDerWaalsContact O-N 3.12Å; I465-A468 PolarHBondContact O-N 2.9Å; N466-A468 PolarHBondContact O-N 3.41Å; A468-K471 PolarHBondContact O-N 3.4Å; A468-N472 WeakPolarHBondContact O-CB 3.43Å; A468-N472 PolarHBondContact O-N 3.12Å; A468-N472 PolarHBondContact O-ND2 3.15Å; A468-N472 VanDerWaalsContact O-ND2 3.11Å; A468-N472 PolarHBondContact O-OD1 3.22Å
469	M	81	Confident	81.1	Confident	65 Å²	65	73 Å²	73	32%	0.32	36%	0.356	S	S	.	.	H	α-helix	trans	-61.8	-50.4	176.2	-173.9	-178.4	178.9	0	0	111	T374 I465 N466 K471 N472 I473	T374-M469 HydrophobicContact CG2-CB 4.49Å; T374-M469 HydrophobicContact CG2-CG 4.45Å; T374-M469 HydrophobicContact CG2-SD 3.96Å; I465-M469 WeakPolarHBondContact O-CB 3.5Å; I465-M469 PolarHBondContact O-N 2.95Å; N466-M469 WeakPolarHBondContact O-CB 3.39Å; N466-M469 PolarHBondContact O-N 3.45Å; N466-M469 VanDerWaalsContact O-N 3.09Å; M469-K471 VanDerWaalsContact C-N 3.33Å; M469-K471 PolarHBondContact O-N 3.31Å; M469-N472 PolarHBondContact O-N 2.91Å; M469-N472 VanDerWaalsContact O-N 3.13Å; M469-I473 HydrophobicContact CE-CD1 4.07Å; M469-I473 HydrophobicContact CG-CD1 3.95Å; M469-I473 WeakPolarHBondContact O-CG1 3.46Å; M469-I473 PolarHBondContact O-N 3.1Å
470	E	82.7	Confident	81.2	Confident	137 Å²	137	74.3 Å²	74.3	64%	0.64	35%	0.354	S	S	*	.	H	α-helix	trans	-59.2	-43.1	176.8	-73.8	-173.9	174.8	0	0	112.1	N466 N472 I473 H474	N466-E470 PolarHBondContact O-N 3.37Å; E470-N472 PolarHBondContact O-N 2.63Å; E470-I473 PolarHBondContact O-N 3.02Å; E470-H474 WeakPolarHBondContact O-CB 3.47Å; E470-H474 PolarHBondContact O-N 3.2Å
471	K	83.3	Confident	81.2	Confident	136 Å²	136	74.2 Å²	74.2	59%	0.591	35%	0.351	S	S	*	.	H	α-helix	trans	-64.3	-39.7	175.7	-75.8	173.6	-172.9	170.2	0	112.4	D467 A468 M469 T475	D467-K471 WeakPolarHBondContact O-CB 3.4Å; D467-K471 WeakPolarHBondContact O-CD 3.34Å; D467-K471 VanDerWaalsContact O-CG 3.23Å; D467-K471 WeakPolarHBondContact O-CG 3.48Å; D467-K471 PolarHBondContact O-N 3.08Å; A468-K471 PolarHBondContact O-N 3.4Å; M469-K471 VanDerWaalsContact C-N 3.33Å; M469-K471 PolarHBondContact O-N 3.31Å; K471-T475 VanDerWaalsContact O-CB 3.25Å; K471-T475 WeakPolarHBondContact O-CB 3.46Å; K471-T475 PolarHBondContact O-N 3.16Å; K471-T475 PolarHBondContact O-OG1 2.92Å
472	N	81.4	Confident	81.3	Confident	11 Å²	11	77.9 Å²	77.9	6%	0.059	37%	0.369	C	S	.	.	H	α-helix	trans	-63.6	-49.6	176.9	-64.9	-23.6	0	0	0	110	H370 L435 A468 M469 E470 H474 T475 L476	H370-N472 PolarHBondContact ND1-ND2 3.05Å; L435-N472 HydrophobicContact CD2-CB 4.46Å; L435-N472 WeakPolarHBondContact CD2-OD1 3.5Å; A468-N472 WeakPolarHBondContact O-CB 3.43Å; A468-N472 PolarHBondContact O-N 3.12Å; A468-N472 PolarHBondContact O-ND2 3.15Å; A468-N472 VanDerWaalsContact O-ND2 3.11Å; A468-N472 PolarHBondContact O-OD1 3.22Å; M469-N472 PolarHBondContact O-N 2.91Å; M469-N472 VanDerWaalsContact O-N 3.13Å; E470-N472 PolarHBondContact O-N 2.63Å; N472-H474 PolarHBondContact O-N 3.01Å; N472-T475 PolarHBondContact O-N 3.13Å; N472-L476 WeakPolarHBondContact O-CB 3.24Å; N472-L476 VanDerWaalsContact O-CG 3.28Å; N472-L476 WeakPolarHBondContact O-CG 3.4Å; N472-L476 PolarHBondContact O-N 2.7Å
473	I	80.4	Confident	81.3	Confident	63 Å²	63	78.1 Å²	78.1	32%	0.323	37%	0.374	S	S	.	.	H	α-helix	trans	-56.3	-54	177.7	-69.9	170.9	0	0	0	110.3	M469 E470 T475 L476 Y477	M469-I473 HydrophobicContact CE-CD1 4.07Å; M469-I473 HydrophobicContact CG-CD1 3.95Å; M469-I473 WeakPolarHBondContact O-CG1 3.46Å; M469-I473 PolarHBondContact O-N 3.1Å; E470-I473 PolarHBondContact O-N 3.02Å; I473-T475 VanDerWaalsContact C-N 3.27Å; I473-T475 PolarHBondContact O-N 3.24Å; I473-L476 PolarHBondContact O-N 3.04Å; I473-Y477 HydrophobicContact CG2-CD2 3.54Å; I473-Y477 HydrophobicContact CG2-CE2 3.58Å; I473-Y477 VanDerWaalsContact O-CD2 3.28Å; I473-Y477 WeakPolarHBondContact O-CD2 3.5Å; I473-Y477 PolarHBondContact O-N 3.3Å
474	H	83.3	Confident	81.1	Confident	141 Å²	141	77.2 Å²	77.2	65%	0.653	37%	0.368	S	S	*	.	H	α-helix	trans	-63	-33.5	-178.9	-168.4	-59.7	0	0	0	112.6	E470 N472 S478	E470-H474 WeakPolarHBondContact O-CB 3.47Å; E470-H474 PolarHBondContact O-N 3.2Å; N472-H474 PolarHBondContact O-N 3.01Å; H474-S478 WeakPolarHBondContact O-CB 3.37Å; H474-S478 PolarHBondContact O-N 3.03Å
475	T	81.2	Confident	81	Confident	35 Å²	35	73 Å²	73	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-71.8	-41.6	177.5	-56.8	0	0	0	0	111	K431 L435 K471 N472 I473 S478 I479	K431-T475 HydrophobicContact CB-CG2 3.74Å; K431-T475 HydrophobicContact CD-CG2 4.49Å; K431-T475 HydrophobicContact CG-CG2 4.41Å; L435-T475 HydrophobicContact CD2-CG2 3.83Å; K471-T475 VanDerWaalsContact O-CB 3.25Å; K471-T475 WeakPolarHBondContact O-CB 3.46Å; K471-T475 PolarHBondContact O-N 3.16Å; K471-T475 PolarHBondContact O-OG1 2.92Å; N472-T475 PolarHBondContact O-N 3.13Å; I473-T475 VanDerWaalsContact C-N 3.27Å; I473-T475 PolarHBondContact O-N 3.24Å; T475-S478 PolarHBondContact O-N 3.44Å; T475-S478 PolarHBondContact O-OG 3.03Å; T475-I479 PolarHBondContact O-N 3.38Å
476	L	79.5	Confident	80.9	Confident	14 Å²	14	77.6 Å²	77.6	7%	0.073	38%	0.379	C	S	.	.	H	α-helix	trans	-67.6	-41.1	178.7	-69.4	168.7	0	0	0	111.7	T363 I366 V432 L435 N472 I473 S478 I479	T363-L476 HydrophobicContact CG2-CD2 4.06Å; I366-L476 HydrophobicContact CB-CD2 4.41Å; I366-L476 HydrophobicContact CG2-CD2 3.84Å; V432-L476 HydrophobicContact CG2-CD2 4.36Å; L435-L476 HydrophobicContact CD1-CD2 4.34Å; L435-L476 HydrophobicContact CD1-CG 4.38Å; N472-L476 WeakPolarHBondContact O-CB 3.24Å; N472-L476 VanDerWaalsContact O-CG 3.28Å; N472-L476 WeakPolarHBondContact O-CG 3.4Å; N472-L476 PolarHBondContact O-N 2.7Å; I473-L476 PolarHBondContact O-N 3.04Å; L476-S478 PolarHBondContact O-N 3.15Å; L476-I479 HydrophobicContact CD2-CD1 4.35Å; L476-I479 PolarHBondContact O-N 3.09Å
477	Y	78.7	Confident	80.8	Confident	198 Å²	198	77.2 Å²	77.2	78%	0.776	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.2	172.8	-85.3	-71.5	0	0	0	114.3	I473	I473-Y477 HydrophobicContact CG2-CD2 3.54Å; I473-Y477 HydrophobicContact CG2-CE2 3.58Å; I473-Y477 VanDerWaalsContact O-CD2 3.28Å; I473-Y477 WeakPolarHBondContact O-CD2 3.5Å; I473-Y477 PolarHBondContact O-N 3.3Å
478	S	80.6	Confident	80.5	Confident	54 Å²	54	77.2 Å²	77.2	38%	0.378	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-9.2	177.2	82.5	0	0	0	0	113.8	K431 H474 T475 L476	K431-S478 PolarHBondContact NZ-O 3Å; K431-S478 PolarHBondContact NZ-OG 2.96Å; H474-S478 WeakPolarHBondContact O-CB 3.37Å; H474-S478 PolarHBondContact O-N 3.03Å; T475-S478 PolarHBondContact O-N 3.44Å; T475-S478 PolarHBondContact O-OG 3.03Å; L476-S478 PolarHBondContact O-N 3.15Å
479	I	73.4	Confident	80.5	Confident	55 Å²	55	82.6 Å²	82.6	28%	0.282	39%	0.392	S	S	.	.			trans	-82.9	0	171.4	-68.6	170.3	0	0	0	106.6	L359 T363 A428 K431 V432 T475 L476	L359-I479 HydrophobicContact CD1-CG2 4.06Å; L359-I479 HydrophobicContact CD2-CG2 4.4Å; L359-I479 HydrophobicContact CG-CG2 4.26Å; T363-I479 HydrophobicContact CG2-CB 3.87Å; T363-I479 HydrophobicContact CG2-CD1 4Å; T363-I479 HydrophobicContact CG2-CG2 3.6Å; A428-I479 HydrophobicContact CB-CB 4.41Å; A428-I479 HydrophobicContact CB-CD1 4.21Å; A428-I479 HydrophobicContact CB-CG1 4.1Å; A428-I479 HydrophobicContact CB-CG2 3.51Å; K431-I479 HydrophobicContact CB-CD1 4.09Å; K431-I479 HydrophobicContact CB-CG1 4.24Å; K431-I479 HydrophobicContact CD-CG1 3.78Å; V432-I479 HydrophobicContact CG2-CD1 3.75Å; T475-I479 PolarHBondContact O-N 3.38Å; L476-I479 HydrophobicContact CD2-CD1 4.35Å; L476-I479 PolarHBondContact O-N 3.09Å

Retrieved 479 of 479 residues in 198.7 ms (Link to these results)

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