A0A077ZCB1_TRITR Loading...

Chromo domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZCB1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 259 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	49.1	Very low	54.2	Low	155 Å²	155	93.2 Å²	93.2	76%	0.764	49%	0.489	S	S	*	.				0	160.4	0	-85	-177.9	-91	0	0	110	Y3 A19 E20	M1-Y3 HydrophobicContact CB-CE2 4.03Å; M1-A19 CarbonylContact O-C 3.58Å; M1-E20 PolarHBondContact N-OE2 2.78Å; M1-E20 PolarHBondContact O-N 2.94Å
2	E	46.4	Very low	53.7	Low	129 Å²	129	96.1 Å²	96.1	60%	0.603	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	138.4	169.2	-66.9	-178.9	173.7	0	0	109.7	W17 L18	E2-W17 HydrophobicContact CB-CE3 4.04Å; E2-W17 HydrophobicContact CB-CZ3 4.46Å; E2-L18 CarbonylContact C-O 3.56Å; E2-L18 VanDerWaalsContact CA-O 3.27Å; E2-L18 WeakPolarHBondContact CA-O 3.37Å
3	Y	56.7	Low	53.2	Low	79 Å²	79	106.9 Å²	106.9	31%	0.31	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.9	-176.7	-58.8	-90.7	0	0	0	108.8	M1 A5 W17 L18 E20 V23	M1-Y3 HydrophobicContact CB-CE2 4.03Å; Y3-A5 PolarHBondContact O-N 3.28Å; Y3-W17 CarbonylContact O-C 3.53Å; Y3-W17 WeakPolarHBondContact O-CA 3.35Å; Y3-L18 PolarHBondContact N-O 3.38Å; Y3-L18 PolarHBondContact O-N 2.83Å; Y3-E20 HydrophobicContact CE2-CB 3.73Å; Y3-E20 HydrophobicContact CE2-CG 3.91Å; Y3-V23 HydrophobicContact CD2-CG2 3.85Å; Y3-V23 HydrophobicContact CE2-CG2 4.24Å; Y3-V23 HydrophobicContact CG-CG2 4.44Å
4	L	55.7	Low	53.1	Low	39 Å²	39	101.2 Å²	101.2	20%	0.204	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	104.4	166.2	-170.3	71.8	0	0	0	108.6	C15 W17 M187	L4-C15 HydrophobicContact CD1-CB 3.65Å; L4-C15 HydrophobicContact CD2-CB 3.92Å; L4-C15 HydrophobicContact CG-CB 3.75Å; L4-W17 HydrophobicContact CB-CD2 4.37Å; L4-W17 HydrophobicContact CB-CE3 4.15Å; L4-W17 HydrophobicContact CB-CH2 4.3Å; L4-W17 HydrophobicContact CB-CZ3 4.12Å; L4-W17 HydrophobicContact CD1-CD2 3.89Å; L4-W17 HydrophobicContact CD1-CG 4.04Å; L4-W17 HydrophobicContact CD1-CZ2 4.31Å; L4-M187 HydrophobicContact CB-CB 4.17Å; L4-M187 HydrophobicContact CD2-CB 3.47Å; L4-M187 VanDerWaalsContact CD2-CB 3.47Å; L4-M187 HydrophobicContact CD2-CG 4.1Å; L4-M187 HydrophobicContact CG-CB 4.46Å
5	A	61.9	Low	53.4	Low	29 Å²	29	96.1 Å²	96.1	24%	0.24	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	135.1	176.9	0	0	0	0	0	110.8	Y3 C15 I16 L18	Y3-A5 PolarHBondContact O-N 3.28Å; A5-C15 WeakPolarHBondContact O-CA 3.25Å; A5-I16 HydrophobicContact CB-CD1 4.24Å; A5-I16 PolarHBondContact N-O 3.17Å; A5-I16 PolarHBondContact O-N 3.4Å; A5-I16 VanDerWaalsContact O-N 3.17Å; A5-L18 HydrophobicContact CB-CD1 3.46Å; A5-L18 VanDerWaalsContact CB-CD1 3.46Å; A5-L18 HydrophobicContact CB-CG 3.83Å
6	K	61.2	Low	53.8	Low	75 Å²	75	92.4 Å²	92.4	33%	0.326	46%	0.457	S	S	.	.			trans	-133.9	131.8	173.2	174.6	173.8	156.6	162.9	0	109.5	H10 W12	K6-H10 WeakPolarHBondContact CE-O 3.41Å; K6-H10 PolarHBondContact NZ-O 3.46Å; K6-W12 HydrophobicContact CB-CZ3 4.35Å; K6-W12 HydrophobicContact CD-CD2 3.81Å; K6-W12 HydrophobicContact CD-CE3 3.52Å; K6-W12 HydrophobicContact CD-CH2 3.74Å; K6-W12 HydrophobicContact CD-CZ2 4.03Å; K6-W12 HydrophobicContact CD-CZ3 3.47Å; K6-W12 VanDerWaalsContact CD-CZ3 3.47Å; K6-W12 VanDerWaalsContact NZ-CE2 3.28Å
7	W	58.5	Low	54.3	Low	108 Å²	108	94.2 Å²	94.2	41%	0.409	46%	0.457	S	S	.	.			trans	-74.2	138.5	171.4	-65.9	106.2	0	0	0	111.4	G9 H10 I29	W7-G9 PolarHBondContact O-N 3.28Å; W7-H10 HydrophobicContact CB-CB 4.27Å; W7-H10 WeakPolarHBondContact CB-CD2 3.26Å; W7-H10 WeakPolarHBondContact O-CB 3.35Å; W7-H10 PolarHBondContact O-N 3.21Å; W7-H10 VanDerWaalsContact O-N 3.1Å; W7-I29 HydrophobicContact CH2-CD1 4.19Å; W7-I29 HydrophobicContact CH2-CG1 4.25Å; W7-I29 HydrophobicContact CH2-CG2 3.79Å; W7-I29 HydrophobicContact CZ2-CB 4.23Å; W7-I29 HydrophobicContact CZ2-CD1 4.42Å; W7-I29 HydrophobicContact CZ2-CG1 3.98Å; W7-I29 HydrophobicContact CZ2-CG2 3.56Å
8	Q	53.9	Low	54.9	Low	196 Å²	196	90.1 Å²	90.1	92%	0.916	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	124.5	178.2	-176.6	175	-0.9	0	0	109.8	H10	Q8-H10 PolarHBondContact O-CD2 2.92Å
9	G	50	Low	55.4	Low	80 Å²	80	86.8 Å²	86.8	83%	0.825	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.2	-4.4	-177.2	0	0	0	0	0	115.2	W7	W7-G9 PolarHBondContact O-N 3.28Å
10	H	51.6	Low	55.8	Low	67 Å²	67	87.3 Å²	87.3	31%	0.31	43%	0.428	S	S	.	.			trans	-99.3	161.2	-175.5	-64.6	-100	0	0	0	113.6	K6 W7 Q8 E36	K6-H10 WeakPolarHBondContact CE-O 3.41Å; K6-H10 PolarHBondContact NZ-O 3.46Å; W7-H10 HydrophobicContact CB-CB 4.27Å; W7-H10 WeakPolarHBondContact CB-CD2 3.26Å; W7-H10 WeakPolarHBondContact O-CB 3.35Å; W7-H10 PolarHBondContact O-N 3.21Å; W7-H10 VanDerWaalsContact O-N 3.1Å; Q8-H10 PolarHBondContact O-CD2 2.92Å; H10-E36 IonicContact CE1-OE1 3.04Å; H10-E36 IonicContact CE1-OE2 2.68Å; H10-E36 PolarHBondContact CE1-OE2 3.49Å; H10-E36 IonicContact CG-OE1 2.83Å; H10-E36 IonicContact ND1-OE1 3.06Å; H10-E36 PolarHBondContact ND1-OE1 2.55Å; H10-E36 IonicContact ND1-OE2 2.66Å; H10-E36 PolarHBondContact ND1-OE2 3.08Å
11	S	51.1	Low	56.4	Low	68 Å²	68	90.7 Å²	90.7	48%	0.476	44%	0.443	S	S	.	.			trans	-68.2	151.9	177.1	-178.1	0	0	0	0	111.3	R13 S14	S11-R13 PolarHBondContact O-N 2.86Å; S11-R13 PolarHBondContact OG-N 2.83Å; S11-S14 PolarHBondContact O-N 3.25Å; S11-S14 VanDerWaalsContact O-N 3.15Å; S11-S14 PolarHBondContact O-OG 3.48Å
12	W	48.5	Very low	57.2	Low	128 Å²	128	85.3 Å²	85.3	49%	0.485	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-62.9	-21.6	171.8	-67.7	108.6	0	0	0	112.8	K6 S14 C15 Y185	K6-W12 HydrophobicContact CB-CZ3 4.35Å; K6-W12 HydrophobicContact CD-CD2 3.81Å; K6-W12 HydrophobicContact CD-CE3 3.52Å; K6-W12 HydrophobicContact CD-CH2 3.74Å; K6-W12 HydrophobicContact CD-CZ2 4.03Å; K6-W12 HydrophobicContact CD-CZ3 3.47Å; K6-W12 VanDerWaalsContact CD-CZ3 3.47Å; K6-W12 VanDerWaalsContact NZ-CE2 3.28Å; W12-S14 PolarHBondContact O-N 3.28Å; W12-C15 WeakPolarHBondContact O-CB 3.19Å; W12-C15 PolarHBondContact O-N 3.14Å; W12-C15 PolarHBondContact O-SG 3.15Å; W12-Y185 HydrophobicContact CH2-CG 4.28Å; W12-Y185 HydrophobicContact CZ2-CG 4.19Å
13	R	47.2	Very low	58	Low	237 Å²	237	82.4 Å²	82.4	89%	0.894	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-68.4	-16.3	175.9	-65.2	-175.1	177.6	168	-1.2	113.8	S11	S11-R13 PolarHBondContact O-N 2.86Å; S11-R13 PolarHBondContact OG-N 2.83Å
14	S	51.9	Low	58.3	Low	27 Å²	27	86.4 Å²	86.4	19%	0.189	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-101.4	14.9	176.2	43.2	0	0	0	0	113.2	S11 W12	S11-S14 PolarHBondContact O-N 3.25Å; S11-S14 VanDerWaalsContact O-N 3.15Å; S11-S14 PolarHBondContact O-OG 3.48Å; W12-S14 PolarHBondContact O-N 3.28Å
15	C	57.5	Low	58.8	Low	24 Å²	24	91.5 Å²	91.5	16%	0.162	45%	0.446	C	S	.	.			trans	-74.3	147.5	173.9	-61.8	0	0	0	0	111.5	L4 A5 W12	L4-C15 HydrophobicContact CD1-CB 3.65Å; L4-C15 HydrophobicContact CD2-CB 3.92Å; L4-C15 HydrophobicContact CG-CB 3.75Å; A5-C15 WeakPolarHBondContact O-CA 3.25Å; W12-C15 WeakPolarHBondContact O-CB 3.19Å; W12-C15 PolarHBondContact O-N 3.14Å; W12-C15 PolarHBondContact O-SG 3.15Å
16	I	60	Low	58.8	Low	38 Å²	38	94.7 Å²	94.7	20%	0.195	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	141.9	-178.7	52.5	102.9	0	0	0	110.6	A5 L18 L32	A5-I16 HydrophobicContact CB-CD1 4.24Å; A5-I16 PolarHBondContact N-O 3.17Å; A5-I16 PolarHBondContact O-N 3.4Å; A5-I16 VanDerWaalsContact O-N 3.17Å; I16-L18 HydrophobicContact CD1-CD1 4.24Å; I16-L18 HydrophobicContact CD1-CD2 3.19Å; I16-L18 HydrophobicContact CD1-CG 3.57Å; I16-L32 HydrophobicContact CB-CD2 4.02Å; I16-L32 HydrophobicContact CD1-CD1 3.2Å; I16-L32 HydrophobicContact CD1-CD2 4.01Å; I16-L32 HydrophobicContact CD1-CG 4.21Å; I16-L32 HydrophobicContact CG1-CD1 3.58Å; I16-L32 HydrophobicContact CG1-CD2 3.69Å; I16-L32 HydrophobicContact CG1-CG 4.24Å; I16-L32 HydrophobicContact CG2-CD2 3.53Å
17	W	62.2	Low	59	Low	122 Å²	122	98.3 Å²	98.3	46%	0.462	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.6	176	-69.5	99.8	0	0	0	109.1	E2 Y3 L4 M187	E2-W17 HydrophobicContact CB-CE3 4.04Å; E2-W17 HydrophobicContact CB-CZ3 4.46Å; Y3-W17 CarbonylContact O-C 3.53Å; Y3-W17 WeakPolarHBondContact O-CA 3.35Å; L4-W17 HydrophobicContact CB-CD2 4.37Å; L4-W17 HydrophobicContact CB-CE3 4.15Å; L4-W17 HydrophobicContact CB-CH2 4.3Å; L4-W17 HydrophobicContact CB-CZ3 4.12Å; L4-W17 HydrophobicContact CD1-CD2 3.89Å; L4-W17 HydrophobicContact CD1-CG 4.04Å; L4-W17 HydrophobicContact CD1-CZ2 4.31Å; W17-M187 HydrophobicContact CH2-CG 4.44Å
18	L	64.7	Low	59.2	Low	21 Å²	21	95.2 Å²	95.2	11%	0.11	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.9	175.1	-64.9	-173.2	0	0	0	108.7	E2 Y3 A5 I16 D22 V23 L28	E2-L18 CarbonylContact C-O 3.56Å; E2-L18 VanDerWaalsContact CA-O 3.27Å; E2-L18 WeakPolarHBondContact CA-O 3.37Å; Y3-L18 PolarHBondContact N-O 3.38Å; Y3-L18 PolarHBondContact O-N 2.83Å; A5-L18 HydrophobicContact CB-CD1 3.46Å; A5-L18 VanDerWaalsContact CB-CD1 3.46Å; A5-L18 HydrophobicContact CB-CG 3.83Å; I16-L18 HydrophobicContact CD1-CD1 4.24Å; I16-L18 HydrophobicContact CD1-CD2 3.19Å; I16-L18 HydrophobicContact CD1-CG 3.57Å; L18-D22 HydrophobicContact CB-CB 4.34Å; L18-D22 HydrophobicContact CD2-CB 4.18Å; L18-V23 HydrophobicContact CB-CG2 4.39Å; L18-V23 HydrophobicContact CD1-CG2 4.48Å; L18-L28 HydrophobicContact CD2-CD2 3.11Å; L18-L28 HydrophobicContact CD2-CG 4.23Å
19	A	64.9	Low	59.5	Low	28 Å²	28	88.7 Å²	88.7	23%	0.231	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	158.3	160.8	0	0	0	0	0	109.5	M1 E21 D22 V23	M1-A19 CarbonylContact O-C 3.58Å; A19-E21 PolarHBondContact O-N 2.9Å; A19-E21 VanDerWaalsContact O-N 3.15Å; A19-D22 VanDerWaalsContact CB-OD2 3.31Å; A19-D22 WeakPolarHBondContact CB-OD2 3.46Å; A19-D22 PolarHBondContact N-OD2 3.04Å; A19-D22 WeakPolarHBondContact O-CA 3.4Å; A19-D22 WeakPolarHBondContact O-CB 3.48Å; A19-D22 PolarHBondContact O-N 3.1Å; A19-V23 PolarHBondContact O-N 3.3Å
20	E	62.9	Low	60.3	Low	95 Å²	95	90.7 Å²	90.7	44%	0.444	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-34.5	173.8	-165.3	164.9	174.4	0	0	113	M1 Y3 D22	M1-E20 PolarHBondContact N-OE2 2.78Å; M1-E20 PolarHBondContact O-N 2.94Å; Y3-E20 HydrophobicContact CE2-CB 3.73Å; Y3-E20 HydrophobicContact CE2-CG 3.91Å; E20-D22 PolarHBondContact O-N 2.79Å
21	E	69.7	Low	61.1	Low	159 Å²	159	93.5 Å²	93.5	74%	0.743	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.1	177	-63.7	154.3	-146.6	0	0	113.1	A19	A19-E21 PolarHBondContact O-N 2.9Å; A19-E21 VanDerWaalsContact O-N 3.15Å
22	D	64.9	Low	61.7	Low	43 Å²	43	91.8 Å²	91.8	23%	0.23	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-17.4	-174.4	-66.9	-37.9	0	0	0	113.1	L18 A19 E20 H24 R25 L28	L18-D22 HydrophobicContact CB-CB 4.34Å; L18-D22 HydrophobicContact CD2-CB 4.18Å; A19-D22 VanDerWaalsContact CB-OD2 3.31Å; A19-D22 WeakPolarHBondContact CB-OD2 3.46Å; A19-D22 PolarHBondContact N-OD2 3.04Å; A19-D22 WeakPolarHBondContact O-CA 3.4Å; A19-D22 WeakPolarHBondContact O-CB 3.48Å; A19-D22 PolarHBondContact O-N 3.1Å; E20-D22 PolarHBondContact O-N 2.79Å; D22-H24 PolarHBondContact O-N 3.33Å; D22-R25 PolarHBondContact O-N 2.58Å; D22-R25 IonicContact OD1-NE 2.82Å; D22-L28 HydrophobicContact CB-CD2 3.75Å
23	V	62.7	Low	62.5	Low	67 Å²	67	90.8 Å²	90.8	41%	0.406	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.7	-178.7	179.9	0	0	0	0	112.5	Y3 L18 A19	Y3-V23 HydrophobicContact CD2-CG2 3.85Å; Y3-V23 HydrophobicContact CE2-CG2 4.24Å; Y3-V23 HydrophobicContact CG-CG2 4.44Å; L18-V23 HydrophobicContact CB-CG2 4.39Å; L18-V23 HydrophobicContact CD1-CG2 4.48Å; A19-V23 PolarHBondContact O-N 3.3Å
24	H	64	Low	63.7	Low	164 Å²	164	82.7 Å²	82.7	76%	0.759	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	0.1	-179.5	-58.7	-57.5	0	0	0	114.4	D22 V26	D22-H24 PolarHBondContact O-N 3.33Å; H24-V26 PolarHBondContact O-N 2.63Å
25	R	65.2	Low	64.4	Low	145 Å²	145	88.9 Å²	88.9	55%	0.547	42%	0.421	S	S	.	.			trans	-83.4	100.4	-178.1	-72.4	-173.5	176.1	-147.5	2.7	111.2	D22 Q27 L28	D22-R25 PolarHBondContact O-N 2.58Å; D22-R25 IonicContact OD1-NE 2.82Å; R25-Q27 PolarHBondContact O-N 2.69Å; R25-L28 HydrophobicContact CB-CB 4.09Å; R25-L28 WeakPolarHBondContact O-CB 3.28Å; R25-L28 PolarHBondContact O-N 3.42Å
26	V	62.4	Low	64.7	Low	96 Å²	96	89.2 Å²	89.2	58%	0.582	42%	0.42	S	S	*	.	H	α-helix	trans	-54.2	-37.5	175.5	179	0	0	0	0	112.5	H24 L28 I29 E30	H24-V26 PolarHBondContact O-N 2.63Å; V26-L28 PolarHBondContact O-N 3.17Å; V26-I29 WeakPolarHBondContact O-CB 3.41Å; V26-I29 PolarHBondContact O-N 2.76Å; V26-I29 VanDerWaalsContact O-N 3.13Å; V26-E30 PolarHBondContact O-N 3.21Å
27	Q	66.5	Low	65.4	Low	151 Å²	151	93.1 Å²	93.1	71%	0.706	43%	0.432	S	S	*	.	H	α-helix	trans	-59.6	-33.5	177.5	-72.5	177.5	-15.3	0	0	113.2	R25 I29 E30 E31	R25-Q27 PolarHBondContact O-N 2.69Å; Q27-I29 VanDerWaalsContact C-N 3.34Å; Q27-E30 PolarHBondContact O-N 2.94Å; Q27-E31 PolarHBondContact O-N 3.06Å
28	L	62	Low	66	Low	44 Å²	44	93.9 Å²	93.9	23%	0.23	44%	0.435	C	S	.	.	H	α-helix	trans	-71.8	-35.2	-179.7	-162.7	73.1	0	0	0	110.8	L18 D22 R25 V26 E31 L32	L18-L28 HydrophobicContact CD2-CD2 3.11Å; L18-L28 HydrophobicContact CD2-CG 4.23Å; D22-L28 HydrophobicContact CB-CD2 3.75Å; R25-L28 HydrophobicContact CB-CB 4.09Å; R25-L28 WeakPolarHBondContact O-CB 3.28Å; R25-L28 PolarHBondContact O-N 3.42Å; V26-L28 PolarHBondContact O-N 3.17Å; L28-E31 PolarHBondContact O-N 3Å; L28-L32 HydrophobicContact CG-CD1 4.27Å; L28-L32 WeakPolarHBondContact O-CB 3.28Å; L28-L32 WeakPolarHBondContact O-CD1 3.03Å; L28-L32 WeakPolarHBondContact O-CG 3.46Å; L28-L32 PolarHBondContact O-N 3.27Å; L28-L32 VanDerWaalsContact O-N 3.15Å
29	I	59.9	Low	66	Low	58 Å²	58	97 Å²	97	30%	0.297	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-48.2	173.6	-62	173.2	0	0	0	110.2	W7 V26 Q27 E31 L32 E33	W7-I29 HydrophobicContact CH2-CD1 4.19Å; W7-I29 HydrophobicContact CH2-CG1 4.25Å; W7-I29 HydrophobicContact CH2-CG2 3.79Å; W7-I29 HydrophobicContact CZ2-CB 4.23Å; W7-I29 HydrophobicContact CZ2-CD1 4.42Å; W7-I29 HydrophobicContact CZ2-CG1 3.98Å; W7-I29 HydrophobicContact CZ2-CG2 3.56Å; V26-I29 WeakPolarHBondContact O-CB 3.41Å; V26-I29 PolarHBondContact O-N 2.76Å; V26-I29 VanDerWaalsContact O-N 3.13Å; Q27-I29 VanDerWaalsContact C-N 3.34Å; I29-E31 PolarHBondContact O-N 3.11Å; I29-L32 PolarHBondContact O-N 3.29Å; I29-E33 WeakPolarHBondContact O-CG 3.43Å; I29-E33 PolarHBondContact O-N 2.98Å; I29-E33 VanDerWaalsContact O-N 3.07Å
30	E	67.9	Low	66.1	Low	122 Å²	122	99.8 Å²	99.8	57%	0.57	46%	0.461	S	S	*	.	H	α-helix	trans	-61.4	-42.1	178.5	-67.6	178.1	170.8	0	0	112.4	V26 Q27 L32 E34	V26-E30 PolarHBondContact O-N 3.21Å; Q27-E30 PolarHBondContact O-N 2.94Å; E30-L32 VanDerWaalsContact C-N 3.29Å; E30-L32 PolarHBondContact O-N 2.92Å; E30-E34 WeakPolarHBondContact O-CB 3.46Å; E30-E34 PolarHBondContact O-N 3.21Å; E30-E34 VanDerWaalsContact O-N 3.09Å
31	E	67.9	Low	66.7	Low	127 Å²	127	100.6 Å²	100.6	59%	0.593	47%	0.465	S	S	*	.	H	α-helix	trans	-64.2	-34.9	178.6	-171.1	178.6	173.8	0	0	112.4	Q27 L28 I29 R35	Q27-E31 PolarHBondContact O-N 3.06Å; L28-E31 PolarHBondContact O-N 3Å; I29-E31 PolarHBondContact O-N 3.11Å; E31-R35 WeakPolarHBondContact O-CB 3.23Å; E31-R35 PolarHBondContact O-N 2.99Å
32	L	62.5	Low	66.7	Low	32 Å²	32	95.4 Å²	95.4	17%	0.168	45%	0.45	C	S	.	.	H	α-helix	trans	-75.3	-41.2	-179.6	-68.1	164.3	0	0	0	112.5	I16 L28 I29 E30 E34 R35 E36	I16-L32 HydrophobicContact CB-CD2 4.02Å; I16-L32 HydrophobicContact CD1-CD1 3.2Å; I16-L32 HydrophobicContact CD1-CD2 4.01Å; I16-L32 HydrophobicContact CD1-CG 4.21Å; I16-L32 HydrophobicContact CG1-CD1 3.58Å; I16-L32 HydrophobicContact CG1-CD2 3.69Å; I16-L32 HydrophobicContact CG1-CG 4.24Å; I16-L32 HydrophobicContact CG2-CD2 3.53Å; L28-L32 HydrophobicContact CG-CD1 4.27Å; L28-L32 WeakPolarHBondContact O-CB 3.28Å; L28-L32 WeakPolarHBondContact O-CD1 3.03Å; L28-L32 WeakPolarHBondContact O-CG 3.46Å; L28-L32 PolarHBondContact O-N 3.27Å; L28-L32 VanDerWaalsContact O-N 3.15Å; I29-L32 PolarHBondContact O-N 3.29Å; E30-L32 VanDerWaalsContact C-N 3.29Å; E30-L32 PolarHBondContact O-N 2.92Å; L32-E34 VanDerWaalsContact C-N 3.29Å; L32-E34 PolarHBondContact O-N 3.16Å; L32-R35 PolarHBondContact O-N 3.18Å; L32-E36 PolarHBondContact O-N 3.33Å
33	E	65.9	Low	66.6	Low	106 Å²	106	96.2 Å²	96.2	50%	0.495	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-40.5	172.3	-70.9	-179.6	170.3	0	0	111	I29 E36 R37	I29-E33 WeakPolarHBondContact O-CG 3.43Å; I29-E33 PolarHBondContact O-N 2.98Å; I29-E33 VanDerWaalsContact O-N 3.07Å; E33-E36 PolarHBondContact O-N 2.84Å; E33-R37 PolarHBondContact O-N 3.43Å
34	E	73	Confident	66.6	Low	68 Å²	68	99.5 Å²	99.5	32%	0.318	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-43.2	174.2	-179	65.3	-128.1	0	0	112.5	E30 L32 E36 R37 R38	E30-E34 WeakPolarHBondContact O-CB 3.46Å; E30-E34 PolarHBondContact O-N 3.21Å; E30-E34 VanDerWaalsContact O-N 3.09Å; L32-E34 VanDerWaalsContact C-N 3.29Å; L32-E34 PolarHBondContact O-N 3.16Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 3.06Å; E34-R37 PolarHBondContact O-N 3.09Å; E34-R37 IonicContact OE1-CZ 2.72Å; E34-R37 IonicContact OE1-NH1 2.71Å; E34-R37 PolarHBondContact OE1-NH1 3.3Å; E34-R37 IonicContact OE1-NH2 3.73Å; E34-R37 IonicContact OE2-CZ 3.56Å; E34-R37 IonicContact OE2-NH1 2.84Å; E34-R37 PolarHBondContact OE2-NH1 2.69Å; E34-R37 IonicContact OE2-NH2 3.88Å; E34-R37 PolarHBondContact OE2-NH2 2.92Å; E34-R38 PolarHBondContact O-N 3.47Å
35	R	66.5	Low	66.4	Low	156 Å²	156	96.1 Å²	96.1	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-63.5	-40.5	177.4	-176.5	178.1	180	143.9	-0.5	111.6	E31 L32 R38 M39	E31-R35 WeakPolarHBondContact O-CB 3.23Å; E31-R35 PolarHBondContact O-N 2.99Å; L32-R35 PolarHBondContact O-N 3.18Å; R35-R38 PolarHBondContact O-N 3.15Å; R35-M39 PolarHBondContact O-N 3.25Å; R35-M39 VanDerWaalsContact O-N 3.12Å
36	E	63.5	Low	65.6	Low	32 Å²	32	97.2 Å²	97.2	15%	0.15	48%	0.484	C	S	.	.	H	α-helix	trans	-67.8	-41.6	177.6	-176.9	168.7	-137.6	0	0	112.2	H10 L32 E33 E34 R38 M39 N40	H10-E36 IonicContact CE1-OE1 3.04Å; H10-E36 IonicContact CE1-OE2 2.68Å; H10-E36 PolarHBondContact CE1-OE2 3.49Å; H10-E36 IonicContact CG-OE1 2.83Å; H10-E36 IonicContact ND1-OE1 3.06Å; H10-E36 PolarHBondContact ND1-OE1 2.55Å; H10-E36 IonicContact ND1-OE2 2.66Å; H10-E36 PolarHBondContact ND1-OE2 3.08Å; L32-E36 PolarHBondContact O-N 3.33Å; E33-E36 PolarHBondContact O-N 2.84Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 3.06Å; E36-R38 VanDerWaalsContact C-N 3.27Å; E36-R38 PolarHBondContact O-N 3.42Å; E36-M39 PolarHBondContact O-N 3.31Å; E36-M39 VanDerWaalsContact O-N 3.1Å; E36-N40 PolarHBondContact O-N 2.86Å
37	R	73.9	Confident	64.6	Low	119 Å²	119	97.6 Å²	97.6	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-53.8	-47.3	174.4	-160.5	-165.3	-45.3	130.1	11.7	111.1	E33 E34 M39 N40 E41	E33-R37 PolarHBondContact O-N 3.43Å; E34-R37 PolarHBondContact O-N 3.09Å; E34-R37 IonicContact OE1-CZ 2.72Å; E34-R37 IonicContact OE1-NH1 2.71Å; E34-R37 PolarHBondContact OE1-NH1 3.3Å; E34-R37 IonicContact OE1-NH2 3.73Å; E34-R37 IonicContact OE2-CZ 3.56Å; E34-R37 IonicContact OE2-NH1 2.84Å; E34-R37 PolarHBondContact OE2-NH1 2.69Å; E34-R37 IonicContact OE2-NH2 3.88Å; E34-R37 PolarHBondContact OE2-NH2 2.92Å; R37-M39 PolarHBondContact O-N 3.18Å; R37-N40 PolarHBondContact O-N 3.23Å; R37-E41 WeakPolarHBondContact CG-OE1 3.49Å; R37-E41 WeakPolarHBondContact O-CB 3.16Å; R37-E41 VanDerWaalsContact O-CG 3.28Å; R37-E41 WeakPolarHBondContact O-CG 3.36Å; R37-E41 PolarHBondContact O-N 2.89Å
38	R	75.5	Confident	63.4	Low	138 Å²	138	96.2 Å²	96.2	52%	0.521	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-38.7	176.8	-74	-174.6	-82.5	153.3	-8.5	113.4	E34 R35 E36 A42	E34-R38 PolarHBondContact O-N 3.47Å; R35-R38 PolarHBondContact O-N 3.15Å; E36-R38 VanDerWaalsContact C-N 3.27Å; E36-R38 PolarHBondContact O-N 3.42Å; R38-A42 WeakPolarHBondContact O-CB 3.33Å; R38-A42 PolarHBondContact O-N 2.89Å
39	M	64.9	Low	62.2	Low	88 Å²	88	101.4 Å²	101.4	43%	0.433	52%	0.523	S	S	.	.	H	α-helix	trans	-67.9	-40.5	176.2	-74.4	-167.8	-59.5	0	0	112.4	R35 E36 R37 A42 A43	R35-M39 PolarHBondContact O-N 3.25Å; R35-M39 VanDerWaalsContact O-N 3.12Å; E36-M39 PolarHBondContact O-N 3.31Å; E36-M39 VanDerWaalsContact O-N 3.1Å; R37-M39 PolarHBondContact O-N 3.18Å; M39-A42 PolarHBondContact O-N 2.9Å; M39-A43 WeakPolarHBondContact O-CB 2.65Å; M39-A43 PolarHBondContact O-N 2.91Å
40	N	66.3	Low	61.2	Low	86 Å²	86	105.3 Å²	105.3	46%	0.46	55%	0.549	S	S	.	.	H	α-helix	trans	-68.6	-37.7	177	-74.7	-24.6	0	0	0	111.7	E36 R37 A43 N44	E36-N40 PolarHBondContact O-N 2.86Å; R37-N40 PolarHBondContact O-N 3.23Å; N40-A43 PolarHBondContact O-N 2.92Å; N40-N44 VanDerWaalsContact O-CB 3.3Å; N40-N44 WeakPolarHBondContact O-CB 3.26Å; N40-N44 PolarHBondContact O-N 3.19Å; N40-N44 PolarHBondContact O-ND2 2.89Å
41	E	75.7	Confident	59.6	Low	111 Å²	111	103 Å²	103	52%	0.519	56%	0.558	S	S	.	*	H	α-helix	trans	-61	-43.9	171.4	-74	168.4	-171.3	0	0	111.4	R37 N44 S45	R37-E41 WeakPolarHBondContact CG-OE1 3.49Å; R37-E41 WeakPolarHBondContact O-CB 3.16Å; R37-E41 VanDerWaalsContact O-CG 3.28Å; R37-E41 WeakPolarHBondContact O-CG 3.36Å; R37-E41 PolarHBondContact O-N 2.89Å; E41-N44 PolarHBondContact O-N 3.32Å; E41-S45 WeakPolarHBondContact O-CB 3.44Å; E41-S45 PolarHBondContact O-N 3.18Å; E41-S45 PolarHBondContact O-OG 2.94Å
42	A	69.4	Low	57.9	Low	51 Å²	51	102.3 Å²	102.3	42%	0.421	57%	0.568	S	S	.	*	H	α-helix	trans	-63.2	-47.4	176.1	0	0	0	0	0	112.2	R38 M39 N44 S45 E46	R38-A42 WeakPolarHBondContact O-CB 3.33Å; R38-A42 PolarHBondContact O-N 2.89Å; M39-A42 PolarHBondContact O-N 2.9Å; A42-N44 VanDerWaalsContact C-N 3.31Å; A42-N44 PolarHBondContact O-N 2.79Å; A42-S45 WeakPolarHBondContact CA-OG 3.19Å; A42-S45 PolarHBondContact O-N 3.49Å; A42-S45 VanDerWaalsContact O-N 3.14Å; A42-S45 PolarHBondContact O-OG 3.13Å; A42-E46 PolarHBondContact O-N 3.39Å
43	A	62.5	Low	56.5	Low	60 Å²	60	106.7 Å²	106.7	50%	0.496	60%	0.596	S	S	.	*	H	α-helix	trans	-64.2	-33.9	178.8	0	0	0	0	0	113	M39 N40	M39-A43 WeakPolarHBondContact O-CB 2.65Å; M39-A43 PolarHBondContact O-N 2.91Å; N40-A43 PolarHBondContact O-N 2.92Å
44	N	62.9	Low	54.9	Low	136 Å²	136	112.9 Å²	112.9	73%	0.727	62%	0.615	S	S	*	*	H	α-helix	trans	-80.7	-18.9	176.1	-69.5	-31.8	0	0	0	113	N40 E41 A42 E46	N40-N44 VanDerWaalsContact O-CB 3.3Å; N40-N44 WeakPolarHBondContact O-CB 3.26Å; N40-N44 PolarHBondContact O-N 3.19Å; N40-N44 PolarHBondContact O-ND2 2.89Å; E41-N44 PolarHBondContact O-N 3.32Å; A42-N44 VanDerWaalsContact C-N 3.31Å; A42-N44 PolarHBondContact O-N 2.79Å; N44-E46 VanDerWaalsContact C-N 3.35Å
45	S	60	Low	53.2	Low	93 Å²	93	119 Å²	119	65%	0.65	64%	0.643	S	S	*	*	H	α-helix	trans	-81.3	-14.1	173.7	68.4	0	0	0	0	113.5	E41 A42	E41-S45 WeakPolarHBondContact O-CB 3.44Å; E41-S45 PolarHBondContact O-N 3.18Å; E41-S45 PolarHBondContact O-OG 2.94Å; A42-S45 WeakPolarHBondContact CA-OG 3.19Å; A42-S45 PolarHBondContact O-N 3.49Å; A42-S45 VanDerWaalsContact O-N 3.14Å; A42-S45 PolarHBondContact O-OG 3.13Å
46	E	49.1	Very low	51.5	Low	168 Å²	168	116 Å²	116	79%	0.785	65%	0.651	S	S	*	*			trans	-97.7	76	173.2	-71.5	-174.2	162.9	0	0	111.3	A42 N44	A42-E46 PolarHBondContact O-N 3.39Å; N44-E46 VanDerWaalsContact C-N 3.35Å
47	S	42	Very low	50.4	Low	103 Å²	103	122.5 Å²	122.5	72%	0.72	69%	0.686	S	S	*	*			trans	-145.2	146.5	158.8	100	0	0	0	0	110.7
48	P	40.6	Very low	48.3	Very low	123 Å²	123	124.4 Å²	124.4	80%	0.799	71%	0.706	S	S	*	*				-100.8	130.4	-114.3	33.6	-32.6	0	0	0	111.9
49	N	37.2	Very low	46.5	Very low	152 Å²	152	124.4 Å²	124.4	81%	0.813	72%	0.72	S	S	*	*			trans	-106.7	134.8	165.6	-110.8	-17.8	0	0	0	109.9
50	T	38.9	Very low	45	Very low	140 Å²	140	128.8 Å²	128.8	86%	0.859	74%	0.74	S	S	*	*			trans	72	114.6	166.3	60	0	0	0	0	115.6
51	G	33.2	Very low	43.6	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	76%	0.761	S	S	*	*			cis	103.8	103.6	36.5	0	0	0	0	0	108.4
52	S	31.7	Very low	41.6	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	78%	0.775	S	S	*	*			trans	28.2	118.8	152	-169.7	0	0	0	0	118
53	T	34.5	Very low	40	Very low	124 Å²	124	139.3 Å²	139.3	76%	0.761	79%	0.79	S	S	*	*				171.5	128.2	105.7	-68	0	0	0	0	110.5	Q55	T53-Q55 PolarHBondContact O-N 3.18Å
54	R	31.8	Very low	38.8	Very low	236 Å²	236	142.1 Å²	142.1	89%	0.891	80%	0.803	S	S	*	*			trans	-49.2	128.4	164.3	-75.9	169.2	154.7	174.6	-6.7	111.1
55	Q	37	Very low	37.3	Very low	197 Å²	197	143 Å²	143	92%	0.921	80%	0.803	S	S	*	*			trans	-162.9	137.6	139.5	-110.7	165.8	24.9	0	0	111.2	T53	T53-Q55 PolarHBondContact O-N 3.18Å
56	A	32	Very low	36.1	Very low	91 Å²	91	146.5 Å²	146.5	75%	0.752	81%	0.813	S	S	*	*			trans	-63.3	152.7	-179.6	0	0	0	0	0	112.7
57	L	39.8	Very low	35.2	Very low	170 Å²	170	146.3 Å²	146.3	89%	0.89	81%	0.81	S	S	*	*			trans	-169.4	118.1	140.2	-100.2	147.7	0	0	0	110.1
58	N	30.2	Very low	34.9	Very low	159 Å²	159	146.5 Å²	146.5	85%	0.85	81%	0.809	S	S	*	*			trans	-61.2	136.5	163.6	-70.9	-27.9	0	0	0	110
59	V	37.5	Very low	34.6	Very low	137 Å²	137	145.5 Å²	145.5	83%	0.83	80%	0.802	S	S	*	*			trans	-153.4	129.6	139.9	-173.4	0	0	0	0	108.5
60	E	33	Very low	34.2	Very low	180 Å²	180	144.9 Å²	144.9	84%	0.841	80%	0.799	S	S	*	*			trans	-53	139.7	168.5	-70.2	168.6	110.1	0	0	111.9
61	D	35.8	Very low	34	Very low	170 Å²	170	145 Å²	145	91%	0.909	80%	0.8	S	S	*	*			trans	-157.1	141.5	145.1	-112.9	-31.2	0	0	0	113.7
62	K	34.5	Very low	33.8	Very low	186 Å²	186	148.2 Å²	148.2	81%	0.809	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-83.2	146.6	-163.2	-167.8	-179.9	-174.2	-179.1	0	111.7
63	P	36.5	Very low	33.7	Very low	114 Å²	114	148.8 Å²	148.8	74%	0.74	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.9	137.7	170.8	31.4	-30.4	0	0	0	110.5
64	P	37.7	Very low	33.3	Very low	118 Å²	118	150.1 Å²	150.1	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.3	130.8	179.7	30.8	-30.3	0	0	0	111.6
65	Q	30.6	Very low	33.3	Very low	155 Å²	155	146.2 Å²	146.2	72%	0.724	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.5	136.5	160.7	-69.1	-175.9	6.9	0	0	109.6
66	L	34.3	Very low	32.9	Very low	166 Å²	166	144.8 Å²	144.8	87%	0.869	79%	0.793	S	S	*	*			trans	-138.8	75	167.8	-102.2	138.3	0	0	0	109
67	F	30.3	Very low	33	Very low	164 Å²	164	148 Å²	148	72%	0.719	80%	0.798	S	S	*	*				14	163.4	124.8	-82.4	-55.7	0	0	0	121.5
68	P	35.8	Very low	32.5	Very low	107 Å²	107	144.8 Å²	144.8	70%	0.695	79%	0.789	S	S	*	*			cis	-147.4	-150	-17.8	46.9	-25.3	0	0	0	113.6
69	P	33.3	Very low	32.5	Very low	102 Å²	102	145.3 Å²	145.3	66%	0.662	79%	0.791	S	S	*	*			trans	-119.9	-171.8	-134.7	25	5.2	0	0	0	114.1
70	D	30.6	Very low	32.1	Very low	139 Å²	139	142.9 Å²	142.9	74%	0.743	79%	0.786	S	S	*	*			trans	69.1	104.3	158.7	-55.7	-29	0	0	0	120.6
71	V	34.6	Very low	32.1	Very low	144 Å²	144	144.8 Å²	144.8	87%	0.873	79%	0.792	S	S	*	*			trans	-142.2	111	133.6	-176.8	0	0	0	0	109.6
72	I	28	Very low	31.7	Very low	140 Å²	140	139.6 Å²	139.6	72%	0.718	78%	0.778	S	S	*	*			trans	-80.3	139.1	168.7	-64	165.3	0	0	0	108.8
73	C	30.7	Very low	31.7	Very low	126 Å²	126	138 Å²	138	85%	0.851	78%	0.778	S	S	*	*			trans	-153.2	97.8	150.2	-95	0	0	0	0	110
74	N	26.2	Very low	31.8	Very low	151 Å²	151	138 Å²	138	81%	0.807	78%	0.781	S	S	*	*			trans	-74	135.7	156.9	-74.2	-18.4	0	0	0	108.4
75	N	31.4	Very low	32	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	78%	0.778	S	S	*	*				-161.4	140	127.6	-131.3	-3.8	0	0	0	112.8
76	E	28.4	Very low	32.5	Very low	167 Å²	167	136.2 Å²	136.2	78%	0.78	78%	0.777	S	S	*	*			trans	-63.6	143	177.8	-57.6	167.4	141.8	0	0	111.4
77	N	33.4	Very low	32.9	Very low	158 Å²	158	134.8 Å²	134.8	85%	0.845	77%	0.77	S	S	*	*			trans	-173.8	104.5	132.9	-96.1	-23.6	0	0	0	111.1
78	S	29.1	Very low	33.3	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	77%	0.768	S	S	*	*				34.2	119.9	126.3	-144.1	0	0	0	0	118
79	L	31.8	Very low	33.6	Very low	170 Å²	170	133.3 Å²	133.3	89%	0.89	76%	0.759	S	S	*	*				-175.6	130.8	105.5	-91	164.5	0	0	0	110.9
80	A	28.4	Very low	34	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	75%	0.75	S	S	*	*			trans	-75.1	139.3	-178.5	0	0	0	0	0	113.1
81	F	32.9	Very low	34.5	Very low	221 Å²	221	129.9 Å²	129.9	97%	0.969	74%	0.743	S	S	*	*			trans	-169.2	110.5	148.3	-92.8	-78	0	0	0	103.7
82	G	27.4	Very low	34.6	Very low	60 Å²	60	129 Å²	129	62%	0.619	73%	0.729	S	S	*	*				98.9	128.8	67.3	0	0	0	0	0	108.9
83	N	34.2	Very low	35	Very low	152 Å²	152	126.3 Å²	126.3	81%	0.813	71%	0.711	S	S	*	*			trans	99.7	96.9	169.1	-44.2	-19.7	0	0	0	113.8
84	S	38.7	Very low	35.4	Very low	116 Å²	116	127.1 Å²	127.1	81%	0.811	70%	0.702	S	S	*	*				63.3	27.1	67.4	-162.9	0	0	0	0	115.7
85	E	41.7	Very low	36.1	Very low	149 Å²	149	127.3 Å²	127.3	70%	0.696	70%	0.696	S	S	*	*			trans	-120.3	-11	171.4	-77.1	-178.1	164.6	0	0	114.2
86	A	41.3	Very low	36.4	Very low	85 Å²	85	122.6 Å²	122.6	70%	0.702	67%	0.67	S	S	*	*	H	α-helix	trans	-76.8	-25.5	-178.7	0	0	0	0	0	113.8
87	D	42.3	Very low	36.7	Very low	136 Å²	136	119 Å²	119	73%	0.727	66%	0.656	S	S	*	*	H	α-helix	trans	-82.3	-25.6	179.8	-93.4	-18.8	0	0	0	113.3
88	E	38.8	Very low	36.7	Very low	145 Å²	145	114.9 Å²	114.9	68%	0.678	64%	0.64	S	S	*	*	H	α-helix	trans	-72.9	-35.3	179.3	-72.4	-161.5	156.3	0	0	112.3	A90 L91 E92	E88-A90 VanDerWaalsContact C-N 3.34Å; E88-A90 PolarHBondContact O-N 3.35Å; E88-L91 PolarHBondContact O-N 3.44Å; E88-E92 PolarHBondContact O-N 3.2Å
89	N	42.6	Very low	36.8	Very low	95 Å²	95	116.3 Å²	116.3	51%	0.508	63%	0.633	S	S	.	*	H	α-helix	trans	-63.8	-38.5	175.7	-78.9	-22.6	0	0	0	112	L91 E92 Y93	N89-L91 VanDerWaalsContact C-N 3.31Å; N89-L91 PolarHBondContact O-N 2.91Å; N89-E92 PolarHBondContact O-N 3.03Å; N89-Y93 WeakPolarHBondContact O-CD2 3.49Å; N89-Y93 PolarHBondContact O-N 3.43Å
90	A	41.7	Very low	36.9	Very low	57 Å²	57	112.2 Å²	112.2	47%	0.471	61%	0.609	S	S	.	*	H	α-helix	trans	-63.6	-36.7	179.9	0	0	0	0	0	112.5	E88 Y93 E94	E88-A90 VanDerWaalsContact C-N 3.34Å; E88-A90 PolarHBondContact O-N 3.35Å; A90-Y93 PolarHBondContact O-N 3.22Å; A90-E94 PolarHBondContact O-N 2.99Å
91	L	41.2	Very low	37	Very low	113 Å²	113	114.7 Å²	114.7	59%	0.592	61%	0.611	S	S	*	*	H	α-helix	trans	-73.3	-32.7	177.5	-109.3	144.4	0	0	0	113	E88 N89 K95	E88-L91 PolarHBondContact O-N 3.44Å; N89-L91 VanDerWaalsContact C-N 3.31Å; N89-L91 PolarHBondContact O-N 2.91Å; L91-K95 PolarHBondContact O-N 3.14Å; L91-K95 VanDerWaalsContact O-N 3.15Å
92	E	37.2	Very low	36.9	Very low	124 Å²	124	113.4 Å²	113.4	58%	0.579	60%	0.601	S	S	*	*	H	α-helix	trans	-68.7	-40	169.5	-83.4	-160.6	153.1	0	0	112.1	E88 N89 E94 K95 L96	E88-E92 PolarHBondContact O-N 3.2Å; N89-E92 PolarHBondContact O-N 3.03Å; E92-E94 VanDerWaalsContact C-N 3.3Å; E92-E94 PolarHBondContact O-N 3.19Å; E92-K95 PolarHBondContact O-N 2.86Å; E92-L96 WeakPolarHBondContact O-CB 3.26Å; E92-L96 WeakPolarHBondContact O-CD1 3.33Å; E92-L96 PolarHBondContact O-N 3.4Å
93	Y	35.4	Very low	37	Very low	85 Å²	85	114.1 Å²	114.1	33%	0.333	60%	0.601	S	S	.	*	H	α-helix	trans	-61.1	-38.1	173.6	-82.9	-69.7	0	0	0	112.2	N89 A90 L96 N97 L234	N89-Y93 WeakPolarHBondContact O-CD2 3.49Å; N89-Y93 PolarHBondContact O-N 3.43Å; A90-Y93 PolarHBondContact O-N 3.22Å; Y93-L96 PolarHBondContact O-N 2.8Å; Y93-N97 PolarHBondContact O-N 3.1Å; Y93-L234 HydrophobicContact CD1-CD2 3.95Å; Y93-L234 HydrophobicContact CE1-CD2 4.02Å
94	E	39	Very low	36.7	Very low	142 Å²	142	114.4 Å²	114.4	66%	0.664	60%	0.601	S	S	*	*	H	α-helix	trans	-69.2	-36.2	177	-145.5	176.9	-160.4	0	0	112.3	A90 E92 N97	A90-E94 PolarHBondContact O-N 2.99Å; E92-E94 VanDerWaalsContact C-N 3.3Å; E92-E94 PolarHBondContact O-N 3.19Å; E94-N97 PolarHBondContact O-N 3.48Å
95	K	41.7	Very low	36.3	Very low	156 Å²	156	113.5 Å²	113.5	68%	0.678	59%	0.593	S	S	*	*	H	α-helix	trans	-66.5	-38.7	169.7	-92	179.7	177.1	173.5	0	112.6	L91 E92 S98	L91-K95 PolarHBondContact O-N 3.14Å; L91-K95 VanDerWaalsContact O-N 3.15Å; E92-K95 PolarHBondContact O-N 2.86Å; K95-S98 WeakPolarHBondContact O-CB 3.37Å; K95-S98 PolarHBondContact O-N 3.3Å; K95-S98 PolarHBondContact O-OG 2.96Å
96	L	38	Very low	35.7	Very low	55 Å²	55	110.2 Å²	110.2	29%	0.288	59%	0.591	S	S	.	*	H	α-helix	trans	-70	-31.1	177.1	-85.1	149.9	0	0	0	112.4	E92 Y93 S98 F99 L234	E92-L96 WeakPolarHBondContact O-CB 3.26Å; E92-L96 WeakPolarHBondContact O-CD1 3.33Å; E92-L96 PolarHBondContact O-N 3.4Å; Y93-L96 PolarHBondContact O-N 2.8Å; L96-S98 PolarHBondContact O-N 3.2Å; L96-F99 WeakPolarHBondContact O-CB 3.35Å; L96-F99 PolarHBondContact O-N 3.48Å; L96-L234 HydrophobicContact CB-CD2 4.27Å
97	N	33.9	Very low	35.3	Very low	93 Å²	93	115.4 Å²	115.4	50%	0.497	60%	0.601	S	S	.	*	H	α-helix	trans	-63.9	-19.2	170.9	-88.8	-4.5	0	0	0	113.4	Y93 E94 F99 H100	Y93-N97 PolarHBondContact O-N 3.1Å; E94-N97 PolarHBondContact O-N 3.48Å; N97-F99 PolarHBondContact O-N 3.28Å; N97-H100 WeakPolarHBondContact O-CB 3.3Å; N97-H100 PolarHBondContact O-N 3.42Å
98	S	33.1	Very low	35	Very low	70 Å²	70	115 Å²	115	49%	0.49	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-67.9	-19.6	171.8	78	0	0	0	0	113.4	K95 L96 H100	K95-S98 WeakPolarHBondContact O-CB 3.37Å; K95-S98 PolarHBondContact O-N 3.3Å; K95-S98 PolarHBondContact O-OG 2.96Å; L96-S98 PolarHBondContact O-N 3.2Å; S98-H100 VanDerWaalsContact C-N 3.35Å
99	F	32.4	Very low	34.7	Very low	133 Å²	133	116.5 Å²	116.5	58%	0.583	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-80.6	-11.8	176.5	-71.1	-90.7	0	0	0	113.7	L96 N97 N101	L96-F99 WeakPolarHBondContact O-CB 3.35Å; L96-F99 PolarHBondContact O-N 3.48Å; N97-F99 PolarHBondContact O-N 3.28Å; F99-N101 PolarHBondContact O-N 3.14Å; F99-N101 VanDerWaalsContact O-N 3.11Å
100	H	33	Very low	34.4	Very low	83 Å²	83	118.1 Å²	118.1	38%	0.384	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-67.5	-9.5	-179.4	-88.8	46.1	0	0	0	114.7	N97 S98 Y102 L234	N97-H100 WeakPolarHBondContact O-CB 3.3Å; N97-H100 PolarHBondContact O-N 3.42Å; S98-H100 VanDerWaalsContact C-N 3.35Å; H100-Y102 VanDerWaalsContact C-N 3.33Å; H100-Y102 PolarHBondContact O-N 2.9Å; H100-L234 PolarHBondContact CE1-O 3.07Å; H100-L234 PolarHBondContact NE2-O 3.28Å
101	N	29.8	Very low	34	Very low	139 Å²	139	119.6 Å²	119.6	74%	0.743	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-84.8	3.5	-178.1	-72.4	-42.2	0	0	0	114.9	F99	F99-N101 PolarHBondContact O-N 3.14Å; F99-N101 VanDerWaalsContact O-N 3.11Å
102	Y	30.8	Very low	33.8	Very low	194 Å²	194	122.8 Å²	122.8	76%	0.761	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-111.9	1.4	-175.8	-64.9	-77.1	0	0	0	115.3	H100	H100-Y102 VanDerWaalsContact C-N 3.33Å; H100-Y102 PolarHBondContact O-N 2.9Å
103	A	30	Very low	33.4	Very low	74 Å²	74	122.3 Å²	122.3	61%	0.612	66%	0.66	S	S	*	*			trans	-105.4	31.4	-173.4	0	0	0	0	0	114.9
104	L	28.7	Very low	33.4	Very low	159 Å²	159	126.1 Å²	126.1	83%	0.832	68%	0.684	S	S	*	*	S	Bend	trans	-79.5	123.3	162.8	-92.6	155.4	0	0	0	108.3	A106	L104-A106 PolarHBondContact O-N 3.1Å
105	P	29.1	Very low	32.8	Very low	96 Å²	96	127 Å²	127	62%	0.623	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-57	124.4	174.6	-17.4	28.1	0	0	0	109.1	E107	P105-E107 PolarHBondContact O-N 2.85Å
106	A	30.8	Very low	32.3	Very low	80 Å²	80	124.9 Å²	124.9	66%	0.661	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-58.2	132.4	164.8	0	0	0	0	0	108.1	L104 V108	L104-A106 PolarHBondContact O-N 3.1Å; A106-V108 VanDerWaalsContact C-N 3.34Å; A106-V108 PolarHBondContact O-N 3.16Å
107	E	32.6	Very low	32	Very low	195 Å²	195	129.6 Å²	129.6	91%	0.911	72%	0.717	S	S	*	*			trans	-59.6	94.5	173.9	-69	-177.7	159.8	0	0	109.2	P105	P105-E107 PolarHBondContact O-N 2.85Å
108	V	36	Very low	32	Very low	128 Å²	128	130.4 Å²	130.4	78%	0.776	73%	0.727	S	S	*	*			trans	-85.9	111	170	-177.7	0	0	0	0	107.1	A106	A106-V108 VanDerWaalsContact C-N 3.34Å; A106-V108 PolarHBondContact O-N 3.16Å
109	E	32.5	Very low	32	Very low	176 Å²	176	134.3 Å²	134.3	82%	0.822	74%	0.742	S	S	*	*			trans	-53.2	129.9	173.4	-71.9	-159.3	153.6	0	0	110.8	A111	E109-A111 PolarHBondContact O-N 3.02Å; E109-A111 VanDerWaalsContact O-N 3.1Å
110	P	34.7	Very low	31.9	Very low	128 Å²	128	132.8 Å²	132.8	83%	0.831	75%	0.745	S	S	*	*			trans	-79.9	101.4	-173.8	30.3	-31.8	0	0	0	110.8	H112	P110-H112 PolarHBondContact O-N 3.09Å
111	A	34.9	Very low	31.8	Very low	89 Å²	89	137.2 Å²	137.2	74%	0.736	77%	0.771	S	S	*	*			trans	-76.7	105.7	161.4	0	0	0	0	0	109.9	E109	E109-A111 PolarHBondContact O-N 3.02Å; E109-A111 VanDerWaalsContact O-N 3.1Å
112	H	36.3	Very low	31.8	Very low	179 Å²	179	132.9 Å²	132.9	83%	0.829	75%	0.752	S	S	*	*	S	Bend	trans	67.4	91.9	159.7	-57.1	-64.4	0	0	0	119.4	P110	P110-H112 PolarHBondContact O-N 3.09Å
113	S	28.2	Very low	32.1	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	75%	0.749	S	S	*	*				60.6	71.2	124.4	-177.8	0	0	0	0	119
114	I	35.3	Very low	32.6	Very low	164 Å²	164	129.8 Å²	129.8	84%	0.841	75%	0.746	S	S	*	*				-141	114.2	129.5	-57.9	179.5	0	0	0	106.4	P116	I114-P116 VanDerWaalsContact O-CD 3.31Å; I114-P116 WeakPolarHBondContact O-CD 3.18Å
115	M	26.8	Very low	32.8	Very low	160 Å²	160	130.1 Å²	130.1	79%	0.788	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58.5	118.3	-178.8	-127	179.5	83.5	0	0	110.6
116	P	32.5	Very low	33.2	Very low	112 Å²	112	129.4 Å²	129.4	73%	0.727	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-76.6	131.1	158.7	4.9	13.3	0	0	0	107.3	I114	I114-P116 VanDerWaalsContact O-CD 3.31Å; I114-P116 WeakPolarHBondContact O-CD 3.18Å
117	L	31.2	Very low	33.4	Very low	154 Å²	154	131.3 Å²	131.3	81%	0.806	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-48.8	129.4	172.5	-80.8	156.3	0	0	0	109.7	L119	L117-L119 PolarHBondContact O-N 2.89Å
118	P	32.5	Very low	33.8	Very low	110 Å²	110	125.1 Å²	125.1	71%	0.714	71%	0.707	S	S	*	*			trans	-70.6	103.5	178.7	28.6	-30.1	0	0	0	107.7
119	L	34.6	Very low	34	Very low	153 Å²	153	122 Å²	122	80%	0.801	69%	0.686	S	S	*	*			trans	-64.2	130.2	161.5	-75.7	168.7	0	0	0	106.9	L117 L121	L117-L119 PolarHBondContact O-N 2.89Å; L119-L121 PolarHBondContact O-N 2.9Å
120	P	30.7	Very low	34.6	Very low	100 Å²	100	122 Å²	122	65%	0.649	68%	0.679	S	S	*	*			trans	-64.7	106	177	25.7	-30.5	0	0	0	107.8	S122	P120-S122 PolarHBondContact O-N 2.84Å
121	L	30.8	Very low	35	Very low	176 Å²	176	120.6 Å²	120.6	92%	0.921	67%	0.673	S	S	*	*			trans	-66.1	70	160.7	-76.6	161.6	0	0	0	107.6	L119 T123	L119-L121 PolarHBondContact O-N 2.9Å; L121-T123 PolarHBondContact O-N 2.67Å
122	S	29.7	Very low	35.5	Very low	48 Å²	48	122.3 Å²	122.3	34%	0.336	67%	0.667	S	S	.	*			trans	-75	115.9	164.6	-175.4	0	0	0	0	106.1	P120 T124 W125	P120-S122 PolarHBondContact O-N 2.84Å; S122-T124 WeakPolarHBondContact CB-OG1 3.26Å; S122-T124 PolarHBondContact O-N 2.87Å; S122-T124 PolarHBondContact OG-OG1 3.17Å; S122-W125 PolarHBondContact O-N 2.56Å
123	T	36.5	Very low	36.3	Very low	116 Å²	116	119.4 Å²	119.4	71%	0.712	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-9.2	174	38.1	0	0	0	0	113.4	L121	L121-T123 PolarHBondContact O-N 2.67Å
124	T	39.5	Very low	37.7	Very low	87 Å²	87	117.9 Å²	117.9	53%	0.534	64%	0.641	S	S	.	*	H	α-helix	trans	-73	-20.1	171.1	62.9	0	0	0	0	114.6	S122 S128	S122-T124 WeakPolarHBondContact CB-OG1 3.26Å; S122-T124 PolarHBondContact O-N 2.87Å; S122-T124 PolarHBondContact OG-OG1 3.17Å; T124-S128 WeakPolarHBondContact O-CB 3.4Å; T124-S128 PolarHBondContact O-N 3.13Å
125	W	33.5	Very low	39.4	Very low	167 Å²	167	117.3 Å²	117.3	63%	0.633	64%	0.635	S	S	*	*	H	α-helix	trans	-73.7	-31.2	178.3	-73.8	93.2	0	0	0	112.3	S122 S128 L129	S122-W125 PolarHBondContact O-N 2.56Å; W125-S128 PolarHBondContact O-N 2.94Å; W125-L129 WeakPolarHBondContact O-CB 3.46Å; W125-L129 WeakPolarHBondContact O-CD1 3.23Å; W125-L129 WeakPolarHBondContact O-CG 3.5Å; W125-L129 PolarHBondContact O-N 2.97Å
126	V	38	Very low	42.1	Very low	81 Å²	81	114.8 Å²	114.8	49%	0.491	62%	0.624	S	S	.	*	H	α-helix	trans	-67.1	-43.9	179.4	-162.7	0	0	0	0	109.8	S128 L129 Y130	V126-S128 VanDerWaalsContact C-N 3.34Å; V126-S128 PolarHBondContact O-N 3.39Å; V126-L129 PolarHBondContact O-N 2.9Å; V126-Y130 HydrophobicContact CG1-CD2 4.39Å; V126-Y130 HydrophobicContact CG1-CE2 4.07Å; V126-Y130 WeakPolarHBondContact O-CD2 3.19Å; V126-Y130 PolarHBondContact O-N 2.75Å
127	D	35.5	Very low	44.7	Very low	119 Å²	119	109.6 Å²	109.6	64%	0.636	59%	0.59	S	S	*	*	H	α-helix	trans	-70.8	-27.6	176.9	-67	-24.6	0	0	0	113.4	S131	D127-S131 PolarHBondContact O-OG 3.3Å
128	S	40.6	Very low	47.5	Very low	65 Å²	65	105.5 Å²	105.5	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-73.7	-35.7	173.2	-170.8	0	0	0	0	112.2	T124 W125 V126 S131	T124-S128 WeakPolarHBondContact O-CB 3.4Å; T124-S128 PolarHBondContact O-N 3.13Å; W125-S128 PolarHBondContact O-N 2.94Å; V126-S128 VanDerWaalsContact C-N 3.34Å; V126-S128 PolarHBondContact O-N 3.39Å; S128-S131 PolarHBondContact O-N 2.91Å
129	L	40.5	Very low	50.4	Low	63 Å²	63	103.7 Å²	103.7	33%	0.33	56%	0.556	S	S	.	*	H	α-helix	trans	-63.2	-40.3	176.2	-84.1	158.7	0	0	0	111.4	W125 V126 S131 Y134 Q239	W125-L129 WeakPolarHBondContact O-CB 3.46Å; W125-L129 WeakPolarHBondContact O-CD1 3.23Å; W125-L129 WeakPolarHBondContact O-CG 3.5Å; W125-L129 PolarHBondContact O-N 2.97Å; V126-L129 PolarHBondContact O-N 2.9Å; L129-S131 VanDerWaalsContact C-N 3.3Å; L129-S131 PolarHBondContact O-N 2.97Å; L129-Y134 WeakPolarHBondContact O-CE2 3.38Å; L129-Y134 PolarHBondContact O-OH 3.13Å; L129-Q239 VanDerWaalsContact CD2-NE2 3.34Å
130	Y	43.9	Very low	53.1	Low	175 Å²	175	101.1 Å²	101.1	69%	0.686	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.9	177.5	-76.2	-76.7	0	0	0	115.4	V126	V126-Y130 HydrophobicContact CG1-CD2 4.39Å; V126-Y130 HydrophobicContact CG1-CE2 4.07Å; V126-Y130 WeakPolarHBondContact O-CD2 3.19Å; V126-Y130 PolarHBondContact O-N 2.75Å
131	S	43.3	Very low	55.9	Low	100 Å²	100	97.6 Å²	97.6	70%	0.699	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-1.7	-177.4	-67.5	0	0	0	0	114.9	D127 S128 L129	D127-S131 PolarHBondContact O-OG 3.3Å; S128-S131 PolarHBondContact O-N 2.91Å; L129-S131 VanDerWaalsContact C-N 3.3Å; L129-S131 PolarHBondContact O-N 2.97Å
132	M	46.4	Very low	58.7	Low	124 Å²	124	93 Å²	93	61%	0.611	50%	0.5	S	S	*	.	S	Bend	trans	-87.2	132.7	172.9	-68.6	-64.6	-68.9	0	0	109	Y134	M132-Y134 VanDerWaalsContact C-N 3.35Å; M132-Y134 PolarHBondContact O-N 2.65Å
133	P	51.8	Low	61.5	Low	118 Å²	118	90.9 Å²	90.9	77%	0.766	48%	0.484	S	S	*	.			trans	-60.6	105.3	167.2	25.9	-30.4	0	0	0	106.5	E135	P133-E135 VanDerWaalsContact C-N 3.26Å; P133-E135 PolarHBondContact O-N 2.89Å
134	Y	58	Low	64	Low	84 Å²	84	87.3 Å²	87.3	33%	0.329	47%	0.465	S	S	.	.			trans	-64.4	94.9	175.3	-76.3	-80.1	0	0	0	107.2	L129 M132 L136 M237	L129-Y134 WeakPolarHBondContact O-CE2 3.38Å; L129-Y134 PolarHBondContact O-OH 3.13Å; M132-Y134 VanDerWaalsContact C-N 3.35Å; M132-Y134 PolarHBondContact O-N 2.65Å; Y134-L136 VanDerWaalsContact C-N 3.35Å; Y134-L136 PolarHBondContact O-N 2.81Å; Y134-M237 HydrophobicContact CD1-CB 4.41Å; Y134-M237 WeakPolarHBondContact CD1-O 3.27Å; Y134-M237 HydrophobicContact CE1-CB 3.99Å; Y134-M237 WeakPolarHBondContact CE1-O 3.31Å
135	E	72.3	Confident	66.5	Low	151 Å²	151	83.2 Å²	83.2	71%	0.706	44%	0.439	S	S	*	.			trans	-67.6	102	170.1	-166.9	173.6	-160.1	0	0	106.4	P133	P133-E135 VanDerWaalsContact C-N 3.26Å; P133-E135 PolarHBondContact O-N 2.89Å
136	L	83	Confident	69.2	Low	108 Å²	108	75.3 Å²	75.3	57%	0.565	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-56.1	146.4	179.2	-69	172.8	0	0	0	109.7	Y134 T138 N233	Y134-L136 VanDerWaalsContact C-N 3.35Å; Y134-L136 PolarHBondContact O-N 2.81Å; L136-T138 PolarHBondContact O-N 3.42Å; L136-N233 HydrophobicContact CD2-CB 4.48Å
137	C	86.8	Confident	71.8	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.014	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-60.9	127.4	173	-168.5	0	0	0	0	109.3	A190 K229 V232 N233	C137-A190 WeakPolarHBondContact SG-CB 3.31Å; C137-K229 HydrophobicContact CB-CG 4.3Å; C137-K229 WeakPolarHBondContact O-CD 3.2Å; C137-K229 WeakPolarHBondContact O-CE 3.42Å; C137-K229 WeakPolarHBondContact O-CG 3.44Å; C137-V232 HydrophobicContact CB-CB 3.98Å; C137-V232 HydrophobicContact CB-CG1 3.63Å; C137-N233 VanDerWaalsContact CB-OD1 3.28Å; C137-N233 WeakPolarHBondContact CB-OD1 3.34Å; C137-N233 PolarHBondContact N-OD1 3Å; C137-N233 PolarHBondContact O-ND2 3.4Å
138	T	90.5	Very high	74.6	Confident	69 Å²	69	68.4 Å²	68.4	42%	0.423	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-92.2	162.2	172.8	70.8	0	0	0	0	110	L136 D140 D141 A190	L136-T138 PolarHBondContact O-N 3.42Å; T138-D140 PolarHBondContact O-N 3.39Å; T138-D141 WeakPolarHBondContact CA-OD2 3.45Å; T138-D141 WeakPolarHBondContact CB-OD2 3.48Å; T138-D141 PolarHBondContact N-OD2 2.96Å; T138-D141 WeakPolarHBondContact O-CB 3.25Å; T138-D141 PolarHBondContact O-N 2.94Å; T138-D141 PolarHBondContact OG1-OD2 3.42Å; T138-A190 WeakPolarHBondContact O-CB 3.46Å
139	D	92	Very high	77	Confident	71 Å²	71	65.4 Å²	65.4	38%	0.38	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.7	-174.7	-73.9	7.2	0	0	0	113.6	A190 K191 K229	D139-A190 PolarHBondContact O-N 3.13Å; D139-K191 HydrophobicContact CB-CB 4Å; D139-K191 HydrophobicContact CB-CD 4.47Å; D139-K191 PolarHBondContact O-N 3.45Å; D139-K229 WeakPolarHBondContact OD1-CD 3.11Å; D139-K229 WeakPolarHBondContact OD1-CE 3.49Å; D139-K229 IonicContact OD1-NZ 2.55Å; D139-K229 PolarHBondContact OD1-NZ 3.46Å
140	D	92.2	Very high	79.4	Confident	100 Å²	100	63.7 Å²	63.7	54%	0.535	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	7	-176.1	-59.8	-49.5	0	0	0	112.8	T138 Y189 K191	T138-D140 PolarHBondContact O-N 3.39Å; D140-Y189 WeakPolarHBondContact O-CD1 3.33Å; D140-Y189 WeakPolarHBondContact O-CE1 3.31Å; D140-K191 IonicContact OD1-NZ 3.08Å; D140-K191 PolarHBondContact OD1-NZ 3.37Å
141	D	89.3	Confident	81.5	Confident	25 Å²	25	56.2 Å²	56.2	13%	0.134	31%	0.311	C	S	.	.			trans	-69.4	131.7	172.1	-78.6	-56.3	0	0	0	111.1	T138 Y189 A190 K240	T138-D141 WeakPolarHBondContact CA-OD2 3.45Å; T138-D141 WeakPolarHBondContact CB-OD2 3.48Å; T138-D141 PolarHBondContact N-OD2 2.96Å; T138-D141 WeakPolarHBondContact O-CB 3.25Å; T138-D141 PolarHBondContact O-N 2.94Å; T138-D141 PolarHBondContact OG1-OD2 3.42Å; D141-Y189 CarbonylContact O-C 3.45Å; D141-Y189 WeakPolarHBondContact O-CA 3.13Å; D141-A190 HydrophobicContact CB-CB 4.36Å; D141-A190 PolarHBondContact O-N 2.92Å; D141-K240 HydrophobicContact CB-CD 4.14Å; D141-K240 WeakPolarHBondContact OD1-CE 3.15Å; D141-K240 IonicContact OD1-NZ 2.72Å; D141-K240 PolarHBondContact OD1-NZ 2.84Å; D141-K240 WeakPolarHBondContact OD2-CE 3.06Å; D141-K240 IonicContact OD2-NZ 3.22Å; D141-K240 PolarHBondContact OD2-NZ 3.45Å
142	P	89.9	Confident	83.5	Confident	80 Å²	80	54.1 Å²	54.1	52%	0.519	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.7	175.1	29.6	-33.1	0	0	0	110.7	T188	P142-T188 CarbonylContact C-O 3.56Å; P142-T188 WeakPolarHBondContact CA-O 3.33Å
143	I	89.3	Confident	85.2	Confident	3 Å²	3	56 Å²	56	2%	0.015	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.1	179.9	-55.5	-60.5	0	0	0	109.8	M187 T188 A190 L228 V232 K240 I243	I143-M187 VanDerWaalsContact C-SD 3.54Å; I143-T188 PolarHBondContact N-O 3.31Å; I143-T188 PolarHBondContact O-N 3.33Å; I143-A190 HydrophobicContact CD1-CB 4.5Å; I143-A190 HydrophobicContact CG1-CB 3.82Å; I143-L228 HydrophobicContact CB-CD1 3.94Å; I143-L228 HydrophobicContact CG1-CB 4.48Å; I143-L228 HydrophobicContact CG2-CB 4.44Å; I143-L228 HydrophobicContact CG2-CD1 3.92Å; I143-V232 HydrophobicContact CD1-CG2 4.05Å; I143-K240 HydrophobicContact CD1-CB 4.23Å; I143-K240 HydrophobicContact CD1-CG 4.24Å; I143-I243 HydrophobicContact CG2-CD1 3.67Å; I143-I243 HydrophobicContact CG2-CG1 4.06Å
144	S	88	Confident	86.5	Confident	42 Å²	42	54.2 Å²	54.2	29%	0.294	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.9	169.6	-58.5	0	0	0	0	109.8	M187 Y242 I243	S144-M187 WeakPolarHBondContact OG-CE 3.29Å; S144-M187 PolarHBondContact OG-SD 3.27Å; S144-Y242 WeakPolarHBondContact O-CA 3.45Å; S144-I243 PolarHBondContact O-N 3.34Å
145	V	91.7	Very high	87.7	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	143.6	-177.7	61.4	0	0	0	0	111.5	F147 Y185 F186 F197 L228 I243 F245	V145-F147 HydrophobicContact CG1-CE2 4.12Å; V145-F147 HydrophobicContact CG2-CD2 4.37Å; V145-F147 HydrophobicContact CG2-CE2 3.64Å; V145-F147 HydrophobicContact CG2-CZ 3.76Å; V145-Y185 CarbonylContact O-C 3.33Å; V145-Y185 WeakPolarHBondContact O-CA 3.46Å; V145-F186 HydrophobicContact CG1-CB 3.84Å; V145-F186 HydrophobicContact CG1-CD2 4.46Å; V145-F186 PolarHBondContact N-O 3.39Å; V145-F186 PolarHBondContact O-N 3.34Å; V145-F186 VanDerWaalsContact O-O 3.13Å; V145-F197 HydrophobicContact CG1-CE1 3.73Å; V145-F197 HydrophobicContact CG1-CZ 3.68Å; V145-L228 HydrophobicContact CG1-CD1 4.41Å; V145-L228 HydrophobicContact CG2-CD2 4.4Å; V145-I243 CarbonylContact C-O 3.59Å; V145-I243 VanDerWaalsContact CA-O 3.25Å; V145-I243 WeakPolarHBondContact CA-O 3.06Å; V145-F245 HydrophobicContact CG2-CD2 3.36Å; V145-F245 HydrophobicContact CG2-CE2 3.31Å
146	G	90.2	Very high	87.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	159.7	168.6	0	0	0	0	0	112.5	C184 Y242 I243 F245	G146-C184 CarbonylContact C-O 3.48Å; G146-C184 VanDerWaalsContact CA-O 3.23Å; G146-C184 WeakPolarHBondContact CA-O 3.42Å; G146-Y242 WeakPolarHBondContact CA-OH 3.47Å; G146-I243 PolarHBondContact N-O 3.45Å; G146-F245 PolarHBondContact O-N 2.91Å
147	F	93.3	Very high	87	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133.4	176.6	-58.7	-96	0	0	0	109.3	V145 S183 C184 F186 F197 I201 F215 F245 F247	V145-F147 HydrophobicContact CG1-CE2 4.12Å; V145-F147 HydrophobicContact CG2-CD2 4.37Å; V145-F147 HydrophobicContact CG2-CE2 3.64Å; V145-F147 HydrophobicContact CG2-CZ 3.76Å; F147-S183 CarbonylContact O-C 3.55Å; F147-S183 VanDerWaalsContact O-CA 3.23Å; F147-S183 WeakPolarHBondContact O-CA 3.37Å; F147-C184 PolarHBondContact N-O 2.84Å; F147-C184 PolarHBondContact O-N 3.36Å; F147-F186 AromaticContact CD2-CD2 3.86Å; F147-F186 HydrophobicContact CD2-CD2 3.86Å; F147-F186 AromaticContact CD2-CE2 3.75Å; F147-F186 HydrophobicContact CD2-CE2 3.75Å; F147-F186 AromaticContact CE2-CD2 3.7Å; F147-F186 HydrophobicContact CE2-CD2 3.7Å; F147-F186 AromaticContact CE2-CE2 3.88Å; F147-F186 HydrophobicContact CE2-CE2 3.88Å; F147-F197 HydrophobicContact CE1-CB 4.01Å; F147-F197 HydrophobicContact CE1-CG 4.32Å; F147-F197 HydrophobicContact CE2-CB 4.13Å; F147-F197 AromaticContact CE2-CD1 3.46Å; F147-F197 HydrophobicContact CE2-CD1 3.46Å; F147-F197 VanDerWaalsContact CE2-CD1 3.46Å; F147-F197 AromaticContact CE2-CE1 3.93Å; F147-F197 HydrophobicContact CE2-CE1 3.93Å; F147-F197 AromaticContact CE2-CG 3.85Å; F147-F197 HydrophobicContact CE2-CG 3.85Å; F147-F197 HydrophobicContact CZ-CB 3.49Å; F147-F197 VanDerWaalsContact CZ-CB 3.49Å; F147-F197 AromaticContact CZ-CD1 3.52Å; F147-F197 HydrophobicContact CZ-CD1 3.52Å; F147-F197 AromaticContact CZ-CD2 3.92Å; F147-F197 HydrophobicContact CZ-CD2 3.92Å; F147-F197 HydrophobicContact CZ-CE1 4.14Å; F147-F197 HydrophobicContact CZ-CE2 4.49Å; F147-F197 AromaticContact CZ-CG 3.36Å; F147-F197 HydrophobicContact CZ-CG 3.36Å; F147-I201 HydrophobicContact CB-CD1 3.73Å; F147-I201 HydrophobicContact CD1-CD1 3.44Å; F147-I201 VanDerWaalsContact CD1-CD1 3.44Å; F147-I201 HydrophobicContact CD2-CD1 3.79Å; F147-I201 HydrophobicContact CE1-CD1 3.96Å; F147-I201 HydrophobicContact CE2-CD1 4.27Å; F147-I201 HydrophobicContact CG-CD1 3.36Å; F147-I201 HydrophobicContact CZ-CD1 4.36Å; F147-F215 AromaticContact CD1-CD1 3.62Å; F147-F215 HydrophobicContact CD1-CD1 3.62Å; F147-F215 AromaticContact CD1-CE1 3.39Å; F147-F215 HydrophobicContact CD1-CE1 3.39Å; F147-F215 HydrophobicContact CD1-CZ 4.2Å; F147-F215 AromaticContact CE1-CD1 3.71Å; F147-F215 HydrophobicContact CE1-CD1 3.71Å; F147-F215 AromaticContact CE1-CE1 3.51Å; F147-F215 HydrophobicContact CE1-CE1 3.51Å; F147-F215 HydrophobicContact CE1-CG 4.34Å; F147-F215 AromaticContact CE1-CZ 3.93Å; F147-F215 HydrophobicContact CE1-CZ 3.93Å; F147-F215 HydrophobicContact CG-CE1 4.48Å; F147-F245 CarbonylContact C-O 3.53Å; F147-F245 VanDerWaalsContact CA-O 3.27Å; F147-F245 WeakPolarHBondContact CA-O 3.47Å; F147-F245 HydrophobicContact CD1-CB 3.62Å; F147-F245 HydrophobicContact CD1-CD2 4.22Å; F147-F245 HydrophobicContact CD1-CG 4.22Å; F147-F245 HydrophobicContact CE1-CB 3.83Å; F147-F245 AromaticContact CE1-CD2 3.69Å; F147-F245 HydrophobicContact CE1-CD2 3.69Å; F147-F245 AromaticContact CE1-CG 3.91Å; F147-F245 HydrophobicContact CE1-CG 3.91Å; F147-F245 HydrophobicContact CG-CB 4.45Å; F147-F245 AromaticContact CZ-CD2 3.94Å; F147-F245 HydrophobicContact CZ-CD2 3.94Å; F147-F247 HydrophobicContact CB-CD1 4.03Å; F147-F247 HydrophobicContact CB-CE1 4.22Å
148	Q	93	Very high	85.8	Confident	56 Å²	56	50 Å²	50	26%	0.262	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137.1	-179.7	-173.9	171.7	27.2	0	0	111.9	S182 L244 F245 Y246 F247	Q148-S182 CarbonylContact C-O 3.5Å; Q148-S182 WeakPolarHBondContact CA-O 3.27Å; Q148-L244 HydrophobicContact CB-CD1 4.19Å; Q148-F245 PolarHBondContact N-O 3.3Å; Q148-Y246 HydrophobicContact CB-CD1 3.97Å; Q148-Y246 HydrophobicContact CB-CE1 4.16Å; Q148-Y246 HydrophobicContact CG-CD1 4.36Å; Q148-Y246 HydrophobicContact CG-CE1 4.33Å; Q148-Y246 CarbonylContact O-C 3.19Å; Q148-Y246 VanDerWaalsContact O-CA 3.27Å; Q148-Y246 WeakPolarHBondContact O-CA 3.43Å; Q148-Y246 VanDerWaalsContact OE1-CE1 3.31Å; Q148-F247 WeakPolarHBondContact O-CD1 3.28Å; Q148-F247 PolarHBondContact O-N 2.91Å
149	F	92	Very high	84.2	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	144.3	170.3	168.4	-85.5	0	0	0	110.5	V169 V172 V173 L178 P181 S182 F247 V249	F149-V169 HydrophobicContact CE1-CG1 4.17Å; F149-V169 HydrophobicContact CZ-CG1 3.94Å; F149-V169 HydrophobicContact CZ-CG2 4.49Å; F149-V172 HydrophobicContact CE1-CG1 4.13Å; F149-V172 HydrophobicContact CE2-CB 4.42Å; F149-V172 HydrophobicContact CE2-CG1 3.76Å; F149-V172 HydrophobicContact CZ-CB 3.87Å; F149-V172 HydrophobicContact CZ-CG1 3.36Å; F149-V173 HydrophobicContact CE1-CG2 3.96Å; F149-V173 HydrophobicContact CZ-CG2 4.49Å; F149-L178 HydrophobicContact CE1-CB 4.4Å; F149-P181 CarbonylContact O-C 3.53Å; F149-P181 WeakPolarHBondContact O-CA 3.21Å; F149-P181 WeakPolarHBondContact O-CB 3.47Å; F149-S182 PolarHBondContact N-O 2.85Å; F149-S182 PolarHBondContact O-N 3.17Å; F149-F247 HydrophobicContact CB-CD1 3.99Å; F149-F247 HydrophobicContact CB-CD2 4.07Å; F149-F247 HydrophobicContact CB-CE1 3.48Å; F149-F247 VanDerWaalsContact CB-CE1 3.48Å; F149-F247 HydrophobicContact CB-CE2 3.56Å; F149-F247 HydrophobicContact CB-CG 4.28Å; F149-F247 HydrophobicContact CB-CZ 3.24Å; F149-F247 HydrophobicContact CD2-CD2 4.18Å; F149-F247 AromaticContact CD2-CE2 3.99Å; F149-F247 HydrophobicContact CD2-CE2 3.99Å; F149-F247 WeakPolarHBondContact CD2-O 3.48Å; F149-F247 HydrophobicContact CG-CE2 4.05Å; F149-F247 HydrophobicContact CG-CZ 4.16Å; F149-V249 HydrophobicContact CE2-CG2 4.23Å
150	P	90.8	Very high	82.4	Confident	27 Å²	27	61 Å²	61	18%	0.175	35%	0.348	C	S	.	.	S	Bend	cis	-80.3	173.7	-7.3	34.8	-37.9	0	0	0	112.5	V169 N180	P150-V169 HydrophobicContact CB-CB 4.48Å; P150-V169 HydrophobicContact CB-CG1 4.01Å; P150-V169 HydrophobicContact CB-CG2 3.57Å; P150-V169 HydrophobicContact CG-CG1 3.98Å; P150-V169 HydrophobicContact CG-CG2 4.18Å; P150-N180 WeakPolarHBondContact CD-OD1 3.21Å
151	I	88	Confident	80.8	Confident	18 Å²	18	58.1 Å²	58.1	9%	0.092	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-59.9	127.4	161.5	-56.1	-178.4	0	0	0	108	Y155 F156 A216 F247 R248	I151-Y155 VanDerWaalsContact CG2-CB 3.5Å; I151-Y155 HydrophobicContact CG2-CD1 3.68Å; I151-Y155 HydrophobicContact CG2-CG 3.71Å; I151-F156 HydrophobicContact CD1-CE2 3.94Å; I151-F156 HydrophobicContact CD1-CZ 3.68Å; I151-F156 HydrophobicContact CG2-CE2 4Å; I151-F156 HydrophobicContact CG2-CZ 4.23Å; I151-A216 HydrophobicContact CD1-CB 3.81Å; I151-A216 HydrophobicContact CG1-CB 4.46Å; I151-F247 PolarHBondContact N-O 3.34Å; I151-R248 HydrophobicContact CD1-CB 3.91Å; I151-R248 HydrophobicContact CD1-CG 3.9Å; I151-R248 HydrophobicContact CG1-CB 4.18Å
152	P	85.8	Confident	79.3	Confident	55 Å²	55	64.8 Å²	64.8	36%	0.357	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-58.1	146.5	179	-25.4	33.9	0	0	0	112.7	G154 Y155 Y246	P152-G154 PolarHBondContact O-N 3.49Å; P152-Y155 WeakPolarHBondContact O-CB 3.41Å; P152-Y155 PolarHBondContact O-N 3.16Å; P152-Y155 VanDerWaalsContact O-N 3.09Å; P152-Y246 VanDerWaalsContact CD-CD1 3.44Å; P152-Y246 HydrophobicContact CG-CD1 4.09Å; P152-Y246 HydrophobicContact CG-CE1 3.66Å
153	N	81.3	Confident	77.8	Confident	165 Å²	165	62.6 Å²	62.6	88%	0.882	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	134.5	172.2	-68.1	-16	0	0	0	109.9	Y155	N153-Y155 VanDerWaalsContact C-N 3.27Å; N153-Y155 PolarHBondContact O-N 3.06Å
154	G	80.1	Confident	76.1	Confident	80 Å²	80	73.9 Å²	73.9	83%	0.825	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	12.8	-176.6	0	0	0	0	0	114.4	P152	P152-G154 PolarHBondContact O-N 3.49Å
155	Y	82	Confident	75.1	Confident	30 Å²	30	73.4 Å²	73.4	12%	0.118	39%	0.394	C	S	.	.			trans	-63.9	-42.2	175.6	-173.9	-100	0	0	0	112.1	I151 P152 N153 A216 F217 A218 Y219 Y246	I151-Y155 VanDerWaalsContact CG2-CB 3.5Å; I151-Y155 HydrophobicContact CG2-CD1 3.68Å; I151-Y155 HydrophobicContact CG2-CG 3.71Å; P152-Y155 WeakPolarHBondContact O-CB 3.41Å; P152-Y155 PolarHBondContact O-N 3.16Å; P152-Y155 VanDerWaalsContact O-N 3.09Å; N153-Y155 VanDerWaalsContact C-N 3.27Å; N153-Y155 PolarHBondContact O-N 3.06Å; Y155-A216 HydrophobicContact CD1-CB 4.34Å; Y155-A216 HydrophobicContact CE1-CB 3.83Å; Y155-F217 WeakPolarHBondContact OH-CA 3.48Å; Y155-A218 PolarHBondContact OH-N 2.9Å; Y155-Y219 HydrophobicContact CD2-CD1 4.23Å; Y155-Y219 HydrophobicContact CD2-CE1 4.49Å; Y155-Y219 HydrophobicContact CE1-CD1 4.48Å; Y155-Y219 HydrophobicContact CE2-CD1 4.07Å; Y155-Y219 HydrophobicContact CE2-CE1 4.32Å; Y155-Y219 HydrophobicContact CG-CD1 4.5Å; Y155-Y219 WeakPolarHBondContact O-CD1 3.15Å; Y155-Y219 PolarHBondContact OH-N 3.15Å; Y155-Y246 HydrophobicContact CD2-CD2 4.02Å; Y155-Y246 AromaticContact CD2-CE2 3.95Å; Y155-Y246 HydrophobicContact CD2-CE2 3.95Å; Y155-Y246 HydrophobicContact CE1-CD2 4.23Å; Y155-Y246 AromaticContact CE2-CD2 3.43Å; Y155-Y246 HydrophobicContact CE2-CD2 3.43Å; Y155-Y246 VanDerWaalsContact CE2-CD2 3.43Å; Y155-Y246 AromaticContact CE2-CE2 3.32Å; Y155-Y246 HydrophobicContact CE2-CE2 3.32Å; Y155-Y246 AromaticContact CZ-CD2 3.55Å; Y155-Y246 AromaticContact CZ-CE2 3.87Å
156	F	77	Confident	74.3	Confident	41 Å²	41	75.8 Å²	75.8	18%	0.18	41%	0.411	C	S	.	.	S	Bend	trans	-80.8	133.1	177.5	-58.1	-66.4	0	0	0	110.6	I151 D158 Q161 A216 Y219 L221	I151-F156 HydrophobicContact CD1-CE2 3.94Å; I151-F156 HydrophobicContact CD1-CZ 3.68Å; I151-F156 HydrophobicContact CG2-CE2 4Å; I151-F156 HydrophobicContact CG2-CZ 4.23Å; F156-D158 VanDerWaalsContact C-N 3.32Å; F156-Q161 HydrophobicContact CB-CB 4.28Å; F156-Q161 HydrophobicContact CD1-CB 3.86Å; F156-Q161 VanDerWaalsContact CD1-CD 3.49Å; F156-Q161 HydrophobicContact CD1-CG 4.26Å; F156-Q161 HydrophobicContact CD2-CB 4.19Å; F156-Q161 HydrophobicContact CE1-CB 4.2Å; F156-Q161 HydrophobicContact CE2-CB 4.5Å; F156-Q161 HydrophobicContact CG-CB 3.85Å; F156-Q161 HydrophobicContact CZ-CB 4.49Å; F156-A216 HydrophobicContact CE1-CB 3.98Å; F156-A216 HydrophobicContact CZ-CB 3.94Å; F156-Y219 WeakPolarHBondContact CD1-O 3.39Å; F156-L221 HydrophobicContact CE1-CD2 4.3Å; F156-L221 HydrophobicContact CE1-CG 4.19Å; F156-L221 HydrophobicContact CZ-CD2 3.88Å; F156-L221 HydrophobicContact CZ-CG 4.17Å
157	S	64.5	Low	73.8	Confident	86 Å²	86	76.5 Å²	76.5	60%	0.601	42%	0.415	S	S	*	.	S	Bend	trans	-68.2	-33.8	175.2	51.7	0	0	0	0	112.2
158	D	61.6	Low	73.3	Confident	99 Å²	99	80.1 Å²	80.1	53%	0.529	44%	0.438	S	S	.	.	S	Bend	trans	-112.2	133.4	179.3	-65.6	-34.9	0	0	0	110.7	F156 M160 Q161	F156-D158 VanDerWaalsContact C-N 3.32Å; D158-M160 HydrophobicContact CB-CB 4.36Å; D158-M160 PolarHBondContact O-N 3.3Å; D158-Q161 PolarHBondContact O-N 3.29Å
159	Q	55.5	Low	72.7	Confident	193 Å²	193	79.6 Å²	79.6	90%	0.902	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-61.3	-6.6	173.7	-64.6	-174.2	5.5	0	0	113.4	Q161	Q159-Q161 PolarHBondContact O-N 3.45Å
160	M	55.8	Low	72.3	Confident	177 Å²	177	85.8 Å²	85.8	87%	0.872	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-71.2	-11	-178.2	-68.6	-73.6	176.3	0	0	114.1	D158	D158-M160 HydrophobicContact CB-CB 4.36Å; D158-M160 PolarHBondContact O-N 3.3Å
161	Q	57.7	Low	72	Confident	41 Å²	41	87.9 Å²	87.9	19%	0.192	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-95.7	13.7	-177.2	-65.8	-168.1	49.4	0	0	114.5	F156 D158 Q159 P163 Y219 L221 R248	F156-Q161 HydrophobicContact CB-CB 4.28Å; F156-Q161 HydrophobicContact CD1-CB 3.86Å; F156-Q161 VanDerWaalsContact CD1-CD 3.49Å; F156-Q161 HydrophobicContact CD1-CG 4.26Å; F156-Q161 HydrophobicContact CD2-CB 4.19Å; F156-Q161 HydrophobicContact CE1-CB 4.2Å; F156-Q161 HydrophobicContact CE2-CB 4.5Å; F156-Q161 HydrophobicContact CG-CB 3.85Å; F156-Q161 HydrophobicContact CZ-CB 4.49Å; D158-Q161 PolarHBondContact O-N 3.29Å; Q159-Q161 PolarHBondContact O-N 3.45Å; Q161-P163 VanDerWaalsContact O-CD 3.25Å; Q161-P163 WeakPolarHBondContact O-CD 3.17Å; Q161-Y219 PolarHBondContact NE2-O 3.2Å; Q161-L221 HydrophobicContact CB-CD1 4.26Å; Q161-R248 PolarHBondContact O-NH1 3.41Å; Q161-R248 PolarHBondContact O-NH2 3.39Å; Q161-R248 VanDerWaalsContact O-NH2 3.15Å
162	E	57.3	Low	71.7	Confident	165 Å²	165	87 Å²	87	77%	0.771	48%	0.477	S	S	*	.			trans	-80.7	107.9	164.2	-71	-162.4	168.5	0	0	109.9
163	P	58.1	Low	71.5	Confident	34 Å²	34	86.5 Å²	86.5	22%	0.221	47%	0.472	C	S	.	.			trans	-83.1	152.5	-174.3	37.5	-37.4	0	0	0	108.1	Q161 G165 S166 L250	Q161-P163 VanDerWaalsContact O-CD 3.25Å; Q161-P163 WeakPolarHBondContact O-CD 3.17Å; P163-G165 PolarHBondContact O-N 3.06Å; P163-G165 VanDerWaalsContact O-N 3.14Å; P163-S166 PolarHBondContact O-N 3.41Å; P163-L250 HydrophobicContact CG-CD2 3.66Å
164	Y	54.5	Low	71.7	Confident	239 Å²	239	86.8 Å²	86.8	94%	0.937	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	121	164.8	-131	-99.6	0	0	0	109.4
165	G	67	Low	71.9	Confident	33 Å²	33	87.9 Å²	87.9	34%	0.34	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	5	177	0	0	0	0	0	116.4	P163 V167 L250 K251	P163-G165 PolarHBondContact O-N 3.06Å; P163-G165 VanDerWaalsContact O-N 3.14Å; G165-V167 PolarHBondContact O-N 2.85Å; G165-L250 CarbonylContact O-C 3.56Å; G165-L250 WeakPolarHBondContact O-CA 3.12Å; G165-K251 PolarHBondContact O-N 3.28Å
166	S	75.2	Confident	72	Confident	51 Å²	51	87.8 Å²	87.8	36%	0.357	45%	0.451	S	S	.	.	B	Isolated β-bridge	trans	-59.5	125.7	169.4	-176.8	0	0	0	0	110.7	P163	P163-S166 PolarHBondContact O-N 3.41Å
167	V	80	Confident	72.3	Confident	15 Å²	15	92.8 Å²	92.8	9%	0.091	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-87.9	128.2	179.3	-173.7	0	0	0	0	108.6	G165 V169 I171 V172 Y211 V249 K251	G165-V167 PolarHBondContact O-N 2.85Å; V167-V169 PolarHBondContact O-N 3.17Å; V167-I171 HydrophobicContact CG1-CB 3.83Å; V167-I171 HydrophobicContact CG1-CG2 3.64Å; V167-V172 HydrophobicContact CB-CG2 3.61Å; V167-V172 HydrophobicContact CG1-CG2 3.6Å; V167-Y211 HydrophobicContact CG2-CD1 4.2Å; V167-Y211 HydrophobicContact CG2-CE1 4.12Å; V167-V249 PolarHBondContact N-O 3.43Å; V167-K251 HydrophobicContact CG2-CB 3.62Å
168	P	81.9	Confident	73.2	Confident	76 Å²	76	89 Å²	89	49%	0.494	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-51.2	137.1	175.2	-27.7	33.7	0	0	0	112.1	D170 I171 V172	P168-D170 PolarHBondContact O-N 3.09Å; P168-D170 VanDerWaalsContact O-N 3.16Å; P168-I171 HydrophobicContact CB-CB 4.48Å; P168-I171 HydrophobicContact CB-CD1 4.16Å; P168-I171 HydrophobicContact CB-CG1 4.16Å; P168-I171 HydrophobicContact CG-CD1 3.9Å; P168-I171 HydrophobicContact CG-CG1 4.45Å; P168-I171 WeakPolarHBondContact O-CA 3.45Å; P168-I171 WeakPolarHBondContact O-CB 3.36Å; P168-I171 PolarHBondContact O-N 3.31Å; P168-V172 PolarHBondContact O-N 2.93Å
169	V	81.5	Confident	74.1	Confident	45 Å²	45	87.7 Å²	87.7	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-52.4	-42.3	-176.1	175.4	0	0	0	0	111.8	F149 P150 V167 I171 V172 V173	F149-V169 HydrophobicContact CE1-CG1 4.17Å; F149-V169 HydrophobicContact CZ-CG1 3.94Å; F149-V169 HydrophobicContact CZ-CG2 4.49Å; P150-V169 HydrophobicContact CB-CB 4.48Å; P150-V169 HydrophobicContact CB-CG1 4.01Å; P150-V169 HydrophobicContact CB-CG2 3.57Å; P150-V169 HydrophobicContact CG-CG1 3.98Å; P150-V169 HydrophobicContact CG-CG2 4.18Å; V167-V169 PolarHBondContact O-N 3.17Å; V169-I171 VanDerWaalsContact C-N 3.27Å; V169-I171 PolarHBondContact O-N 2.85Å; V169-V172 WeakPolarHBondContact O-CB 3.27Å; V169-V172 PolarHBondContact O-N 3.17Å; V169-V173 HydrophobicContact CG1-CG2 4.06Å; V169-V173 WeakPolarHBondContact O-CB 3.39Å; V169-V173 VanDerWaalsContact O-CG2 3.28Å; V169-V173 WeakPolarHBondContact O-CG2 3.5Å; V169-V173 PolarHBondContact O-N 2.84Å
170	D	83.1	Confident	75.3	Confident	132 Å²	132	82.9 Å²	82.9	71%	0.706	43%	0.432	S	S	*	.	H	α-helix	trans	-62.2	-35.5	179.7	-62	-27.3	0	0	0	112.6	P168 K174	P168-D170 PolarHBondContact O-N 3.09Å; P168-D170 VanDerWaalsContact O-N 3.16Å; D170-K174 VanDerWaalsContact O-CB 3.23Å; D170-K174 WeakPolarHBondContact O-CB 3.41Å; D170-K174 PolarHBondContact O-N 3.09Å
171	I	84.2	Confident	76.5	Confident	70 Å²	70	78.5 Å²	78.5	36%	0.359	42%	0.416	S	S	.	.	H	α-helix	trans	-72.1	-44.4	175.9	-61.8	-179	0	0	0	109.4	V167 P168 V169 K174 E175	V167-I171 HydrophobicContact CG1-CB 3.83Å; V167-I171 HydrophobicContact CG1-CG2 3.64Å; P168-I171 HydrophobicContact CB-CB 4.48Å; P168-I171 HydrophobicContact CB-CD1 4.16Å; P168-I171 HydrophobicContact CB-CG1 4.16Å; P168-I171 HydrophobicContact CG-CD1 3.9Å; P168-I171 HydrophobicContact CG-CG1 4.45Å; P168-I171 WeakPolarHBondContact O-CA 3.45Å; P168-I171 WeakPolarHBondContact O-CB 3.36Å; P168-I171 PolarHBondContact O-N 3.31Å; V169-I171 VanDerWaalsContact C-N 3.27Å; V169-I171 PolarHBondContact O-N 2.85Å; I171-K174 PolarHBondContact O-N 3.07Å; I171-E175 HydrophobicContact CG2-CG 3.85Å; I171-E175 WeakPolarHBondContact CG2-OE2 3.42Å; I171-E175 VanDerWaalsContact O-CB 3.28Å; I171-E175 WeakPolarHBondContact O-CB 3.49Å; I171-E175 WeakPolarHBondContact O-CG 3.27Å; I171-E175 PolarHBondContact O-N 2.98Å
172	V	82	Confident	77.7	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.006	41%	0.408	C	S	.	.	H	α-helix	trans	-58.3	-50.9	176.7	172.3	0	0	0	0	111.5	F149 V167 P168 V169 K174 L176 L178 V249	F149-V172 HydrophobicContact CE1-CG1 4.13Å; F149-V172 HydrophobicContact CE2-CB 4.42Å; F149-V172 HydrophobicContact CE2-CG1 3.76Å; F149-V172 HydrophobicContact CZ-CB 3.87Å; F149-V172 HydrophobicContact CZ-CG1 3.36Å; V167-V172 HydrophobicContact CB-CG2 3.61Å; V167-V172 HydrophobicContact CG1-CG2 3.6Å; P168-V172 PolarHBondContact O-N 2.93Å; V169-V172 WeakPolarHBondContact O-CB 3.27Å; V169-V172 PolarHBondContact O-N 3.17Å; V172-K174 VanDerWaalsContact C-N 3.25Å; V172-K174 PolarHBondContact O-N 2.9Å; V172-L176 HydrophobicContact CG1-CD1 4.11Å; V172-L176 WeakPolarHBondContact O-CA 3.38Å; V172-L176 VanDerWaalsContact O-CB 3.26Å; V172-L176 WeakPolarHBondContact O-CB 3.36Å; V172-L176 PolarHBondContact O-N 2.82Å; V172-L178 HydrophobicContact CG1-CB 4.45Å; V172-L178 HydrophobicContact CG1-CD1 3.43Å; V172-L178 VanDerWaalsContact CG1-CD1 3.43Å; V172-V249 HydrophobicContact CG1-CB 4.09Å; V172-V249 HydrophobicContact CG1-CG2 3.64Å; V172-V249 HydrophobicContact CG2-CB 3.78Å; V172-V249 HydrophobicContact CG2-CG1 4.33Å; V172-V249 HydrophobicContact CG2-CG2 4.28Å
173	V	81.9	Confident	79.3	Confident	44 Å²	44	71.3 Å²	71.3	27%	0.267	39%	0.389	S	S	.	.	H	α-helix	trans	-58.7	-40.6	179.6	169.1	0	0	0	0	110.8	F149 V169 N177 L178 N180	F149-V173 HydrophobicContact CE1-CG2 3.96Å; F149-V173 HydrophobicContact CZ-CG2 4.49Å; V169-V173 HydrophobicContact CG1-CG2 4.06Å; V169-V173 WeakPolarHBondContact O-CB 3.39Å; V169-V173 VanDerWaalsContact O-CG2 3.28Å; V169-V173 WeakPolarHBondContact O-CG2 3.5Å; V169-V173 PolarHBondContact O-N 2.84Å; V173-N177 VanDerWaalsContact O-CA 3.25Å; V173-N177 WeakPolarHBondContact O-CA 3.36Å; V173-N177 PolarHBondContact O-N 2.99Å; V173-L178 WeakPolarHBondContact CG1-O 3.45Å; V173-N180 HydrophobicContact CG2-CB 3.86Å
174	K	84.2	Confident	80.6	Confident	171 Å²	171	69.8 Å²	69.8	74%	0.743	38%	0.379	S	S	*	.	H	α-helix	trans	-78.6	-44.4	-178	-172.9	-179.9	178.9	-176.3	0	113.9	D170 I171 V172	D170-K174 VanDerWaalsContact O-CB 3.23Å; D170-K174 WeakPolarHBondContact O-CB 3.41Å; D170-K174 PolarHBondContact O-N 3.09Å; I171-K174 PolarHBondContact O-N 3.07Å; V172-K174 VanDerWaalsContact C-N 3.25Å; V172-K174 PolarHBondContact O-N 2.9Å
175	E	84.5	Confident	82.2	Confident	103 Å²	103	63.6 Å²	63.6	48%	0.481	35%	0.354	S	S	.	.	H	α-helix	trans	-79.1	-37.4	-176.2	-70.3	-173.1	165.3	0	0	112.1	I171 Y211	I171-E175 HydrophobicContact CG2-CG 3.85Å; I171-E175 WeakPolarHBondContact CG2-OE2 3.42Å; I171-E175 VanDerWaalsContact O-CB 3.28Å; I171-E175 WeakPolarHBondContact O-CB 3.49Å; I171-E175 WeakPolarHBondContact O-CG 3.27Å; I171-E175 PolarHBondContact O-N 2.98Å; E175-Y211 PolarHBondContact OE2-OH 3.22Å
176	L	84.5	Confident	83.1	Confident	28 Å²	28	64.5 Å²	64.5	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-102.3	-0.1	-175.5	-61.2	173.9	0	0	0	113.2	V172 L178 I207 Y211 V249	V172-L176 HydrophobicContact CG1-CD1 4.11Å; V172-L176 WeakPolarHBondContact O-CA 3.38Å; V172-L176 VanDerWaalsContact O-CB 3.26Å; V172-L176 WeakPolarHBondContact O-CB 3.36Å; V172-L176 PolarHBondContact O-N 2.82Å; L176-L178 HydrophobicContact CB-CD1 3.85Å; L176-L178 HydrophobicContact CB-CG 4.43Å; L176-L178 HydrophobicContact CD1-CD1 4.13Å; L176-L178 PolarHBondContact O-N 2.81Å; L176-L178 VanDerWaalsContact O-N 3.16Å; L176-I207 HydrophobicContact CD1-CG1 4.32Å; L176-I207 HydrophobicContact CD1-CG2 4.16Å; L176-Y211 HydrophobicContact CD1-CD1 4.35Å; L176-Y211 HydrophobicContact CD1-CD2 4.42Å; L176-Y211 HydrophobicContact CD1-CG 4.19Å; L176-Y211 HydrophobicContact CD2-CD2 3.85Å; L176-Y211 HydrophobicContact CD2-CE2 3.98Å; L176-Y211 HydrophobicContact CD2-CG 4.43Å; L176-V249 HydrophobicContact CD1-CG1 3.8Å; L176-V249 HydrophobicContact CD1-CG2 4.39Å
177	N	83.3	Confident	83.6	Confident	145 Å²	145	64.6 Å²	64.6	78%	0.775	35%	0.345	S	S	*	.			trans	51.9	33.7	-177.5	-65.3	-47	0	0	0	113.2	V173	V173-N177 VanDerWaalsContact O-CA 3.25Å; V173-N177 WeakPolarHBondContact O-CA 3.36Å; V173-N177 PolarHBondContact O-N 2.99Å
178	L	83.2	Confident	84	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.037	35%	0.352	C	S	.	.			trans	-74.7	132	175	-92.1	148.2	0	0	0	110	F149 V172 V173 L176 Y205 I207 V249	F149-L178 HydrophobicContact CE1-CB 4.4Å; V172-L178 HydrophobicContact CG1-CB 4.45Å; V172-L178 HydrophobicContact CG1-CD1 3.43Å; V172-L178 VanDerWaalsContact CG1-CD1 3.43Å; V173-L178 WeakPolarHBondContact CG1-O 3.45Å; L176-L178 HydrophobicContact CB-CD1 3.85Å; L176-L178 HydrophobicContact CB-CG 4.43Å; L176-L178 HydrophobicContact CD1-CD1 4.13Å; L176-L178 PolarHBondContact O-N 2.81Å; L176-L178 VanDerWaalsContact O-N 3.16Å; L178-Y205 HydrophobicContact CD2-CD1 3.42Å; L178-Y205 VanDerWaalsContact CD2-CD1 3.42Å; L178-Y205 HydrophobicContact CD2-CD2 4.16Å; L178-Y205 HydrophobicContact CD2-CE1 4.01Å; L178-Y205 HydrophobicContact CD2-CG 3.51Å; L178-I207 HydrophobicContact CD1-CD1 4.13Å; L178-I207 HydrophobicContact CD1-CG1 4.26Å; L178-V249 HydrophobicContact CD1-CG2 4.21Å
179	S	80.6	Confident	84.5	Confident	72 Å²	72	66.8 Å²	66.8	50%	0.503	35%	0.346	S	S	.	.			trans	-62.4	148.8	169	39.4	0	0	0	0	111.4	P181 S182	S179-P181 CarbonylContact O-C 3.59Å; S179-S182 VanDerWaalsContact C-OG 3.28Å; S179-S182 WeakPolarHBondContact CA-OG 3.48Å; S179-S182 WeakPolarHBondContact CB-OG 3.38Å; S179-S182 PolarHBondContact N-OG 3.35Å; S179-S182 VanDerWaalsContact N-OG 3.17Å; S179-S182 WeakPolarHBondContact O-CB 3.48Å; S179-S182 PolarHBondContact O-N 3.44Å; S179-S182 VanDerWaalsContact O-N 3.13Å; S179-S182 PolarHBondContact O-OG 2.96Å; S179-S182 PolarHBondContact OG-OG 2.9Å
180	N	80.4	Confident	85.1	Confident	92 Å²	92	64.6 Å²	64.6	49%	0.492	33%	0.333	S	S	.	.	S	Bend	trans	-126	106.2	174.8	-173.4	0.9	0	0	0	110	P150 V173	P150-N180 WeakPolarHBondContact CD-OD1 3.21Å; V173-N180 HydrophobicContact CG2-CB 3.86Å
181	P	80.8	Confident	85.6	Confident	85 Å²	85	63.3 Å²	63.3	55%	0.552	32%	0.321	S	S	*	.	S	Bend	cis	-77.3	153.8	-0.3	31.8	-34.8	0	0	0	113	F149 S179	F149-P181 CarbonylContact O-C 3.53Å; F149-P181 WeakPolarHBondContact O-CA 3.21Å; F149-P181 WeakPolarHBondContact O-CB 3.47Å; S179-P181 CarbonylContact O-C 3.59Å
182	S	84.3	Confident	86	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.007	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.7	166.2	-75.1	0	0	0	0	109.3	Q148 F149 S179	Q148-S182 CarbonylContact C-O 3.5Å; Q148-S182 WeakPolarHBondContact CA-O 3.27Å; F149-S182 PolarHBondContact N-O 2.85Å; F149-S182 PolarHBondContact O-N 3.17Å; S179-S182 VanDerWaalsContact C-OG 3.28Å; S179-S182 WeakPolarHBondContact CA-OG 3.48Å; S179-S182 WeakPolarHBondContact CB-OG 3.38Å; S179-S182 PolarHBondContact N-OG 3.35Å; S179-S182 VanDerWaalsContact N-OG 3.17Å; S179-S182 WeakPolarHBondContact O-CB 3.48Å; S179-S182 PolarHBondContact O-N 3.44Å; S179-S182 VanDerWaalsContact O-N 3.13Å; S179-S182 PolarHBondContact O-OG 2.96Å; S179-S182 PolarHBondContact OG-OG 2.9Å
183	S	89.2	Confident	86.6	Confident	54 Å²	54	65.6 Å²	65.6	38%	0.378	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.2	174.1	59.9	0	0	0	0	113.6	F147 Y185 Y205	F147-S183 CarbonylContact O-C 3.55Å; F147-S183 VanDerWaalsContact O-CA 3.23Å; F147-S183 WeakPolarHBondContact O-CA 3.37Å; S183-Y185 PolarHBondContact OG-OH 3.37Å; S183-Y205 PolarHBondContact N-OH 3.15Å; S183-Y205 PolarHBondContact O-OH 3.39Å
184	C	85.7	Confident	87.2	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.007	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	155	170.2	65	0	0	0	0	110.6	G146 F147 F186 K204	G146-C184 CarbonylContact C-O 3.48Å; G146-C184 VanDerWaalsContact CA-O 3.23Å; G146-C184 WeakPolarHBondContact CA-O 3.42Å; F147-C184 PolarHBondContact N-O 2.84Å; F147-C184 PolarHBondContact O-N 3.36Å; C184-F186 HydrophobicContact CB-CE2 4.24Å; C184-F186 HydrophobicContact CB-CZ 4.43Å; C184-F186 VanDerWaalsContact SG-CE2 3.6Å; C184-K204 HydrophobicContact CB-CD 3.66Å
185	Y	89.3	Confident	87.6	Confident	109 Å²	109	57.1 Å²	57.1	43%	0.427	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144	-172.3	-53	-89.6	0	0	0	109.3	W12 V145 S183 Y242	W12-Y185 HydrophobicContact CH2-CG 4.28Å; W12-Y185 HydrophobicContact CZ2-CG 4.19Å; V145-Y185 CarbonylContact O-C 3.33Å; V145-Y185 WeakPolarHBondContact O-CA 3.46Å; S183-Y185 PolarHBondContact OG-OH 3.37Å; Y185-Y242 HydrophobicContact CD1-CE2 4.14Å; Y185-Y242 VanDerWaalsContact CD1-OH 3.3Å; Y185-Y242 WeakPolarHBondContact CD1-OH 3.48Å; Y185-Y242 WeakPolarHBondContact CE1-OH 3.47Å
186	F	85.9	Confident	88	Confident	53 Å²	53	55.1 Å²	55.1	23%	0.232	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.7	-179.1	-52.7	-88.5	0	0	0	110.4	V145 F147 C184 F197 L200	V145-F186 HydrophobicContact CG1-CB 3.84Å; V145-F186 HydrophobicContact CG1-CD2 4.46Å; V145-F186 PolarHBondContact N-O 3.39Å; V145-F186 PolarHBondContact O-N 3.34Å; V145-F186 VanDerWaalsContact O-O 3.13Å; F147-F186 AromaticContact CD2-CD2 3.86Å; F147-F186 HydrophobicContact CD2-CD2 3.86Å; F147-F186 AromaticContact CD2-CE2 3.75Å; F147-F186 HydrophobicContact CD2-CE2 3.75Å; F147-F186 AromaticContact CE2-CD2 3.7Å; F147-F186 HydrophobicContact CE2-CD2 3.7Å; F147-F186 AromaticContact CE2-CE2 3.88Å; F147-F186 HydrophobicContact CE2-CE2 3.88Å; C184-F186 HydrophobicContact CB-CE2 4.24Å; C184-F186 HydrophobicContact CB-CZ 4.43Å; C184-F186 VanDerWaalsContact SG-CE2 3.6Å; F186-F197 HydrophobicContact CB-CE1 4.1Å; F186-F197 HydrophobicContact CD2-CD1 4.06Å; F186-F197 AromaticContact CD2-CE1 3.99Å; F186-F197 HydrophobicContact CD2-CE1 3.99Å; F186-F197 HydrophobicContact CE2-CD1 4.31Å; F186-F197 HydrophobicContact CG-CD1 4.5Å; F186-F197 HydrophobicContact CG-CE1 4.1Å; F186-L200 HydrophobicContact CE1-CD1 4.28Å; F186-L200 HydrophobicContact CZ-CB 4.43Å
187	M	84.2	Confident	88.4	Confident	53 Å²	53	54 Å²	54	26%	0.261	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.2	161.4	-173.7	76.8	71.5	0	0	106.8	L4 W17 I143 S144	L4-M187 HydrophobicContact CB-CB 4.17Å; L4-M187 HydrophobicContact CD2-CB 3.47Å; L4-M187 VanDerWaalsContact CD2-CB 3.47Å; L4-M187 HydrophobicContact CD2-CG 4.1Å; L4-M187 HydrophobicContact CG-CB 4.46Å; W17-M187 HydrophobicContact CH2-CG 4.44Å; I143-M187 VanDerWaalsContact C-SD 3.54Å; S144-M187 WeakPolarHBondContact OG-CE 3.29Å; S144-M187 PolarHBondContact OG-SD 3.27Å
188	T	89.3	Confident	88.9	Confident	39 Å²	39	47.9 Å²	47.9	24%	0.239	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	-179.6	178.5	-165.5	0	0	0	0	110.7	P142 I143 A192 F197 L228	P142-T188 CarbonylContact C-O 3.56Å; P142-T188 WeakPolarHBondContact CA-O 3.33Å; I143-T188 PolarHBondContact N-O 3.31Å; I143-T188 PolarHBondContact O-N 3.33Å; T188-A192 HydrophobicContact CG2-CB 3.57Å; T188-F197 HydrophobicContact CG2-CE1 4.39Å; T188-F197 HydrophobicContact CG2-CE2 4.38Å; T188-F197 HydrophobicContact CG2-CZ 3.55Å; T188-L228 HydrophobicContact CG2-CD1 3.49Å; T188-L228 VanDerWaalsContact CG2-CD1 3.49Å
189	Y	92.3	Very high	89.3	Confident	97 Å²	97	54.3 Å²	54.3	38%	0.38	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	148.9	174.1	-64.9	-67.7	0	0	0	111.6	D140 D141 K191 A192	D140-Y189 WeakPolarHBondContact O-CD1 3.33Å; D140-Y189 WeakPolarHBondContact O-CE1 3.31Å; D141-Y189 CarbonylContact O-C 3.45Å; D141-Y189 WeakPolarHBondContact O-CA 3.13Å; Y189-K191 PolarHBondContact O-N 3.26Å; Y189-A192 VanDerWaalsContact O-CB 3.29Å; Y189-A192 WeakPolarHBondContact O-CB 3.23Å; Y189-A192 PolarHBondContact O-N 2.69Å
190	A	93.2	Very high	89.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.3	-175.8	0	0	0	0	0	113.6	C137 T138 D139 D141 I143 A192 L228 K229	C137-A190 WeakPolarHBondContact SG-CB 3.31Å; T138-A190 WeakPolarHBondContact O-CB 3.46Å; D139-A190 PolarHBondContact O-N 3.13Å; D141-A190 HydrophobicContact CB-CB 4.36Å; D141-A190 PolarHBondContact O-N 2.92Å; I143-A190 HydrophobicContact CD1-CB 4.5Å; I143-A190 HydrophobicContact CG1-CB 3.82Å; A190-A192 PolarHBondContact O-N 2.72Å; A190-L228 CarbonylContact O-C 3.53Å; A190-L228 WeakPolarHBondContact O-CA 3.33Å; A190-L228 WeakPolarHBondContact O-CB 3.25Å; A190-L228 PolarHBondContact O-N 3.45Å; A190-L228 VanDerWaalsContact O-N 3.07Å; A190-K229 HydrophobicContact CB-CB 3.87Å; A190-K229 PolarHBondContact O-N 3.26Å
191	K	95	Very high	90.2	Very high	105 Å²	105	49.9 Å²	49.9	46%	0.457	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.4	173	66.3	-168.4	171.7	-154.3	0	115.5	D139 D140 Y189 K193	D139-K191 HydrophobicContact CB-CB 4Å; D139-K191 HydrophobicContact CB-CD 4.47Å; D139-K191 PolarHBondContact O-N 3.45Å; D140-K191 IonicContact OD1-NZ 3.08Å; D140-K191 PolarHBondContact OD1-NZ 3.37Å; Y189-K191 PolarHBondContact O-N 3.26Å; K191-K193 PolarHBondContact O-N 3.05Å
192	A	92.4	Very high	90.6	Very high	18 Å²	18	47.5 Å²	47.5	15%	0.149	23%	0.234	C	C	.	.			trans	-63.2	129.9	179.5	0	0	0	0	0	111.3	T188 Y189 A190 F197 S227 L228	T188-A192 HydrophobicContact CG2-CB 3.57Å; Y189-A192 VanDerWaalsContact O-CB 3.29Å; Y189-A192 WeakPolarHBondContact O-CB 3.23Å; Y189-A192 PolarHBondContact O-N 2.69Å; A190-A192 PolarHBondContact O-N 2.72Å; A192-F197 HydrophobicContact CB-CE2 3.9Å; A192-F197 HydrophobicContact CB-CZ 4.18Å; A192-S227 CarbonylContact O-C 3.53Å; A192-S227 VanDerWaalsContact O-CA 3.29Å; A192-S227 WeakPolarHBondContact O-CA 3.45Å; A192-L228 HydrophobicContact CB-CD1 4.43Å; A192-L228 PolarHBondContact O-N 3.03Å
193	K	95.2	Very high	90.7	Very high	101 Å²	101	53.9 Å²	53.9	44%	0.439	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-89.7	151.8	179.5	-66	-171.9	175.5	-171.6	0	112.7	K191 S195 S196 F197 F226	K191-K193 PolarHBondContact O-N 3.05Å; K193-S195 WeakPolarHBondContact CB-OG 3.42Å; K193-S195 PolarHBondContact O-N 2.96Å; K193-S196 VanDerWaalsContact O-CB 3.31Å; K193-S196 WeakPolarHBondContact O-CB 3.5Å; K193-S196 PolarHBondContact O-N 2.94Å; K193-F197 WeakPolarHBondContact O-CD2 3.27Å; K193-F197 PolarHBondContact O-N 3.2Å; K193-F226 CarbonylContact C-O 3.58Å; K193-F226 WeakPolarHBondContact CA-O 3.44Å
194	L	94.3	Very high	90.7	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.2	-36.3	172.7	-71.3	-176.3	0	0	0	112.4	S196 F197 K198 F215 L222 F226 F245	L194-S196 PolarHBondContact O-N 2.71Å; L194-F197 HydrophobicContact CD2-CD2 4.45Å; L194-F197 PolarHBondContact O-N 3.26Å; L194-F197 VanDerWaalsContact O-N 3.1Å; L194-K198 WeakPolarHBondContact O-CB 3.47Å; L194-K198 PolarHBondContact O-N 2.83Å; L194-F215 HydrophobicContact CB-CD2 3.93Å; L194-F215 HydrophobicContact CB-CE2 4.22Å; L194-F215 HydrophobicContact CD1-CB 4.44Å; L194-F215 HydrophobicContact CD1-CD2 4.29Å; L194-F215 HydrophobicContact CD2-CD2 4.04Å; L194-F215 HydrophobicContact CD2-CG 4.46Å; L194-F215 HydrophobicContact CG-CD2 4.31Å; L194-F215 WeakPolarHBondContact O-CE2 3.31Å; L194-L222 HydrophobicContact CD1-CB 3.57Å; L194-L222 HydrophobicContact CD1-CD1 3.87Å; L194-L222 HydrophobicContact CD1-CG 4.44Å; L194-F226 HydrophobicContact CD1-CB 4.18Å; L194-F226 PolarHBondContact N-O 3.15Å; L194-F245 HydrophobicContact CD2-CD1 4.46Å; L194-F245 HydrophobicContact CD2-CE1 4.14Å; L194-F245 HydrophobicContact CD2-CE2 4.41Å; L194-F245 HydrophobicContact CD2-CZ 4.1Å
195	S	92.9	Very high	90.8	Very high	36 Å²	36	58.5 Å²	58.5	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-56.2	-30.8	171.8	49.4	0	0	0	0	114.1	K193 K198 K199 E224	K193-S195 WeakPolarHBondContact CB-OG 3.42Å; K193-S195 PolarHBondContact O-N 2.96Å; S195-K198 WeakPolarHBondContact O-CB 3.43Å; S195-K199 WeakPolarHBondContact O-CG 3.33Å; S195-K199 PolarHBondContact O-N 2.81Å; S195-E224 WeakPolarHBondContact CB-O 3.43Å; S195-E224 PolarHBondContact N-O 3.26Å; S195-E224 PolarHBondContact OG-O 3.11Å
196	S	92.2	Very high	90.8	Very high	61 Å²	61	57.8 Å²	57.8	43%	0.427	28%	0.283	S	S	.	.	H	α-helix	trans	-72.5	-45.3	174.7	-60.7	0	0	0	0	111.1	K193 L194 K198 K199 L200	K193-S196 VanDerWaalsContact O-CB 3.31Å; K193-S196 WeakPolarHBondContact O-CB 3.5Å; K193-S196 PolarHBondContact O-N 2.94Å; L194-S196 PolarHBondContact O-N 2.71Å; S196-K198 VanDerWaalsContact C-N 3.28Å; S196-K198 PolarHBondContact O-N 2.79Å; S196-K199 PolarHBondContact O-N 2.87Å; S196-L200 WeakPolarHBondContact O-CG 3.34Å; S196-L200 PolarHBondContact O-N 2.96Å; S196-L200 VanDerWaalsContact O-N 3.13Å
197	F	93.8	Very high	90.9	Very high	6 Å²	6	55.8 Å²	55.8	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-35.4	175	-68.2	-72.1	0	0	0	112.6	V145 F147 F186 T188 A192 K193 L194 K199 L200 I201 F215 L228	V145-F197 HydrophobicContact CG1-CE1 3.73Å; V145-F197 HydrophobicContact CG1-CZ 3.68Å; F147-F197 HydrophobicContact CE1-CB 4.01Å; F147-F197 HydrophobicContact CE1-CG 4.32Å; F147-F197 HydrophobicContact CE2-CB 4.13Å; F147-F197 AromaticContact CE2-CD1 3.46Å; F147-F197 HydrophobicContact CE2-CD1 3.46Å; F147-F197 VanDerWaalsContact CE2-CD1 3.46Å; F147-F197 AromaticContact CE2-CE1 3.93Å; F147-F197 HydrophobicContact CE2-CE1 3.93Å; F147-F197 AromaticContact CE2-CG 3.85Å; F147-F197 HydrophobicContact CE2-CG 3.85Å; F147-F197 HydrophobicContact CZ-CB 3.49Å; F147-F197 VanDerWaalsContact CZ-CB 3.49Å; F147-F197 AromaticContact CZ-CD1 3.52Å; F147-F197 HydrophobicContact CZ-CD1 3.52Å; F147-F197 AromaticContact CZ-CD2 3.92Å; F147-F197 HydrophobicContact CZ-CD2 3.92Å; F147-F197 HydrophobicContact CZ-CE1 4.14Å; F147-F197 HydrophobicContact CZ-CE2 4.49Å; F147-F197 AromaticContact CZ-CG 3.36Å; F147-F197 HydrophobicContact CZ-CG 3.36Å; F186-F197 HydrophobicContact CB-CE1 4.1Å; F186-F197 HydrophobicContact CD2-CD1 4.06Å; F186-F197 AromaticContact CD2-CE1 3.99Å; F186-F197 HydrophobicContact CD2-CE1 3.99Å; F186-F197 HydrophobicContact CE2-CD1 4.31Å; F186-F197 HydrophobicContact CG-CD1 4.5Å; F186-F197 HydrophobicContact CG-CE1 4.1Å; T188-F197 HydrophobicContact CG2-CE1 4.39Å; T188-F197 HydrophobicContact CG2-CE2 4.38Å; T188-F197 HydrophobicContact CG2-CZ 3.55Å; A192-F197 HydrophobicContact CB-CE2 3.9Å; A192-F197 HydrophobicContact CB-CZ 4.18Å; K193-F197 WeakPolarHBondContact O-CD2 3.27Å; K193-F197 PolarHBondContact O-N 3.2Å; L194-F197 HydrophobicContact CD2-CD2 4.45Å; L194-F197 PolarHBondContact O-N 3.26Å; L194-F197 VanDerWaalsContact O-N 3.1Å; F197-K199 PolarHBondContact O-N 2.86Å; F197-L200 HydrophobicContact CD1-CD1 4.31Å; F197-L200 WeakPolarHBondContact O-CB 3.3Å; F197-L200 PolarHBondContact O-N 3.28Å; F197-L200 VanDerWaalsContact O-N 3.16Å; F197-I201 WeakPolarHBondContact O-CB 3.4Å; F197-I201 VanDerWaalsContact O-CG1 3.31Å; F197-I201 WeakPolarHBondContact O-CG1 3.28Å; F197-I201 PolarHBondContact O-N 3.26Å; F197-F215 HydrophobicContact CB-CE2 4.38Å; F197-F215 HydrophobicContact CB-CZ 4.15Å; F197-L228 HydrophobicContact CE2-CD1 3.96Å; F197-L228 HydrophobicContact CE2-CD2 4.09Å; F197-L228 HydrophobicContact CE2-CG 4.01Å; F197-L228 HydrophobicContact CZ-CD1 3.94Å; F197-L228 HydrophobicContact CZ-CG 4.49Å
198	K	92.7	Very high	91	Very high	16 Å²	16	61.3 Å²	61.3	7%	0.07	29%	0.293	C	S	.	.	H	α-helix	trans	-53	-53.8	174.2	-172.1	171.2	176.6	-177.7	0	111.3	L194 S195 S196 L200 I201 L202 D212 I213 F215 E224	L194-K198 WeakPolarHBondContact O-CB 3.47Å; L194-K198 PolarHBondContact O-N 2.83Å; S195-K198 WeakPolarHBondContact O-CB 3.43Å; S196-K198 VanDerWaalsContact C-N 3.28Å; S196-K198 PolarHBondContact O-N 2.79Å; K198-L200 VanDerWaalsContact C-N 3.35Å; K198-L200 PolarHBondContact O-N 2.84Å; K198-I201 PolarHBondContact O-N 2.92Å; K198-L202 HydrophobicContact CG-CD1 4.25Å; K198-L202 VanDerWaalsContact O-CG 3.27Å; K198-L202 WeakPolarHBondContact O-CG 3.23Å; K198-L202 PolarHBondContact O-N 3.07Å; K198-D212 WeakPolarHBondContact CE-OD1 3.49Å; K198-D212 WeakPolarHBondContact CE-OD2 3.5Å; K198-D212 IonicContact NZ-OD1 2.69Å; K198-D212 PolarHBondContact NZ-OD1 3.32Å; K198-D212 VanDerWaalsContact NZ-OD1 3.08Å; K198-D212 IonicContact NZ-OD2 3.56Å; K198-D212 PolarHBondContact NZ-OD2 2.83Å; K198-I213 HydrophobicContact CD-CG1 4.45Å; K198-I213 WeakPolarHBondContact CE-O 3.17Å; K198-I213 HydrophobicContact CG-CD1 4.18Å; K198-I213 HydrophobicContact CG-CG1 3.66Å; K198-F215 HydrophobicContact CB-CE2 3.88Å; K198-F215 HydrophobicContact CB-CZ 4.18Å; K198-E224 HydrophobicContact CD-CG 3.97Å; K198-E224 WeakPolarHBondContact CD-OE2 3.38Å; K198-E224 IonicContact NZ-OE1 3.63Å; K198-E224 PolarHBondContact NZ-OE1 3.13Å; K198-E224 IonicContact NZ-OE2 3Å; K198-E224 PolarHBondContact NZ-OE2 3.25Å
199	K	90.9	Very high	90.8	Very high	142 Å²	142	64.6 Å²	64.6	62%	0.617	32%	0.317	S	S	*	.	H	α-helix	trans	-58.9	-44.7	176.1	-66.4	172.8	-176	177.5	0	111.8	S195 S196 F197 I201 L202 I203	S195-K199 WeakPolarHBondContact O-CG 3.33Å; S195-K199 PolarHBondContact O-N 2.81Å; S196-K199 PolarHBondContact O-N 2.87Å; F197-K199 PolarHBondContact O-N 2.86Å; K199-I201 PolarHBondContact O-N 2.77Å; K199-L202 PolarHBondContact O-N 2.82Å; K199-I203 WeakPolarHBondContact O-CD1 3.23Å; K199-I203 VanDerWaalsContact O-CG1 3.27Å; K199-I203 WeakPolarHBondContact O-CG1 3.28Å; K199-I203 PolarHBondContact O-N 2.83Å
200	L	90.2	Very high	90.5	Very high	70 Å²	70	62.4 Å²	62.4	37%	0.366	32%	0.315	S	S	.	.	H	α-helix	trans	-61.5	-41.7	179	-70.7	173.4	0	0	0	112.5	F186 S196 F197 K198 I203 K204	F186-L200 HydrophobicContact CE1-CD1 4.28Å; F186-L200 HydrophobicContact CZ-CB 4.43Å; S196-L200 WeakPolarHBondContact O-CG 3.34Å; S196-L200 PolarHBondContact O-N 2.96Å; S196-L200 VanDerWaalsContact O-N 3.13Å; F197-L200 HydrophobicContact CD1-CD1 4.31Å; F197-L200 WeakPolarHBondContact O-CB 3.3Å; F197-L200 PolarHBondContact O-N 3.28Å; F197-L200 VanDerWaalsContact O-N 3.16Å; K198-L200 VanDerWaalsContact C-N 3.35Å; K198-L200 PolarHBondContact O-N 2.84Å; L200-I203 PolarHBondContact O-N 2.74Å; L200-K204 VanDerWaalsContact O-CB 3.23Å; L200-K204 WeakPolarHBondContact O-CB 3.37Å; L200-K204 PolarHBondContact O-N 3.25Å
201	I	90	Very high	90.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-73.7	-40.5	-178.3	-70.2	169.5	0	0	0	110.9	F147 F197 K198 K199 I203 K204 Y205 I213 F215 F247	F147-I201 HydrophobicContact CB-CD1 3.73Å; F147-I201 HydrophobicContact CD1-CD1 3.44Å; F147-I201 VanDerWaalsContact CD1-CD1 3.44Å; F147-I201 HydrophobicContact CD2-CD1 3.79Å; F147-I201 HydrophobicContact CE1-CD1 3.96Å; F147-I201 HydrophobicContact CE2-CD1 4.27Å; F147-I201 HydrophobicContact CG-CD1 3.36Å; F147-I201 HydrophobicContact CZ-CD1 4.36Å; F197-I201 WeakPolarHBondContact O-CB 3.4Å; F197-I201 VanDerWaalsContact O-CG1 3.31Å; F197-I201 WeakPolarHBondContact O-CG1 3.28Å; F197-I201 PolarHBondContact O-N 3.26Å; K198-I201 PolarHBondContact O-N 2.92Å; K199-I201 PolarHBondContact O-N 2.77Å; I201-I203 VanDerWaalsContact C-N 3.31Å; I201-I203 PolarHBondContact O-N 2.87Å; I201-K204 PolarHBondContact O-N 3.1Å; I201-Y205 HydrophobicContact CG2-CD2 3.61Å; I201-Y205 HydrophobicContact CG2-CE2 3.87Å; I201-Y205 WeakPolarHBondContact O-CD2 3.05Å; I201-Y205 PolarHBondContact O-N 3.4Å; I201-I213 HydrophobicContact CB-CD1 3.6Å; I201-I213 HydrophobicContact CG2-CD1 3.34Å; I201-F215 HydrophobicContact CD1-CE1 3.49Å; I201-F215 VanDerWaalsContact CD1-CE1 3.49Å; I201-F215 HydrophobicContact CD1-CZ 3.73Å; I201-F247 HydrophobicContact CG2-CD2 4.33Å; I201-F247 HydrophobicContact CG2-CE1 4.4Å; I201-F247 HydrophobicContact CG2-CE2 3.98Å; I201-F247 HydrophobicContact CG2-CZ 4Å
202	L	89.5	Confident	90.2	Very high	36 Å²	36	60.6 Å²	60.6	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-56.9	-44.8	172.4	-70.1	172.5	0	0	0	111.4	K198 K199 N206 I207 I213	K198-L202 HydrophobicContact CG-CD1 4.25Å; K198-L202 VanDerWaalsContact O-CG 3.27Å; K198-L202 WeakPolarHBondContact O-CG 3.23Å; K198-L202 PolarHBondContact O-N 3.07Å; K199-L202 PolarHBondContact O-N 2.82Å; L202-N206 CarbonylContact O-C 3.53Å; L202-N206 WeakPolarHBondContact O-CA 3.39Å; L202-N206 PolarHBondContact O-N 2.72Å; L202-I207 HydrophobicContact CD2-CB 3.64Å; L202-I207 HydrophobicContact CD2-CD1 4.39Å; L202-I207 HydrophobicContact CD2-CG2 3.54Å; L202-I207 PolarHBondContact O-N 3.19Å; L202-I213 HydrophobicContact CD2-CG1 4.29Å; L202-I213 HydrophobicContact CD2-CG2 3.96Å; L202-I213 HydrophobicContact CG-CD1 4.36Å; L202-I213 HydrophobicContact CG-CG1 4.37Å
203	I	87.5	Confident	90.3	Very high	135 Å²	135	59.7 Å²	59.7	69%	0.692	30%	0.3	S	S	*	.	H	α-helix	trans	-65.9	-50.3	175.9	-66.7	165.5	0	0	0	110.7	K199 L200 I201 Y205 N206	K199-I203 WeakPolarHBondContact O-CD1 3.23Å; K199-I203 VanDerWaalsContact O-CG1 3.27Å; K199-I203 WeakPolarHBondContact O-CG1 3.28Å; K199-I203 PolarHBondContact O-N 2.83Å; L200-I203 PolarHBondContact O-N 2.74Å; I201-I203 VanDerWaalsContact C-N 3.31Å; I201-I203 PolarHBondContact O-N 2.87Å; I203-Y205 VanDerWaalsContact C-N 3.29Å; I203-Y205 PolarHBondContact O-N 3.26Å; I203-N206 PolarHBondContact O-N 2.87Å; I203-N206 VanDerWaalsContact O-N 3.1Å
204	K	88	Confident	90.2	Very high	118 Å²	118	57.3 Å²	57.3	51%	0.513	29%	0.291	S	S	.	.	H	α-helix	trans	-57.5	-41.1	-175.9	178.2	169.7	-178	161.6	0	112.5	C184 L200 I201	C184-K204 HydrophobicContact CB-CD 3.66Å; L200-K204 VanDerWaalsContact O-CB 3.23Å; L200-K204 WeakPolarHBondContact O-CB 3.37Å; L200-K204 PolarHBondContact O-N 3.25Å; I201-K204 PolarHBondContact O-N 3.1Å
205	Y	88.2	Confident	90.1	Very high	33 Å²	33	57.3 Å²	57.3	13%	0.129	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	8.9	-179	-64.1	-66.3	0	0	0	113.3	L178 S183 I201 I203 I207 F247	L178-Y205 HydrophobicContact CD2-CD1 3.42Å; L178-Y205 VanDerWaalsContact CD2-CD1 3.42Å; L178-Y205 HydrophobicContact CD2-CD2 4.16Å; L178-Y205 HydrophobicContact CD2-CE1 4.01Å; L178-Y205 HydrophobicContact CD2-CG 3.51Å; S183-Y205 PolarHBondContact N-OH 3.15Å; S183-Y205 PolarHBondContact O-OH 3.39Å; I201-Y205 HydrophobicContact CG2-CD2 3.61Å; I201-Y205 HydrophobicContact CG2-CE2 3.87Å; I201-Y205 WeakPolarHBondContact O-CD2 3.05Å; I201-Y205 PolarHBondContact O-N 3.4Å; I203-Y205 VanDerWaalsContact C-N 3.29Å; I203-Y205 PolarHBondContact O-N 3.26Å; Y205-I207 PolarHBondContact O-N 2.86Å; Y205-I207 VanDerWaalsContact O-N 3.14Å; Y205-F247 AromaticContact CD2-CZ 4Å; Y205-F247 HydrophobicContact CD2-CZ 4Å; Y205-F247 HydrophobicContact CE2-CE1 4.22Å; Y205-F247 AromaticContact CE2-CZ 3.62Å; Y205-F247 HydrophobicContact CE2-CZ 3.62Å
206	N	88.5	Confident	90.1	Very high	95 Å²	95	55.6 Å²	55.6	51%	0.508	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	38.7	-178.4	-175.8	50.5	0	0	0	112.6	L202 I203 R208	L202-N206 CarbonylContact O-C 3.53Å; L202-N206 WeakPolarHBondContact O-CA 3.39Å; L202-N206 PolarHBondContact O-N 2.72Å; I203-N206 PolarHBondContact O-N 2.87Å; I203-N206 VanDerWaalsContact O-N 3.1Å; N206-R208 PolarHBondContact O-N 3.41Å; N206-R208 PolarHBondContact OD1-NE 2.71Å; N206-R208 PolarHBondContact OD1-NH2 3.07Å
207	I	88.4	Confident	89.9	Confident	10 Å²	10	53.9 Å²	53.9	5%	0.051	26%	0.264	C	S	.	.			trans	-78.9	107	175.8	-57.5	171.1	0	0	0	106.8	L176 L178 L202 Y205 I213 V249	L176-I207 HydrophobicContact CD1-CG1 4.32Å; L176-I207 HydrophobicContact CD1-CG2 4.16Å; L178-I207 HydrophobicContact CD1-CD1 4.13Å; L178-I207 HydrophobicContact CD1-CG1 4.26Å; L202-I207 HydrophobicContact CD2-CB 3.64Å; L202-I207 HydrophobicContact CD2-CD1 4.39Å; L202-I207 HydrophobicContact CD2-CG2 3.54Å; L202-I207 PolarHBondContact O-N 3.19Å; Y205-I207 PolarHBondContact O-N 2.86Å; Y205-I207 VanDerWaalsContact O-N 3.14Å; I207-I213 HydrophobicContact CD1-CG2 3.81Å; I207-V249 HydrophobicContact CD1-CG2 4.11Å; I207-V249 HydrophobicContact CG2-CG1 4.38Å
208	R	86.5	Confident	89.5	Confident	170 Å²	170	55.3 Å²	55.3	64%	0.642	28%	0.276	S	S	*	.			trans	-97.6	161.3	-176.5	-62.8	-176.8	-174	168.5	0.4	111.1	N206 Y211	N206-R208 PolarHBondContact O-N 3.41Å; N206-R208 PolarHBondContact OD1-NE 2.71Å; N206-R208 PolarHBondContact OD1-NH2 3.07Å; R208-Y211 WeakPolarHBondContact O-CB 3.41Å; R208-Y211 VanDerWaalsContact O-CD2 3.26Å; R208-Y211 WeakPolarHBondContact O-CD2 3Å; R208-Y211 PolarHBondContact O-N 2.75Å
209	S	84.7	Confident	88.9	Confident	107 Å²	107	60.1 Å²	60.1	75%	0.748	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	139.9	165.3	179.3	0	0	0	0	110.8	Y211	S209-Y211 VanDerWaalsContact C-N 3.35Å
210	P	87.5	Confident	88.5	Confident	52 Å²	52	56.5 Å²	56.5	34%	0.338	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.4	17.7	9.8	38.3	-37.3	0	0	0	114.1	K251 L252	P210-K251 HydrophobicContact CG-CG 4.3Å; P210-L252 VanDerWaalsContact O-CB 3.26Å; P210-L252 WeakPolarHBondContact O-CB 3.33Å; P210-L252 WeakPolarHBondContact O-CG 3.3Å; P210-L252 PolarHBondContact O-N 3.3Å
211	Y	89.9	Confident	88.4	Confident	36 Å²	36	55.3 Å²	55.3	14%	0.141	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	151.7	179.6	-57.7	-81.3	0	0	0	112.1	V167 E175 L176 R208 S209 V249 L250 K251	V167-Y211 HydrophobicContact CG2-CD1 4.2Å; V167-Y211 HydrophobicContact CG2-CE1 4.12Å; E175-Y211 PolarHBondContact OE2-OH 3.22Å; L176-Y211 HydrophobicContact CD1-CD1 4.35Å; L176-Y211 HydrophobicContact CD1-CD2 4.42Å; L176-Y211 HydrophobicContact CD1-CG 4.19Å; L176-Y211 HydrophobicContact CD2-CD2 3.85Å; L176-Y211 HydrophobicContact CD2-CE2 3.98Å; L176-Y211 HydrophobicContact CD2-CG 4.43Å; R208-Y211 WeakPolarHBondContact O-CB 3.41Å; R208-Y211 VanDerWaalsContact O-CD2 3.26Å; R208-Y211 WeakPolarHBondContact O-CD2 3Å; R208-Y211 PolarHBondContact O-N 2.75Å; S209-Y211 VanDerWaalsContact C-N 3.35Å; Y211-V249 HydrophobicContact CD1-CG1 3.92Å; Y211-V249 HydrophobicContact CG-CG1 4.25Å; Y211-L250 CarbonylContact C-O 3.55Å; Y211-L250 WeakPolarHBondContact CA-O 3.39Å; Y211-K251 HydrophobicContact CD1-CB 4.24Å; Y211-K251 HydrophobicContact CD1-CG 4.48Å; Y211-K251 HydrophobicContact CE1-CB 4.29Å; Y211-K251 HydrophobicContact CE1-CD 4.29Å; Y211-K251 HydrophobicContact CE1-CG 4.29Å
212	D	91.9	Very high	88.4	Confident	30 Å²	30	55.9 Å²	55.9	16%	0.16	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	175.8	175.5	-155.3	4.6	0	0	0	111	K198 V249 L250 L252	K198-D212 WeakPolarHBondContact CE-OD1 3.49Å; K198-D212 WeakPolarHBondContact CE-OD2 3.5Å; K198-D212 IonicContact NZ-OD1 2.69Å; K198-D212 PolarHBondContact NZ-OD1 3.32Å; K198-D212 VanDerWaalsContact NZ-OD1 3.08Å; K198-D212 IonicContact NZ-OD2 3.56Å; K198-D212 PolarHBondContact NZ-OD2 2.83Å; D212-V249 CarbonylContact O-C 3.53Å; D212-V249 WeakPolarHBondContact O-CA 3.32Å; D212-V249 WeakPolarHBondContact O-CG1 3.22Å; D212-L250 HydrophobicContact CB-CB 4.5Å; D212-L250 PolarHBondContact N-O 3.06Å; D212-L250 PolarHBondContact O-N 2.96Å; D212-L252 HydrophobicContact CB-CD1 4.22Å; D212-L252 HydrophobicContact CB-CD2 4.02Å; D212-L252 HydrophobicContact CB-CG 4.02Å
213	I	92.8	Very high	88.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.3	177.3	67.1	177.7	0	0	0	113.2	K198 I201 L202 I207 F215 F247 R248 V249	K198-I213 HydrophobicContact CD-CG1 4.45Å; K198-I213 WeakPolarHBondContact CE-O 3.17Å; K198-I213 HydrophobicContact CG-CD1 4.18Å; K198-I213 HydrophobicContact CG-CG1 3.66Å; I201-I213 HydrophobicContact CB-CD1 3.6Å; I201-I213 HydrophobicContact CG2-CD1 3.34Å; L202-I213 HydrophobicContact CD2-CG1 4.29Å; L202-I213 HydrophobicContact CD2-CG2 3.96Å; L202-I213 HydrophobicContact CG-CD1 4.36Å; L202-I213 HydrophobicContact CG-CG1 4.37Å; I207-I213 HydrophobicContact CD1-CG2 3.81Å; I213-F215 HydrophobicContact CD1-CE1 4.11Å; I213-F215 HydrophobicContact CD1-CZ 3.92Å; I213-F215 HydrophobicContact CG1-CZ 4.47Å; I213-F247 HydrophobicContact CG2-CD2 4.31Å; I213-R248 VanDerWaalsContact CA-O 3.26Å; I213-R248 WeakPolarHBondContact CA-O 3.3Å; I213-R248 WeakPolarHBondContact CB-O 3.47Å; I213-V249 HydrophobicContact CG2-CG2 4.12Å
214	E	93.1	Very high	88.4	Confident	50 Å²	50	53.4 Å²	53.4	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	150.1	171.7	-70.5	178.7	149.9	0	0	110.4	L221 F247 R248 L250	E214-L221 HydrophobicContact CB-CD2 4.2Å; E214-F247 WeakPolarHBondContact O-CA 3.41Å; E214-F247 VanDerWaalsContact O-CB 3.3Å; E214-F247 WeakPolarHBondContact O-CB 3.33Å; E214-R248 HydrophobicContact CB-CG 4.42Å; E214-R248 PolarHBondContact N-O 3.17Å; E214-R248 PolarHBondContact O-N 3.19Å; E214-R248 IonicContact OE2-CZ 3.26Å; E214-R248 VanDerWaalsContact OE2-CZ 3.26Å; E214-R248 IonicContact OE2-NE 2.94Å; E214-R248 PolarHBondContact OE2-NE 3.25Å; E214-R248 IonicContact OE2-NH2 2.69Å; E214-R248 PolarHBondContact OE2-NH2 2.95Å; E214-L250 VanDerWaalsContact CD-CD1 3.47Å; E214-L250 HydrophobicContact CG-CD1 3.6Å; E214-L250 HydrophobicContact CG-CG 4.17Å
215	F	93.9	Very high	88.6	Confident	1 Å²	1	55 Å²	55	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	143.9	176.5	-60.5	-60.3	0	0	0	111.6	F147 L194 F197 K198 I201 I213 L221 L222 Y246 F247	F147-F215 AromaticContact CD1-CD1 3.62Å; F147-F215 HydrophobicContact CD1-CD1 3.62Å; F147-F215 AromaticContact CD1-CE1 3.39Å; F147-F215 HydrophobicContact CD1-CE1 3.39Å; F147-F215 HydrophobicContact CD1-CZ 4.2Å; F147-F215 AromaticContact CE1-CD1 3.71Å; F147-F215 HydrophobicContact CE1-CD1 3.71Å; F147-F215 AromaticContact CE1-CE1 3.51Å; F147-F215 HydrophobicContact CE1-CE1 3.51Å; F147-F215 HydrophobicContact CE1-CG 4.34Å; F147-F215 AromaticContact CE1-CZ 3.93Å; F147-F215 HydrophobicContact CE1-CZ 3.93Å; F147-F215 HydrophobicContact CG-CE1 4.48Å; L194-F215 HydrophobicContact CB-CD2 3.93Å; L194-F215 HydrophobicContact CB-CE2 4.22Å; L194-F215 HydrophobicContact CD1-CB 4.44Å; L194-F215 HydrophobicContact CD1-CD2 4.29Å; L194-F215 HydrophobicContact CD2-CD2 4.04Å; L194-F215 HydrophobicContact CD2-CG 4.46Å; L194-F215 HydrophobicContact CG-CD2 4.31Å; L194-F215 WeakPolarHBondContact O-CE2 3.31Å; F197-F215 HydrophobicContact CB-CE2 4.38Å; F197-F215 HydrophobicContact CB-CZ 4.15Å; K198-F215 HydrophobicContact CB-CE2 3.88Å; K198-F215 HydrophobicContact CB-CZ 4.18Å; I201-F215 HydrophobicContact CD1-CE1 3.49Å; I201-F215 VanDerWaalsContact CD1-CE1 3.49Å; I201-F215 HydrophobicContact CD1-CZ 3.73Å; I213-F215 HydrophobicContact CD1-CE1 4.11Å; I213-F215 HydrophobicContact CD1-CZ 3.92Å; I213-F215 HydrophobicContact CG1-CZ 4.47Å; F215-L221 WeakPolarHBondContact O-CA 3.38Å; F215-L222 PolarHBondContact O-N 3.04Å; F215-Y246 CarbonylContact C-O 3.55Å; F215-Y246 WeakPolarHBondContact CA-O 3.41Å; F215-F247 HydrophobicContact CD1-CB 3.8Å; F215-F247 HydrophobicContact CE1-CB 4Å
216	A	91.3	Very high	88.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.8	172.3	0	0	0	0	0	110.8	I151 Y155 F156 Q220 L221 Y246	I151-A216 HydrophobicContact CD1-CB 3.81Å; I151-A216 HydrophobicContact CG1-CB 4.46Å; Y155-A216 HydrophobicContact CD1-CB 4.34Å; Y155-A216 HydrophobicContact CE1-CB 3.83Å; F156-A216 HydrophobicContact CE1-CB 3.98Å; F156-A216 HydrophobicContact CZ-CB 3.94Å; A216-Q220 CarbonylContact C-O 3.54Å; A216-Q220 WeakPolarHBondContact CA-O 2.92Å; A216-L221 HydrophobicContact CB-CD2 4.35Å; A216-Y246 PolarHBondContact N-O 3.47Å; A216-Y246 PolarHBondContact O-N 3.24Å
217	F	89.5	Confident	89	Confident	25 Å²	25	50.2 Å²	50.2	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	150	175.5	-170.9	-105.5	0	0	0	108.8	Y155 Y219 Q220 L222 I231 F235 L236 I243 L244 F245	Y155-F217 WeakPolarHBondContact OH-CA 3.48Å; F217-Y219 PolarHBondContact O-N 3.29Å; F217-Y219 VanDerWaalsContact O-N 3.13Å; F217-Q220 PolarHBondContact N-O 3.24Å; F217-Q220 VanDerWaalsContact O-CG 3.23Å; F217-Q220 WeakPolarHBondContact O-CG 3.29Å; F217-Q220 PolarHBondContact O-N 3.32Å; F217-L222 HydrophobicContact CB-CD1 3.39Å; F217-L222 HydrophobicContact CB-CG 4.02Å; F217-L222 HydrophobicContact CG-CD1 4.33Å; F217-I231 HydrophobicContact CD1-CG2 3.91Å; F217-I231 HydrophobicContact CE1-CG2 3.82Å; F217-I231 HydrophobicContact CZ-CG2 4.35Å; F217-F235 HydrophobicContact CD1-CB 4.2Å; F217-F235 HydrophobicContact CD1-CD1 4.4Å; F217-F235 HydrophobicContact CD1-CD2 4.34Å; F217-F235 HydrophobicContact CD1-CG 4.06Å; F217-F235 HydrophobicContact CE1-CB 3.68Å; F217-F235 HydrophobicContact CE1-CG 4.06Å; F217-L236 HydrophobicContact CZ-CD2 4.19Å; F217-I243 HydrophobicContact CD2-CG2 3.95Å; F217-I243 HydrophobicContact CE2-CG2 3.43Å; F217-I243 VanDerWaalsContact CE2-CG2 3.43Å; F217-I243 HydrophobicContact CZ-CG2 3.85Å; F217-L244 WeakPolarHBondContact CD2-O 3.49Å; F217-F245 HydrophobicContact CB-CD1 3.76Å; F217-F245 HydrophobicContact CB-CE1 3.83Å; F217-F245 HydrophobicContact CD2-CD1 4.08Å; F217-F245 HydrophobicContact CD2-CE1 4.07Å; F217-F245 HydrophobicContact CG-CD1 4.18Å; F217-F245 AromaticContact CG-CE1 3.98Å; F217-F245 HydrophobicContact CG-CE1 3.98Å
218	A	83.9	Confident	89.3	Confident	35 Å²	35	49.8 Å²	49.8	29%	0.289	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	42.4	179.3	0	0	0	0	0	113.4	Y155 Q220 F235	Y155-A218 PolarHBondContact OH-N 2.9Å; A218-Q220 PolarHBondContact O-N 2.71Å; A218-F235 HydrophobicContact CB-CD1 3.61Å; A218-F235 HydrophobicContact CB-CE1 4.05Å; A218-F235 HydrophobicContact CB-CG 4.42Å
219	Y	81.2	Confident	89.7	Confident	117 Å²	117	44.2 Å²	44.2	46%	0.459	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	20.1	179.1	-43.2	-64.4	0	0	0	115.2	Y155 F156 Q161 F217	Y155-Y219 HydrophobicContact CD2-CD1 4.23Å; Y155-Y219 HydrophobicContact CD2-CE1 4.49Å; Y155-Y219 HydrophobicContact CE1-CD1 4.48Å; Y155-Y219 HydrophobicContact CE2-CD1 4.07Å; Y155-Y219 HydrophobicContact CE2-CE1 4.32Å; Y155-Y219 HydrophobicContact CG-CD1 4.5Å; Y155-Y219 WeakPolarHBondContact O-CD1 3.15Å; Y155-Y219 PolarHBondContact OH-N 3.15Å; F156-Y219 WeakPolarHBondContact CD1-O 3.39Å; Q161-Y219 PolarHBondContact NE2-O 3.2Å; F217-Y219 PolarHBondContact O-N 3.29Å; F217-Y219 VanDerWaalsContact O-N 3.13Å
220	Q	82.6	Confident	89.9	Confident	67 Å²	67	40.8 Å²	40.8	31%	0.313	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154.4	176	59.8	176.7	67.1	0	0	113.1	A216 F217 A218 L222 F235	A216-Q220 CarbonylContact C-O 3.54Å; A216-Q220 WeakPolarHBondContact CA-O 2.92Å; F217-Q220 PolarHBondContact N-O 3.24Å; F217-Q220 VanDerWaalsContact O-CG 3.23Å; F217-Q220 WeakPolarHBondContact O-CG 3.29Å; F217-Q220 PolarHBondContact O-N 3.32Å; A218-Q220 PolarHBondContact O-N 2.71Å; Q220-L222 HydrophobicContact CG-CD2 4.23Å; Q220-F235 HydrophobicContact CG-CE1 4.34Å
221	L	88.3	Confident	90.1	Very high	44 Å²	44	38.3 Å²	38.3	23%	0.23	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	141.8	166.2	-61.8	161	0	0	0	110.2	F156 Q161 E214 F215 A216	F156-L221 HydrophobicContact CE1-CD2 4.3Å; F156-L221 HydrophobicContact CE1-CG 4.19Å; F156-L221 HydrophobicContact CZ-CD2 3.88Å; F156-L221 HydrophobicContact CZ-CG 4.17Å; Q161-L221 HydrophobicContact CB-CD1 4.26Å; E214-L221 HydrophobicContact CB-CD2 4.2Å; F215-L221 WeakPolarHBondContact O-CA 3.38Å; A216-L221 HydrophobicContact CB-CD2 4.35Å
222	L	89.7	Confident	90	Very high	12 Å²	12	36.6 Å²	36.6	6%	0.063	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.7	-179.5	-64.1	-179.1	0	0	0	111.5	L194 F215 F217 Q220 F226 I231 F235 F245	L194-L222 HydrophobicContact CD1-CB 3.57Å; L194-L222 HydrophobicContact CD1-CD1 3.87Å; L194-L222 HydrophobicContact CD1-CG 4.44Å; F215-L222 PolarHBondContact O-N 3.04Å; F217-L222 HydrophobicContact CB-CD1 3.39Å; F217-L222 HydrophobicContact CB-CG 4.02Å; F217-L222 HydrophobicContact CG-CD1 4.33Å; Q220-L222 HydrophobicContact CG-CD2 4.23Å; L222-F226 HydrophobicContact CD2-CD2 4.15Å; L222-F226 HydrophobicContact CD2-CE2 4.16Å; L222-I231 HydrophobicContact CD1-CD1 3.52Å; L222-I231 HydrophobicContact CD1-CG1 4.45Å; L222-I231 HydrophobicContact CD2-CD1 4.29Å; L222-I231 HydrophobicContact CG-CD1 4.47Å; L222-F235 HydrophobicContact CD2-CE2 4Å; L222-F235 HydrophobicContact CD2-CZ 3.74Å; L222-F245 HydrophobicContact CD1-CD1 3.89Å; L222-F245 HydrophobicContact CD1-CE1 3.45Å; L222-F245 VanDerWaalsContact CD1-CE1 3.45Å
223	P	87.1	Confident	89.8	Confident	46 Å²	46	36.3 Å²	36.3	30%	0.299	17%	0.173	S	C	.	.			trans	-65	143.5	170.9	-17.8	30.1	0	0	0	112.3	Y225 F226	P223-Y225 HydrophobicContact CB-CD1 3.5Å; P223-Y225 HydrophobicContact CB-CE1 3.12Å; P223-Y225 HydrophobicContact CB-CE2 4.3Å; P223-Y225 HydrophobicContact CB-CG 4.23Å; P223-Y225 HydrophobicContact CG-CE1 3.85Å; P223-Y225 PolarHBondContact O-N 3.02Å; P223-Y225 VanDerWaalsContact O-N 3.14Å; P223-F226 HydrophobicContact CB-CD1 4.34Å; P223-F226 HydrophobicContact CB-CE1 4.5Å; P223-F226 HydrophobicContact CG-CD1 4.33Å; P223-F226 HydrophobicContact CG-CE1 4.06Å; P223-F226 HydrophobicContact CG-CZ 4.22Å; P223-F226 WeakPolarHBondContact O-CB 3.2Å; P223-F226 PolarHBondContact O-N 3.2Å
224	E	90.1	Very high	89.4	Confident	74 Å²	74	36.9 Å²	36.9	35%	0.346	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.2	-176.9	-68.6	170.6	-140.2	0	0	114.9	S195 K198 F226	S195-E224 WeakPolarHBondContact CB-O 3.43Å; S195-E224 PolarHBondContact N-O 3.26Å; S195-E224 PolarHBondContact OG-O 3.11Å; K198-E224 HydrophobicContact CD-CG 3.97Å; K198-E224 WeakPolarHBondContact CD-OE2 3.38Å; K198-E224 IonicContact NZ-OE1 3.63Å; K198-E224 PolarHBondContact NZ-OE1 3.13Å; K198-E224 IonicContact NZ-OE2 3Å; K198-E224 PolarHBondContact NZ-OE2 3.25Å; E224-F226 VanDerWaalsContact C-N 3.3Å
225	Y	90.9	Very high	89	Confident	152 Å²	152	37.3 Å²	37.3	60%	0.596	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.3	178.7	62.2	-99.6	0	0	0	113	P223 S227	P223-Y225 HydrophobicContact CB-CD1 3.5Å; P223-Y225 HydrophobicContact CB-CE1 3.12Å; P223-Y225 HydrophobicContact CB-CE2 4.3Å; P223-Y225 HydrophobicContact CB-CG 4.23Å; P223-Y225 HydrophobicContact CG-CE1 3.85Å; P223-Y225 PolarHBondContact O-N 3.02Å; P223-Y225 VanDerWaalsContact O-N 3.14Å; Y225-S227 PolarHBondContact O-N 3.22Å
226	F	91.1	Very high	88.5	Confident	16 Å²	16	38.7 Å²	38.7	7%	0.07	19%	0.185	C	C	.	.			trans	-62.6	133.1	175.7	-79.4	12.1	0	0	0	110.9	K193 L194 L222 P223 E224 I231 L234 F235	K193-F226 CarbonylContact C-O 3.58Å; K193-F226 WeakPolarHBondContact CA-O 3.44Å; L194-F226 HydrophobicContact CD1-CB 4.18Å; L194-F226 PolarHBondContact N-O 3.15Å; L222-F226 HydrophobicContact CD2-CD2 4.15Å; L222-F226 HydrophobicContact CD2-CE2 4.16Å; P223-F226 HydrophobicContact CB-CD1 4.34Å; P223-F226 HydrophobicContact CB-CE1 4.5Å; P223-F226 HydrophobicContact CG-CD1 4.33Å; P223-F226 HydrophobicContact CG-CE1 4.06Å; P223-F226 HydrophobicContact CG-CZ 4.22Å; P223-F226 WeakPolarHBondContact O-CB 3.2Å; P223-F226 PolarHBondContact O-N 3.2Å; E224-F226 VanDerWaalsContact C-N 3.3Å; F226-I231 HydrophobicContact CB-CD1 4.1Å; F226-I231 HydrophobicContact CD2-CD1 3.55Å; F226-I231 HydrophobicContact CE2-CD1 4.43Å; F226-I231 HydrophobicContact CG-CD1 4.31Å; F226-L234 HydrophobicContact CE2-CD1 4.32Å; F226-L234 HydrophobicContact CZ-CD1 4.31Å; F226-F235 HydrophobicContact CE2-CE2 4.15Å; F226-F235 HydrophobicContact CE2-CZ 4.44Å
227	S	95	Very high	88.1	Confident	11 Å²	11	42.9 Å²	42.9	8%	0.077	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-86.4	160.6	166.9	69	0	0	0	0	111.1	A192 Y225 K229 D230 I231	A192-S227 CarbonylContact O-C 3.53Å; A192-S227 VanDerWaalsContact O-CA 3.29Å; A192-S227 WeakPolarHBondContact O-CA 3.45Å; Y225-S227 PolarHBondContact O-N 3.22Å; S227-K229 PolarHBondContact O-N 3Å; S227-D230 WeakPolarHBondContact CB-OD2 3.05Å; S227-D230 PolarHBondContact N-OD2 3.1Å; S227-D230 WeakPolarHBondContact O-CB 3.41Å; S227-D230 PolarHBondContact O-N 2.99Å; S227-D230 PolarHBondContact OG-N 3.47Å; S227-D230 VanDerWaalsContact OG-N 3.13Å; S227-D230 PolarHBondContact OG-OD2 3.33Å; S227-I231 WeakPolarHBondContact O-CG1 3.46Å; S227-I231 PolarHBondContact O-N 2.92Å; S227-I231 VanDerWaalsContact O-N 3.09Å
228	L	94.2	Very high	87.5	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-32.2	172.6	-65	-179.9	0	0	0	111.8	I143 V145 T188 A190 A192 F197 D230 I231 V232 F245	I143-L228 HydrophobicContact CB-CD1 3.94Å; I143-L228 HydrophobicContact CG1-CB 4.48Å; I143-L228 HydrophobicContact CG2-CB 4.44Å; I143-L228 HydrophobicContact CG2-CD1 3.92Å; V145-L228 HydrophobicContact CG1-CD1 4.41Å; V145-L228 HydrophobicContact CG2-CD2 4.4Å; T188-L228 HydrophobicContact CG2-CD1 3.49Å; T188-L228 VanDerWaalsContact CG2-CD1 3.49Å; A190-L228 CarbonylContact O-C 3.53Å; A190-L228 WeakPolarHBondContact O-CA 3.33Å; A190-L228 WeakPolarHBondContact O-CB 3.25Å; A190-L228 PolarHBondContact O-N 3.45Å; A190-L228 VanDerWaalsContact O-N 3.07Å; A192-L228 HydrophobicContact CB-CD1 4.43Å; A192-L228 PolarHBondContact O-N 3.03Å; F197-L228 HydrophobicContact CE2-CD1 3.96Å; F197-L228 HydrophobicContact CE2-CD2 4.09Å; F197-L228 HydrophobicContact CE2-CG 4.01Å; F197-L228 HydrophobicContact CZ-CD1 3.94Å; F197-L228 HydrophobicContact CZ-CG 4.49Å; L228-D230 VanDerWaalsContact C-N 3.34Å; L228-I231 WeakPolarHBondContact O-CB 3.47Å; L228-I231 PolarHBondContact O-N 3.05Å; L228-I231 VanDerWaalsContact O-N 3.17Å; L228-V232 VanDerWaalsContact O-CG2 3.28Å; L228-V232 WeakPolarHBondContact O-CG2 3.45Å; L228-V232 PolarHBondContact O-N 3.07Å; L228-F245 HydrophobicContact CD2-CE2 3.8Å; L228-F245 HydrophobicContact CD2-CZ 3.94Å
229	K	94.1	Very high	87.1	Confident	54 Å²	54	44.7 Å²	44.7	24%	0.235	21%	0.21	C	C	.	.	H	α-helix	trans	-58.3	-45.6	171.1	173.7	178.4	173	-167.9	0	111.6	C137 D139 A190 S227 I231 V232 N233	C137-K229 HydrophobicContact CB-CG 4.3Å; C137-K229 WeakPolarHBondContact O-CD 3.2Å; C137-K229 WeakPolarHBondContact O-CE 3.42Å; C137-K229 WeakPolarHBondContact O-CG 3.44Å; D139-K229 WeakPolarHBondContact OD1-CD 3.11Å; D139-K229 WeakPolarHBondContact OD1-CE 3.49Å; D139-K229 IonicContact OD1-NZ 2.55Å; D139-K229 PolarHBondContact OD1-NZ 3.46Å; A190-K229 HydrophobicContact CB-CB 3.87Å; A190-K229 PolarHBondContact O-N 3.26Å; S227-K229 PolarHBondContact O-N 3Å; K229-I231 VanDerWaalsContact C-N 3.26Å; K229-I231 PolarHBondContact O-N 3.06Å; K229-V232 PolarHBondContact O-N 2.97Å; K229-N233 WeakPolarHBondContact CG-ND2 3.27Å; K229-N233 WeakPolarHBondContact O-CB 3.48Å; K229-N233 PolarHBondContact O-N 3.26Å
230	D	90.8	Very high	87.1	Confident	34 Å²	34	43.5 Å²	43.5	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-42	175.9	-57.2	-43.8	0	0	0	110	S227 L228 L234	S227-D230 WeakPolarHBondContact CB-OD2 3.05Å; S227-D230 PolarHBondContact N-OD2 3.1Å; S227-D230 WeakPolarHBondContact O-CB 3.41Å; S227-D230 PolarHBondContact O-N 2.99Å; S227-D230 PolarHBondContact OG-N 3.47Å; S227-D230 VanDerWaalsContact OG-N 3.13Å; S227-D230 PolarHBondContact OG-OD2 3.33Å; L228-D230 VanDerWaalsContact C-N 3.34Å; D230-L234 HydrophobicContact CB-CD1 4.3Å; D230-L234 WeakPolarHBondContact O-CB 3.46Å; D230-L234 WeakPolarHBondContact O-CG 3.46Å; D230-L234 PolarHBondContact O-N 3.43Å
231	I	90	Very high	86.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-47.3	177	-55.2	-53.5	0	0	0	111.9	F217 L222 F226 S227 L228 K229 F235 I243 F245	F217-I231 HydrophobicContact CD1-CG2 3.91Å; F217-I231 HydrophobicContact CE1-CG2 3.82Å; F217-I231 HydrophobicContact CZ-CG2 4.35Å; L222-I231 HydrophobicContact CD1-CD1 3.52Å; L222-I231 HydrophobicContact CD1-CG1 4.45Å; L222-I231 HydrophobicContact CD2-CD1 4.29Å; L222-I231 HydrophobicContact CG-CD1 4.47Å; F226-I231 HydrophobicContact CB-CD1 4.1Å; F226-I231 HydrophobicContact CD2-CD1 3.55Å; F226-I231 HydrophobicContact CE2-CD1 4.43Å; F226-I231 HydrophobicContact CG-CD1 4.31Å; S227-I231 WeakPolarHBondContact O-CG1 3.46Å; S227-I231 PolarHBondContact O-N 2.92Å; S227-I231 VanDerWaalsContact O-N 3.09Å; L228-I231 WeakPolarHBondContact O-CB 3.47Å; L228-I231 PolarHBondContact O-N 3.05Å; L228-I231 VanDerWaalsContact O-N 3.17Å; K229-I231 VanDerWaalsContact C-N 3.26Å; K229-I231 PolarHBondContact O-N 3.06Å; I231-F235 HydrophobicContact CD1-CD2 4.18Å; I231-F235 HydrophobicContact CD1-CE2 3.92Å; I231-F235 HydrophobicContact CG2-CD2 4.11Å; I231-F235 WeakPolarHBondContact O-CB 3.39Å; I231-F235 WeakPolarHBondContact O-CD2 3.4Å; I231-F235 PolarHBondContact O-N 3.09Å; I231-I243 HydrophobicContact CG2-CD1 4.25Å; I231-I243 HydrophobicContact CG2-CG2 4.21Å; I231-F245 HydrophobicContact CB-CZ 4.48Å; I231-F245 HydrophobicContact CG1-CE1 4.23Å; I231-F245 HydrophobicContact CG1-CZ 4Å; I231-F245 HydrophobicContact CG2-CE1 4.31Å; I231-F245 HydrophobicContact CG2-CZ 4.08Å
232	V	89.5	Confident	86.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-44.7	-178.8	173.8	0	0	0	0	111	C137 I143 L228 K229 L236 M237 G238 I243	C137-V232 HydrophobicContact CB-CB 3.98Å; C137-V232 HydrophobicContact CB-CG1 3.63Å; I143-V232 HydrophobicContact CD1-CG2 4.05Å; L228-V232 VanDerWaalsContact O-CG2 3.28Å; L228-V232 WeakPolarHBondContact O-CG2 3.45Å; L228-V232 PolarHBondContact O-N 3.07Å; K229-V232 PolarHBondContact O-N 2.97Å; V232-L236 HydrophobicContact CG2-CD1 4.35Å; V232-L236 CarbonylContact O-C 3.59Å; V232-L236 VanDerWaalsContact O-CA 3.3Å; V232-L236 WeakPolarHBondContact O-CA 2.93Å; V232-L236 WeakPolarHBondContact O-CB 2.92Å; V232-L236 PolarHBondContact O-N 3.5Å; V232-L236 VanDerWaalsContact O-N 3.09Å; V232-M237 PolarHBondContact O-N 3.44Å; V232-M237 VanDerWaalsContact O-N 3.09Å; V232-G238 PolarHBondContact O-N 2.66Å; V232-I243 HydrophobicContact CG2-CD1 3.61Å
233	N	87.7	Confident	86.8	Confident	24 Å²	24	47.3 Å²	47.3	13%	0.128	22%	0.222	C	C	.	.	H	α-helix	trans	-73.4	-41.3	-177.5	-69.9	-17	0	0	0	111.9	L136 C137 K229	L136-N233 HydrophobicContact CD2-CB 4.48Å; C137-N233 VanDerWaalsContact CB-OD1 3.28Å; C137-N233 WeakPolarHBondContact CB-OD1 3.34Å; C137-N233 PolarHBondContact N-OD1 3Å; C137-N233 PolarHBondContact O-ND2 3.4Å; K229-N233 WeakPolarHBondContact CG-ND2 3.27Å; K229-N233 WeakPolarHBondContact O-CB 3.48Å; K229-N233 PolarHBondContact O-N 3.26Å
234	L	84.4	Confident	87	Confident	13 Å²	13	47.3 Å²	47.3	7%	0.068	22%	0.219	C	C	.	.	H	α-helix	trans	-78.2	-45.1	-178.3	-64.5	172.2	0	0	0	112.6	Y93 L96 H100 F226 D230	Y93-L234 HydrophobicContact CD1-CD2 3.95Å; Y93-L234 HydrophobicContact CE1-CD2 4.02Å; L96-L234 HydrophobicContact CB-CD2 4.27Å; H100-L234 PolarHBondContact CE1-O 3.07Å; H100-L234 PolarHBondContact NE2-O 3.28Å; F226-L234 HydrophobicContact CE2-CD1 4.32Å; F226-L234 HydrophobicContact CZ-CD1 4.31Å; D230-L234 HydrophobicContact CB-CD1 4.3Å; D230-L234 WeakPolarHBondContact O-CB 3.46Å; D230-L234 WeakPolarHBondContact O-CG 3.46Å; D230-L234 PolarHBondContact O-N 3.43Å
235	F	83.7	Confident	87.3	Confident	58 Å²	58	43.8 Å²	43.8	25%	0.254	20%	0.202	S	C	.	.	H	α-helix	trans	-103.3	-22.7	-171.4	-59.9	-89.1	0	0	0	113.8	F217 A218 Q220 L222 F226 I231	F217-F235 HydrophobicContact CD1-CB 4.2Å; F217-F235 HydrophobicContact CD1-CD1 4.4Å; F217-F235 HydrophobicContact CD1-CD2 4.34Å; F217-F235 HydrophobicContact CD1-CG 4.06Å; F217-F235 HydrophobicContact CE1-CB 3.68Å; F217-F235 HydrophobicContact CE1-CG 4.06Å; A218-F235 HydrophobicContact CB-CD1 3.61Å; A218-F235 HydrophobicContact CB-CE1 4.05Å; A218-F235 HydrophobicContact CB-CG 4.42Å; Q220-F235 HydrophobicContact CG-CE1 4.34Å; L222-F235 HydrophobicContact CD2-CE2 4Å; L222-F235 HydrophobicContact CD2-CZ 3.74Å; F226-F235 HydrophobicContact CE2-CE2 4.15Å; F226-F235 HydrophobicContact CE2-CZ 4.44Å; I231-F235 HydrophobicContact CD1-CD2 4.18Å; I231-F235 HydrophobicContact CD1-CE2 3.92Å; I231-F235 HydrophobicContact CG2-CD2 4.11Å; I231-F235 WeakPolarHBondContact O-CB 3.39Å; I231-F235 WeakPolarHBondContact O-CD2 3.4Å; I231-F235 PolarHBondContact O-N 3.09Å
236	L	84	Confident	87.4	Confident	30 Å²	30	38.7 Å²	38.7	16%	0.157	18%	0.182	C	C	.	.	S	Bend	trans	-115.1	8.3	-174.9	-53.8	175.5	0	0	0	112.5	F217 V232 G238 Q239 M241 I243	F217-L236 HydrophobicContact CZ-CD2 4.19Å; V232-L236 HydrophobicContact CG2-CD1 4.35Å; V232-L236 CarbonylContact O-C 3.59Å; V232-L236 VanDerWaalsContact O-CA 3.3Å; V232-L236 WeakPolarHBondContact O-CA 2.93Å; V232-L236 WeakPolarHBondContact O-CB 2.92Å; V232-L236 PolarHBondContact O-N 3.5Å; V232-L236 VanDerWaalsContact O-N 3.09Å; L236-G238 PolarHBondContact O-N 2.68Å; L236-Q239 HydrophobicContact CB-CB 4.44Å; L236-Q239 WeakPolarHBondContact O-CB 3.34Å; L236-Q239 WeakPolarHBondContact O-CG 3.4Å; L236-Q239 PolarHBondContact O-N 3.12Å; L236-M241 HydrophobicContact CD1-CG 3.88Å; L236-M241 HydrophobicContact CD2-SD 4.15Å; L236-I243 HydrophobicContact CD1-CD1 4.09Å; L236-I243 HydrophobicContact CD1-CG1 4.01Å
237	M	81.5	Confident	87.5	Confident	88 Å²	88	37.9 Å²	37.9	43%	0.433	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	41.4	179.7	-59.8	-178	149.8	0	0	112.6	Y134 V232 Q239	Y134-M237 HydrophobicContact CD1-CB 4.41Å; Y134-M237 WeakPolarHBondContact CD1-O 3.27Å; Y134-M237 HydrophobicContact CE1-CB 3.99Å; Y134-M237 WeakPolarHBondContact CE1-O 3.31Å; V232-M237 PolarHBondContact O-N 3.44Å; V232-M237 VanDerWaalsContact O-N 3.09Å; M237-Q239 VanDerWaalsContact C-N 3.28Å; M237-Q239 PolarHBondContact O-N 3.46Å
238	G	77.5	Confident	87.3	Confident	8 Å²	8	38.3 Å²	38.3	8%	0.082	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	-5.2	-179.2	0	0	0	0	0	115	V232 L236 K240	V232-G238 PolarHBondContact O-N 2.66Å; L236-G238 PolarHBondContact O-N 2.68Å; G238-K240 PolarHBondContact O-N 3.43Å; G238-K240 VanDerWaalsContact O-N 3.11Å
239	Q	76.8	Confident	87.2	Confident	91 Å²	91	38.4 Å²	38.4	43%	0.425	18%	0.179	S	C	.	.			trans	-71.7	108.4	-179.6	-63	-175	1.7	0	0	111.3	L129 L236 M237 M241	L129-Q239 VanDerWaalsContact CD2-NE2 3.34Å; L236-Q239 HydrophobicContact CB-CB 4.44Å; L236-Q239 WeakPolarHBondContact O-CB 3.34Å; L236-Q239 WeakPolarHBondContact O-CG 3.4Å; L236-Q239 PolarHBondContact O-N 3.12Å; M237-Q239 VanDerWaalsContact C-N 3.28Å; M237-Q239 PolarHBondContact O-N 3.46Å; Q239-M241 VanDerWaalsContact C-N 3.31Å; Q239-M241 PolarHBondContact O-N 3.19Å
240	K	81.2	Confident	87.1	Confident	91 Å²	91	36.7 Å²	36.7	40%	0.396	17%	0.172	S	C	.	.			trans	-74.4	80.2	177.8	-57.2	169.8	-166.4	174	0	110.2	D141 I143 G238	D141-K240 HydrophobicContact CB-CD 4.14Å; D141-K240 WeakPolarHBondContact OD1-CE 3.15Å; D141-K240 IonicContact OD1-NZ 2.72Å; D141-K240 PolarHBondContact OD1-NZ 2.84Å; D141-K240 WeakPolarHBondContact OD2-CE 3.06Å; D141-K240 IonicContact OD2-NZ 3.22Å; D141-K240 PolarHBondContact OD2-NZ 3.45Å; I143-K240 HydrophobicContact CD1-CB 4.23Å; I143-K240 HydrophobicContact CD1-CG 4.24Å; G238-K240 PolarHBondContact O-N 3.43Å; G238-K240 VanDerWaalsContact O-N 3.11Å
241	M	77.7	Confident	86.9	Confident	101 Å²	101	40.1 Å²	40.1	50%	0.498	19%	0.186	S	C	.	.			trans	-114	171.1	175.9	62.2	-178.9	-71.5	0	0	111.7	L236 Q239 I243	L236-M241 HydrophobicContact CD1-CG 3.88Å; L236-M241 HydrophobicContact CD2-SD 4.15Å; Q239-M241 VanDerWaalsContact C-N 3.31Å; Q239-M241 PolarHBondContact O-N 3.19Å; M241-I243 WeakPolarHBondContact O-CG1 3.44Å; M241-I243 PolarHBondContact O-N 3Å
242	Y	87.3	Confident	86.4	Confident	102 Å²	102	43.7 Å²	43.7	40%	0.4	20%	0.204	S	C	.	.			trans	-61.1	127.1	171.8	170.3	-101.9	0	0	0	110.6	S144 G146 Y185 L244	S144-Y242 WeakPolarHBondContact O-CA 3.45Å; G146-Y242 WeakPolarHBondContact CA-OH 3.47Å; Y185-Y242 HydrophobicContact CD1-CE2 4.14Å; Y185-Y242 VanDerWaalsContact CD1-OH 3.3Å; Y185-Y242 WeakPolarHBondContact CD1-OH 3.48Å; Y185-Y242 WeakPolarHBondContact CE1-OH 3.47Å; Y242-L244 HydrophobicContact CE1-CB 3.85Å; Y242-L244 WeakPolarHBondContact OH-CD1 3.48Å
243	I	89.2	Confident	85.3	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.2	-177.7	-46.5	-177.1	0	0	0	109.2	I143 S144 V145 G146 F217 I231 V232 L236 M241 F245	I143-I243 HydrophobicContact CG2-CD1 3.67Å; I143-I243 HydrophobicContact CG2-CG1 4.06Å; S144-I243 PolarHBondContact O-N 3.34Å; V145-I243 CarbonylContact C-O 3.59Å; V145-I243 VanDerWaalsContact CA-O 3.25Å; V145-I243 WeakPolarHBondContact CA-O 3.06Å; G146-I243 PolarHBondContact N-O 3.45Å; F217-I243 HydrophobicContact CD2-CG2 3.95Å; F217-I243 HydrophobicContact CE2-CG2 3.43Å; F217-I243 VanDerWaalsContact CE2-CG2 3.43Å; F217-I243 HydrophobicContact CZ-CG2 3.85Å; I231-I243 HydrophobicContact CG2-CD1 4.25Å; I231-I243 HydrophobicContact CG2-CG2 4.21Å; V232-I243 HydrophobicContact CG2-CD1 3.61Å; L236-I243 HydrophobicContact CD1-CD1 4.09Å; L236-I243 HydrophobicContact CD1-CG1 4.01Å; M241-I243 WeakPolarHBondContact O-CG1 3.44Å; M241-I243 PolarHBondContact O-N 3Å; I243-F245 HydrophobicContact CB-CE2 4.1Å; I243-F245 HydrophobicContact CB-CZ 4.5Å; I243-F245 HydrophobicContact CG2-CD2 4.14Å; I243-F245 HydrophobicContact CG2-CE1 4.19Å; I243-F245 HydrophobicContact CG2-CE2 3.45Å; I243-F245 VanDerWaalsContact CG2-CE2 3.45Å; I243-F245 HydrophobicContact CG2-CZ 3.48Å; I243-F245 VanDerWaalsContact CG2-CZ 3.48Å
244	L	91.2	Very high	83.9	Confident	46 Å²	46	52.3 Å²	52.3	24%	0.241	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.7	173.8	179.8	65.8	0	0	0	110	Q148 F217 Y242	Q148-L244 HydrophobicContact CB-CD1 4.19Å; F217-L244 WeakPolarHBondContact CD2-O 3.49Å; Y242-L244 HydrophobicContact CE1-CB 3.85Å; Y242-L244 WeakPolarHBondContact OH-CD1 3.48Å
245	F	94.7	Very high	82.2	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	147.8	169.4	-62.1	-83.5	0	0	0	110.4	V145 G146 F147 Q148 L194 F217 L222 L228 I231 I243	V145-F245 HydrophobicContact CG2-CD2 3.36Å; V145-F245 HydrophobicContact CG2-CE2 3.31Å; G146-F245 PolarHBondContact O-N 2.91Å; F147-F245 CarbonylContact C-O 3.53Å; F147-F245 VanDerWaalsContact CA-O 3.27Å; F147-F245 WeakPolarHBondContact CA-O 3.47Å; F147-F245 HydrophobicContact CD1-CB 3.62Å; F147-F245 HydrophobicContact CD1-CD2 4.22Å; F147-F245 HydrophobicContact CD1-CG 4.22Å; F147-F245 HydrophobicContact CE1-CB 3.83Å; F147-F245 AromaticContact CE1-CD2 3.69Å; F147-F245 HydrophobicContact CE1-CD2 3.69Å; F147-F245 AromaticContact CE1-CG 3.91Å; F147-F245 HydrophobicContact CE1-CG 3.91Å; F147-F245 HydrophobicContact CG-CB 4.45Å; F147-F245 AromaticContact CZ-CD2 3.94Å; F147-F245 HydrophobicContact CZ-CD2 3.94Å; Q148-F245 PolarHBondContact N-O 3.3Å; L194-F245 HydrophobicContact CD2-CD1 4.46Å; L194-F245 HydrophobicContact CD2-CE1 4.14Å; L194-F245 HydrophobicContact CD2-CE2 4.41Å; L194-F245 HydrophobicContact CD2-CZ 4.1Å; F217-F245 HydrophobicContact CB-CD1 3.76Å; F217-F245 HydrophobicContact CB-CE1 3.83Å; F217-F245 HydrophobicContact CD2-CD1 4.08Å; F217-F245 HydrophobicContact CD2-CE1 4.07Å; F217-F245 HydrophobicContact CG-CD1 4.18Å; F217-F245 AromaticContact CG-CE1 3.98Å; F217-F245 HydrophobicContact CG-CE1 3.98Å; L222-F245 HydrophobicContact CD1-CD1 3.89Å; L222-F245 HydrophobicContact CD1-CE1 3.45Å; L222-F245 VanDerWaalsContact CD1-CE1 3.45Å; L228-F245 HydrophobicContact CD2-CE2 3.8Å; L228-F245 HydrophobicContact CD2-CZ 3.94Å; I231-F245 HydrophobicContact CB-CZ 4.48Å; I231-F245 HydrophobicContact CG1-CE1 4.23Å; I231-F245 HydrophobicContact CG1-CZ 4Å; I231-F245 HydrophobicContact CG2-CE1 4.31Å; I231-F245 HydrophobicContact CG2-CZ 4.08Å; I243-F245 HydrophobicContact CB-CE2 4.1Å; I243-F245 HydrophobicContact CB-CZ 4.5Å; I243-F245 HydrophobicContact CG2-CD2 4.14Å; I243-F245 HydrophobicContact CG2-CE1 4.19Å; I243-F245 HydrophobicContact CG2-CE2 3.45Å; I243-F245 VanDerWaalsContact CG2-CE2 3.45Å; I243-F245 HydrophobicContact CG2-CZ 3.48Å; I243-F245 VanDerWaalsContact CG2-CZ 3.48Å
246	Y	93.4	Very high	80.4	Confident	44 Å²	44	63.4 Å²	63.4	17%	0.173	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	155.6	161.3	-61	-80.5	0	0	0	109.7	Q148 P152 Y155 F215 A216	Q148-Y246 HydrophobicContact CB-CD1 3.97Å; Q148-Y246 HydrophobicContact CB-CE1 4.16Å; Q148-Y246 HydrophobicContact CG-CD1 4.36Å; Q148-Y246 HydrophobicContact CG-CE1 4.33Å; Q148-Y246 CarbonylContact O-C 3.19Å; Q148-Y246 VanDerWaalsContact O-CA 3.27Å; Q148-Y246 WeakPolarHBondContact O-CA 3.43Å; Q148-Y246 VanDerWaalsContact OE1-CE1 3.31Å; P152-Y246 VanDerWaalsContact CD-CD1 3.44Å; P152-Y246 HydrophobicContact CG-CD1 4.09Å; P152-Y246 HydrophobicContact CG-CE1 3.66Å; Y155-Y246 HydrophobicContact CD2-CD2 4.02Å; Y155-Y246 AromaticContact CD2-CE2 3.95Å; Y155-Y246 HydrophobicContact CD2-CE2 3.95Å; Y155-Y246 HydrophobicContact CE1-CD2 4.23Å; Y155-Y246 AromaticContact CE2-CD2 3.43Å; Y155-Y246 HydrophobicContact CE2-CD2 3.43Å; Y155-Y246 VanDerWaalsContact CE2-CD2 3.43Å; Y155-Y246 AromaticContact CE2-CE2 3.32Å; Y155-Y246 HydrophobicContact CE2-CE2 3.32Å; Y155-Y246 AromaticContact CZ-CD2 3.55Å; Y155-Y246 AromaticContact CZ-CE2 3.87Å; F215-Y246 CarbonylContact C-O 3.55Å; F215-Y246 WeakPolarHBondContact CA-O 3.41Å; A216-Y246 PolarHBondContact N-O 3.47Å; A216-Y246 PolarHBondContact O-N 3.24Å
247	F	93.8	Very high	78.2	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	155.4	171.6	71.5	-85.9	0	0	0	112	F147 Q148 F149 I151 I201 Y205 I213 E214 F215	F147-F247 HydrophobicContact CB-CD1 4.03Å; F147-F247 HydrophobicContact CB-CE1 4.22Å; Q148-F247 WeakPolarHBondContact O-CD1 3.28Å; Q148-F247 PolarHBondContact O-N 2.91Å; F149-F247 HydrophobicContact CB-CD1 3.99Å; F149-F247 HydrophobicContact CB-CD2 4.07Å; F149-F247 HydrophobicContact CB-CE1 3.48Å; F149-F247 VanDerWaalsContact CB-CE1 3.48Å; F149-F247 HydrophobicContact CB-CE2 3.56Å; F149-F247 HydrophobicContact CB-CG 4.28Å; F149-F247 HydrophobicContact CB-CZ 3.24Å; F149-F247 HydrophobicContact CD2-CD2 4.18Å; F149-F247 AromaticContact CD2-CE2 3.99Å; F149-F247 HydrophobicContact CD2-CE2 3.99Å; F149-F247 WeakPolarHBondContact CD2-O 3.48Å; F149-F247 HydrophobicContact CG-CE2 4.05Å; F149-F247 HydrophobicContact CG-CZ 4.16Å; I151-F247 PolarHBondContact N-O 3.34Å; I201-F247 HydrophobicContact CG2-CD2 4.33Å; I201-F247 HydrophobicContact CG2-CE1 4.4Å; I201-F247 HydrophobicContact CG2-CE2 3.98Å; I201-F247 HydrophobicContact CG2-CZ 4Å; Y205-F247 AromaticContact CD2-CZ 4Å; Y205-F247 HydrophobicContact CD2-CZ 4Å; Y205-F247 HydrophobicContact CE2-CE1 4.22Å; Y205-F247 AromaticContact CE2-CZ 3.62Å; Y205-F247 HydrophobicContact CE2-CZ 3.62Å; I213-F247 HydrophobicContact CG2-CD2 4.31Å; E214-F247 WeakPolarHBondContact O-CA 3.41Å; E214-F247 VanDerWaalsContact O-CB 3.3Å; E214-F247 WeakPolarHBondContact O-CB 3.33Å; F215-F247 HydrophobicContact CD1-CB 3.8Å; F215-F247 HydrophobicContact CE1-CB 4Å
248	R	91.4	Very high	75.9	Confident	20 Å²	20	65.6 Å²	65.6	8%	0.075	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	162.9	170.6	64.2	171.9	171.5	-142.7	-7.5	110.3	I151 Q161 I213 E214	I151-R248 HydrophobicContact CD1-CB 3.91Å; I151-R248 HydrophobicContact CD1-CG 3.9Å; I151-R248 HydrophobicContact CG1-CB 4.18Å; Q161-R248 PolarHBondContact O-NH1 3.41Å; Q161-R248 PolarHBondContact O-NH2 3.39Å; Q161-R248 VanDerWaalsContact O-NH2 3.15Å; I213-R248 VanDerWaalsContact CA-O 3.26Å; I213-R248 WeakPolarHBondContact CA-O 3.3Å; I213-R248 WeakPolarHBondContact CB-O 3.47Å; E214-R248 HydrophobicContact CB-CG 4.42Å; E214-R248 PolarHBondContact N-O 3.17Å; E214-R248 PolarHBondContact O-N 3.19Å; E214-R248 IonicContact OE2-CZ 3.26Å; E214-R248 VanDerWaalsContact OE2-CZ 3.26Å; E214-R248 IonicContact OE2-NE 2.94Å; E214-R248 PolarHBondContact OE2-NE 3.25Å; E214-R248 IonicContact OE2-NH2 2.69Å; E214-R248 PolarHBondContact OE2-NH2 2.95Å
249	V	91.9	Very high	73.6	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.006	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.7	177.4	-177.4	0	0	0	0	109.7	F149 V167 V172 L176 L178 I207 Y211 D212 I213	F149-V249 HydrophobicContact CE2-CG2 4.23Å; V167-V249 PolarHBondContact N-O 3.43Å; V172-V249 HydrophobicContact CG1-CB 4.09Å; V172-V249 HydrophobicContact CG1-CG2 3.64Å; V172-V249 HydrophobicContact CG2-CB 3.78Å; V172-V249 HydrophobicContact CG2-CG1 4.33Å; V172-V249 HydrophobicContact CG2-CG2 4.28Å; L176-V249 HydrophobicContact CD1-CG1 3.8Å; L176-V249 HydrophobicContact CD1-CG2 4.39Å; L178-V249 HydrophobicContact CD1-CG2 4.21Å; I207-V249 HydrophobicContact CD1-CG2 4.11Å; I207-V249 HydrophobicContact CG2-CG1 4.38Å; Y211-V249 HydrophobicContact CD1-CG1 3.92Å; Y211-V249 HydrophobicContact CG-CG1 4.25Å; D212-V249 CarbonylContact O-C 3.53Å; D212-V249 WeakPolarHBondContact O-CA 3.32Å; D212-V249 WeakPolarHBondContact O-CG1 3.22Å; I213-V249 HydrophobicContact CG2-CG2 4.12Å
250	L	90.8	Very high	73.5	Confident	18 Å²	18	76.8 Å²	76.8	9%	0.094	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	158.2	172.9	-55.8	-176.2	0	0	0	110.4	P163 G165 Y211 D212 E214	P163-L250 HydrophobicContact CG-CD2 3.66Å; G165-L250 CarbonylContact O-C 3.56Å; G165-L250 WeakPolarHBondContact O-CA 3.12Å; Y211-L250 CarbonylContact C-O 3.55Å; Y211-L250 WeakPolarHBondContact CA-O 3.39Å; D212-L250 HydrophobicContact CB-CB 4.5Å; D212-L250 PolarHBondContact N-O 3.06Å; D212-L250 PolarHBondContact O-N 2.96Å; E214-L250 VanDerWaalsContact CD-CD1 3.47Å; E214-L250 HydrophobicContact CG-CD1 3.6Å; E214-L250 HydrophobicContact CG-CG 4.17Å
251	K	86.8	Confident	73.1	Confident	106 Å²	106	76.1 Å²	76.1	46%	0.461	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.1	165.9	-172.7	172.2	-173.6	168.7	0	108.6	G165 V167 P210 Y211 S253	G165-K251 PolarHBondContact O-N 3.28Å; V167-K251 HydrophobicContact CG2-CB 3.62Å; P210-K251 HydrophobicContact CG-CG 4.3Å; Y211-K251 HydrophobicContact CD1-CB 4.24Å; Y211-K251 HydrophobicContact CD1-CG 4.48Å; Y211-K251 HydrophobicContact CE1-CB 4.29Å; Y211-K251 HydrophobicContact CE1-CD 4.29Å; Y211-K251 HydrophobicContact CE1-CG 4.29Å; K251-S253 PolarHBondContact O-N 3.14Å
252	L	80.1	Confident	72.8	Confident	75 Å²	75	74.7 Å²	74.7	39%	0.393	41%	0.413	S	S	.	.			trans	-63.4	121.3	175.6	-59.6	171.9	0	0	0	108.7	P210 D212	P210-L252 VanDerWaalsContact O-CB 3.26Å; P210-L252 WeakPolarHBondContact O-CB 3.33Å; P210-L252 WeakPolarHBondContact O-CG 3.3Å; P210-L252 PolarHBondContact O-N 3.3Å; D212-L252 HydrophobicContact CB-CD1 4.22Å; D212-L252 HydrophobicContact CB-CD2 4.02Å; D212-L252 HydrophobicContact CB-CG 4.02Å
253	S	66.4	Low	71.9	Confident	64 Å²	64	73.1 Å²	73.1	45%	0.448	41%	0.414	S	S	.	.			trans	-70.8	146.8	166.9	57.5	0	0	0	0	109	K251 E255 N256	K251-S253 PolarHBondContact O-N 3.14Å; S253-E255 PolarHBondContact O-N 3.38Å; S253-N256 PolarHBondContact O-N 2.71Å
254	V	57.5	Low	70.9	Confident	141 Å²	141	77.6 Å²	77.6	86%	0.855	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-58.4	-14	-176.3	-178.3	0	0	0	0	112.7	N256	V254-N256 PolarHBondContact O-N 3.49Å
255	E	49.8	Very low	69.5	Low	175 Å²	175	79.7 Å²	79.7	82%	0.818	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-73.1	-19.4	179.8	-71.1	179.3	154.8	0	0	114.5	S253	S253-E255 PolarHBondContact O-N 3.38Å
256	N	45	Very low	67.7	Low	129 Å²	129	85.4 Å²	85.4	69%	0.69	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-95.1	2.6	-179.4	-78.5	-6	0	0	0	115	S253 V254 G258	S253-N256 PolarHBondContact O-N 2.71Å; V254-N256 PolarHBondContact O-N 3.49Å; N256-G258 VanDerWaalsContact C-N 3.35Å
257	A	38.2	Very low	65.7	Low	95 Å²	95	88.5 Å²	88.5	79%	0.785	51%	0.509	S	S	*	.	S	Bend	trans	-92	14.9	-178.8	0	0	0	0	0	114.1
258	G	32.4	Very low	63.4	Low	70 Å²	70	95.9 Å²	95.9	72%	0.722	55%	0.551	S	S	*	*			trans	-139.4	17.1	-167.2	0	0	0	0	0	117.7	N256	N256-G258 VanDerWaalsContact C-N 3.35Å
259	M	30.3	Very low	60.8	Low	257 Å²	257	102.8 Å²	102.8	100%	1.266	59%	0.594	S	S	*	*			trans	-124.1	0	165.4	-68.6	-158.4	-146.8	0	0	110.4

Retrieved 259 of 259 residues in 645.6 ms (Link to these results)

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