A0A087YJW6_POEFO Loading...

Transmembrane and immunoglobulin domain containing 1

AlphaFold DB , UniProt , Accession A0A087YJW6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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	42.8	Very low	47.9	Very low	228 Å²	228	154.7 Å²	154.7	100%	1.123	80%	0.804	S	S	*	*				0	132.1	0	-163.2	167.2	72.1	0	0	107.7
2	K	37.6	Very low	48.1	Very low	194 Å²	194	154.8 Å²	154.8	84%	0.843	81%	0.805	S	S	*	*			trans	80.7	87.6	178.4	-64.2	179.6	176.6	177.9	0	115.6
3	L	37.6	Very low	48.4	Very low	152 Å²	152	154.8 Å²	154.8	80%	0.796	81%	0.805	S	S	*	*				90.1	102.3	72.7	-163.1	81.9	0	0	0	110.1	I5	L3-I5 HydrophobicContact CD2-CD1 4.44Å
4	M	49.5	Very low	48.4	Very low	188 Å²	188	152.1 Å²	152.1	93%	0.926	80%	0.802	S	S	*	*			trans	-68.1	136.9	168.9	-62.8	-166.9	173.6	0	0	109.8
5	I	48.5	Very low	48.9	Very low	146 Å²	146	149.8 Å²	149.8	75%	0.749	80%	0.803	S	S	*	*			trans	-128.9	117.3	162.5	-63.9	178.3	0	0	0	108.5	L3	L3-I5 HydrophobicContact CD2-CD1 4.44Å
6	S	53	Low	48.6	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	80%	0.803	S	S	*	*			trans	-74.1	139.9	178.2	-178.4	0	0	0	0	111
7	I	53.9	Low	48.6	Very low	153 Å²	153	144.5 Å²	144.5	79%	0.785	80%	0.8	S	S	*	*			trans	-125.9	92.2	165.1	-56.4	174.8	0	0	0	106.9	L9	I7-L9 HydrophobicContact CG2-CD1 4.47Å
8	A	54.4	Low	48.9	Very low	75 Å²	75	141.3 Å²	141.3	62%	0.62	79%	0.789	S	S	*	*			trans	-83.1	113.1	168	0	0	0	0	0	108.4	L10	A8-L10 PolarHBondContact O-N 3.2Å; A8-L10 VanDerWaalsContact O-N 3.14Å
9	L	51.5	Low	49.1	Very low	138 Å²	138	141.8 Å²	141.8	72%	0.723	79%	0.785	S	S	*	*			trans	-68.5	103.9	167.7	-104.4	87.2	0	0	0	108.6	I7 F11	I7-L9 HydrophobicContact CG2-CD1 4.47Å; L9-F11 HydrophobicContact CD2-CE2 4.36Å; L9-F11 HydrophobicContact CD2-CZ 4.45Å; L9-F11 PolarHBondContact O-N 3.35Å
10	L	48.8	Very low	49.7	Very low	146 Å²	146	140 Å²	140	76%	0.764	78%	0.778	S	S	*	*			trans	-75.8	107.2	163.5	-88.8	99.5	0	0	0	109	A8 L12	A8-L10 PolarHBondContact O-N 3.2Å; A8-L10 VanDerWaalsContact O-N 3.14Å; L10-L12 PolarHBondContact O-N 3.22Å; L10-L12 VanDerWaalsContact O-N 3.12Å
11	F	49.2	Very low	50.3	Low	177 Å²	177	134.1 Å²	134.1	78%	0.776	75%	0.746	S	S	*	*			trans	-71.7	96.3	159.8	-78	-85.5	0	0	0	108.4	L9 L13	L9-F11 HydrophobicContact CD2-CE2 4.36Å; L9-F11 HydrophobicContact CD2-CZ 4.45Å; L9-F11 PolarHBondContact O-N 3.35Å; F11-L13 PolarHBondContact O-N 3.47Å; F11-L13 VanDerWaalsContact O-N 3.09Å
12	L	51	Low	52.3	Low	156 Å²	156	126.8 Å²	126.8	82%	0.817	71%	0.714	S	S	*	*			trans	-69	98.7	164.9	-82.3	156.3	0	0	0	107.9	L10 P14	L10-L12 PolarHBondContact O-N 3.22Å; L10-L12 VanDerWaalsContact O-N 3.12Å; L12-P14 WeakPolarHBondContact O-CD 3.39Å
13	L	51.4	Low	54.9	Low	155 Å²	155	117.9 Å²	117.9	81%	0.812	68%	0.676	S	S	*	*			trans	-62.8	123.3	163.2	-75.4	163.2	0	0	0	107.6	F11 S15	F11-L13 PolarHBondContact O-N 3.47Å; F11-L13 VanDerWaalsContact O-N 3.09Å; L13-S15 PolarHBondContact O-N 3.02Å
14	P	48.3	Very low	57.6	Low	117 Å²	117	114.1 Å²	114.1	76%	0.76	65%	0.652	S	S	*	*			trans	-69.3	104.6	172.3	28.7	-31.2	0	0	0	107.3	L12 C16	L12-P14 WeakPolarHBondContact O-CD 3.39Å; P14-C16 PolarHBondContact O-N 3.4Å
15	S	55.3	Low	59.9	Low	117 Å²	117	106.2 Å²	106.2	82%	0.818	61%	0.613	S	S	*	*			trans	-65.9	86.5	163.3	39.9	0	0	0	0	107.4	L13 A17	L13-S15 PolarHBondContact O-N 3.02Å; S15-A17 PolarHBondContact O-N 3.41Å
16	C	45.2	Very low	62.2	Low	118 Å²	118	103.4 Å²	103.4	80%	0.797	60%	0.597	S	S	*	*			trans	-64	91.5	168.6	-159.9	0	0	0	0	106.5	P14 S18	P14-C16 PolarHBondContact O-N 3.4Å; C16-S18 PolarHBondContact O-N 3.18Å
17	A	48.7	Very low	64.3	Low	91 Å²	91	99.2 Å²	99.2	75%	0.752	57%	0.567	S	S	*	*			trans	-65.4	83.4	163.4	0	0	0	0	0	106	S15 Q19	S15-A17 PolarHBondContact O-N 3.41Å; A17-Q19 PolarHBondContact O-N 3.25Å
18	S	53	Low	66.4	Low	88 Å²	88	95.7 Å²	95.7	62%	0.615	56%	0.557	S	S	*	*			trans	-55.7	112.1	166.5	-163.2	0	0	0	0	104.9	C16 T20	C16-S18 PolarHBondContact O-N 3.18Å; S18-T20 PolarHBondContact O-N 3Å
19	Q	54.1	Low	68.5	Low	150 Å²	150	94.6 Å²	94.6	70%	0.701	54%	0.543	S	S	*	.			trans	-67.8	81	169.5	-72.7	-179.5	18.4	0	0	105.9	A17 S21 T53	A17-Q19 PolarHBondContact O-N 3.25Å; Q19-S21 PolarHBondContact O-N 3.47Å; Q19-S21 VanDerWaalsContact O-N 3.12Å; Q19-T53 PolarHBondContact OE1-OG1 3.48Å
20	T	60.3	Low	70.6	Confident	105 Å²	105	96.2 Å²	96.2	64%	0.644	55%	0.547	S	S	*	.			trans	-66.4	111.9	171.2	47.9	0	0	0	0	105.8	S18 V22	S18-T20 PolarHBondContact O-N 3Å; T20-V22 PolarHBondContact O-N 3.35Å
21	S	62.4	Low	72.9	Confident	17 Å²	17	91.8 Å²	91.8	12%	0.119	53%	0.527	C	S	.	.			trans	-68.8	128.9	171.8	-55.7	0	0	0	0	109.7	Q19 N51 H54 H105	Q19-S21 PolarHBondContact O-N 3.47Å; Q19-S21 VanDerWaalsContact O-N 3.12Å; S21-N51 WeakPolarHBondContact CA-O 3.44Å; S21-N51 WeakPolarHBondContact CB-O 3.44Å; S21-H54 WeakPolarHBondContact CB-NE2 3.35Å; S21-H54 PolarHBondContact OG-CD2 2.92Å; S21-H54 PolarHBondContact OG-CE1 3.27Å; S21-H54 PolarHBondContact OG-NE2 2.92Å; S21-H105 PolarHBondContact O-CE1 2.91Å; S21-H105 VanDerWaalsContact O-CE1 3.32Å; S21-H105 PolarHBondContact O-ND1 2.94Å
22	V	84.5	Confident	75.1	Confident	74 Å²	74	89 Å²	89	45%	0.448	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.1	-175.1	179.9	0	0	0	0	107.9	T20 N51	T20-V22 PolarHBondContact O-N 3.35Å; V22-N51 PolarHBondContact N-O 2.93Å; V22-N51 VanDerWaalsContact N-O 3.14Å; V22-N51 PolarHBondContact O-N 3.49Å; V22-N51 VanDerWaalsContact O-N 3.09Å
23	V	93.1	Very high	77.1	Confident	8 Å²	8	89.2 Å²	89.2	5%	0.048	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.6	163.8	172.1	0	0	0	0	107	C48 L50 L59 C97 H105 A107	V23-C48 VanDerWaalsContact CG1-SG 3.51Å; V23-L50 HydrophobicContact CG2-CD1 3.55Å; V23-L59 HydrophobicContact CG2-CD2 4.26Å; V23-C97 HydrophobicContact CG1-CB 4.32Å; V23-H105 HydrophobicContact CG2-CB 3.86Å; V23-A107 HydrophobicContact CG1-CB 4.24Å
24	Y	94.1	Very high	79.1	Confident	73 Å²	73	83.4 Å²	83.4	29%	0.286	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.9	174.3	68.2	-78.9	0	0	0	110.7	E26 C48 T49 N51	Y24-E26 HydrophobicContact CD2-CG 4.16Å; Y24-E26 HydrophobicContact CE2-CG 3.8Å; Y24-C48 WeakPolarHBondContact O-CA 3.25Å; Y24-T49 WeakPolarHBondContact CD1-O 3.4Å; Y24-T49 HydrophobicContact CE1-CG2 4Å; Y24-T49 PolarHBondContact N-O 2.86Å; Y24-T49 VanDerWaalsContact N-O 3.14Å; Y24-T49 PolarHBondContact O-N 3.24Å; Y24-N51 HydrophobicContact CE1-CB 4.45Å; Y24-N51 WeakPolarHBondContact CE1-ND2 3.25Å
25	I	96.9	Very high	81.5	Confident	22 Å²	22	80 Å²	80	11%	0.113	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.5	-179.9	-65.3	167.9	0	0	0	108.4	L46 V47 C48 W61 C97 A107 V109	I25-L46 HydrophobicContact CG2-CB 4.34Å; I25-L46 HydrophobicContact CG2-CD2 4.47Å; I25-V47 CarbonylContact C-O 3.58Å; I25-V47 WeakPolarHBondContact CA-O 3.44Å; I25-C48 HydrophobicContact CG1-CB 4.32Å; I25-W61 HydrophobicContact CD1-CH2 3.6Å; I25-W61 HydrophobicContact CD1-CZ3 3.64Å; I25-W61 HydrophobicContact CG1-CH2 3.73Å; I25-W61 HydrophobicContact CG1-CZ3 4.29Å; I25-W61 HydrophobicContact CG2-CH2 4.05Å; I25-C97 HydrophobicContact CD1-CB 3.94Å; I25-C97 HydrophobicContact CG1-CB 4.03Å; I25-A107 HydrophobicContact CD1-CB 3.99Å; I25-A107 WeakPolarHBondContact CD1-O 3.42Å; I25-A107 HydrophobicContact CG1-CB 3.91Å; I25-V109 HydrophobicContact CB-CG1 4.33Å; I25-V109 HydrophobicContact CD1-CG2 4.37Å; I25-V109 HydrophobicContact CG2-CG1 4.11Å; I25-V109 HydrophobicContact CG2-CG2 4.19Å
26	E	97.3	Very high	83.5	Confident	87 Å²	87	74.4 Å²	74.4	41%	0.407	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	138.5	162.3	-63.6	172	162.8	0	0	108	Y24 V47 R78	Y24-E26 HydrophobicContact CD2-CG 4.16Å; Y24-E26 HydrophobicContact CE2-CG 3.8Å; E26-V47 HydrophobicContact CB-CB 4.42Å; E26-V47 PolarHBondContact N-O 2.94Å; E26-V47 PolarHBondContact O-N 2.96Å; E26-R78 IonicContact OE2-CZ 2.77Å; E26-R78 IonicContact OE2-NH1 3.13Å; E26-R78 IonicContact OE2-NH2 2.61Å; E26-R78 PolarHBondContact OE2-NH2 3.48Å
27	S	97.6	Very high	86	Confident	16 Å²	16	73 Å²	73	11%	0.112	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.5	176.3	67.9	0	0	0	0	112.4	P29 P31 I36 S45	S27-P29 CarbonylContact C-O 3.22Å; S27-P29 VanDerWaalsContact C-O 3.22Å; S27-P29 WeakPolarHBondContact CB-O 3.27Å; S27-P29 CarbonylContact O-C 3.38Å; S27-P29 PolarHBondContact OG-O 3.02Å; S27-P31 VanDerWaalsContact OG-CD 3.27Å; S27-P31 WeakPolarHBondContact OG-CD 3.26Å; S27-I36 WeakPolarHBondContact OG-CD1 3.46Å; S27-S45 CarbonylContact C-O 3.53Å; S27-S45 VanDerWaalsContact CA-O 3.26Å; S27-S45 WeakPolarHBondContact CA-O 3.46Å
28	S	97.3	Very high	88.4	Confident	80 Å²	80	69.2 Å²	69.2	56%	0.559	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.3	166.7	-170.4	0	0	0	0	107.8	V44 S45	S28-V44 WeakPolarHBondContact O-CA 3.36Å; S28-S45 PolarHBondContact N-O 2.87Å; S28-S45 PolarHBondContact O-N 3.4Å
29	P	97.6	Very high	90.4	Very high	51 Å²	51	70.1 Å²	70.1	33%	0.331	38%	0.379	S	S	.	.	S	Bend	cis	-70.1	162.1	2.6	27.8	-29.5	0	0	0	113.7	S27 I36 Q37	S27-P29 CarbonylContact C-O 3.22Å; S27-P29 VanDerWaalsContact C-O 3.22Å; S27-P29 WeakPolarHBondContact CB-O 3.27Å; S27-P29 CarbonylContact O-C 3.38Å; S27-P29 PolarHBondContact OG-O 3.02Å; P29-I36 HydrophobicContact CG-CG2 3.71Å; P29-Q37 WeakPolarHBondContact CG-O 3.27Å
30	E	96.9	Very high	92.4	Very high	173 Å²	173	66 Å²	66	81%	0.808	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-65.9	142.8	178.9	-71.5	-176.9	179.3	0	0	111.3
31	P	96.1	Very high	94.1	Very high	52 Å²	52	69.4 Å²	69.4	34%	0.338	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-82	143.2	-179.5	31.8	-26.2	0	0	0	111	S27 V35 I36	S27-P31 VanDerWaalsContact OG-CD 3.27Å; S27-P31 WeakPolarHBondContact OG-CD 3.26Å; P31-V35 CarbonylContact C-O 3.54Å; P31-V35 WeakPolarHBondContact CA-O 3.35Å; P31-I36 HydrophobicContact CB-CG1 3.85Å
32	L	95.4	Very high	95.8	Very high	119 Å²	119	71.4 Å²	71.4	62%	0.623	38%	0.376	S	S	*	.	B	Isolated β-bridge	trans	-101.6	117.2	165.9	-179.1	63	0	0	0	108.3	G34 V35	L32-G34 PolarHBondContact O-N 3.22Å; L32-V35 PolarHBondContact N-O 3.48Å; L32-V35 WeakPolarHBondContact O-CB 3.45Å; L32-V35 PolarHBondContact O-N 3.45Å
33	D	93.9	Very high	96.4	Very high	160 Å²	160	71 Å²	71	86%	0.856	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	41.4	-178.2	-62.5	-28	0	0	0	113.7	V35	D33-V35 VanDerWaalsContact C-N 3.28Å; D33-V35 PolarHBondContact O-N 3.3Å
34	G	93.3	Very high	96.7	Very high	33 Å²	33	70.6 Å²	70.6	34%	0.34	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	5.5	-178.7	0	0	0	0	0	114.8	L32 V109 T110	L32-G34 PolarHBondContact O-N 3.22Å; G34-V109 WeakPolarHBondContact O-CA 3.49Å; G34-T110 PolarHBondContact O-N 2.91Å
35	V	98.1	Very high	96.9	Very high	46 Å²	46	69.2 Å²	69.2	28%	0.279	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.5	178.9	-174.3	0	0	0	0	110.9	P31 L32 D33 T110 N112	P31-V35 CarbonylContact C-O 3.54Å; P31-V35 WeakPolarHBondContact CA-O 3.35Å; L32-V35 PolarHBondContact N-O 3.48Å; L32-V35 WeakPolarHBondContact O-CB 3.45Å; L32-V35 PolarHBondContact O-N 3.45Å; D33-V35 VanDerWaalsContact C-N 3.28Å; D33-V35 PolarHBondContact O-N 3.3Å; V35-T110 CarbonylContact C-O 3.18Å; V35-T110 VanDerWaalsContact CA-O 3.29Å; V35-T110 WeakPolarHBondContact CA-O 3.4Å; V35-N112 HydrophobicContact CG1-CB 3.52Å
36	I	98.4	Very high	97	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	115.1	177.1	-59.1	171.1	0	0	0	108.3	S27 P29 P31 V44 L46 V109 T110 L111 N112	S27-I36 WeakPolarHBondContact OG-CD1 3.46Å; P29-I36 HydrophobicContact CG-CG2 3.71Å; P31-I36 HydrophobicContact CB-CG1 3.85Å; I36-V44 HydrophobicContact CD1-CG1 4.12Å; I36-V44 HydrophobicContact CG2-CG1 4.16Å; I36-V44 HydrophobicContact CG2-CG2 4.33Å; I36-L46 HydrophobicContact CD1-CD2 3.45Å; I36-L46 VanDerWaalsContact CD1-CD2 3.45Å; I36-V109 HydrophobicContact CD1-CB 3.9Å; I36-V109 HydrophobicContact CD1-CG1 4.45Å; I36-V109 HydrophobicContact CD1-CG2 3.75Å; I36-V109 HydrophobicContact CG1-CB 4.31Å; I36-T110 PolarHBondContact N-O 2.89Å; I36-L111 HydrophobicContact CB-CD2 3.76Å; I36-L111 HydrophobicContact CD1-CD2 3.94Å; I36-L111 HydrophobicContact CG1-CD2 4.37Å; I36-L111 HydrophobicContact CG2-CD2 4.08Å; I36-N112 PolarHBondContact O-N 2.89Å
37	Q	97.8	Very high	97	Very high	89 Å²	89	65.3 Å²	65.3	42%	0.416	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.2	175.2	-58.7	-61.9	-35.8	0	0	109.8	P29 N112	P29-Q37 WeakPolarHBondContact CG-O 3.27Å; Q37-N112 PolarHBondContact OE1-ND2 2.99Å
38	T	97.6	Very high	97	Very high	10 Å²	10	64.6 Å²	64.6	6%	0.061	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	179.4	178.5	-169	0	0	0	0	110.9	D42 V44 V86 N112 V113 T114	T38-D42 WeakPolarHBondContact OG1-CB 3.45Å; T38-V44 HydrophobicContact CG2-CG2 4.03Å; T38-V86 HydrophobicContact CG2-CG1 3.97Å; T38-V86 HydrophobicContact CG2-CG2 4.3Å; T38-N112 PolarHBondContact N-O 2.84Å; T38-V113 HydrophobicContact CG2-CB 4.41Å; T38-V113 HydrophobicContact CG2-CG2 3.81Å; T38-T114 PolarHBondContact O-N 3.26Å; T38-T114 PolarHBondContact O-OG1 2.63Å
39	K	96.4	Very high	96.9	Very high	107 Å²	107	61.5 Å²	61.5	47%	0.465	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	163.5	176.3	57.6	178.5	-179.3	-170.2	0	109.8	D42 T114	K39-D42 VanDerWaalsContact CE-CG 3.4Å; K39-D42 WeakPolarHBondContact CE-OD1 3.33Å; K39-D42 WeakPolarHBondContact CE-OD2 3.39Å; K39-D42 HydrophobicContact CG-CB 4.37Å; K39-D42 VanDerWaalsContact CG-CG 3.41Å; K39-D42 WeakPolarHBondContact CG-OD2 3.27Å; K39-D42 WeakPolarHBondContact O-CB 3.39Å; K39-D42 PolarHBondContact O-N 2.9Å; K39-T114 WeakPolarHBondContact CA-O 3.47Å
40	I	96	Very high	96.7	Very high	65 Å²	65	59.6 Å²	59.6	33%	0.333	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	146.9	174.9	56.5	168.4	0	0	0	111.8	D42 V86 V113	I40-D42 PolarHBondContact O-N 3.38Å; I40-V86 CarbonylContact C-O 3.5Å; I40-V86 WeakPolarHBondContact CA-O 3.28Å; I40-V113 HydrophobicContact CG2-CG1 4.04Å
41	K	96.1	Very high	96.3	Very high	175 Å²	175	55.3 Å²	55.3	76%	0.761	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-4.9	-177.3	-51.4	175.4	-179.9	174.6	0	115.9	V86	K41-V86 PolarHBondContact N-O 2.75Å
42	D	97.4	Very high	95.5	Very high	59 Å²	59	54.8 Å²	54.8	32%	0.316	30%	0.302	S	S	.	.			trans	-72.5	174.6	169.7	-76.1	2.4	0	0	0	111.1	T38 K39 I40 V86	T38-D42 WeakPolarHBondContact OG1-CB 3.45Å; K39-D42 VanDerWaalsContact CE-CG 3.4Å; K39-D42 WeakPolarHBondContact CE-OD1 3.33Å; K39-D42 WeakPolarHBondContact CE-OD2 3.39Å; K39-D42 HydrophobicContact CG-CB 4.37Å; K39-D42 VanDerWaalsContact CG-CG 3.41Å; K39-D42 WeakPolarHBondContact CG-OD2 3.27Å; K39-D42 WeakPolarHBondContact O-CB 3.39Å; K39-D42 PolarHBondContact O-N 2.9Å; I40-D42 PolarHBondContact O-N 3.38Å; D42-V86 WeakPolarHBondContact O-CG2 3.45Å; D42-V86 PolarHBondContact O-N 3.04Å
43	T	98.1	Very high	94.5	Very high	66 Å²	66	54.9 Å²	54.9	41%	0.405	31%	0.308	S	S	.	.			trans	-117.4	132.2	172.2	-64.7	0	0	0	0	109.3	I83 N84	T43-I83 VanDerWaalsContact CA-O 3.31Å; T43-I83 WeakPolarHBondContact CA-O 3.43Å; T43-N84 HydrophobicContact CG2-CB 4.03Å; T43-N84 PolarHBondContact OG1-OD1 2.92Å
44	V	98.5	Very high	93.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.3	169.7	177.9	0	0	0	0	108.6	S28 I36 T38 L46 C82 I83 V86 L111	S28-V44 WeakPolarHBondContact O-CA 3.36Å; I36-V44 HydrophobicContact CD1-CG1 4.12Å; I36-V44 HydrophobicContact CG2-CG1 4.16Å; I36-V44 HydrophobicContact CG2-CG2 4.33Å; T38-V44 HydrophobicContact CG2-CG2 4.03Å; V44-L46 HydrophobicContact CG1-CD2 3.68Å; V44-L46 HydrophobicContact CG1-CG 4.25Å; V44-C82 CarbonylContact O-C 3.55Å; V44-C82 WeakPolarHBondContact O-CA 3.25Å; V44-I83 HydrophobicContact CB-CB 4.29Å; V44-I83 HydrophobicContact CB-CD1 3.98Å; V44-I83 HydrophobicContact CG1-CD1 4.07Å; V44-I83 PolarHBondContact N-O 2.74Å; V44-I83 PolarHBondContact O-N 2.76Å; V44-V86 HydrophobicContact CG2-CG2 3.88Å; V44-L111 HydrophobicContact CG1-CD2 4.14Å; V44-L111 HydrophobicContact CG2-CD2 4.36Å
45	S	98.3	Very high	92.7	Very high	43 Å²	43	57.6 Å²	57.6	30%	0.301	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.4	174.6	-58.9	0	0	0	0	109.4	S27 S28	S27-S45 CarbonylContact C-O 3.53Å; S27-S45 VanDerWaalsContact CA-O 3.26Å; S27-S45 WeakPolarHBondContact CA-O 3.46Å; S28-S45 PolarHBondContact N-O 2.87Å; S28-S45 PolarHBondContact O-N 3.4Å
46	L	98.4	Very high	91.9	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.5	177.1	-52	-177.5	0	0	0	109	I25 I36 V44 W61 C80 V81 I83 F95 V109	I25-L46 HydrophobicContact CG2-CB 4.34Å; I25-L46 HydrophobicContact CG2-CD2 4.47Å; I36-L46 HydrophobicContact CD1-CD2 3.45Å; I36-L46 VanDerWaalsContact CD1-CD2 3.45Å; V44-L46 HydrophobicContact CG1-CD2 3.68Å; V44-L46 HydrophobicContact CG1-CG 4.25Å; L46-W61 HydrophobicContact CB-CH2 3.72Å; L46-W61 HydrophobicContact CB-CZ2 4.12Å; L46-W61 HydrophobicContact CB-CZ3 4.46Å; L46-W61 HydrophobicContact CD1-CH2 4.15Å; L46-W61 HydrophobicContact CD1-CZ3 4.08Å; L46-C80 CarbonylContact O-C 3.52Å; L46-C80 WeakPolarHBondContact O-CA 3.36Å; L46-V81 HydrophobicContact CB-CG2 3.8Å; L46-V81 HydrophobicContact CD1-CG2 3.94Å; L46-V81 HydrophobicContact CG-CG2 4.23Å; L46-V81 PolarHBondContact N-O 2.76Å; L46-V81 PolarHBondContact O-N 3.34Å; L46-I83 HydrophobicContact CD1-CD1 3.97Å; L46-I83 HydrophobicContact CG-CD1 4.08Å; L46-F95 HydrophobicContact CD1-CB 3.51Å; L46-F95 HydrophobicContact CD1-CD1 3.89Å; L46-F95 HydrophobicContact CD1-CD2 4.09Å; L46-F95 HydrophobicContact CD1-CG 3.55Å; L46-V109 HydrophobicContact CD1-CG2 4.03Å; L46-V109 HydrophobicContact CD2-CG2 4Å
47	V	98.1	Very high	91.4	Very high	27 Å²	27	61.5 Å²	61.5	16%	0.164	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	113.4	177.4	-173.5	0	0	0	0	109.2	I25 E26 R78 C80	I25-V47 CarbonylContact C-O 3.58Å; I25-V47 WeakPolarHBondContact CA-O 3.44Å; E26-V47 HydrophobicContact CB-CB 4.42Å; E26-V47 PolarHBondContact N-O 2.94Å; E26-V47 PolarHBondContact O-N 2.96Å; V47-R78 HydrophobicContact CG1-CG 3.85Å; V47-R78 VanDerWaalsContact CG1-NH2 3.32Å; V47-C80 VanDerWaalsContact CG1-SG 3.59Å; V47-C80 HydrophobicContact CG2-CB 4.44Å
48	C	96.9	Very high	91.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135.1	175.4	178	0	0	0	0	110	V23 Y24 I25 W61 R78 S79 C97	V23-C48 VanDerWaalsContact CG1-SG 3.51Å; Y24-C48 WeakPolarHBondContact O-CA 3.25Å; I25-C48 HydrophobicContact CG1-CB 4.32Å; C48-W61 HydrophobicContact CB-CH2 4.03Å; C48-W61 HydrophobicContact CB-CZ2 3.32Å; C48-R78 CarbonylContact O-C 3.58Å; C48-R78 VanDerWaalsContact O-CA 3.24Å; C48-R78 WeakPolarHBondContact O-CA 3.39Å; C48-S79 PolarHBondContact N-O 2.87Å; C48-S79 PolarHBondContact O-N 3.49Å; C48-C97 HydrophobicContact CB-CB 3.48Å; C48-C97 VanDerWaalsContact CB-CB 3.48Å; C48-C97 WeakPolarHBondContact CB-SG 3.37Å; C48-C97 WeakPolarHBondContact SG-CB 3.41Å; C48-C97 CovalentContact SG-SG 2.01Å; C48-C97 PolarHBondContact SG-SG 3.06Å
49	T	95.4	Very high	91.1	Very high	16 Å²	16	59.7 Å²	59.7	10%	0.098	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.6	176.5	-54	0	0	0	0	110.1	Y24 N77 R78	Y24-T49 WeakPolarHBondContact CD1-O 3.4Å; Y24-T49 HydrophobicContact CE1-CG2 4Å; Y24-T49 PolarHBondContact N-O 2.86Å; Y24-T49 VanDerWaalsContact N-O 3.14Å; Y24-T49 PolarHBondContact O-N 3.24Å; T49-N77 WeakPolarHBondContact CA-O 3.34Å; T49-R78 PolarHBondContact OG1-NH1 3.43Å
50	L	93.5	Very high	91.1	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.052	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.2	170.8	-179.5	67.5	0	0	0	109	V23 L59 N77 L99	V23-L50 HydrophobicContact CG2-CD1 3.55Å; L50-L59 HydrophobicContact CB-CD2 4.26Å; L50-N77 PolarHBondContact N-O 3.35Å; L50-L99 HydrophobicContact CD1-CD1 4.39Å; L50-L99 HydrophobicContact CD2-CD1 3.74Å
51	N	87.8	Confident	91.2	Very high	83 Å²	83	52.1 Å²	52.1	44%	0.444	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.4	169.3	-78.5	-10.2	0	0	0	110	S21 V22 Y24	S21-N51 WeakPolarHBondContact CA-O 3.44Å; S21-N51 WeakPolarHBondContact CB-O 3.44Å; V22-N51 PolarHBondContact N-O 2.93Å; V22-N51 VanDerWaalsContact N-O 3.14Å; V22-N51 PolarHBondContact O-N 3.49Å; V22-N51 VanDerWaalsContact O-N 3.09Å; Y24-N51 HydrophobicContact CE1-CB 4.45Å; Y24-N51 WeakPolarHBondContact CE1-ND2 3.25Å
52	G	80.3	Confident	91.3	Very high	42 Å²	42	44.9 Å²	44.9	43%	0.433	25%	0.248	S	C	.	.	S	Bend	trans	134.5	174.3	178.2	0	0	0	0	0	112.7
53	T	74.4	Confident	91.3	Very high	120 Å²	120	45.8 Å²	45.8	74%	0.736	25%	0.247	S	C	*	.			trans	-100.8	101.7	174	9.5	0	0	0	0	109.3	Q19	Q19-T53 PolarHBondContact OE1-OG1 3.48Å
54	H	72.9	Confident	91.3	Very high	46 Å²	46	46.9 Å²	46.9	21%	0.213	25%	0.251	C	S	.	.			trans	-120.1	145.7	171.2	-67.5	-84	0	0	0	110.9	S21 D56 K57	S21-H54 WeakPolarHBondContact CB-NE2 3.35Å; S21-H54 PolarHBondContact OG-CD2 2.92Å; S21-H54 PolarHBondContact OG-CE1 3.27Å; S21-H54 PolarHBondContact OG-NE2 2.92Å; H54-D56 WeakPolarHBondContact CB-O 3.41Å; H54-K57 VanDerWaalsContact O-CE 3.25Å; H54-K57 WeakPolarHBondContact O-CE 3.37Å
55	E	76.8	Confident	91.2	Very high	205 Å²	205	53.7 Å²	53.7	96%	0.958	29%	0.287	S	S	*	.	S	Bend	trans	-71.1	-41.7	170.9	-63.8	-172.4	165.6	0	0	111
56	D	81	Confident	91.2	Very high	54 Å²	54	54.5 Å²	54.5	29%	0.289	30%	0.296	S	S	.	.			trans	-93.8	124.3	169.6	-179.7	19.2	0	0	0	110.4	H54 E58 S101	H54-D56 WeakPolarHBondContact CB-O 3.41Å; D56-E58 WeakPolarHBondContact OD1-CB 3.4Å; D56-E58 PolarHBondContact OD1-N 2.92Å; D56-S101 WeakPolarHBondContact OD2-CB 3.45Å; D56-S101 PolarHBondContact OD2-N 3.32Å; D56-S101 PolarHBondContact OD2-OG 2.59Å
57	K	87.4	Confident	91.1	Very high	74 Å²	74	61.1 Å²	61.1	32%	0.322	33%	0.329	S	S	.	.			trans	-120.1	8.2	-174.8	-68.4	165.4	163.5	-169.1	0	111.9	H54 L59 E76 N77	H54-K57 VanDerWaalsContact O-CE 3.25Å; H54-K57 WeakPolarHBondContact O-CE 3.37Å; K57-L59 PolarHBondContact O-N 3.41Å; K57-E76 HydrophobicContact CB-CG 3.7Å; K57-E76 WeakPolarHBondContact O-CA 3.32Å; K57-N77 WeakPolarHBondContact CB-OD1 3.31Å; K57-N77 WeakPolarHBondContact CD-OD1 3.34Å; K57-N77 WeakPolarHBondContact CG-OD1 3.34Å; K57-N77 PolarHBondContact O-N 3.45Å
58	E	93.6	Very high	91	Very high	61 Å²	61	62.1 Å²	62.1	29%	0.285	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-76.1	117.1	-177.3	-160.5	-178.6	160.5	0	0	110.4	D56 K75 K100	D56-E58 WeakPolarHBondContact OD1-CB 3.4Å; D56-E58 PolarHBondContact OD1-N 2.92Å; E58-K75 CarbonylContact C-O 3.25Å; E58-K75 WeakPolarHBondContact CA-O 3.44Å; E58-K75 HydrophobicContact CG-CB 4.14Å; E58-K100 HydrophobicContact CB-CB 4.16Å; E58-K100 HydrophobicContact CB-CD 4.13Å; E58-K100 HydrophobicContact CG-CB 4.5Å; E58-K100 HydrophobicContact CG-CD 3.9Å; E58-K100 VanDerWaalsContact O-CB 3.23Å; E58-K100 WeakPolarHBondContact O-CB 3.3Å; E58-K100 PolarHBondContact O-N 2.93Å; E58-K100 WeakPolarHBondContact OE1-CD 3.25Å; E58-K100 IonicContact OE1-NZ 3.98Å; E58-K100 PolarHBondContact OE1-NZ 2.88Å; E58-K100 WeakPolarHBondContact OE2-CD 3.3Å; E58-K100 IonicContact OE2-NZ 3.2Å; E58-K100 PolarHBondContact OE2-NZ 3.3Å
59	L	95.3	Very high	91	Very high	0 Å²	0	72 Å²	72	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	142.1	175.5	-66.9	172.7	0	0	0	110	V23 L50 K57 K75	V23-L59 HydrophobicContact CG2-CD2 4.26Å; L50-L59 HydrophobicContact CB-CD2 4.26Å; K57-L59 PolarHBondContact O-N 3.41Å; L59-K75 PolarHBondContact N-O 2.99Å
60	V	96.7	Very high	90.9	Very high	13 Å²	13	72.1 Å²	72.1	8%	0.079	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.7	172.3	-61.8	0	0	0	0	110	L62 M67 C97 Q98 K100	V60-L62 HydrophobicContact CG2-CD1 4.19Å; V60-M67 HydrophobicContact CB-CE 4.41Å; V60-M67 HydrophobicContact CG1-CE 4.26Å; V60-C97 WeakPolarHBondContact O-CA 3.43Å; V60-Q98 HydrophobicContact CG2-CG 3.44Å; V60-Q98 VanDerWaalsContact CG2-CG 3.44Å; V60-Q98 PolarHBondContact N-O 2.89Å; V60-Q98 PolarHBondContact O-N 2.8Å; V60-K100 HydrophobicContact CG1-CB 4.04Å; V60-K100 HydrophobicContact CG1-CD 4.35Å; V60-K100 HydrophobicContact CG1-CG 4.13Å
61	W	98.1	Very high	90.9	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.9	173.7	-81.9	101.2	0	0	0	110.2	I25 L46 C48 I68 L70 S79 V81 F95 T96 C97	I25-W61 HydrophobicContact CD1-CH2 3.6Å; I25-W61 HydrophobicContact CD1-CZ3 3.64Å; I25-W61 HydrophobicContact CG1-CH2 3.73Å; I25-W61 HydrophobicContact CG1-CZ3 4.29Å; I25-W61 HydrophobicContact CG2-CH2 4.05Å; L46-W61 HydrophobicContact CB-CH2 3.72Å; L46-W61 HydrophobicContact CB-CZ2 4.12Å; L46-W61 HydrophobicContact CB-CZ3 4.46Å; L46-W61 HydrophobicContact CD1-CH2 4.15Å; L46-W61 HydrophobicContact CD1-CZ3 4.08Å; C48-W61 HydrophobicContact CB-CH2 4.03Å; C48-W61 HydrophobicContact CB-CZ2 3.32Å; W61-I68 HydrophobicContact CB-CB 4.08Å; W61-I68 HydrophobicContact CB-CD1 3.98Å; W61-I68 HydrophobicContact CB-CG1 4.22Å; W61-I68 PolarHBondContact O-N 3.01Å; W61-L70 HydrophobicContact CB-CD1 4.37Å; W61-L70 HydrophobicContact CB-CD2 4.43Å; W61-L70 HydrophobicContact CG-CD1 4.47Å; W61-L70 HydrophobicContact CG-CD2 4.5Å; W61-S79 VanDerWaalsContact CD1-OG 3.26Å; W61-S79 PolarHBondContact NE1-O 2.99Å; W61-S79 PolarHBondContact NE1-OG 3.38Å; W61-S79 VanDerWaalsContact NE1-OG 3.14Å; W61-V81 HydrophobicContact CB-CG1 4.25Å; W61-V81 HydrophobicContact CD2-CG1 4.1Å; W61-V81 HydrophobicContact CD2-CG2 3.84Å; W61-V81 HydrophobicContact CE3-CG2 4.03Å; W61-V81 HydrophobicContact CG-CG1 3.75Å; W61-V81 HydrophobicContact CG-CG2 4.36Å; W61-V81 HydrophobicContact CH2-CG2 4.17Å; W61-V81 HydrophobicContact CZ2-CG2 3.96Å; W61-V81 HydrophobicContact CZ3-CG2 4.21Å; W61-F95 HydrophobicContact CE3-CB 4.34Å; W61-F95 HydrophobicContact CZ3-CB 3.96Å; W61-T96 CarbonylContact C-O 3.54Å; W61-T96 WeakPolarHBondContact CA-O 3.43Å; W61-C97 HydrophobicContact CD2-CB 3.95Å; W61-C97 HydrophobicContact CE3-CB 3.86Å; W61-C97 HydrophobicContact CH2-CB 3.86Å; W61-C97 HydrophobicContact CZ2-CB 3.96Å; W61-C97 HydrophobicContact CZ3-CB 3.8Å
62	L	98.3	Very high	90.9	Very high	22 Å²	22	80.5 Å²	80.5	12%	0.115	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.8	172.7	-56.2	89.3	0	0	0	109	V60 A66 F95 T96 Q98	V60-L62 HydrophobicContact CG2-CD1 4.19Å; L62-A66 CarbonylContact C-O 3.5Å; L62-A66 VanDerWaalsContact CA-O 3.27Å; L62-A66 WeakPolarHBondContact CA-O 3.04Å; L62-F95 WeakPolarHBondContact O-CA 3.33Å; L62-T96 HydrophobicContact CD1-CG2 4.43Å; L62-T96 PolarHBondContact N-O 2.86Å; L62-T96 PolarHBondContact O-N 3.41Å; L62-Q98 HydrophobicContact CD1-CG 3.83Å
63	R	98.2	Very high	91.3	Very high	79 Å²	79	82.6 Å²	82.6	30%	0.298	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	114.4	167.3	176	-179.5	169.4	158.9	2.2	107.5	D65 A66 I68 K89 D90 T94 F95	R63-D65 VanDerWaalsContact C-N 3.28Å; R63-D65 PolarHBondContact O-N 3.49Å; R63-A66 PolarHBondContact N-O 3.37Å; R63-A66 WeakPolarHBondContact O-CB 3.15Å; R63-A66 PolarHBondContact O-N 3.33Å; R63-I68 HydrophobicContact CB-CD1 3.99Å; R63-I68 HydrophobicContact CB-CG1 4.12Å; R63-K89 PolarHBondContact NH2-O 2.98Å; R63-D90 IonicContact CZ-OD1 2.65Å; R63-D90 IonicContact NH1-OD1 2.69Å; R63-D90 PolarHBondContact NH1-OD1 2.79Å; R63-D90 IonicContact NH2-OD1 2.97Å; R63-D90 PolarHBondContact NH2-OD1 2.92Å; R63-T94 WeakPolarHBondContact CA-O 3.19Å; R63-F95 HydrophobicContact CB-CD1 4.33Å; R63-F95 HydrophobicContact CB-CE1 4.09Å; R63-F95 HydrophobicContact CG-CE1 4.05Å; R63-F95 HydrophobicContact CG-CZ 4.06Å
64	N	97.4	Very high	92.2	Very high	88 Å²	88	78.7 Å²	78.7	47%	0.471	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	52.1	-173.7	-57.7	-19.3	0	0	0	111.4	A66 A93 T94	N64-A66 PolarHBondContact O-N 2.91Å; N64-A93 WeakPolarHBondContact OD1-CA 3.38Å; N64-T94 PolarHBondContact N-O 3.03Å; N64-T94 PolarHBondContact OD1-N 3.33Å
65	D	96	Very high	93.2	Very high	143 Å²	143	78.7 Å²	78.7	77%	0.765	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	-0.1	-177.5	-50.7	-49.7	0	0	0	116.4	R63	R63-D65 VanDerWaalsContact C-N 3.28Å; R63-D65 PolarHBondContact O-N 3.49Å
66	A	97.6	Very high	93.9	Very high	60 Å²	60	74.7 Å²	74.7	50%	0.496	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.5	174.1	0	0	0	0	0	111.1	L62 R63 N64 I68	L62-A66 CarbonylContact C-O 3.5Å; L62-A66 VanDerWaalsContact CA-O 3.27Å; L62-A66 WeakPolarHBondContact CA-O 3.04Å; R63-A66 PolarHBondContact N-O 3.37Å; R63-A66 WeakPolarHBondContact O-CB 3.15Å; R63-A66 PolarHBondContact O-N 3.33Å; N64-A66 PolarHBondContact O-N 2.91Å; A66-I68 PolarHBondContact O-N 3.37Å
67	M	96.9	Very high	94.3	Very high	141 Å²	141	74.7 Å²	74.7	70%	0.695	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	130.2	-178.5	-174.3	175.3	-77.6	0	0	112	V60	V60-M67 HydrophobicContact CB-CE 4.41Å; V60-M67 HydrophobicContact CG1-CE 4.26Å
68	I	96.9	Very high	94.6	Very high	48 Å²	48	76.9 Å²	76.9	25%	0.246	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-85.4	129.4	172.7	-53.3	-177	0	0	0	108.6	W61 R63 A66 L70 F95	W61-I68 HydrophobicContact CB-CB 4.08Å; W61-I68 HydrophobicContact CB-CD1 3.98Å; W61-I68 HydrophobicContact CB-CG1 4.22Å; W61-I68 PolarHBondContact O-N 3.01Å; R63-I68 HydrophobicContact CB-CD1 3.99Å; R63-I68 HydrophobicContact CB-CG1 4.12Å; A66-I68 PolarHBondContact O-N 3.37Å; I68-L70 HydrophobicContact CG2-CD2 4.34Å; I68-L70 PolarHBondContact O-N 2.9Å; I68-F95 HydrophobicContact CD1-CD1 4.13Å; I68-F95 HydrophobicContact CD1-CE1 4.12Å
69	K	95.4	Very high	94.8	Very high	208 Å²	208	74 Å²	74	90%	0.904	39%	0.39	S	S	*	.			trans	-73	111.2	174	-173.5	177.9	179.8	-180	0	109.9
70	L	94.8	Very high	94.9	Very high	17 Å²	17	76.3 Å²	76.3	9%	0.089	41%	0.406	C	S	.	.			trans	-96	150.6	177.1	-57.2	168.5	0	0	0	111	W61 I68 K75 V81	W61-L70 HydrophobicContact CB-CD1 4.37Å; W61-L70 HydrophobicContact CB-CD2 4.43Å; W61-L70 HydrophobicContact CG-CD1 4.47Å; W61-L70 HydrophobicContact CG-CD2 4.5Å; I68-L70 HydrophobicContact CG2-CD2 4.34Å; I68-L70 PolarHBondContact O-N 2.9Å; L70-K75 HydrophobicContact CB-CD 4.38Å; L70-K75 HydrophobicContact CB-CG 3.79Å; L70-K75 HydrophobicContact CD1-CG 4.07Å; L70-K75 WeakPolarHBondContact O-CE 3.2Å; L70-K75 PolarHBondContact O-NZ 2.94Å; L70-V81 HydrophobicContact CD2-CG1 3.71Å
71	N	93.3	Very high	94.9	Very high	132 Å²	132	76.5 Å²	76.5	71%	0.706	41%	0.407	S	S	*	.			trans	-69.1	151.3	167.2	-64.1	-24.8	0	0	0	110	G73 N74 K75	N71-G73 VanDerWaalsContact C-N 3.28Å; N71-G73 PolarHBondContact O-N 3.46Å; N71-N74 PolarHBondContact O-N 3.21Å; N71-K75 WeakPolarHBondContact O-CE 3.44Å
72	D	87.1	Confident	94.9	Very high	138 Å²	138	80.7 Å²	80.7	74%	0.738	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-61.8	-33	-173.2	-63.9	-33.1	0	0	0	113.7	N74 K75	D72-N74 PolarHBondContact O-N 2.93Å; D72-K75 IonicContact OD1-NZ 3Å; D72-K75 PolarHBondContact OD1-NZ 3Å
73	G	88.6	Confident	94.9	Very high	85 Å²	85	80.2 Å²	80.2	88%	0.876	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-76.2	0.6	174.3	0	0	0	0	0	115.5	N71	N71-G73 VanDerWaalsContact C-N 3.28Å; N71-G73 PolarHBondContact O-N 3.46Å
74	N	94.8	Very high	94.8	Very high	38 Å²	38	81.8 Å²	81.8	20%	0.203	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-121.1	38.4	-175.7	-172.7	40.6	0	0	0	112	N71 D72 S79 C80	N71-N74 PolarHBondContact O-N 3.21Å; D72-N74 PolarHBondContact O-N 2.93Å; N74-S79 WeakPolarHBondContact O-CB 3.47Å; N74-S79 PolarHBondContact O-OG 3.05Å; N74-S79 WeakPolarHBondContact OD1-CA 3.35Å; N74-C80 PolarHBondContact ND2-O 3.39Å; N74-C80 PolarHBondContact OD1-N 3.28Å
75	K	92.9	Very high	94.8	Very high	47 Å²	47	81.2 Å²	81.2	20%	0.204	45%	0.448	C	S	.	.	S	Bend	trans	-131.2	-12.6	-175.8	-65	172.8	-173	168.2	0	113.3	E58 L59 L70 N71 D72	E58-K75 CarbonylContact C-O 3.25Å; E58-K75 WeakPolarHBondContact CA-O 3.44Å; E58-K75 HydrophobicContact CG-CB 4.14Å; L59-K75 PolarHBondContact N-O 2.99Å; L70-K75 HydrophobicContact CB-CD 4.38Å; L70-K75 HydrophobicContact CB-CG 3.79Å; L70-K75 HydrophobicContact CD1-CG 4.07Å; L70-K75 WeakPolarHBondContact O-CE 3.2Å; L70-K75 PolarHBondContact O-NZ 2.94Å; N71-K75 WeakPolarHBondContact O-CE 3.44Å; D72-K75 IonicContact OD1-NZ 3Å; D72-K75 PolarHBondContact OD1-NZ 3Å
76	E	90.9	Very high	94.9	Very high	121 Å²	121	74.4 Å²	74.4	57%	0.565	41%	0.412	S	S	*	.	B	Isolated β-bridge	trans	-112.7	124.7	-167.7	-164.7	-169.4	166	0	0	112.4	K57 R78	K57-E76 HydrophobicContact CB-CG 3.7Å; K57-E76 WeakPolarHBondContact O-CA 3.32Å; E76-R78 PolarHBondContact O-N 3.4Å
77	N	90.4	Very high	94.9	Very high	54 Å²	54	75.3 Å²	75.3	29%	0.289	41%	0.407	S	S	.	.	S	Bend	trans	59.1	-42.8	-179.6	-60.6	-54.4	0	0	0	116.2	T49 L50 K57	T49-N77 WeakPolarHBondContact CA-O 3.34Å; L50-N77 PolarHBondContact N-O 3.35Å; K57-N77 WeakPolarHBondContact CB-OD1 3.31Å; K57-N77 WeakPolarHBondContact CD-OD1 3.34Å; K57-N77 WeakPolarHBondContact CG-OD1 3.34Å; K57-N77 PolarHBondContact O-N 3.45Å
78	R	94.4	Very high	94.8	Very high	120 Å²	120	71.3 Å²	71.3	45%	0.453	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	125.6	178.5	-170.3	172.7	-177.8	89.8	-5	108.2	E26 V47 C48 T49 E76	E26-R78 IonicContact OE2-CZ 2.77Å; E26-R78 IonicContact OE2-NH1 3.13Å; E26-R78 IonicContact OE2-NH2 2.61Å; E26-R78 PolarHBondContact OE2-NH2 3.48Å; V47-R78 HydrophobicContact CG1-CG 3.85Å; V47-R78 VanDerWaalsContact CG1-NH2 3.32Å; C48-R78 CarbonylContact O-C 3.58Å; C48-R78 VanDerWaalsContact O-CA 3.24Å; C48-R78 WeakPolarHBondContact O-CA 3.39Å; T49-R78 PolarHBondContact OG1-NH1 3.43Å; E76-R78 PolarHBondContact O-N 3.4Å
79	S	96.8	Very high	94.7	Very high	0 Å²	0	77.1 Å²	77.1	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.2	-178.8	179.5	0	0	0	0	110.3	C48 W61 N74	C48-S79 PolarHBondContact N-O 2.87Å; C48-S79 PolarHBondContact O-N 3.49Å; W61-S79 VanDerWaalsContact CD1-OG 3.26Å; W61-S79 PolarHBondContact NE1-O 2.99Å; W61-S79 PolarHBondContact NE1-OG 3.38Å; W61-S79 VanDerWaalsContact NE1-OG 3.14Å; N74-S79 WeakPolarHBondContact O-CB 3.47Å; N74-S79 PolarHBondContact O-OG 3.05Å; N74-S79 WeakPolarHBondContact OD1-CA 3.35Å
80	C	97.1	Very high	94.8	Very high	49 Å²	49	67.4 Å²	67.4	33%	0.331	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.8	-174.2	-54.3	0	0	0	0	111.4	L46 V47 N74	L46-C80 CarbonylContact O-C 3.52Å; L46-C80 WeakPolarHBondContact O-CA 3.36Å; V47-C80 VanDerWaalsContact CG1-SG 3.59Å; V47-C80 HydrophobicContact CG2-CB 4.44Å; N74-C80 PolarHBondContact ND2-O 3.39Å; N74-C80 PolarHBondContact OD1-N 3.28Å
81	V	97.8	Very high	95	Very high	16 Å²	16	69.1 Å²	69.1	10%	0.097	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144	169.6	-64.7	0	0	0	0	109.7	L46 W61 L70 F95	L46-V81 HydrophobicContact CB-CG2 3.8Å; L46-V81 HydrophobicContact CD1-CG2 3.94Å; L46-V81 HydrophobicContact CG-CG2 4.23Å; L46-V81 PolarHBondContact N-O 2.76Å; L46-V81 PolarHBondContact O-N 3.34Å; W61-V81 HydrophobicContact CB-CG1 4.25Å; W61-V81 HydrophobicContact CD2-CG1 4.1Å; W61-V81 HydrophobicContact CD2-CG2 3.84Å; W61-V81 HydrophobicContact CE3-CG2 4.03Å; W61-V81 HydrophobicContact CG-CG1 3.75Å; W61-V81 HydrophobicContact CG-CG2 4.36Å; W61-V81 HydrophobicContact CH2-CG2 4.17Å; W61-V81 HydrophobicContact CZ2-CG2 3.96Å; W61-V81 HydrophobicContact CZ3-CG2 4.21Å; L70-V81 HydrophobicContact CD2-CG1 3.71Å; V81-F95 HydrophobicContact CG2-CD1 4.49Å
82	C	97.1	Very high	95.2	Very high	89 Å²	89	65 Å²	65	60%	0.601	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	137.1	179.7	-59.3	0	0	0	0	110.2	V44	V44-C82 CarbonylContact O-C 3.55Å; V44-C82 WeakPolarHBondContact O-CA 3.25Å
83	I	98.2	Very high	95.7	Very high	12 Å²	12	58.5 Å²	58.5	6%	0.062	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	108	171.5	-54.9	90.9	0	0	0	106.5	T43 V44 L46 V86 D90 F95 L111	T43-I83 VanDerWaalsContact CA-O 3.31Å; T43-I83 WeakPolarHBondContact CA-O 3.43Å; V44-I83 HydrophobicContact CB-CB 4.29Å; V44-I83 HydrophobicContact CB-CD1 3.98Å; V44-I83 HydrophobicContact CG1-CD1 4.07Å; V44-I83 PolarHBondContact N-O 2.74Å; V44-I83 PolarHBondContact O-N 2.76Å; L46-I83 HydrophobicContact CD1-CD1 3.97Å; L46-I83 HydrophobicContact CG-CD1 4.08Å; I83-V86 HydrophobicContact CB-CG2 4.37Å; I83-V86 HydrophobicContact CG2-CG2 3.86Å; I83-D90 WeakPolarHBondContact CG2-OD2 3.37Å; I83-F95 HydrophobicContact CD1-CE1 4.03Å; I83-F95 HydrophobicContact CD1-CE2 4.06Å; I83-F95 HydrophobicContact CD1-CZ 3.76Å; I83-F95 HydrophobicContact CG1-CE1 4Å; I83-F95 HydrophobicContact CG1-CE2 4.07Å; I83-F95 HydrophobicContact CG1-CZ 3.48Å; I83-F95 VanDerWaalsContact CG1-CZ 3.48Å; I83-L111 HydrophobicContact CG1-CD1 4.42Å
84	N	96.9	Very high	96.2	Very high	112 Å²	112	56.5 Å²	56.5	60%	0.599	30%	0.303	S	S	*	.			trans	-153	123.7	-179.9	-177.7	30.6	0	0	0	111.8	T43	T43-N84 HydrophobicContact CG2-CB 4.03Å; T43-N84 PolarHBondContact OG1-OD1 2.92Å
85	P	97.8	Very high	96.3	Very high	75 Å²	75	55 Å²	55	49%	0.487	29%	0.294	S	S	.	.	S	Bend	cis	-71	150.5	-13.4	30.4	-33.6	0	0	0	110.9	I87	P85-I87 HydrophobicContact CG-CG2 4.42Å; P85-I87 PolarHBondContact O-N 3.17Å
86	V	98.3	Very high	96.6	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	29%	0.289	C	S	.	.			trans	-63.1	131.6	163.6	174	0	0	0	0	109.2	T38 I40 K41 D42 V44 I83 D90 V113	T38-V86 HydrophobicContact CG2-CG1 3.97Å; T38-V86 HydrophobicContact CG2-CG2 4.3Å; I40-V86 CarbonylContact C-O 3.5Å; I40-V86 WeakPolarHBondContact CA-O 3.28Å; K41-V86 PolarHBondContact N-O 2.75Å; D42-V86 WeakPolarHBondContact O-CG2 3.45Å; D42-V86 PolarHBondContact O-N 3.04Å; V44-V86 HydrophobicContact CG2-CG2 3.88Å; I83-V86 HydrophobicContact CB-CG2 4.37Å; I83-V86 HydrophobicContact CG2-CG2 3.86Å; V86-D90 WeakPolarHBondContact CA-OD2 3.4Å; V86-D90 HydrophobicContact CG1-CB 4.36Å; V86-V113 HydrophobicContact CG1-CB 4.3Å; V86-V113 HydrophobicContact CG1-CG1 3.55Å; V86-V113 HydrophobicContact CG1-CG2 3.68Å
87	I	96.6	Very high	96.9	Very high	79 Å²	79	47.7 Å²	47.7	41%	0.405	26%	0.262	S	S	.	.			trans	-122.2	165.5	179	60.8	166.7	0	0	0	111.5	P85 K89 D90	P85-I87 HydrophobicContact CG-CG2 4.42Å; P85-I87 PolarHBondContact O-N 3.17Å; I87-K89 HydrophobicContact CD1-CB 4.05Å; I87-K89 HydrophobicContact CD1-CD 4.49Å; I87-K89 HydrophobicContact CG1-CB 4.35Å; I87-K89 PolarHBondContact O-N 3.23Å; I87-K89 VanDerWaalsContact O-N 3.1Å; I87-D90 VanDerWaalsContact CG1-OD2 3.3Å; I87-D90 WeakPolarHBondContact CG1-OD2 3.08Å; I87-D90 PolarHBondContact N-OD2 3.07Å; I87-D90 VanDerWaalsContact O-CB 3.29Å; I87-D90 WeakPolarHBondContact O-CB 3.32Å; I87-D90 PolarHBondContact O-N 2.86Å
88	Q	95	Very high	97.1	Very high	57 Å²	57	47.2 Å²	47.2	27%	0.266	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-52.3	-36.2	179.6	-170.5	-175.9	12.6	0	0	113.7	D90 D91 Y115	Q88-D90 PolarHBondContact O-N 2.66Å; Q88-D91 VanDerWaalsContact O-CB 3.31Å; Q88-D91 WeakPolarHBondContact O-CB 3.48Å; Q88-D91 PolarHBondContact O-N 2.71Å; Q88-Y115 HydrophobicContact CG-CD1 4.19Å; Q88-Y115 HydrophobicContact CG-CD2 3.89Å; Q88-Y115 HydrophobicContact CG-CE1 3.88Å; Q88-Y115 HydrophobicContact CG-CE2 3.54Å; Q88-Y115 HydrophobicContact CG-CG 4.22Å
89	K	95.1	Very high	97.1	Very high	170 Å²	170	41.5 Å²	41.5	74%	0.739	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-72.6	-8.7	179.7	-63.4	179.3	-179.6	175.5	0	114	R63 I87 D91	R63-K89 PolarHBondContact NH2-O 2.98Å; I87-K89 HydrophobicContact CD1-CB 4.05Å; I87-K89 HydrophobicContact CD1-CD 4.49Å; I87-K89 HydrophobicContact CG1-CB 4.35Å; I87-K89 PolarHBondContact O-N 3.23Å; I87-K89 VanDerWaalsContact O-N 3.1Å; K89-D91 VanDerWaalsContact C-N 3.32Å
90	D	97.6	Very high	97	Very high	4 Å²	4	47 Å²	47	2%	0.021	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-84	-11.5	174.1	-57.5	-35.1	0	0	0	111.8	R63 I83 V86 I87 Q88 G92 A93 L111 V113	R63-D90 IonicContact CZ-OD1 2.65Å; R63-D90 IonicContact NH1-OD1 2.69Å; R63-D90 PolarHBondContact NH1-OD1 2.79Å; R63-D90 IonicContact NH2-OD1 2.97Å; R63-D90 PolarHBondContact NH2-OD1 2.92Å; I83-D90 WeakPolarHBondContact CG2-OD2 3.37Å; V86-D90 WeakPolarHBondContact CA-OD2 3.4Å; V86-D90 HydrophobicContact CG1-CB 4.36Å; I87-D90 VanDerWaalsContact CG1-OD2 3.3Å; I87-D90 WeakPolarHBondContact CG1-OD2 3.08Å; I87-D90 PolarHBondContact N-OD2 3.07Å; I87-D90 VanDerWaalsContact O-CB 3.29Å; I87-D90 WeakPolarHBondContact O-CB 3.32Å; I87-D90 PolarHBondContact O-N 2.86Å; Q88-D90 PolarHBondContact O-N 2.66Å; D90-G92 PolarHBondContact O-N 3.49Å; D90-A93 WeakPolarHBondContact O-CB 3.43Å; D90-A93 PolarHBondContact O-N 3.01Å; D90-L111 HydrophobicContact CB-CD1 4.13Å; D90-V113 HydrophobicContact CB-CG2 4.19Å
91	D	97.6	Very high	96.7	Very high	52 Å²	52	48.3 Å²	48.3	28%	0.278	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	129.1	175.9	-167.3	35.2	0	0	0	111.5	Q88 K89 A93 V113 Y115 N142	Q88-D91 VanDerWaalsContact O-CB 3.31Å; Q88-D91 WeakPolarHBondContact O-CB 3.48Å; Q88-D91 PolarHBondContact O-N 2.71Å; K89-D91 VanDerWaalsContact C-N 3.32Å; D91-A93 PolarHBondContact O-N 2.77Å; D91-V113 HydrophobicContact CB-CB 3.92Å; D91-V113 HydrophobicContact CB-CG2 4.28Å; D91-V113 PolarHBondContact OD1-N 2.82Å; D91-Y115 HydrophobicContact CB-CE1 3.9Å; D91-Y115 PolarHBondContact OD2-OH 3.15Å; D91-N142 PolarHBondContact OD1-ND2 3.3Å; D91-N142 PolarHBondContact OD2-ND2 2.88Å
92	G	97.8	Very high	96.3	Very high	46 Å²	46	50.7 Å²	50.7	47%	0.474	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	4	-174.3	0	0	0	0	0	114.7	D90 T94 L111	D90-G92 PolarHBondContact O-N 3.49Å; G92-T94 PolarHBondContact O-N 2.95Å; G92-L111 VanDerWaalsContact CA-O 3.31Å; G92-L111 WeakPolarHBondContact CA-O 3.3Å; G92-L111 PolarHBondContact N-O 2.9Å
93	A	98.1	Very high	96	Very high	1 Å²	1	50 Å²	50	1%	0.008	28%	0.278	C	S	.	.			trans	-69.8	128.7	177.8	0	0	0	0	0	110.9	N64 D90 D91 F95 T110 L111	N64-A93 WeakPolarHBondContact OD1-CA 3.38Å; D90-A93 WeakPolarHBondContact O-CB 3.43Å; D90-A93 PolarHBondContact O-N 3.01Å; D91-A93 PolarHBondContact O-N 2.77Å; A93-F95 HydrophobicContact CB-CE2 4.12Å; A93-T110 WeakPolarHBondContact O-CA 3.1Å; A93-L111 PolarHBondContact O-N 2.87Å
94	T	98.3	Very high	95.6	Very high	43 Å²	43	53.4 Å²	53.4	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128	175.8	-57	0	0	0	0	110	R63 N64 G92 V109 T110	R63-T94 WeakPolarHBondContact CA-O 3.19Å; N64-T94 PolarHBondContact N-O 3.03Å; N64-T94 PolarHBondContact OD1-N 3.33Å; G92-T94 PolarHBondContact O-N 2.95Å; T94-V109 WeakPolarHBondContact CA-O 3.23Å; T94-T110 PolarHBondContact OG1-OG1 2.81Å
95	F	98.4	Very high	95.3	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.2	173.4	-70.2	-96.1	0	0	0	109.1	L46 W61 L62 R63 I68 V81 I83 A93 S108 V109 L111	L46-F95 HydrophobicContact CD1-CB 3.51Å; L46-F95 HydrophobicContact CD1-CD1 3.89Å; L46-F95 HydrophobicContact CD1-CD2 4.09Å; L46-F95 HydrophobicContact CD1-CG 3.55Å; W61-F95 HydrophobicContact CE3-CB 4.34Å; W61-F95 HydrophobicContact CZ3-CB 3.96Å; L62-F95 WeakPolarHBondContact O-CA 3.33Å; R63-F95 HydrophobicContact CB-CD1 4.33Å; R63-F95 HydrophobicContact CB-CE1 4.09Å; R63-F95 HydrophobicContact CG-CE1 4.05Å; R63-F95 HydrophobicContact CG-CZ 4.06Å; I68-F95 HydrophobicContact CD1-CD1 4.13Å; I68-F95 HydrophobicContact CD1-CE1 4.12Å; V81-F95 HydrophobicContact CG2-CD1 4.49Å; I83-F95 HydrophobicContact CD1-CE1 4.03Å; I83-F95 HydrophobicContact CD1-CE2 4.06Å; I83-F95 HydrophobicContact CD1-CZ 3.76Å; I83-F95 HydrophobicContact CG1-CE1 4Å; I83-F95 HydrophobicContact CG1-CE2 4.07Å; I83-F95 HydrophobicContact CG1-CZ 3.48Å; I83-F95 VanDerWaalsContact CG1-CZ 3.48Å; A93-F95 HydrophobicContact CB-CE2 4.12Å; F95-S108 CarbonylContact O-C 3.4Å; F95-S108 VanDerWaalsContact O-CA 3.27Å; F95-S108 WeakPolarHBondContact O-CA 3.49Å; F95-V109 HydrophobicContact CB-CG2 4.15Å; F95-V109 PolarHBondContact N-O 2.93Å; F95-V109 PolarHBondContact O-N 2.84Å; F95-L111 HydrophobicContact CD2-CD1 4.4Å; F95-L111 HydrophobicContact CD2-CG 4.2Å; F95-L111 HydrophobicContact CE2-CD1 3.66Å; F95-L111 HydrophobicContact CE2-CG 3.92Å; F95-L111 HydrophobicContact CZ-CD1 4.5Å
96	T	98.2	Very high	95.2	Very high	15 Å²	15	49.4 Å²	49.4	9%	0.092	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.5	179.7	-59.2	0	0	0	0	109.2	W61 L62 A107 S108	W61-T96 CarbonylContact C-O 3.54Å; W61-T96 WeakPolarHBondContact CA-O 3.43Å; L62-T96 HydrophobicContact CD1-CG2 4.43Å; L62-T96 PolarHBondContact N-O 2.86Å; L62-T96 PolarHBondContact O-N 3.41Å; T96-A107 CarbonylContact C-O 3.54Å; T96-A107 WeakPolarHBondContact CA-O 3.49Å; T96-S108 WeakPolarHBondContact CG2-OG 3.31Å; T96-S108 PolarHBondContact OG1-OG 2.77Å
97	C	97.4	Very high	95.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.8	166.2	-177.6	0	0	0	0	108.7	V23 I25 C48 V60 W61 S106 A107	V23-C97 HydrophobicContact CG1-CB 4.32Å; I25-C97 HydrophobicContact CD1-CB 3.94Å; I25-C97 HydrophobicContact CG1-CB 4.03Å; C48-C97 HydrophobicContact CB-CB 3.48Å; C48-C97 VanDerWaalsContact CB-CB 3.48Å; C48-C97 WeakPolarHBondContact CB-SG 3.37Å; C48-C97 WeakPolarHBondContact SG-CB 3.41Å; C48-C97 CovalentContact SG-SG 2.01Å; C48-C97 PolarHBondContact SG-SG 3.06Å; V60-C97 WeakPolarHBondContact O-CA 3.43Å; W61-C97 HydrophobicContact CD2-CB 3.95Å; W61-C97 HydrophobicContact CE3-CB 3.86Å; W61-C97 HydrophobicContact CH2-CB 3.86Å; W61-C97 HydrophobicContact CZ2-CB 3.96Å; W61-C97 HydrophobicContact CZ3-CB 3.8Å; C97-S106 CarbonylContact O-C 3.58Å; C97-S106 VanDerWaalsContact O-CA 3.23Å; C97-S106 WeakPolarHBondContact O-CA 3.22Å; C97-A107 PolarHBondContact N-O 2.81Å; C97-A107 PolarHBondContact O-N 2.64Å
98	Q	95.5	Very high	95.1	Very high	44 Å²	44	49.5 Å²	49.5	21%	0.206	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	158.2	177.7	65.1	-174.7	52.7	0	0	111.7	V60 L62 H105	V60-Q98 HydrophobicContact CG2-CG 3.44Å; V60-Q98 VanDerWaalsContact CG2-CG 3.44Å; V60-Q98 PolarHBondContact N-O 2.89Å; V60-Q98 PolarHBondContact O-N 2.8Å; L62-Q98 HydrophobicContact CD1-CG 3.83Å; Q98-H105 WeakPolarHBondContact CA-O 3.26Å; Q98-H105 WeakPolarHBondContact CB-O 3.35Å
99	L	94.2	Very high	95.3	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.8	171.8	-171.7	68.5	0	0	0	110.1	L50 N102 H105	L50-L99 HydrophobicContact CD1-CD1 4.39Å; L50-L99 HydrophobicContact CD2-CD1 3.74Å; L99-N102 HydrophobicContact CD2-CB 4.43Å; L99-N102 CarbonylContact O-C 3.56Å; L99-N102 VanDerWaalsContact O-C 3.25Å; L99-N102 PolarHBondContact O-N 3.12Å; L99-H105 HydrophobicContact CB-CB 4.15Å; L99-H105 PolarHBondContact N-O 3.14Å
100	K	93.3	Very high	95.4	Very high	115 Å²	115	41 Å²	41	50%	0.5	26%	0.256	S	S	.	.	S	Bend	trans	-64.8	-43.6	-176.3	-174	178.8	175.7	-177.1	0	112.9	E58 V60 N102	E58-K100 HydrophobicContact CB-CB 4.16Å; E58-K100 HydrophobicContact CB-CD 4.13Å; E58-K100 HydrophobicContact CG-CB 4.5Å; E58-K100 HydrophobicContact CG-CD 3.9Å; E58-K100 VanDerWaalsContact O-CB 3.23Å; E58-K100 WeakPolarHBondContact O-CB 3.3Å; E58-K100 PolarHBondContact O-N 2.93Å; E58-K100 WeakPolarHBondContact OE1-CD 3.25Å; E58-K100 IonicContact OE1-NZ 3.98Å; E58-K100 PolarHBondContact OE1-NZ 2.88Å; E58-K100 WeakPolarHBondContact OE2-CD 3.3Å; E58-K100 IonicContact OE2-NZ 3.2Å; E58-K100 PolarHBondContact OE2-NZ 3.3Å; V60-K100 HydrophobicContact CG1-CB 4.04Å; V60-K100 HydrophobicContact CG1-CD 4.35Å; V60-K100 HydrophobicContact CG1-CG 4.13Å; K100-N102 VanDerWaalsContact C-N 3.32Å
101	S	91.7	Very high	95.5	Very high	76 Å²	76	40.9 Å²	40.9	53%	0.531	26%	0.256	S	S	.	.	S	Bend	trans	-68.9	-28.1	176.9	38.2	0	0	0	0	113.6	D56	D56-S101 WeakPolarHBondContact OD2-CB 3.45Å; D56-S101 PolarHBondContact OD2-N 3.32Å; D56-S101 PolarHBondContact OD2-OG 2.59Å
102	N	89.8	Confident	95.5	Very high	67 Å²	67	40.7 Å²	40.7	36%	0.358	25%	0.254	S	S	.	.			trans	-149.5	101.4	-176.8	-175.4	7.7	0	0	0	112.5	L99 K100 S104 H105	L99-N102 HydrophobicContact CD2-CB 4.43Å; L99-N102 CarbonylContact O-C 3.56Å; L99-N102 VanDerWaalsContact O-C 3.25Å; L99-N102 PolarHBondContact O-N 3.12Å; K100-N102 VanDerWaalsContact C-N 3.32Å; N102-S104 PolarHBondContact ND2-OG 2.82Å; N102-S104 PolarHBondContact O-N 2.86Å; N102-S104 VanDerWaalsContact O-N 3.1Å; N102-S104 WeakPolarHBondContact OD1-CB 3.42Å; N102-S104 PolarHBondContact OD1-N 3.15Å; N102-S104 PolarHBondContact OD1-OG 3.43Å; N102-H105 PolarHBondContact ND2-CD2 3.28Å; N102-H105 PolarHBondContact ND2-NE2 2.74Å; N102-H105 PolarHBondContact O-N 2.8Å
103	S	90.3	Very high	95.5	Very high	73 Å²	73	38.5 Å²	38.5	51%	0.51	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.2	179.6	63	0	0	0	0	114.5	H105	S103-H105 PolarHBondContact O-N 2.86Å
104	S	89.2	Confident	95.4	Very high	85 Å²	85	40.3 Å²	40.3	59%	0.594	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.6	172.6	74.8	0	0	0	0	112.4	N102 S106	N102-S104 PolarHBondContact ND2-OG 2.82Å; N102-S104 PolarHBondContact O-N 2.86Å; N102-S104 VanDerWaalsContact O-N 3.1Å; N102-S104 WeakPolarHBondContact OD1-CB 3.42Å; N102-S104 PolarHBondContact OD1-N 3.15Å; N102-S104 PolarHBondContact OD1-OG 3.43Å; S104-S106 PolarHBondContact O-N 2.96Å
105	H	91.4	Very high	95.3	Very high	43 Å²	43	39.4 Å²	39.4	20%	0.199	24%	0.235	C	C	.	.	S	Bend	trans	-92.6	91.5	170.4	-59.3	-78.4	0	0	0	108.7	S21 V23 Q98 L99 N102 S103	S21-H105 PolarHBondContact O-CE1 2.91Å; S21-H105 VanDerWaalsContact O-CE1 3.32Å; S21-H105 PolarHBondContact O-ND1 2.94Å; V23-H105 HydrophobicContact CG2-CB 3.86Å; Q98-H105 WeakPolarHBondContact CA-O 3.26Å; Q98-H105 WeakPolarHBondContact CB-O 3.35Å; L99-H105 HydrophobicContact CB-CB 4.15Å; L99-H105 PolarHBondContact N-O 3.14Å; N102-H105 PolarHBondContact ND2-CD2 3.28Å; N102-H105 PolarHBondContact ND2-NE2 2.74Å; N102-H105 PolarHBondContact O-N 2.8Å; S103-H105 PolarHBondContact O-N 2.86Å
106	S	94.9	Very high	95.1	Very high	60 Å²	60	40.6 Å²	40.6	42%	0.42	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149.1	-178	65	0	0	0	0	111.8	C97 S104	C97-S106 CarbonylContact O-C 3.58Å; C97-S106 VanDerWaalsContact O-CA 3.23Å; C97-S106 WeakPolarHBondContact O-CA 3.22Å; S104-S106 PolarHBondContact O-N 2.96Å
107	A	96	Very high	95	Very high	20 Å²	20	40 Å²	40	17%	0.165	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.6	165.6	0	0	0	0	0	109.5	V23 I25 T96 C97	V23-A107 HydrophobicContact CG1-CB 4.24Å; I25-A107 HydrophobicContact CD1-CB 3.99Å; I25-A107 WeakPolarHBondContact CD1-O 3.42Å; I25-A107 HydrophobicContact CG1-CB 3.91Å; T96-A107 CarbonylContact C-O 3.54Å; T96-A107 WeakPolarHBondContact CA-O 3.49Å; C97-A107 PolarHBondContact N-O 2.81Å; C97-A107 PolarHBondContact O-N 2.64Å
108	S	97.4	Very high	94.6	Very high	61 Å²	61	45.6 Å²	45.6	43%	0.427	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.5	-178.3	-62.6	0	0	0	0	111	F95 T96	F95-S108 CarbonylContact O-C 3.4Å; F95-S108 VanDerWaalsContact O-CA 3.27Å; F95-S108 WeakPolarHBondContact O-CA 3.49Å; T96-S108 WeakPolarHBondContact CG2-OG 3.31Å; T96-S108 PolarHBondContact OG1-OG 2.77Å
109	V	98.1	Very high	94.5	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.042	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.2	170.3	-67.6	0	0	0	0	109	I25 G34 I36 L46 T94 F95	I25-V109 HydrophobicContact CB-CG1 4.33Å; I25-V109 HydrophobicContact CD1-CG2 4.37Å; I25-V109 HydrophobicContact CG2-CG1 4.11Å; I25-V109 HydrophobicContact CG2-CG2 4.19Å; G34-V109 WeakPolarHBondContact O-CA 3.49Å; I36-V109 HydrophobicContact CD1-CB 3.9Å; I36-V109 HydrophobicContact CD1-CG1 4.45Å; I36-V109 HydrophobicContact CD1-CG2 3.75Å; I36-V109 HydrophobicContact CG1-CB 4.31Å; L46-V109 HydrophobicContact CD1-CG2 4.03Å; L46-V109 HydrophobicContact CD2-CG2 4Å; T94-V109 WeakPolarHBondContact CA-O 3.23Å; F95-V109 HydrophobicContact CB-CG2 4.15Å; F95-V109 PolarHBondContact N-O 2.93Å; F95-V109 PolarHBondContact O-N 2.84Å
110	T	98.5	Very high	94.1	Very high	43 Å²	43	48 Å²	48	26%	0.264	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.6	179.2	-57.9	0	0	0	0	110.1	G34 V35 I36 A93 T94	G34-T110 PolarHBondContact O-N 2.91Å; V35-T110 CarbonylContact C-O 3.18Å; V35-T110 VanDerWaalsContact CA-O 3.29Å; V35-T110 WeakPolarHBondContact CA-O 3.4Å; I36-T110 PolarHBondContact N-O 2.89Å; A93-T110 WeakPolarHBondContact O-CA 3.1Å; T94-T110 PolarHBondContact OG1-OG1 2.81Å
111	L	98.6	Very high	94	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.9	174.4	-57.4	-171.5	0	0	0	110.1	I36 V44 I83 D90 G92 A93 F95 V113	I36-L111 HydrophobicContact CB-CD2 3.76Å; I36-L111 HydrophobicContact CD1-CD2 3.94Å; I36-L111 HydrophobicContact CG1-CD2 4.37Å; I36-L111 HydrophobicContact CG2-CD2 4.08Å; V44-L111 HydrophobicContact CG1-CD2 4.14Å; V44-L111 HydrophobicContact CG2-CD2 4.36Å; I83-L111 HydrophobicContact CG1-CD1 4.42Å; D90-L111 HydrophobicContact CB-CD1 4.13Å; G92-L111 VanDerWaalsContact CA-O 3.31Å; G92-L111 WeakPolarHBondContact CA-O 3.3Å; G92-L111 PolarHBondContact N-O 2.9Å; A93-L111 PolarHBondContact O-N 2.87Å; F95-L111 HydrophobicContact CD2-CD1 4.4Å; F95-L111 HydrophobicContact CD2-CG 4.2Å; F95-L111 HydrophobicContact CE2-CD1 3.66Å; F95-L111 HydrophobicContact CE2-CG 3.92Å; F95-L111 HydrophobicContact CZ-CD1 4.5Å; L111-V113 HydrophobicContact CB-CG2 4.08Å
112	N	98.1	Very high	94.2	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.251	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	106.5	161.8	-177	-13.4	0	0	0	106.9	V35 I36 Q37 T38 N142	V35-N112 HydrophobicContact CG1-CB 3.52Å; I36-N112 PolarHBondContact O-N 2.89Å; Q37-N112 PolarHBondContact OE1-ND2 2.99Å; T38-N112 PolarHBondContact N-O 2.84Å; N112-N142 PolarHBondContact OD1-ND2 2.99Å
113	V	98.1	Very high	94.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	115.8	-174.2	-175.3	0	0	0	0	108	T38 I40 V86 D90 D91 L111 Y115 N142	T38-V113 HydrophobicContact CG2-CB 4.41Å; T38-V113 HydrophobicContact CG2-CG2 3.81Å; I40-V113 HydrophobicContact CG2-CG1 4.04Å; V86-V113 HydrophobicContact CG1-CB 4.3Å; V86-V113 HydrophobicContact CG1-CG1 3.55Å; V86-V113 HydrophobicContact CG1-CG2 3.68Å; D90-V113 HydrophobicContact CB-CG2 4.19Å; D91-V113 HydrophobicContact CB-CB 3.92Å; D91-V113 HydrophobicContact CB-CG2 4.28Å; D91-V113 PolarHBondContact OD1-N 2.82Å; L111-V113 HydrophobicContact CB-CG2 4.08Å; V113-Y115 HydrophobicContact CG1-CD1 4.25Å; V113-Y115 WeakPolarHBondContact O-CD1 3.23Å; V113-Y115 VanDerWaalsContact O-CE1 3.26Å; V113-Y115 WeakPolarHBondContact O-CE1 3.25Å; V113-N142 WeakPolarHBondContact O-CB 3.26Å; V113-N142 PolarHBondContact O-ND2 2.98Å
114	T	97.1	Very high	94.8	Very high	40 Å²	40	51.5 Å²	51.5	25%	0.245	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.6	175.9	56.7	0	0	0	0	111	T38 K39 N142 Y198	T38-T114 PolarHBondContact O-N 3.26Å; T38-T114 PolarHBondContact O-OG1 2.63Å; K39-T114 WeakPolarHBondContact CA-O 3.47Å; T114-N142 CarbonylContact C-O 3.58Å; T114-N142 VanDerWaalsContact CA-O 3.28Å; T114-N142 WeakPolarHBondContact CA-O 3.49Å; T114-Y198 VanDerWaalsContact CB-OH 3.28Å; T114-Y198 WeakPolarHBondContact CB-OH 3.28Å; T114-Y198 PolarHBondContact O-OH 2.85Å; T114-Y198 PolarHBondContact OG1-OH 3.2Å
115	Y	95.7	Very high	95.2	Very high	24 Å²	24	48.7 Å²	48.7	9%	0.094	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-158.9	151.9	179.2	56.2	-88.2	0	0	0	111.8	Q88 D91 V113 R140 A141 N142 Y198	Q88-Y115 HydrophobicContact CG-CD1 4.19Å; Q88-Y115 HydrophobicContact CG-CD2 3.89Å; Q88-Y115 HydrophobicContact CG-CE1 3.88Å; Q88-Y115 HydrophobicContact CG-CE2 3.54Å; Q88-Y115 HydrophobicContact CG-CG 4.22Å; D91-Y115 HydrophobicContact CB-CE1 3.9Å; D91-Y115 PolarHBondContact OD2-OH 3.15Å; V113-Y115 HydrophobicContact CG1-CD1 4.25Å; V113-Y115 WeakPolarHBondContact O-CD1 3.23Å; V113-Y115 VanDerWaalsContact O-CE1 3.26Å; V113-Y115 WeakPolarHBondContact O-CE1 3.25Å; Y115-R140 HydrophobicContact CE2-CB 4.38Å; Y115-R140 WeakPolarHBondContact CE2-O 3.27Å; Y115-A141 VanDerWaalsContact CE2-CA 3.48Å; Y115-A141 WeakPolarHBondContact O-CA 3.45Å; Y115-N142 HydrophobicContact CD1-CB 4.03Å; Y115-N142 HydrophobicContact CE1-CB 3.55Å; Y115-N142 HydrophobicContact CE2-CB 4.49Å; Y115-N142 PolarHBondContact N-O 2.86Å; Y115-N142 PolarHBondContact O-N 2.03Å; Y115-Y198 WeakPolarHBondContact CA-OH 3.42Å; Y115-Y198 PolarHBondContact N-OH 2.87Å; Y115-Y198 VanDerWaalsContact N-OH 3.12Å
116	S	94.6	Very high	95.5	Very high	30 Å²	30	51 Å²	51	21%	0.21	31%	0.308	C	S	.	.			trans	-86.3	165	167.4	62.4	0	0	0	0	111.4	D118	S116-D118 PolarHBondContact O-N 2.93Å
117	A	94.4	Very high	95.6	Very high	2 Å²	2	49.3 Å²	49.3	2%	0.017	29%	0.294	C	S	.	.			trans	-57	134.6	169.5	0	0	0	0	0	111.4	L119 R140 V193 Q201	A117-L119 HydrophobicContact CB-CD1 4.13Å; A117-L119 HydrophobicContact CB-CG 4.01Å; A117-L119 PolarHBondContact O-N 2.62Å; A117-L119 VanDerWaalsContact O-N 3.11Å; A117-R140 VanDerWaalsContact CA-O 3.29Å; A117-R140 WeakPolarHBondContact CA-O 3.27Å; A117-V193 HydrophobicContact CB-CB 4.35Å; A117-V193 HydrophobicContact CB-CG1 4.08Å; A117-Q201 WeakPolarHBondContact O-CG 3.46Å
118	D	90.6	Very high	95.6	Very high	118 Å²	118	50.6 Å²	50.6	63%	0.631	30%	0.297	S	S	*	.			trans	-84.1	84	176.1	-173.4	9.9	0	0	0	110.1	S116 S120	S116-D118 PolarHBondContact O-N 2.93Å; D118-S120 PolarHBondContact OD1-OG 2.85Å
119	L	92.8	Very high	95.5	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.016	29%	0.291	C	S	.	.			trans	-109.6	23.7	-179	-64.3	179.6	0	0	0	112.9	A117 C137 D138 V193 Q201 S202 K203	A117-L119 HydrophobicContact CB-CD1 4.13Å; A117-L119 HydrophobicContact CB-CG 4.01Å; A117-L119 PolarHBondContact O-N 2.62Å; A117-L119 VanDerWaalsContact O-N 3.11Å; L119-C137 HydrophobicContact CD2-CB 3.75Å; L119-D138 VanDerWaalsContact CD2-O 3.3Å; L119-D138 WeakPolarHBondContact CD2-O 3.49Å; L119-V193 HydrophobicContact CD1-CB 3.6Å; L119-V193 HydrophobicContact CD1-CG2 3.39Å; L119-Q201 HydrophobicContact CB-CB 4.09Å; L119-Q201 HydrophobicContact CD1-CB 4.14Å; L119-Q201 HydrophobicContact CG-CB 4.41Å; L119-S202 CarbonylContact O-C 3.22Å; L119-K203 HydrophobicContact CB-CB 4Å; L119-K203 HydrophobicContact CD2-CB 4.16Å; L119-K203 VanDerWaalsContact O-CA 3.31Å; L119-K203 WeakPolarHBondContact O-CA 2.94Å; L119-K203 WeakPolarHBondContact O-CB 3.38Å; L119-K203 PolarHBondContact O-N 2.85Å
120	S	85.9	Confident	95.2	Very high	94 Å²	94	55.2 Å²	55.2	66%	0.657	31%	0.311	S	S	*	.			trans	-69.4	140.7	-176.9	62.6	0	0	0	0	113	D118	D118-S120 PolarHBondContact OD1-OG 2.85Å
121	G	90.5	Very high	95	Very high	53 Å²	53	57.1 Å²	57.1	55%	0.546	32%	0.317	S	S	.	.	S	Bend	trans	101.5	-170.7	167.6	0	0	0	0	0	116.3	T204	G121-T204 PolarHBondContact O-N 3.29Å
122	S	95.2	Very high	94.9	Very high	80 Å²	80	60 Å²	60	56%	0.559	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	136.8	-178	-177.9	0	0	0	0	109.6	T204	S122-T204 CarbonylContact C-O 3.39Å; S122-T204 VanDerWaalsContact CA-O 3.26Å; S122-T204 WeakPolarHBondContact CA-O 3.22Å
123	E	96.8	Very high	94.9	Very high	87 Å²	87	57.9 Å²	57.9	41%	0.407	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.5	-179.1	-175	171.1	170.9	0	0	109.9	V125 K203 T204 F205 Q206	E123-V125 HydrophobicContact CG-CG2 4.28Å; E123-K203 WeakPolarHBondContact OE2-CE 3.2Å; E123-K203 IonicContact OE2-NZ 3.34Å; E123-K203 PolarHBondContact OE2-NZ 3.36Å; E123-T204 PolarHBondContact N-O 2.81Å; E123-F205 HydrophobicContact CB-CD1 3.88Å; E123-F205 HydrophobicContact CB-CE1 4.32Å; E123-F205 HydrophobicContact CG-CD1 4.32Å; E123-F205 CarbonylContact O-C 3.54Å; E123-F205 VanDerWaalsContact O-CA 3.3Å; E123-F205 WeakPolarHBondContact O-CA 3.25Å; E123-F205 WeakPolarHBondContact OE2-CE1 3.18Å; E123-Q206 PolarHBondContact O-N 2.84Å
124	K	97.8	Very high	94.9	Very high	184 Å²	184	61.9 Å²	61.9	80%	0.8	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.2	174.7	-65.6	-176.3	-179.9	-178.4	0	108.9	Q206	K124-Q206 WeakPolarHBondContact CA-O 3.22Å; K124-Q206 HydrophobicContact CG-CB 4.31Å
125	V	97.8	Very high	94.9	Very high	26 Å²	26	60.1 Å²	60.1	16%	0.158	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.9	-178.9	179.8	0	0	0	0	107.6	E123 L127 L135 F205 Q206 V207 T208	E123-V125 HydrophobicContact CG-CG2 4.28Å; V125-L127 HydrophobicContact CG1-CD1 4.14Å; V125-L127 HydrophobicContact CG1-CD2 4.29Å; V125-L127 HydrophobicContact CG1-CG 3.97Å; V125-L135 HydrophobicContact CG2-CD2 3.99Å; V125-F205 HydrophobicContact CG2-CD1 4.43Å; V125-Q206 PolarHBondContact N-O 3.47Å; V125-V207 HydrophobicContact CB-CG2 4.15Å; V125-V207 CarbonylContact O-C 3.53Å; V125-V207 VanDerWaalsContact O-CA 3.3Å; V125-V207 WeakPolarHBondContact O-CA 3.41Å; V125-T208 PolarHBondContact O-N 2.8Å
126	T	97.3	Very high	94.9	Very high	91 Å²	91	62.7 Å²	62.7	56%	0.558	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.3	176.4	-55.1	0	0	0	0	108.4	T208 T210	T126-T208 WeakPolarHBondContact CA-O 3.3Å; T126-T210 HydrophobicContact CG2-CG2 3.77Å
127	L	96.7	Very high	95	Very high	24 Å²	24	61.3 Å²	61.3	13%	0.126	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.6	-177.9	-62.3	172.2	0	0	0	109.6	V125 E131 L133 V180 T208 V209 T210	V125-L127 HydrophobicContact CG1-CD1 4.14Å; V125-L127 HydrophobicContact CG1-CD2 4.29Å; V125-L127 HydrophobicContact CG1-CG 3.97Å; L127-E131 WeakPolarHBondContact CA-OE2 3.3Å; L127-L133 HydrophobicContact CD1-CB 3.98Å; L127-L133 HydrophobicContact CD1-CD1 3.59Å; L127-L133 HydrophobicContact CD1-CG 4.42Å; L127-V180 HydrophobicContact CD1-CG2 4Å; L127-T208 PolarHBondContact N-O 2.9Å; L127-V209 CarbonylContact O-C 3.51Å; L127-V209 WeakPolarHBondContact O-CA 3.12Å; L127-T210 PolarHBondContact O-N 2.81Å; L127-T210 PolarHBondContact O-OG1 2.75Å; L127-T210 VanDerWaalsContact O-OG1 3.07Å
128	E	95.7	Very high	95	Very high	47 Å²	47	63.2 Å²	63.2	22%	0.22	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	155.1	166.4	-65.4	-173.7	-169.3	0	0	110.7	E130 E131 T210 T213	E128-E130 PolarHBondContact O-N 3.48Å; E128-E131 HydrophobicContact CB-CG 3.98Å; E128-E131 PolarHBondContact N-OE2 2.87Å; E128-E131 WeakPolarHBondContact O-CB 3.16Å; E128-E131 PolarHBondContact O-N 3.13Å; E128-E131 VanDerWaalsContact O-N 3.15Å; E128-T210 CarbonylContact C-O 3.57Å; E128-T210 WeakPolarHBondContact CA-O 2.9Å; E128-T213 VanDerWaalsContact CD-OG1 3.29Å; E128-T213 WeakPolarHBondContact OE1-CB 2.92Å; E128-T213 WeakPolarHBondContact OE1-CG2 2.79Å; E128-T213 PolarHBondContact OE1-OG1 3.29Å; E128-T213 PolarHBondContact OE2-N 2.85Å; E128-T213 PolarHBondContact OE2-OG1 3.25Å; E128-T213 VanDerWaalsContact OE2-OG1 3.04Å
129	E	94.4	Very high	95.2	Very high	64 Å²	64	57.9 Å²	57.9	30%	0.299	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	142	169.7	-72.6	-170.8	154.9	0	0	111.6	E131 V209 T210 K212	E129-E131 PolarHBondContact O-N 2.69Å; E129-V209 HydrophobicContact CG-CG1 3.78Å; E129-T210 PolarHBondContact N-O 2.85Å; E129-K212 HydrophobicContact CB-CB 4.46Å
130	E	92.1	Very high	95.2	Very high	101 Å²	101	63 Å²	63	47%	0.472	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-2.3	-174	-46.7	-172	132.6	0	0	116.7	E128 V180 K212	E128-E130 PolarHBondContact O-N 3.48Å; E130-V180 PolarHBondContact N-O 3.08Å; E130-K212 IonicContact OE2-NZ 2.66Å; E130-K212 PolarHBondContact OE2-NZ 2.98Å
131	E	95.6	Very high	95.7	Very high	84 Å²	84	58.8 Å²	58.8	39%	0.393	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-69.3	168.8	168.5	-69.2	-168.9	145	0	0	111.7	L127 E128 E129 K179 V180	L127-E131 WeakPolarHBondContact CA-OE2 3.3Å; E128-E131 HydrophobicContact CB-CG 3.98Å; E128-E131 PolarHBondContact N-OE2 2.87Å; E128-E131 WeakPolarHBondContact O-CB 3.16Å; E128-E131 PolarHBondContact O-N 3.13Å; E128-E131 VanDerWaalsContact O-N 3.15Å; E129-E131 PolarHBondContact O-N 2.69Å; E131-K179 CarbonylContact O-C 3.54Å; E131-K179 WeakPolarHBondContact O-CA 3.46Å; E131-V180 WeakPolarHBondContact O-CB 3.41Å; E131-V180 VanDerWaalsContact O-CG2 3.28Å; E131-V180 WeakPolarHBondContact O-CG2 3.41Å; E131-V180 PolarHBondContact O-N 2.87Å
132	S	96.5	Very high	95.9	Very high	62 Å²	62	57.8 Å²	57.8	43%	0.434	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-93.6	129.6	175.8	58.3	0	0	0	0	111.5	A177	S132-A177 CarbonylContact C-O 3.56Å; S132-A177 VanDerWaalsContact CA-O 3.25Å; S132-A177 WeakPolarHBondContact CA-O 3.06Å
133	L	97.4	Very high	95.9	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	130	167.8	179.1	67.2	0	0	0	109.3	L127 L135 F164 Y176 A177 V180 Y189 V207	L127-L133 HydrophobicContact CD1-CB 3.98Å; L127-L133 HydrophobicContact CD1-CD1 3.59Å; L127-L133 HydrophobicContact CD1-CG 4.42Å; L133-L135 HydrophobicContact CD1-CD1 4.19Å; L133-L135 HydrophobicContact CD1-CD2 3.68Å; L133-L135 HydrophobicContact CD1-CG 3.71Å; L133-L135 HydrophobicContact CD2-CD1 4.42Å; L133-L135 HydrophobicContact CD2-CG 4.47Å; L133-L135 HydrophobicContact CG-CG 4.05Å; L133-F164 HydrophobicContact CD2-CE1 4.24Å; L133-Y176 CarbonylContact O-C 3.57Å; L133-Y176 VanDerWaalsContact O-CA 3.23Å; L133-Y176 WeakPolarHBondContact O-CA 3.13Å; L133-Y176 WeakPolarHBondContact O-CD2 3.31Å; L133-A177 HydrophobicContact CB-CB 4.14Å; L133-A177 PolarHBondContact N-O 2.81Å; L133-A177 PolarHBondContact O-N 3.17Å; L133-V180 HydrophobicContact CB-CG2 3.61Å; L133-Y189 HydrophobicContact CD2-CE1 4.29Å; L133-Y189 HydrophobicContact CD2-CE2 4.41Å; L133-V207 HydrophobicContact CD1-CG1 4.28Å; L133-V207 HydrophobicContact CD1-CG2 3.99Å
134	D	97.2	Very high	95.8	Very high	84 Å²	84	59 Å²	59	45%	0.449	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	102.7	170.1	-172.9	-9.9	0	0	0	108.4	K174 Y176	D134-K174 IonicContact OD2-NZ 3.59Å; D134-Y176 HydrophobicContact CB-CD2 4.28Å
135	L	97.6	Very high	95.6	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.1	175.6	-55.7	-178.3	0	0	0	109.1	V125 L133 W150 K174 L175 Y189 F205 V207	V125-L135 HydrophobicContact CG2-CD2 3.99Å; L133-L135 HydrophobicContact CD1-CD1 4.19Å; L133-L135 HydrophobicContact CD1-CD2 3.68Å; L133-L135 HydrophobicContact CD1-CG 3.71Å; L133-L135 HydrophobicContact CD2-CD1 4.42Å; L133-L135 HydrophobicContact CD2-CG 4.47Å; L133-L135 HydrophobicContact CG-CG 4.05Å; L135-W150 HydrophobicContact CB-CH2 3.65Å; L135-W150 HydrophobicContact CB-CZ3 3.84Å; L135-W150 HydrophobicContact CD1-CZ3 4.11Å; L135-K174 CarbonylContact O-C 3.52Å; L135-K174 WeakPolarHBondContact O-CA 3.43Å; L135-L175 HydrophobicContact CB-CB 4.41Å; L135-L175 HydrophobicContact CD1-CD2 4.37Å; L135-L175 PolarHBondContact N-O 3.28Å; L135-L175 PolarHBondContact O-N 3.44Å; L135-Y189 HydrophobicContact CD1-CD1 3.89Å; L135-Y189 HydrophobicContact CD1-CD2 3.86Å; L135-Y189 HydrophobicContact CD1-CE1 4.47Å; L135-Y189 HydrophobicContact CD1-CE2 4.46Å; L135-Y189 HydrophobicContact CD1-CG 3.52Å; L135-F205 HydrophobicContact CB-CD2 4.38Å; L135-F205 HydrophobicContact CB-CE2 4.37Å; L135-F205 HydrophobicContact CB-CG 4.47Å; L135-F205 HydrophobicContact CB-CZ 4.43Å; L135-F205 HydrophobicContact CD1-CB 3.98Å; L135-F205 HydrophobicContact CD1-CD2 4.11Å; L135-F205 HydrophobicContact CD1-CG 4.03Å; L135-F205 HydrophobicContact CD2-CB 4.06Å; L135-F205 HydrophobicContact CD2-CD1 3.82Å; L135-F205 HydrophobicContact CD2-CE1 4.42Å; L135-F205 HydrophobicContact CD2-CG 3.93Å; L135-F205 HydrophobicContact CG-CG 4.38Å; L135-V207 HydrophobicContact CD1-CG2 4.21Å; L135-V207 HydrophobicContact CD2-CG2 4.32Å
136	Q	96.3	Very high	95.4	Very high	79 Å²	79	55.2 Å²	55.2	37%	0.369	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.9	-176.4	-178.3	174.8	-26.2	0	0	112.3	N172 T173 K174 F205	Q136-N172 HydrophobicContact CG-CB 4.31Å; Q136-N172 VanDerWaalsContact NE2-CG 3.27Å; Q136-N172 PolarHBondContact NE2-OD1 2.65Å; Q136-T173 WeakPolarHBondContact CA-O 3.4Å; Q136-K174 HydrophobicContact CB-CG 4.25Å; Q136-K174 HydrophobicContact CG-CG 4.1Å; Q136-F205 WeakPolarHBondContact O-CZ 3.15Å
137	C	95.9	Very high	95.2	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.007	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.6	167.8	-65.7	0	0	0	0	111.2	L119 N172 T173 C191	L119-C137 HydrophobicContact CD2-CB 3.75Å; C137-N172 VanDerWaalsContact O-CA 3.25Å; C137-N172 WeakPolarHBondContact O-CA 3.35Å; C137-T173 HydrophobicContact CB-CG2 3.65Å; C137-T173 PolarHBondContact N-O 2.97Å; C137-T173 PolarHBondContact O-N 2.79Å; C137-C191 HydrophobicContact CB-CB 4.28Å; C137-C191 WeakPolarHBondContact CB-SG 3.31Å; C137-C191 WeakPolarHBondContact SG-CB 3.31Å; C137-C191 CovalentContact SG-SG 2.03Å; C137-C191 PolarHBondContact SG-SG 2.91Å
138	D	94.7	Very high	95.2	Very high	41 Å²	41	54.2 Å²	54.2	22%	0.219	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	113.4	167.3	-170.2	-20.5	0	0	0	109.1	L119 R140	L119-D138 VanDerWaalsContact CD2-O 3.3Å; L119-D138 WeakPolarHBondContact CD2-O 3.49Å; D138-R140 VanDerWaalsContact OD1-CB 3.22Å; D138-R140 WeakPolarHBondContact OD1-CB 3.4Å; D138-R140 WeakPolarHBondContact OD1-CG 3.16Å; D138-R140 IonicContact OD1-CZ 2.71Å; D138-R140 PolarHBondContact OD1-N 3Å; D138-R140 IonicContact OD1-NE 2.74Å; D138-R140 PolarHBondContact OD1-NE 2.83Å; D138-R140 IonicContact OD2-CZ 3.17Å; D138-R140 IonicContact OD2-NE 3.97Å; D138-R140 PolarHBondContact OD2-NE 3.01Å; D138-R140 IonicContact OD2-NH2 2.82Å; D138-R140 PolarHBondContact OD2-NH2 2.97Å
139	M	94.8	Very high	95.2	Very high	7 Å²	7	54.2 Å²	54.2	3%	0.034	29%	0.294	C	S	.	.			trans	-100.3	10.7	-178.6	68.2	167.8	76.6	0	0	113.1	A141 V148 N168 I171 T173 V193	M139-A141 PolarHBondContact O-N 2.9Å; M139-A141 VanDerWaalsContact O-N 3.1Å; M139-V148 HydrophobicContact CE-CB 4.31Å; M139-V148 HydrophobicContact CE-CG1 4.27Å; M139-V148 HydrophobicContact CE-CG2 3.53Å; M139-V148 HydrophobicContact SD-CG2 3.82Å; M139-N168 HydrophobicContact CE-CB 4.39Å; M139-N168 VanDerWaalsContact CE-ND2 3.27Å; M139-N168 WeakPolarHBondContact CE-ND2 3.34Å; M139-N168 WeakPolarHBondContact CE-OD1 3.34Å; M139-N168 PolarHBondContact SD-OD1 3.47Å; M139-N168 VanDerWaalsContact SD-OD1 3.41Å; M139-I171 VanDerWaalsContact CG-C 3.43Å; M139-I171 WeakPolarHBondContact CG-O 3.42Å; M139-I171 PolarHBondContact N-O 2.94Å; M139-T173 HydrophobicContact CE-CG2 3.83Å; M139-V193 HydrophobicContact CB-CG1 3.98Å; M139-V193 HydrophobicContact CB-CG2 3.9Å
140	R	94.2	Very high	95.3	Very high	111 Å²	111	51.7 Å²	51.7	42%	0.419	28%	0.282	S	S	.	.			trans	-57.6	119.1	179.3	-74.4	-178.3	-80.7	-175.2	-3.1	110.4	Y115 A117 D138 I171	Y115-R140 HydrophobicContact CE2-CB 4.38Å; Y115-R140 WeakPolarHBondContact CE2-O 3.27Å; A117-R140 VanDerWaalsContact CA-O 3.29Å; A117-R140 WeakPolarHBondContact CA-O 3.27Å; D138-R140 VanDerWaalsContact OD1-CB 3.22Å; D138-R140 WeakPolarHBondContact OD1-CB 3.4Å; D138-R140 WeakPolarHBondContact OD1-CG 3.16Å; D138-R140 IonicContact OD1-CZ 2.71Å; D138-R140 PolarHBondContact OD1-N 3Å; D138-R140 IonicContact OD1-NE 2.74Å; D138-R140 PolarHBondContact OD1-NE 2.83Å; D138-R140 IonicContact OD2-CZ 3.17Å; D138-R140 IonicContact OD2-NE 3.97Å; D138-R140 PolarHBondContact OD2-NE 3.01Å; D138-R140 IonicContact OD2-NH2 2.82Å; D138-R140 PolarHBondContact OD2-NH2 2.97Å; R140-I171 HydrophobicContact CG-CB 4.35Å; R140-I171 HydrophobicContact CG-CG2 3.53Å
141	A	95.1	Very high	95.6	Very high	5 Å²	5	49.4 Å²	49.4	4%	0.041	27%	0.271	C	S	.	.			trans	-142.5	151.1	175.8	0	0	0	0	0	109	Y115 M139 P143 L144	Y115-A141 VanDerWaalsContact CE2-CA 3.48Å; Y115-A141 WeakPolarHBondContact O-CA 3.45Å; M139-A141 PolarHBondContact O-N 2.9Å; M139-A141 VanDerWaalsContact O-N 3.1Å; A141-P143 CarbonylContact C-O 3.6Å; A141-P143 VanDerWaalsContact C-O 3.22Å; A141-P143 WeakPolarHBondContact CB-O 3.03Å; A141-P143 CarbonylContact O-C 3.58Å; A141-L144 WeakPolarHBondContact O-CA 3.33Å; A141-L144 PolarHBondContact O-N 3.19Å
142	N	96	Very high	95.7	Very high	32 Å²	32	46.4 Å²	46.4	17%	0.171	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-129.1	111	168	-177.3	12	0	0	0	108.4	D91 N112 V113 T114 Y115	D91-N142 PolarHBondContact OD1-ND2 3.3Å; D91-N142 PolarHBondContact OD2-ND2 2.88Å; N112-N142 PolarHBondContact OD1-ND2 2.99Å; V113-N142 WeakPolarHBondContact O-CB 3.26Å; V113-N142 PolarHBondContact O-ND2 2.98Å; T114-N142 CarbonylContact C-O 3.58Å; T114-N142 VanDerWaalsContact CA-O 3.28Å; T114-N142 WeakPolarHBondContact CA-O 3.49Å; Y115-N142 HydrophobicContact CD1-CB 4.03Å; Y115-N142 HydrophobicContact CE1-CB 3.55Å; Y115-N142 HydrophobicContact CE2-CB 4.49Å; Y115-N142 PolarHBondContact N-O 2.86Å; Y115-N142 PolarHBondContact O-N 2.03Å
143	P	95	Very high	95.7	Very high	55 Å²	55	48.4 Å²	48.4	36%	0.357	26%	0.264	S	S	.	.	S	Bend	cis	-65.9	158.4	3.9	-21.2	34.2	0	0	0	114.4	A141 P196	A141-P143 CarbonylContact C-O 3.6Å; A141-P143 VanDerWaalsContact C-O 3.22Å; A141-P143 WeakPolarHBondContact CB-O 3.03Å; A141-P143 CarbonylContact O-C 3.58Å; P143-P196 HydrophobicContact CB-CB 4.3Å; P143-P196 HydrophobicContact CB-CG 4.19Å; P143-P196 HydrophobicContact CG-CB 4.4Å
144	L	93.8	Very high	95.6	Very high	137 Å²	137	51.1 Å²	51.1	72%	0.717	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-53.1	142.8	-177.7	-67.6	174.9	0	0	0	112.4	A141 P196	A141-L144 WeakPolarHBondContact O-CA 3.33Å; A141-L144 PolarHBondContact O-N 3.19Å; L144-P196 VanDerWaalsContact O-CD 3.22Å; L144-P196 WeakPolarHBondContact O-CD 3.3Å
145	A	94.3	Very high	95.5	Very high	31 Å²	31	51.7 Å²	51.7	26%	0.256	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-59.4	137.1	175.9	0	0	0	0	0	111.3	V193 T194	A145-V193 HydrophobicContact CB-CG1 3.6Å; A145-T194 CarbonylContact C-O 3.59Å; A145-T194 WeakPolarHBondContact CA-O 3.41Å
146	T	93.4	Very high	95.4	Very high	100 Å²	100	57.3 Å²	57.3	61%	0.613	33%	0.328	S	S	*	.			trans	-99.8	-26.4	-177.5	49.3	0	0	0	0	112.9	T194 P196	T146-T194 PolarHBondContact N-O 2.83Å; T146-T194 PolarHBondContact OG1-O 3.28Å; T146-P196 HydrophobicContact CG2-CG 3.78Å
147	S	93.2	Very high	95.4	Very high	55 Å²	55	54.3 Å²	54.3	39%	0.385	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	151.2	177.8	67.8	0	0	0	0	112.4	T194	S147-T194 PolarHBondContact N-O 3.14Å; S147-T194 PolarHBondContact O-N 3.21Å; S147-T194 WeakPolarHBondContact OG-CB 3.42Å
148	V	95.6	Very high	95.1	Very high	38 Å²	38	57.8 Å²	57.8	23%	0.23	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	133.2	177.5	179.1	0	0	0	0	109.2	M139 T173 T192 V193	M139-V148 HydrophobicContact CE-CB 4.31Å; M139-V148 HydrophobicContact CE-CG1 4.27Å; M139-V148 HydrophobicContact CE-CG2 3.53Å; M139-V148 HydrophobicContact SD-CG2 3.82Å; V148-T173 HydrophobicContact CG1-CG2 3.54Å; V148-T192 CarbonylContact C-O 3.53Å; V148-T192 WeakPolarHBondContact CA-O 3.47Å; V148-V193 HydrophobicContact CB-CG2 4.49Å; V148-V193 HydrophobicContact CG1-CG2 4.15Å; V148-V193 HydrophobicContact CG2-CB 4.45Å; V148-V193 HydrophobicContact CG2-CG1 4.26Å; V148-V193 HydrophobicContact CG2-CG2 3.84Å
149	T	95.9	Very high	94.8	Very high	48 Å²	48	60.2 Å²	60.2	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.6	-176.4	-57.1	0	0	0	0	110.2	Q151 L156 C191 T192	T149-Q151 HydrophobicContact CG2-CG 4.25Å; T149-L156 HydrophobicContact CG2-CD2 3.24Å; T149-C191 WeakPolarHBondContact O-CA 3.43Å; T149-T192 PolarHBondContact N-O 3.01Å; T149-T192 PolarHBondContact O-N 3.26Å
150	W	97.7	Very high	94.3	Very high	11 Å²	11	64.5 Å²	64.5	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.8	169.7	-74.9	91.5	0	0	0	110.3	L135 V157 I166 T173 L175 Q190 C191 F205	L135-W150 HydrophobicContact CB-CH2 3.65Å; L135-W150 HydrophobicContact CB-CZ3 3.84Å; L135-W150 HydrophobicContact CD1-CZ3 4.11Å; W150-V157 HydrophobicContact CB-CB 4.45Å; W150-V157 HydrophobicContact CB-CG2 3.9Å; W150-V157 PolarHBondContact O-N 3.44Å; W150-V157 VanDerWaalsContact O-N 3.14Å; W150-I166 HydrophobicContact CB-CD1 4.04Å; W150-I166 HydrophobicContact CG-CD1 4.18Å; W150-T173 HydrophobicContact CZ2-CG2 3.84Å; W150-T173 PolarHBondContact NE1-OG1 2.91Å; W150-L175 HydrophobicContact CD2-CB 3.76Å; W150-L175 HydrophobicContact CD2-CD2 4.28Å; W150-L175 HydrophobicContact CD2-CG 4.49Å; W150-L175 HydrophobicContact CE3-CB 3.81Å; W150-L175 HydrophobicContact CE3-CD2 3.81Å; W150-L175 HydrophobicContact CE3-CG 4.4Å; W150-L175 HydrophobicContact CG-CB 4.37Å; W150-L175 HydrophobicContact CH2-CB 4Å; W150-L175 HydrophobicContact CZ2-CB 3.95Å; W150-L175 HydrophobicContact CZ3-CB 3.93Å; W150-L175 HydrophobicContact CZ3-CD2 4.25Å; W150-Q190 CarbonylContact C-O 3.52Å; W150-Q190 WeakPolarHBondContact CA-O 3.37Å; W150-C191 HydrophobicContact CD2-CB 3.96Å; W150-C191 HydrophobicContact CE3-CB 3.78Å; W150-C191 HydrophobicContact CH2-CB 3.72Å; W150-C191 HydrophobicContact CZ2-CB 3.89Å; W150-C191 HydrophobicContact CZ3-CB 3.67Å; W150-F205 HydrophobicContact CH2-CD2 4.42Å; W150-F205 AromaticContact CH2-CE2 3.8Å; W150-F205 HydrophobicContact CH2-CE2 3.8Å; W150-F205 HydrophobicContact CH2-CZ 4.43Å; W150-F205 HydrophobicContact CZ3-CD2 4.04Å; W150-F205 AromaticContact CZ3-CE2 3.84Å; W150-F205 HydrophobicContact CZ3-CE2 3.84Å
151	Q	97.8	Very high	93.6	Very high	53 Å²	53	63.6 Å²	63.6	25%	0.248	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.7	174.2	-67.9	177.7	-7.7	0	0	110.3	T149 T155 L156 Y189 Q190	T149-Q151 HydrophobicContact CG2-CG 4.25Å; Q151-T155 CarbonylContact C-O 3.58Å; Q151-T155 WeakPolarHBondContact CA-O 3.29Å; Q151-T155 VanDerWaalsContact CB-O 3.3Å; Q151-T155 WeakPolarHBondContact CB-O 3.4Å; Q151-L156 HydrophobicContact CG-CD2 4.15Å; Q151-Y189 CarbonylContact O-C 3.49Å; Q151-Y189 VanDerWaalsContact O-CA 3.23Å; Q151-Y189 WeakPolarHBondContact O-CA 3.29Å; Q151-Q190 PolarHBondContact N-O 3.02Å; Q151-Q190 PolarHBondContact O-N 2.99Å
152	L	97.3	Very high	92.8	Very high	20 Å²	20	63.9 Å²	63.9	11%	0.105	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.1	169	171.4	55.8	0	0	0	107.4	G154 T155 V157 F164 Y189	L152-G154 PolarHBondContact O-N 3.11Å; L152-G154 VanDerWaalsContact O-N 3.13Å; L152-T155 PolarHBondContact N-O 3.18Å; L152-T155 PolarHBondContact O-N 3.4Å; L152-T155 VanDerWaalsContact O-N 3.08Å; L152-T155 PolarHBondContact O-OG1 2.77Å; L152-V157 HydrophobicContact CB-CG2 4.04Å; L152-F164 HydrophobicContact CD2-CZ 4.14Å; L152-Y189 HydrophobicContact CB-CD1 4.23Å; L152-Y189 HydrophobicContact CB-CE1 4.12Å; L152-Y189 HydrophobicContact CD1-CD1 4.12Å; L152-Y189 HydrophobicContact CD1-CD2 3.96Å; L152-Y189 HydrophobicContact CD1-CE1 3.84Å; L152-Y189 HydrophobicContact CD1-CE2 3.64Å; L152-Y189 HydrophobicContact CD1-CG 4.2Å; L152-Y189 HydrophobicContact CD2-CE1 4.12Å; L152-Y189 HydrophobicContact CG-CE1 4.25Å
153	N	96.5	Very high	92.6	Very high	104 Å²	104	64.9 Å²	64.9	56%	0.556	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	33.4	-179.3	-59.6	-34.3	0	0	0	113.6	T155 G187 S188	N153-T155 VanDerWaalsContact C-N 3.32Å; N153-T155 PolarHBondContact O-N 2.69Å; N153-G187 WeakPolarHBondContact OD1-CA 3.1Å; N153-S188 PolarHBondContact N-O 3.38Å; N153-S188 PolarHBondContact OD1-N 2.92Å
154	G	95.6	Very high	92.6	Very high	58 Å²	58	63 Å²	63	60%	0.598	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-3.9	178.3	0	0	0	0	0	115.3	L152	L152-G154 PolarHBondContact O-N 3.11Å; L152-G154 VanDerWaalsContact O-N 3.13Å
155	T	95.3	Very high	92.7	Very high	97 Å²	97	60.9 Å²	60.9	60%	0.595	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	152.1	171.8	54.9	0	0	0	0	110.4	Q151 L152 N153 V157	Q151-T155 CarbonylContact C-O 3.58Å; Q151-T155 WeakPolarHBondContact CA-O 3.29Å; Q151-T155 VanDerWaalsContact CB-O 3.3Å; Q151-T155 WeakPolarHBondContact CB-O 3.4Å; L152-T155 PolarHBondContact N-O 3.18Å; L152-T155 PolarHBondContact O-N 3.4Å; L152-T155 VanDerWaalsContact O-N 3.08Å; L152-T155 PolarHBondContact O-OG1 2.77Å; N153-T155 VanDerWaalsContact C-N 3.32Å; N153-T155 PolarHBondContact O-N 2.69Å; T155-V157 PolarHBondContact O-N 3.02Å
156	L	95.7	Very high	92.8	Very high	120 Å²	120	62.6 Å²	62.6	63%	0.628	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	138.4	174.1	-67.5	173.9	0	0	0	109.7	T149 Q151 D158	T149-L156 HydrophobicContact CG2-CD2 3.24Å; Q151-L156 HydrophobicContact CG-CD2 4.15Å; L156-D158 PolarHBondContact O-N 2.99Å
157	V	94.9	Very high	92.9	Very high	17 Å²	17	61.4 Å²	61.4	10%	0.103	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-60.9	122.2	176.6	175	0	0	0	0	109.4	W150 L152 T155 L159 F164 L175	W150-V157 HydrophobicContact CB-CB 4.45Å; W150-V157 HydrophobicContact CB-CG2 3.9Å; W150-V157 PolarHBondContact O-N 3.44Å; W150-V157 VanDerWaalsContact O-N 3.14Å; L152-V157 HydrophobicContact CB-CG2 4.04Å; T155-V157 PolarHBondContact O-N 3.02Å; V157-L159 HydrophobicContact CG1-CD2 4.27Å; V157-L159 PolarHBondContact O-N 3.38Å; V157-F164 HydrophobicContact CG1-CB 3.91Å; V157-F164 HydrophobicContact CG1-CD1 4.18Å; V157-F164 HydrophobicContact CG1-CD2 3.52Å; V157-F164 HydrophobicContact CG1-CE2 4.02Å; V157-F164 HydrophobicContact CG1-CG 3.61Å; V157-L175 HydrophobicContact CG1-CD1 3.98Å; V157-L175 HydrophobicContact CG2-CD1 4.5Å; V157-L175 HydrophobicContact CG2-CD2 4.16Å
158	D	89.6	Confident	92.9	Very high	74 Å²	74	63.2 Å²	63.2	40%	0.396	38%	0.381	S	S	.	.			trans	-84.3	108.7	175.1	-178	1.9	0	0	0	110.2	L156 S160 T161 F164	L156-D158 PolarHBondContact O-N 2.99Å; D158-S160 VanDerWaalsContact CG-OG 3.28Å; D158-S160 PolarHBondContact O-N 3.46Å; D158-S160 WeakPolarHBondContact OD1-CB 3.34Å; D158-S160 PolarHBondContact OD1-N 2.85Å; D158-S160 PolarHBondContact OD1-OG 3.41Å; D158-S160 PolarHBondContact OD2-OG 3.2Å; D158-T161 WeakPolarHBondContact CB-OG1 3.19Å; D158-T161 WeakPolarHBondContact OD2-CB 3.38Å; D158-T161 VanDerWaalsContact OD2-CG2 3.31Å; D158-T161 WeakPolarHBondContact OD2-CG2 3.49Å; D158-T161 PolarHBondContact OD2-OG1 2.84Å; D158-F164 WeakPolarHBondContact O-CD2 3.41Å
159	L	90	Very high	92.7	Very high	92 Å²	92	66.5 Å²	66.5	48%	0.482	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-14.7	179.3	-56.8	-179	0	0	0	113.2	V157 F164 I166	V157-L159 HydrophobicContact CG1-CD2 4.27Å; V157-L159 PolarHBondContact O-N 3.38Å; L159-F164 HydrophobicContact CD2-CB 3.79Å; L159-I166 HydrophobicContact CD2-CD1 3.86Å; L159-I166 HydrophobicContact CD2-CG1 3.95Å
160	S	84.2	Confident	92.2	Very high	97 Å²	97	66.4 Å²	66.4	68%	0.678	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-34.2	-176	71.9	0	0	0	0	113.8	D158	D158-S160 VanDerWaalsContact CG-OG 3.28Å; D158-S160 PolarHBondContact O-N 3.46Å; D158-S160 WeakPolarHBondContact OD1-CB 3.34Å; D158-S160 PolarHBondContact OD1-N 2.85Å; D158-S160 PolarHBondContact OD1-OG 3.41Å; D158-S160 PolarHBondContact OD2-OG 3.2Å
161	T	78	Confident	91.8	Very high	92 Å²	92	69.8 Å²	69.8	56%	0.564	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-6.1	-169.3	52	0	0	0	0	114.9	D158	D158-T161 WeakPolarHBondContact CB-OG1 3.19Å; D158-T161 WeakPolarHBondContact OD2-CB 3.38Å; D158-T161 VanDerWaalsContact OD2-CG2 3.31Å; D158-T161 WeakPolarHBondContact OD2-CG2 3.49Å; D158-T161 PolarHBondContact OD2-OG1 2.84Å
162	G	78.8	Confident	91.6	Very high	10 Å²	10	68.8 Å²	68.8	10%	0.103	42%	0.42	C	S	.	.	S	Bend	trans	-126.8	4.7	179.8	0	0	0	0	0	115.9	F164 H185	G162-F164 PolarHBondContact O-N 3.42Å; G162-F164 VanDerWaalsContact O-N 3.14Å; G162-H185 PolarHBondContact O-NE2 2.84Å
163	G	91	Very high	91.6	Very high	53 Å²	53	67.9 Å²	67.9	55%	0.546	42%	0.416	S	S	.	.			trans	61.4	23.4	-177.2	0	0	0	0	0	113.8
164	F	96.1	Very high	91.6	Very high	16 Å²	16	66 Å²	66	7%	0.07	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	143.3	176.6	-67.4	-74.3	0	0	0	111.1	L133 L152 V157 D158 L159 G162 L175 Y176 A177 H185 Y189	L133-F164 HydrophobicContact CD2-CE1 4.24Å; L152-F164 HydrophobicContact CD2-CZ 4.14Å; V157-F164 HydrophobicContact CG1-CB 3.91Å; V157-F164 HydrophobicContact CG1-CD1 4.18Å; V157-F164 HydrophobicContact CG1-CD2 3.52Å; V157-F164 HydrophobicContact CG1-CE2 4.02Å; V157-F164 HydrophobicContact CG1-CG 3.61Å; D158-F164 WeakPolarHBondContact O-CD2 3.41Å; L159-F164 HydrophobicContact CD2-CB 3.79Å; G162-F164 PolarHBondContact O-N 3.42Å; G162-F164 VanDerWaalsContact O-N 3.14Å; F164-L175 HydrophobicContact CB-CD1 4.09Å; F164-L175 HydrophobicContact CD1-CD1 3.93Å; F164-L175 HydrophobicContact CD1-CD2 4.29Å; F164-L175 HydrophobicContact CD1-CG 4.13Å; F164-L175 HydrophobicContact CE1-CD2 4.4Å; F164-L175 HydrophobicContact CG-CD1 4.29Å; F164-Y176 CarbonylContact C-O 3.51Å; F164-Y176 WeakPolarHBondContact CA-O 3.31Å; F164-A177 HydrophobicContact CD1-CB 4.1Å; F164-A177 HydrophobicContact CE1-CB 4.31Å; F164-H185 AromaticContact CE1-CD2 3.5Å; F164-H185 AromaticContact CZ-CD2 3.43Å; F164-H185 VanDerWaalsContact CZ-CD2 3.43Å; F164-H185 WeakPolarHBondContact CZ-CD2 3.26Å; F164-Y189 AromaticContact CE1-CE1 3.94Å; F164-Y189 HydrophobicContact CE1-CE1 3.94Å; F164-Y189 HydrophobicContact CZ-CE1 4.23Å
165	I	95.9	Very high	91.7	Very high	93 Å²	93	63.2 Å²	63.2	48%	0.477	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.5	173	-60	173.5	0	0	0	107.3	T167 Y176	I165-T167 HydrophobicContact CG2-CG2 4.21Å; I165-Y176 HydrophobicContact CB-CD1 4.43Å; I165-Y176 HydrophobicContact CD1-CD1 4.25Å; I165-Y176 PolarHBondContact N-O 2.9Å; I165-Y176 PolarHBondContact O-N 3.46Å
166	I	96.4	Very high	91.8	Very high	67 Å²	67	62.1 Å²	62.1	34%	0.344	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.8	172.2	-64	172.3	0	0	0	108.7	W150 L159 K174 L175	W150-I166 HydrophobicContact CB-CD1 4.04Å; W150-I166 HydrophobicContact CG-CD1 4.18Å; L159-I166 HydrophobicContact CD2-CD1 3.86Å; L159-I166 HydrophobicContact CD2-CG1 3.95Å; I166-K174 VanDerWaalsContact CA-O 3.26Å; I166-K174 WeakPolarHBondContact CA-O 3.45Å; I166-L175 HydrophobicContact CD1-CD1 3.96Å; I166-L175 HydrophobicContact CG1-CD1 3.42Å; I166-L175 VanDerWaalsContact CG1-CD1 3.42Å
167	T	95.6	Very high	91.8	Very high	74 Å²	74	56.5 Å²	56.5	45%	0.454	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145	171.2	59.3	0	0	0	0	110.3	I165 T173 K174	I165-T167 HydrophobicContact CG2-CG2 4.21Å; T167-T173 CarbonylContact O-C 3.56Å; T167-T173 VanDerWaalsContact O-CA 3.25Å; T167-T173 WeakPolarHBondContact O-CA 3.23Å; T167-T173 PolarHBondContact O-OG1 2.61Å; T167-K174 PolarHBondContact N-O 3.1Å; T167-K174 PolarHBondContact O-N 3.27Å
168	N	94	Very high	91.9	Very high	93 Å²	93	63 Å²	63	50%	0.497	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	122	176.2	-176.4	-13.8	0	0	0	108.6	M139 G170 N172	M139-N168 HydrophobicContact CE-CB 4.39Å; M139-N168 VanDerWaalsContact CE-ND2 3.27Å; M139-N168 WeakPolarHBondContact CE-ND2 3.34Å; M139-N168 WeakPolarHBondContact CE-OD1 3.34Å; M139-N168 PolarHBondContact SD-OD1 3.47Å; M139-N168 VanDerWaalsContact SD-OD1 3.41Å; N168-G170 PolarHBondContact OD1-N 2.75Å; N168-N172 WeakPolarHBondContact CA-O 3.44Å
169	D	90.9	Very high	92.1	Very high	108 Å²	108	65.9 Å²	65.9	58%	0.578	37%	0.366	S	S	*	.			trans	-105.8	8.8	178.9	67.1	12	0	0	0	113.3	I171 N172	D169-I171 VanDerWaalsContact C-N 3.26Å; D169-I171 PolarHBondContact O-N 3.27Å; D169-I171 WeakPolarHBondContact OD1-CA 3.36Å; D169-I171 WeakPolarHBondContact OD1-CB 3.37Å; D169-I171 PolarHBondContact OD1-N 3.1Å; D169-N172 PolarHBondContact N-O 2.88Å; D169-N172 VanDerWaalsContact N-O 3.17Å; D169-N172 PolarHBondContact OD1-N 3.23Å
170	G	85.6	Confident	92.3	Very high	45 Å²	45	61.8 Å²	61.8	46%	0.464	35%	0.345	S	S	.	.	S	Bend	trans	84.7	-10.8	-176.1	0	0	0	0	0	114.5	N168	N168-G170 PolarHBondContact OD1-N 2.75Å
171	I	89	Confident	92.8	Very high	83 Å²	83	60.1 Å²	60.1	43%	0.426	33%	0.328	S	S	.	.	S	Bend	trans	-117.9	-39.4	179	-61.1	-179.2	0	0	0	110	M139 R140 D169	M139-I171 VanDerWaalsContact CG-C 3.43Å; M139-I171 WeakPolarHBondContact CG-O 3.42Å; M139-I171 PolarHBondContact N-O 2.94Å; R140-I171 HydrophobicContact CG-CB 4.35Å; R140-I171 HydrophobicContact CG-CG2 3.53Å; D169-I171 VanDerWaalsContact C-N 3.26Å; D169-I171 PolarHBondContact O-N 3.27Å; D169-I171 WeakPolarHBondContact OD1-CA 3.36Å; D169-I171 WeakPolarHBondContact OD1-CB 3.37Å; D169-I171 PolarHBondContact OD1-N 3.1Å
172	N	94.1	Very high	93.7	Very high	31 Å²	31	60 Å²	60	17%	0.166	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143.1	-179.8	-61.6	-83.2	0	0	0	110.4	Q136 C137 N168 D169	Q136-N172 HydrophobicContact CG-CB 4.31Å; Q136-N172 VanDerWaalsContact NE2-CG 3.27Å; Q136-N172 PolarHBondContact NE2-OD1 2.65Å; C137-N172 VanDerWaalsContact O-CA 3.25Å; C137-N172 WeakPolarHBondContact O-CA 3.35Å; N168-N172 WeakPolarHBondContact CA-O 3.44Å; D169-N172 PolarHBondContact N-O 2.88Å; D169-N172 VanDerWaalsContact N-O 3.17Å; D169-N172 PolarHBondContact OD1-N 3.23Å
173	T	96.4	Very high	94.4	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	142.6	160.8	-177.2	0	0	0	0	109.5	Q136 C137 M139 V148 W150 T167	Q136-T173 WeakPolarHBondContact CA-O 3.4Å; C137-T173 HydrophobicContact CB-CG2 3.65Å; C137-T173 PolarHBondContact N-O 2.97Å; C137-T173 PolarHBondContact O-N 2.79Å; M139-T173 HydrophobicContact CE-CG2 3.83Å; V148-T173 HydrophobicContact CG1-CG2 3.54Å; W150-T173 HydrophobicContact CZ2-CG2 3.84Å; W150-T173 PolarHBondContact NE1-OG1 2.91Å; T167-T173 CarbonylContact O-C 3.56Å; T167-T173 VanDerWaalsContact O-CA 3.25Å; T167-T173 WeakPolarHBondContact O-CA 3.23Å; T167-T173 PolarHBondContact O-OG1 2.61Å
174	K	97.1	Very high	94.5	Very high	64 Å²	64	65.9 Å²	65.9	28%	0.278	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.5	173.3	-55.4	-173.6	173.2	-149.8	0	110.6	D134 L135 Q136 I166 T167	D134-K174 IonicContact OD2-NZ 3.59Å; L135-K174 CarbonylContact O-C 3.52Å; L135-K174 WeakPolarHBondContact O-CA 3.43Å; Q136-K174 HydrophobicContact CB-CG 4.25Å; Q136-K174 HydrophobicContact CG-CG 4.1Å; I166-K174 VanDerWaalsContact CA-O 3.26Å; I166-K174 WeakPolarHBondContact CA-O 3.45Å; T167-K174 PolarHBondContact N-O 3.1Å; T167-K174 PolarHBondContact O-N 3.27Å
175	L	97.5	Very high	94.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.8	165.8	179.8	73.9	0	0	0	108.2	L135 W150 V157 F164 I166 Y189	L135-L175 HydrophobicContact CB-CB 4.41Å; L135-L175 HydrophobicContact CD1-CD2 4.37Å; L135-L175 PolarHBondContact N-O 3.28Å; L135-L175 PolarHBondContact O-N 3.44Å; W150-L175 HydrophobicContact CD2-CB 3.76Å; W150-L175 HydrophobicContact CD2-CD2 4.28Å; W150-L175 HydrophobicContact CD2-CG 4.49Å; W150-L175 HydrophobicContact CE3-CB 3.81Å; W150-L175 HydrophobicContact CE3-CD2 3.81Å; W150-L175 HydrophobicContact CE3-CG 4.4Å; W150-L175 HydrophobicContact CG-CB 4.37Å; W150-L175 HydrophobicContact CH2-CB 4Å; W150-L175 HydrophobicContact CZ2-CB 3.95Å; W150-L175 HydrophobicContact CZ3-CB 3.93Å; W150-L175 HydrophobicContact CZ3-CD2 4.25Å; V157-L175 HydrophobicContact CG1-CD1 3.98Å; V157-L175 HydrophobicContact CG2-CD1 4.5Å; V157-L175 HydrophobicContact CG2-CD2 4.16Å; F164-L175 HydrophobicContact CB-CD1 4.09Å; F164-L175 HydrophobicContact CD1-CD1 3.93Å; F164-L175 HydrophobicContact CD1-CD2 4.29Å; F164-L175 HydrophobicContact CD1-CG 4.13Å; F164-L175 HydrophobicContact CE1-CD2 4.4Å; F164-L175 HydrophobicContact CG-CD1 4.29Å; I166-L175 HydrophobicContact CD1-CD1 3.96Å; I166-L175 HydrophobicContact CG1-CD1 3.42Å; I166-L175 VanDerWaalsContact CG1-CD1 3.42Å; L175-Y189 HydrophobicContact CD2-CD1 3.33Å; L175-Y189 HydrophobicContact CD2-CE1 3.45Å; L175-Y189 VanDerWaalsContact CD2-CE1 3.45Å; L175-Y189 HydrophobicContact CD2-CG 4.45Å
176	Y	97.3	Very high	94.6	Very high	74 Å²	74	64.5 Å²	64.5	29%	0.29	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.9	-174	175.6	-95.4	0	0	0	111.8	L133 D134 F164 I165 K178	L133-Y176 CarbonylContact O-C 3.57Å; L133-Y176 VanDerWaalsContact O-CA 3.23Å; L133-Y176 WeakPolarHBondContact O-CA 3.13Å; L133-Y176 WeakPolarHBondContact O-CD2 3.31Å; D134-Y176 HydrophobicContact CB-CD2 4.28Å; F164-Y176 CarbonylContact C-O 3.51Å; F164-Y176 WeakPolarHBondContact CA-O 3.31Å; I165-Y176 HydrophobicContact CB-CD1 4.43Å; I165-Y176 HydrophobicContact CD1-CD1 4.25Å; I165-Y176 PolarHBondContact N-O 2.9Å; I165-Y176 PolarHBondContact O-N 3.46Å; Y176-K178 HydrophobicContact CE1-CB 3.86Å
177	A	96.6	Very high	94.6	Very high	1 Å²	1	62 Å²	62	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.5	166.1	0	0	0	0	0	109.6	S132 L133 F164	S132-A177 CarbonylContact C-O 3.56Å; S132-A177 VanDerWaalsContact CA-O 3.25Å; S132-A177 WeakPolarHBondContact CA-O 3.06Å; L133-A177 HydrophobicContact CB-CB 4.14Å; L133-A177 PolarHBondContact N-O 2.81Å; L133-A177 PolarHBondContact O-N 3.17Å; F164-A177 HydrophobicContact CD1-CB 4.1Å; F164-A177 HydrophobicContact CE1-CB 4.31Å
178	K	95.2	Very high	94.8	Very high	155 Å²	155	60.2 Å²	60.2	67%	0.674	32%	0.315	S	S	*	.	S	Bend	trans	-71.8	-35.3	-171.2	-175.1	174.2	-179.4	177.2	0	114	Y176	Y176-K178 HydrophobicContact CE1-CB 3.86Å
179	K	93.9	Very high	94.9	Very high	134 Å²	134	55.8 Å²	55.8	58%	0.583	29%	0.291	S	S	*	.	S	Bend	trans	-136.4	106.4	-178.6	-72.9	-169.8	173.5	-164	0	108.4	E131	E131-K179 CarbonylContact O-C 3.54Å; E131-K179 WeakPolarHBondContact O-CA 3.46Å
180	V	95.4	Very high	95.3	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.03	28%	0.277	C	S	.	.			trans	-73.1	135.9	-179.7	171	0	0	0	0	110	L127 E130 E131 L133 H185 V209	L127-V180 HydrophobicContact CD1-CG2 4Å; E130-V180 PolarHBondContact N-O 3.08Å; E131-V180 WeakPolarHBondContact O-CB 3.41Å; E131-V180 VanDerWaalsContact O-CG2 3.28Å; E131-V180 WeakPolarHBondContact O-CG2 3.41Å; E131-V180 PolarHBondContact O-N 2.87Å; L133-V180 HydrophobicContact CB-CG2 3.61Å; V180-H185 HydrophobicContact CG1-CB 3.97Å; V180-V209 HydrophobicContact CG1-CB 4.26Å; V180-V209 HydrophobicContact CG1-CG1 3.77Å; V180-V209 HydrophobicContact CG1-CG2 3.41Å; V180-V209 VanDerWaalsContact CG1-CG2 3.41Å
181	D	94.9	Very high	95.8	Very high	62 Å²	62	51.4 Å²	51.4	33%	0.332	26%	0.255	S	S	.	.			trans	-124.3	129.9	174.6	173.4	-80.2	0	0	0	107.5	S183 L184 H185	D181-S183 VanDerWaalsContact C-N 3.3Å; D181-S183 PolarHBondContact O-N 2.88Å; D181-S183 WeakPolarHBondContact OD1-CA 3.42Å; D181-S183 WeakPolarHBondContact OD1-CB 3.4Å; D181-S183 PolarHBondContact OD1-N 2.9Å; D181-S183 PolarHBondContact OD1-OG 3.1Å; D181-L184 HydrophobicContact CB-CB 4.4Å; D181-L184 HydrophobicContact CB-CD1 4.44Å; D181-L184 PolarHBondContact O-N 3.48Å; D181-L184 PolarHBondContact OD1-N 3.24Å; D181-L184 VanDerWaalsContact OD1-N 3.12Å; D181-H185 PolarHBondContact N-ND1 2.87Å; D181-H185 VanDerWaalsContact O-CB 3.32Å; D181-H185 WeakPolarHBondContact O-CB 3.22Å; D181-H185 PolarHBondContact O-N 2.81Å; D181-H185 PolarHBondContact O-ND1 2.92Å
182	R	95.5	Very high	96.2	Very high	90 Å²	90	48.7 Å²	48.7	34%	0.34	24%	0.242	S	C	.	.	H	α-helix	trans	-57.5	-41.7	-175.8	179.4	-177.9	-73.4	145.5	3.9	112.5	L184 E186 V209 D211	R182-L184 VanDerWaalsContact C-N 3.32Å; R182-L184 PolarHBondContact O-N 3.01Å; R182-E186 HydrophobicContact CG-CB 4.37Å; R182-E186 WeakPolarHBondContact O-CB 3.44Å; R182-E186 PolarHBondContact O-N 3.42Å; R182-V209 HydrophobicContact CB-CB 3.99Å; R182-V209 HydrophobicContact CB-CG1 4.01Å; R182-V209 HydrophobicContact CG-CB 4.24Å; R182-V209 PolarHBondContact NE-O 3.26Å; R182-V209 PolarHBondContact NH2-O 2.94Å; R182-D211 IonicContact CZ-OD1 2.75Å; R182-D211 IonicContact NH1-OD1 3.97Å; R182-D211 PolarHBondContact NH1-OD1 2.91Å; R182-D211 VanDerWaalsContact NH2-N 3.16Å; R182-D211 IonicContact NH2-OD1 2.88Å; R182-D211 PolarHBondContact NH2-OD1 2.84Å
183	S	93.6	Very high	96.3	Very high	104 Å²	104	47.3 Å²	47.3	73%	0.727	24%	0.235	S	C	*	.	H	α-helix	trans	-71.8	-27.1	-174.7	73.1	0	0	0	0	113.6	D181	D181-S183 VanDerWaalsContact C-N 3.3Å; D181-S183 PolarHBondContact O-N 2.88Å; D181-S183 WeakPolarHBondContact OD1-CA 3.42Å; D181-S183 WeakPolarHBondContact OD1-CB 3.4Å; D181-S183 PolarHBondContact OD1-N 2.9Å; D181-S183 PolarHBondContact OD1-OG 3.1Å
184	L	94.1	Very high	96.3	Very high	82 Å²	82	49.4 Å²	49.4	43%	0.429	25%	0.248	S	C	.	.	H	α-helix	trans	-101.3	-31.6	-176.1	-63	176.2	0	0	0	113.6	D181 R182	D181-L184 HydrophobicContact CB-CB 4.4Å; D181-L184 HydrophobicContact CB-CD1 4.44Å; D181-L184 PolarHBondContact O-N 3.48Å; D181-L184 PolarHBondContact OD1-N 3.24Å; D181-L184 VanDerWaalsContact OD1-N 3.12Å; R182-L184 VanDerWaalsContact C-N 3.32Å; R182-L184 PolarHBondContact O-N 3.01Å
185	H	96.2	Very high	96.2	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.028	24%	0.236	C	C	.	.	H	α-helix	trans	-116.2	-11.7	-167.1	-54.9	91.2	0	0	0	113.9	G162 F164 V180 D181 Y189	G162-H185 PolarHBondContact O-NE2 2.84Å; F164-H185 AromaticContact CE1-CD2 3.5Å; F164-H185 AromaticContact CZ-CD2 3.43Å; F164-H185 VanDerWaalsContact CZ-CD2 3.43Å; F164-H185 WeakPolarHBondContact CZ-CD2 3.26Å; V180-H185 HydrophobicContact CG1-CB 3.97Å; D181-H185 PolarHBondContact N-ND1 2.87Å; D181-H185 VanDerWaalsContact O-CB 3.32Å; D181-H185 WeakPolarHBondContact O-CB 3.22Å; D181-H185 PolarHBondContact O-N 2.81Å; D181-H185 PolarHBondContact O-ND1 2.92Å; H185-Y189 VanDerWaalsContact C-OH 3.32Å; H185-Y189 VanDerWaalsContact CA-OH 3.3Å; H185-Y189 WeakPolarHBondContact CA-OH 3.44Å; H185-Y189 VanDerWaalsContact O-CE2 3.25Å; H185-Y189 WeakPolarHBondContact O-CE2 3.28Å; H185-Y189 PolarHBondContact O-OH 2.8Å
186	E	97.3	Very high	96	Very high	74 Å²	74	49.3 Å²	49.3	35%	0.346	25%	0.254	S	S	.	.			trans	-72.9	136.6	174	-171.6	166.7	106.5	0	0	110.7	R182 V207 V209	R182-E186 HydrophobicContact CG-CB 4.37Å; R182-E186 WeakPolarHBondContact O-CB 3.44Å; R182-E186 PolarHBondContact O-N 3.42Å; E186-V207 WeakPolarHBondContact CG-O 3.33Å; E186-V209 HydrophobicContact CB-CG2 4.01Å; E186-V209 PolarHBondContact OE2-N 3.12Å
187	G	97.2	Very high	95.8	Very high	14 Å²	14	49.9 Å²	49.9	14%	0.144	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.6	-168.1	175.2	0	0	0	0	0	114.9	N153 V207	N153-G187 WeakPolarHBondContact OD1-CA 3.1Å; G187-V207 PolarHBondContact N-O 2.92Å; G187-V207 VanDerWaalsContact N-O 3.15Å; G187-V207 PolarHBondContact O-N 2.94Å
188	S	98.1	Very high	95.5	Very high	37 Å²	37	53.2 Å²	53.2	26%	0.259	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	108.8	-179.7	179.4	0	0	0	0	109.9	N153 F205 Q206	N153-S188 PolarHBondContact N-O 3.38Å; N153-S188 PolarHBondContact OD1-N 2.92Å; S188-F205 CarbonylContact C-O 3.57Å; S188-F205 WeakPolarHBondContact CA-O 3.45Å; S188-Q206 PolarHBondContact OG-NE2 2.7Å
189	Y	98.1	Very high	95.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	139.5	173.3	-64.7	-100.5	0	0	0	110.2	L133 L135 Q151 L152 F164 L175 H185 T204 F205 V207	L133-Y189 HydrophobicContact CD2-CE1 4.29Å; L133-Y189 HydrophobicContact CD2-CE2 4.41Å; L135-Y189 HydrophobicContact CD1-CD1 3.89Å; L135-Y189 HydrophobicContact CD1-CD2 3.86Å; L135-Y189 HydrophobicContact CD1-CE1 4.47Å; L135-Y189 HydrophobicContact CD1-CE2 4.46Å; L135-Y189 HydrophobicContact CD1-CG 3.52Å; Q151-Y189 CarbonylContact O-C 3.49Å; Q151-Y189 VanDerWaalsContact O-CA 3.23Å; Q151-Y189 WeakPolarHBondContact O-CA 3.29Å; L152-Y189 HydrophobicContact CB-CD1 4.23Å; L152-Y189 HydrophobicContact CB-CE1 4.12Å; L152-Y189 HydrophobicContact CD1-CD1 4.12Å; L152-Y189 HydrophobicContact CD1-CD2 3.96Å; L152-Y189 HydrophobicContact CD1-CE1 3.84Å; L152-Y189 HydrophobicContact CD1-CE2 3.64Å; L152-Y189 HydrophobicContact CD1-CG 4.2Å; L152-Y189 HydrophobicContact CD2-CE1 4.12Å; L152-Y189 HydrophobicContact CG-CE1 4.25Å; F164-Y189 AromaticContact CE1-CE1 3.94Å; F164-Y189 HydrophobicContact CE1-CE1 3.94Å; F164-Y189 HydrophobicContact CZ-CE1 4.23Å; L175-Y189 HydrophobicContact CD2-CD1 3.33Å; L175-Y189 HydrophobicContact CD2-CE1 3.45Å; L175-Y189 VanDerWaalsContact CD2-CE1 3.45Å; L175-Y189 HydrophobicContact CD2-CG 4.45Å; H185-Y189 VanDerWaalsContact C-OH 3.32Å; H185-Y189 VanDerWaalsContact CA-OH 3.3Å; H185-Y189 WeakPolarHBondContact CA-OH 3.44Å; H185-Y189 VanDerWaalsContact O-CE2 3.25Å; H185-Y189 WeakPolarHBondContact O-CE2 3.28Å; H185-Y189 PolarHBondContact O-OH 2.8Å; Y189-T204 CarbonylContact O-C 3.58Å; Y189-T204 VanDerWaalsContact O-CA 3.28Å; Y189-T204 WeakPolarHBondContact O-CA 3.46Å; Y189-F205 PolarHBondContact N-O 3.14Å; Y189-F205 PolarHBondContact O-N 2.69Å; Y189-V207 HydrophobicContact CD2-CB 4.01Å; Y189-V207 HydrophobicContact CD2-CG2 3.43Å; Y189-V207 VanDerWaalsContact CD2-CG2 3.43Å; Y189-V207 HydrophobicContact CE2-CB 3.73Å; Y189-V207 HydrophobicContact CE2-CG1 4.36Å; Y189-V207 HydrophobicContact CE2-CG2 3.48Å; Y189-V207 VanDerWaalsContact CE2-CG2 3.48Å
190	Q	97.9	Very high	95.3	Very high	62 Å²	62	45.6 Å²	45.6	29%	0.29	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.9	172.5	-174.9	169.2	75.8	0	0	110	W150 Q151 K203	W150-Q190 CarbonylContact C-O 3.52Å; W150-Q190 WeakPolarHBondContact CA-O 3.37Å; Q151-Q190 PolarHBondContact N-O 3.02Å; Q151-Q190 PolarHBondContact O-N 2.99Å; Q190-K203 WeakPolarHBondContact CA-O 2.96Å
191	C	97.4	Very high	95.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.2	176.7	159.4	0	0	0	0	107.6	C137 T149 W150 S202 K203 F205	C137-C191 HydrophobicContact CB-CB 4.28Å; C137-C191 WeakPolarHBondContact CB-SG 3.31Å; C137-C191 WeakPolarHBondContact SG-CB 3.31Å; C137-C191 CovalentContact SG-SG 2.03Å; C137-C191 PolarHBondContact SG-SG 2.91Å; T149-C191 WeakPolarHBondContact O-CA 3.43Å; W150-C191 HydrophobicContact CD2-CB 3.96Å; W150-C191 HydrophobicContact CE3-CB 3.78Å; W150-C191 HydrophobicContact CH2-CB 3.72Å; W150-C191 HydrophobicContact CZ2-CB 3.89Å; W150-C191 HydrophobicContact CZ3-CB 3.67Å; C191-S202 CarbonylContact O-C 3.58Å; C191-S202 WeakPolarHBondContact O-CA 3.35Å; C191-K203 PolarHBondContact N-O 2.91Å; C191-K203 PolarHBondContact O-N 2.82Å; C191-F205 HydrophobicContact CB-CE2 4.38Å
192	T	96.8	Very high	95.4	Very high	25 Å²	25	47.6 Å²	47.6	15%	0.153	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.5	-174	-59.4	0	0	0	0	109.6	V148 T149 P200 Q201	V148-T192 CarbonylContact C-O 3.53Å; V148-T192 WeakPolarHBondContact CA-O 3.47Å; T149-T192 PolarHBondContact N-O 3.01Å; T149-T192 PolarHBondContact O-N 3.26Å; T192-P200 HydrophobicContact CG2-CB 3.78Å; T192-Q201 CarbonylContact C-O 3.58Å; T192-Q201 WeakPolarHBondContact CA-O 3.4Å
193	V	96.9	Very high	95.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.5	-180	177.4	0	0	0	0	109.2	A117 L119 M139 A145 V148 Q201	A117-V193 HydrophobicContact CB-CB 4.35Å; A117-V193 HydrophobicContact CB-CG1 4.08Å; L119-V193 HydrophobicContact CD1-CB 3.6Å; L119-V193 HydrophobicContact CD1-CG2 3.39Å; M139-V193 HydrophobicContact CB-CG1 3.98Å; M139-V193 HydrophobicContact CB-CG2 3.9Å; A145-V193 HydrophobicContact CB-CG1 3.6Å; V148-V193 HydrophobicContact CB-CG2 4.49Å; V148-V193 HydrophobicContact CG1-CG2 4.15Å; V148-V193 HydrophobicContact CG2-CB 4.45Å; V148-V193 HydrophobicContact CG2-CG1 4.26Å; V148-V193 HydrophobicContact CG2-CG2 3.84Å; V193-Q201 PolarHBondContact N-O 3.4Å; V193-Q201 PolarHBondContact O-N 2.88Å
194	T	94.8	Very high	95.7	Very high	46 Å²	46	41.6 Å²	41.6	28%	0.282	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.8	176.1	-52.2	0	0	0	0	109.7	A145 T146 S147	A145-T194 CarbonylContact C-O 3.59Å; A145-T194 WeakPolarHBondContact CA-O 3.41Å; T146-T194 PolarHBondContact N-O 2.83Å; T146-T194 PolarHBondContact OG1-O 3.28Å; S147-T194 PolarHBondContact N-O 3.14Å; S147-T194 PolarHBondContact O-N 3.21Å; S147-T194 WeakPolarHBondContact OG-CB 3.42Å
195	S	94.6	Very high	95.9	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.028	24%	0.24	C	C	.	.			trans	-131.2	148.9	175.4	57.2	0	0	0	0	110.9	G197 Y198	S195-G197 PolarHBondContact O-N 3.49Å; S195-Y198 PolarHBondContact O-N 3.07Å
196	P	94.9	Very high	96	Very high	59 Å²	59	41 Å²	41	38%	0.383	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.1	-179.9	-23.7	34.2	0	0	0	112.3	P143 L144 T146 Y198	P143-P196 HydrophobicContact CB-CB 4.3Å; P143-P196 HydrophobicContact CB-CG 4.19Å; P143-P196 HydrophobicContact CG-CB 4.4Å; L144-P196 VanDerWaalsContact O-CD 3.22Å; L144-P196 WeakPolarHBondContact O-CD 3.3Å; T146-P196 HydrophobicContact CG2-CG 3.78Å; P196-Y198 WeakPolarHBondContact O-CD2 3.38Å; P196-Y198 PolarHBondContact O-N 2.86Å
197	G	91.6	Very high	96.1	Very high	85 Å²	85	37.6 Å²	37.6	88%	0.876	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.4	-3.7	-179.8	0	0	0	0	0	115	S195	S195-G197 PolarHBondContact O-N 3.49Å
198	Y	91.6	Very high	96.1	Very high	72 Å²	72	40.2 Å²	40.2	28%	0.282	25%	0.253	S	S	.	.	S	Bend	trans	-126.1	149.6	177.9	-61.7	-83.8	0	0	0	111.2	T114 Y115 S195 P196	T114-Y198 VanDerWaalsContact CB-OH 3.28Å; T114-Y198 WeakPolarHBondContact CB-OH 3.28Å; T114-Y198 PolarHBondContact O-OH 2.85Å; T114-Y198 PolarHBondContact OG1-OH 3.2Å; Y115-Y198 WeakPolarHBondContact CA-OH 3.42Å; Y115-Y198 PolarHBondContact N-OH 2.87Å; Y115-Y198 VanDerWaalsContact N-OH 3.12Å; S195-Y198 PolarHBondContact O-N 3.07Å; P196-Y198 WeakPolarHBondContact O-CD2 3.38Å; P196-Y198 PolarHBondContact O-N 2.86Å
199	G	90.8	Very high	96	Very high	42 Å²	42	38.6 Å²	38.6	43%	0.433	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-71	163.8	170.4	0	0	0	0	0	111.7	Q201	G199-Q201 PolarHBondContact O-N 3.48Å; G199-Q201 PolarHBondContact O-NE2 3.48Å; G199-Q201 VanDerWaalsContact O-NE2 3.1Å
200	P	93.7	Very high	95.9	Very high	87 Å²	87	41.3 Å²	41.3	57%	0.565	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-57.8	126.4	178.3	24.9	-33.5	0	0	0	110.4	T192	T192-P200 HydrophobicContact CG2-CB 3.78Å
201	Q	96.1	Very high	95.6	Very high	62 Å²	62	43.2 Å²	43.2	29%	0.29	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	139.8	173	-61	-54.1	-58.9	0	0	108.4	A117 L119 T192 V193 G199	A117-Q201 WeakPolarHBondContact O-CG 3.46Å; L119-Q201 HydrophobicContact CB-CB 4.09Å; L119-Q201 HydrophobicContact CD1-CB 4.14Å; L119-Q201 HydrophobicContact CG-CB 4.41Å; T192-Q201 CarbonylContact C-O 3.58Å; T192-Q201 WeakPolarHBondContact CA-O 3.4Å; V193-Q201 PolarHBondContact N-O 3.4Å; V193-Q201 PolarHBondContact O-N 2.88Å; G199-Q201 PolarHBondContact O-N 3.48Å; G199-Q201 PolarHBondContact O-NE2 3.48Å; G199-Q201 VanDerWaalsContact O-NE2 3.1Å
202	S	96.3	Very high	95	Very high	46 Å²	46	48.4 Å²	48.4	32%	0.322	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	135.4	-175.8	64.5	0	0	0	0	113.2	L119 C191	L119-S202 CarbonylContact O-C 3.22Å; C191-S202 CarbonylContact O-C 3.58Å; C191-S202 WeakPolarHBondContact O-CA 3.35Å
203	K	97.4	Very high	94.2	Very high	43 Å²	43	50.7 Å²	50.7	19%	0.187	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.1	173.8	-173.8	174.6	175.1	-169.2	0	109.2	L119 E123 Q190 C191 F205	L119-K203 HydrophobicContact CB-CB 4Å; L119-K203 HydrophobicContact CD2-CB 4.16Å; L119-K203 VanDerWaalsContact O-CA 3.31Å; L119-K203 WeakPolarHBondContact O-CA 2.94Å; L119-K203 WeakPolarHBondContact O-CB 3.38Å; L119-K203 PolarHBondContact O-N 2.85Å; E123-K203 WeakPolarHBondContact OE2-CE 3.2Å; E123-K203 IonicContact OE2-NZ 3.34Å; E123-K203 PolarHBondContact OE2-NZ 3.36Å; Q190-K203 WeakPolarHBondContact CA-O 2.96Å; C191-K203 PolarHBondContact N-O 2.91Å; C191-K203 PolarHBondContact O-N 2.82Å; K203-F205 HydrophobicContact CB-CE2 4.48Å; K203-F205 HydrophobicContact CD-CE1 4.16Å; K203-F205 HydrophobicContact CD-CE2 4.31Å; K203-F205 HydrophobicContact CD-CZ 3.71Å; K203-F205 HydrophobicContact CG-CE2 4.18Å; K203-F205 HydrophobicContact CG-CZ 4.06Å
204	T	98	Very high	93.2	Very high	25 Å²	25	57.7 Å²	57.7	15%	0.153	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.1	179.5	-59.9	0	0	0	0	110.9	G121 S122 E123 Y189	G121-T204 PolarHBondContact O-N 3.29Å; S122-T204 CarbonylContact C-O 3.39Å; S122-T204 VanDerWaalsContact CA-O 3.26Å; S122-T204 WeakPolarHBondContact CA-O 3.22Å; E123-T204 PolarHBondContact N-O 2.81Å; Y189-T204 CarbonylContact O-C 3.58Å; Y189-T204 VanDerWaalsContact O-CA 3.28Å; Y189-T204 WeakPolarHBondContact O-CA 3.46Å
205	F	98.4	Very high	92	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.009	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.7	170.8	-51.1	-96.9	0	0	0	109.3	E123 V125 L135 Q136 W150 S188 Y189 C191 K203	E123-F205 HydrophobicContact CB-CD1 3.88Å; E123-F205 HydrophobicContact CB-CE1 4.32Å; E123-F205 HydrophobicContact CG-CD1 4.32Å; E123-F205 CarbonylContact O-C 3.54Å; E123-F205 VanDerWaalsContact O-CA 3.3Å; E123-F205 WeakPolarHBondContact O-CA 3.25Å; E123-F205 WeakPolarHBondContact OE2-CE1 3.18Å; V125-F205 HydrophobicContact CG2-CD1 4.43Å; L135-F205 HydrophobicContact CB-CD2 4.38Å; L135-F205 HydrophobicContact CB-CE2 4.37Å; L135-F205 HydrophobicContact CB-CG 4.47Å; L135-F205 HydrophobicContact CB-CZ 4.43Å; L135-F205 HydrophobicContact CD1-CB 3.98Å; L135-F205 HydrophobicContact CD1-CD2 4.11Å; L135-F205 HydrophobicContact CD1-CG 4.03Å; L135-F205 HydrophobicContact CD2-CB 4.06Å; L135-F205 HydrophobicContact CD2-CD1 3.82Å; L135-F205 HydrophobicContact CD2-CE1 4.42Å; L135-F205 HydrophobicContact CD2-CG 3.93Å; L135-F205 HydrophobicContact CG-CG 4.38Å; Q136-F205 WeakPolarHBondContact O-CZ 3.15Å; W150-F205 HydrophobicContact CH2-CD2 4.42Å; W150-F205 AromaticContact CH2-CE2 3.8Å; W150-F205 HydrophobicContact CH2-CE2 3.8Å; W150-F205 HydrophobicContact CH2-CZ 4.43Å; W150-F205 HydrophobicContact CZ3-CD2 4.04Å; W150-F205 AromaticContact CZ3-CE2 3.84Å; W150-F205 HydrophobicContact CZ3-CE2 3.84Å; S188-F205 CarbonylContact C-O 3.57Å; S188-F205 WeakPolarHBondContact CA-O 3.45Å; Y189-F205 PolarHBondContact N-O 3.14Å; Y189-F205 PolarHBondContact O-N 2.69Å; C191-F205 HydrophobicContact CB-CE2 4.38Å; K203-F205 HydrophobicContact CB-CE2 4.48Å; K203-F205 HydrophobicContact CD-CE1 4.16Å; K203-F205 HydrophobicContact CD-CE2 4.31Å; K203-F205 HydrophobicContact CD-CZ 3.71Å; K203-F205 HydrophobicContact CG-CE2 4.18Å; K203-F205 HydrophobicContact CG-CZ 4.06Å
206	Q	98.3	Very high	90.9	Very high	73 Å²	73	70.2 Å²	70.2	34%	0.341	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	99.4	173.2	-61.1	-59.7	-46.5	0	0	108	E123 K124 V125 S188	E123-Q206 PolarHBondContact O-N 2.84Å; K124-Q206 WeakPolarHBondContact CA-O 3.22Å; K124-Q206 HydrophobicContact CG-CB 4.31Å; V125-Q206 PolarHBondContact N-O 3.47Å; S188-Q206 PolarHBondContact OG-NE2 2.7Å
207	V	98.3	Very high	90.2	Very high	4 Å²	4	70.9 Å²	70.9	2%	0.024	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128	-178.7	178.4	0	0	0	0	109.2	V125 L133 L135 E186 G187 Y189 V209	V125-V207 HydrophobicContact CB-CG2 4.15Å; V125-V207 CarbonylContact O-C 3.53Å; V125-V207 VanDerWaalsContact O-CA 3.3Å; V125-V207 WeakPolarHBondContact O-CA 3.41Å; L133-V207 HydrophobicContact CD1-CG1 4.28Å; L133-V207 HydrophobicContact CD1-CG2 3.99Å; L135-V207 HydrophobicContact CD1-CG2 4.21Å; L135-V207 HydrophobicContact CD2-CG2 4.32Å; E186-V207 WeakPolarHBondContact CG-O 3.33Å; G187-V207 PolarHBondContact N-O 2.92Å; G187-V207 VanDerWaalsContact N-O 3.15Å; G187-V207 PolarHBondContact O-N 2.94Å; Y189-V207 HydrophobicContact CD2-CB 4.01Å; Y189-V207 HydrophobicContact CD2-CG2 3.43Å; Y189-V207 VanDerWaalsContact CD2-CG2 3.43Å; Y189-V207 HydrophobicContact CE2-CB 3.73Å; Y189-V207 HydrophobicContact CE2-CG1 4.36Å; Y189-V207 HydrophobicContact CE2-CG2 3.48Å; Y189-V207 VanDerWaalsContact CE2-CG2 3.48Å; V207-V209 HydrophobicContact CG1-CG2 4.4Å
208	T	97.9	Very high	89.5	Confident	68 Å²	68	72 Å²	72	42%	0.417	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.7	174.6	-55.5	0	0	0	0	109.4	V125 T126 L127	V125-T208 PolarHBondContact O-N 2.8Å; T126-T208 WeakPolarHBondContact CA-O 3.3Å; L127-T208 PolarHBondContact N-O 2.9Å
209	V	97.2	Very high	89.1	Confident	3 Å²	3	75.6 Å²	75.6	2%	0.018	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	115.5	-176.5	-174.5	0	0	0	0	110	L127 E129 V180 R182 E186 V207	L127-V209 CarbonylContact O-C 3.51Å; L127-V209 WeakPolarHBondContact O-CA 3.12Å; E129-V209 HydrophobicContact CG-CG1 3.78Å; V180-V209 HydrophobicContact CG1-CB 4.26Å; V180-V209 HydrophobicContact CG1-CG1 3.77Å; V180-V209 HydrophobicContact CG1-CG2 3.41Å; V180-V209 VanDerWaalsContact CG1-CG2 3.41Å; R182-V209 HydrophobicContact CB-CB 3.99Å; R182-V209 HydrophobicContact CB-CG1 4.01Å; R182-V209 HydrophobicContact CG-CB 4.24Å; R182-V209 PolarHBondContact NE-O 3.26Å; R182-V209 PolarHBondContact NH2-O 2.94Å; E186-V209 HydrophobicContact CB-CG2 4.01Å; E186-V209 PolarHBondContact OE2-N 3.12Å; V207-V209 HydrophobicContact CG1-CG2 4.4Å
210	T	95.4	Very high	88.9	Confident	57 Å²	57	77.8 Å²	77.8	35%	0.35	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	153.6	177.8	55.3	0	0	0	0	111.3	T126 L127 E128 E129	T126-T210 HydrophobicContact CG2-CG2 3.77Å; L127-T210 PolarHBondContact O-N 2.81Å; L127-T210 PolarHBondContact O-OG1 2.75Å; L127-T210 VanDerWaalsContact O-OG1 3.07Å; E128-T210 CarbonylContact C-O 3.57Å; E128-T210 WeakPolarHBondContact CA-O 2.9Å; E129-T210 PolarHBondContact N-O 2.85Å
211	D	90.8	Very high	88.6	Confident	102 Å²	102	76 Å²	76	55%	0.545	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-62.2	144.3	176.5	-62.1	-28.1	0	0	0	109.5	R182 T213	R182-D211 IonicContact CZ-OD1 2.75Å; R182-D211 IonicContact NH1-OD1 3.97Å; R182-D211 PolarHBondContact NH1-OD1 2.91Å; R182-D211 VanDerWaalsContact NH2-N 3.16Å; R182-D211 IonicContact NH2-OD1 2.88Å; R182-D211 PolarHBondContact NH2-OD1 2.84Å; D211-T213 PolarHBondContact O-N 3.36Å
212	K	84.9	Confident	88.4	Confident	109 Å²	109	77.2 Å²	77.2	47%	0.474	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-55.6	125.5	178.4	-175.1	174.6	-176.3	174.1	0	111.3	E129 E130 I214	E129-K212 HydrophobicContact CB-CB 4.46Å; E130-K212 IonicContact OE2-NZ 2.66Å; E130-K212 PolarHBondContact OE2-NZ 2.98Å; K212-I214 PolarHBondContact O-N 3.32Å
213	T	79.4	Confident	88.1	Confident	73 Å²	73	77.6 Å²	77.6	45%	0.448	41%	0.411	S	S	.	.			trans	-75.4	111	172.9	61.9	0	0	0	0	109	E128 D211 K215	E128-T213 VanDerWaalsContact CD-OG1 3.29Å; E128-T213 WeakPolarHBondContact OE1-CB 2.92Å; E128-T213 WeakPolarHBondContact OE1-CG2 2.79Å; E128-T213 PolarHBondContact OE1-OG1 3.29Å; E128-T213 PolarHBondContact OE2-N 2.85Å; E128-T213 PolarHBondContact OE2-OG1 3.25Å; E128-T213 VanDerWaalsContact OE2-OG1 3.04Å; D211-T213 PolarHBondContact O-N 3.36Å; T213-K215 PolarHBondContact O-N 3.06Å
214	I	76.3	Confident	87.9	Confident	150 Å²	150	77.3 Å²	77.3	77%	0.769	42%	0.42	S	S	*	.			trans	-69.3	100.7	171.3	-56.7	179	0	0	0	106.6	K212 F216	K212-I214 PolarHBondContact O-N 3.32Å; I214-F216 PolarHBondContact O-N 3.1Å
215	K	70.1	Confident	87.8	Confident	189 Å²	189	80.6 Å²	80.6	82%	0.822	44%	0.44	S	S	*	.			trans	-65.3	82.5	171.5	-67.4	-174.5	-176.8	175.8	0	108.9	T213	T213-K215 PolarHBondContact O-N 3.06Å
216	F	72.3	Confident	87.7	Confident	124 Å²	124	84 Å²	84	54%	0.544	46%	0.461	S	S	.	.			trans	-63.2	128.2	178.4	-172.5	-101.8	0	0	0	108.9	I214 L218 T221	I214-F216 PolarHBondContact O-N 3.1Å; F216-L218 HydrophobicContact CD1-CD1 4.39Å; F216-L218 PolarHBondContact O-N 3.32Å; F216-T221 VanDerWaalsContact CE1-CB 3.47Å; F216-T221 HydrophobicContact CE1-CG2 3.55Å; F216-T221 WeakPolarHBondContact CE1-OG1 3.21Å; F216-T221 HydrophobicContact CZ-CG2 3.53Å; F216-T221 WeakPolarHBondContact CZ-OG1 3.39Å
217	P	78.9	Confident	87.6	Confident	72 Å²	72	84.7 Å²	84.7	47%	0.468	47%	0.47	S	S	.	.			trans	-73.1	82.9	-179.2	29.9	-34	0	0	0	109.3	M219 P220 T221	P217-M219 VanDerWaalsContact C-N 3.29Å; P217-M219 PolarHBondContact O-N 2.69Å; P217-P220 HydrophobicContact CB-CB 4.32Å; P217-P220 HydrophobicContact CB-CG 3.88Å; P217-P220 WeakPolarHBondContact O-CD 3.27Å; P217-T221 WeakPolarHBondContact O-CB 3.35Å; P217-T221 PolarHBondContact O-N 2.79Å; P217-T221 PolarHBondContact O-OG1 2.92Å
218	L	77.7	Confident	87.5	Confident	108 Å²	108	88.8 Å²	88.8	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-60.2	-41.3	-173.8	-162.9	79.2	0	0	0	111	F216 T221 I222	F216-L218 HydrophobicContact CD1-CD1 4.39Å; F216-L218 PolarHBondContact O-N 3.32Å; L218-T221 PolarHBondContact O-N 2.98Å; L218-I222 HydrophobicContact CD2-CD1 4.08Å; L218-I222 HydrophobicContact CG-CD1 3.76Å; L218-I222 HydrophobicContact CG-CG1 4.41Å; L218-I222 WeakPolarHBondContact O-CB 3.29Å; L218-I222 WeakPolarHBondContact O-CG1 2.97Å; L218-I222 PolarHBondContact O-N 2.97Å
219	M	82.2	Confident	87.4	Confident	149 Å²	149	87.7 Å²	87.7	73%	0.734	49%	0.493	S	S	*	.	H	α-helix	trans	-65.5	-53.2	-179.3	-67.9	-65.1	-178.9	0	0	113	P217 T221 I222 A223	P217-M219 VanDerWaalsContact C-N 3.29Å; P217-M219 PolarHBondContact O-N 2.69Å; M219-T221 VanDerWaalsContact C-N 3.28Å; M219-T221 PolarHBondContact O-N 3.26Å; M219-I222 PolarHBondContact O-N 3.03Å; M219-A223 WeakPolarHBondContact O-CB 3.12Å; M219-A223 PolarHBondContact O-N 2.84Å
220	P	87.9	Confident	87.4	Confident	87 Å²	87	92.2 Å²	92.2	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-57	-39	172.4	-29.5	36.5	0	0	0	113.8	P217 A223 G224	P217-P220 HydrophobicContact CB-CB 4.32Å; P217-P220 HydrophobicContact CB-CG 3.88Å; P217-P220 WeakPolarHBondContact O-CD 3.27Å; P220-A223 PolarHBondContact O-N 3.03Å; P220-G224 PolarHBondContact O-N 2.88Å
221	T	88	Confident	87.3	Confident	50 Å²	50	93.1 Å²	93.1	31%	0.307	52%	0.522	S	S	.	.	H	α-helix	trans	-68.1	-45.9	-179.3	-50.4	0	0	0	0	111.5	F216 P217 L218 M219 A223 G224 V225	F216-T221 VanDerWaalsContact CE1-CB 3.47Å; F216-T221 HydrophobicContact CE1-CG2 3.55Å; F216-T221 WeakPolarHBondContact CE1-OG1 3.21Å; F216-T221 HydrophobicContact CZ-CG2 3.53Å; F216-T221 WeakPolarHBondContact CZ-OG1 3.39Å; P217-T221 WeakPolarHBondContact O-CB 3.35Å; P217-T221 PolarHBondContact O-N 2.79Å; P217-T221 PolarHBondContact O-OG1 2.92Å; L218-T221 PolarHBondContact O-N 2.98Å; M219-T221 VanDerWaalsContact C-N 3.28Å; M219-T221 PolarHBondContact O-N 3.26Å; T221-A223 PolarHBondContact O-N 2.01Å; T221-G224 PolarHBondContact O-N 2.95Å; T221-V225 WeakPolarHBondContact O-CG2 3.38Å; T221-V225 PolarHBondContact O-N 2.81Å
222	I	89.9	Confident	87.5	Confident	87 Å²	87	91.8 Å²	91.8	45%	0.446	52%	0.517	S	S	.	.	H	α-helix	trans	-60.1	-46.9	176	-69.7	166.4	0	0	0	110.1	L218 M219 G224 V225 V226	L218-I222 HydrophobicContact CD2-CD1 4.08Å; L218-I222 HydrophobicContact CG-CD1 3.76Å; L218-I222 HydrophobicContact CG-CG1 4.41Å; L218-I222 WeakPolarHBondContact O-CB 3.29Å; L218-I222 WeakPolarHBondContact O-CG1 2.97Å; L218-I222 PolarHBondContact O-N 2.97Å; M219-I222 PolarHBondContact O-N 3.03Å; I222-G224 VanDerWaalsContact C-N 3.31Å; I222-G224 PolarHBondContact O-N 2.94Å; I222-V225 PolarHBondContact O-N 2.84Å; I222-V226 HydrophobicContact CG2-CG2 4.25Å; I222-V226 VanDerWaalsContact O-CG2 3.32Å; I222-V226 WeakPolarHBondContact O-CG2 3.24Å; I222-V226 PolarHBondContact O-N 2.69Å
223	A	91.1	Very high	88	Confident	55 Å²	55	91.4 Å²	91.4	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-58.2	-44.8	177.9	0	0	0	0	0	111.6	M219 P220 T221 V226 V227	M219-A223 WeakPolarHBondContact O-CB 3.12Å; M219-A223 PolarHBondContact O-N 2.84Å; P220-A223 PolarHBondContact O-N 3.03Å; T221-A223 PolarHBondContact O-N 2.01Å; A223-V226 PolarHBondContact O-N 2.91Å; A223-V227 VanDerWaalsContact O-CG2 3.31Å; A223-V227 WeakPolarHBondContact O-CG2 3.41Å; A223-V227 PolarHBondContact O-N 2.85Å
224	G	93.7	Very high	88.6	Confident	36 Å²	36	93.9 Å²	93.9	37%	0.371	53%	0.53	S	S	.	.	H	α-helix	trans	-58.6	-47.8	174.8	0	0	0	0	0	112.7	P220 T221 I222 V226 V227 V228	P220-G224 PolarHBondContact O-N 2.88Å; T221-G224 PolarHBondContact O-N 2.95Å; I222-G224 VanDerWaalsContact C-N 3.31Å; I222-G224 PolarHBondContact O-N 2.94Å; G224-V226 PolarHBondContact O-N 2.79Å; G224-V227 PolarHBondContact O-N 2.98Å; G224-V228 WeakPolarHBondContact O-CG2 3.28Å; G224-V228 PolarHBondContact O-N 2.89Å
225	V	95.5	Very high	89.4	Confident	95 Å²	95	89.1 Å²	89.1	58%	0.576	51%	0.513	S	S	*	.	H	α-helix	trans	-61.8	-42.9	178.4	171.7	0	0	0	0	111.7	T221 I222 V228 A229	T221-V225 WeakPolarHBondContact O-CG2 3.38Å; T221-V225 PolarHBondContact O-N 2.81Å; I222-V225 PolarHBondContact O-N 2.84Å; V225-V228 PolarHBondContact O-N 2.96Å; V225-A229 WeakPolarHBondContact O-CB 3.34Å; V225-A229 PolarHBondContact O-N 3.41Å
226	V	96.2	Very high	90.5	Very high	74 Å²	74	84.4 Å²	84.4	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-43.2	178.2	171.7	0	0	0	0	111.3	I222 A223 G224 A229 L230	I222-V226 HydrophobicContact CG2-CG2 4.25Å; I222-V226 VanDerWaalsContact O-CG2 3.32Å; I222-V226 WeakPolarHBondContact O-CG2 3.24Å; I222-V226 PolarHBondContact O-N 2.69Å; A223-V226 PolarHBondContact O-N 2.91Å; G224-V226 PolarHBondContact O-N 2.79Å; V226-A229 PolarHBondContact O-N 2.88Å; V226-L230 HydrophobicContact CG1-CD1 3.85Å; V226-L230 HydrophobicContact CG1-CG 4.39Å; V226-L230 WeakPolarHBondContact O-CB 3.22Å; V226-L230 WeakPolarHBondContact O-CG 3.26Å; V226-L230 PolarHBondContact O-N 3.42Å
227	V	96.3	Very high	91.3	Very high	86 Å²	86	81.9 Å²	81.9	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-63.6	-44.2	177.4	172.4	0	0	0	0	111.1	A223 G224 A229 L230 T231	A223-V227 VanDerWaalsContact O-CG2 3.31Å; A223-V227 WeakPolarHBondContact O-CG2 3.41Å; A223-V227 PolarHBondContact O-N 2.85Å; G224-V227 PolarHBondContact O-N 2.98Å; V227-A229 PolarHBondContact O-N 3.31Å; V227-L230 PolarHBondContact O-N 3.2Å; V227-T231 HydrophobicContact CG1-CG2 4.28Å; V227-T231 WeakPolarHBondContact O-CB 3.45Å; V227-T231 VanDerWaalsContact O-CG2 3.25Å; V227-T231 WeakPolarHBondContact O-CG2 3.38Å; V227-T231 PolarHBondContact O-N 3.4Å; V227-T231 PolarHBondContact O-OG1 3.48Å
228	V	96.4	Very high	91.6	Very high	90 Å²	90	81.8 Å²	81.8	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-62.5	-42.2	176	174.7	0	0	0	0	111.1	G224 V225 T231 T232	G224-V228 WeakPolarHBondContact O-CG2 3.28Å; G224-V228 PolarHBondContact O-N 2.89Å; V225-V228 PolarHBondContact O-N 2.96Å; V228-T231 WeakPolarHBondContact CA-OG1 3.49Å; V228-T231 PolarHBondContact O-OG1 3.17Å; V228-T232 HydrophobicContact CG1-CG2 4.39Å; V228-T232 WeakPolarHBondContact O-CB 3.41Å; V228-T232 VanDerWaalsContact O-CG2 3.25Å; V228-T232 WeakPolarHBondContact O-CG2 3.18Å; V228-T232 PolarHBondContact O-N 3.47Å; V228-T232 PolarHBondContact O-OG1 2.72Å
229	A	96.1	Very high	91.9	Very high	46 Å²	46	85.7 Å²	85.7	38%	0.38	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-44.6	177.1	0	0	0	0	0	112.5	V225 V226 V227 T232 L233	V225-A229 WeakPolarHBondContact O-CB 3.34Å; V225-A229 PolarHBondContact O-N 3.41Å; V226-A229 PolarHBondContact O-N 2.88Å; V227-A229 PolarHBondContact O-N 3.31Å; A229-T232 WeakPolarHBondContact CA-OG1 3.1Å; A229-T232 PolarHBondContact O-OG1 2.95Å; A229-L233 WeakPolarHBondContact O-CB 2.79Å; A229-L233 PolarHBondContact O-N 2.97Å
230	L	95.7	Very high	91.7	Very high	98 Å²	98	87.8 Å²	87.8	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-43.5	178.3	-73.5	171.2	0	0	0	112.1	V226 V227 L233 L234	V226-L230 HydrophobicContact CG1-CD1 3.85Å; V226-L230 HydrophobicContact CG1-CG 4.39Å; V226-L230 WeakPolarHBondContact O-CB 3.22Å; V226-L230 WeakPolarHBondContact O-CG 3.26Å; V226-L230 PolarHBondContact O-N 3.42Å; V227-L230 PolarHBondContact O-N 3.2Å; L230-L233 PolarHBondContact O-N 3.49Å; L230-L234 WeakPolarHBondContact O-CB 3.23Å; L230-L234 VanDerWaalsContact O-CG 3.27Å; L230-L234 WeakPolarHBondContact O-CG 3.25Å; L230-L234 PolarHBondContact O-N 3.33Å
231	T	95.1	Very high	91	Very high	76 Å²	76	92.3 Å²	92.3	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-40.3	178.8	50.9	0	0	0	0	112.3	V227 V228 L234 A235	V227-T231 HydrophobicContact CG1-CG2 4.28Å; V227-T231 WeakPolarHBondContact O-CB 3.45Å; V227-T231 VanDerWaalsContact O-CG2 3.25Å; V227-T231 WeakPolarHBondContact O-CG2 3.38Å; V227-T231 PolarHBondContact O-N 3.4Å; V227-T231 PolarHBondContact O-OG1 3.48Å; V228-T231 WeakPolarHBondContact CA-OG1 3.49Å; V228-T231 PolarHBondContact O-OG1 3.17Å; T231-L234 PolarHBondContact O-N 2.9Å; T231-A235 WeakPolarHBondContact O-CB 3.44Å; T231-A235 PolarHBondContact O-N 2.85Å
232	T	94.6	Very high	90.4	Very high	73 Å²	73	94.2 Å²	94.2	45%	0.448	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-43.2	174.5	51.6	0	0	0	0	112.2	V228 A229 L234 A235 I236	V228-T232 HydrophobicContact CG1-CG2 4.39Å; V228-T232 WeakPolarHBondContact O-CB 3.41Å; V228-T232 VanDerWaalsContact O-CG2 3.25Å; V228-T232 WeakPolarHBondContact O-CG2 3.18Å; V228-T232 PolarHBondContact O-N 3.47Å; V228-T232 PolarHBondContact O-OG1 2.72Å; A229-T232 WeakPolarHBondContact CA-OG1 3.1Å; A229-T232 PolarHBondContact O-OG1 2.95Å; T232-L234 PolarHBondContact O-N 3.47Å; T232-A235 PolarHBondContact O-N 2.88Å; T232-I236 VanDerWaalsContact O-CG1 3.27Å; T232-I236 WeakPolarHBondContact O-CG1 3.41Å; T232-I236 PolarHBondContact O-N 3.43Å
233	L	94.9	Very high	89.4	Confident	102 Å²	102	95 Å²	95	53%	0.534	52%	0.52	S	S	.	.	H	α-helix	trans	-57	-48.5	172.6	-90.9	159.6	0	0	0	111.9	A229 L230 A235 I236 V237	A229-L233 WeakPolarHBondContact O-CB 2.79Å; A229-L233 PolarHBondContact O-N 2.97Å; L230-L233 PolarHBondContact O-N 3.49Å; L233-A235 VanDerWaalsContact C-N 3.32Å; L233-A235 PolarHBondContact O-N 3.14Å; L233-I236 PolarHBondContact O-N 2.9Å; L233-V237 WeakPolarHBondContact O-CG2 3.45Å; L233-V237 PolarHBondContact O-N 2.84Å
234	L	92.9	Very high	88.3	Confident	124 Å²	124	95.7 Å²	95.7	65%	0.649	53%	0.525	S	S	*	.	H	α-helix	trans	-62.2	-39.5	177.8	-71.8	171.6	0	0	0	111.9	L230 T231 T232 V237 S238	L230-L234 WeakPolarHBondContact O-CB 3.23Å; L230-L234 VanDerWaalsContact O-CG 3.27Å; L230-L234 WeakPolarHBondContact O-CG 3.25Å; L230-L234 PolarHBondContact O-N 3.33Å; T231-L234 PolarHBondContact O-N 2.9Å; T232-L234 PolarHBondContact O-N 3.47Å; L234-V237 PolarHBondContact O-N 3.32Å; L234-S238 VanDerWaalsContact O-CB 3.26Å; L234-S238 WeakPolarHBondContact O-CB 3.41Å; L234-S238 PolarHBondContact O-N 2.88Å
235	A	92	Very high	87	Confident	50 Å²	50	102 Å²	102	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-64.6	-41.7	175.8	0	0	0	0	0	112.3	T231 T232 L233 S238 R239	T231-A235 WeakPolarHBondContact O-CB 3.44Å; T231-A235 PolarHBondContact O-N 2.85Å; T232-A235 PolarHBondContact O-N 2.88Å; L233-A235 VanDerWaalsContact C-N 3.32Å; L233-A235 PolarHBondContact O-N 3.14Å; A235-S238 PolarHBondContact O-N 2.97Å; A235-R239 WeakPolarHBondContact O-CG 3.27Å; A235-R239 PolarHBondContact O-N 2.84Å
236	I	92.3	Very high	85.3	Confident	91 Å²	91	102.3 Å²	102.3	47%	0.467	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-49.7	175.9	-67.2	164.3	0	0	0	110.2	T232 L233 S238 R239 W240	T232-I236 VanDerWaalsContact O-CG1 3.27Å; T232-I236 WeakPolarHBondContact O-CG1 3.41Å; T232-I236 PolarHBondContact O-N 3.43Å; L233-I236 PolarHBondContact O-N 2.9Å; I236-S238 VanDerWaalsContact C-N 3.3Å; I236-S238 PolarHBondContact O-N 2.81Å; I236-R239 PolarHBondContact O-N 3.34Å; I236-W240 WeakPolarHBondContact O-CB 3.39Å; I236-W240 PolarHBondContact O-N 3.12Å
237	V	89.9	Confident	83.5	Confident	70 Å²	70	104.1 Å²	104.1	42%	0.424	56%	0.563	S	S	.	*	H	α-helix	trans	-60.2	-41.3	178.5	171.6	0	0	0	0	111.3	L233 L234 W240 R241	L233-V237 WeakPolarHBondContact O-CG2 3.45Å; L233-V237 PolarHBondContact O-N 2.84Å; L234-V237 PolarHBondContact O-N 3.32Å; V237-W240 PolarHBondContact O-N 3.41Å; V237-R241 WeakPolarHBondContact O-CG 3.4Å; V237-R241 PolarHBondContact O-N 3.45Å
238	S	85.9	Confident	81.4	Confident	71 Å²	71	112 Å²	112	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-59.9	-49.8	175.9	178.9	0	0	0	0	111.5	L234 A235 I236 W240 R241 V242	L234-S238 VanDerWaalsContact O-CB 3.26Å; L234-S238 WeakPolarHBondContact O-CB 3.41Å; L234-S238 PolarHBondContact O-N 2.88Å; A235-S238 PolarHBondContact O-N 2.97Å; I236-S238 VanDerWaalsContact C-N 3.3Å; I236-S238 PolarHBondContact O-N 2.81Å; S238-W240 PolarHBondContact O-N 2.78Å; S238-R241 PolarHBondContact O-N 2.71Å; S238-V242 WeakPolarHBondContact O-CG2 3.44Å; S238-V242 PolarHBondContact O-N 3.14Å
239	R	83.8	Confident	80.6	Confident	190 Å²	190	113.1 Å²	113.1	72%	0.717	59%	0.592	S	S	*	*	H	α-helix	trans	-63.6	-39.5	177.6	-73.8	-176.9	176.7	-168.1	-0.2	112.5	A235 I236 V242 I243	A235-R239 WeakPolarHBondContact O-CG 3.27Å; A235-R239 PolarHBondContact O-N 2.84Å; I236-R239 PolarHBondContact O-N 3.34Å; R239-V242 PolarHBondContact O-N 3.09Å; R239-I243 WeakPolarHBondContact O-CG1 3.2Å; R239-I243 PolarHBondContact O-N 2.99Å
240	W	76.9	Confident	79.8	Confident	192 Å²	192	116.6 Å²	116.6	73%	0.727	60%	0.603	S	S	*	*	H	α-helix	trans	-63.3	-41	176	-85.2	50.4	0	0	0	112.6	I236 V237 S238 V242 I243 A244	I236-W240 WeakPolarHBondContact O-CB 3.39Å; I236-W240 PolarHBondContact O-N 3.12Å; V237-W240 PolarHBondContact O-N 3.41Å; S238-W240 PolarHBondContact O-N 2.78Å; W240-V242 VanDerWaalsContact C-N 3.28Å; W240-V242 PolarHBondContact O-N 3.2Å; W240-I243 PolarHBondContact O-N 2.79Å; W240-A244 VanDerWaalsContact O-CB 3.27Å; W240-A244 WeakPolarHBondContact O-CB 3.24Å; W240-A244 PolarHBondContact O-N 2.83Å
241	R	74.6	Confident	78.9	Confident	182 Å²	182	117.7 Å²	117.7	69%	0.687	61%	0.608	S	S	*	*	H	α-helix	trans	-64.2	-33	175.3	-77	-175.4	-180	-171.6	1.5	112.7	V237 S238 K245	V237-R241 WeakPolarHBondContact O-CG 3.4Å; V237-R241 PolarHBondContact O-N 3.45Å; S238-R241 PolarHBondContact O-N 2.71Å; R241-K245 WeakPolarHBondContact O-CG 3.47Å; R241-K245 PolarHBondContact O-N 2.83Å
242	V	74	Confident	78	Confident	90 Å²	90	120.1 Å²	120.1	55%	0.545	62%	0.617	S	S	.	*	H	α-helix	trans	-70.6	-47.1	175	175.1	0	0	0	0	110.6	S238 R239 W240 A244 K245 C246	S238-V242 WeakPolarHBondContact O-CG2 3.44Å; S238-V242 PolarHBondContact O-N 3.14Å; R239-V242 PolarHBondContact O-N 3.09Å; W240-V242 VanDerWaalsContact C-N 3.28Å; W240-V242 PolarHBondContact O-N 3.2Å; V242-A244 PolarHBondContact O-N 2.74Å; V242-K245 PolarHBondContact O-N 2.99Å; V242-C246 PolarHBondContact O-N 3.12Å
243	I	70	Confident	77	Confident	105 Å²	105	123.1 Å²	123.1	54%	0.538	63%	0.627	S	S	.	*	H	α-helix	trans	-62.2	-43.6	177.8	-64.8	164.6	0	0	0	111.1	R239 W240 K245 C246 C247	R239-I243 WeakPolarHBondContact O-CG1 3.2Å; R239-I243 PolarHBondContact O-N 2.99Å; W240-I243 PolarHBondContact O-N 2.79Å; I243-K245 PolarHBondContact O-N 3.09Å; I243-C246 PolarHBondContact O-N 3.35Å; I243-C247 PolarHBondContact O-N 3.14Å
244	A	68.3	Low	75.8	Confident	68 Å²	68	124.5 Å²	124.5	56%	0.562	63%	0.633	S	S	*	*	H	α-helix	trans	-63.6	-23.8	178.3	0	0	0	0	0	113.7	W240 V242	W240-A244 VanDerWaalsContact O-CB 3.27Å; W240-A244 WeakPolarHBondContact O-CB 3.24Å; W240-A244 PolarHBondContact O-N 2.83Å; V242-A244 PolarHBondContact O-N 2.74Å
245	K	64.9	Low	74.5	Confident	169 Å²	169	124.5 Å²	124.5	74%	0.735	63%	0.632	S	S	*	*	H	α-helix	trans	-78.2	-21.6	173.4	-78.8	-179.3	178.6	-174.1	0	113.5	R241 V242 I243	R241-K245 WeakPolarHBondContact O-CG 3.47Å; R241-K245 PolarHBondContact O-N 2.83Å; V242-K245 PolarHBondContact O-N 2.99Å; I243-K245 PolarHBondContact O-N 3.09Å
246	C	60.2	Low	73.2	Confident	101 Å²	101	130.2 Å²	130.2	68%	0.682	65%	0.649	S	S	*	*	H	α-helix	trans	-87.5	-14.2	177.1	-62.8	0	0	0	0	113.2	V242 I243 K248	V242-C246 PolarHBondContact O-N 3.12Å; I243-C246 PolarHBondContact O-N 3.35Å; C246-K248 VanDerWaalsContact C-N 3.32Å
247	C	59.3	Low	71.6	Confident	113 Å²	113	133.5 Å²	133.5	76%	0.764	66%	0.664	S	S	*	*			trans	-94.2	25.4	177.2	-64.2	0	0	0	0	113.4	I243	I243-C247 PolarHBondContact O-N 3.14Å
248	K	51.7	Low	69.9	Low	251 Å²	251	139.3 Å²	139.3	100%	1.091	69%	0.686	S	S	*	*			trans	-129.3	0	176.8	-143.8	-175.8	-168.3	-178	0	109.1	C246	C246-K248 VanDerWaalsContact C-N 3.32Å

Retrieved 248 of 248 residues in 327.5 ms (Link to these results)

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