A0A087WUC8_HUMAN Loading...

Tubulin polyglutamylase complex subunit 2

AlphaFold DB , UniProt , Accession A0A087WUC8, Species HUMAN (Homo sapiens, Human), Gene TPGS2, Length 232 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	35.1	Very low	34.9	Very low	240 Å²	240	141.4 Å²	141.4	100%	1.182	84%	0.842	S	S	*	*				0	92.9	0	-82.3	172.3	163.4	0	0	105.7
2	E	33.3	Very low	35.2	Very low	191 Å²	191	139.4 Å²	139.4	89%	0.893	84%	0.839	S	S	*	*			trans	-77.7	134.4	163.8	-68.6	121.2	125.4	0	0	108.3
3	E	32	Very low	36.4	Very low	192 Å²	192	131.9 Å²	131.9	90%	0.897	80%	0.797	S	S	*	*			trans	-103.3	105.9	171.8	-169.6	172.8	130.2	0	0	107.3	A5	E3-A5 PolarHBondContact O-N 3.47Å; E3-A5 VanDerWaalsContact O-N 3.07Å
4	E	34	Very low	37.7	Very low	185 Å²	185	131.6 Å²	131.6	86%	0.864	78%	0.78	S	S	*	*			trans	-75.5	99.3	-176.1	-164.4	-176	-179.1	0	0	110	S6	E4-S6 VanDerWaalsContact C-N 3.31Å; E4-S6 PolarHBondContact O-N 2.65Å
5	A	32.9	Very low	39.3	Very low	93 Å²	93	128.3 Å²	128.3	77%	0.769	76%	0.763	S	S	*	*			trans	-70.1	83.1	179.8	0	0	0	0	0	111.6	E3 S7	E3-A5 PolarHBondContact O-N 3.47Å; E3-A5 VanDerWaalsContact O-N 3.07Å; A5-S7 PolarHBondContact O-N 2.81Å
6	S	33.8	Very low	40.8	Very low	109 Å²	109	124.9 Å²	124.9	76%	0.762	74%	0.737	S	S	*	*			trans	-52.2	129.4	-179.7	61.8	0	0	0	0	112.8	E4	E4-S6 VanDerWaalsContact C-N 3.31Å; E4-S6 PolarHBondContact O-N 2.65Å
7	S	35.7	Very low	42.2	Very low	118 Å²	118	119.1 Å²	119.1	83%	0.825	70%	0.701	S	S	*	*			trans	-75.9	132.4	-172.2	-63.8	0	0	0	0	113	A5 G9	A5-S7 PolarHBondContact O-N 2.81Å; S7-G9 PolarHBondContact O-N 3.28Å
8	P	37.5	Very low	43.7	Very low	130 Å²	130	115.6 Å²	115.6	84%	0.844	68%	0.677	S	S	*	*			trans	-83.5	112.3	-173.6	31.1	-34.7	0	0	0	114.4
9	G	32.3	Very low	45.2	Very low	70 Å²	70	117.6 Å²	117.6	72%	0.722	68%	0.677	S	S	*	*				82.7	58.5	129.8	0	0	0	0	0	120.8	S7 G11	S7-G9 PolarHBondContact O-N 3.28Å; G9-G11 PolarHBondContact O-N 2.74Å
10	L	41.8	Very low	46.8	Very low	164 Å²	164	112.5 Å²	112.5	86%	0.859	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	57.4	159.6	-83.4	83.8	0	0	0	112.5
11	G	35.7	Very low	48.2	Very low	63 Å²	63	107.1 Å²	107.1	65%	0.649	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-35.8	-173.4	0	0	0	0	0	115.9	G9	G9-G11 PolarHBondContact O-N 2.74Å
12	C	38.5	Very low	50.1	Low	118 Å²	118	101.2 Å²	101.2	80%	0.797	59%	0.589	S	S	*	*	S	Bend	trans	-95	-36.3	-161.7	-156.7	0	0	0	0	115	K14 P15	C12-K14 PolarHBondContact O-N 3.27Å; C12-P15 WeakPolarHBondContact O-CD 3.46Å
13	S	50.4	Low	52.1	Low	42 Å²	42	93.1 Å²	93.1	29%	0.294	56%	0.556	S	S	.	*	S	Bend	trans	-76.7	-21.2	-165.5	-54.1	0	0	0	0	116.2	H16 L17 E41	S13-H16 WeakPolarHBondContact O-CB 3.49Å; S13-H16 PolarHBondContact O-N 3.24Å; S13-L17 PolarHBondContact O-N 2.89Å; S13-L17 VanDerWaalsContact O-N 3.1Å; S13-E41 WeakPolarHBondContact CB-OE1 3.47Å; S13-E41 WeakPolarHBondContact CB-OE2 3.23Å; S13-E41 VanDerWaalsContact OG-CD 3.31Å; S13-E41 PolarHBondContact OG-OE1 3.17Å; S13-E41 VanDerWaalsContact OG-OE1 3.1Å; S13-E41 PolarHBondContact OG-OE2 2.97Å
14	K	55.1	Low	54.3	Low	128 Å²	128	84.2 Å²	84.2	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-49.4	-49.4	-171.2	-60.7	-168.8	179.1	-167.2	0	114.8	C12 H16 L17 E18	C12-K14 PolarHBondContact O-N 3.27Å; K14-H16 VanDerWaalsContact C-N 3.26Å; K14-H16 PolarHBondContact O-N 3.36Å; K14-L17 PolarHBondContact O-N 3.42Å; K14-E18 WeakPolarHBondContact O-CB 3.38Å; K14-E18 WeakPolarHBondContact O-CG 3.33Å; K14-E18 PolarHBondContact O-N 3.22Å
15	P	60.8	Low	56.4	Low	82 Å²	82	76 Å²	76	53%	0.532	48%	0.477	S	S	.	.	H	α-helix	trans	-70.6	-14	-179.7	28.9	-37.3	0	0	0	114.8	C12 K19	C12-P15 WeakPolarHBondContact O-CD 3.46Å; P15-K19 WeakPolarHBondContact O-CG 3.2Å
16	H	63.7	Low	58.4	Low	74 Å²	74	78.4 Å²	78.4	34%	0.343	47%	0.466	S	S	.	.	H	α-helix	trans	-82.9	-47.4	169.5	-175	-113	0	0	0	110.4	S13 K14 E18 K19 L20 M71	S13-H16 WeakPolarHBondContact O-CB 3.49Å; S13-H16 PolarHBondContact O-N 3.24Å; K14-H16 VanDerWaalsContact C-N 3.26Å; K14-H16 PolarHBondContact O-N 3.36Å; H16-E18 VanDerWaalsContact C-N 3.31Å; H16-E18 PolarHBondContact O-N 2.97Å; H16-K19 PolarHBondContact O-N 3.43Å; H16-K19 VanDerWaalsContact O-N 3.17Å; H16-L20 WeakPolarHBondContact O-CB 3.31Å; H16-L20 PolarHBondContact O-N 3.24Å; H16-M71 VanDerWaalsContact NE2-CE 3.34Å; H16-M71 WeakPolarHBondContact NE2-CE 3.49Å
17	L	65.7	Low	60.6	Low	25 Å²	25	77.9 Å²	77.9	13%	0.131	45%	0.454	C	S	.	.	H	α-helix	trans	-56.6	-41.7	174.9	-70.7	179.1	0	0	0	112.7	S13 K14 K19 L20 T21 I39 E41	S13-L17 PolarHBondContact O-N 2.89Å; S13-L17 VanDerWaalsContact O-N 3.1Å; K14-L17 PolarHBondContact O-N 3.42Å; L17-K19 VanDerWaalsContact C-N 3.34Å; L17-K19 PolarHBondContact O-N 3.09Å; L17-L20 PolarHBondContact O-N 3.15Å; L17-T21 WeakPolarHBondContact O-CB 3.25Å; L17-T21 WeakPolarHBondContact O-CG2 3.32Å; L17-T21 PolarHBondContact O-N 3.14Å; L17-T21 PolarHBondContact O-OG1 2.84Å; L17-I39 HydrophobicContact CD1-CD1 4.34Å; L17-I39 HydrophobicContact CD2-CB 4.22Å; L17-I39 HydrophobicContact CD2-CD1 4.08Å; L17-I39 HydrophobicContact CD2-CG2 3.65Å; L17-E41 HydrophobicContact CD2-CG 3.68Å; L17-E41 HydrophobicContact CG-CG 4.31Å
18	E	68.4	Low	62.7	Low	57 Å²	57	72.3 Å²	72.3	27%	0.266	42%	0.415	S	S	.	.	H	α-helix	trans	-65.8	-33.9	178.5	-74.8	178.4	169.1	0	0	113	K14 H16 L22 G23 R26	K14-E18 WeakPolarHBondContact O-CB 3.38Å; K14-E18 WeakPolarHBondContact O-CG 3.33Å; K14-E18 PolarHBondContact O-N 3.22Å; H16-E18 VanDerWaalsContact C-N 3.31Å; H16-E18 PolarHBondContact O-N 2.97Å; E18-L22 CarbonylContact O-C 3.52Å; E18-L22 VanDerWaalsContact O-CA 3.32Å; E18-L22 WeakPolarHBondContact O-CA 3.29Å; E18-L22 PolarHBondContact O-N 2.87Å; E18-L22 VanDerWaalsContact O-N 3.12Å; E18-G23 PolarHBondContact O-N 3.19Å; E18-R26 IonicContact OE1-CZ 3.17Å; E18-R26 IonicContact OE1-NE 2.76Å; E18-R26 PolarHBondContact OE1-NE 3.04Å; E18-R26 IonicContact OE1-NH2 2.77Å; E18-R26 PolarHBondContact OE1-NH2 2.99Å; E18-R26 IonicContact OE2-CZ 3.72Å; E18-R26 IonicContact OE2-NE 3.89Å; E18-R26 IonicContact OE2-NH2 2.87Å; E18-R26 PolarHBondContact OE2-NH2 3.25Å
19	K	72.8	Confident	64.6	Low	154 Å²	154	72.7 Å²	72.7	67%	0.67	41%	0.405	S	S	*	.	H	α-helix	trans	-71.6	-45.4	174.1	-71.7	175.5	-178.6	-178.6	0	111.5	P15 H16 L17 L22	P15-K19 WeakPolarHBondContact O-CG 3.2Å; H16-K19 PolarHBondContact O-N 3.43Å; H16-K19 VanDerWaalsContact O-N 3.17Å; L17-K19 VanDerWaalsContact C-N 3.34Å; L17-K19 PolarHBondContact O-N 3.09Å; K19-L22 WeakPolarHBondContact O-CD2 3.45Å; K19-L22 PolarHBondContact O-N 2.77Å
20	L	75.8	Confident	66.9	Low	14 Å²	14	74.1 Å²	74.1	7%	0.073	40%	0.404	C	S	.	.	H	α-helix	trans	-63.4	-48.1	-179.2	-173.9	157.1	0	0	0	110.8	H16 L17 L22 T72 F75 Y193	H16-L20 WeakPolarHBondContact O-CB 3.31Å; H16-L20 PolarHBondContact O-N 3.24Å; L17-L20 PolarHBondContact O-N 3.15Å; L20-L22 VanDerWaalsContact C-N 3.29Å; L20-L22 PolarHBondContact O-N 2.76Å; L20-T72 HydrophobicContact CD1-CG2 3.91Å; L20-F75 HydrophobicContact CD2-CD2 3.48Å; L20-F75 VanDerWaalsContact CD2-CD2 3.48Å; L20-F75 HydrophobicContact CD2-CE1 4.48Å; L20-F75 HydrophobicContact CD2-CE2 3.31Å; L20-F75 HydrophobicContact CD2-CG 4.16Å; L20-F75 HydrophobicContact CD2-CZ 3.85Å; L20-Y193 WeakPolarHBondContact CD2-OH 3.47Å; L20-Y193 WeakPolarHBondContact O-CE1 3.31Å; L20-Y193 PolarHBondContact O-OH 3.22Å
21	T	76.8	Confident	68.6	Low	1 Å²	1	68.6 Å²	68.6	1%	0.006	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	5.6	179.1	63.8	0	0	0	0	114.2	L17 G23 I24 I39 F75 M77	L17-T21 WeakPolarHBondContact O-CB 3.25Å; L17-T21 WeakPolarHBondContact O-CG2 3.32Å; L17-T21 PolarHBondContact O-N 3.14Å; L17-T21 PolarHBondContact O-OG1 2.84Å; T21-G23 PolarHBondContact O-N 2.65Å; T21-I24 WeakPolarHBondContact O-CB 3.29Å; T21-I24 WeakPolarHBondContact O-CD1 3.47Å; T21-I24 VanDerWaalsContact O-CG1 3.24Å; T21-I24 WeakPolarHBondContact O-CG1 3.41Å; T21-I24 PolarHBondContact O-N 3.01Å; T21-I39 HydrophobicContact CG2-CD1 3.88Å; T21-F75 HydrophobicContact CG2-CE2 4.25Å; T21-F75 HydrophobicContact CG2-CZ 4.02Å; T21-M77 HydrophobicContact CG2-SD 3.74Å
22	L	75.9	Confident	70.4	Confident	116 Å²	116	72 Å²	72	61%	0.607	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	34.2	-173.1	-63.2	177.2	0	0	0	114.1	E18 K19 L20 I197	E18-L22 CarbonylContact O-C 3.52Å; E18-L22 VanDerWaalsContact O-CA 3.32Å; E18-L22 WeakPolarHBondContact O-CA 3.29Å; E18-L22 PolarHBondContact O-N 2.87Å; E18-L22 VanDerWaalsContact O-N 3.12Å; K19-L22 WeakPolarHBondContact O-CD2 3.45Å; K19-L22 PolarHBondContact O-N 2.77Å; L20-L22 VanDerWaalsContact C-N 3.29Å; L20-L22 PolarHBondContact O-N 2.76Å; L22-I197 HydrophobicContact CB-CD1 4.3Å; L22-I197 HydrophobicContact CB-CG2 4.43Å; L22-I197 HydrophobicContact CD1-CD1 3.84Å; L22-I197 HydrophobicContact CD1-CG2 4.27Å; L22-I197 HydrophobicContact CG-CD1 3.95Å
23	G	74.4	Confident	72.3	Confident	20 Å²	20	68.1 Å²	68.1	21%	0.206	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	82	6.4	180	0	0	0	0	0	116.3	E18 T21 T25 R26	E18-G23 PolarHBondContact O-N 3.19Å; T21-G23 PolarHBondContact O-N 2.65Å; G23-T25 PolarHBondContact O-N 2.87Å; G23-T25 VanDerWaalsContact O-N 3.14Å; G23-R26 PolarHBondContact O-N 3.23Å; G23-R26 VanDerWaalsContact O-N 3.09Å
24	I	78.1	Confident	73.9	Confident	6 Å²	6	67.6 Å²	67.6	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-51.2	-38.3	178.3	-76.3	163.3	0	0	0	112.4	T21 R26 I27 L28 M77 M93 I197 L200	T21-I24 WeakPolarHBondContact O-CB 3.29Å; T21-I24 WeakPolarHBondContact O-CD1 3.47Å; T21-I24 VanDerWaalsContact O-CG1 3.24Å; T21-I24 WeakPolarHBondContact O-CG1 3.41Å; T21-I24 PolarHBondContact O-N 3.01Å; I24-R26 VanDerWaalsContact C-N 3.26Å; I24-R26 PolarHBondContact O-N 2.89Å; I24-I27 WeakPolarHBondContact O-CA 2.78Å; I24-I27 WeakPolarHBondContact O-CB 3.44Å; I24-I27 PolarHBondContact O-N 2.92Å; I24-L28 HydrophobicContact CG2-CD1 3.52Å; I24-L28 HydrophobicContact CG2-CG 3.77Å; I24-L28 PolarHBondContact O-N 2.84Å; I24-M77 HydrophobicContact CG2-CE 4.08Å; I24-M93 HydrophobicContact CD1-CE 4.24Å; I24-M93 HydrophobicContact CD1-SD 4.24Å; I24-M93 HydrophobicContact CG2-CE 4.32Å; I24-I197 HydrophobicContact CD1-CB 3.82Å; I24-I197 HydrophobicContact CD1-CG1 3.82Å; I24-I197 HydrophobicContact CD1-CG2 3.58Å; I24-I197 WeakPolarHBondContact CD1-O 3.41Å; I24-I197 HydrophobicContact CG1-CG2 4.33Å; I24-L200 HydrophobicContact CB-CD2 4.45Å; I24-L200 HydrophobicContact CD1-CD2 4.1Å; I24-L200 HydrophobicContact CG1-CD2 3.87Å; I24-L200 HydrophobicContact CG2-CD2 3.74Å
25	T	77.3	Confident	75.1	Confident	12 Å²	12	63.5 Å²	63.5	7%	0.074	35%	0.351	C	S	.	.	H	α-helix	trans	-48.2	-49.3	177.8	46.6	0	0	0	0	111.9	G23 I27 L28 E29 I39 M77	G23-T25 PolarHBondContact O-N 2.87Å; G23-T25 VanDerWaalsContact O-N 3.14Å; T25-I27 VanDerWaalsContact C-N 3.34Å; T25-I27 PolarHBondContact O-N 2.98Å; T25-L28 PolarHBondContact O-N 3.49Å; T25-E29 VanDerWaalsContact O-CB 3.31Å; T25-E29 WeakPolarHBondContact O-CB 3.39Å; T25-E29 WeakPolarHBondContact O-CG 3.41Å; T25-E29 PolarHBondContact O-N 2.86Å; T25-I39 HydrophobicContact CG2-CD1 3.49Å; T25-I39 VanDerWaalsContact CG2-CD1 3.49Å; T25-M77 HydrophobicContact CG2-CE 3.99Å
26	R	76.7	Confident	76.2	Confident	143 Å²	143	64.7 Å²	64.7	54%	0.54	35%	0.349	S	S	.	.	H	α-helix	trans	-67.1	-33.1	179.5	-59.5	-173.4	-176.9	-171.3	5.6	112.8	E18 G23 I24 S30	E18-R26 IonicContact OE1-CZ 3.17Å; E18-R26 IonicContact OE1-NE 2.76Å; E18-R26 PolarHBondContact OE1-NE 3.04Å; E18-R26 IonicContact OE1-NH2 2.77Å; E18-R26 PolarHBondContact OE1-NH2 2.99Å; E18-R26 IonicContact OE2-CZ 3.72Å; E18-R26 IonicContact OE2-NE 3.89Å; E18-R26 IonicContact OE2-NH2 2.87Å; E18-R26 PolarHBondContact OE2-NH2 3.25Å; G23-R26 PolarHBondContact O-N 3.23Å; G23-R26 VanDerWaalsContact O-N 3.09Å; I24-R26 VanDerWaalsContact C-N 3.26Å; I24-R26 PolarHBondContact O-N 2.89Å; R26-S30 VanDerWaalsContact O-CB 3.23Å; R26-S30 WeakPolarHBondContact O-CB 3.24Å; R26-S30 PolarHBondContact O-N 2.91Å; R26-S30 PolarHBondContact O-OG 3.21Å
27	I	78.7	Confident	77.2	Confident	98 Å²	98	63.2 Å²	63.2	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-69.8	-43.5	178.1	-57.3	175.9	0	0	0	110	I24 T25 S30 S31	I24-I27 WeakPolarHBondContact O-CA 2.78Å; I24-I27 WeakPolarHBondContact O-CB 3.44Å; I24-I27 PolarHBondContact O-N 2.92Å; T25-I27 VanDerWaalsContact C-N 3.34Å; T25-I27 PolarHBondContact O-N 2.98Å; I27-S30 PolarHBondContact O-N 2.82Å; I27-S31 PolarHBondContact O-N 2.68Å; I27-S31 PolarHBondContact O-OG 3.04Å
28	L	79.4	Confident	78.1	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-66.2	-48.7	175.2	-71.9	178.9	0	0	0	111.6	I24 T25 S30 S31 V34 V37 M77 W79 L200	I24-L28 HydrophobicContact CG2-CD1 3.52Å; I24-L28 HydrophobicContact CG2-CG 3.77Å; I24-L28 PolarHBondContact O-N 2.84Å; T25-L28 PolarHBondContact O-N 3.49Å; L28-S30 PolarHBondContact O-N 2.8Å; L28-S31 WeakPolarHBondContact O-CB 3.37Å; L28-S31 PolarHBondContact O-N 2.88Å; L28-V34 HydrophobicContact CB-CG1 4.09Å; L28-V34 WeakPolarHBondContact O-CB 3.34Å; L28-V37 HydrophobicContact CB-CG2 4.14Å; L28-V37 HydrophobicContact CD1-CG1 4.4Å; L28-M77 HydrophobicContact CD1-CE 3.68Å; L28-W79 HydrophobicContact CD1-CB 4.11Å; L28-W79 HydrophobicContact CD1-CD2 4.04Å; L28-W79 HydrophobicContact CD1-CG 3.69Å; L28-W79 HydrophobicContact CD2-CD2 3.66Å; L28-W79 HydrophobicContact CD2-CE3 3.82Å; L28-W79 HydrophobicContact CD2-CG 4.22Å; L28-W79 HydrophobicContact CD2-CH2 3.97Å; L28-W79 HydrophobicContact CD2-CZ2 3.85Å; L28-W79 HydrophobicContact CD2-CZ3 3.96Å; L28-L200 HydrophobicContact CD2-CD1 4.36Å
29	E	77.9	Confident	78.9	Confident	138 Å²	138	64.4 Å²	64.4	65%	0.645	36%	0.356	S	S	*	.	H	α-helix	trans	-60.5	-28	175.6	-72.5	166.9	-175.7	0	0	113	T25	T25-E29 VanDerWaalsContact O-CB 3.31Å; T25-E29 WeakPolarHBondContact O-CB 3.39Å; T25-E29 WeakPolarHBondContact O-CG 3.41Å; T25-E29 PolarHBondContact O-N 2.86Å
30	S	80.1	Confident	79.5	Confident	100 Å²	100	61.3 Å²	61.3	70%	0.699	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-8.7	174.6	-57.9	0	0	0	0	114	R26 I27 L28	R26-S30 VanDerWaalsContact O-CB 3.23Å; R26-S30 WeakPolarHBondContact O-CB 3.24Å; R26-S30 PolarHBondContact O-N 2.91Å; R26-S30 PolarHBondContact O-OG 3.21Å; I27-S30 PolarHBondContact O-N 2.82Å; L28-S30 PolarHBondContact O-N 2.8Å
31	S	78.9	Confident	79.6	Confident	47 Å²	47	65.5 Å²	65.5	33%	0.329	37%	0.365	S	S	.	.	S	Bend	trans	-90.4	122.3	-173.4	-67.7	0	0	0	0	111.2	I27 L28 G33 V34	I27-S31 PolarHBondContact O-N 2.68Å; I27-S31 PolarHBondContact O-OG 3.04Å; L28-S31 WeakPolarHBondContact O-CB 3.37Å; L28-S31 PolarHBondContact O-N 2.88Å; S31-G33 PolarHBondContact O-N 2.88Å; S31-V34 PolarHBondContact O-N 3.4Å; S31-V34 VanDerWaalsContact O-N 3.15Å
32	P	72.4	Confident	80	Confident	136 Å²	136	67.9 Å²	67.9	88%	0.883	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	124.1	-174.2	25.3	-34	0	0	0	111.3
33	G	77.9	Confident	80.4	Confident	36 Å²	36	67.2 Å²	67.2	37%	0.371	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-10.6	-179.3	0	0	0	0	0	115.2	S31 V81 K82	S31-G33 PolarHBondContact O-N 2.88Å; G33-V81 CarbonylContact O-C 3.29Å; G33-V81 VanDerWaalsContact O-CA 3.29Å; G33-V81 WeakPolarHBondContact O-CA 3.38Å; G33-K82 PolarHBondContact O-N 2.76Å
34	V	83.9	Confident	81.2	Confident	30 Å²	30	70.1 Å²	70.1	18%	0.182	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	135.9	176	174.8	0	0	0	0	111.1	L28 S31 V37 W79 S80 V81	L28-V34 HydrophobicContact CB-CG1 4.09Å; L28-V34 WeakPolarHBondContact O-CB 3.34Å; S31-V34 PolarHBondContact O-N 3.4Å; S31-V34 VanDerWaalsContact O-N 3.15Å; V34-V37 HydrophobicContact CG1-CG2 3.65Å; V34-W79 HydrophobicContact CG1-CE3 4.05Å; V34-W79 HydrophobicContact CG2-CE3 4.12Å; V34-W79 HydrophobicContact CG2-CZ3 3.98Å; V34-S80 WeakPolarHBondContact CA-O 3.17Å; V34-V81 HydrophobicContact CG2-CG2 4.14Å
35	T	81.4	Confident	81.8	Confident	43 Å²	43	70 Å²	70	26%	0.264	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	168.3	-179.1	57.9	0	0	0	0	111.2	V37 S80 K82	T35-V37 PolarHBondContact O-N 3.34Å; T35-V37 VanDerWaalsContact O-N 3.08Å; T35-S80 PolarHBondContact N-O 3.01Å; T35-S80 CarbonylContact O-C 3.55Å; T35-S80 WeakPolarHBondContact O-CA 3.48Å; T35-S80 PolarHBondContact O-N 2.81Å; T35-S80 VanDerWaalsContact O-O 3.06Å; T35-K82 HydrophobicContact CG2-CB 3.82Å
36	E	83	Confident	82.6	Confident	107 Å²	107	74.1 Å²	74.1	50%	0.5	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.6	28.3	172.1	-52.3	-176.2	144.6	0	0	115.9	T38 S80 I87	E36-T38 PolarHBondContact O-N 3.12Å; E36-T38 PolarHBondContact O-OG1 2.96Å; E36-S80 VanDerWaalsContact OE2-CB 3.31Å; E36-S80 WeakPolarHBondContact OE2-CB 2.96Å; E36-S80 PolarHBondContact OE2-OG 3.1Å; E36-I87 HydrophobicContact CG-CG2 4.29Å; E36-I87 VanDerWaalsContact OE2-CG2 3.24Å; E36-I87 WeakPolarHBondContact OE2-CG2 3.44Å
37	V	84.9	Confident	83.3	Confident	43 Å²	43	75.4 Å²	75.4	26%	0.261	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	107.8	174.8	-174.7	0	0	0	0	109.1	L28 V34 T35 M77 W79	L28-V37 HydrophobicContact CB-CG2 4.14Å; L28-V37 HydrophobicContact CD1-CG1 4.4Å; V34-V37 HydrophobicContact CG1-CG2 3.65Å; T35-V37 PolarHBondContact O-N 3.34Å; T35-V37 VanDerWaalsContact O-N 3.08Å; V37-M77 HydrophobicContact CG1-CE 3.62Å; V37-W79 HydrophobicContact CG2-CB 4.05Å
38	T	84.8	Confident	84	Confident	71 Å²	71	75.9 Å²	75.9	44%	0.436	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.9	-170.7	-58.2	0	0	0	0	108.9	E36 M77 T78	E36-T38 PolarHBondContact O-N 3.12Å; E36-T38 PolarHBondContact O-OG1 2.96Å; T38-M77 CarbonylContact O-C 3.52Å; T38-M77 VanDerWaalsContact O-CA 3.28Å; T38-M77 WeakPolarHBondContact O-CA 3.45Å; T38-T78 PolarHBondContact N-O 2.93Å; T38-T78 PolarHBondContact O-N 2.86Å
39	I	84.8	Confident	84.6	Confident	36 Å²	36	79 Å²	79	19%	0.185	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.8	173.8	-56.4	170.3	0	0	0	109	L17 T21 T25 E41 F75 M77	L17-I39 HydrophobicContact CD1-CD1 4.34Å; L17-I39 HydrophobicContact CD2-CB 4.22Å; L17-I39 HydrophobicContact CD2-CD1 4.08Å; L17-I39 HydrophobicContact CD2-CG2 3.65Å; T21-I39 HydrophobicContact CG2-CD1 3.88Å; T25-I39 HydrophobicContact CG2-CD1 3.49Å; T25-I39 VanDerWaalsContact CG2-CD1 3.49Å; I39-E41 PolarHBondContact O-N 2.7Å; I39-F75 HydrophobicContact CG2-CE2 3.97Å; I39-M77 HydrophobicContact CD1-CE 4.06Å; I39-M77 HydrophobicContact CD1-CG 4.42Å; I39-M77 HydrophobicContact CD1-SD 3.83Å; I39-M77 HydrophobicContact CG1-CB 4.01Å; I39-M77 HydrophobicContact CG1-CE 4.13Å; I39-M77 HydrophobicContact CG1-CG 3.67Å; I39-M77 HydrophobicContact CG1-SD 3.76Å
40	I	85.7	Confident	85.2	Confident	88 Å²	88	72.6 Å²	72.6	45%	0.451	40%	0.402	S	S	.	.			trans	-92.5	97.6	171.7	-50.6	-175.5	0	0	0	107.8	K42 H76	I40-K42 HydrophobicContact CG2-CG 4.48Å; I40-K42 PolarHBondContact O-N 3.47Å; I40-H76 HydrophobicContact CB-CB 4.21Å; I40-H76 HydrophobicContact CD1-CB 4.18Å; I40-H76 HydrophobicContact CG1-CB 4.29Å; I40-H76 PolarHBondContact N-O 3.03Å
41	E	77.6	Confident	85.8	Confident	102 Å²	102	70.2 Å²	70.2	48%	0.477	39%	0.385	S	S	.	.			trans	-58.9	125.9	167.4	-72.8	173.5	-131.1	0	0	109.6	S13 L17 I39	S13-E41 WeakPolarHBondContact CB-OE1 3.47Å; S13-E41 WeakPolarHBondContact CB-OE2 3.23Å; S13-E41 VanDerWaalsContact OG-CD 3.31Å; S13-E41 PolarHBondContact OG-OE1 3.17Å; S13-E41 VanDerWaalsContact OG-OE1 3.1Å; S13-E41 PolarHBondContact OG-OE2 2.97Å; L17-E41 HydrophobicContact CD2-CG 3.68Å; L17-E41 HydrophobicContact CG-CG 4.31Å; I39-E41 PolarHBondContact O-N 2.7Å
42	K	85.2	Confident	86.4	Confident	52 Å²	52	71 Å²	71	23%	0.226	39%	0.391	C	S	.	.			trans	-115.5	135.7	172.9	-59.8	-179.8	-163.3	163.1	0	107.6	I40 T72 N73 F75 I95	I40-K42 HydrophobicContact CG2-CG 4.48Å; I40-K42 PolarHBondContact O-N 3.47Å; K42-T72 PolarHBondContact O-OG1 3.06Å; K42-N73 WeakPolarHBondContact CD-O 3.42Å; K42-F75 PolarHBondContact NZ-O 3.08Å; K42-I95 PolarHBondContact NZ-O 2.82Å; K42-I95 VanDerWaalsContact NZ-O 3.14Å
43	P	86	Confident	87.3	Confident	101 Å²	101	65.4 Å²	65.4	66%	0.656	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-62.7	158.1	175.9	28.2	-35.3	0	0	0	110.5	N73	P43-N73 WeakPolarHBondContact O-CB 3.19Å; P43-N73 PolarHBondContact O-N 2.87Å
44	P	90.3	Very high	88	Confident	82 Å²	82	65.2 Å²	65.2	53%	0.532	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-48.8	146	168.7	-29.8	36.4	0	0	0	113.2
45	A	91.8	Very high	88.2	Confident	4 Å²	4	71.2 Å²	71.2	3%	0.033	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-74.8	137.4	165.8	0	0	0	0	0	109.4	I50 Y69 N73 I98	A45-I50 HydrophobicContact CB-CG1 4.49Å; A45-Y69 VanDerWaalsContact CB-O 3.26Å; A45-Y69 WeakPolarHBondContact CB-O 3.4Å; A45-Y69 PolarHBondContact N-O 2.93Å; A45-N73 HydrophobicContact CB-CB 4.1Å; A45-I98 HydrophobicContact CB-CG2 4.33Å
46	E	92.9	Very high	88.6	Confident	97 Å²	97	77.6 Å²	77.6	45%	0.453	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-72.9	144.4	175.1	-144.1	-57	98	0	0	109.7	H48 M49 I50	E46-H48 PolarHBondContact O-N 3.37Å; E46-H48 VanDerWaalsContact O-N 3.16Å; E46-H48 IonicContact OE2-CE1 3.78Å; E46-H48 IonicContact OE2-CG 2.85Å; E46-H48 PolarHBondContact OE2-N 3.39Å; E46-H48 IonicContact OE2-ND1 3.25Å; E46-H48 PolarHBondContact OE2-ND1 2.9Å; E46-M49 HydrophobicContact CB-CG 4.31Å; E46-M49 VanDerWaalsContact O-CB 3.31Å; E46-M49 WeakPolarHBondContact O-CB 3.32Å; E46-M49 PolarHBondContact O-N 2.98Å; E46-I50 PolarHBondContact O-N 3.43Å
47	R	91.9	Very high	88.8	Confident	170 Å²	170	73.3 Å²	73.3	64%	0.642	37%	0.372	S	S	*	.	H	α-helix	trans	-48.9	-41.1	176.2	-69.6	179.8	179.2	-88.1	-2.9	112.3	M49 I50 S51 L70	R47-M49 VanDerWaalsContact C-N 3.29Å; R47-M49 PolarHBondContact O-N 3.26Å; R47-I50 PolarHBondContact O-N 2.93Å; R47-S51 PolarHBondContact O-N 3.47Å; R47-S51 PolarHBondContact O-OG 3.15Å; R47-L70 HydrophobicContact CG-CD2 3.67Å
48	H	92.4	Very high	88.8	Confident	108 Å²	108	75.5 Å²	75.5	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-65.1	-28.8	177.8	77.6	-103.1	0	0	0	113.8	E46 I50 S52	E46-H48 PolarHBondContact O-N 3.37Å; E46-H48 VanDerWaalsContact O-N 3.16Å; E46-H48 IonicContact OE2-CE1 3.78Å; E46-H48 IonicContact OE2-CG 2.85Å; E46-H48 PolarHBondContact OE2-N 3.39Å; E46-H48 IonicContact OE2-ND1 3.25Å; E46-H48 PolarHBondContact OE2-ND1 2.9Å; H48-I50 VanDerWaalsContact C-N 3.34Å; H48-S52 VanDerWaalsContact O-CB 3.22Å; H48-S52 WeakPolarHBondContact O-CB 3.38Å; H48-S52 PolarHBondContact O-N 3.33Å; H48-S52 PolarHBondContact O-OG 3.44Å
49	M	92.1	Very high	88.9	Confident	68 Å²	68	72.4 Å²	72.4	34%	0.335	36%	0.363	S	S	.	.	H	α-helix	trans	-68.1	-38.6	175.6	-68.2	-72.3	-68.9	0	0	110.7	E46 R47 W53 I98 S99	E46-M49 HydrophobicContact CB-CG 4.31Å; E46-M49 VanDerWaalsContact O-CB 3.31Å; E46-M49 WeakPolarHBondContact O-CB 3.32Å; E46-M49 PolarHBondContact O-N 2.98Å; R47-M49 VanDerWaalsContact C-N 3.29Å; R47-M49 PolarHBondContact O-N 3.26Å; M49-W53 WeakPolarHBondContact O-CB 3.49Å; M49-W53 PolarHBondContact O-N 2.98Å; M49-I98 HydrophobicContact CB-CG2 4.35Å; M49-S99 WeakPolarHBondContact CE-OG 3.13Å
50	I	91.6	Very high	89.1	Confident	4 Å²	4	74 Å²	74	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-66.4	-52	175.6	-51.5	-176	0	0	0	109.8	A45 E46 R47 H48 S52 W53 E54 M61 K66 L70 I98	A45-I50 HydrophobicContact CB-CG1 4.49Å; E46-I50 PolarHBondContact O-N 3.43Å; R47-I50 PolarHBondContact O-N 2.93Å; H48-I50 VanDerWaalsContact C-N 3.34Å; I50-S52 VanDerWaalsContact C-N 3.28Å; I50-S52 PolarHBondContact O-N 3Å; I50-W53 WeakPolarHBondContact O-CA 3.34Å; I50-W53 WeakPolarHBondContact O-CB 3.43Å; I50-W53 PolarHBondContact O-N 2.94Å; I50-E54 HydrophobicContact CG2-CG 4.39Å; I50-E54 WeakPolarHBondContact O-CG 3.1Å; I50-E54 PolarHBondContact O-N 3.41Å; I50-M61 HydrophobicContact CG2-CB 4.43Å; I50-M61 HydrophobicContact CG2-SD 3.76Å; I50-K66 HydrophobicContact CD1-CG 4.12Å; I50-K66 HydrophobicContact CG2-CG 4.33Å; I50-L70 HydrophobicContact CD1-CD2 3.7Å; I50-L70 HydrophobicContact CD1-CG 3.71Å; I50-I98 HydrophobicContact CB-CD1 4.09Å; I50-I98 HydrophobicContact CG1-CD1 3.81Å; I50-I98 HydrophobicContact CG2-CD1 4.23Å
51	S	91.9	Very high	89.3	Confident	50 Å²	50	69.9 Å²	69.9	35%	0.35	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-33	178.2	-57.1	0	0	0	0	113.3	R47 Q55	R47-S51 PolarHBondContact O-N 3.47Å; R47-S51 PolarHBondContact O-OG 3.15Å; S51-Q55 WeakPolarHBondContact O-CB 3.38Å; S51-Q55 WeakPolarHBondContact O-CG 3.14Å; S51-Q55 PolarHBondContact O-N 3.27Å
52	S	92.6	Very high	89.9	Confident	64 Å²	64	65.2 Å²	65.2	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-67.9	-36.1	173	-61.5	0	0	0	0	112.3	H48 I50 K56	H48-S52 VanDerWaalsContact O-CB 3.22Å; H48-S52 WeakPolarHBondContact O-CB 3.38Å; H48-S52 PolarHBondContact O-N 3.33Å; H48-S52 PolarHBondContact O-OG 3.44Å; I50-S52 VanDerWaalsContact C-N 3.28Å; I50-S52 PolarHBondContact O-N 3Å; S52-K56 WeakPolarHBondContact O-CB 3.41Å; S52-K56 PolarHBondContact O-N 3.1Å
53	W	91.4	Very high	90.2	Very high	18 Å²	18	68.3 Å²	68.3	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-70.1	-43.3	174.7	-178.8	100.7	0	0	0	111.2	M49 I50 K56 N57 C59 M61 I98 L101 F145	M49-W53 WeakPolarHBondContact O-CB 3.49Å; M49-W53 PolarHBondContact O-N 2.98Å; I50-W53 WeakPolarHBondContact O-CA 3.34Å; I50-W53 WeakPolarHBondContact O-CB 3.43Å; I50-W53 PolarHBondContact O-N 2.94Å; W53-K56 PolarHBondContact O-N 3.11Å; W53-N57 VanDerWaalsContact CE2-ND2 3.3Å; W53-N57 PolarHBondContact NE1-ND2 3.19Å; W53-N57 WeakPolarHBondContact O-CB 3.26Å; W53-N57 PolarHBondContact O-N 3Å; W53-N57 PolarHBondContact O-ND2 3.01Å; W53-C59 VanDerWaalsContact CH2-SG 3.6Å; W53-C59 WeakPolarHBondContact CZ3-SG 3.21Å; W53-M61 HydrophobicContact CD2-CE 4Å; W53-M61 HydrophobicContact CE3-CB 4.5Å; W53-M61 HydrophobicContact CE3-CE 3.65Å; W53-M61 HydrophobicContact CH2-CE 4.11Å; W53-M61 HydrophobicContact CZ2-CE 4.39Å; W53-M61 HydrophobicContact CZ3-CB 4.08Å; W53-M61 HydrophobicContact CZ3-CE 3.72Å; W53-I98 HydrophobicContact CB-CD1 3.83Å; W53-I98 HydrophobicContact CB-CG1 3.98Å; W53-I98 HydrophobicContact CD2-CD1 4.49Å; W53-I98 HydrophobicContact CD2-CG1 4.39Å; W53-I98 HydrophobicContact CG-CD1 4.02Å; W53-I98 HydrophobicContact CG-CG1 3.79Å; W53-L101 HydrophobicContact CH2-CD2 4.21Å; W53-L101 HydrophobicContact CZ2-CD2 3.47Å; W53-L101 VanDerWaalsContact CZ2-CD2 3.47Å; W53-L101 HydrophobicContact CZ2-CG 3.79Å; W53-L101 PolarHBondContact NE1-O 3.13Å; W53-L101 VanDerWaalsContact NE1-O 3.1Å; W53-F145 HydrophobicContact CH2-CD1 4.26Å; W53-F145 HydrophobicContact CH2-CD2 4.14Å; W53-F145 HydrophobicContact CH2-CE1 4.06Å; W53-F145 AromaticContact CH2-CE2 3.91Å; W53-F145 HydrophobicContact CH2-CE2 3.91Å; W53-F145 HydrophobicContact CH2-CG 4.3Å; W53-F145 AromaticContact CH2-CZ 3.87Å; W53-F145 HydrophobicContact CH2-CZ 3.87Å; W53-F145 AromaticContact CZ2-CD1 3.49Å; W53-F145 HydrophobicContact CZ2-CD1 3.49Å; W53-F145 VanDerWaalsContact CZ2-CD1 3.49Å; W53-F145 HydrophobicContact CZ2-CD2 4.11Å; W53-F145 AromaticContact CZ2-CE1 3.51Å; W53-F145 HydrophobicContact CZ2-CE1 3.51Å; W53-F145 HydrophobicContact CZ2-CE2 4.11Å; W53-F145 AromaticContact CZ2-CG 3.8Å; W53-F145 HydrophobicContact CZ2-CG 3.8Å; W53-F145 AromaticContact CZ2-CZ 3.83Å; W53-F145 HydrophobicContact CZ2-CZ 3.83Å
54	E	91.3	Very high	90.5	Very high	31 Å²	31	65.4 Å²	65.4	15%	0.145	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-49.3	176.5	-69.4	175.4	127.3	0	0	111	I50 N57 N58 C59 M61 K66	I50-E54 HydrophobicContact CG2-CG 4.39Å; I50-E54 WeakPolarHBondContact O-CG 3.1Å; I50-E54 PolarHBondContact O-N 3.41Å; E54-N57 PolarHBondContact O-N 3.16Å; E54-N58 WeakPolarHBondContact O-CA 3.22Å; E54-N58 PolarHBondContact O-N 3.31Å; E54-C59 WeakPolarHBondContact CA-O 3.45Å; E54-C59 VanDerWaalsContact CB-O 3.31Å; E54-C59 WeakPolarHBondContact CB-O 3.47Å; E54-C59 PolarHBondContact O-N 3.25Å; E54-M61 HydrophobicContact CG-CB 4.06Å; E54-M61 PolarHBondContact OE1-N 3.28Å; E54-K66 VanDerWaalsContact OE1-CE 3.27Å; E54-K66 WeakPolarHBondContact OE1-CE 3.41Å; E54-K66 IonicContact OE1-NZ 3.74Å; E54-K66 PolarHBondContact OE1-NZ 3.46Å
55	Q	89.6	Confident	90.6	Very high	157 Å²	157	61.5 Å²	61.5	73%	0.734	30%	0.301	S	S	*	.	H	α-helix	trans	-62.9	-42.7	176.4	-71.8	170.3	28.2	0	0	112.9	S51 N57	S51-Q55 WeakPolarHBondContact O-CB 3.38Å; S51-Q55 WeakPolarHBondContact O-CG 3.14Å; S51-Q55 PolarHBondContact O-N 3.27Å; Q55-N57 VanDerWaalsContact C-N 3.35Å; Q55-N57 PolarHBondContact O-N 3.23Å
56	K	89.4	Confident	90.7	Very high	177 Å²	177	62.9 Å²	62.9	77%	0.77	31%	0.306	S	S	*	.	H	α-helix	trans	-63.4	-39.7	-180	176.9	-177.7	174.3	-173.5	0	112.4	S52 W53	S52-K56 WeakPolarHBondContact O-CB 3.41Å; S52-K56 PolarHBondContact O-N 3.1Å; W53-K56 PolarHBondContact O-N 3.11Å
57	N	85.6	Confident	90.7	Very high	16 Å²	16	62.2 Å²	62.2	9%	0.086	31%	0.305	C	S	.	.	H	α-helix	trans	-95	-15.9	-174.2	-63.1	-63.2	0	0	0	113.2	W53 E54 Q55 C59 F145 K164	W53-N57 VanDerWaalsContact CE2-ND2 3.3Å; W53-N57 PolarHBondContact NE1-ND2 3.19Å; W53-N57 WeakPolarHBondContact O-CB 3.26Å; W53-N57 PolarHBondContact O-N 3Å; W53-N57 PolarHBondContact O-ND2 3.01Å; E54-N57 PolarHBondContact O-N 3.16Å; Q55-N57 VanDerWaalsContact C-N 3.35Å; Q55-N57 PolarHBondContact O-N 3.23Å; N57-C59 VanDerWaalsContact CB-SG 3.59Å; N57-F145 HydrophobicContact CB-CE1 4.01Å; N57-F145 HydrophobicContact CB-CZ 3.89Å; N57-K164 WeakPolarHBondContact O-CE 3.37Å; N57-K164 PolarHBondContact O-NZ 2.75Å
58	N	85.9	Confident	90.7	Very high	90 Å²	90	55.1 Å²	55.1	48%	0.481	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	52.9	-173.6	-165.6	47.7	0	0	0	112.9	E54 K164	E54-N58 WeakPolarHBondContact O-CA 3.22Å; E54-N58 PolarHBondContact O-N 3.31Å; N58-K164 HydrophobicContact CB-CD 4.36Å
59	C	86.2	Confident	90.7	Very high	6 Å²	6	50 Å²	50	4%	0.041	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-143.7	154.7	174.5	56	0	0	0	0	110	W53 E54 N57 Y160 A166	W53-C59 VanDerWaalsContact CH2-SG 3.6Å; W53-C59 WeakPolarHBondContact CZ3-SG 3.21Å; E54-C59 WeakPolarHBondContact CA-O 3.45Å; E54-C59 VanDerWaalsContact CB-O 3.31Å; E54-C59 WeakPolarHBondContact CB-O 3.47Å; E54-C59 PolarHBondContact O-N 3.25Å; N57-C59 VanDerWaalsContact CB-SG 3.59Å; C59-Y160 HydrophobicContact CB-CD1 4.49Å; C59-Y160 HydrophobicContact CB-CE1 4.02Å; C59-A166 WeakPolarHBondContact CA-O 3.42Å; C59-A166 HydrophobicContact CB-CB 3.82Å
60	V	89.3	Confident	90.6	Very high	69 Å²	69	48.7 Å²	48.7	42%	0.418	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-99.4	120.6	176.2	-173.8	0	0	0	0	109	Y160 A166 A168	V60-Y160 WeakPolarHBondContact O-CE1 3.26Å; V60-Y160 PolarHBondContact O-OH 3.38Å; V60-A166 PolarHBondContact N-O 3.47Å; V60-A168 HydrophobicContact CB-CB 4.2Å; V60-A168 HydrophobicContact CG1-CB 3.99Å
61	M	90	Very high	90.4	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-69.4	129.5	-178.3	179.4	174.2	-78.6	0	0	110.7	I50 W53 E54 V65 K66 Y69 I98 L101	I50-M61 HydrophobicContact CG2-CB 4.43Å; I50-M61 HydrophobicContact CG2-SD 3.76Å; W53-M61 HydrophobicContact CD2-CE 4Å; W53-M61 HydrophobicContact CE3-CB 4.5Å; W53-M61 HydrophobicContact CE3-CE 3.65Å; W53-M61 HydrophobicContact CH2-CE 4.11Å; W53-M61 HydrophobicContact CZ2-CE 4.39Å; W53-M61 HydrophobicContact CZ3-CB 4.08Å; W53-M61 HydrophobicContact CZ3-CE 3.72Å; E54-M61 HydrophobicContact CG-CB 4.06Å; E54-M61 PolarHBondContact OE1-N 3.28Å; M61-V65 HydrophobicContact CE-CG1 4.13Å; M61-V65 HydrophobicContact CG-CB 3.94Å; M61-V65 HydrophobicContact CG-CG1 3.81Å; M61-V65 HydrophobicContact SD-CB 4.37Å; M61-V65 HydrophobicContact SD-CG1 3.77Å; M61-K66 HydrophobicContact CG-CB 4.13Å; M61-K66 PolarHBondContact O-NZ 3.27Å; M61-K66 HydrophobicContact SD-CB 4.18Å; M61-Y69 HydrophobicContact CE-CD2 3.93Å; M61-Y69 HydrophobicContact CE-CE2 4Å; M61-Y69 HydrophobicContact SD-CD2 3.76Å; M61-Y69 HydrophobicContact SD-CE2 4.34Å; M61-I98 HydrophobicContact CE-CD1 3.63Å; M61-I98 HydrophobicContact CE-CG1 4.13Å; M61-I98 HydrophobicContact SD-CD1 4.35Å; M61-L101 HydrophobicContact CE-CD2 3.89Å
62	P	91.4	Very high	90.4	Very high	4 Å²	4	50.1 Å²	50.1	3%	0.026	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-49.6	143.7	174.3	-31.1	36.6	0	0	0	113	D64 V65 K66 L158 Y160 T171	P62-D64 VanDerWaalsContact C-N 3.25Å; P62-D64 PolarHBondContact O-N 3.36Å; P62-V65 HydrophobicContact CB-CB 4.3Å; P62-V65 HydrophobicContact CB-CG2 4Å; P62-V65 HydrophobicContact CG-CG2 4.29Å; P62-V65 PolarHBondContact O-N 3.1Å; P62-K66 WeakPolarHBondContact O-CB 3.22Å; P62-K66 PolarHBondContact O-N 3.2Å; P62-L158 HydrophobicContact CG-CD1 4.48Å; P62-Y160 WeakPolarHBondContact CD-OH 3.33Å; P62-T171 HydrophobicContact CG-CG2 3.5Å; P62-T171 VanDerWaalsContact CG-CG2 3.5Å; P62-T171 VanDerWaalsContact CG-OG1 3.27Å; P62-T171 WeakPolarHBondContact CG-OG1 3.39Å
63	E	91.1	Very high	90.3	Very high	118 Å²	118	48.4 Å²	48.4	55%	0.551	24%	0.238	S	C	*	.	H	α-helix	trans	-66.1	-27.8	-171.8	-173.9	56.6	-160.4	0	0	112.3	K66 N67	E63-K66 WeakPolarHBondContact OE2-CD 3.47Å; E63-N67 VanDerWaalsContact CD-ND2 3.32Å; E63-N67 WeakPolarHBondContact CG-ND2 3.33Å; E63-N67 WeakPolarHBondContact O-CB 3.37Å; E63-N67 PolarHBondContact O-N 3.05Å; E63-N67 PolarHBondContact O-ND2 2.99Å; E63-N67 PolarHBondContact OE1-ND2 2.88Å
64	D	92.4	Very high	90.2	Very high	40 Å²	40	47.6 Å²	47.6	21%	0.214	24%	0.235	C	C	.	.	H	α-helix	trans	-77.4	-42.3	175.1	69.7	-19.7	0	0	0	113.2	P62 K66 N67 F68 F189 T190	P62-D64 VanDerWaalsContact C-N 3.25Å; P62-D64 PolarHBondContact O-N 3.36Å; D64-K66 VanDerWaalsContact C-N 3.28Å; D64-K66 PolarHBondContact O-N 2.88Å; D64-N67 PolarHBondContact O-N 3.29Å; D64-F68 WeakPolarHBondContact O-CB 3.47Å; D64-F68 PolarHBondContact O-N 2.86Å; D64-F189 PolarHBondContact OD2-N 3.38Å; D64-F189 VanDerWaalsContact OD2-N 3.13Å; D64-T190 WeakPolarHBondContact CB-OG1 3.27Å; D64-T190 WeakPolarHBondContact OD2-CB 3.33Å; D64-T190 PolarHBondContact OD2-N 3.02Å; D64-T190 PolarHBondContact OD2-OG1 3.28Å
65	V	92.4	Very high	90.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-42.9	169.2	-178.1	0	0	0	0	110.5	M61 P62 F68 Y69 L158 F189	M61-V65 HydrophobicContact CE-CG1 4.13Å; M61-V65 HydrophobicContact CG-CB 3.94Å; M61-V65 HydrophobicContact CG-CG1 3.81Å; M61-V65 HydrophobicContact SD-CB 4.37Å; M61-V65 HydrophobicContact SD-CG1 3.77Å; P62-V65 HydrophobicContact CB-CB 4.3Å; P62-V65 HydrophobicContact CB-CG2 4Å; P62-V65 HydrophobicContact CG-CG2 4.29Å; P62-V65 PolarHBondContact O-N 3.1Å; V65-F68 PolarHBondContact O-N 2.97Å; V65-Y69 HydrophobicContact CG1-CD2 3.77Å; V65-Y69 HydrophobicContact CG1-CE2 3.59Å; V65-Y69 VanDerWaalsContact O-CD2 3.24Å; V65-Y69 WeakPolarHBondContact O-CD2 3.25Å; V65-Y69 PolarHBondContact O-N 3.26Å; V65-L158 HydrophobicContact CG2-CD1 4.48Å; V65-L158 HydrophobicContact CG2-CD2 4.34Å; V65-F189 HydrophobicContact CG2-CB 3.41Å; V65-F189 VanDerWaalsContact CG2-CB 3.41Å; V65-F189 HydrophobicContact CG2-CD1 4.37Å; V65-F189 HydrophobicContact CG2-CD2 4.12Å; V65-F189 HydrophobicContact CG2-CG 3.72Å
66	K	92.5	Very high	90.1	Very high	33 Å²	33	41.6 Å²	41.6	14%	0.143	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-48.5	177.4	179.5	169.7	-74.2	136.9	0	111.5	I50 E54 M61 P62 E63 D64 F68 Y69 L70	I50-K66 HydrophobicContact CD1-CG 4.12Å; I50-K66 HydrophobicContact CG2-CG 4.33Å; E54-K66 VanDerWaalsContact OE1-CE 3.27Å; E54-K66 WeakPolarHBondContact OE1-CE 3.41Å; E54-K66 IonicContact OE1-NZ 3.74Å; E54-K66 PolarHBondContact OE1-NZ 3.46Å; M61-K66 HydrophobicContact CG-CB 4.13Å; M61-K66 PolarHBondContact O-NZ 3.27Å; M61-K66 HydrophobicContact SD-CB 4.18Å; P62-K66 WeakPolarHBondContact O-CB 3.22Å; P62-K66 PolarHBondContact O-N 3.2Å; E63-K66 WeakPolarHBondContact OE2-CD 3.47Å; D64-K66 VanDerWaalsContact C-N 3.28Å; D64-K66 PolarHBondContact O-N 2.88Å; K66-F68 VanDerWaalsContact C-N 3.35Å; K66-F68 PolarHBondContact O-N 3.06Å; K66-Y69 PolarHBondContact O-N 3.4Å; K66-L70 HydrophobicContact CG-CD1 4.09Å; K66-L70 WeakPolarHBondContact O-CB 3.31Å; K66-L70 VanDerWaalsContact O-CG 3.26Å; K66-L70 WeakPolarHBondContact O-CG 3.47Å; K66-L70 PolarHBondContact O-N 3.24Å
67	N	92.4	Very high	90.1	Very high	82 Å²	82	33.1 Å²	33.1	44%	0.439	17%	0.17	S	C	.	.	H	α-helix	trans	-65.6	-35.5	176.6	-81.2	-65	0	0	0	112.8	E63 D64 L70 M71	E63-N67 VanDerWaalsContact CD-ND2 3.32Å; E63-N67 WeakPolarHBondContact CG-ND2 3.33Å; E63-N67 WeakPolarHBondContact O-CB 3.37Å; E63-N67 PolarHBondContact O-N 3.05Å; E63-N67 PolarHBondContact O-ND2 2.99Å; E63-N67 PolarHBondContact OE1-ND2 2.88Å; D64-N67 PolarHBondContact O-N 3.29Å; N67-L70 PolarHBondContact O-N 3.47Å; N67-M71 WeakPolarHBondContact O-CB 3.24Å; N67-M71 PolarHBondContact O-N 2.76Å; N67-M71 VanDerWaalsContact O-N 3.08Å
68	F	92.1	Very high	90.3	Very high	22 Å²	22	34.7 Å²	34.7	10%	0.096	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-49.5	170.4	172.3	-97.3	0	0	0	111.3	D64 V65 K66 L70 M71 T72 F75 I95 F189 Y193	D64-F68 WeakPolarHBondContact O-CB 3.47Å; D64-F68 PolarHBondContact O-N 2.86Å; V65-F68 PolarHBondContact O-N 2.97Å; K66-F68 VanDerWaalsContact C-N 3.35Å; K66-F68 PolarHBondContact O-N 3.06Å; F68-L70 VanDerWaalsContact C-N 3.34Å; F68-L70 PolarHBondContact O-N 3.19Å; F68-M71 PolarHBondContact O-N 2.77Å; F68-T72 HydrophobicContact CD2-CG2 4.05Å; F68-T72 HydrophobicContact CE1-CG2 4.28Å; F68-T72 HydrophobicContact CE2-CG2 3.57Å; F68-T72 HydrophobicContact CZ-CG2 3.7Å; F68-T72 PolarHBondContact O-N 2.79Å; F68-T72 VanDerWaalsContact O-O 3.1Å; F68-F75 HydrophobicContact CZ-CB 3.99Å; F68-I95 HydrophobicContact CE1-CB 4.32Å; F68-I95 HydrophobicContact CE1-CD1 4.34Å; F68-I95 HydrophobicContact CE1-CG2 3.77Å; F68-I95 HydrophobicContact CE2-CD1 4.25Å; F68-I95 HydrophobicContact CZ-CB 4.17Å; F68-I95 HydrophobicContact CZ-CD1 3.78Å; F68-I95 HydrophobicContact CZ-CG2 4.11Å; F68-F189 HydrophobicContact CB-CD1 4.3Å; F68-F189 HydrophobicContact CB-CE1 3.54Å; F68-F189 HydrophobicContact CB-CZ 4.13Å; F68-F189 AromaticContact CD1-CE1 3.92Å; F68-F189 HydrophobicContact CD1-CE1 3.92Å; F68-F189 AromaticContact CD1-CZ 3.59Å; F68-F189 HydrophobicContact CD1-CZ 3.59Å; F68-F189 AromaticContact CD2-CE1 3.75Å; F68-F189 HydrophobicContact CD2-CE1 3.75Å; F68-F189 AromaticContact CD2-CZ 3.86Å; F68-F189 HydrophobicContact CD2-CZ 3.86Å; F68-F189 AromaticContact CE1-CZ 3.88Å; F68-F189 HydrophobicContact CE1-CZ 3.88Å; F68-F189 HydrophobicContact CE2-CE1 4.43Å; F68-F189 HydrophobicContact CE2-CZ 4.13Å; F68-F189 AromaticContact CG-CE1 3.45Å; F68-F189 HydrophobicContact CG-CE1 3.45Å; F68-F189 VanDerWaalsContact CG-CE1 3.45Å; F68-F189 AromaticContact CG-CZ 3.57Å; F68-F189 HydrophobicContact CG-CZ 3.57Å; F68-F189 HydrophobicContact CZ-CZ 4.14Å; F68-Y193 HydrophobicContact CE2-CD2 4.37Å; F68-Y193 AromaticContact CE2-CE2 3.87Å; F68-Y193 HydrophobicContact CE2-CE2 3.87Å
69	Y	92.5	Very high	90.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-34.9	177.8	-77.8	-54.3	0	0	0	113.5	A45 M61 V65 K66 M71 T72 N96 I98 L101	A45-Y69 VanDerWaalsContact CB-O 3.26Å; A45-Y69 WeakPolarHBondContact CB-O 3.4Å; A45-Y69 PolarHBondContact N-O 2.93Å; M61-Y69 HydrophobicContact CE-CD2 3.93Å; M61-Y69 HydrophobicContact CE-CE2 4Å; M61-Y69 HydrophobicContact SD-CD2 3.76Å; M61-Y69 HydrophobicContact SD-CE2 4.34Å; V65-Y69 HydrophobicContact CG1-CD2 3.77Å; V65-Y69 HydrophobicContact CG1-CE2 3.59Å; V65-Y69 VanDerWaalsContact O-CD2 3.24Å; V65-Y69 WeakPolarHBondContact O-CD2 3.25Å; V65-Y69 PolarHBondContact O-N 3.26Å; K66-Y69 PolarHBondContact O-N 3.4Å; Y69-M71 PolarHBondContact O-N 3.16Å; Y69-T72 WeakPolarHBondContact CA-O 3.35Å; Y69-T72 CarbonylContact O-C 3.28Å; Y69-N96 VanDerWaalsContact CE1-O 3.25Å; Y69-N96 WeakPolarHBondContact CE1-O 3.48Å; Y69-N96 PolarHBondContact OH-O 3.47Å; Y69-I98 HydrophobicContact CD1-CB 4.29Å; Y69-I98 HydrophobicContact CE1-CB 4.29Å; Y69-I98 HydrophobicContact CG-CB 4.44Å; Y69-L101 HydrophobicContact CE2-CD2 4.03Å
70	L	90.6	Very high	90.6	Very high	41 Å²	41	31.1 Å²	31.1	22%	0.215	16%	0.16	C	C	.	.	H	α-helix	trans	-69.2	-12.3	172	-68.5	172.7	0	0	0	113.8	R47 I50 K66 N67 F68	R47-L70 HydrophobicContact CG-CD2 3.67Å; I50-L70 HydrophobicContact CD1-CD2 3.7Å; I50-L70 HydrophobicContact CD1-CG 3.71Å; K66-L70 HydrophobicContact CG-CD1 4.09Å; K66-L70 WeakPolarHBondContact O-CB 3.31Å; K66-L70 VanDerWaalsContact O-CG 3.26Å; K66-L70 WeakPolarHBondContact O-CG 3.47Å; K66-L70 PolarHBondContact O-N 3.24Å; N67-L70 PolarHBondContact O-N 3.47Å; F68-L70 VanDerWaalsContact C-N 3.34Å; F68-L70 PolarHBondContact O-N 3.19Å
71	M	88.6	Confident	90.6	Very high	78 Å²	78	29.4 Å²	29.4	38%	0.384	15%	0.15	S	C	.	.	H	α-helix	trans	-100.8	-37.1	173.3	-174.4	173.7	175.9	0	0	112.4	H16 N67 F68 Y69	H16-M71 VanDerWaalsContact NE2-CE 3.34Å; H16-M71 WeakPolarHBondContact NE2-CE 3.49Å; N67-M71 WeakPolarHBondContact O-CB 3.24Å; N67-M71 PolarHBondContact O-N 2.76Å; N67-M71 VanDerWaalsContact O-N 3.08Å; F68-M71 PolarHBondContact O-N 2.77Å; Y69-M71 PolarHBondContact O-N 3.16Å
72	T	89.8	Confident	90.3	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.031	17%	0.168	C	C	.	.			trans	-155.3	131.2	179.1	-176.1	0	0	0	0	110.3	L20 K42 F68 Y69 G74	L20-T72 HydrophobicContact CD1-CG2 3.91Å; K42-T72 PolarHBondContact O-OG1 3.06Å; F68-T72 HydrophobicContact CD2-CG2 4.05Å; F68-T72 HydrophobicContact CE1-CG2 4.28Å; F68-T72 HydrophobicContact CE2-CG2 3.57Å; F68-T72 HydrophobicContact CZ-CG2 3.7Å; F68-T72 PolarHBondContact O-N 2.79Å; F68-T72 VanDerWaalsContact O-O 3.1Å; Y69-T72 WeakPolarHBondContact CA-O 3.35Å; Y69-T72 CarbonylContact O-C 3.28Å; T72-G74 WeakPolarHBondContact CG2-O 3.46Å; T72-G74 PolarHBondContact O-N 2.9Å; T72-G74 PolarHBondContact OG1-O 2.65Å
73	N	90.6	Very high	89.9	Confident	29 Å²	29	38.2 Å²	38.2	16%	0.155	19%	0.192	C	C	.	.	S	Bend	trans	-77	68	-179.1	-167.3	-4.5	0	0	0	112.1	K42 P43 A45 S97 I98	K42-N73 WeakPolarHBondContact CD-O 3.42Å; P43-N73 WeakPolarHBondContact O-CB 3.19Å; P43-N73 PolarHBondContact O-N 2.87Å; A45-N73 HydrophobicContact CB-CB 4.1Å; N73-S97 WeakPolarHBondContact O-CA 3.28Å; N73-S97 WeakPolarHBondContact O-CB 3.34Å; N73-S97 WeakPolarHBondContact OD1-CA 3.48Å; N73-S97 VanDerWaalsContact OD1-CB 3.23Å; N73-S97 WeakPolarHBondContact OD1-CB 3.49Å; N73-I98 PolarHBondContact OD1-N 3.2Å
74	G	89.5	Confident	89.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	84.3	-178.9	-167.3	0	0	0	0	0	112.4	T72 I95	T72-G74 WeakPolarHBondContact CG2-O 3.46Å; T72-G74 PolarHBondContact O-N 2.9Å; T72-G74 PolarHBondContact OG1-O 2.65Å; G74-I95 WeakPolarHBondContact CA-O 3.34Å
75	F	90.4	Very high	89.1	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.013	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.1	-178.4	175.2	-132.4	0	0	0	110.3	L20 T21 I39 K42 F68 M77 M93 I95 Y193	L20-F75 HydrophobicContact CD2-CD2 3.48Å; L20-F75 VanDerWaalsContact CD2-CD2 3.48Å; L20-F75 HydrophobicContact CD2-CE1 4.48Å; L20-F75 HydrophobicContact CD2-CE2 3.31Å; L20-F75 HydrophobicContact CD2-CG 4.16Å; L20-F75 HydrophobicContact CD2-CZ 3.85Å; T21-F75 HydrophobicContact CG2-CE2 4.25Å; T21-F75 HydrophobicContact CG2-CZ 4.02Å; I39-F75 HydrophobicContact CG2-CE2 3.97Å; K42-F75 PolarHBondContact NZ-O 3.08Å; F68-F75 HydrophobicContact CZ-CB 3.99Å; F75-M77 HydrophobicContact CE1-CB 4.08Å; F75-M77 HydrophobicContact CE2-CB 3.72Å; F75-M77 HydrophobicContact CZ-CB 3.34Å; F75-M77 HydrophobicContact CZ-CG 4.29Å; F75-M77 HydrophobicContact CZ-SD 4.04Å; F75-M93 HydrophobicContact CD1-CB 4.3Å; F75-M93 HydrophobicContact CE1-CB 3.68Å; F75-M93 HydrophobicContact CE1-SD 4.39Å; F75-M93 HydrophobicContact CZ-CB 4.5Å; F75-I95 HydrophobicContact CB-CB 4.18Å; F75-I95 HydrophobicContact CB-CG1 4.36Å; F75-I95 PolarHBondContact N-O 2.9Å; F75-I95 PolarHBondContact O-N 2.67Å; F75-Y193 HydrophobicContact CD1-CE2 4.21Å
76	H	89.8	Confident	88.7	Confident	59 Å²	59	51.3 Å²	51.3	27%	0.273	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	123	163.8	-166	-165.5	0	0	0	109.1	I40 M93	I40-H76 HydrophobicContact CB-CB 4.21Å; I40-H76 HydrophobicContact CD1-CB 4.18Å; I40-H76 HydrophobicContact CG1-CB 4.29Å; I40-H76 PolarHBondContact N-O 3.03Å; H76-M93 CarbonylContact C-O 3.6Å; H76-M93 VanDerWaalsContact CA-O 3.29Å; H76-M93 WeakPolarHBondContact CA-O 3.48Å
77	M	89.1	Confident	88.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.3	175.5	172.7	171.9	-172.2	0	0	109.5	T21 I24 T25 L28 V37 T38 I39 F75 S92 M93	T21-M77 HydrophobicContact CG2-SD 3.74Å; I24-M77 HydrophobicContact CG2-CE 4.08Å; T25-M77 HydrophobicContact CG2-CE 3.99Å; L28-M77 HydrophobicContact CD1-CE 3.68Å; V37-M77 HydrophobicContact CG1-CE 3.62Å; T38-M77 CarbonylContact O-C 3.52Å; T38-M77 VanDerWaalsContact O-CA 3.28Å; T38-M77 WeakPolarHBondContact O-CA 3.45Å; I39-M77 HydrophobicContact CD1-CE 4.06Å; I39-M77 HydrophobicContact CD1-CG 4.42Å; I39-M77 HydrophobicContact CD1-SD 3.83Å; I39-M77 HydrophobicContact CG1-CB 4.01Å; I39-M77 HydrophobicContact CG1-CE 4.13Å; I39-M77 HydrophobicContact CG1-CG 3.67Å; I39-M77 HydrophobicContact CG1-SD 3.76Å; F75-M77 HydrophobicContact CE1-CB 4.08Å; F75-M77 HydrophobicContact CE2-CB 3.72Å; F75-M77 HydrophobicContact CZ-CB 3.34Å; F75-M77 HydrophobicContact CZ-CG 4.29Å; F75-M77 HydrophobicContact CZ-SD 4.04Å; M77-S92 WeakPolarHBondContact O-CA 3.29Å; M77-M93 HydrophobicContact CB-CB 4.49Å; M77-M93 HydrophobicContact CB-CE 4.25Å; M77-M93 HydrophobicContact CE-CE 4.34Å; M77-M93 HydrophobicContact CG-CE 3.88Å; M77-M93 PolarHBondContact N-O 2.8Å; M77-M93 PolarHBondContact O-N 3.26Å; M77-M93 HydrophobicContact SD-CE 3.48Å; M77-M93 WeakPolarHBondContact SD-CE 3.38Å
78	T	90	Very high	88	Confident	48 Å²	48	53.2 Å²	53.2	29%	0.294	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	151.6	178	55.5	0	0	0	0	110.5	T38 G91	T38-T78 PolarHBondContact N-O 2.93Å; T38-T78 PolarHBondContact O-N 2.86Å; T78-G91 WeakPolarHBondContact CA-O 3.46Å
79	W	90.4	Very high	87.7	Confident	15 Å²	15	57.3 Å²	57.3	6%	0.057	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	148.1	173.5	59	-81.6	0	0	0	111.7	L28 V34 V37 V81 L90 G91 L200 L202	L28-W79 HydrophobicContact CD1-CB 4.11Å; L28-W79 HydrophobicContact CD1-CD2 4.04Å; L28-W79 HydrophobicContact CD1-CG 3.69Å; L28-W79 HydrophobicContact CD2-CD2 3.66Å; L28-W79 HydrophobicContact CD2-CE3 3.82Å; L28-W79 HydrophobicContact CD2-CG 4.22Å; L28-W79 HydrophobicContact CD2-CH2 3.97Å; L28-W79 HydrophobicContact CD2-CZ2 3.85Å; L28-W79 HydrophobicContact CD2-CZ3 3.96Å; V34-W79 HydrophobicContact CG1-CE3 4.05Å; V34-W79 HydrophobicContact CG2-CE3 4.12Å; V34-W79 HydrophobicContact CG2-CZ3 3.98Å; V37-W79 HydrophobicContact CG2-CB 4.05Å; W79-V81 HydrophobicContact CE3-CG2 4.21Å; W79-V81 HydrophobicContact CZ3-CG2 3.79Å; W79-L90 HydrophobicContact CE3-CB 4.24Å; W79-L90 HydrophobicContact CH2-CB 4.36Å; W79-L90 HydrophobicContact CH2-CD2 3.75Å; W79-L90 HydrophobicContact CH2-CG 4.42Å; W79-L90 HydrophobicContact CZ3-CB 4.03Å; W79-L90 HydrophobicContact CZ3-CD2 3.76Å; W79-L90 HydrophobicContact CZ3-CG 4.43Å; W79-L90 PolarHBondContact O-N 2.92Å; W79-G91 PolarHBondContact N-O 3.31Å; W79-G91 PolarHBondContact O-N 2.76Å; W79-L200 HydrophobicContact CZ2-CB 3.85Å; W79-L200 HydrophobicContact CZ2-CD1 4.26Å; W79-L200 PolarHBondContact NE1-O 2.88Å; W79-L202 HydrophobicContact CH2-CD2 3.93Å; W79-L202 HydrophobicContact CZ2-CD2 3.78Å; W79-L202 HydrophobicContact CZ2-CG 4.33Å
80	S	88.1	Confident	87.4	Confident	7 Å²	7	60.4 Å²	60.4	5%	0.049	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	168.3	-178.8	-59.3	0	0	0	0	110.9	V34 T35 E36 I87 I88	V34-S80 WeakPolarHBondContact CA-O 3.17Å; T35-S80 PolarHBondContact N-O 3.01Å; T35-S80 CarbonylContact O-C 3.55Å; T35-S80 WeakPolarHBondContact O-CA 3.48Å; T35-S80 PolarHBondContact O-N 2.81Å; T35-S80 VanDerWaalsContact O-O 3.06Å; E36-S80 VanDerWaalsContact OE2-CB 3.31Å; E36-S80 WeakPolarHBondContact OE2-CB 2.96Å; E36-S80 PolarHBondContact OE2-OG 3.1Å; S80-I87 VanDerWaalsContact CB-CG2 3.42Å; S80-I88 CarbonylContact C-O 3.4Å; S80-I88 VanDerWaalsContact CA-O 3.25Å; S80-I88 WeakPolarHBondContact CA-O 3.49Å; S80-I88 WeakPolarHBondContact CB-O 3.47Å
81	V	87.9	Confident	87.1	Confident	32 Å²	32	58.8 Å²	58.8	19%	0.194	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.2	166.4	173.4	0	0	0	0	108.4	G33 V34 W79 L83 I88 L90	G33-V81 CarbonylContact O-C 3.29Å; G33-V81 VanDerWaalsContact O-CA 3.29Å; G33-V81 WeakPolarHBondContact O-CA 3.38Å; V34-V81 HydrophobicContact CG2-CG2 4.14Å; W79-V81 HydrophobicContact CE3-CG2 4.21Å; W79-V81 HydrophobicContact CZ3-CG2 3.79Å; V81-L83 PolarHBondContact O-N 2.83Å; V81-I88 PolarHBondContact N-O 3.27Å; V81-I88 PolarHBondContact O-N 3.1Å; V81-L90 HydrophobicContact CG2-CB 4.18Å; V81-L90 HydrophobicContact CG2-CD2 3.83Å
82	K	85.8	Confident	87.1	Confident	88 Å²	88	57.1 Å²	57.1	38%	0.383	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	114.8	166.1	-178.9	167.6	177.8	168.5	0	109	G33 T35 D84 E85 H86 I87	G33-K82 PolarHBondContact O-N 2.76Å; T35-K82 HydrophobicContact CG2-CB 3.82Å; K82-D84 WeakPolarHBondContact CE-O 3.22Å; K82-D84 WeakPolarHBondContact CG-O 3.47Å; K82-E85 WeakPolarHBondContact CE-OE2 3.44Å; K82-E85 IonicContact NZ-OE1 3.79Å; K82-E85 IonicContact NZ-OE2 2.67Å; K82-E85 PolarHBondContact NZ-OE2 3.39Å; K82-H86 CarbonylContact C-O 3.49Å; K82-H86 WeakPolarHBondContact CA-O 3.24Å; K82-I87 HydrophobicContact CB-CG1 4.43Å
83	L	83	Confident	87.1	Confident	102 Å²	102	56.9 Å²	56.9	53%	0.534	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.7	172.2	-173.8	71.2	0	0	0	108.1	V81 E85 H86 I88	V81-L83 PolarHBondContact O-N 2.83Å; L83-E85 PolarHBondContact O-N 3.39Å; L83-H86 PolarHBondContact N-O 3.33Å; L83-H86 PolarHBondContact O-N 2.84Å; L83-H86 VanDerWaalsContact O-O 3.11Å; L83-I88 HydrophobicContact CB-CD1 4.1Å; L83-I88 HydrophobicContact CD2-CD1 4.13Å
84	D	83.9	Confident	87.1	Confident	141 Å²	141	56.3 Å²	56.3	75%	0.754	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	-118.1	-168.4	-55	-45.7	0	0	0	111	K82	K82-D84 WeakPolarHBondContact CE-O 3.22Å; K82-D84 WeakPolarHBondContact CG-O 3.47Å
85	E	81.7	Confident	87.3	Confident	154 Å²	154	56.4 Å²	56.4	72%	0.72	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	9.2	174.7	-64.9	-58.5	162.2	0	0	114.4	K82 L83	K82-E85 WeakPolarHBondContact CE-OE2 3.44Å; K82-E85 IonicContact NZ-OE1 3.79Å; K82-E85 IonicContact NZ-OE2 2.67Å; K82-E85 PolarHBondContact NZ-OE2 3.39Å; L83-E85 PolarHBondContact O-N 3.39Å
86	H	84.1	Confident	87.4	Confident	139 Å²	139	57.4 Å²	57.4	64%	0.644	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	130.6	179.3	-65.4	-63.1	0	0	0	111.8	K82 L83	K82-H86 CarbonylContact C-O 3.49Å; K82-H86 WeakPolarHBondContact CA-O 3.24Å; L83-H86 PolarHBondContact N-O 3.33Å; L83-H86 PolarHBondContact O-N 2.84Å; L83-H86 VanDerWaalsContact O-O 3.11Å
87	I	86.5	Confident	87.5	Confident	84 Å²	84	55.6 Å²	55.6	43%	0.431	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.4	169.1	-55.8	177.4	0	0	0	108.1	E36 S80 K82	E36-I87 HydrophobicContact CG-CG2 4.29Å; E36-I87 VanDerWaalsContact OE2-CG2 3.24Å; E36-I87 WeakPolarHBondContact OE2-CG2 3.44Å; S80-I87 VanDerWaalsContact CB-CG2 3.42Å; K82-I87 HydrophobicContact CB-CG1 4.43Å
88	I	84.6	Confident	87.6	Confident	70 Å²	70	55.8 Å²	55.8	36%	0.359	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	115	-176.1	-56.4	176.2	0	0	0	108	S80 V81 L83 L90	S80-I88 CarbonylContact C-O 3.4Å; S80-I88 VanDerWaalsContact CA-O 3.25Å; S80-I88 WeakPolarHBondContact CA-O 3.49Å; S80-I88 WeakPolarHBondContact CB-O 3.47Å; V81-I88 PolarHBondContact N-O 3.27Å; V81-I88 PolarHBondContact O-N 3.1Å; L83-I88 HydrophobicContact CB-CD1 4.1Å; L83-I88 HydrophobicContact CD2-CD1 4.13Å; I88-L90 PolarHBondContact O-N 2.95Å
89	P	85.4	Confident	87.6	Confident	108 Å²	108	57.5 Å²	57.5	70%	0.701	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	118.3	173.8	26.9	-33	0	0	0	108.9
90	L	85.4	Confident	87.5	Confident	65 Å²	65	63.1 Å²	63.1	34%	0.34	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-34.4	-170.3	-155.8	76.7	0	0	0	113.2	W79 V81 I88 L202 P203	W79-L90 HydrophobicContact CE3-CB 4.24Å; W79-L90 HydrophobicContact CH2-CB 4.36Å; W79-L90 HydrophobicContact CH2-CD2 3.75Å; W79-L90 HydrophobicContact CH2-CG 4.42Å; W79-L90 HydrophobicContact CZ3-CB 4.03Å; W79-L90 HydrophobicContact CZ3-CD2 3.76Å; W79-L90 HydrophobicContact CZ3-CG 4.43Å; W79-L90 PolarHBondContact O-N 2.92Å; V81-L90 HydrophobicContact CG2-CB 4.18Å; V81-L90 HydrophobicContact CG2-CD2 3.83Å; I88-L90 PolarHBondContact O-N 2.95Å; L90-L202 HydrophobicContact CD2-CD2 4.05Å; L90-L202 HydrophobicContact CG-CD2 4.09Å; L90-P203 WeakPolarHBondContact O-CD 3.12Å; L90-P203 VanDerWaalsContact O-CG 3.26Å; L90-P203 WeakPolarHBondContact O-CG 3.5Å
91	G	85.7	Confident	87.6	Confident	7 Å²	7	63.1 Å²	63.1	7%	0.072	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.6	179.4	0	0	0	0	0	113.7	T78 W79 G201	T78-G91 WeakPolarHBondContact CA-O 3.46Å; W79-G91 PolarHBondContact N-O 3.31Å; W79-G91 PolarHBondContact O-N 2.76Å; G91-G201 CarbonylContact C-O 3.54Å; G91-G201 WeakPolarHBondContact CA-O 3.47Å
92	S	87.8	Confident	87.5	Confident	44 Å²	44	65 Å²	65	31%	0.308	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	121.7	171.1	-176.6	0	0	0	0	110.3	M77 G201	M77-S92 WeakPolarHBondContact O-CA 3.29Å; S92-G201 PolarHBondContact N-O 2.81Å; S92-G201 WeakPolarHBondContact O-CA 3.39Å
93	M	90	Very high	87.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	110.2	170.9	-65.4	179	-85.1	0	0	108.1	I24 F75 H76 M77 L196 G201	I24-M93 HydrophobicContact CD1-CE 4.24Å; I24-M93 HydrophobicContact CD1-SD 4.24Å; I24-M93 HydrophobicContact CG2-CE 4.32Å; F75-M93 HydrophobicContact CD1-CB 4.3Å; F75-M93 HydrophobicContact CE1-CB 3.68Å; F75-M93 HydrophobicContact CE1-SD 4.39Å; F75-M93 HydrophobicContact CZ-CB 4.5Å; H76-M93 CarbonylContact C-O 3.6Å; H76-M93 VanDerWaalsContact CA-O 3.29Å; H76-M93 WeakPolarHBondContact CA-O 3.48Å; M77-M93 HydrophobicContact CB-CB 4.49Å; M77-M93 HydrophobicContact CB-CE 4.25Å; M77-M93 HydrophobicContact CE-CE 4.34Å; M77-M93 HydrophobicContact CG-CE 3.88Å; M77-M93 PolarHBondContact N-O 2.8Å; M77-M93 PolarHBondContact O-N 3.26Å; M77-M93 HydrophobicContact SD-CE 3.48Å; M77-M93 WeakPolarHBondContact SD-CE 3.38Å; M93-L196 HydrophobicContact CB-CD1 4.1Å; M93-L196 HydrophobicContact CB-CD2 4.19Å; M93-L196 HydrophobicContact CB-CG 4.06Å; M93-L196 HydrophobicContact CG-CD1 3.9Å; M93-L196 HydrophobicContact CG-CG 3.91Å; M93-L196 HydrophobicContact SD-CG 4.35Å; M93-G201 VanDerWaalsContact CG-CA 3.43Å
94	A	90.9	Very high	87.4	Confident	17 Å²	17	59.6 Å²	59.6	14%	0.14	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.6	-179.3	0	0	0	0	0	111.1	D148	A94-D148 WeakPolarHBondContact CB-OD1 3.36Å; A94-D148 WeakPolarHBondContact O-CB 3.46Å
95	I	92.9	Very high	86.5	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	125.2	168.1	-54.7	-178.3	0	0	0	107.7	K42 F68 G74 F75 F189 Y193 L196	K42-I95 PolarHBondContact NZ-O 2.82Å; K42-I95 VanDerWaalsContact NZ-O 3.14Å; F68-I95 HydrophobicContact CE1-CB 4.32Å; F68-I95 HydrophobicContact CE1-CD1 4.34Å; F68-I95 HydrophobicContact CE1-CG2 3.77Å; F68-I95 HydrophobicContact CE2-CD1 4.25Å; F68-I95 HydrophobicContact CZ-CB 4.17Å; F68-I95 HydrophobicContact CZ-CD1 3.78Å; F68-I95 HydrophobicContact CZ-CG2 4.11Å; G74-I95 WeakPolarHBondContact CA-O 3.34Å; F75-I95 HydrophobicContact CB-CB 4.18Å; F75-I95 HydrophobicContact CB-CG1 4.36Å; F75-I95 PolarHBondContact N-O 2.9Å; F75-I95 PolarHBondContact O-N 2.67Å; I95-F189 HydrophobicContact CD1-CE2 4.01Å; I95-F189 HydrophobicContact CD1-CZ 3.78Å; I95-F189 HydrophobicContact CG2-CE2 4.3Å; I95-Y193 HydrophobicContact CD1-CD2 3.54Å; I95-Y193 HydrophobicContact CD1-CE2 3.63Å; I95-L196 HydrophobicContact CD1-CD2 3.97Å; I95-L196 HydrophobicContact CG1-CD2 4.03Å
96	N	92.6	Very high	85.1	Confident	23 Å²	23	52 Å²	52	12%	0.123	29%	0.287	C	S	.	.			trans	-56.3	142.3	179	-83.2	-32.7	0	0	0	111.2	Y69 K100 E146 L147	Y69-N96 VanDerWaalsContact CE1-O 3.25Å; Y69-N96 WeakPolarHBondContact CE1-O 3.48Å; Y69-N96 PolarHBondContact OH-O 3.47Å; N96-K100 HydrophobicContact CB-CB 3.96Å; N96-E146 PolarHBondContact ND2-O 2.88Å; N96-L147 WeakPolarHBondContact CB-O 3.28Å; N96-L147 PolarHBondContact N-O 3.21Å
97	S	91.7	Very high	83.3	Confident	22 Å²	22	49 Å²	49	15%	0.154	28%	0.282	C	S	.	.			trans	-67	158.4	166.2	50.6	0	0	0	0	109.8	N73 S99 K100 L101	N73-S97 WeakPolarHBondContact O-CA 3.28Å; N73-S97 WeakPolarHBondContact O-CB 3.34Å; N73-S97 WeakPolarHBondContact OD1-CA 3.48Å; N73-S97 VanDerWaalsContact OD1-CB 3.23Å; N73-S97 WeakPolarHBondContact OD1-CB 3.49Å; S97-S99 PolarHBondContact O-N 3.45Å; S97-S99 VanDerWaalsContact O-N 3.14Å; S97-K100 CarbonylContact O-C 3.5Å; S97-K100 WeakPolarHBondContact O-CA 3.42Å; S97-K100 WeakPolarHBondContact O-CB 3.34Å; S97-K100 PolarHBondContact O-N 2.67Å; S97-L101 PolarHBondContact O-N 3.26Å
98	I	92	Very high	81.2	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-59.7	-30.6	-178.3	-165.3	167.5	0	0	0	112.7	A45 M49 I50 W53 M61 Y69 N73 K100 L101	A45-I98 HydrophobicContact CB-CG2 4.33Å; M49-I98 HydrophobicContact CB-CG2 4.35Å; I50-I98 HydrophobicContact CB-CD1 4.09Å; I50-I98 HydrophobicContact CG1-CD1 3.81Å; I50-I98 HydrophobicContact CG2-CD1 4.23Å; W53-I98 HydrophobicContact CB-CD1 3.83Å; W53-I98 HydrophobicContact CB-CG1 3.98Å; W53-I98 HydrophobicContact CD2-CD1 4.49Å; W53-I98 HydrophobicContact CD2-CG1 4.39Å; W53-I98 HydrophobicContact CG-CD1 4.02Å; W53-I98 HydrophobicContact CG-CG1 3.79Å; M61-I98 HydrophobicContact CE-CD1 3.63Å; M61-I98 HydrophobicContact CE-CG1 4.13Å; M61-I98 HydrophobicContact SD-CD1 4.35Å; Y69-I98 HydrophobicContact CD1-CB 4.29Å; Y69-I98 HydrophobicContact CE1-CB 4.29Å; Y69-I98 HydrophobicContact CG-CB 4.44Å; N73-I98 PolarHBondContact OD1-N 3.2Å; I98-K100 PolarHBondContact O-N 2.99Å; I98-L101 WeakPolarHBondContact O-CB 3.42Å; I98-L101 PolarHBondContact O-N 3.39Å
99	S	88.9	Confident	79.2	Confident	84 Å²	84	51 Å²	51	59%	0.587	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-69.5	-17	173	-41.7	0	0	0	0	114.2	M49 S97	M49-S99 WeakPolarHBondContact CE-OG 3.13Å; S97-S99 PolarHBondContact O-N 3.45Å; S97-S99 VanDerWaalsContact O-N 3.14Å
100	K	89.1	Confident	77.1	Confident	133 Å²	133	53.4 Å²	53.4	58%	0.578	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-104.4	-4.1	174.5	-72.7	-170.2	172.9	-165.9	0	113.2	N96 S97 I98 T102	N96-K100 HydrophobicContact CB-CB 3.96Å; S97-K100 CarbonylContact O-C 3.5Å; S97-K100 WeakPolarHBondContact O-CA 3.42Å; S97-K100 WeakPolarHBondContact O-CB 3.34Å; S97-K100 PolarHBondContact O-N 2.67Å; I98-K100 PolarHBondContact O-N 2.99Å; K100-T102 PolarHBondContact O-N 2.9Å
101	L	89.4	Confident	74.8	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.037	31%	0.312	C	S	.	.			trans	-74.9	78	177.1	-174	59.6	0	0	0	109.5	W53 M61 Y69 S97 I98 F145 E146 L147	W53-L101 HydrophobicContact CH2-CD2 4.21Å; W53-L101 HydrophobicContact CZ2-CD2 3.47Å; W53-L101 VanDerWaalsContact CZ2-CD2 3.47Å; W53-L101 HydrophobicContact CZ2-CG 3.79Å; W53-L101 PolarHBondContact NE1-O 3.13Å; W53-L101 VanDerWaalsContact NE1-O 3.1Å; M61-L101 HydrophobicContact CE-CD2 3.89Å; Y69-L101 HydrophobicContact CE2-CD2 4.03Å; S97-L101 PolarHBondContact O-N 3.26Å; I98-L101 WeakPolarHBondContact O-CB 3.42Å; I98-L101 PolarHBondContact O-N 3.39Å; L101-F145 HydrophobicContact CD1-CB 3.66Å; L101-F145 HydrophobicContact CG-CB 4Å; L101-E146 WeakPolarHBondContact CD1-O 3.3Å; L101-L147 HydrophobicContact CD1-CD2 3.91Å; L101-L147 HydrophobicContact CD1-CG 4.43Å
102	T	85.5	Confident	73	Confident	73 Å²	73	60.5 Å²	60.5	45%	0.448	34%	0.338	S	S	.	.			trans	-78.9	140.7	-176.4	44.7	0	0	0	0	111.4	K100 F145 E146	K100-T102 PolarHBondContact O-N 2.9Å; T102-F145 VanDerWaalsContact O-CA 3.24Å; T102-F145 WeakPolarHBondContact O-CA 3.49Å; T102-E146 PolarHBondContact O-N 2.87Å
103	Q	86.9	Confident	71.1	Confident	56 Å²	56	64.5 Å²	64.5	26%	0.262	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-71.5	128.8	168.8	-164.4	-172.1	-35.6	0	0	109.2	T105 V143 I144 F145	Q103-T105 PolarHBondContact NE2-OG1 2.84Å; Q103-T105 PolarHBondContact O-N 2.81Å; Q103-V143 HydrophobicContact CG-CG1 4.23Å; Q103-I144 CarbonylContact C-O 3.52Å; Q103-I144 VanDerWaalsContact CA-O 3.28Å; Q103-I144 WeakPolarHBondContact CA-O 3.42Å; Q103-I144 WeakPolarHBondContact CG-O 3.21Å; Q103-F145 HydrophobicContact CB-CD1 3.91Å; Q103-F145 HydrophobicContact CB-CE1 3.72Å; Q103-F145 HydrophobicContact CG-CD1 4.28Å; Q103-F145 HydrophobicContact CG-CE1 3.95Å; Q103-F145 HydrophobicContact CG-CZ 4.33Å
104	L	80.8	Confident	69.2	Low	19 Å²	19	72.1 Å²	72.1	10%	0.099	40%	0.404	C	S	.	.			trans	-83.4	85.4	171.1	-63.9	-175.5	0	0	0	109.2	I144 E146 K155 C157	L104-I144 HydrophobicContact CB-CB 4.25Å; L104-I144 HydrophobicContact CB-CG2 4.01Å; L104-I144 HydrophobicContact CD1-CG2 4.01Å; L104-I144 HydrophobicContact CG-CG2 4.35Å; L104-I144 PolarHBondContact N-O 2.91Å; L104-E146 HydrophobicContact CD1-CB 4.5Å; L104-E146 HydrophobicContact CD2-CB 4.26Å; L104-E146 HydrophobicContact CG-CB 4.36Å; L104-K155 HydrophobicContact CD1-CD 3.98Å; L104-K155 HydrophobicContact CD2-CD 4.43Å; L104-C157 VanDerWaalsContact CD1-SG 3.52Å
105	T	65.3	Low	67.5	Low	60 Å²	60	72.7 Å²	72.7	37%	0.368	41%	0.409	S	S	.	.			trans	-97	143.5	173.8	-46.6	0	0	0	0	109.7	Q103 S107 S108	Q103-T105 PolarHBondContact NE2-OG1 2.84Å; Q103-T105 PolarHBondContact O-N 2.81Å; T105-S107 PolarHBondContact O-N 3.48Å; T105-S108 WeakPolarHBondContact O-CB 3.47Å; T105-S108 PolarHBondContact O-N 2.86Å; T105-S108 PolarHBondContact O-OG 3.43Å
106	Q	52.6	Low	65.5	Low	75 Å²	75	77.5 Å²	77.5	35%	0.35	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-41.2	-38.7	179.6	-57.4	-178	-10.1	0	0	114.5	S108 F138	Q106-S108 PolarHBondContact O-N 3.45Å; Q106-S108 VanDerWaalsContact O-N 3.12Å; Q106-F138 HydrophobicContact CG-CB 4.23Å; Q106-F138 WeakPolarHBondContact CG-O 3.4Å; Q106-F138 PolarHBondContact NE2-O 2.82Å
107	S	45.6	Very low	63.6	Low	76 Å²	76	79.1 Å²	79.1	53%	0.531	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-58.2	-22.1	-179.1	-36.8	0	0	0	0	115	T105 M109 S111	T105-S107 PolarHBondContact O-N 3.48Å; S107-M109 VanDerWaalsContact C-N 3.29Å; S107-M109 PolarHBondContact O-N 3.37Å; S107-S111 PolarHBondContact O-OG 3.3Å
108	S	41.7	Very low	61.8	Low	77 Å²	77	79.6 Å²	79.6	54%	0.538	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-77.2	-4.2	-168.2	67.3	0	0	0	0	115.7	T105 Q106	T105-S108 WeakPolarHBondContact O-CB 3.47Å; T105-S108 PolarHBondContact O-N 2.86Å; T105-S108 PolarHBondContact O-OG 3.43Å; Q106-S108 PolarHBondContact O-N 3.45Å; Q106-S108 VanDerWaalsContact O-N 3.12Å
109	M	43.5	Very low	59.9	Low	121 Å²	121	81.7 Å²	81.7	60%	0.596	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-46.8	176.9	-83.2	-72.2	159.5	0	0	113.5	S107	S107-M109 VanDerWaalsContact C-N 3.29Å; S107-M109 PolarHBondContact O-N 3.37Å
110	Y	41.7	Very low	58.3	Low	157 Å²	157	83 Å²	83	62%	0.616	47%	0.47	S	S	*	.			trans	-134.4	73	-174	-59	-67	0	0	0	112.9	L112	Y110-L112 PolarHBondContact O-N 3.27Å
111	S	37	Very low	56.5	Low	102 Å²	102	82.8 Å²	82.8	71%	0.713	47%	0.474	S	S	*	.			trans	-75.3	69.6	170.6	-72.9	0	0	0	0	112	S107	S107-S111 PolarHBondContact O-OG 3.3Å
112	L	46.7	Very low	54.9	Low	120 Å²	120	85.9 Å²	85.9	63%	0.628	49%	0.488	S	S	*	.			trans	-123.7	128.9	169.1	-82.1	170.2	0	0	0	108.6	Y110 N114 A115	Y110-L112 PolarHBondContact O-N 3.27Å; L112-N114 PolarHBondContact O-N 2.9Å; L112-A115 HydrophobicContact CB-CB 3.75Å; L112-A115 PolarHBondContact O-N 2.77Å; L112-A115 VanDerWaalsContact O-N 3.16Å
113	P	48.3	Very low	53.1	Low	127 Å²	127	88 Å²	88	83%	0.825	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-4.7	-168.1	26	-35.2	0	0	0	115.9
114	N	51.1	Low	51.2	Low	160 Å²	160	91.8 Å²	91.8	86%	0.856	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138	18.9	178.1	-78.7	93.9	0	0	0	112.6	L112	L112-N114 PolarHBondContact O-N 2.9Å
115	A	54.1	Low	49.5	Very low	30 Å²	30	95.3 Å²	95.3	25%	0.248	54%	0.542	C	S	.	.	S	Bend	trans	-77.6	148.8	172.3	0	0	0	0	0	110.9	L112 T117	L112-A115 HydrophobicContact CB-CB 3.75Å; L112-A115 PolarHBondContact O-N 2.77Å; L112-A115 VanDerWaalsContact O-N 3.16Å; A115-T117 PolarHBondContact O-N 2.94Å
116	P	50	Low	48.6	Very low	103 Å²	103	100 Å²	100	67%	0.669	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-58.6	134.1	166.3	27	-33.9	0	0	0	109.4	D120	P116-D120 HydrophobicContact CB-CB 4.35Å
117	T	53.9	Low	48.2	Very low	57 Å²	57	104.9 Å²	104.9	35%	0.35	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-83.9	170.3	177.8	71.1	0	0	0	0	110.3	A115 A119 D120	A115-T117 PolarHBondContact O-N 2.94Å; T117-A119 PolarHBondContact O-N 2.88Å; T117-A119 PolarHBondContact OG1-N 2.95Å; T117-D120 WeakPolarHBondContact CA-OD2 3.18Å; T117-D120 WeakPolarHBondContact CB-OD2 3.33Å; T117-D120 PolarHBondContact N-OD2 2.85Å; T117-D120 PolarHBondContact O-N 2.75Å; T117-D120 PolarHBondContact OG1-OD2 3.01Å
118	L	52.7	Low	47.9	Very low	32 Å²	32	105.5 Å²	105.5	17%	0.168	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-67.9	-22.9	173.7	-61.7	-173.4	0	0	0	112.7	D120 L121 F138 L180	L118-D120 VanDerWaalsContact C-N 3.26Å; L118-D120 PolarHBondContact O-N 2.73Å; L118-L121 PolarHBondContact O-N 3.08Å; L118-L121 VanDerWaalsContact O-N 3.15Å; L118-F138 HydrophobicContact CB-CD2 4.21Å; L118-F138 HydrophobicContact CB-CG 4.47Å; L118-F138 HydrophobicContact CD1-CD1 4.35Å; L118-F138 HydrophobicContact CD1-CD2 4.36Å; L118-F138 HydrophobicContact CD1-CE1 4.35Å; L118-F138 HydrophobicContact CD1-CE2 4.37Å; L118-F138 HydrophobicContact CD1-CG 4.35Å; L118-F138 HydrophobicContact CD1-CZ 4.36Å; L118-L180 HydrophobicContact CD1-CD1 4.12Å; L118-L180 HydrophobicContact CD2-CD1 3.57Å; L118-L180 HydrophobicContact CG-CD1 4.4Å
119	A	52.4	Low	48	Very low	47 Å²	47	104.9 Å²	104.9	39%	0.388	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-68.1	-26	173.4	0	0	0	0	0	112.4	T117 L121 E122	T117-A119 PolarHBondContact O-N 2.88Å; T117-A119 PolarHBondContact OG1-N 2.95Å; A119-L121 PolarHBondContact O-N 3.32Å; A119-E122 PolarHBondContact O-N 3.42Å
120	D	55.3	Low	48.2	Very low	112 Å²	112	107.3 Å²	107.3	60%	0.599	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-74.9	1.2	173.7	-55.4	-76.4	0	0	0	113	P116 T117 L118	P116-D120 HydrophobicContact CB-CB 4.35Å; T117-D120 WeakPolarHBondContact CA-OD2 3.18Å; T117-D120 WeakPolarHBondContact CB-OD2 3.33Å; T117-D120 PolarHBondContact N-OD2 2.85Å; T117-D120 PolarHBondContact O-N 2.75Å; T117-D120 PolarHBondContact OG1-OD2 3.01Å; L118-D120 VanDerWaalsContact C-N 3.26Å; L118-D120 PolarHBondContact O-N 2.73Å
121	L	51.6	Low	48.7	Very low	128 Å²	128	107.5 Å²	107.5	67%	0.67	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-120.3	1.5	176.3	-65.4	173.7	0	0	0	113	L118 A119 D123	L118-L121 PolarHBondContact O-N 3.08Å; L118-L121 VanDerWaalsContact O-N 3.15Å; A119-L121 PolarHBondContact O-N 3.32Å; L121-D123 PolarHBondContact O-N 3.32Å
122	E	55.3	Low	49.6	Very low	71 Å²	71	109.1 Å²	109.1	33%	0.332	61%	0.611	S	S	.	*			trans	-76.7	89.3	172.5	-68.1	-178	-170.6	0	0	108.4	A119 D124 H137 F138	A119-E122 PolarHBondContact O-N 3.42Å; E122-D124 PolarHBondContact O-N 3.47Å; E122-H137 IonicContact OE2-CE1 3.76Å; E122-H137 IonicContact OE2-CG 3.3Å; E122-H137 IonicContact OE2-ND1 3.34Å; E122-H137 PolarHBondContact OE2-ND1 2.79Å; E122-F138 PolarHBondContact OE1-N 3.39Å
123	D	48.1	Very low	50.4	Low	118 Å²	118	105.5 Å²	105.5	63%	0.631	59%	0.594	S	S	*	*			trans	-63.1	127.4	-178.6	179.3	53.1	0	0	0	111.9	L121 T125	L121-D123 PolarHBondContact O-N 3.32Å; D123-T125 PolarHBondContact O-N 3.07Å; D123-T125 WeakPolarHBondContact OD2-CG2 2.92Å; D123-T125 PolarHBondContact OD2-OG1 3.36Å
124	D	47.3	Very low	51.6	Low	135 Å²	135	105.8 Å²	105.8	72%	0.722	58%	0.584	S	S	*	*			trans	-75.5	29.9	-168.8	-120.3	-7.9	0	0	0	113.4	E122 H126	E122-D124 PolarHBondContact O-N 3.47Å; D124-H126 VanDerWaalsContact C-N 3.29Å; D124-H126 PolarHBondContact O-N 3.07Å; D124-H126 IonicContact OD1-NE2 2.67Å
125	T	45.3	Very low	52.9	Low	94 Å²	94	103.9 Å²	103.9	58%	0.577	57%	0.569	S	S	*	*			trans	-76.7	76.6	-179.9	36.5	0	0	0	0	111.7	D123 E127	D123-T125 PolarHBondContact O-N 3.07Å; D123-T125 WeakPolarHBondContact OD2-CG2 2.92Å; D123-T125 PolarHBondContact OD2-OG1 3.36Å; T125-E127 PolarHBondContact O-N 2.8Å
126	H	47.3	Very low	54.1	Low	157 Å²	157	102.7 Å²	102.7	73%	0.727	56%	0.558	S	S	*	*			trans	-62.2	64.8	174.4	-82	-81.8	0	0	0	114.5	D124 A128	D124-H126 VanDerWaalsContact C-N 3.29Å; D124-H126 PolarHBondContact O-N 3.07Å; D124-H126 IonicContact OD1-NE2 2.67Å; H126-A128 PolarHBondContact O-N 2.89Å; H126-A128 VanDerWaalsContact O-N 3.07Å
127	E	43.8	Very low	55.2	Low	179 Å²	179	100 Å²	100	84%	0.836	54%	0.536	S	S	*	.			trans	-80.6	72.5	159.5	-71.4	-64.4	148.2	0	0	109.2	T125 S129	T125-E127 PolarHBondContact O-N 2.8Å; E127-S129 VanDerWaalsContact C-N 3.3Å; E127-S129 PolarHBondContact O-N 2.8Å
128	A	39.7	Very low	56	Low	88 Å²	88	98.3 Å²	98.3	73%	0.727	52%	0.524	S	S	*	.			trans	-74.3	78.8	-179.4	0	0	0	0	0	111.4	H126 D130	H126-A128 PolarHBondContact O-N 2.89Å; H126-A128 VanDerWaalsContact O-N 3.07Å; A128-D130 PolarHBondContact O-N 3.46Å
129	S	42.8	Very low	56.8	Low	64 Å²	64	99.4 Å²	99.4	45%	0.448	53%	0.531	S	S	.	.			trans	-74.6	105	166.8	177.6	0	0	0	0	109.4	E127 D131 Q132	E127-S129 VanDerWaalsContact C-N 3.3Å; E127-S129 PolarHBondContact O-N 2.8Å; S129-D131 PolarHBondContact O-N 3.11Å; S129-Q132 PolarHBondContact O-N 3.11Å
130	D	48	Very low	57.5	Low	173 Å²	173	102.8 Å²	102.8	93%	0.925	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	-22.6	-176.2	-113.6	-3.8	0	0	0	114.8	A128	A128-D130 PolarHBondContact O-N 3.46Å
131	D	51.7	Low	58.3	Low	160 Å²	160	102.6 Å²	102.6	86%	0.856	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-1.9	178.1	-68.9	-69.9	0	0	0	115.5	S129	S129-D131 PolarHBondContact O-N 3.11Å
132	Q	56.5	Low	59.7	Low	137 Å²	137	97.2 Å²	97.2	64%	0.64	52%	0.515	S	S	*	.	S	Bend	trans	-101.8	142.6	-178.8	-70.6	-163.5	-0	0	0	113.5	S129	S129-Q132 PolarHBondContact O-N 3.11Å
133	P	64.4	Low	61.2	Low	43 Å²	43	94 Å²	94	28%	0.279	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-65.5	138.2	175.7	28	-33.9	0	0	0	111	K135 W174 F184	P133-K135 PolarHBondContact O-N 2.79Å; P133-W174 HydrophobicContact CB-CZ2 4.09Å; P133-W174 HydrophobicContact CG-CH2 4.14Å; P133-W174 HydrophobicContact CG-CZ2 3.99Å; P133-F184 HydrophobicContact CB-CD2 4.4Å; P133-F184 HydrophobicContact CG-CB 4.08Å; P133-F184 HydrophobicContact CG-CD1 4.43Å; P133-F184 HydrophobicContact CG-CD2 3.67Å; P133-F184 HydrophobicContact CG-CE2 4.16Å; P133-F184 HydrophobicContact CG-CG 3.81Å
134	E	71.9	Confident	63.2	Low	133 Å²	133	88.6 Å²	88.6	62%	0.621	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-54.5	126.8	177.8	-170.6	179.4	178.2	0	0	110.7	R141 W174	E134-R141 IonicContact OE1-NH1 2.8Å; E134-W174 WeakPolarHBondContact O-CZ2 3.4Å
135	K	79.4	Confident	65.2	Low	121 Å²	121	82.2 Å²	82.2	53%	0.526	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-65.8	134.7	-178.1	-65.9	172	-174.2	164.4	0	109.5	P133 H137 W174	P133-K135 PolarHBondContact O-N 2.79Å; K135-H137 PolarHBondContact O-CD2 2.83Å; K135-H137 VanDerWaalsContact O-CD2 3.31Å; K135-W174 HydrophobicContact CB-CH2 4.47Å; K135-W174 HydrophobicContact CG-CH2 4.22Å; K135-W174 HydrophobicContact CG-CZ3 4.27Å
136	P	79.8	Confident	67.5	Low	5 Å²	5	79 Å²	79	3%	0.032	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-65.6	141.1	176.2	26.3	-33.8	0	0	0	111.1	I144 V159 W174 W182	P136-I144 HydrophobicContact CB-CD1 4.31Å; P136-V159 HydrophobicContact CB-CG1 3.67Å; P136-V159 HydrophobicContact CB-CG2 4.15Å; P136-V159 HydrophobicContact CG-CG1 4.24Å; P136-V159 HydrophobicContact CG-CG2 4.07Å; P136-W174 HydrophobicContact CG-CD2 3.94Å; P136-W174 HydrophobicContact CG-CE3 4.27Å; P136-W174 HydrophobicContact CG-CG 4.1Å; P136-W182 HydrophobicContact CG-CB 4.37Å; P136-W182 HydrophobicContact CG-CD2 3.56Å; P136-W182 HydrophobicContact CG-CE3 3.82Å; P136-W182 HydrophobicContact CG-CG 3.82Å; P136-W182 HydrophobicContact CG-CH2 4.47Å; P136-W182 HydrophobicContact CG-CZ2 4.25Å; P136-W182 HydrophobicContact CG-CZ3 4.26Å; P136-W182 PolarHBondContact O-NE1 2.88Å
137	H	72.4	Confident	69.6	Low	45 Å²	45	71.6 Å²	71.6	21%	0.208	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-103.5	153.1	177.6	-70.6	-92	0	0	0	110.6	E122 K135 D139 R141 S142	E122-H137 IonicContact OE2-CE1 3.76Å; E122-H137 IonicContact OE2-CG 3.3Å; E122-H137 IonicContact OE2-ND1 3.34Å; E122-H137 PolarHBondContact OE2-ND1 2.79Å; K135-H137 PolarHBondContact O-CD2 2.83Å; K135-H137 VanDerWaalsContact O-CD2 3.31Å; H137-D139 PolarHBondContact O-N 3.04Å; H137-D139 VanDerWaalsContact O-N 3.15Å; H137-R141 PolarHBondContact CD2-NH1 2.83Å; H137-R141 PolarHBondContact CD2-NH2 3.39Å; H137-R141 PolarHBondContact CE1-NH2 3.34Å; H137-R141 PolarHBondContact ND1-NH2 2.8Å; H137-R141 VanDerWaalsContact ND1-NH2 3.16Å; H137-R141 PolarHBondContact NE2-NH1 2.96Å; H137-R141 PolarHBondContact NE2-NH2 2.77Å; H137-S142 PolarHBondContact N-OG 3.07Å; H137-S142 WeakPolarHBondContact O-CB 3.29Å
138	F	71	Confident	71.8	Confident	22 Å²	22	63.5 Å²	63.5	10%	0.096	34%	0.344	C	S	.	.	S	Bend	trans	-78.3	13.9	175.2	-68.9	-78.3	0	0	0	113.5	Q106 L118 E122 I144 L176 W182	Q106-F138 HydrophobicContact CG-CB 4.23Å; Q106-F138 WeakPolarHBondContact CG-O 3.4Å; Q106-F138 PolarHBondContact NE2-O 2.82Å; L118-F138 HydrophobicContact CB-CD2 4.21Å; L118-F138 HydrophobicContact CB-CG 4.47Å; L118-F138 HydrophobicContact CD1-CD1 4.35Å; L118-F138 HydrophobicContact CD1-CD2 4.36Å; L118-F138 HydrophobicContact CD1-CE1 4.35Å; L118-F138 HydrophobicContact CD1-CE2 4.37Å; L118-F138 HydrophobicContact CD1-CG 4.35Å; L118-F138 HydrophobicContact CD1-CZ 4.36Å; E122-F138 PolarHBondContact OE1-N 3.39Å; F138-I144 HydrophobicContact CD1-CD1 4.39Å; F138-L176 HydrophobicContact CE1-CD2 4.25Å; F138-L176 HydrophobicContact CZ-CD1 3.89Å; F138-L176 HydrophobicContact CZ-CD2 3.87Å; F138-W182 HydrophobicContact CD1-CZ2 4.35Å; F138-W182 HydrophobicContact CE1-CH2 4.38Å; F138-W182 AromaticContact CE1-CZ2 3.6Å; F138-W182 HydrophobicContact CE1-CZ2 3.6Å; F138-W182 AromaticContact CE2-CE2 3.97Å; F138-W182 AromaticContact CE2-CZ2 3.97Å; F138-W182 HydrophobicContact CE2-CZ2 3.97Å; F138-W182 AromaticContact CE2-NE1 3.53Å; F138-W182 AromaticContact CZ-CE2 3.79Å; F138-W182 HydrophobicContact CZ-CH2 4.34Å; F138-W182 AromaticContact CZ-CZ2 3.38Å; F138-W182 HydrophobicContact CZ-CZ2 3.38Å; F138-W182 AromaticContact CZ-NE1 3.86Å
139	D	68.7	Low	74	Confident	56 Å²	56	61.8 Å²	61.8	30%	0.299	33%	0.327	S	S	.	.	S	Bend	trans	-98.9	-161.5	-175.7	73.4	20.8	0	0	0	113.2	H137 R141	H137-D139 PolarHBondContact O-N 3.04Å; H137-D139 VanDerWaalsContact O-N 3.15Å; D139-R141 VanDerWaalsContact C-N 3.28Å; D139-R141 PolarHBondContact O-N 3.13Å; D139-R141 WeakPolarHBondContact OD1-CB 3.27Å; D139-R141 WeakPolarHBondContact OD1-CG 3.15Å; D139-R141 PolarHBondContact OD1-N 2.9Å; D139-R141 IonicContact OD1-NE 2.72Å; D139-R141 PolarHBondContact OD1-NE 3.02Å; D139-R141 IonicContact OD2-CZ 3.88Å; D139-R141 VanDerWaalsContact OD2-CZ 3.25Å; D139-R141 IonicContact OD2-NE 3.57Å; D139-R141 PolarHBondContact OD2-NE 3.16Å; D139-R141 IonicContact OD2-NH2 3.89Å; D139-R141 PolarHBondContact OD2-NH2 3.41Å
140	S	67.9	Low	76	Confident	117 Å²	117	59.3 Å²	59.3	82%	0.818	31%	0.309	S	S	*	.	S	Bend	trans	-75.7	-7.2	-179.1	-60.5	0	0	0	0	114.9
141	R	72.4	Confident	77.4	Confident	108 Å²	108	58.5 Å²	58.5	41%	0.408	31%	0.305	S	S	.	.	S	Bend	trans	-73.8	-47.9	178.5	-66.8	178.2	-81.2	156.2	-4.4	110.9	E134 H137 D139 K161 S162 G163	E134-R141 IonicContact OE1-NH1 2.8Å; H137-R141 PolarHBondContact CD2-NH1 2.83Å; H137-R141 PolarHBondContact CD2-NH2 3.39Å; H137-R141 PolarHBondContact CE1-NH2 3.34Å; H137-R141 PolarHBondContact ND1-NH2 2.8Å; H137-R141 VanDerWaalsContact ND1-NH2 3.16Å; H137-R141 PolarHBondContact NE2-NH1 2.96Å; H137-R141 PolarHBondContact NE2-NH2 2.77Å; D139-R141 VanDerWaalsContact C-N 3.28Å; D139-R141 PolarHBondContact O-N 3.13Å; D139-R141 WeakPolarHBondContact OD1-CB 3.27Å; D139-R141 WeakPolarHBondContact OD1-CG 3.15Å; D139-R141 PolarHBondContact OD1-N 2.9Å; D139-R141 IonicContact OD1-NE 2.72Å; D139-R141 PolarHBondContact OD1-NE 3.02Å; D139-R141 IonicContact OD2-CZ 3.88Å; D139-R141 VanDerWaalsContact OD2-CZ 3.25Å; D139-R141 IonicContact OD2-NE 3.57Å; D139-R141 PolarHBondContact OD2-NE 3.16Å; D139-R141 IonicContact OD2-NH2 3.89Å; D139-R141 PolarHBondContact OD2-NH2 3.41Å; R141-K161 VanDerWaalsContact O-O 3.06Å; R141-S162 CarbonylContact O-C 3.56Å; R141-G163 WeakPolarHBondContact O-CA 3.46Å; R141-G163 PolarHBondContact O-N 2.83Å
142	S	80.2	Confident	78.6	Confident	16 Å²	16	53.5 Å²	53.5	11%	0.112	29%	0.291	C	S	.	.			trans	-101.5	144.4	-177.6	-50.3	0	0	0	0	112.7	H137 Y160	H137-S142 PolarHBondContact N-OG 3.07Å; H137-S142 WeakPolarHBondContact O-CB 3.29Å; S142-Y160 VanDerWaalsContact CA-O 3.27Å; S142-Y160 WeakPolarHBondContact CA-O 3.48Å
143	V	86.2	Confident	79.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	125	167.7	-164.9	0	0	0	0	108.6	Q103 F145 V159 Y160 K164 A166	Q103-V143 HydrophobicContact CG-CG1 4.23Å; V143-F145 HydrophobicContact CB-CE2 4.29Å; V143-F145 HydrophobicContact CG1-CD2 4.44Å; V143-F145 HydrophobicContact CG1-CE2 3.48Å; V143-F145 VanDerWaalsContact CG1-CE2 3.48Å; V143-F145 HydrophobicContact CG1-CZ 3.58Å; V143-V159 CarbonylContact O-C 3.5Å; V143-Y160 HydrophobicContact CB-CD2 4.4Å; V143-Y160 PolarHBondContact N-O 2.83Å; V143-Y160 VanDerWaalsContact N-O 3.08Å; V143-Y160 WeakPolarHBondContact O-CD2 3.46Å; V143-Y160 PolarHBondContact O-N 3.24Å; V143-K164 HydrophobicContact CG2-CG 3.97Å; V143-A166 HydrophobicContact CB-CB 4.49Å; V143-A166 HydrophobicContact CG2-CB 4.03Å
144	I	89.6	Confident	80.7	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.3	-166.1	-53	-179.6	0	0	0	109.7	Q103 L104 P136 F138 C157 L158 V159 W182	Q103-I144 CarbonylContact C-O 3.52Å; Q103-I144 VanDerWaalsContact CA-O 3.28Å; Q103-I144 WeakPolarHBondContact CA-O 3.42Å; Q103-I144 WeakPolarHBondContact CG-O 3.21Å; L104-I144 HydrophobicContact CB-CB 4.25Å; L104-I144 HydrophobicContact CB-CG2 4.01Å; L104-I144 HydrophobicContact CD1-CG2 4.01Å; L104-I144 HydrophobicContact CG-CG2 4.35Å; L104-I144 PolarHBondContact N-O 2.91Å; P136-I144 HydrophobicContact CB-CD1 4.31Å; F138-I144 HydrophobicContact CD1-CD1 4.39Å; I144-C157 HydrophobicContact CG2-CB 3.8Å; I144-L158 CarbonylContact C-O 3.59Å; I144-L158 WeakPolarHBondContact CA-O 3.08Å; I144-V159 HydrophobicContact CG1-CG2 4.5Å; I144-V159 HydrophobicContact CG2-CG2 4.41Å; I144-W182 HydrophobicContact CD1-CH2 3.93Å; I144-W182 HydrophobicContact CD1-CZ2 3.66Å; I144-W182 HydrophobicContact CG2-CH2 3.89Å
145	F	91	Very high	81.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.1	178.9	-57.1	-90.4	0	0	0	113.2	W53 N57 L101 T102 Q103 V143 L147 C157 L158 Y160	W53-F145 HydrophobicContact CH2-CD1 4.26Å; W53-F145 HydrophobicContact CH2-CD2 4.14Å; W53-F145 HydrophobicContact CH2-CE1 4.06Å; W53-F145 AromaticContact CH2-CE2 3.91Å; W53-F145 HydrophobicContact CH2-CE2 3.91Å; W53-F145 HydrophobicContact CH2-CG 4.3Å; W53-F145 AromaticContact CH2-CZ 3.87Å; W53-F145 HydrophobicContact CH2-CZ 3.87Å; W53-F145 AromaticContact CZ2-CD1 3.49Å; W53-F145 HydrophobicContact CZ2-CD1 3.49Å; W53-F145 VanDerWaalsContact CZ2-CD1 3.49Å; W53-F145 HydrophobicContact CZ2-CD2 4.11Å; W53-F145 AromaticContact CZ2-CE1 3.51Å; W53-F145 HydrophobicContact CZ2-CE1 3.51Å; W53-F145 HydrophobicContact CZ2-CE2 4.11Å; W53-F145 AromaticContact CZ2-CG 3.8Å; W53-F145 HydrophobicContact CZ2-CG 3.8Å; W53-F145 AromaticContact CZ2-CZ 3.83Å; W53-F145 HydrophobicContact CZ2-CZ 3.83Å; N57-F145 HydrophobicContact CB-CE1 4.01Å; N57-F145 HydrophobicContact CB-CZ 3.89Å; L101-F145 HydrophobicContact CD1-CB 3.66Å; L101-F145 HydrophobicContact CG-CB 4Å; T102-F145 VanDerWaalsContact O-CA 3.24Å; T102-F145 WeakPolarHBondContact O-CA 3.49Å; Q103-F145 HydrophobicContact CB-CD1 3.91Å; Q103-F145 HydrophobicContact CB-CE1 3.72Å; Q103-F145 HydrophobicContact CG-CD1 4.28Å; Q103-F145 HydrophobicContact CG-CE1 3.95Å; Q103-F145 HydrophobicContact CG-CZ 4.33Å; V143-F145 HydrophobicContact CB-CE2 4.29Å; V143-F145 HydrophobicContact CG1-CD2 4.44Å; V143-F145 HydrophobicContact CG1-CE2 3.48Å; V143-F145 VanDerWaalsContact CG1-CE2 3.48Å; V143-F145 HydrophobicContact CG1-CZ 3.58Å; F145-L147 PolarHBondContact O-N 2.88Å; F145-C157 CarbonylContact O-C 3.45Å; F145-C157 WeakPolarHBondContact O-CA 3.38Å; F145-L158 PolarHBondContact N-O 2.89Å; F145-L158 PolarHBondContact O-N 2.77Å; F145-Y160 HydrophobicContact CD2-CD2 4.02Å; F145-Y160 AromaticContact CD2-CE2 3.6Å; F145-Y160 HydrophobicContact CD2-CE2 3.6Å; F145-Y160 AromaticContact CE2-CD2 3.83Å; F145-Y160 HydrophobicContact CE2-CD2 3.83Å; F145-Y160 AromaticContact CE2-CE2 3.47Å; F145-Y160 HydrophobicContact CE2-CE2 3.47Å; F145-Y160 VanDerWaalsContact CE2-CE2 3.47Å
146	E	92.5	Very high	82.1	Confident	28 Å²	28	36.6 Å²	36.6	13%	0.131	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	103.6	-177.3	-170.8	-175.6	118	0	0	112.8	N96 L101 T102 L104 K155	N96-E146 PolarHBondContact ND2-O 2.88Å; L101-E146 WeakPolarHBondContact CD1-O 3.3Å; T102-E146 PolarHBondContact O-N 2.87Å; L104-E146 HydrophobicContact CD1-CB 4.5Å; L104-E146 HydrophobicContact CD2-CB 4.26Å; L104-E146 HydrophobicContact CG-CB 4.36Å; E146-K155 HydrophobicContact CG-CD 4.2Å; E146-K155 WeakPolarHBondContact OE2-CD 3.34Å; E146-K155 VanDerWaalsContact OE2-CE 3.26Å; E146-K155 WeakPolarHBondContact OE2-CE 3.18Å; E146-K155 IonicContact OE2-NZ 2.71Å; E146-K155 PolarHBondContact OE2-NZ 2.83Å
147	L	92	Very high	82.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-39.7	173.6	-71.6	173	0	0	0	112	N96 L101 F145 V156 L158 I173 F189	N96-L147 WeakPolarHBondContact CB-O 3.28Å; N96-L147 PolarHBondContact N-O 3.21Å; L101-L147 HydrophobicContact CD1-CD2 3.91Å; L101-L147 HydrophobicContact CD1-CG 4.43Å; F145-L147 PolarHBondContact O-N 2.88Å; L147-V156 HydrophobicContact CB-CG1 4.38Å; L147-V156 HydrophobicContact CD1-CG1 4.31Å; L147-V156 PolarHBondContact N-O 2.74Å; L147-L158 HydrophobicContact CD1-CB 3.9Å; L147-L158 HydrophobicContact CD2-CB 4.34Å; L147-L158 HydrophobicContact CG-CB 3.95Å; L147-I173 HydrophobicContact CD1-CD1 3.78Å; L147-I173 HydrophobicContact CD1-CG2 4.48Å; L147-F189 HydrophobicContact CD1-CD2 4.11Å; L147-F189 HydrophobicContact CD2-CD2 4.45Å; L147-F189 HydrophobicContact CD2-CE2 4.41Å
148	D	90.4	Very high	83.7	Confident	10 Å²	10	34.3 Å²	34.3	5%	0.053	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	151.5	175.4	-176.8	29.6	0	0	0	111.2	A94 C150 K155 V156	A94-D148 WeakPolarHBondContact CB-OD1 3.36Å; A94-D148 WeakPolarHBondContact O-CB 3.46Å; D148-C150 PolarHBondContact OD1-N 3.1Å; D148-C150 VanDerWaalsContact OD1-N 3.15Å; D148-C150 VanDerWaalsContact OD2-CA 3.28Å; D148-C150 WeakPolarHBondContact OD2-CA 3.39Å; D148-C150 PolarHBondContact OD2-N 3.15Å; D148-C150 VanDerWaalsContact OD2-N 3.1Å; D148-C150 PolarHBondContact OD2-SG 3.32Å; D148-K155 CarbonylContact O-C 3.59Å; D148-K155 VanDerWaalsContact O-CA 3.29Å; D148-K155 WeakPolarHBondContact O-CA 3.25Å; D148-V156 HydrophobicContact CB-CB 4.4Å; D148-V156 PolarHBondContact N-O 3.14Å; D148-V156 PolarHBondContact O-N 2.97Å
149	S	85.6	Confident	84.7	Confident	52 Å²	52	33.3 Å²	33.3	36%	0.364	20%	0.198	S	C	.	.			trans	-101.4	3.7	175.1	60.2	0	0	0	0	113.1	N151 G152 G154	S149-N151 PolarHBondContact O-N 3.31Å; S149-G152 PolarHBondContact O-N 2.81Å; S149-G154 CarbonylContact C-O 3.47Å; S149-G154 VanDerWaalsContact C-O 3.29Å
150	C	83.4	Confident	85.6	Confident	12 Å²	12	30.6 Å²	30.6	8%	0.081	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	47.5	38	170.2	-54.6	0	0	0	0	113.9	D148 G152 S153 Q206	D148-C150 PolarHBondContact OD1-N 3.1Å; D148-C150 VanDerWaalsContact OD1-N 3.15Å; D148-C150 VanDerWaalsContact OD2-CA 3.28Å; D148-C150 WeakPolarHBondContact OD2-CA 3.39Å; D148-C150 PolarHBondContact OD2-N 3.15Å; D148-C150 VanDerWaalsContact OD2-N 3.1Å; D148-C150 PolarHBondContact OD2-SG 3.32Å; C150-G152 PolarHBondContact O-N 2.93Å; C150-G152 VanDerWaalsContact O-N 3.16Å; C150-S153 WeakPolarHBondContact CB-OG 3.24Å; C150-S153 WeakPolarHBondContact O-CB 3.21Å; C150-S153 PolarHBondContact O-N 2.8Å; C150-S153 PolarHBondContact O-OG 2.71Å; C150-Q206 PolarHBondContact SG-NE2 3.46Å
151	N	78.8	Confident	86.1	Confident	156 Å²	156	29.1 Å²	29.1	83%	0.834	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	48.1	36.5	-173.5	-155.4	50.1	0	0	0	114.5	S149	S149-N151 PolarHBondContact O-N 3.31Å
152	G	77.3	Confident	85.9	Confident	54 Å²	54	26 Å²	26	56%	0.557	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	82.3	7.7	179.9	0	0	0	0	0	115.6	S149 C150 R178	S149-G152 PolarHBondContact O-N 2.81Å; C150-G152 PolarHBondContact O-N 2.93Å; C150-G152 VanDerWaalsContact O-N 3.16Å; G152-R178 WeakPolarHBondContact O-CD 3.36Å
153	S	77.8	Confident	85	Confident	20 Å²	20	27 Å²	27	14%	0.14	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.1	177.4	66.7	0	0	0	0	114.8	C150 Y207	C150-S153 WeakPolarHBondContact CB-OG 3.24Å; C150-S153 WeakPolarHBondContact O-CB 3.21Å; C150-S153 PolarHBondContact O-N 2.8Å; C150-S153 PolarHBondContact O-OG 2.71Å; S153-Y207 PolarHBondContact O-OH 2.88Å
154	G	85.8	Confident	83.9	Confident	8 Å²	8	31.5 Å²	31.5	8%	0.082	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	-160.2	-177	0	0	0	0	0	108.8	S149 L176	S149-G154 CarbonylContact C-O 3.47Å; S149-G154 VanDerWaalsContact C-O 3.29Å; G154-L176 CarbonylContact C-O 3.49Å; G154-L176 WeakPolarHBondContact CA-O 3.48Å
155	K	90.4	Very high	82.5	Confident	52 Å²	52	35.6 Å²	35.6	23%	0.226	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	145.3	170	-58.6	-174.6	176.6	-158.9	0	110.1	L104 E146 D148 F175 L176	L104-K155 HydrophobicContact CD1-CD 3.98Å; L104-K155 HydrophobicContact CD2-CD 4.43Å; E146-K155 HydrophobicContact CG-CD 4.2Å; E146-K155 WeakPolarHBondContact OE2-CD 3.34Å; E146-K155 VanDerWaalsContact OE2-CE 3.26Å; E146-K155 WeakPolarHBondContact OE2-CE 3.18Å; E146-K155 IonicContact OE2-NZ 2.71Å; E146-K155 PolarHBondContact OE2-NZ 2.83Å; D148-K155 CarbonylContact O-C 3.59Å; D148-K155 VanDerWaalsContact O-CA 3.29Å; D148-K155 WeakPolarHBondContact O-CA 3.25Å; K155-F175 CarbonylContact O-C 3.55Å; K155-F175 WeakPolarHBondContact O-CA 3.28Å; K155-F175 VanDerWaalsContact O-CD2 3.24Å; K155-F175 WeakPolarHBondContact O-CD2 3.33Å; K155-L176 HydrophobicContact CB-CB 4.38Å; K155-L176 PolarHBondContact N-O 2.67Å; K155-L176 PolarHBondContact O-N 3.08Å
156	V	91.8	Very high	81.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.3	162.4	175	0	0	0	0	108.6	L147 D148 I173 F175 L185 Y192 Q206	L147-V156 HydrophobicContact CB-CG1 4.38Å; L147-V156 HydrophobicContact CD1-CG1 4.31Å; L147-V156 PolarHBondContact N-O 2.74Å; D148-V156 HydrophobicContact CB-CB 4.4Å; D148-V156 PolarHBondContact N-O 3.14Å; D148-V156 PolarHBondContact O-N 2.97Å; V156-I173 HydrophobicContact CG1-CG2 3.49Å; V156-I173 VanDerWaalsContact CG1-CG2 3.49Å; V156-F175 HydrophobicContact CG2-CD2 4.03Å; V156-L185 HydrophobicContact CG1-CD1 4.38Å; V156-L185 HydrophobicContact CG2-CD1 4.05Å; V156-Y192 HydrophobicContact CB-CE2 4.32Å; V156-Y192 HydrophobicContact CG1-CD2 4.17Å; V156-Y192 HydrophobicContact CG1-CE1 4.12Å; V156-Y192 HydrophobicContact CG1-CE2 3.73Å; V156-Y192 HydrophobicContact CG2-CE2 3.86Å; V156-Q206 HydrophobicContact CG2-CG 4.28Å
157	C	92.9	Very high	80.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.6	-171.7	-61.3	0	0	0	0	111.3	L104 I144 F145 V159 I173 W174 W182	L104-C157 VanDerWaalsContact CD1-SG 3.52Å; I144-C157 HydrophobicContact CG2-CB 3.8Å; F145-C157 CarbonylContact O-C 3.45Å; F145-C157 WeakPolarHBondContact O-CA 3.38Å; C157-V159 HydrophobicContact CB-CG2 4.29Å; C157-I173 WeakPolarHBondContact O-CA 3.47Å; C157-W174 PolarHBondContact N-O 2.86Å; C157-W174 PolarHBondContact O-N 2.97Å; C157-W182 HydrophobicContact CB-CH2 4.31Å; C157-W182 HydrophobicContact CB-CZ3 4.04Å
158	L	92.6	Very high	80.1	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.4	159.5	179.5	64.7	0	0	0	107.4	P62 V65 I144 F145 L147 Y160 T171 I173	P62-L158 HydrophobicContact CG-CD1 4.48Å; V65-L158 HydrophobicContact CG2-CD1 4.48Å; V65-L158 HydrophobicContact CG2-CD2 4.34Å; I144-L158 CarbonylContact C-O 3.59Å; I144-L158 WeakPolarHBondContact CA-O 3.08Å; F145-L158 PolarHBondContact N-O 2.89Å; F145-L158 PolarHBondContact O-N 2.77Å; L147-L158 HydrophobicContact CD1-CB 3.9Å; L147-L158 HydrophobicContact CD2-CB 4.34Å; L147-L158 HydrophobicContact CG-CB 3.95Å; L158-Y160 HydrophobicContact CD2-CE2 3.78Å; L158-Y160 HydrophobicContact CG-CD2 4.47Å; L158-Y160 HydrophobicContact CG-CE2 3.86Å; L158-T171 HydrophobicContact CD1-CG2 4.37Å; L158-I173 HydrophobicContact CD1-CD1 3.73Å
159	V	90.6	Very high	79.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.1	-178.9	169.5	0	0	0	0	108.4	P136 V143 I144 C157 T171 E172 W174	P136-V159 HydrophobicContact CB-CG1 3.67Å; P136-V159 HydrophobicContact CB-CG2 4.15Å; P136-V159 HydrophobicContact CG-CG1 4.24Å; P136-V159 HydrophobicContact CG-CG2 4.07Å; V143-V159 CarbonylContact O-C 3.5Å; I144-V159 HydrophobicContact CG1-CG2 4.5Å; I144-V159 HydrophobicContact CG2-CG2 4.41Å; C157-V159 HydrophobicContact CB-CG2 4.29Å; V159-T171 CarbonylContact O-C 3.59Å; V159-T171 WeakPolarHBondContact O-CA 3.39Å; V159-T171 WeakPolarHBondContact O-CB 3.18Å; V159-E172 PolarHBondContact N-O 3.16Å; V159-E172 PolarHBondContact O-N 2.72Å; V159-W174 HydrophobicContact CG2-CB 3.99Å; V159-W174 HydrophobicContact CG2-CG 3.99Å
160	Y	88	Confident	79.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.2	166.6	-62.5	-114.5	0	0	0	107.6	C59 V60 P62 S142 V143 F145 L158 A166 L167 D170 T171	C59-Y160 HydrophobicContact CB-CD1 4.49Å; C59-Y160 HydrophobicContact CB-CE1 4.02Å; V60-Y160 WeakPolarHBondContact O-CE1 3.26Å; V60-Y160 PolarHBondContact O-OH 3.38Å; P62-Y160 WeakPolarHBondContact CD-OH 3.33Å; S142-Y160 VanDerWaalsContact CA-O 3.27Å; S142-Y160 WeakPolarHBondContact CA-O 3.48Å; V143-Y160 HydrophobicContact CB-CD2 4.4Å; V143-Y160 PolarHBondContact N-O 2.83Å; V143-Y160 VanDerWaalsContact N-O 3.08Å; V143-Y160 WeakPolarHBondContact O-CD2 3.46Å; V143-Y160 PolarHBondContact O-N 3.24Å; F145-Y160 HydrophobicContact CD2-CD2 4.02Å; F145-Y160 AromaticContact CD2-CE2 3.6Å; F145-Y160 HydrophobicContact CD2-CE2 3.6Å; F145-Y160 AromaticContact CE2-CD2 3.83Å; F145-Y160 HydrophobicContact CE2-CD2 3.83Å; F145-Y160 AromaticContact CE2-CE2 3.47Å; F145-Y160 HydrophobicContact CE2-CE2 3.47Å; F145-Y160 VanDerWaalsContact CE2-CE2 3.47Å; L158-Y160 HydrophobicContact CD2-CE2 3.78Å; L158-Y160 HydrophobicContact CG-CD2 4.47Å; L158-Y160 HydrophobicContact CG-CE2 3.86Å; Y160-A166 HydrophobicContact CD1-CB 3.47Å; Y160-A166 VanDerWaalsContact CD1-CB 3.47Å; Y160-A166 HydrophobicContact CE1-CB 4.25Å; Y160-A166 HydrophobicContact CG-CB 3.8Å; Y160-L167 WeakPolarHBondContact CD1-O 3.26Å; Y160-D170 CarbonylContact C-O 3.46Å; Y160-D170 WeakPolarHBondContact CA-O 3.27Å; Y160-T171 HydrophobicContact CD1-CG2 3.35Å; Y160-T171 HydrophobicContact CD2-CG2 4.1Å; Y160-T171 HydrophobicContact CE1-CG2 3.42Å; Y160-T171 VanDerWaalsContact CE1-CG2 3.42Å; Y160-T171 HydrophobicContact CE2-CG2 4.13Å; Y160-T171 HydrophobicContact CG-CG2 3.72Å
161	K	78.6	Confident	79.4	Confident	86 Å²	86	49 Å²	49	37%	0.374	28%	0.283	S	S	.	.	S	Bend	trans	-73.7	-34.9	-179.8	-68.3	-173.7	179.1	171	0	113.4	R141 D170 E172	R141-K161 VanDerWaalsContact O-O 3.06Å; K161-D170 HydrophobicContact CB-CB 4.45Å; K161-D170 PolarHBondContact N-O 2.88Å; K161-E172 WeakPolarHBondContact CE-OE1 3.39Å; K161-E172 WeakPolarHBondContact CE-OE2 3.41Å; K161-E172 IonicContact NZ-OE1 2.73Å; K161-E172 PolarHBondContact NZ-OE1 3.08Å; K161-E172 IonicContact NZ-OE2 2.75Å; K161-E172 PolarHBondContact NZ-OE2 3.37Å
162	S	69.1	Low	80	Confident	43 Å²	43	42.5 Å²	42.5	30%	0.301	25%	0.247	S	C	.	.	S	Bend	trans	-86.9	129.9	-178.9	-69.8	0	0	0	0	112	R141 A166 D170	R141-S162 CarbonylContact O-C 3.56Å; S162-A166 WeakPolarHBondContact O-CB 3.06Å; S162-D170 WeakPolarHBondContact CB-OD2 3.26Å; S162-D170 VanDerWaalsContact OG-CG 3.28Å; S162-D170 PolarHBondContact OG-OD2 3.37Å
163	G	61.7	Low	80.7	Confident	35 Å²	35	40 Å²	40	36%	0.361	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-60	163.5	170.7	0	0	0	0	0	112.5	R141 P165	R141-G163 WeakPolarHBondContact O-CA 3.46Å; R141-G163 PolarHBondContact O-N 2.83Å; G163-P165 CarbonylContact O-C 3.59Å
164	K	62.4	Low	81.4	Confident	100 Å²	100	39.3 Å²	39.3	44%	0.435	22%	0.216	S	C	.	.	S	Bend	trans	-61.7	133.1	-166	-59.6	-170.1	-179.3	-162.3	0	112.8	N57 N58 V143	N57-K164 WeakPolarHBondContact O-CE 3.37Å; N57-K164 PolarHBondContact O-NZ 2.75Å; N58-K164 HydrophobicContact CB-CD 4.36Å; V143-K164 HydrophobicContact CG2-CG 3.97Å
165	P	60.4	Low	81.6	Confident	89 Å²	89	39 Å²	39	58%	0.578	21%	0.212	S	C	*	.	S	Bend	cis	-78.7	122.5	6.3	31.8	-34.1	0	0	0	112.5	G163 L167	G163-P165 CarbonylContact O-C 3.59Å; P165-L167 PolarHBondContact O-N 3.04Å
166	A	75.1	Confident	81.5	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.008	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-78.7	124	-175.3	0	0	0	0	0	110.7	C59 V60 V143 Y160 S162	C59-A166 WeakPolarHBondContact CA-O 3.42Å; C59-A166 HydrophobicContact CB-CB 3.82Å; V60-A166 PolarHBondContact N-O 3.47Å; V143-A166 HydrophobicContact CB-CB 4.49Å; V143-A166 HydrophobicContact CG2-CB 4.03Å; Y160-A166 HydrophobicContact CD1-CB 3.47Å; Y160-A166 VanDerWaalsContact CD1-CB 3.47Å; Y160-A166 HydrophobicContact CE1-CB 4.25Å; Y160-A166 HydrophobicContact CG-CB 3.8Å; S162-A166 WeakPolarHBondContact O-CB 3.06Å
167	L	74.9	Confident	81.2	Confident	89 Å²	89	37.3 Å²	37.3	47%	0.466	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-83.7	150.9	-173.1	-64.9	174.4	0	0	0	112.5	Y160 P165 E169 D170	Y160-L167 WeakPolarHBondContact CD1-O 3.26Å; P165-L167 PolarHBondContact O-N 3.04Å; L167-E169 PolarHBondContact O-N 3.03Å; L167-D170 PolarHBondContact O-N 3.37Å
168	A	75.7	Confident	80.6	Confident	35 Å²	35	46.4 Å²	46.4	29%	0.289	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14	177.9	0	0	0	0	0	114.3	V60	V60-A168 HydrophobicContact CB-CB 4.2Å; V60-A168 HydrophobicContact CG1-CB 3.99Å
169	E	73.2	Confident	80	Confident	185 Å²	185	49.5 Å²	49.5	86%	0.864	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-18.5	179.7	-62.2	179.6	174.8	0	0	112.1	L167 T171	L167-E169 PolarHBondContact O-N 3.03Å; E169-T171 VanDerWaalsContact C-N 3.32Å; E169-T171 PolarHBondContact O-N 3.06Å
170	D	81.8	Confident	79.3	Confident	53 Å²	53	52.7 Å²	52.7	28%	0.283	28%	0.282	S	S	.	.	S	Bend	trans	-93.5	25.7	-178.6	-68.7	-37.1	0	0	0	112.9	Y160 K161 S162 L167	Y160-D170 CarbonylContact C-O 3.46Å; Y160-D170 WeakPolarHBondContact CA-O 3.27Å; K161-D170 HydrophobicContact CB-CB 4.45Å; K161-D170 PolarHBondContact N-O 2.88Å; S162-D170 WeakPolarHBondContact CB-OD2 3.26Å; S162-D170 VanDerWaalsContact OG-CG 3.28Å; S162-D170 PolarHBondContact OG-OD2 3.37Å; L167-D170 PolarHBondContact O-N 3.37Å
171	T	88.8	Confident	79	Confident	20 Å²	20	58.8 Å²	58.8	12%	0.123	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	146.9	-175	61.5	0	0	0	0	114.6	P62 L158 V159 Y160 E169	P62-T171 HydrophobicContact CG-CG2 3.5Å; P62-T171 VanDerWaalsContact CG-CG2 3.5Å; P62-T171 VanDerWaalsContact CG-OG1 3.27Å; P62-T171 WeakPolarHBondContact CG-OG1 3.39Å; L158-T171 HydrophobicContact CD1-CG2 4.37Å; V159-T171 CarbonylContact O-C 3.59Å; V159-T171 WeakPolarHBondContact O-CA 3.39Å; V159-T171 WeakPolarHBondContact O-CB 3.18Å; Y160-T171 HydrophobicContact CD1-CG2 3.35Å; Y160-T171 HydrophobicContact CD2-CG2 4.1Å; Y160-T171 HydrophobicContact CE1-CG2 3.42Å; Y160-T171 VanDerWaalsContact CE1-CG2 3.42Å; Y160-T171 HydrophobicContact CE2-CG2 4.13Å; Y160-T171 HydrophobicContact CG-CG2 3.72Å; E169-T171 VanDerWaalsContact C-N 3.32Å; E169-T171 PolarHBondContact O-N 3.06Å
172	E	91.9	Very high	79.4	Confident	21 Å²	21	56 Å²	56	10%	0.098	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	165.2	174.1	-71.2	-179	155.6	0	0	111.5	V159 K161 W174 F184	V159-E172 PolarHBondContact N-O 3.16Å; V159-E172 PolarHBondContact O-N 2.72Å; K161-E172 WeakPolarHBondContact CE-OE1 3.39Å; K161-E172 WeakPolarHBondContact CE-OE2 3.41Å; K161-E172 IonicContact NZ-OE1 2.73Å; K161-E172 PolarHBondContact NZ-OE1 3.08Å; K161-E172 IonicContact NZ-OE2 2.75Å; K161-E172 PolarHBondContact NZ-OE2 3.37Å; E172-W174 PolarHBondContact OE2-NE1 3.31Å; E172-F184 HydrophobicContact CB-CE2 4.3Å; E172-F184 HydrophobicContact CG-CE2 4.08Å
173	I	92.3	Very high	80.2	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	118.8	174.1	-46.7	-62.8	0	0	0	109.9	L147 V156 C157 L158 L185 T186 F189 Y192	L147-I173 HydrophobicContact CD1-CD1 3.78Å; L147-I173 HydrophobicContact CD1-CG2 4.48Å; V156-I173 HydrophobicContact CG1-CG2 3.49Å; V156-I173 VanDerWaalsContact CG1-CG2 3.49Å; C157-I173 WeakPolarHBondContact O-CA 3.47Å; L158-I173 HydrophobicContact CD1-CD1 3.73Å; I173-L185 HydrophobicContact CG2-CD1 4.42Å; I173-L185 WeakPolarHBondContact O-CB 3.24Å; I173-L185 PolarHBondContact O-N 3.32Å; I173-T186 PolarHBondContact N-O 2.89Å; I173-T186 PolarHBondContact O-N 2.87Å; I173-F189 HydrophobicContact CD1-CB 4.18Å; I173-Y192 HydrophobicContact CG2-CD1 4.39Å; I173-Y192 HydrophobicContact CG2-CD2 3.93Å; I173-Y192 HydrophobicContact CG2-CG 3.78Å
174	W	91.9	Very high	81.4	Confident	6 Å²	6	56.7 Å²	56.7	2%	0.023	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	148	-178.8	-72.2	75.2	0	0	0	111.3	P133 E134 K135 P136 C157 V159 E172 W182 F184	P133-W174 HydrophobicContact CB-CZ2 4.09Å; P133-W174 HydrophobicContact CG-CH2 4.14Å; P133-W174 HydrophobicContact CG-CZ2 3.99Å; E134-W174 WeakPolarHBondContact O-CZ2 3.4Å; K135-W174 HydrophobicContact CB-CH2 4.47Å; K135-W174 HydrophobicContact CG-CH2 4.22Å; K135-W174 HydrophobicContact CG-CZ3 4.27Å; P136-W174 HydrophobicContact CG-CD2 3.94Å; P136-W174 HydrophobicContact CG-CE3 4.27Å; P136-W174 HydrophobicContact CG-CG 4.1Å; C157-W174 PolarHBondContact N-O 2.86Å; C157-W174 PolarHBondContact O-N 2.97Å; V159-W174 HydrophobicContact CG2-CB 3.99Å; V159-W174 HydrophobicContact CG2-CG 3.99Å; E172-W174 PolarHBondContact OE2-NE1 3.31Å; W174-W182 HydrophobicContact CB-CE3 3.87Å; W174-W182 HydrophobicContact CB-CZ3 4.03Å; W174-W182 HydrophobicContact CE3-CB 3.78Å; W174-W182 HydrophobicContact CZ3-CB 3.95Å; W174-F184 HydrophobicContact CD2-CB 4.29Å; W174-F184 HydrophobicContact CD2-CD2 4.42Å; W174-F184 AromaticContact CE2-CD2 3.83Å; W174-F184 HydrophobicContact CE3-CB 4.09Å; W174-F184 VanDerWaalsContact CE3-N 3.3Å; W174-F184 HydrophobicContact CH2-CB 3.96Å; W174-F184 HydrophobicContact CZ2-CB 4.14Å; W174-F184 AromaticContact CZ2-CD2 3.93Å; W174-F184 HydrophobicContact CZ2-CD2 3.93Å; W174-F184 HydrophobicContact CZ3-CB 3.93Å; W174-F184 AromaticContact NE1-CD2 3.95Å
175	F	90.1	Very high	82.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.2	167.7	-178.6	-113.7	0	0	0	109.8	K155 V156 D177 H183 L185 Q206 Y207 T210	K155-F175 CarbonylContact O-C 3.55Å; K155-F175 WeakPolarHBondContact O-CA 3.28Å; K155-F175 VanDerWaalsContact O-CD2 3.24Å; K155-F175 WeakPolarHBondContact O-CD2 3.33Å; V156-F175 HydrophobicContact CG2-CD2 4.03Å; F175-D177 HydrophobicContact CD1-CB 4.42Å; F175-D177 HydrophobicContact CE1-CB 3.87Å; F175-H183 HydrophobicContact CB-CB 4.45Å; F175-H183 PolarHBondContact N-O 2.91Å; F175-H183 PolarHBondContact O-N 3.48Å; F175-L185 HydrophobicContact CB-CD1 4.06Å; F175-L185 HydrophobicContact CB-CD2 4.12Å; F175-L185 HydrophobicContact CB-CG 3.99Å; F175-Q206 HydrophobicContact CB-CB 4.49Å; F175-Q206 HydrophobicContact CD1-CB 4.04Å; F175-Q206 HydrophobicContact CD2-CB 3.72Å; F175-Q206 HydrophobicContact CD2-CG 3.83Å; F175-Q206 HydrophobicContact CE1-CB 4.15Å; F175-Q206 HydrophobicContact CE2-CB 3.84Å; F175-Q206 HydrophobicContact CE2-CG 3.99Å; F175-Q206 HydrophobicContact CG-CB 3.83Å; F175-Q206 HydrophobicContact CG-CG 4.37Å; F175-Q206 HydrophobicContact CZ-CB 4.06Å; F175-Y207 HydrophobicContact CE1-CD2 4.01Å; F175-Y207 HydrophobicContact CE1-CE1 4.19Å; F175-Y207 AromaticContact CE1-CE2 3.65Å; F175-Y207 HydrophobicContact CE1-CE2 3.65Å; F175-Y207 HydrophobicContact CE1-CG 4.45Å; F175-Y207 AromaticContact CE1-CZ 3.75Å; F175-Y207 HydrophobicContact CZ-CD2 4.13Å; F175-Y207 AromaticContact CZ-CE2 3.56Å; F175-Y207 HydrophobicContact CZ-CE2 3.56Å; F175-Y207 AromaticContact CZ-CZ 3.96Å; F175-T210 HydrophobicContact CD1-CG2 4.48Å
176	L	88.6	Confident	84.1	Confident	9 Å²	9	48.9 Å²	48.9	5%	0.047	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116.1	170.9	-177.5	63.7	0	0	0	108.5	F138 G154 K155 L180 W182	F138-L176 HydrophobicContact CE1-CD2 4.25Å; F138-L176 HydrophobicContact CZ-CD1 3.89Å; F138-L176 HydrophobicContact CZ-CD2 3.87Å; G154-L176 CarbonylContact C-O 3.49Å; G154-L176 WeakPolarHBondContact CA-O 3.48Å; K155-L176 HydrophobicContact CB-CB 4.38Å; K155-L176 PolarHBondContact N-O 2.67Å; K155-L176 PolarHBondContact O-N 3.08Å; L176-L180 HydrophobicContact CD1-CB 4.22Å; L176-L180 HydrophobicContact CD1-CD2 4.28Å; L176-L180 WeakPolarHBondContact CD1-O 3.47Å; L176-L180 HydrophobicContact CD2-CD2 4.16Å; L176-L180 HydrophobicContact CG-CD2 4.31Å; L176-W182 HydrophobicContact CB-CE3 3.94Å; L176-W182 HydrophobicContact CB-CH2 4.05Å; L176-W182 HydrophobicContact CB-CZ3 3.63Å; L176-W182 HydrophobicContact CD1-CD2 3.8Å; L176-W182 HydrophobicContact CD1-CE3 3.97Å; L176-W182 HydrophobicContact CD1-CG 4.44Å; L176-W182 HydrophobicContact CD1-CH2 4.1Å; L176-W182 HydrophobicContact CD1-CZ2 3.94Å; L176-W182 HydrophobicContact CD1-CZ3 4.13Å; L176-W182 HydrophobicContact CD2-CH2 4.07Å; L176-W182 HydrophobicContact CD2-CZ2 4.32Å; L176-W182 HydrophobicContact CG-CH2 4.31Å; L176-W182 HydrophobicContact CG-CZ3 4.3Å
177	D	84.4	Confident	84.8	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.043	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	178.9	177.5	77.2	27	0	0	0	113.1	F175 A179 L180 Y181 H183 Y207	F175-D177 HydrophobicContact CD1-CB 4.42Å; F175-D177 HydrophobicContact CE1-CB 3.87Å; D177-A179 PolarHBondContact O-N 2.85Å; D177-A179 VanDerWaalsContact OD1-CA 3.3Å; D177-A179 WeakPolarHBondContact OD1-CA 3.39Å; D177-A179 WeakPolarHBondContact OD1-CB 3.44Å; D177-A179 PolarHBondContact OD1-N 2.6Å; D177-L180 PolarHBondContact O-N 3.01Å; D177-L180 VanDerWaalsContact O-N 3.08Å; D177-L180 PolarHBondContact OD1-N 2.82Å; D177-L180 VanDerWaalsContact OD1-N 3.11Å; D177-Y181 PolarHBondContact N-O 2.99Å; D177-Y181 PolarHBondContact OD1-N 2.82Å; D177-Y181 VanDerWaalsContact OD1-N 3.11Å; D177-H183 IonicContact OD2-CD2 3.41Å; D177-H183 IonicContact OD2-CE1 2.68Å; D177-H183 IonicContact OD2-NE2 3.93Å; D177-H183 PolarHBondContact OD2-NE2 3.26Å; D177-Y207 HydrophobicContact CB-CE1 4.19Å
178	R	81	Confident	85.5	Confident	192 Å²	192	51.7 Å²	51.7	73%	0.725	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-11.8	-178.3	-60	-175.5	-59.6	164.6	4.3	114.4	G152 L180	G152-R178 WeakPolarHBondContact O-CD 3.36Å; R178-L180 VanDerWaalsContact C-N 3.33Å
179	A	78.6	Confident	86.3	Confident	66 Å²	66	50.3 Å²	50.3	55%	0.545	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	6.4	170.1	0	0	0	0	0	111.7	D177 Y181	D177-A179 PolarHBondContact O-N 2.85Å; D177-A179 VanDerWaalsContact OD1-CA 3.3Å; D177-A179 WeakPolarHBondContact OD1-CA 3.39Å; D177-A179 WeakPolarHBondContact OD1-CB 3.44Å; D177-A179 PolarHBondContact OD1-N 2.6Å; A179-Y181 VanDerWaalsContact C-N 3.28Å; A179-Y181 HydrophobicContact CB-CD2 3.75Å; A179-Y181 HydrophobicContact CB-CE2 3.81Å; A179-Y181 PolarHBondContact O-N 3.45Å
180	L	77.9	Confident	87.2	Confident	68 Å²	68	45 Å²	45	36%	0.356	23%	0.225	S	C	.	.			trans	67.7	18.8	-179	-52.4	174.6	0	0	0	114.8	L118 L176 D177 R178	L118-L180 HydrophobicContact CD1-CD1 4.12Å; L118-L180 HydrophobicContact CD2-CD1 3.57Å; L118-L180 HydrophobicContact CG-CD1 4.4Å; L176-L180 HydrophobicContact CD1-CB 4.22Å; L176-L180 HydrophobicContact CD1-CD2 4.28Å; L176-L180 WeakPolarHBondContact CD1-O 3.47Å; L176-L180 HydrophobicContact CD2-CD2 4.16Å; L176-L180 HydrophobicContact CG-CD2 4.31Å; D177-L180 PolarHBondContact O-N 3.01Å; D177-L180 VanDerWaalsContact O-N 3.08Å; D177-L180 PolarHBondContact OD1-N 2.82Å; D177-L180 VanDerWaalsContact OD1-N 3.11Å; R178-L180 VanDerWaalsContact C-N 3.33Å
181	Y	81.2	Confident	87.7	Confident	127 Å²	127	43.5 Å²	43.5	50%	0.498	22%	0.22	S	C	.	.			trans	-75.6	137.9	169.7	-64.2	-67.1	0	0	0	111.2	D177 A179 H183 Y212	D177-Y181 PolarHBondContact N-O 2.99Å; D177-Y181 PolarHBondContact OD1-N 2.82Å; D177-Y181 VanDerWaalsContact OD1-N 3.11Å; A179-Y181 VanDerWaalsContact C-N 3.28Å; A179-Y181 HydrophobicContact CB-CD2 3.75Å; A179-Y181 HydrophobicContact CB-CE2 3.81Å; A179-Y181 PolarHBondContact O-N 3.45Å; Y181-H183 PolarHBondContact O-CD2 3.03Å; Y181-H183 VanDerWaalsContact O-CD2 3.26Å; Y181-Y212 WeakPolarHBondContact CD2-OH 3.22Å; Y181-Y212 WeakPolarHBondContact CE2-OH 3.38Å
182	W	85.4	Confident	87.8	Confident	28 Å²	28	42.6 Å²	42.6	11%	0.106	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.1	175.3	-71.2	116.9	0	0	0	111.3	P136 F138 I144 C157 W174 L176	P136-W182 HydrophobicContact CG-CB 4.37Å; P136-W182 HydrophobicContact CG-CD2 3.56Å; P136-W182 HydrophobicContact CG-CE3 3.82Å; P136-W182 HydrophobicContact CG-CG 3.82Å; P136-W182 HydrophobicContact CG-CH2 4.47Å; P136-W182 HydrophobicContact CG-CZ2 4.25Å; P136-W182 HydrophobicContact CG-CZ3 4.26Å; P136-W182 PolarHBondContact O-NE1 2.88Å; F138-W182 HydrophobicContact CD1-CZ2 4.35Å; F138-W182 HydrophobicContact CE1-CH2 4.38Å; F138-W182 AromaticContact CE1-CZ2 3.6Å; F138-W182 HydrophobicContact CE1-CZ2 3.6Å; F138-W182 AromaticContact CE2-CE2 3.97Å; F138-W182 AromaticContact CE2-CZ2 3.97Å; F138-W182 HydrophobicContact CE2-CZ2 3.97Å; F138-W182 AromaticContact CE2-NE1 3.53Å; F138-W182 AromaticContact CZ-CE2 3.79Å; F138-W182 HydrophobicContact CZ-CH2 4.34Å; F138-W182 AromaticContact CZ-CZ2 3.38Å; F138-W182 HydrophobicContact CZ-CZ2 3.38Å; F138-W182 AromaticContact CZ-NE1 3.86Å; I144-W182 HydrophobicContact CD1-CH2 3.93Å; I144-W182 HydrophobicContact CD1-CZ2 3.66Å; I144-W182 HydrophobicContact CG2-CH2 3.89Å; C157-W182 HydrophobicContact CB-CH2 4.31Å; C157-W182 HydrophobicContact CB-CZ3 4.04Å; W174-W182 HydrophobicContact CB-CE3 3.87Å; W174-W182 HydrophobicContact CB-CZ3 4.03Å; W174-W182 HydrophobicContact CE3-CB 3.78Å; W174-W182 HydrophobicContact CZ3-CB 3.95Å; L176-W182 HydrophobicContact CB-CE3 3.94Å; L176-W182 HydrophobicContact CB-CH2 4.05Å; L176-W182 HydrophobicContact CB-CZ3 3.63Å; L176-W182 HydrophobicContact CD1-CD2 3.8Å; L176-W182 HydrophobicContact CD1-CE3 3.97Å; L176-W182 HydrophobicContact CD1-CG 4.44Å; L176-W182 HydrophobicContact CD1-CH2 4.1Å; L176-W182 HydrophobicContact CD1-CZ2 3.94Å; L176-W182 HydrophobicContact CD1-CZ3 4.13Å; L176-W182 HydrophobicContact CD2-CH2 4.07Å; L176-W182 HydrophobicContact CD2-CZ2 4.32Å; L176-W182 HydrophobicContact CG-CH2 4.31Å; L176-W182 HydrophobicContact CG-CZ3 4.3Å
183	H	86.6	Confident	87.7	Confident	20 Å²	20	43 Å²	43	9%	0.093	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.5	176.7	-51.3	-91	0	0	0	109.5	F175 D177 Y181 T210 Y212	F175-H183 HydrophobicContact CB-CB 4.45Å; F175-H183 PolarHBondContact N-O 2.91Å; F175-H183 PolarHBondContact O-N 3.48Å; D177-H183 IonicContact OD2-CD2 3.41Å; D177-H183 IonicContact OD2-CE1 2.68Å; D177-H183 IonicContact OD2-NE2 3.93Å; D177-H183 PolarHBondContact OD2-NE2 3.26Å; Y181-H183 PolarHBondContact O-CD2 3.03Å; Y181-H183 VanDerWaalsContact O-CD2 3.26Å; H183-T210 HydrophobicContact CB-CG2 3.76Å; H183-T210 WeakPolarHBondContact ND1-CB 3.48Å; H183-T210 WeakPolarHBondContact ND1-CG2 3.35Å; H183-Y212 AromaticContact CE1-CE2 3.8Å
184	F	87.9	Confident	87.6	Confident	72 Å²	72	50.5 Å²	50.5	32%	0.316	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	134.7	178.6	177.6	-97.8	0	0	0	110.4	P133 E172 W174	P133-F184 HydrophobicContact CB-CD2 4.4Å; P133-F184 HydrophobicContact CG-CB 4.08Å; P133-F184 HydrophobicContact CG-CD1 4.43Å; P133-F184 HydrophobicContact CG-CD2 3.67Å; P133-F184 HydrophobicContact CG-CE2 4.16Å; P133-F184 HydrophobicContact CG-CG 3.81Å; E172-F184 HydrophobicContact CB-CE2 4.3Å; E172-F184 HydrophobicContact CG-CE2 4.08Å; W174-F184 HydrophobicContact CD2-CB 4.29Å; W174-F184 HydrophobicContact CD2-CD2 4.42Å; W174-F184 AromaticContact CE2-CD2 3.83Å; W174-F184 HydrophobicContact CE3-CB 4.09Å; W174-F184 VanDerWaalsContact CE3-N 3.3Å; W174-F184 HydrophobicContact CH2-CB 3.96Å; W174-F184 HydrophobicContact CZ2-CB 4.14Å; W174-F184 AromaticContact CZ2-CD2 3.93Å; W174-F184 HydrophobicContact CZ2-CD2 3.93Å; W174-F184 HydrophobicContact CZ3-CB 3.93Å; W174-F184 AromaticContact NE1-CD2 3.95Å
185	L	88.2	Confident	87.5	Confident	11 Å²	11	52 Å²	52	6%	0.058	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-61.6	170.9	-63.5	-176.3	0	0	0	110.9	V156 I173 F175 Y192 W205 F209	V156-L185 HydrophobicContact CG1-CD1 4.38Å; V156-L185 HydrophobicContact CG2-CD1 4.05Å; I173-L185 HydrophobicContact CG2-CD1 4.42Å; I173-L185 WeakPolarHBondContact O-CB 3.24Å; I173-L185 PolarHBondContact O-N 3.32Å; F175-L185 HydrophobicContact CB-CD1 4.06Å; F175-L185 HydrophobicContact CB-CD2 4.12Å; F175-L185 HydrophobicContact CB-CG 3.99Å; L185-Y192 HydrophobicContact CD1-CD2 3.87Å; L185-Y192 HydrophobicContact CD1-CE2 3.97Å; L185-W205 HydrophobicContact CD1-CH2 4.5Å; L185-F209 HydrophobicContact CD2-CB 3.93Å; L185-F209 HydrophobicContact CD2-CD2 4.14Å; L185-F209 HydrophobicContact CD2-CG 4.11Å
186	T	91	Very high	87.4	Confident	14 Å²	14	52 Å²	52	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	160	-174.1	59	0	0	0	0	112.8	I173 T188 A191 Y192 L195	I173-T186 PolarHBondContact N-O 2.89Å; I173-T186 PolarHBondContact O-N 2.87Å; T186-T188 PolarHBondContact OG1-O 3.34Å; T186-A191 HydrophobicContact CG2-CB 3.63Å; T186-Y192 WeakPolarHBondContact OG1-CB 3.31Å; T186-Y192 PolarHBondContact OG1-N 3.34Å; T186-L195 HydrophobicContact CG2-CD1 3.57Å; T186-L195 HydrophobicContact CG2-CG 4.35Å
187	D	89.2	Confident	87.4	Confident	95 Å²	95	52.3 Å²	52.3	51%	0.508	25%	0.253	S	S	.	.	S	Bend	trans	-63.9	-43.3	168.7	53.8	3.4	0	0	0	112.8
188	T	90.4	Very high	87.5	Confident	54 Å²	54	56.8 Å²	56.8	33%	0.331	28%	0.281	S	S	.	.	S	Bend	trans	-121.8	150.1	-165.6	52.2	0	0	0	0	111.7	T186 T190 A191 Y192	T186-T188 PolarHBondContact OG1-O 3.34Å; T188-T190 PolarHBondContact O-N 2.8Å; T188-A191 PolarHBondContact O-N 3.14Å; T188-A191 WeakPolarHBondContact OG1-CB 3.4Å; T188-A191 PolarHBondContact OG1-N 2.93Å; T188-Y192 PolarHBondContact O-N 2.89Å; T188-Y192 VanDerWaalsContact O-N 3.1Å
189	F	92.3	Very high	87.7	Confident	7 Å²	7	50 Å²	50	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-33.3	172.5	171.3	-89.5	0	0	0	111.3	D64 V65 F68 I95 L147 I173 A191 Y192 Y193	D64-F189 PolarHBondContact OD2-N 3.38Å; D64-F189 VanDerWaalsContact OD2-N 3.13Å; V65-F189 HydrophobicContact CG2-CB 3.41Å; V65-F189 VanDerWaalsContact CG2-CB 3.41Å; V65-F189 HydrophobicContact CG2-CD1 4.37Å; V65-F189 HydrophobicContact CG2-CD2 4.12Å; V65-F189 HydrophobicContact CG2-CG 3.72Å; F68-F189 HydrophobicContact CB-CD1 4.3Å; F68-F189 HydrophobicContact CB-CE1 3.54Å; F68-F189 HydrophobicContact CB-CZ 4.13Å; F68-F189 AromaticContact CD1-CE1 3.92Å; F68-F189 HydrophobicContact CD1-CE1 3.92Å; F68-F189 AromaticContact CD1-CZ 3.59Å; F68-F189 HydrophobicContact CD1-CZ 3.59Å; F68-F189 AromaticContact CD2-CE1 3.75Å; F68-F189 HydrophobicContact CD2-CE1 3.75Å; F68-F189 AromaticContact CD2-CZ 3.86Å; F68-F189 HydrophobicContact CD2-CZ 3.86Å; F68-F189 AromaticContact CE1-CZ 3.88Å; F68-F189 HydrophobicContact CE1-CZ 3.88Å; F68-F189 HydrophobicContact CE2-CE1 4.43Å; F68-F189 HydrophobicContact CE2-CZ 4.13Å; F68-F189 AromaticContact CG-CE1 3.45Å; F68-F189 HydrophobicContact CG-CE1 3.45Å; F68-F189 VanDerWaalsContact CG-CE1 3.45Å; F68-F189 AromaticContact CG-CZ 3.57Å; F68-F189 HydrophobicContact CG-CZ 3.57Å; F68-F189 HydrophobicContact CZ-CZ 4.14Å; I95-F189 HydrophobicContact CD1-CE2 4.01Å; I95-F189 HydrophobicContact CD1-CZ 3.78Å; I95-F189 HydrophobicContact CG2-CE2 4.3Å; L147-F189 HydrophobicContact CD1-CD2 4.11Å; L147-F189 HydrophobicContact CD2-CD2 4.45Å; L147-F189 HydrophobicContact CD2-CE2 4.41Å; I173-F189 HydrophobicContact CD1-CB 4.18Å; F189-A191 PolarHBondContact O-N 3.19Å; F189-Y192 HydrophobicContact CD2-CD1 4.34Å; F189-Y192 HydrophobicContact CE2-CD1 4.41Å; F189-Y192 PolarHBondContact O-N 3.16Å; F189-Y193 HydrophobicContact CZ-CD2 4.3Å; F189-Y193 WeakPolarHBondContact O-CB 3.37Å; F189-Y193 PolarHBondContact O-N 3.15Å
190	T	91.6	Very high	87.9	Confident	74 Å²	74	48.9 Å²	48.9	45%	0.454	24%	0.242	S	C	.	.	H	α-helix	trans	-61.2	-41.5	175.2	-56.9	0	0	0	0	112.1	D64 T188 R194	D64-T190 WeakPolarHBondContact CB-OG1 3.27Å; D64-T190 WeakPolarHBondContact OD2-CB 3.33Å; D64-T190 PolarHBondContact OD2-N 3.02Å; D64-T190 PolarHBondContact OD2-OG1 3.28Å; T188-T190 PolarHBondContact O-N 2.8Å; T190-R194 WeakPolarHBondContact O-CG 3.18Å; T190-R194 PolarHBondContact O-N 2.75Å; T190-R194 VanDerWaalsContact O-N 3.16Å
191	A	91.5	Very high	88.1	Confident	21 Å²	21	45.9 Å²	45.9	17%	0.174	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-44.8	174.5	0	0	0	0	0	111.3	T186 T188 F189 Y193 R194 L195	T186-A191 HydrophobicContact CG2-CB 3.63Å; T188-A191 PolarHBondContact O-N 3.14Å; T188-A191 WeakPolarHBondContact OG1-CB 3.4Å; T188-A191 PolarHBondContact OG1-N 2.93Å; F189-A191 PolarHBondContact O-N 3.19Å; A191-Y193 VanDerWaalsContact C-N 3.34Å; A191-Y193 PolarHBondContact O-N 3.39Å; A191-R194 WeakPolarHBondContact O-CB 3.23Å; A191-R194 PolarHBondContact O-N 2.88Å; A191-L195 PolarHBondContact O-N 3.36Å
192	Y	92.6	Very high	88.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.4	-44.4	173.5	168.7	-107.1	0	0	0	112.6	V156 I173 L185 T186 T188 F189 R194 L195 L196 W205	V156-Y192 HydrophobicContact CB-CE2 4.32Å; V156-Y192 HydrophobicContact CG1-CD2 4.17Å; V156-Y192 HydrophobicContact CG1-CE1 4.12Å; V156-Y192 HydrophobicContact CG1-CE2 3.73Å; V156-Y192 HydrophobicContact CG2-CE2 3.86Å; I173-Y192 HydrophobicContact CG2-CD1 4.39Å; I173-Y192 HydrophobicContact CG2-CD2 3.93Å; I173-Y192 HydrophobicContact CG2-CG 3.78Å; L185-Y192 HydrophobicContact CD1-CD2 3.87Å; L185-Y192 HydrophobicContact CD1-CE2 3.97Å; T186-Y192 WeakPolarHBondContact OG1-CB 3.31Å; T186-Y192 PolarHBondContact OG1-N 3.34Å; T188-Y192 PolarHBondContact O-N 2.89Å; T188-Y192 VanDerWaalsContact O-N 3.1Å; F189-Y192 HydrophobicContact CD2-CD1 4.34Å; F189-Y192 HydrophobicContact CE2-CD1 4.41Å; F189-Y192 PolarHBondContact O-N 3.16Å; Y192-R194 VanDerWaalsContact C-N 3.28Å; Y192-R194 PolarHBondContact O-N 2.73Å; Y192-L195 WeakPolarHBondContact O-CB 3.06Å; Y192-L195 PolarHBondContact O-N 3.36Å; Y192-L196 HydrophobicContact CE1-CD2 4.39Å; Y192-L196 PolarHBondContact O-N 3.37Å; Y192-W205 HydrophobicContact CD2-CH2 4.07Å; Y192-W205 HydrophobicContact CD2-CZ2 4.43Å; Y192-W205 AromaticContact CE2-CH2 3.74Å; Y192-W205 HydrophobicContact CE2-CH2 3.74Å; Y192-W205 AromaticContact CE2-CZ2 3.69Å; Y192-W205 HydrophobicContact CE2-CZ2 3.69Å
193	Y	90.1	Very high	87.8	Confident	29 Å²	29	45 Å²	45	11%	0.114	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-39.2	179.2	-166.1	-113.7	0	0	0	111.7	L20 F68 F75 I95 F189 A191 L196 I197	L20-Y193 WeakPolarHBondContact CD2-OH 3.47Å; L20-Y193 WeakPolarHBondContact O-CE1 3.31Å; L20-Y193 PolarHBondContact O-OH 3.22Å; F68-Y193 HydrophobicContact CE2-CD2 4.37Å; F68-Y193 AromaticContact CE2-CE2 3.87Å; F68-Y193 HydrophobicContact CE2-CE2 3.87Å; F75-Y193 HydrophobicContact CD1-CE2 4.21Å; I95-Y193 HydrophobicContact CD1-CD2 3.54Å; I95-Y193 HydrophobicContact CD1-CE2 3.63Å; F189-Y193 HydrophobicContact CZ-CD2 4.3Å; F189-Y193 WeakPolarHBondContact O-CB 3.37Å; F189-Y193 PolarHBondContact O-N 3.15Å; A191-Y193 VanDerWaalsContact C-N 3.34Å; A191-Y193 PolarHBondContact O-N 3.39Å; Y193-L196 HydrophobicContact CD2-CD2 4.48Å; Y193-L196 PolarHBondContact O-N 2.85Å; Y193-I197 HydrophobicContact CD1-CD1 3.88Å; Y193-I197 HydrophobicContact CE1-CD1 3.51Å; Y193-I197 HydrophobicContact CE1-CG1 4.44Å; Y193-I197 WeakPolarHBondContact O-CB 3.46Å; Y193-I197 WeakPolarHBondContact O-CG1 3.44Å; Y193-I197 PolarHBondContact O-N 2.78Å
194	R	90.1	Very high	87.4	Confident	160 Å²	160	47 Å²	47	60%	0.604	25%	0.246	S	C	*	.	H	α-helix	trans	-66.1	-36.5	172.6	-71.9	172.3	61.4	-153.6	-4.5	112.6	T190 A191 Y192 T198	T190-R194 WeakPolarHBondContact O-CG 3.18Å; T190-R194 PolarHBondContact O-N 2.75Å; T190-R194 VanDerWaalsContact O-N 3.16Å; A191-R194 WeakPolarHBondContact O-CB 3.23Å; A191-R194 PolarHBondContact O-N 2.88Å; Y192-R194 VanDerWaalsContact C-N 3.28Å; Y192-R194 PolarHBondContact O-N 2.73Å; R194-T198 VanDerWaalsContact O-CB 3.29Å; R194-T198 WeakPolarHBondContact O-CB 3.39Å; R194-T198 PolarHBondContact O-N 3.23Å; R194-T198 PolarHBondContact O-OG1 3.37Å
195	L	89.4	Confident	87.1	Confident	36 Å²	36	44 Å²	44	19%	0.188	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-48	173	-68.3	-178.1	0	0	0	111.7	T186 A191 Y192 I197 T198 H199 W205 F209	T186-L195 HydrophobicContact CG2-CD1 3.57Å; T186-L195 HydrophobicContact CG2-CG 4.35Å; A191-L195 PolarHBondContact O-N 3.36Å; Y192-L195 WeakPolarHBondContact O-CB 3.06Å; Y192-L195 PolarHBondContact O-N 3.36Å; L195-I197 VanDerWaalsContact C-N 3.25Å; L195-I197 PolarHBondContact O-N 3.44Å; L195-T198 PolarHBondContact O-N 2.86Å; L195-H199 PolarHBondContact O-CD2 3.35Å; L195-H199 PolarHBondContact O-N 3.07Å; L195-W205 HydrophobicContact CB-CH2 3.61Å; L195-W205 HydrophobicContact CB-CZ3 3.74Å; L195-W205 HydrophobicContact CD1-CH2 4.49Å; L195-W205 HydrophobicContact CD1-CZ3 4.28Å; L195-F209 HydrophobicContact CD1-CE1 4.27Å; L195-F209 HydrophobicContact CD1-CE2 4.26Å; L195-F209 HydrophobicContact CD1-CZ 3.89Å; L195-F209 HydrophobicContact CD2-CZ 3.87Å; L195-F209 HydrophobicContact CG-CZ 4.49Å
196	L	88.5	Confident	86.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-53.5	-44.2	177.2	-178.2	64.4	0	0	0	111.7	M93 I95 Y192 Y193 L200 G201 W205	M93-L196 HydrophobicContact CB-CD1 4.1Å; M93-L196 HydrophobicContact CB-CD2 4.19Å; M93-L196 HydrophobicContact CB-CG 4.06Å; M93-L196 HydrophobicContact CG-CD1 3.9Å; M93-L196 HydrophobicContact CG-CG 3.91Å; M93-L196 HydrophobicContact SD-CG 4.35Å; I95-L196 HydrophobicContact CD1-CD2 3.97Å; I95-L196 HydrophobicContact CG1-CD2 4.03Å; Y192-L196 HydrophobicContact CE1-CD2 4.39Å; Y192-L196 PolarHBondContact O-N 3.37Å; Y193-L196 HydrophobicContact CD2-CD2 4.48Å; Y193-L196 PolarHBondContact O-N 2.85Å; L196-L200 PolarHBondContact O-N 3.39Å; L196-G201 PolarHBondContact O-N 3.3Å; L196-W205 HydrophobicContact CB-CZ2 4.09Å; L196-W205 HydrophobicContact CD1-CZ2 4Å
197	I	87.4	Confident	86.1	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.082	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-51.6	172.4	-79.5	-178.7	0	0	0	111.5	L22 I24 Y193 L195 H199 L200	L22-I197 HydrophobicContact CB-CD1 4.3Å; L22-I197 HydrophobicContact CB-CG2 4.43Å; L22-I197 HydrophobicContact CD1-CD1 3.84Å; L22-I197 HydrophobicContact CD1-CG2 4.27Å; L22-I197 HydrophobicContact CG-CD1 3.95Å; I24-I197 HydrophobicContact CD1-CB 3.82Å; I24-I197 HydrophobicContact CD1-CG1 3.82Å; I24-I197 HydrophobicContact CD1-CG2 3.58Å; I24-I197 WeakPolarHBondContact CD1-O 3.41Å; I24-I197 HydrophobicContact CG1-CG2 4.33Å; Y193-I197 HydrophobicContact CD1-CD1 3.88Å; Y193-I197 HydrophobicContact CE1-CD1 3.51Å; Y193-I197 HydrophobicContact CE1-CG1 4.44Å; Y193-I197 WeakPolarHBondContact O-CB 3.46Å; Y193-I197 WeakPolarHBondContact O-CG1 3.44Å; Y193-I197 PolarHBondContact O-N 2.78Å; L195-I197 VanDerWaalsContact C-N 3.25Å; L195-I197 PolarHBondContact O-N 3.44Å; I197-H199 PolarHBondContact O-N 3.42Å; I197-L200 PolarHBondContact O-N 3.15Å
198	T	86.8	Confident	85.4	Confident	102 Å²	102	42 Å²	42	63%	0.626	23%	0.225	S	C	*	.	H	α-helix	trans	-61.4	-32.7	-176.4	-58	0	0	0	0	112.3	R194 L195	R194-T198 VanDerWaalsContact O-CB 3.29Å; R194-T198 WeakPolarHBondContact O-CB 3.39Å; R194-T198 PolarHBondContact O-N 3.23Å; R194-T198 PolarHBondContact O-OG1 3.37Å; L195-T198 PolarHBondContact O-N 2.86Å
199	H	84.8	Confident	84.5	Confident	50 Å²	50	43.7 Å²	43.7	23%	0.231	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	6	177.2	-65	-67.3	0	0	0	114.2	L195 I197 G201 L202 W205 F209	L195-H199 PolarHBondContact O-CD2 3.35Å; L195-H199 PolarHBondContact O-N 3.07Å; I197-H199 PolarHBondContact O-N 3.42Å; H199-G201 PolarHBondContact O-N 3.19Å; H199-L202 WeakPolarHBondContact O-CB 3.45Å; H199-L202 WeakPolarHBondContact O-CG 3.46Å; H199-L202 PolarHBondContact O-N 3.01Å; H199-W205 HydrophobicContact CB-CB 3.62Å; H199-W205 HydrophobicContact CB-CD2 3.73Å; H199-W205 HydrophobicContact CB-CE3 4.1Å; H199-W205 HydrophobicContact CB-CG 3.53Å; H199-W205 AromaticContact CD2-CD2 3.81Å; H199-W205 AromaticContact CD2-CE3 3.22Å; H199-W205 AromaticContact CD2-CZ3 3.68Å; H199-W205 AromaticContact CG-CD2 3.92Å; H199-W205 AromaticContact CG-CE3 3.75Å; H199-W205 AromaticContact NE2-CE3 3.94Å; H199-F209 AromaticContact NE2-CE2 3.66Å; H199-F209 AromaticContact NE2-CZ 3.86Å
200	L	83.6	Confident	83.5	Confident	42 Å²	42	44 Å²	44	22%	0.22	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	17.4	176.9	-54	173.5	0	0	0	114.9	I24 L28 W79 L196 I197 L202	I24-L200 HydrophobicContact CB-CD2 4.45Å; I24-L200 HydrophobicContact CD1-CD2 4.1Å; I24-L200 HydrophobicContact CG1-CD2 3.87Å; I24-L200 HydrophobicContact CG2-CD2 3.74Å; L28-L200 HydrophobicContact CD2-CD1 4.36Å; W79-L200 HydrophobicContact CZ2-CB 3.85Å; W79-L200 HydrophobicContact CZ2-CD1 4.26Å; W79-L200 PolarHBondContact NE1-O 2.88Å; L196-L200 PolarHBondContact O-N 3.39Å; I197-L200 PolarHBondContact O-N 3.15Å; L200-L202 VanDerWaalsContact C-N 3.29Å; L200-L202 HydrophobicContact CB-CG 4.49Å; L200-L202 PolarHBondContact O-N 3.32Å
201	G	81.6	Confident	81.9	Confident	4 Å²	4	46 Å²	46	4%	0.041	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	25.5	-169.4	0	0	0	0	0	115.1	G91 S92 M93 L196 H199	G91-G201 CarbonylContact C-O 3.54Å; G91-G201 WeakPolarHBondContact CA-O 3.47Å; S92-G201 PolarHBondContact N-O 2.81Å; S92-G201 WeakPolarHBondContact O-CA 3.39Å; M93-G201 VanDerWaalsContact CG-CA 3.43Å; L196-G201 PolarHBondContact O-N 3.3Å; H199-G201 PolarHBondContact O-N 3.19Å
202	L	83.9	Confident	80.4	Confident	64 Å²	64	51.4 Å²	51.4	34%	0.335	26%	0.264	S	S	.	.			trans	-59.1	149.9	176.8	-73.7	170.1	0	0	0	111.9	W79 L90 H199 L200 Q204 W205	W79-L202 HydrophobicContact CH2-CD2 3.93Å; W79-L202 HydrophobicContact CZ2-CD2 3.78Å; W79-L202 HydrophobicContact CZ2-CG 4.33Å; L90-L202 HydrophobicContact CD2-CD2 4.05Å; L90-L202 HydrophobicContact CG-CD2 4.09Å; H199-L202 WeakPolarHBondContact O-CB 3.45Å; H199-L202 WeakPolarHBondContact O-CG 3.46Å; H199-L202 PolarHBondContact O-N 3.01Å; L200-L202 VanDerWaalsContact C-N 3.29Å; L200-L202 HydrophobicContact CB-CG 4.49Å; L200-L202 PolarHBondContact O-N 3.32Å; L202-Q204 PolarHBondContact O-N 3.1Å; L202-W205 VanDerWaalsContact O-CD1 3.23Å; L202-W205 PolarHBondContact O-N 3.46Å
203	P	76.9	Confident	78.9	Confident	73 Å²	73	52.7 Å²	52.7	47%	0.474	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	134.1	-168.5	-14.1	32.2	0	0	0	109.4	L90 W205	L90-P203 WeakPolarHBondContact O-CD 3.12Å; L90-P203 VanDerWaalsContact O-CG 3.26Å; L90-P203 WeakPolarHBondContact O-CG 3.5Å; P203-W205 PolarHBondContact O-N 3.05Å
204	Q	77.9	Confident	77.5	Confident	62 Å²	62	54.2 Å²	54.2	29%	0.29	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	21.7	180	-54.2	169.7	-1.9	0	0	114.2	L202 Q206 Y207	L202-Q204 PolarHBondContact O-N 3.1Å; Q204-Q206 PolarHBondContact O-N 2.97Å; Q204-Y207 HydrophobicContact CB-CD2 3.67Å; Q204-Y207 HydrophobicContact CB-CE2 4.27Å; Q204-Y207 HydrophobicContact CB-CG 4.47Å; Q204-Y207 HydrophobicContact CG-CD2 4.14Å; Q204-Y207 HydrophobicContact CG-CE2 4.25Å; Q204-Y207 WeakPolarHBondContact O-CB 3.18Å; Q204-Y207 PolarHBondContact O-N 3.38Å
205	W	81.5	Confident	75.5	Confident	8 Å²	8	48.1 Å²	48.1	3%	0.03	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-57.7	-32.6	177.2	75.9	-103.6	0	0	0	112.8	L185 Y192 L195 L196 H199 L202 P203 Y207 A208 F209	L185-W205 HydrophobicContact CD1-CH2 4.5Å; Y192-W205 HydrophobicContact CD2-CH2 4.07Å; Y192-W205 HydrophobicContact CD2-CZ2 4.43Å; Y192-W205 AromaticContact CE2-CH2 3.74Å; Y192-W205 HydrophobicContact CE2-CH2 3.74Å; Y192-W205 AromaticContact CE2-CZ2 3.69Å; Y192-W205 HydrophobicContact CE2-CZ2 3.69Å; L195-W205 HydrophobicContact CB-CH2 3.61Å; L195-W205 HydrophobicContact CB-CZ3 3.74Å; L195-W205 HydrophobicContact CD1-CH2 4.49Å; L195-W205 HydrophobicContact CD1-CZ3 4.28Å; L196-W205 HydrophobicContact CB-CZ2 4.09Å; L196-W205 HydrophobicContact CD1-CZ2 4Å; H199-W205 HydrophobicContact CB-CB 3.62Å; H199-W205 HydrophobicContact CB-CD2 3.73Å; H199-W205 HydrophobicContact CB-CE3 4.1Å; H199-W205 HydrophobicContact CB-CG 3.53Å; H199-W205 AromaticContact CD2-CD2 3.81Å; H199-W205 AromaticContact CD2-CE3 3.22Å; H199-W205 AromaticContact CD2-CZ3 3.68Å; H199-W205 AromaticContact CG-CD2 3.92Å; H199-W205 AromaticContact CG-CE3 3.75Å; H199-W205 AromaticContact NE2-CE3 3.94Å; L202-W205 VanDerWaalsContact O-CD1 3.23Å; L202-W205 PolarHBondContact O-N 3.46Å; P203-W205 PolarHBondContact O-N 3.05Å; W205-Y207 PolarHBondContact O-N 2.98Å; W205-A208 WeakPolarHBondContact O-CB 3.33Å; W205-A208 PolarHBondContact O-N 3.02Å; W205-F209 HydrophobicContact CE3-CD2 4.4Å; W205-F209 AromaticContact CE3-CE2 3.99Å; W205-F209 HydrophobicContact CE3-CE2 3.99Å; W205-F209 HydrophobicContact CZ3-CD2 4.19Å; W205-F209 AromaticContact CZ3-CE2 3.78Å; W205-F209 HydrophobicContact CZ3-CE2 3.78Å
206	Q	79.4	Confident	73.6	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.037	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-58	-32.5	176.7	-58.1	85.3	-12.5	0	0	111.9	C150 V156 F175 Q204 A208 F209	C150-Q206 PolarHBondContact SG-NE2 3.46Å; V156-Q206 HydrophobicContact CG2-CG 4.28Å; F175-Q206 HydrophobicContact CB-CB 4.49Å; F175-Q206 HydrophobicContact CD1-CB 4.04Å; F175-Q206 HydrophobicContact CD2-CB 3.72Å; F175-Q206 HydrophobicContact CD2-CG 3.83Å; F175-Q206 HydrophobicContact CE1-CB 4.15Å; F175-Q206 HydrophobicContact CE2-CB 3.84Å; F175-Q206 HydrophobicContact CE2-CG 3.99Å; F175-Q206 HydrophobicContact CG-CB 3.83Å; F175-Q206 HydrophobicContact CG-CG 4.37Å; F175-Q206 HydrophobicContact CZ-CB 4.06Å; Q204-Q206 PolarHBondContact O-N 2.97Å; Q206-A208 PolarHBondContact O-N 3.03Å; Q206-A208 VanDerWaalsContact O-N 3.11Å; Q206-F209 PolarHBondContact O-N 2.7Å; Q206-F209 VanDerWaalsContact O-N 3.1Å
207	Y	77.8	Confident	71.7	Confident	30 Å²	30	60.3 Å²	60.3	12%	0.118	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-65.7	-13.3	177.8	-72.1	-95	0	0	0	113.1	S153 F175 D177 Q204 W205 F209 T210 G213	S153-Y207 PolarHBondContact O-OH 2.88Å; F175-Y207 HydrophobicContact CE1-CD2 4.01Å; F175-Y207 HydrophobicContact CE1-CE1 4.19Å; F175-Y207 AromaticContact CE1-CE2 3.65Å; F175-Y207 HydrophobicContact CE1-CE2 3.65Å; F175-Y207 HydrophobicContact CE1-CG 4.45Å; F175-Y207 AromaticContact CE1-CZ 3.75Å; F175-Y207 HydrophobicContact CZ-CD2 4.13Å; F175-Y207 AromaticContact CZ-CE2 3.56Å; F175-Y207 HydrophobicContact CZ-CE2 3.56Å; F175-Y207 AromaticContact CZ-CZ 3.96Å; D177-Y207 HydrophobicContact CB-CE1 4.19Å; Q204-Y207 HydrophobicContact CB-CD2 3.67Å; Q204-Y207 HydrophobicContact CB-CE2 4.27Å; Q204-Y207 HydrophobicContact CB-CG 4.47Å; Q204-Y207 HydrophobicContact CG-CD2 4.14Å; Q204-Y207 HydrophobicContact CG-CE2 4.25Å; Q204-Y207 WeakPolarHBondContact O-CB 3.18Å; Q204-Y207 PolarHBondContact O-N 3.38Å; W205-Y207 PolarHBondContact O-N 2.98Å; Y207-F209 PolarHBondContact O-N 2.87Å; Y207-T210 HydrophobicContact CD1-CG2 4.41Å; Y207-T210 PolarHBondContact O-N 2.64Å; Y207-T210 VanDerWaalsContact O-N 3.16Å; Y207-T210 PolarHBondContact O-OG1 2.73Å; Y207-G213 CarbonylContact O-C 3.58Å; Y207-G213 VanDerWaalsContact O-C 3.28Å; Y207-G213 WeakPolarHBondContact O-CA 3.43Å
208	A	75.8	Confident	69.9	Low	42 Å²	42	61.4 Å²	61.4	35%	0.347	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-60.7	-25.4	170.6	0	0	0	0	0	113.7	W205 Q206 I214	W205-A208 WeakPolarHBondContact O-CB 3.33Å; W205-A208 PolarHBondContact O-N 3.02Å; Q206-A208 PolarHBondContact O-N 3.03Å; Q206-A208 VanDerWaalsContact O-N 3.11Å; A208-I214 HydrophobicContact CB-CD1 3.82Å; A208-I214 HydrophobicContact CB-CG1 3.64Å
209	F	71.1	Confident	67.8	Low	89 Å²	89	62.2 Å²	62.2	39%	0.39	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-96.1	6.8	180	-61.8	-89.8	0	0	0	112.7	L185 L195 H199 W205 Q206 Y207	L185-F209 HydrophobicContact CD2-CB 3.93Å; L185-F209 HydrophobicContact CD2-CD2 4.14Å; L185-F209 HydrophobicContact CD2-CG 4.11Å; L195-F209 HydrophobicContact CD1-CE1 4.27Å; L195-F209 HydrophobicContact CD1-CE2 4.26Å; L195-F209 HydrophobicContact CD1-CZ 3.89Å; L195-F209 HydrophobicContact CD2-CZ 3.87Å; L195-F209 HydrophobicContact CG-CZ 4.49Å; H199-F209 AromaticContact NE2-CE2 3.66Å; H199-F209 AromaticContact NE2-CZ 3.86Å; W205-F209 HydrophobicContact CE3-CD2 4.4Å; W205-F209 AromaticContact CE3-CE2 3.99Å; W205-F209 HydrophobicContact CE3-CE2 3.99Å; W205-F209 HydrophobicContact CZ3-CD2 4.19Å; W205-F209 AromaticContact CZ3-CE2 3.78Å; W205-F209 HydrophobicContact CZ3-CE2 3.78Å; Q206-F209 PolarHBondContact O-N 2.7Å; Q206-F209 VanDerWaalsContact O-N 3.1Å; Y207-F209 PolarHBondContact O-N 2.87Å
210	T	71	Confident	65.8	Low	13 Å²	13	65 Å²	65	8%	0.08	36%	0.363	C	S	.	.	S	Bend	trans	-110.5	155.9	-177	74.3	0	0	0	0	111.1	F175 H183 Y207 Y212 G213	F175-T210 HydrophobicContact CD1-CG2 4.48Å; H183-T210 HydrophobicContact CB-CG2 3.76Å; H183-T210 WeakPolarHBondContact ND1-CB 3.48Å; H183-T210 WeakPolarHBondContact ND1-CG2 3.35Å; Y207-T210 HydrophobicContact CD1-CG2 4.41Å; Y207-T210 PolarHBondContact O-N 2.64Å; Y207-T210 VanDerWaalsContact O-N 3.16Å; Y207-T210 PolarHBondContact O-OG1 2.73Å; T210-Y212 PolarHBondContact O-N 3.19Å; T210-Y212 VanDerWaalsContact O-N 3.15Å; T210-G213 PolarHBondContact O-N 3.41Å; T210-G213 PolarHBondContact OG1-N 2.9Å
211	S	58.8	Low	63.9	Low	116 Å²	116	73.4 Å²	73.4	81%	0.811	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.9	175.7	54.8	0	0	0	0	113.9
212	Y	60	Low	62	Low	135 Å²	135	76.8 Å²	76.8	53%	0.529	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-29.6	173.8	-52.5	-62.8	0	0	0	113.1	Y181 H183 T210	Y181-Y212 WeakPolarHBondContact CD2-OH 3.22Å; Y181-Y212 WeakPolarHBondContact CE2-OH 3.38Å; H183-Y212 AromaticContact CE1-CE2 3.8Å; T210-Y212 PolarHBondContact O-N 3.19Å; T210-Y212 VanDerWaalsContact O-N 3.15Å
213	G	60	Low	59.8	Low	26 Å²	26	78.6 Å²	78.6	27%	0.268	45%	0.45	S	S	.	.			trans	67.7	177.2	-174.6	0	0	0	0	0	114.5	Y207 T210 S215	Y207-G213 CarbonylContact O-C 3.58Å; Y207-G213 VanDerWaalsContact O-C 3.28Å; Y207-G213 WeakPolarHBondContact O-CA 3.43Å; T210-G213 PolarHBondContact O-N 3.41Å; T210-G213 PolarHBondContact OG1-N 2.9Å; G213-S215 PolarHBondContact O-N 3.12Å
214	I	61	Low	58	Low	62 Å²	62	84.9 Å²	84.9	32%	0.318	47%	0.473	S	S	.	.	S	Bend	trans	-63.9	126.4	177.8	-53.2	176.4	0	0	0	110.3	A208 A218 K219	A208-I214 HydrophobicContact CB-CD1 3.82Å; A208-I214 HydrophobicContact CB-CG1 3.64Å; I214-A218 HydrophobicContact CG2-CB 3.64Å; I214-K219 HydrophobicContact CG2-CG 4.4Å; I214-K219 VanDerWaalsContact O-CE 3.25Å; I214-K219 WeakPolarHBondContact O-CE 3.47Å
215	S	47.7	Very low	56.2	Low	32 Å²	32	85.5 Å²	85.5	22%	0.224	50%	0.496	C	S	.	.			trans	-47.6	140.7	173.9	173.1	0	0	0	0	112.3	G213 Q217 A218 K219	G213-S215 PolarHBondContact O-N 3.12Å; S215-Q217 PolarHBondContact O-N 2.87Å; S215-Q217 PolarHBondContact OG-N 2.77Å; S215-A218 PolarHBondContact O-N 2.94Å; S215-K219 PolarHBondContact O-N 3.28Å
216	P	50	Low	54	Low	111 Å²	111	97 Å²	97	72%	0.721	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-24.2	176.7	-26.7	35	0	0	0	114.8
217	Q	48.4	Very low	51.9	Low	182 Å²	182	102.1 Å²	102.1	85%	0.85	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-25.6	177.9	-65.7	180	-15.6	0	0	113.7	S215	S215-Q217 PolarHBondContact O-N 2.87Å; S215-Q217 PolarHBondContact OG-N 2.77Å
218	A	49.1	Very low	50.3	Low	38 Å²	38	110.1 Å²	110.1	31%	0.314	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95	0.3	179.4	0	0	0	0	0	113	I214 S215	I214-A218 HydrophobicContact CG2-CB 3.64Å; S215-A218 PolarHBondContact O-N 2.94Å
219	K	42.9	Very low	48.3	Very low	120 Å²	120	120 Å²	120	52%	0.522	64%	0.64	S	S	.	*	S	Bend	trans	-76.2	131.4	168.4	-66.4	-178.7	-177	177.8	0	109.4	I214 S215 K221	I214-K219 HydrophobicContact CG2-CG 4.4Å; I214-K219 VanDerWaalsContact O-CE 3.25Å; I214-K219 WeakPolarHBondContact O-CE 3.47Å; S215-K219 PolarHBondContact O-N 3.28Å; K219-K221 PolarHBondContact O-N 3.16Å
220	P	44	Very low	46.4	Very low	107 Å²	107	119.1 Å²	119.1	70%	0.695	66%	0.656	S	S	*	*			trans	-60.7	128.5	174.1	25.3	-33.3	0	0	0	109.7	G222	P220-G222 PolarHBondContact O-N 2.9Å
221	K	42.5	Very low	44.8	Very low	220 Å²	220	123.9 Å²	123.9	96%	0.957	69%	0.689	S	S	*	*	S	Bend	trans	-73.3	71.3	-179.2	-68	-176.2	178.4	178.5	0	111.1	K219	K219-K221 PolarHBondContact O-N 3.16Å
222	G	42.5	Very low	43.6	Very low	74 Å²	74	131.8 Å²	131.8	76%	0.763	71%	0.709	S	S	*	*			trans	-162.6	17.3	-173.5	0	0	0	0	0	116.2	P220	P220-G222 PolarHBondContact O-N 2.9Å
223	S	37.4	Very low	42.8	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	72%	0.718	S	S	*	*			trans	-140.7	42.4	-178.3	55.8	0	0	0	0	113.9	G225	S223-G225 PolarHBondContact O-N 2.94Å
224	E	38.3	Very low	41.9	Very low	204 Å²	204	137.2 Å²	137.2	95%	0.953	74%	0.742	S	S	*	*			trans	-73.4	121.7	165.2	-167.8	165.9	-153.7	0	0	109.6
225	G	41.7	Very low	40.8	Very low	75 Å²	75	141.4 Å²	141.4	77%	0.773	77%	0.765	S	S	*	*			trans	110.9	59.7	166.7	0	0	0	0	0	118.9	S223	S223-G225 PolarHBondContact O-N 2.94Å
226	R	34.8	Very low	40.4	Very low	250 Å²	250	147.8 Å²	147.8	94%	0.943	80%	0.797	S	S	*	*			trans	-142.6	119.9	134.4	-154.8	162.6	-174.5	156.8	0.5	112.2
227	S	35.2	Very low	39.8	Very low	116 Å²	116	150.1 Å²	150.1	81%	0.811	80%	0.802	S	S	*	*			trans	-75.7	156.7	-175.1	-169	0	0	0	0	113
228	K	44.7	Very low	39.2	Very low	197 Å²	197	148 Å²	148	86%	0.857	80%	0.799	S	S	*	*			trans	-59	132.1	-177	-62.5	-179.7	178.1	-176.8	0	112.8
229	R	32.7	Very low	38.5	Very low	250 Å²	250	155.9 Å²	155.9	94%	0.943	83%	0.833	S	S	*	*			trans	-172.4	130.2	149.5	-99.8	-175.6	-65.8	-171	1.3	105.5
230	G	32.5	Very low	38.2	Very low	70 Å²	70	158.6 Å²	158.6	72%	0.722	86%	0.857	S	S	*	*			cis	172.1	158.1	-2.3	0	0	0	0	0	107.7
231	C	35.8	Very low	37.7	Very low	114 Å²	114	162.9 Å²	162.9	77%	0.77	87%	0.871	S	S	*	*			trans	-41.2	142.4	-178.6	-51.8	0	0	0	0	113
232	F	34.4	Very low	37.3	Very low	282 Å²	282	157.7 Å²	157.7	100%	1.237	86%	0.863	S	S	*	*			cis	-126.7	0	45	-72.1	-94.3	0	0	0	114.7

Retrieved 232 of 232 residues in 417 ms (Link to these results)

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