A0A077Z5K3_TRITR Loading...

Inward rectifier potassium channel irk 1

AlphaFold DB , UniProt , Accession A0A077Z5K3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 320 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	36.1	Very low	52.3	Low	248 Å²	248	157.7 Å²	157.7	100%	1.222	77%	0.767	S	S	*	*				0	125.1	0	-67.5	-166.9	-178.4	0	0	108.4	K3	M1-K3 PolarHBondContact O-N 2.72Å
2	R	32.9	Very low	55.4	Low	250 Å²	250	148.8 Å²	148.8	94%	0.943	73%	0.725	S	S	*	*			trans	-64.6	125.8	-166.7	-79	175.9	175.4	165.3	-1.8	112.1	K4	R2-K4 PolarHBondContact O-N 3.42Å; R2-K4 VanDerWaalsContact O-N 3.13Å
3	K	38	Very low	58.2	Low	203 Å²	203	137.4 Å²	137.4	88%	0.883	67%	0.669	S	S	*	*			trans	-55.3	112.5	161.8	-78.5	179.6	173.3	-179.6	0	107.9	M1 H5	M1-K3 PolarHBondContact O-N 2.72Å; K3-H5 PolarHBondContact O-N 3Å
4	K	39.1	Very low	60.5	Low	192 Å²	192	130.4 Å²	130.4	84%	0.835	64%	0.637	S	S	*	*			trans	-61.4	131.1	169	-101.3	178.7	172.2	179.6	0	107.4	R2 D6	R2-K4 PolarHBondContact O-N 3.42Å; R2-K4 VanDerWaalsContact O-N 3.13Å; K4-D6 PolarHBondContact O-N 3.03Å; K4-D6 VanDerWaalsContact O-N 3.09Å
5	H	42	Very low	62.5	Low	182 Å²	182	125.4 Å²	125.4	84%	0.843	61%	0.61	S	S	*	*			trans	-57.4	109	173.4	-82.4	-112.3	0	0	0	109.6	K3 V7	K3-H5 PolarHBondContact O-N 3Å; H5-V7 PolarHBondContact O-N 2.74Å; H5-V7 VanDerWaalsContact O-N 3.1Å
6	D	45.2	Very low	64	Low	157 Å²	157	124.2 Å²	124.2	84%	0.84	61%	0.608	S	S	*	*			trans	-68.4	101.9	161	-73.6	-35.1	0	0	0	107.1	K4 C8	K4-D6 PolarHBondContact O-N 3.03Å; K4-D6 VanDerWaalsContact O-N 3.09Å; D6-C8 PolarHBondContact O-N 3.19Å
7	V	54	Low	65.4	Low	93 Å²	93	118.2 Å²	118.2	56%	0.564	59%	0.585	S	S	*	*			trans	-67	100.5	168.2	179.7	0	0	0	0	106.3	H5 Y9	H5-V7 PolarHBondContact O-N 2.74Å; H5-V7 VanDerWaalsContact O-N 3.1Å; V7-Y9 HydrophobicContact CB-CE2 4.08Å; V7-Y9 HydrophobicContact CG1-CD1 4.22Å; V7-Y9 HydrophobicContact CG1-CD2 4.33Å; V7-Y9 HydrophobicContact CG1-CE1 3.74Å; V7-Y9 HydrophobicContact CG1-CE2 3.88Å; V7-Y9 HydrophobicContact CG1-CG 4.49Å; V7-Y9 WeakPolarHBondContact O-CD2 3.23Å; V7-Y9 PolarHBondContact O-N 2.9Å
8	C	55	Low	66.5	Low	127 Å²	127	118.4 Å²	118.4	86%	0.858	58%	0.584	S	S	*	*			trans	-72.6	95.1	177.7	-161.9	0	0	0	0	108.4	D6	D6-C8 PolarHBondContact O-N 3.19Å
9	Y	68.2	Low	67.7	Low	108 Å²	108	118.8 Å²	118.8	42%	0.424	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-70.6	131.1	172.8	-67.1	-72.9	0	0	0	109.5	V7 R11	V7-Y9 HydrophobicContact CB-CE2 4.08Å; V7-Y9 HydrophobicContact CG1-CD1 4.22Å; V7-Y9 HydrophobicContact CG1-CD2 4.33Å; V7-Y9 HydrophobicContact CG1-CE1 3.74Å; V7-Y9 HydrophobicContact CG1-CE2 3.88Å; V7-Y9 HydrophobicContact CG1-CG 4.49Å; V7-Y9 WeakPolarHBondContact O-CD2 3.23Å; V7-Y9 PolarHBondContact O-N 2.9Å; Y9-R11 PolarHBondContact O-N 3.5Å
10	S	76.6	Confident	68.6	Low	113 Å²	113	116.7 Å²	116.7	79%	0.79	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-65.3	127.6	171.2	-169.1	0	0	0	0	108.9
11	R	88.7	Confident	69.3	Low	62 Å²	62	116.7 Å²	116.7	23%	0.234	57%	0.573	C	S	.	*	P	Polyproline II helix	trans	-91.2	140.1	174.8	59.6	-175.9	65.4	-164.4	-3.6	109.7	Y9 L13 N14 K15 N20 L258 E261	Y9-R11 PolarHBondContact O-N 3.5Å; R11-L13 WeakPolarHBondContact CD-O 3.39Å; R11-N14 VanDerWaalsContact CD-OD1 3.25Å; R11-N14 WeakPolarHBondContact CD-OD1 3.35Å; R11-N14 WeakPolarHBondContact CG-OD1 3.18Å; R11-K15 VanDerWaalsContact NH1-CG 3.29Å; R11-N20 WeakPolarHBondContact O-CB 3.37Å; R11-N20 PolarHBondContact O-ND2 2.74Å; R11-L258 HydrophobicContact CB-CD1 4.45Å; R11-L258 HydrophobicContact CB-CD2 4.25Å; R11-E261 IonicContact CZ-OE1 3.26Å; R11-E261 IonicContact NH1-OE1 2.75Å; R11-E261 IonicContact NH2-OE1 3.77Å; R11-E261 PolarHBondContact NH2-OE1 3.25Å
12	L	88.7	Confident	71.4	Confident	51 Å²	51	110.4 Å²	110.4	27%	0.267	55%	0.554	S	S	.	*	S	Bend	trans	-70.7	-40.9	175.2	-173.7	70.3	0	0	0	111.1	Y19 N20 L21 I190 E235 I237	L12-Y19 WeakPolarHBondContact O-CA 3.27Å; L12-N20 PolarHBondContact O-N 3.24Å; L12-L21 HydrophobicContact CD1-CD1 3.91Å; L12-L21 HydrophobicContact CD1-CD2 3.42Å; L12-L21 VanDerWaalsContact CD1-CD2 3.42Å; L12-L21 HydrophobicContact CD1-CG 3.6Å; L12-I190 HydrophobicContact CD2-CD1 3.27Å; L12-E235 VanDerWaalsContact CB-OE2 3.31Å; L12-E235 WeakPolarHBondContact CB-OE2 3.24Å; L12-E235 PolarHBondContact N-OE1 3.26Å; L12-E235 PolarHBondContact N-OE2 3.08Å; L12-I237 HydrophobicContact CD2-CD1 4.29Å
13	L	91.7	Very high	73.4	Confident	0 Å²	0	103 Å²	103	0%	0	55%	0.545	C	S	.	.	B	Isolated β-bridge	trans	-120.3	131.9	178.9	-175.9	74	0	0	0	108.8	R11 G17 Y19 E235 I237 S256	R11-L13 WeakPolarHBondContact CD-O 3.39Å; L13-G17 VanDerWaalsContact CD1-C 3.48Å; L13-G17 VanDerWaalsContact CD1-O 3.27Å; L13-G17 WeakPolarHBondContact CD1-O 3.42Å; L13-Y19 HydrophobicContact CD1-CD1 3.76Å; L13-Y19 HydrophobicContact CD1-CD2 3.97Å; L13-Y19 HydrophobicContact CD1-CE1 3.79Å; L13-Y19 HydrophobicContact CD1-CE2 3.98Å; L13-Y19 HydrophobicContact CD1-CG 3.86Å; L13-E235 PolarHBondContact N-OE1 3.33Å; L13-I237 HydrophobicContact CB-CD1 4.25Å; L13-I237 HydrophobicContact CD2-CD1 4.43Å; L13-I237 HydrophobicContact CD2-CG1 4.37Å; L13-I237 HydrophobicContact CD2-CG2 3.76Å; L13-S256 WeakPolarHBondContact O-CB 3.47Å; L13-S256 PolarHBondContact O-OG 2.97Å
14	N	91.3	Very high	75.3	Confident	40 Å²	40	96.2 Å²	96.2	21%	0.214	53%	0.533	C	S	.	.			trans	-74.5	159.4	173.3	-71.9	-33.9	0	0	0	110.8	R11 N16 G17 E18 N20	R11-N14 VanDerWaalsContact CD-OD1 3.25Å; R11-N14 WeakPolarHBondContact CD-OD1 3.35Å; R11-N14 WeakPolarHBondContact CG-OD1 3.18Å; N14-N16 WeakPolarHBondContact CB-OD1 3.48Å; N14-N16 PolarHBondContact O-N 2.9Å; N14-N16 VanDerWaalsContact O-N 3.11Å; N14-G17 PolarHBondContact O-N 2.84Å; N14-E18 WeakPolarHBondContact CB-O 3.31Å; N14-E18 PolarHBondContact N-O 2.97Å; N14-N20 PolarHBondContact ND2-OD1 2.57Å; N14-N20 PolarHBondContact OD1-ND2 3.15Å
15	K	89.9	Confident	77.1	Confident	55 Å²	55	95.4 Å²	95.4	24%	0.239	54%	0.538	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.1	177.9	-78.4	-82.3	-175.8	-172	0	113	R11 G17 E155 T255 S256 E261	R11-K15 VanDerWaalsContact NH1-CG 3.29Å; K15-G17 VanDerWaalsContact C-N 3.29Å; K15-E155 PolarHBondContact NZ-O 2.89Å; K15-T255 PolarHBondContact O-OG1 3.41Å; K15-S256 WeakPolarHBondContact CD-O 3.43Å; K15-S256 WeakPolarHBondContact CE-O 3.45Å; K15-S256 PolarHBondContact NZ-O 2.96Å; K15-E261 VanDerWaalsContact CE-OE1 3.23Å; K15-E261 WeakPolarHBondContact CE-OE1 3.36Å; K15-E261 WeakPolarHBondContact CE-OE2 3.39Å; K15-E261 IonicContact NZ-OE1 2.74Å; K15-E261 IonicContact NZ-OE2 2.82Å; K15-E261 PolarHBondContact NZ-OE2 2.66Å
16	N	86.5	Confident	78.5	Confident	106 Å²	106	91 Å²	91	57%	0.567	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.9	175.5	68.9	-7.6	0	0	0	113.7	N14 E18	N14-N16 WeakPolarHBondContact CB-OD1 3.48Å; N14-N16 PolarHBondContact O-N 2.9Å; N14-N16 VanDerWaalsContact O-N 3.11Å; N16-E18 VanDerWaalsContact ND2-CD 3.31Å; N16-E18 PolarHBondContact ND2-OE2 3.4Å; N16-E18 WeakPolarHBondContact OD1-CB 3.39Å; N16-E18 PolarHBondContact OD1-N 2.9Å
17	G	87.3	Confident	79.7	Confident	22 Å²	22	91.5 Å²	91.5	23%	0.227	52%	0.521	C	S	.	.	S	Bend	trans	88.9	5.3	-179.5	0	0	0	0	0	115.5	L13 N14 K15 S254	L13-G17 VanDerWaalsContact CD1-C 3.48Å; L13-G17 VanDerWaalsContact CD1-O 3.27Å; L13-G17 WeakPolarHBondContact CD1-O 3.42Å; N14-G17 PolarHBondContact O-N 2.84Å; K15-G17 VanDerWaalsContact C-N 3.29Å; G17-S254 WeakPolarHBondContact CA-O 3.3Å; G17-S254 PolarHBondContact N-O 3.27Å
18	E	86.7	Confident	80.2	Confident	122 Å²	122	91.9 Å²	91.9	57%	0.57	52%	0.52	S	S	*	.			trans	-82.9	131	174.8	-66.4	176.4	157.3	0	0	111	N14 N16	N14-E18 WeakPolarHBondContact CB-O 3.31Å; N14-E18 PolarHBondContact N-O 2.97Å; N16-E18 VanDerWaalsContact ND2-CD 3.31Å; N16-E18 PolarHBondContact ND2-OE2 3.4Å; N16-E18 WeakPolarHBondContact OD1-CB 3.39Å; N16-E18 PolarHBondContact OD1-N 2.9Å
19	Y	87.9	Confident	80.6	Confident	127 Å²	127	88.9 Å²	88.9	50%	0.498	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-77.6	131.3	176.3	-68.6	-88.6	0	0	0	111	L12 L13 L21	L12-Y19 WeakPolarHBondContact O-CA 3.27Å; L13-Y19 HydrophobicContact CD1-CD1 3.76Å; L13-Y19 HydrophobicContact CD1-CD2 3.97Å; L13-Y19 HydrophobicContact CD1-CE1 3.79Å; L13-Y19 HydrophobicContact CD1-CE2 3.98Å; L13-Y19 HydrophobicContact CD1-CG 3.86Å; Y19-L21 HydrophobicContact CD1-CD1 4.26Å; Y19-L21 PolarHBondContact O-N 3.04Å; Y19-L21 VanDerWaalsContact O-N 3.16Å
20	N	86.9	Confident	80.5	Confident	75 Å²	75	88.2 Å²	88.2	40%	0.401	51%	0.508	S	S	.	.			trans	-88.2	56.3	170.3	-65.3	-33.6	0	0	0	110.4	R11 L12 N14	R11-N20 WeakPolarHBondContact O-CB 3.37Å; R11-N20 PolarHBondContact O-ND2 2.74Å; L12-N20 PolarHBondContact O-N 3.24Å; N14-N20 PolarHBondContact ND2-OD1 2.57Å; N14-N20 PolarHBondContact OD1-ND2 3.15Å
21	L	83.8	Confident	80	Confident	118 Å²	118	89.4 Å²	89.4	62%	0.618	50%	0.495	S	S	*	.			trans	-119.5	127.1	179.6	-76.2	173.6	0	0	0	109.8	L12 Y19	L12-L21 HydrophobicContact CD1-CD1 3.91Å; L12-L21 HydrophobicContact CD1-CD2 3.42Å; L12-L21 VanDerWaalsContact CD1-CD2 3.42Å; L12-L21 HydrophobicContact CD1-CG 3.6Å; Y19-L21 HydrophobicContact CD1-CD1 4.26Å; Y19-L21 PolarHBondContact O-N 3.04Å; Y19-L21 VanDerWaalsContact O-N 3.16Å
22	S	78.6	Confident	78.8	Confident	116 Å²	116	93.5 Å²	93.5	81%	0.811	51%	0.51	S	S	*	.			trans	-104.9	121.8	167.1	57.6	0	0	0	0	108.9	G24	S22-G24 PolarHBondContact O-N 3.29Å
23	A	76.5	Confident	77.9	Confident	93 Å²	93	98.5 Å²	98.5	77%	0.769	54%	0.536	S	S	*	.			trans	-70.6	126	171.5	0	0	0	0	0	109.4	V26	A23-V26 HydrophobicContact CB-CG2 3.85Å
24	G	76.1	Confident	77.5	Confident	61 Å²	61	101.7 Å²	101.7	63%	0.629	55%	0.553	S	S	*	*			trans	-111.4	151.1	171.2	0	0	0	0	0	110.3	S22 V26	S22-G24 PolarHBondContact O-N 3.29Å; G24-V26 VanDerWaalsContact C-N 3.32Å; G24-V26 PolarHBondContact O-N 2.8Å
25	N	77.8	Confident	77.2	Confident	176 Å²	176	103.9 Å²	103.9	94%	0.941	57%	0.569	S	S	*	*	S	Bend	trans	54.3	38.9	175.9	-61.8	-12.3	0	0	0	115.1
26	V	71.2	Confident	77.1	Confident	88 Å²	88	106.7 Å²	106.7	53%	0.533	58%	0.578	S	S	.	*			trans	-87.3	129.2	169.6	-176.4	0	0	0	0	108.1	A23 G24 D28	A23-V26 HydrophobicContact CB-CG2 3.85Å; G24-V26 VanDerWaalsContact C-N 3.32Å; G24-V26 PolarHBondContact O-N 2.8Å; V26-D28 PolarHBondContact O-N 3.3Å
27	E	71.4	Confident	77.2	Confident	168 Å²	168	105.2 Å²	105.2	79%	0.785	57%	0.57	S	S	*	*			trans	-65.3	101	169.7	-72.5	-176.8	171.4	0	0	109	S29	E27-S29 PolarHBondContact O-N 3.36Å
28	D	64.6	Low	77.2	Confident	102 Å²	102	106.6 Å²	106.6	55%	0.545	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.1	13	-173.6	-84.1	-25.3	0	0	0	115.7	V26 W31	V26-D28 PolarHBondContact O-N 3.3Å; D28-W31 PolarHBondContact O-NE1 2.96Å
29	S	62.8	Low	77.4	Confident	64 Å²	64	102.7 Å²	102.7	45%	0.448	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-29.4	-173.5	70.9	0	0	0	0	113.5	E27	E27-S29 PolarHBondContact O-N 3.36Å
30	T	65.6	Low	77.5	Confident	94 Å²	94	97.1 Å²	97.1	58%	0.577	54%	0.536	S	S	*	.	S	Bend	trans	-83.7	-31.9	-167.7	51	0	0	0	0	114.2	R32 L33	T30-R32 PolarHBondContact O-N 3.43Å; T30-L33 PolarHBondContact O-N 3.19Å; T30-L33 VanDerWaalsContact O-N 3.1Å
31	W	65.4	Low	77.6	Confident	138 Å²	138	98.3 Å²	98.3	52%	0.523	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-63.8	-26.3	-179.6	69	-97.6	0	0	0	112.8	D28 L33 D34	D28-W31 PolarHBondContact O-NE1 2.96Å; W31-L33 VanDerWaalsContact C-N 3.28Å; W31-L33 PolarHBondContact O-N 3.28Å; W31-D34 PolarHBondContact O-N 2.86Å
32	R	63.7	Low	77.8	Confident	148 Å²	148	95 Å²	95	56%	0.558	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-69.4	-23.3	177.2	-69.9	-171.8	-76.7	-122	0.7	113.7	T30 D34 T35	T30-R32 PolarHBondContact O-N 3.43Å; R32-D34 VanDerWaalsContact C-N 3.26Å; R32-T35 PolarHBondContact O-OG1 2.68Å
33	L	70.2	Confident	78.5	Confident	155 Å²	155	97 Å²	97	81%	0.812	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-77.3	-18.6	176.6	-64.9	171.3	0	0	0	111.6	T30 W31 T35	T30-L33 PolarHBondContact O-N 3.19Å; T30-L33 VanDerWaalsContact O-N 3.1Å; W31-L33 VanDerWaalsContact C-N 3.28Å; W31-L33 PolarHBondContact O-N 3.28Å; L33-T35 PolarHBondContact O-N 2.9Å
34	D	83.3	Confident	79.3	Confident	67 Å²	67	97.7 Å²	97.7	36%	0.358	50%	0.501	S	S	.	.			trans	-100.3	52.5	-179	-161.8	-1.5	0	0	0	112.4	W31 R32 W36 N37 T38	W31-D34 PolarHBondContact O-N 2.86Å; R32-D34 VanDerWaalsContact C-N 3.26Å; D34-W36 PolarHBondContact O-N 2.99Å; D34-N37 PolarHBondContact O-N 3.37Å; D34-N37 VanDerWaalsContact OD1-CB 3.23Å; D34-N37 WeakPolarHBondContact OD1-CB 3.45Å; D34-N37 VanDerWaalsContact OD1-CG 3.26Å; D34-N37 PolarHBondContact OD1-N 3.09Å; D34-N37 PolarHBondContact OD1-ND2 3.4Å; D34-N37 WeakPolarHBondContact OD2-CB 3.23Å; D34-N37 PolarHBondContact OD2-ND2 2.96Å; D34-T38 WeakPolarHBondContact O-CB 3.22Å; D34-T38 PolarHBondContact O-N 3.34Å; D34-T38 PolarHBondContact O-OG1 3.4Å
35	T	84.4	Confident	80.1	Confident	87 Å²	87	105.1 Å²	105.1	53%	0.534	51%	0.51	S	S	.	.	H	α-helix	trans	-57.6	-36.7	-179.8	-54.8	0	0	0	0	111.8	R32 L33 L39	R32-T35 PolarHBondContact O-OG1 2.68Å; L33-T35 PolarHBondContact O-N 2.9Å; T35-L39 HydrophobicContact CG2-CD1 4.11Å; T35-L39 HydrophobicContact CG2-CG 4.46Å; T35-L39 VanDerWaalsContact O-CG 3.31Å; T35-L39 WeakPolarHBondContact O-CG 3.39Å; T35-L39 PolarHBondContact O-N 3.16Å
36	W	88.6	Confident	80.9	Confident	113 Å²	113	104 Å²	104	43%	0.428	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-55.1	-179.7	176.6	-93.8	0	0	0	111.9	D34 T38 L39 V40 V136 A139	D34-W36 PolarHBondContact O-N 2.99Å; W36-T38 VanDerWaalsContact C-N 3.26Å; W36-T38 PolarHBondContact O-N 3.28Å; W36-L39 PolarHBondContact O-N 3.2Å; W36-V40 WeakPolarHBondContact O-CG2 3.34Å; W36-V40 PolarHBondContact O-N 3.49Å; W36-V40 VanDerWaalsContact O-N 3.11Å; W36-V136 HydrophobicContact CE3-CG2 3.94Å; W36-V136 HydrophobicContact CH2-CG2 3.99Å; W36-V136 HydrophobicContact CZ3-CG2 3.57Å; W36-A139 HydrophobicContact CZ2-CB 4.19Å
37	N	87.9	Confident	81.9	Confident	76 Å²	76	99.9 Å²	99.9	41%	0.406	47%	0.467	S	S	.	.	H	α-helix	trans	-65.2	-36.5	179.7	-67	-40.6	0	0	0	110.6	D34 L39 V40 E41	D34-N37 PolarHBondContact O-N 3.37Å; D34-N37 VanDerWaalsContact OD1-CB 3.23Å; D34-N37 WeakPolarHBondContact OD1-CB 3.45Å; D34-N37 VanDerWaalsContact OD1-CG 3.26Å; D34-N37 PolarHBondContact OD1-N 3.09Å; D34-N37 PolarHBondContact OD1-ND2 3.4Å; D34-N37 WeakPolarHBondContact OD2-CB 3.23Å; D34-N37 PolarHBondContact OD2-ND2 2.96Å; N37-L39 PolarHBondContact O-N 2.81Å; N37-V40 PolarHBondContact O-N 2.76Å; N37-E41 WeakPolarHBondContact O-CB 3.45Å; N37-E41 VanDerWaalsContact O-CG 3.26Å; N37-E41 WeakPolarHBondContact O-CG 3.46Å; N37-E41 PolarHBondContact O-N 2.9Å
38	T	88.9	Confident	82.9	Confident	51 Å²	51	96.2 Å²	96.2	31%	0.313	45%	0.452	S	S	.	.	H	α-helix	trans	-55.6	-50.2	174.6	-58.1	0	0	0	0	111.6	D34 W36 V40 E41 V42	D34-T38 WeakPolarHBondContact O-CB 3.22Å; D34-T38 PolarHBondContact O-N 3.34Å; D34-T38 PolarHBondContact O-OG1 3.4Å; W36-T38 VanDerWaalsContact C-N 3.26Å; W36-T38 PolarHBondContact O-N 3.28Å; T38-V40 VanDerWaalsContact C-N 3.34Å; T38-V40 PolarHBondContact O-N 3.05Å; T38-E41 PolarHBondContact O-N 2.71Å; T38-V42 HydrophobicContact CG2-CG2 4.09Å; T38-V42 WeakPolarHBondContact O-CB 3.48Å; T38-V42 WeakPolarHBondContact O-CG2 3.28Å; T38-V42 PolarHBondContact O-N 3.33Å
39	L	89.8	Confident	84.4	Confident	39 Å²	39	95 Å²	95	20%	0.204	45%	0.446	C	S	.	.	H	α-helix	trans	-61.6	-40.4	178.3	-73.8	170.2	0	0	0	112.6	T35 W36 N37 E41 V50 V136 K140	T35-L39 HydrophobicContact CG2-CD1 4.11Å; T35-L39 HydrophobicContact CG2-CG 4.46Å; T35-L39 VanDerWaalsContact O-CG 3.31Å; T35-L39 WeakPolarHBondContact O-CG 3.39Å; T35-L39 PolarHBondContact O-N 3.16Å; W36-L39 PolarHBondContact O-N 3.2Å; N37-L39 PolarHBondContact O-N 2.81Å; L39-E41 VanDerWaalsContact C-N 3.32Å; L39-E41 PolarHBondContact O-N 3.05Å; L39-V50 HydrophobicContact CD2-CB 4.49Å; L39-V50 HydrophobicContact CD2-CG1 3.97Å; L39-V136 HydrophobicContact CB-CG1 4.11Å; L39-V136 HydrophobicContact CB-CG2 4.43Å; L39-K140 PolarHBondContact O-NZ 3.21Å; L39-K140 VanDerWaalsContact O-NZ 3.16Å
40	V	90.9	Very high	85.9	Confident	11 Å²	11	95.1 Å²	95.1	7%	0.067	44%	0.443	C	S	.	.	H	α-helix	trans	-67.7	-32.3	177.4	175.1	0	0	0	0	111.4	W36 N37 T38 V136 A139 K140	W36-V40 WeakPolarHBondContact O-CG2 3.34Å; W36-V40 PolarHBondContact O-N 3.49Å; W36-V40 VanDerWaalsContact O-N 3.11Å; N37-V40 PolarHBondContact O-N 2.76Å; T38-V40 VanDerWaalsContact C-N 3.34Å; T38-V40 PolarHBondContact O-N 3.05Å; V40-V136 HydrophobicContact CG2-CG1 4.24Å; V40-A139 HydrophobicContact CG2-CB 4.04Å; V40-K140 VanDerWaalsContact C-NZ 3.35Å; V40-K140 PolarHBondContact O-NZ 3.08Å
41	E	87.9	Confident	87.2	Confident	100 Å²	100	91.3 Å²	91.3	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-88.8	-31.1	-175.5	-69.9	-159.8	150.5	0	0	115.3	N37 T38 L39 K143 R145	N37-E41 WeakPolarHBondContact O-CB 3.45Å; N37-E41 VanDerWaalsContact O-CG 3.26Å; N37-E41 WeakPolarHBondContact O-CG 3.46Å; N37-E41 PolarHBondContact O-N 2.9Å; T38-E41 PolarHBondContact O-N 2.71Å; L39-E41 VanDerWaalsContact C-N 3.32Å; L39-E41 PolarHBondContact O-N 3.05Å; E41-K143 IonicContact OE1-NZ 2.67Å; E41-K143 PolarHBondContact OE1-NZ 3.34Å; E41-R145 PolarHBondContact O-NH1 3.4Å; E41-R145 PolarHBondContact O-NH2 2.94Å
42	V	89.5	Confident	88.6	Confident	48 Å²	48	87.3 Å²	87.3	29%	0.291	42%	0.415	S	S	.	.	S	Bend	trans	-53.5	152.7	178.2	161.5	0	0	0	0	111.8	T38 W46 K140	T38-V42 HydrophobicContact CG2-CG2 4.09Å; T38-V42 WeakPolarHBondContact O-CB 3.48Å; T38-V42 WeakPolarHBondContact O-CG2 3.28Å; T38-V42 PolarHBondContact O-N 3.33Å; V42-W46 HydrophobicContact CG1-CB 3.29Å; V42-W46 HydrophobicContact CG1-CG 4.23Å; V42-K140 VanDerWaalsContact O-CE 3.3Å; V42-K140 WeakPolarHBondContact O-CE 3.25Å; V42-K140 PolarHBondContact O-NZ 3.29Å
43	K	92.3	Very high	90.2	Very high	157 Å²	157	84.9 Å²	84.9	68%	0.683	41%	0.413	S	S	*	.			trans	-61.7	148.7	179.1	-62.3	179.1	179.8	174.7	0	111	R45 W46 C47	K43-R45 PolarHBondContact O-N 3.39Å; K43-R45 VanDerWaalsContact O-N 3.11Å; K43-W46 PolarHBondContact O-N 3.01Å; K43-W46 VanDerWaalsContact O-N 3.07Å; K43-C47 PolarHBondContact O-N 2.81Å
44	W	92.4	Very high	91.3	Very high	109 Å²	109	79.3 Å²	79.3	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-48.4	-42.7	-180	-84.3	105.1	0	0	0	113.7	W46 C47 L48 V137 K140 M141	W44-W46 PolarHBondContact O-N 3.09Å; W44-C47 PolarHBondContact O-N 3.37Å; W44-L48 WeakPolarHBondContact O-CB 3.34Å; W44-L48 WeakPolarHBondContact O-CG 3.39Å; W44-L48 PolarHBondContact O-N 3.48Å; W44-V137 HydrophobicContact CH2-CG1 4.26Å; W44-V137 HydrophobicContact CZ3-CG1 4.42Å; W44-K140 HydrophobicContact CD2-CD 3.72Å; W44-K140 HydrophobicContact CE3-CD 3.85Å; W44-K140 HydrophobicContact CG-CD 4.43Å; W44-K140 HydrophobicContact CH2-CB 4.28Å; W44-K140 HydrophobicContact CH2-CD 3.76Å; W44-K140 HydrophobicContact CH2-CG 4.15Å; W44-K140 HydrophobicContact CZ2-CB 4.24Å; W44-K140 HydrophobicContact CZ2-CD 3.64Å; W44-K140 HydrophobicContact CZ2-CG 3.75Å; W44-K140 HydrophobicContact CZ3-CD 3.86Å; W44-M141 HydrophobicContact CH2-CE 4.25Å; W44-M141 HydrophobicContact CH2-CG 3.9Å; W44-M141 HydrophobicContact CZ2-CG 4.04Å
45	R	94.4	Very high	91.9	Very high	216 Å²	216	77.3 Å²	77.3	82%	0.815	38%	0.375	S	S	*	.	H	α-helix	trans	-57.7	-46.5	-179.8	-62.5	-179.2	-178.1	136.9	1.1	112.7	K43 L49	K43-R45 PolarHBondContact O-N 3.39Å; K43-R45 VanDerWaalsContact O-N 3.11Å; R45-L49 WeakPolarHBondContact O-CB 3.43Å; R45-L49 PolarHBondContact O-N 3.1Å
46	W	94.1	Very high	92.4	Very high	154 Å²	154	76 Å²	76	58%	0.583	37%	0.367	S	S	*	.	H	α-helix	trans	-73.4	-37.5	179.9	-66.5	121.9	0	0	0	111.9	V42 K43 W44 L49 V50	V42-W46 HydrophobicContact CG1-CB 3.29Å; V42-W46 HydrophobicContact CG1-CG 4.23Å; K43-W46 PolarHBondContact O-N 3.01Å; K43-W46 VanDerWaalsContact O-N 3.07Å; W44-W46 PolarHBondContact O-N 3.09Å; W46-L49 HydrophobicContact CE3-CD1 4.19Å; W46-L49 HydrophobicContact CZ3-CD1 4.15Å; W46-L49 PolarHBondContact O-N 3.14Å; W46-V50 WeakPolarHBondContact O-CG2 3.47Å; W46-V50 PolarHBondContact O-N 3.13Å
47	C	92.9	Very high	92.8	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-47	175	-179.9	0	0	0	0	111.5	K43 W44 L49 V50 F51	K43-C47 PolarHBondContact O-N 2.81Å; W44-C47 PolarHBondContact O-N 3.37Å; C47-L49 VanDerWaalsContact C-N 3.33Å; C47-L49 PolarHBondContact O-N 3.27Å; C47-V50 PolarHBondContact O-N 3.45Å; C47-F51 WeakPolarHBondContact O-CD2 3.32Å; C47-F51 PolarHBondContact O-N 3.27Å; C47-F51 VanDerWaalsContact O-N 3.17Å; C47-F51 VanDerWaalsContact SG-CE2 3.57Å
48	L	92.5	Very high	93.2	Very high	91 Å²	91	72.2 Å²	72.2	48%	0.476	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-38.4	175.1	-68.5	173	0	0	0	112.1	W44 F51 A52	W44-L48 WeakPolarHBondContact O-CB 3.34Å; W44-L48 WeakPolarHBondContact O-CG 3.39Å; W44-L48 PolarHBondContact O-N 3.48Å; L48-F51 PolarHBondContact O-N 2.88Å; L48-A52 WeakPolarHBondContact O-CB 3.48Å; L48-A52 PolarHBondContact O-N 3.1Å
49	L	95.3	Very high	93.5	Very high	77 Å²	77	71.8 Å²	71.8	40%	0.403	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-44.2	176.5	-175.5	154.7	0	0	0	111.6	R45 W46 C47 F51 A52 L53	R45-L49 WeakPolarHBondContact O-CB 3.43Å; R45-L49 PolarHBondContact O-N 3.1Å; W46-L49 HydrophobicContact CE3-CD1 4.19Å; W46-L49 HydrophobicContact CZ3-CD1 4.15Å; W46-L49 PolarHBondContact O-N 3.14Å; C47-L49 VanDerWaalsContact C-N 3.33Å; C47-L49 PolarHBondContact O-N 3.27Å; L49-F51 VanDerWaalsContact C-N 3.34Å; L49-F51 PolarHBondContact O-N 3.05Å; L49-A52 PolarHBondContact O-N 2.81Å; L49-L53 HydrophobicContact CD2-CD1 3.44Å; L49-L53 VanDerWaalsContact CD2-CD1 3.44Å; L49-L53 HydrophobicContact CD2-CG 4.02Å; L49-L53 HydrophobicContact CG-CD1 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.13Å; L49-L53 WeakPolarHBondContact O-CG 3.36Å; L49-L53 PolarHBondContact O-N 2.73Å
50	V	93.7	Very high	93.9	Very high	66 Å²	66	72.8 Å²	72.8	40%	0.4	35%	0.351	S	S	.	.	H	α-helix	trans	-60.1	-44.5	177.1	169.8	0	0	0	0	110.9	L39 W46 C47 L53 S54	L39-V50 HydrophobicContact CD2-CB 4.49Å; L39-V50 HydrophobicContact CD2-CG1 3.97Å; W46-V50 WeakPolarHBondContact O-CG2 3.47Å; W46-V50 PolarHBondContact O-N 3.13Å; C47-V50 PolarHBondContact O-N 3.45Å; V50-L53 PolarHBondContact O-N 3.44Å; V50-S54 PolarHBondContact O-N 2.9Å; V50-S54 PolarHBondContact O-OG 3.32Å
51	F	93.8	Very high	94.1	Very high	14 Å²	14	76.6 Å²	76.6	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-67.3	-42.7	176.6	-71.5	-54.6	0	0	0	112.8	C47 L48 L49 L53 S54 F55 M133 V136	C47-F51 WeakPolarHBondContact O-CD2 3.32Å; C47-F51 PolarHBondContact O-N 3.27Å; C47-F51 VanDerWaalsContact O-N 3.17Å; C47-F51 VanDerWaalsContact SG-CE2 3.57Å; L48-F51 PolarHBondContact O-N 2.88Å; L49-F51 VanDerWaalsContact C-N 3.34Å; L49-F51 PolarHBondContact O-N 3.05Å; F51-L53 VanDerWaalsContact C-N 3.31Å; F51-L53 PolarHBondContact O-N 2.92Å; F51-S54 WeakPolarHBondContact CA-OG 3.35Å; F51-S54 PolarHBondContact O-N 3.18Å; F51-S54 PolarHBondContact O-OG 2.84Å; F51-F55 WeakPolarHBondContact O-CD2 3.39Å; F51-F55 PolarHBondContact O-N 3.44Å; F51-M133 HydrophobicContact CB-CG 4.42Å; F51-M133 HydrophobicContact CB-SD 4.45Å; F51-M133 HydrophobicContact CD1-CB 3.8Å; F51-M133 HydrophobicContact CD1-CG 3.98Å; F51-M133 HydrophobicContact CD2-CG 3.91Å; F51-M133 HydrophobicContact CE1-CB 3.79Å; F51-M133 HydrophobicContact CE1-CG 4.22Å; F51-M133 HydrophobicContact CE2-CB 4.49Å; F51-M133 HydrophobicContact CE2-CG 4.12Å; F51-M133 HydrophobicContact CG-CB 4.21Å; F51-M133 HydrophobicContact CG-CG 3.84Å; F51-M133 HydrophobicContact CG-SD 4.49Å; F51-M133 HydrophobicContact CZ-CB 4.16Å; F51-M133 HydrophobicContact CZ-CG 4.3Å; F51-V136 HydrophobicContact CE2-CB 4.14Å; F51-V136 HydrophobicContact CE2-CG1 3.95Å; F51-V136 HydrophobicContact CZ-CB 3.73Å; F51-V136 HydrophobicContact CZ-CG1 3.9Å; F51-V136 HydrophobicContact CZ-CG2 4.03Å
52	A	94.9	Very high	94.5	Very high	54 Å²	54	72.6 Å²	72.6	45%	0.446	35%	0.351	S	S	.	.	H	α-helix	trans	-59.1	-45.1	176	0	0	0	0	0	111.2	L48 L49 F55 V56	L48-A52 WeakPolarHBondContact O-CB 3.48Å; L48-A52 PolarHBondContact O-N 3.1Å; L49-A52 PolarHBondContact O-N 2.81Å; A52-F55 PolarHBondContact O-N 2.98Å; A52-V56 VanDerWaalsContact O-CG2 3.3Å; A52-V56 WeakPolarHBondContact O-CG2 3.36Å; A52-V56 PolarHBondContact O-N 2.94Å
53	L	96.1	Very high	94.8	Very high	98 Å²	98	70.3 Å²	70.3	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-64.4	-40.6	175	-71.3	-178.1	0	0	0	112	L49 V50 F51 F55 V56 M57	L49-L53 HydrophobicContact CD2-CD1 3.44Å; L49-L53 VanDerWaalsContact CD2-CD1 3.44Å; L49-L53 HydrophobicContact CD2-CG 4.02Å; L49-L53 HydrophobicContact CG-CD1 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.13Å; L49-L53 WeakPolarHBondContact O-CG 3.36Å; L49-L53 PolarHBondContact O-N 2.73Å; V50-L53 PolarHBondContact O-N 3.44Å; F51-L53 VanDerWaalsContact C-N 3.31Å; F51-L53 PolarHBondContact O-N 2.92Å; L53-F55 VanDerWaalsContact C-N 3.33Å; L53-F55 PolarHBondContact O-N 2.89Å; L53-V56 PolarHBondContact O-N 3.26Å; L53-M57 WeakPolarHBondContact O-CB 3.3Å; L53-M57 WeakPolarHBondContact O-CG 3.44Å; L53-M57 PolarHBondContact O-N 2.96Å
54	S	94.6	Very high	95	Very high	37 Å²	37	67 Å²	67	26%	0.259	33%	0.33	S	S	.	.	H	α-helix	trans	-62.7	-40.7	178.4	66.8	0	0	0	0	112.1	V50 F51 S58	V50-S54 PolarHBondContact O-N 2.9Å; V50-S54 PolarHBondContact O-OG 3.32Å; F51-S54 WeakPolarHBondContact CA-OG 3.35Å; F51-S54 PolarHBondContact O-N 3.18Å; F51-S54 PolarHBondContact O-OG 2.84Å; S54-S58 WeakPolarHBondContact O-CB 3.47Å; S54-S58 PolarHBondContact O-N 2.83Å; S54-S58 PolarHBondContact O-OG 3.15Å
55	F	95.1	Very high	95.1	Very high	26 Å²	26	64.6 Å²	64.6	11%	0.114	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-52.1	175.1	-76.5	-64.7	0	0	0	111.7	F51 A52 L53 M57 S58 W59 I129 M133	F51-F55 WeakPolarHBondContact O-CD2 3.39Å; F51-F55 PolarHBondContact O-N 3.44Å; A52-F55 PolarHBondContact O-N 2.98Å; L53-F55 VanDerWaalsContact C-N 3.33Å; L53-F55 PolarHBondContact O-N 2.89Å; F55-M57 VanDerWaalsContact C-N 3.32Å; F55-M57 PolarHBondContact O-N 2.75Å; F55-S58 PolarHBondContact O-N 3.17Å; F55-S58 VanDerWaalsContact O-N 3.14Å; F55-S58 PolarHBondContact O-OG 3.35Å; F55-W59 HydrophobicContact CB-CH2 4.16Å; F55-W59 HydrophobicContact CB-CZ2 3.74Å; F55-W59 HydrophobicContact CD1-CZ2 4.43Å; F55-W59 HydrophobicContact CG-CZ2 4.34Å; F55-W59 VanDerWaalsContact O-CG 3.23Å; F55-W59 PolarHBondContact O-N 2.87Å; F55-I129 HydrophobicContact CD1-CG2 4.08Å; F55-I129 HydrophobicContact CE1-CB 4.47Å; F55-I129 HydrophobicContact CE1-CG2 3.69Å; F55-I129 HydrophobicContact CE2-CG2 4.38Å; F55-I129 HydrophobicContact CZ-CG2 3.85Å; F55-M133 HydrophobicContact CE2-SD 3.57Å; F55-M133 VanDerWaalsContact CE2-SD 3.57Å; F55-M133 HydrophobicContact CZ-SD 4.03Å
56	V	95.1	Very high	95.1	Very high	59 Å²	59	54.3 Å²	54.3	36%	0.358	29%	0.286	S	S	.	.	H	α-helix	trans	-59.1	-43.7	-179.8	172.4	0	0	0	0	111.3	A52 L53 W59 L60	A52-V56 VanDerWaalsContact O-CG2 3.3Å; A52-V56 WeakPolarHBondContact O-CG2 3.36Å; A52-V56 PolarHBondContact O-N 2.94Å; L53-V56 PolarHBondContact O-N 3.26Å; V56-W59 HydrophobicContact CG2-CE3 4.21Å; V56-W59 HydrophobicContact CG2-CZ3 4Å; V56-W59 PolarHBondContact O-N 3.37Å; V56-L60 HydrophobicContact CG1-CD1 3.91Å; V56-L60 HydrophobicContact CG1-CG 4.38Å; V56-L60 WeakPolarHBondContact O-CB 3.49Å; V56-L60 VanDerWaalsContact O-CG 3.27Å; V56-L60 WeakPolarHBondContact O-CG 3.36Å; V56-L60 PolarHBondContact O-N 3.29Å
57	M	96.4	Very high	95.1	Very high	103 Å²	103	52.2 Å²	52.2	51%	0.507	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-42.7	176.6	-72.9	-61.9	-65	0	0	111.9	L53 F55 W59 L60 I61	L53-M57 WeakPolarHBondContact O-CB 3.3Å; L53-M57 WeakPolarHBondContact O-CG 3.44Å; L53-M57 PolarHBondContact O-N 2.96Å; F55-M57 VanDerWaalsContact C-N 3.32Å; F55-M57 PolarHBondContact O-N 2.75Å; M57-W59 PolarHBondContact O-N 3.33Å; M57-L60 PolarHBondContact O-N 3.44Å; M57-I61 WeakPolarHBondContact O-CB 3.42Å; M57-I61 WeakPolarHBondContact O-CD1 3.28Å; M57-I61 VanDerWaalsContact O-CG1 3.23Å; M57-I61 WeakPolarHBondContact O-CG1 3.18Å; M57-I61 PolarHBondContact O-N 3.06Å
58	S	96.5	Very high	95	Very high	6 Å²	6	59.7 Å²	59.7	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-45.1	176.3	67.3	0	0	0	0	111.9	S54 F55 L60 I61 F62 Q98	S54-S58 WeakPolarHBondContact O-CB 3.47Å; S54-S58 PolarHBondContact O-N 2.83Å; S54-S58 PolarHBondContact O-OG 3.15Å; F55-S58 PolarHBondContact O-N 3.17Å; F55-S58 VanDerWaalsContact O-N 3.14Å; F55-S58 PolarHBondContact O-OG 3.35Å; S58-L60 VanDerWaalsContact C-N 3.35Å; S58-L60 PolarHBondContact O-N 2.95Å; S58-I61 PolarHBondContact O-N 2.88Å; S58-F62 WeakPolarHBondContact O-CD2 3.46Å; S58-F62 PolarHBondContact O-N 3.37Å; S58-F62 VanDerWaalsContact O-N 3.11Å; S58-Q98 PolarHBondContact OG-NE2 3.44Å; S58-Q98 PolarHBondContact OG-OE1 2.91Å
59	W	96.2	Very high	94.9	Very high	42 Å²	42	57 Å²	57	16%	0.159	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-44.7	177	-56.1	-25.4	0	0	0	111.2	F55 V56 M57 S63 F91 S94 L95 H99	F55-W59 HydrophobicContact CB-CH2 4.16Å; F55-W59 HydrophobicContact CB-CZ2 3.74Å; F55-W59 HydrophobicContact CD1-CZ2 4.43Å; F55-W59 HydrophobicContact CG-CZ2 4.34Å; F55-W59 VanDerWaalsContact O-CG 3.23Å; F55-W59 PolarHBondContact O-N 2.87Å; V56-W59 HydrophobicContact CG2-CE3 4.21Å; V56-W59 HydrophobicContact CG2-CZ3 4Å; V56-W59 PolarHBondContact O-N 3.37Å; M57-W59 PolarHBondContact O-N 3.33Å; W59-S63 VanDerWaalsContact O-CB 3.28Å; W59-S63 WeakPolarHBondContact O-CB 3.47Å; W59-S63 PolarHBondContact O-N 3.38Å; W59-S63 PolarHBondContact O-OG 2.89Å; W59-F91 HydrophobicContact CB-CE2 3.83Å; W59-F91 HydrophobicContact CB-CZ 4.39Å; W59-F91 HydrophobicContact CE3-CE2 4.5Å; W59-F91 AromaticContact CE3-CZ 3.99Å; W59-F91 HydrophobicContact CE3-CZ 3.99Å; W59-S94 PolarHBondContact O-OG 3.01Å; W59-L95 HydrophobicContact CD2-CD1 4.49Å; W59-L95 HydrophobicContact CD2-CG 4.46Å; W59-L95 HydrophobicContact CE3-CD1 4.19Å; W59-L95 HydrophobicContact CH2-CD1 4.49Å; W59-L95 HydrophobicContact CZ3-CD1 4.18Å; W59-H99 AromaticContact CE2-CE1 3.45Å; W59-H99 VanDerWaalsContact CE2-CE1 3.45Å; W59-H99 AromaticContact CE2-ND1 3.91Å; W59-H99 AromaticContact CZ2-CE1 3.18Å; W59-H99 WeakPolarHBondContact CZ2-CE1 3.32Å; W59-H99 AromaticContact CZ2-ND1 3.89Å; W59-H99 AromaticContact CZ2-NE2 3.82Å; W59-H99 AromaticContact NE1-CE1 3.23Å; W59-H99 PolarHBondContact NE1-CE1 3.01Å; W59-H99 AromaticContact NE1-ND1 3.54Å
60	L	96.6	Very high	94.5	Very high	61 Å²	61	55.1 Å²	55.1	32%	0.319	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-45	178.9	-72.3	173.2	0	0	0	112.2	V56 M57 S58 F62 S63 V64 F87 F91	V56-L60 HydrophobicContact CG1-CD1 3.91Å; V56-L60 HydrophobicContact CG1-CG 4.38Å; V56-L60 WeakPolarHBondContact O-CB 3.49Å; V56-L60 VanDerWaalsContact O-CG 3.27Å; V56-L60 WeakPolarHBondContact O-CG 3.36Å; V56-L60 PolarHBondContact O-N 3.29Å; M57-L60 PolarHBondContact O-N 3.44Å; S58-L60 VanDerWaalsContact C-N 3.35Å; S58-L60 PolarHBondContact O-N 2.95Å; L60-F62 PolarHBondContact O-N 2.98Å; L60-S63 WeakPolarHBondContact O-CB 3.35Å; L60-S63 PolarHBondContact O-N 3.1Å; L60-S63 VanDerWaalsContact O-N 3.17Å; L60-V64 WeakPolarHBondContact O-CG2 3.3Å; L60-V64 PolarHBondContact O-N 3.22Å; L60-F87 HydrophobicContact CD2-CZ 4.48Å; L60-F91 HydrophobicContact CD2-CD2 3.95Å; L60-F91 HydrophobicContact CD2-CE2 3.85Å; L60-F91 HydrophobicContact CG-CE2 4.24Å
61	I	96.7	Very high	94.2	Very high	91 Å²	91	60.7 Å²	60.7	47%	0.467	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-51.1	178.5	-70.3	164.4	0	0	0	110.3	M57 S58 S63 V64 I65	M57-I61 WeakPolarHBondContact O-CB 3.42Å; M57-I61 WeakPolarHBondContact O-CD1 3.28Å; M57-I61 VanDerWaalsContact O-CG1 3.23Å; M57-I61 WeakPolarHBondContact O-CG1 3.18Å; M57-I61 PolarHBondContact O-N 3.06Å; S58-I61 PolarHBondContact O-N 2.88Å; I61-S63 VanDerWaalsContact C-N 3.29Å; I61-S63 PolarHBondContact O-N 2.76Å; I61-V64 PolarHBondContact O-N 2.87Å; I61-I65 HydrophobicContact CG2-CD1 4.07Å; I61-I65 WeakPolarHBondContact O-CG1 3.4Å; I61-I65 PolarHBondContact O-N 3.03Å; I61-I65 VanDerWaalsContact O-N 3.11Å
62	F	96.6	Very high	93.7	Very high	16 Å²	16	63.4 Å²	63.4	7%	0.07	32%	0.322	C	S	.	.	H	α-helix	trans	-66.6	-32.4	177.3	-73.7	-66.8	0	0	0	112.5	S58 L60 V64 I65 Y66 S94 V118 Q122 L125	S58-F62 WeakPolarHBondContact O-CD2 3.46Å; S58-F62 PolarHBondContact O-N 3.37Å; S58-F62 VanDerWaalsContact O-N 3.11Å; L60-F62 PolarHBondContact O-N 2.98Å; F62-V64 VanDerWaalsContact C-N 3.34Å; F62-V64 PolarHBondContact O-N 3.16Å; F62-I65 HydrophobicContact CD1-CD1 4.2Å; F62-I65 PolarHBondContact O-N 3.4Å; F62-Y66 HydrophobicContact CB-CD2 4.37Å; F62-Y66 HydrophobicContact CB-CE2 4.06Å; F62-Y66 WeakPolarHBondContact O-CD2 3.21Å; F62-Y66 PolarHBondContact O-N 3.45Å; F62-S94 WeakPolarHBondContact CB-OG 3.42Å; F62-V118 HydrophobicContact CD1-CG1 3.89Å; F62-V118 HydrophobicContact CE1-CG1 4.19Å; F62-Q122 HydrophobicContact CB-CG 4.49Å; F62-Q122 HydrophobicContact CD1-CB 3.78Å; F62-Q122 HydrophobicContact CD1-CG 4.1Å; F62-Q122 HydrophobicContact CD2-CB 4.05Å; F62-Q122 HydrophobicContact CD2-CG 3.57Å; F62-Q122 HydrophobicContact CE1-CB 3.6Å; F62-Q122 HydrophobicContact CE1-CG 4.23Å; F62-Q122 HydrophobicContact CE2-CB 3.87Å; F62-Q122 HydrophobicContact CE2-CG 3.7Å; F62-Q122 HydrophobicContact CG-CB 4.02Å; F62-Q122 HydrophobicContact CG-CG 3.8Å; F62-Q122 HydrophobicContact CZ-CB 3.67Å; F62-Q122 HydrophobicContact CZ-CG 4.06Å; F62-L125 HydrophobicContact CE2-CB 4.45Å; F62-L125 HydrophobicContact CE2-CD2 3.78Å; F62-L125 HydrophobicContact CZ-CB 4.44Å; F62-L125 HydrophobicContact CZ-CD2 4.05Å
63	S	95.7	Very high	92.7	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-40.8	174.5	-56.9	0	0	0	0	111.9	W59 L60 I61 I65 Y67 V90 F91 S94	W59-S63 VanDerWaalsContact O-CB 3.28Å; W59-S63 WeakPolarHBondContact O-CB 3.47Å; W59-S63 PolarHBondContact O-N 3.38Å; W59-S63 PolarHBondContact O-OG 2.89Å; L60-S63 WeakPolarHBondContact O-CB 3.35Å; L60-S63 PolarHBondContact O-N 3.1Å; L60-S63 VanDerWaalsContact O-N 3.17Å; I61-S63 VanDerWaalsContact C-N 3.29Å; I61-S63 PolarHBondContact O-N 2.76Å; S63-I65 VanDerWaalsContact C-N 3.35Å; S63-Y67 WeakPolarHBondContact O-CB 3.11Å; S63-Y67 PolarHBondContact O-N 3.11Å; S63-V90 WeakPolarHBondContact O-CG1 3.36Å; S63-F91 VanDerWaalsContact OG-CA 3.31Å; S63-F91 WeakPolarHBondContact OG-CA 3.41Å; S63-F91 WeakPolarHBondContact OG-CD2 3.14Å; S63-S94 VanDerWaalsContact OG-CB 3.26Å; S63-S94 WeakPolarHBondContact OG-CB 3.36Å
64	V	95.7	Very high	91.4	Very high	88 Å²	88	64.5 Å²	64.5	53%	0.533	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-41.7	175.8	173	0	0	0	0	110.6	L60 I61 F62 Y67 Y68 F87	L60-V64 WeakPolarHBondContact O-CG2 3.3Å; L60-V64 PolarHBondContact O-N 3.22Å; I61-V64 PolarHBondContact O-N 2.87Å; F62-V64 VanDerWaalsContact C-N 3.34Å; F62-V64 PolarHBondContact O-N 3.16Å; V64-Y67 PolarHBondContact O-N 2.8Å; V64-Y68 PolarHBondContact O-N 2.83Å; V64-F87 HydrophobicContact CG2-CE2 4.32Å
65	I	95	Very high	90.1	Very high	57 Å²	57	68.7 Å²	68.7	29%	0.292	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-48.8	177.7	-64.1	167.3	0	0	0	111	I61 F62 S63 Y67 Y68 F69 V118	I61-I65 HydrophobicContact CG2-CD1 4.07Å; I61-I65 WeakPolarHBondContact O-CG1 3.4Å; I61-I65 PolarHBondContact O-N 3.03Å; I61-I65 VanDerWaalsContact O-N 3.11Å; F62-I65 HydrophobicContact CD1-CD1 4.2Å; F62-I65 PolarHBondContact O-N 3.4Å; S63-I65 VanDerWaalsContact C-N 3.35Å; I65-Y67 VanDerWaalsContact C-N 3.29Å; I65-Y67 PolarHBondContact O-N 2.77Å; I65-Y68 WeakPolarHBondContact O-CB 3.37Å; I65-Y68 PolarHBondContact O-N 2.91Å; I65-F69 HydrophobicContact CG2-CD2 3.89Å; I65-F69 HydrophobicContact CG2-CE2 3.56Å; I65-F69 WeakPolarHBondContact O-CD2 3.47Å; I65-F69 PolarHBondContact O-N 3.16Å; I65-F69 VanDerWaalsContact O-N 3.14Å; I65-V118 HydrophobicContact CG2-CB 4.5Å; I65-V118 HydrophobicContact CG2-CG1 3.78Å; I65-V118 HydrophobicContact CG2-CG2 3.97Å
66	Y	94.3	Very high	88.9	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-65.4	-33.2	176.7	-68.9	-49.1	0	0	0	112.7	F62 Y68 F69 A70 L81 V90 Y93 V115 V118 M119 Q122	F62-Y66 HydrophobicContact CB-CD2 4.37Å; F62-Y66 HydrophobicContact CB-CE2 4.06Å; F62-Y66 WeakPolarHBondContact O-CD2 3.21Å; F62-Y66 PolarHBondContact O-N 3.45Å; Y66-Y68 VanDerWaalsContact C-N 3.32Å; Y66-F69 PolarHBondContact O-N 2.84Å; Y66-A70 VanDerWaalsContact O-CB 3.3Å; Y66-A70 WeakPolarHBondContact O-CB 3.49Å; Y66-A70 PolarHBondContact O-N 3.16Å; Y66-L81 HydrophobicContact CD1-CD1 4.17Å; Y66-L81 HydrophobicContact CG-CD1 4.37Å; Y66-V90 HydrophobicContact CG-CG1 4.48Å; Y66-Y93 HydrophobicContact CD1-CE1 4.07Å; Y66-Y93 AromaticContact CD2-CD1 3.83Å; Y66-Y93 HydrophobicContact CD2-CD1 3.83Å; Y66-Y93 AromaticContact CD2-CE1 3.92Å; Y66-Y93 HydrophobicContact CD2-CE1 3.92Å; Y66-Y93 AromaticContact CE1-CE1 3.89Å; Y66-Y93 HydrophobicContact CE1-CE1 3.89Å; Y66-Y93 AromaticContact CE2-CD1 3.98Å; Y66-Y93 HydrophobicContact CE2-CD1 3.98Å; Y66-Y93 AromaticContact CE2-CE1 3.73Å; Y66-Y93 HydrophobicContact CE2-CE1 3.73Å; Y66-Y93 HydrophobicContact CG-CD1 4.15Å; Y66-Y93 HydrophobicContact CG-CE1 4.1Å; Y66-Y93 AromaticContact CZ-CE1 3.72Å; Y66-V115 HydrophobicContact CD1-CG1 4.27Å; Y66-V115 HydrophobicContact CE1-CG1 4.07Å; Y66-V118 HydrophobicContact CD1-CG1 4.44Å; Y66-V118 HydrophobicContact CE1-CB 4.3Å; Y66-V118 HydrophobicContact CE1-CG1 3.76Å; Y66-M119 WeakPolarHBondContact OH-CA 3.33Å; Y66-Q122 VanDerWaalsContact CZ-OE1 3.29Å; Y66-Q122 PolarHBondContact OH-OE1 3.49Å
67	Y	93	Very high	87.9	Confident	110 Å²	110	81.5 Å²	81.5	43%	0.431	40%	0.398	S	S	.	.	H	α-helix	trans	-66	-38.2	176.1	-177.4	-98.7	0	0	0	111.1	S63 V64 I65 A70 R71 F87 V90	S63-Y67 WeakPolarHBondContact O-CB 3.11Å; S63-Y67 PolarHBondContact O-N 3.11Å; V64-Y67 PolarHBondContact O-N 2.8Å; I65-Y67 VanDerWaalsContact C-N 3.29Å; I65-Y67 PolarHBondContact O-N 2.77Å; Y67-A70 PolarHBondContact O-N 2.86Å; Y67-R71 WeakPolarHBondContact O-CB 3.49Å; Y67-R71 PolarHBondContact O-N 2.65Å; Y67-R71 VanDerWaalsContact O-N 3.1Å; Y67-F87 HydrophobicContact CD2-CB 4.41Å; Y67-F87 HydrophobicContact CD2-CD2 4.01Å; Y67-F87 HydrophobicContact CE2-CB 4.4Å; Y67-F87 HydrophobicContact CG-CD2 4.07Å; Y67-V90 HydrophobicContact CD2-CG2 4.02Å
68	Y	92.1	Very high	87.2	Confident	157 Å²	157	81.3 Å²	81.3	62%	0.616	40%	0.396	S	S	*	.	H	α-helix	trans	-59.2	-52	171.9	173.5	-97.4	0	0	0	111.4	V64 I65 Y66 A70 R71 S72	V64-Y68 PolarHBondContact O-N 2.83Å; I65-Y68 WeakPolarHBondContact O-CB 3.37Å; I65-Y68 PolarHBondContact O-N 2.91Å; Y66-Y68 VanDerWaalsContact C-N 3.32Å; Y68-A70 VanDerWaalsContact C-N 3.33Å; Y68-A70 PolarHBondContact O-N 3.11Å; Y68-R71 PolarHBondContact O-N 3.01Å; Y68-R71 VanDerWaalsContact O-N 3.11Å; Y68-S72 PolarHBondContact O-N 2.92Å; Y68-S72 PolarHBondContact O-OG 3.33Å
69	F	89.9	Confident	86.8	Confident	35 Å²	35	83.5 Å²	83.5	15%	0.154	41%	0.41	C	S	.	.	H	α-helix	trans	-63.9	-35.3	178.5	-73.2	-64.2	0	0	0	113.6	I65 Y66 R71 S72 E114 V115 V118	I65-F69 HydrophobicContact CG2-CD2 3.89Å; I65-F69 HydrophobicContact CG2-CE2 3.56Å; I65-F69 WeakPolarHBondContact O-CD2 3.47Å; I65-F69 PolarHBondContact O-N 3.16Å; I65-F69 VanDerWaalsContact O-N 3.14Å; Y66-F69 PolarHBondContact O-N 2.84Å; F69-R71 VanDerWaalsContact C-N 3.27Å; F69-R71 PolarHBondContact O-N 3.26Å; F69-S72 WeakPolarHBondContact CA-OG 3.48Å; F69-S72 PolarHBondContact O-OG 2.95Å; F69-E114 HydrophobicContact CD1-CB 4.32Å; F69-E114 HydrophobicContact CE1-CB 3.51Å; F69-E114 HydrophobicContact CE1-CG 4.18Å; F69-E114 HydrophobicContact CZ-CB 3.71Å; F69-V115 HydrophobicContact CB-CG2 3.78Å; F69-V115 HydrophobicContact CD1-CG2 4.33Å; F69-V115 HydrophobicContact CD2-CG2 4.17Å; F69-V115 HydrophobicContact CG-CG2 3.85Å; F69-V118 HydrophobicContact CE2-CG2 3.85Å; F69-V118 HydrophobicContact CZ-CG2 4.45Å
70	A	87.7	Confident	86.4	Confident	37 Å²	37	81.8 Å²	81.8	31%	0.306	40%	0.404	S	S	.	.	H	α-helix	trans	-66.8	-29.4	175.7	0	0	0	0	0	112.3	Y66 Y67 Y68 I84	Y66-A70 VanDerWaalsContact O-CB 3.3Å; Y66-A70 WeakPolarHBondContact O-CB 3.49Å; Y66-A70 PolarHBondContact O-N 3.16Å; Y67-A70 PolarHBondContact O-N 2.86Å; Y68-A70 VanDerWaalsContact C-N 3.33Å; Y68-A70 PolarHBondContact O-N 3.11Å; A70-I84 HydrophobicContact CB-CG2 4.3Å
71	R	86	Confident	86.1	Confident	184 Å²	184	79.2 Å²	79.2	69%	0.694	39%	0.391	S	S	*	.	H	α-helix	trans	-91.2	-26.1	-177.5	-170.6	61.5	-175.8	90.2	-6	114	Y67 Y68 F69 H73	Y67-R71 WeakPolarHBondContact O-CB 3.49Å; Y67-R71 PolarHBondContact O-N 2.65Å; Y67-R71 VanDerWaalsContact O-N 3.1Å; Y68-R71 PolarHBondContact O-N 3.01Å; Y68-R71 VanDerWaalsContact O-N 3.11Å; F69-R71 VanDerWaalsContact C-N 3.27Å; F69-R71 PolarHBondContact O-N 3.26Å; R71-H73 PolarHBondContact O-N 2.83Å
72	S	83.2	Confident	85.9	Confident	70 Å²	70	77 Å²	77	49%	0.49	38%	0.378	S	S	.	.	S	Bend	trans	-75.9	-5.7	178.9	61.9	0	0	0	0	113.9	Y68 F69	Y68-S72 PolarHBondContact O-N 2.92Å; Y68-S72 PolarHBondContact O-OG 3.33Å; F69-S72 WeakPolarHBondContact CA-OG 3.48Å; F69-S72 PolarHBondContact O-OG 2.95Å
73	H	75.2	Confident	85.6	Confident	48 Å²	48	79.5 Å²	79.5	22%	0.222	39%	0.392	C	S	.	.	S	Bend	trans	-80.7	132.9	-176.8	-167.6	74.2	0	0	0	112.1	R71 W77 E78	R71-H73 PolarHBondContact O-N 2.83Å; H73-W77 VanDerWaalsContact NE2-C 3.32Å; H73-W77 PolarHBondContact NE2-O 2.92Å; H73-E78 PolarHBondContact CE1-O 2.87Å; H73-E78 PolarHBondContact NE2-O 2.72Å
74	D	67.4	Low	85.3	Confident	128 Å²	128	81.2 Å²	81.2	68%	0.684	40%	0.401	S	S	*	.			trans	-75.8	136.4	174.7	-82.9	-29.3	0	0	0	111.1	E76 W77	D74-E76 PolarHBondContact O-N 3.48Å; D74-W77 PolarHBondContact O-N 2.82Å
75	S	68.4	Low	84.9	Confident	124 Å²	124	84.3 Å²	84.3	87%	0.867	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-12.8	-168.5	54.3	0	0	0	0	115.8
76	E	69.6	Low	84.7	Confident	177 Å²	177	84.4 Å²	84.4	83%	0.827	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.7	-178	-70.7	-172.4	161.9	0	0	113.8	D74	D74-E76 PolarHBondContact O-N 3.48Å
77	W	73.5	Confident	84.7	Confident	177 Å²	177	88.5 Å²	88.5	67%	0.67	44%	0.438	S	S	*	.	S	Bend	trans	-109.9	160.3	-173.2	-64.7	81.6	0	0	0	112.1	H73 D74	H73-W77 VanDerWaalsContact NE2-C 3.32Å; H73-W77 PolarHBondContact NE2-O 2.92Å; D74-W77 PolarHBondContact O-N 2.82Å
78	E	82.9	Confident	84.7	Confident	99 Å²	99	86 Å²	86	46%	0.463	44%	0.44	S	S	.	.			trans	-57.5	129.1	171.8	-66.7	-155.3	113.7	0	0	110.8	H73 K82 Q111	H73-E78 PolarHBondContact CE1-O 2.87Å; H73-E78 PolarHBondContact NE2-O 2.72Å; E78-K82 IonicContact OE1-NZ 3.67Å; E78-K82 PolarHBondContact OE1-NZ 3.3Å; E78-Q111 HydrophobicContact CB-CG 4.26Å
79	P	87.5	Confident	84.9	Confident	53 Å²	53	79 Å²	79	34%	0.344	41%	0.414	S	S	.	.			trans	-64.7	148.1	-175	27.8	-35.7	0	0	0	111.2	L81 K82 T109	P79-L81 PolarHBondContact O-N 3.14Å; P79-L81 VanDerWaalsContact O-N 3.1Å; P79-K82 HydrophobicContact CG-CD 4.12Å; P79-T109 WeakPolarHBondContact O-CG2 3.43Å; P79-T109 PolarHBondContact O-OG1 2.83Å
80	C	87.8	Confident	85.1	Confident	6 Å²	6	77.4 Å²	77.4	4%	0.041	41%	0.407	C	S	.	.	S	Bend	trans	-54.9	-29.3	175.1	-55.8	0	0	0	0	113.2	P108 T109 C112 V115	C80-P108 CarbonylContact O-C 3.56Å; C80-P108 WeakPolarHBondContact O-CA 3.43Å; C80-T109 VanDerWaalsContact CA-OG1 3.32Å; C80-T109 WeakPolarHBondContact CA-OG1 3.46Å; C80-T109 PolarHBondContact O-N 3.29Å; C80-T109 PolarHBondContact O-OG1 3.32Å; C80-C112 VanDerWaalsContact CA-SG 3.53Å; C80-C112 HydrophobicContact CB-CB 3.6Å; C80-C112 WeakPolarHBondContact CB-SG 3.25Å; C80-C112 WeakPolarHBondContact SG-CB 3.12Å; C80-C112 CovalentContact SG-SG 2.03Å; C80-C112 PolarHBondContact SG-SG 3Å; C80-V115 HydrophobicContact CB-CG2 3.93Å
81	L	91.1	Very high	85.5	Confident	6 Å²	6	78.2 Å²	78.2	3%	0.031	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125	179.3	-70.1	154.7	0	0	0	109.4	Y66 P79 I84 Y93 P108 V115	Y66-L81 HydrophobicContact CD1-CD1 4.17Å; Y66-L81 HydrophobicContact CG-CD1 4.37Å; P79-L81 PolarHBondContact O-N 3.14Å; P79-L81 VanDerWaalsContact O-N 3.1Å; L81-I84 HydrophobicContact CB-CD1 3.29Å; L81-I84 HydrophobicContact CB-CG1 3.83Å; L81-I84 HydrophobicContact CD1-CD1 3.57Å; L81-I84 HydrophobicContact CD2-CD1 4.24Å; L81-I84 HydrophobicContact CG-CD1 3.87Å; L81-Y93 HydrophobicContact CD2-CD1 3.9Å; L81-Y93 HydrophobicContact CD2-CD2 4.47Å; L81-Y93 HydrophobicContact CD2-CE1 3.42Å; L81-Y93 VanDerWaalsContact CD2-CE1 3.42Å; L81-Y93 HydrophobicContact CD2-CE2 4.05Å; L81-Y93 HydrophobicContact CD2-CG 4.39Å; L81-P108 HydrophobicContact CD2-CB 4.03Å; L81-V115 HydrophobicContact CD2-CG1 4.19Å; L81-V115 HydrophobicContact CG-CG1 4.33Å
82	K	91.5	Very high	85.9	Confident	46 Å²	46	73 Å²	73	20%	0.2	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	149.5	179.2	-67.6	-87.7	-175.3	169.6	0	111.2	E78 P79 I84 Y107 T109	E78-K82 IonicContact OE1-NZ 3.67Å; E78-K82 PolarHBondContact OE1-NZ 3.3Å; P79-K82 HydrophobicContact CG-CD 4.12Å; K82-I84 VanDerWaalsContact C-N 3.35Å; K82-I84 PolarHBondContact O-N 3.2Å; K82-Y107 HydrophobicContact CB-CD1 4.34Å; K82-Y107 HydrophobicContact CB-CD2 4.44Å; K82-Y107 HydrophobicContact CB-CE1 3.91Å; K82-Y107 HydrophobicContact CB-CE2 4.05Å; K82-Y107 HydrophobicContact CG-CD2 4.42Å; K82-Y107 HydrophobicContact CG-CE1 4.42Å; K82-Y107 HydrophobicContact CG-CE2 3.75Å; K82-Y107 PolarHBondContact N-O 3.02Å; K82-T109 HydrophobicContact CD-CG2 4.43Å; K82-T109 HydrophobicContact CG-CG2 3.71Å
83	N	90.4	Very high	86.5	Confident	68 Å²	68	70.1 Å²	70.1	36%	0.364	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	36.2	177.6	-60.4	-40	0	0	0	115.2	F105	N83-F105 HydrophobicContact CB-CD1 4.07Å; N83-F105 HydrophobicContact CB-CE1 3.71Å; N83-F105 HydrophobicContact CB-CZ 4.2Å; N83-F105 WeakPolarHBondContact CB-O 3.09Å; N83-F105 PolarHBondContact ND2-O 3.12Å
84	I	89.5	Confident	87.5	Confident	36 Å²	36	67.9 Å²	67.9	19%	0.185	36%	0.357	C	S	.	.			trans	-103.8	108	173.2	-60.2	-157.5	0	0	0	109.8	A70 L81 K82 V90	A70-I84 HydrophobicContact CB-CG2 4.3Å; L81-I84 HydrophobicContact CB-CD1 3.29Å; L81-I84 HydrophobicContact CB-CG1 3.83Å; L81-I84 HydrophobicContact CD1-CD1 3.57Å; L81-I84 HydrophobicContact CD2-CD1 4.24Å; L81-I84 HydrophobicContact CG-CD1 3.87Å; K82-I84 VanDerWaalsContact C-N 3.35Å; K82-I84 PolarHBondContact O-N 3.2Å; I84-V90 HydrophobicContact CD1-CG2 4.05Å; I84-V90 HydrophobicContact CG2-CG2 3.32Å
85	N	87.1	Confident	88.8	Confident	153 Å²	153	63.7 Å²	63.7	82%	0.818	34%	0.335	S	S	*	.			trans	-111.2	-20.3	-175.8	-59	-17.7	0	0	0	112.9	S89	N85-S89 PolarHBondContact N-OG 3.2Å
86	S	91.6	Very high	90.1	Very high	59 Å²	59	58.1 Å²	58.1	41%	0.413	30%	0.295	S	S	.	.	S	Bend	trans	-154.1	168.5	-176.1	64.6	0	0	0	0	111.7	A88 S89 V90	S86-A88 PolarHBondContact O-N 3.34Å; S86-A88 PolarHBondContact OG-N 2.87Å; S86-S89 PolarHBondContact N-OG 3.45Å; S86-S89 PolarHBondContact O-N 2.77Å; S86-S89 PolarHBondContact O-OG 2.79Å; S86-S89 PolarHBondContact OG-N 2.86Å; S86-V90 PolarHBondContact O-N 2.67Å
87	F	93.1	Very high	91.3	Very high	85 Å²	85	51 Å²	51	37%	0.373	27%	0.267	S	S	.	.	H	α-helix	trans	-55.9	-35.7	171.5	-176	-98.5	0	0	0	112.2	L60 V64 Y67 S89 V90 F91	L60-F87 HydrophobicContact CD2-CZ 4.48Å; V64-F87 HydrophobicContact CG2-CE2 4.32Å; Y67-F87 HydrophobicContact CD2-CB 4.41Å; Y67-F87 HydrophobicContact CD2-CD2 4.01Å; Y67-F87 HydrophobicContact CE2-CB 4.4Å; Y67-F87 HydrophobicContact CG-CD2 4.07Å; F87-S89 VanDerWaalsContact C-N 3.33Å; F87-S89 PolarHBondContact O-N 3.38Å; F87-V90 PolarHBondContact O-N 3.05Å; F87-V90 VanDerWaalsContact O-N 3.14Å; F87-F91 PolarHBondContact O-N 2.99Å
88	A	94.3	Very high	92.3	Very high	59 Å²	59	43.1 Å²	43.1	49%	0.488	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-38.1	176.5	0	0	0	0	0	112.4	S86 F91 L92	S86-A88 PolarHBondContact O-N 3.34Å; S86-A88 PolarHBondContact OG-N 2.87Å; A88-F91 PolarHBondContact O-N 2.8Å; A88-L92 WeakPolarHBondContact O-CG 3.3Å; A88-L92 PolarHBondContact O-N 3.29Å
89	S	94.2	Very high	92.8	Very high	10 Å²	10	41.8 Å²	41.8	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-33.9	174.3	48.7	0	0	0	0	113	N85 S86 F87 Y93 R106	N85-S89 PolarHBondContact N-OG 3.2Å; S86-S89 PolarHBondContact N-OG 3.45Å; S86-S89 PolarHBondContact O-N 2.77Å; S86-S89 PolarHBondContact O-OG 2.79Å; S86-S89 PolarHBondContact OG-N 2.86Å; F87-S89 VanDerWaalsContact C-N 3.33Å; F87-S89 PolarHBondContact O-N 3.38Å; S89-Y93 PolarHBondContact O-N 2.91Å; S89-R106 WeakPolarHBondContact O-CD 3.23Å
90	V	94.6	Very high	93.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-41.3	173.6	-174	0	0	0	0	110.9	S63 Y66 Y67 I84 S86 F87 Y93 S94	S63-V90 WeakPolarHBondContact O-CG1 3.36Å; Y66-V90 HydrophobicContact CG-CG1 4.48Å; Y67-V90 HydrophobicContact CD2-CG2 4.02Å; I84-V90 HydrophobicContact CD1-CG2 4.05Å; I84-V90 HydrophobicContact CG2-CG2 3.32Å; S86-V90 PolarHBondContact O-N 2.67Å; F87-V90 PolarHBondContact O-N 3.05Å; F87-V90 VanDerWaalsContact O-N 3.14Å; V90-Y93 PolarHBondContact O-N 3.06Å; V90-S94 WeakPolarHBondContact O-CB 3.37Å; V90-S94 PolarHBondContact O-N 2.86Å
91	F	95.7	Very high	93.5	Very high	55 Å²	55	48.7 Å²	48.7	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-43.7	176.2	-179.7	-95.5	0	0	0	112.4	W59 L60 S63 F87 A88 S94 L95	W59-F91 HydrophobicContact CB-CE2 3.83Å; W59-F91 HydrophobicContact CB-CZ 4.39Å; W59-F91 HydrophobicContact CE3-CE2 4.5Å; W59-F91 AromaticContact CE3-CZ 3.99Å; W59-F91 HydrophobicContact CE3-CZ 3.99Å; L60-F91 HydrophobicContact CD2-CD2 3.95Å; L60-F91 HydrophobicContact CD2-CE2 3.85Å; L60-F91 HydrophobicContact CG-CE2 4.24Å; S63-F91 VanDerWaalsContact OG-CA 3.31Å; S63-F91 WeakPolarHBondContact OG-CA 3.41Å; S63-F91 WeakPolarHBondContact OG-CD2 3.14Å; F87-F91 PolarHBondContact O-N 2.99Å; A88-F91 PolarHBondContact O-N 2.8Å; F91-S94 PolarHBondContact O-N 2.81Å; F91-L95 HydrophobicContact CE1-CD1 4.32Å; F91-L95 WeakPolarHBondContact O-CB 3.29Å; F91-L95 PolarHBondContact O-N 3.01Å
92	L	95.5	Very high	93.5	Very high	75 Å²	75	50.9 Å²	50.9	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-45.9	173.2	-72.5	171.4	0	0	0	111.6	A88 S94 L95 E96	A88-L92 WeakPolarHBondContact O-CG 3.3Å; A88-L92 PolarHBondContact O-N 3.29Å; L92-S94 PolarHBondContact O-N 3.39Å; L92-L95 PolarHBondContact O-N 3.21Å; L92-E96 WeakPolarHBondContact O-CB 3.5Å; L92-E96 WeakPolarHBondContact O-CG 3.08Å; L92-E96 PolarHBondContact O-N 3.33Å
93	Y	95.2	Very high	93.5	Very high	9 Å²	9	55.9 Å²	55.9	4%	0.035	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-45.9	175.4	173.9	-104.4	0	0	0	112.3	Y66 L81 S89 V90 L95 E96 A97 R106 P108	Y66-Y93 HydrophobicContact CD1-CE1 4.07Å; Y66-Y93 AromaticContact CD2-CD1 3.83Å; Y66-Y93 HydrophobicContact CD2-CD1 3.83Å; Y66-Y93 AromaticContact CD2-CE1 3.92Å; Y66-Y93 HydrophobicContact CD2-CE1 3.92Å; Y66-Y93 AromaticContact CE1-CE1 3.89Å; Y66-Y93 HydrophobicContact CE1-CE1 3.89Å; Y66-Y93 AromaticContact CE2-CD1 3.98Å; Y66-Y93 HydrophobicContact CE2-CD1 3.98Å; Y66-Y93 AromaticContact CE2-CE1 3.73Å; Y66-Y93 HydrophobicContact CE2-CE1 3.73Å; Y66-Y93 HydrophobicContact CG-CD1 4.15Å; Y66-Y93 HydrophobicContact CG-CE1 4.1Å; Y66-Y93 AromaticContact CZ-CE1 3.72Å; L81-Y93 HydrophobicContact CD2-CD1 3.9Å; L81-Y93 HydrophobicContact CD2-CD2 4.47Å; L81-Y93 HydrophobicContact CD2-CE1 3.42Å; L81-Y93 VanDerWaalsContact CD2-CE1 3.42Å; L81-Y93 HydrophobicContact CD2-CE2 4.05Å; L81-Y93 HydrophobicContact CD2-CG 4.39Å; S89-Y93 PolarHBondContact O-N 2.91Å; V90-Y93 PolarHBondContact O-N 3.06Å; Y93-L95 VanDerWaalsContact C-N 3.33Å; Y93-L95 PolarHBondContact O-N 3.11Å; Y93-E96 PolarHBondContact O-N 3.1Å; Y93-A97 VanDerWaalsContact O-CB 3.3Å; Y93-A97 WeakPolarHBondContact O-CB 2.9Å; Y93-A97 PolarHBondContact O-N 3.32Å; Y93-R106 HydrophobicContact CD2-CB 3.9Å; Y93-R106 HydrophobicContact CG-CB 4.47Å; Y93-P108 WeakPolarHBondContact OH-CD 3.3Å; Y93-P108 WeakPolarHBondContact OH-CG 3.2Å
94	S	96	Very high	93.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.6	-44	177.2	-178.6	0	0	0	0	112	W59 F62 S63 V90 F91 L92 Q98 Q122	W59-S94 PolarHBondContact O-OG 3.01Å; F62-S94 WeakPolarHBondContact CB-OG 3.42Å; S63-S94 VanDerWaalsContact OG-CB 3.26Å; S63-S94 WeakPolarHBondContact OG-CB 3.36Å; V90-S94 WeakPolarHBondContact O-CB 3.37Å; V90-S94 PolarHBondContact O-N 2.86Å; F91-S94 PolarHBondContact O-N 2.81Å; L92-S94 PolarHBondContact O-N 3.39Å; S94-Q98 WeakPolarHBondContact O-CB 3.44Å; S94-Q98 PolarHBondContact O-N 2.6Å; S94-Q122 PolarHBondContact O-NE2 2.91Å; S94-Q122 PolarHBondContact OG-NE2 2.79Å
95	L	95.4	Very high	93.7	Very high	41 Å²	41	59.1 Å²	59.1	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-48.1	176.5	-172.8	159.5	0	0	0	111.2	W59 F91 L92 Y93 A97 Q98 H99 I101	W59-L95 HydrophobicContact CD2-CD1 4.49Å; W59-L95 HydrophobicContact CD2-CG 4.46Å; W59-L95 HydrophobicContact CE3-CD1 4.19Å; W59-L95 HydrophobicContact CH2-CD1 4.49Å; W59-L95 HydrophobicContact CZ3-CD1 4.18Å; F91-L95 HydrophobicContact CE1-CD1 4.32Å; F91-L95 WeakPolarHBondContact O-CB 3.29Å; F91-L95 PolarHBondContact O-N 3.01Å; L92-L95 PolarHBondContact O-N 3.21Å; Y93-L95 VanDerWaalsContact C-N 3.33Å; Y93-L95 PolarHBondContact O-N 3.11Å; L95-A97 VanDerWaalsContact C-N 3.33Å; L95-A97 PolarHBondContact O-N 3.11Å; L95-Q98 PolarHBondContact O-N 3.37Å; L95-H99 PolarHBondContact O-N 3Å; L95-H99 VanDerWaalsContact O-N 3.08Å; L95-I101 HydrophobicContact CD2-CD1 3.75Å
96	E	95.2	Very high	94	Very high	6 Å²	6	54.3 Å²	54.3	3%	0.028	31%	0.31	C	S	.	.	H	α-helix	trans	-58.7	-42.5	178.8	-73.5	172.1	-137	0	0	112	L92 Y93 T100 I101 G102 F103 R106	L92-E96 WeakPolarHBondContact O-CB 3.5Å; L92-E96 WeakPolarHBondContact O-CG 3.08Å; L92-E96 PolarHBondContact O-N 3.33Å; Y93-E96 PolarHBondContact O-N 3.1Å; E96-T100 PolarHBondContact O-N 3.37Å; E96-I101 PolarHBondContact O-N 3.36Å; E96-G102 PolarHBondContact O-N 2.99Å; E96-F103 VanDerWaalsContact CD-CD2 3.46Å; E96-F103 HydrophobicContact CG-CD2 3.64Å; E96-F103 HydrophobicContact CG-CE2 4.05Å; E96-R106 IonicContact OE1-CZ 3.63Å; E96-R106 IonicContact OE1-NH1 2.87Å; E96-R106 PolarHBondContact OE1-NH1 2.82Å
97	A	94.3	Very high	94	Very high	28 Å²	28	56.7 Å²	56.7	23%	0.231	31%	0.311	C	S	.	.	H	α-helix	trans	-68.3	-49	179.4	0	0	0	0	0	111.8	Y93 L95 H99 T100	Y93-A97 VanDerWaalsContact O-CB 3.3Å; Y93-A97 WeakPolarHBondContact O-CB 2.9Å; Y93-A97 PolarHBondContact O-N 3.32Å; L95-A97 VanDerWaalsContact C-N 3.33Å; L95-A97 PolarHBondContact O-N 3.11Å; A97-H99 PolarHBondContact O-N 2.76Å; A97-T100 PolarHBondContact O-N 3.07Å
98	Q	95.4	Very high	93.9	Very high	12 Å²	12	54.6 Å²	54.6	6%	0.056	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-36.6	-176.6	-162.5	170.5	-48.3	0	0	113.4	S58 S94 L95 T100 Q122	S58-Q98 PolarHBondContact OG-NE2 3.44Å; S58-Q98 PolarHBondContact OG-OE1 2.91Å; S94-Q98 WeakPolarHBondContact O-CB 3.44Å; S94-Q98 PolarHBondContact O-N 2.6Å; L95-Q98 PolarHBondContact O-N 3.37Å; Q98-T100 VanDerWaalsContact C-N 3.27Å; Q98-Q122 HydrophobicContact CB-CG 4.15Å; Q98-Q122 HydrophobicContact CG-CG 4.2Å
99	H	93.6	Very high	93.7	Very high	70 Å²	70	52.5 Å²	52.5	32%	0.324	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	2.3	178.6	-76.5	67.7	0	0	0	112.9	W59 L95 A97 I101	W59-H99 AromaticContact CE2-CE1 3.45Å; W59-H99 VanDerWaalsContact CE2-CE1 3.45Å; W59-H99 AromaticContact CE2-ND1 3.91Å; W59-H99 AromaticContact CZ2-CE1 3.18Å; W59-H99 WeakPolarHBondContact CZ2-CE1 3.32Å; W59-H99 AromaticContact CZ2-ND1 3.89Å; W59-H99 AromaticContact CZ2-NE2 3.82Å; W59-H99 AromaticContact NE1-CE1 3.23Å; W59-H99 PolarHBondContact NE1-CE1 3.01Å; W59-H99 AromaticContact NE1-ND1 3.54Å; L95-H99 PolarHBondContact O-N 3Å; L95-H99 VanDerWaalsContact O-N 3.08Å; A97-H99 PolarHBondContact O-N 2.76Å; H99-I101 HydrophobicContact CB-CD1 3.93Å; H99-I101 HydrophobicContact CB-CG1 3.74Å; H99-I101 PolarHBondContact O-N 2.96Å
100	T	94.5	Very high	93.4	Very high	127 Å²	127	60.6 Å²	60.6	78%	0.779	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	33.5	-177.5	64.5	0	0	0	0	112.5	E96 A97 Q98	E96-T100 PolarHBondContact O-N 3.37Å; A97-T100 PolarHBondContact O-N 3.07Å; Q98-T100 VanDerWaalsContact C-N 3.27Å
101	I	95.2	Very high	93	Very high	77 Å²	77	65.8 Å²	65.8	40%	0.395	35%	0.347	S	S	.	.			trans	-75.3	-50	178.2	-59.5	173.4	0	0	0	109.3	L95 E96 H99 F103	L95-I101 HydrophobicContact CD2-CD1 3.75Å; E96-I101 PolarHBondContact O-N 3.36Å; H99-I101 HydrophobicContact CB-CD1 3.93Å; H99-I101 HydrophobicContact CB-CG1 3.74Å; H99-I101 PolarHBondContact O-N 2.96Å; I101-F103 HydrophobicContact CG2-CD1 3.93Å; I101-F103 HydrophobicContact CG2-CD2 4.1Å; I101-F103 HydrophobicContact CG2-CE1 3.56Å; I101-F103 HydrophobicContact CG2-CE2 3.74Å; I101-F103 HydrophobicContact CG2-CG 4.18Å; I101-F103 HydrophobicContact CG2-CZ 3.46Å; I101-F103 VanDerWaalsContact CG2-CZ 3.46Å
102	G	90.5	Very high	92.7	Very high	53 Å²	53	64.2 Å²	64.2	55%	0.546	34%	0.343	S	S	.	.			trans	52.3	65	173.3	0	0	0	0	0	114.5	E96 G104	E96-G102 PolarHBondContact O-N 2.99Å; G102-G104 PolarHBondContact O-N 2.81Å
103	F	92.7	Very high	92.4	Very high	151 Å²	151	64.4 Å²	64.4	66%	0.662	35%	0.351	S	S	*	.			trans	-62.1	-15	179.7	-67.7	-59.4	0	0	0	113.8	E96 I101 F105	E96-F103 VanDerWaalsContact CD-CD2 3.46Å; E96-F103 HydrophobicContact CG-CD2 3.64Å; E96-F103 HydrophobicContact CG-CE2 4.05Å; I101-F103 HydrophobicContact CG2-CD1 3.93Å; I101-F103 HydrophobicContact CG2-CD2 4.1Å; I101-F103 HydrophobicContact CG2-CE1 3.56Å; I101-F103 HydrophobicContact CG2-CE2 3.74Å; I101-F103 HydrophobicContact CG2-CG 4.18Å; I101-F103 HydrophobicContact CG2-CZ 3.46Å; I101-F103 VanDerWaalsContact CG2-CZ 3.46Å; F103-F105 VanDerWaalsContact C-N 3.29Å; F103-F105 PolarHBondContact O-N 2.92Å
104	G	90.4	Very high	92.2	Very high	52 Å²	52	68.8 Å²	68.8	54%	0.536	37%	0.371	S	S	.	.	S	Bend	trans	84.6	-7.6	175.2	0	0	0	0	0	114.9	G102	G102-G104 PolarHBondContact O-N 2.81Å
105	F	92.7	Very high	92.1	Very high	120 Å²	120	68.8 Å²	68.8	53%	0.526	37%	0.371	S	S	.	.	S	Bend	trans	-75.9	-32	176.1	-171.4	-102.7	0	0	0	112.7	N83 F103	N83-F105 HydrophobicContact CB-CD1 4.07Å; N83-F105 HydrophobicContact CB-CE1 3.71Å; N83-F105 HydrophobicContact CB-CZ 4.2Å; N83-F105 WeakPolarHBondContact CB-O 3.09Å; N83-F105 PolarHBondContact ND2-O 3.12Å; F103-F105 VanDerWaalsContact C-N 3.29Å; F103-F105 PolarHBondContact O-N 2.92Å
106	R	93.2	Very high	91.9	Very high	51 Å²	51	70.8 Å²	70.8	19%	0.192	38%	0.382	C	S	.	.	S	Bend	trans	-116.8	123.7	178.5	-59.8	171.1	-170.9	84.2	10.9	108.1	S89 Y93 E96	S89-R106 WeakPolarHBondContact O-CD 3.23Å; Y93-R106 HydrophobicContact CD2-CB 3.9Å; Y93-R106 HydrophobicContact CG-CB 4.47Å; E96-R106 IonicContact OE1-CZ 3.63Å; E96-R106 IonicContact OE1-NH1 2.87Å; E96-R106 PolarHBondContact OE1-NH1 2.82Å
107	Y	91.9	Very high	91.9	Very high	110 Å²	110	75.1 Å²	75.1	43%	0.431	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.5	-176.2	59.4	-88.5	0	0	0	111.3	K82	K82-Y107 HydrophobicContact CB-CD1 4.34Å; K82-Y107 HydrophobicContact CB-CD2 4.44Å; K82-Y107 HydrophobicContact CB-CE1 3.91Å; K82-Y107 HydrophobicContact CB-CE2 4.05Å; K82-Y107 HydrophobicContact CG-CD2 4.42Å; K82-Y107 HydrophobicContact CG-CE1 4.42Å; K82-Y107 HydrophobicContact CG-CE2 3.75Å; K82-Y107 PolarHBondContact N-O 3.02Å
108	P	91.7	Very high	91.9	Very high	41 Å²	41	74.7 Å²	74.7	27%	0.266	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	150.7	174	33.4	-33.4	0	0	0	110.7	C80 L81 Y93 V115 M119	C80-P108 CarbonylContact O-C 3.56Å; C80-P108 WeakPolarHBondContact O-CA 3.43Å; L81-P108 HydrophobicContact CD2-CB 4.03Å; Y93-P108 WeakPolarHBondContact OH-CD 3.3Å; Y93-P108 WeakPolarHBondContact OH-CG 3.2Å; P108-V115 HydrophobicContact CB-CG1 4Å; P108-M119 HydrophobicContact CG-SD 4.11Å
109	T	90.1	Very high	91.9	Very high	15 Å²	15	77.7 Å²	77.7	9%	0.092	41%	0.414	C	S	.	.			trans	-101.6	159.8	172.3	63.1	0	0	0	0	110.6	P79 C80 K82 Q111	P79-T109 WeakPolarHBondContact O-CG2 3.43Å; P79-T109 PolarHBondContact O-OG1 2.83Å; C80-T109 VanDerWaalsContact CA-OG1 3.32Å; C80-T109 WeakPolarHBondContact CA-OG1 3.46Å; C80-T109 PolarHBondContact O-N 3.29Å; C80-T109 PolarHBondContact O-OG1 3.32Å; K82-T109 HydrophobicContact CD-CG2 4.43Å; K82-T109 HydrophobicContact CG-CG2 3.71Å; T109-Q111 PolarHBondContact O-N 3.48Å
110	E	88.5	Confident	91.9	Very high	180 Å²	180	76 Å²	76	84%	0.841	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-6.5	-179	-62.6	179.2	-168.4	0	0	113.6	C112	E110-C112 VanDerWaalsContact C-N 3.27Å; E110-C112 PolarHBondContact O-N 2.81Å
111	Q	85.7	Confident	92	Very high	108 Å²	108	75 Å²	75	51%	0.505	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-27.9	-174.5	-58	-57.9	-23.2	0	0	113	E78 T109	E78-Q111 HydrophobicContact CB-CG 4.26Å; T109-Q111 PolarHBondContact O-N 3.48Å
112	C	88.4	Confident	92	Very high	22 Å²	22	71.4 Å²	71.4	15%	0.149	39%	0.385	C	S	.	.			trans	-121.1	94.1	-171.3	-52	0	0	0	0	110.6	C80 E110 E114 V115	C80-C112 VanDerWaalsContact CA-SG 3.53Å; C80-C112 HydrophobicContact CB-CB 3.6Å; C80-C112 WeakPolarHBondContact CB-SG 3.25Å; C80-C112 WeakPolarHBondContact SG-CB 3.12Å; C80-C112 CovalentContact SG-SG 2.03Å; C80-C112 PolarHBondContact SG-SG 3Å; E110-C112 VanDerWaalsContact C-N 3.27Å; E110-C112 PolarHBondContact O-N 2.81Å; C112-E114 PolarHBondContact O-N 2.69Å; C112-V115 HydrophobicContact CB-CB 4.41Å; C112-V115 HydrophobicContact CB-CG2 4.03Å; C112-V115 PolarHBondContact O-N 3.26Å; C112-V115 VanDerWaalsContact O-N 3.1Å
113	S	90	Very high	92.3	Very high	79 Å²	79	71.2 Å²	71.2	55%	0.552	38%	0.378	S	S	*	.	H	α-helix	trans	-54.9	-33.8	177.3	53	0	0	0	0	113	V115 I116 L117	S113-V115 VanDerWaalsContact C-N 3.33Å; S113-V115 PolarHBondContact O-N 3.31Å; S113-I116 WeakPolarHBondContact O-CB 3.34Å; S113-I116 PolarHBondContact O-N 2.97Å; S113-L117 PolarHBondContact O-N 3.14Å; S113-L117 VanDerWaalsContact O-N 3.08Å
114	E	91.3	Very high	92.4	Very high	101 Å²	101	70.6 Å²	70.6	47%	0.472	38%	0.379	S	S	.	.	H	α-helix	trans	-61.2	-39.6	178.8	-57.6	-52.5	142.7	0	0	112.5	F69 C112 I116 L117 V118	F69-E114 HydrophobicContact CD1-CB 4.32Å; F69-E114 HydrophobicContact CE1-CB 3.51Å; F69-E114 HydrophobicContact CE1-CG 4.18Å; F69-E114 HydrophobicContact CZ-CB 3.71Å; C112-E114 PolarHBondContact O-N 2.69Å; E114-I116 VanDerWaalsContact C-N 3.33Å; E114-I116 PolarHBondContact O-N 3.2Å; E114-L117 PolarHBondContact O-N 2.79Å; E114-V118 WeakPolarHBondContact O-CG2 3.38Å; E114-V118 PolarHBondContact O-N 2.85Å
115	V	92.9	Very high	92.7	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-67.5	-37.2	178.9	176.1	0	0	0	0	110.9	Y66 F69 C80 L81 P108 C112 S113 L117 V118 M119	Y66-V115 HydrophobicContact CD1-CG1 4.27Å; Y66-V115 HydrophobicContact CE1-CG1 4.07Å; F69-V115 HydrophobicContact CB-CG2 3.78Å; F69-V115 HydrophobicContact CD1-CG2 4.33Å; F69-V115 HydrophobicContact CD2-CG2 4.17Å; F69-V115 HydrophobicContact CG-CG2 3.85Å; C80-V115 HydrophobicContact CB-CG2 3.93Å; L81-V115 HydrophobicContact CD2-CG1 4.19Å; L81-V115 HydrophobicContact CG-CG1 4.33Å; P108-V115 HydrophobicContact CB-CG1 4Å; C112-V115 HydrophobicContact CB-CB 4.41Å; C112-V115 HydrophobicContact CB-CG2 4.03Å; C112-V115 PolarHBondContact O-N 3.26Å; C112-V115 VanDerWaalsContact O-N 3.1Å; S113-V115 VanDerWaalsContact C-N 3.33Å; S113-V115 PolarHBondContact O-N 3.31Å; V115-L117 VanDerWaalsContact C-N 3.35Å; V115-V118 PolarHBondContact O-N 3.17Å; V115-M119 WeakPolarHBondContact O-CB 3.08Å; V115-M119 PolarHBondContact O-N 3.41Å
116	I	92.8	Very high	92.8	Very high	84 Å²	84	66.1 Å²	66.1	43%	0.431	35%	0.349	S	S	.	.	H	α-helix	trans	-63	-43.8	175.9	-57.7	174.7	0	0	0	110.2	S113 E114 M119 G120	S113-I116 WeakPolarHBondContact O-CB 3.34Å; S113-I116 PolarHBondContact O-N 2.97Å; E114-I116 VanDerWaalsContact C-N 3.33Å; E114-I116 PolarHBondContact O-N 3.2Å; I116-M119 PolarHBondContact O-N 3.25Å; I116-G120 PolarHBondContact O-N 3.45Å
117	L	94.3	Very high	93	Very high	96 Å²	96	68.2 Å²	68.2	50%	0.503	37%	0.367	S	S	.	.	H	α-helix	trans	-62.8	-46.7	177.4	-177	67.9	0	0	0	111.5	S113 E114 V115 M119 G120 M121	S113-L117 PolarHBondContact O-N 3.14Å; S113-L117 VanDerWaalsContact O-N 3.08Å; E114-L117 PolarHBondContact O-N 2.79Å; V115-L117 VanDerWaalsContact C-N 3.35Å; L117-M119 VanDerWaalsContact C-N 3.31Å; L117-M119 PolarHBondContact O-N 2.72Å; L117-G120 PolarHBondContact O-N 2.82Å; L117-M121 HydrophobicContact CD1-CE 4Å; L117-M121 HydrophobicContact CD2-CE 3.69Å; L117-M121 HydrophobicContact CG-CE 3.58Å; L117-M121 WeakPolarHBondContact O-CG 3.3Å; L117-M121 PolarHBondContact O-N 2.88Å
118	V	95.1	Very high	93.1	Very high	19 Å²	19	66.6 Å²	66.6	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-61	-40.2	176.5	172.8	0	0	0	0	111.6	F62 I65 Y66 F69 E114 V115 G120 M121 Q122	F62-V118 HydrophobicContact CD1-CG1 3.89Å; F62-V118 HydrophobicContact CE1-CG1 4.19Å; I65-V118 HydrophobicContact CG2-CB 4.5Å; I65-V118 HydrophobicContact CG2-CG1 3.78Å; I65-V118 HydrophobicContact CG2-CG2 3.97Å; Y66-V118 HydrophobicContact CD1-CG1 4.44Å; Y66-V118 HydrophobicContact CE1-CB 4.3Å; Y66-V118 HydrophobicContact CE1-CG1 3.76Å; F69-V118 HydrophobicContact CE2-CG2 3.85Å; F69-V118 HydrophobicContact CZ-CG2 4.45Å; E114-V118 WeakPolarHBondContact O-CG2 3.38Å; E114-V118 PolarHBondContact O-N 2.85Å; V115-V118 PolarHBondContact O-N 3.17Å; V118-G120 VanDerWaalsContact C-N 3.32Å; V118-G120 PolarHBondContact O-N 2.85Å; V118-M121 PolarHBondContact O-N 3.04Å; V118-Q122 WeakPolarHBondContact O-CB 3.47Å; V118-Q122 PolarHBondContact O-N 2.9Å
119	M	93.9	Very high	93.3	Very high	75 Å²	75	65.8 Å²	65.8	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-60.7	-42.2	175.5	-169.7	-176.3	80.8	0	0	111.6	Y66 P108 V115 I116 L117 Q122 A123	Y66-M119 WeakPolarHBondContact OH-CA 3.33Å; P108-M119 HydrophobicContact CG-SD 4.11Å; V115-M119 WeakPolarHBondContact O-CB 3.08Å; V115-M119 PolarHBondContact O-N 3.41Å; I116-M119 PolarHBondContact O-N 3.25Å; L117-M119 VanDerWaalsContact C-N 3.31Å; L117-M119 PolarHBondContact O-N 2.72Å; M119-Q122 PolarHBondContact O-N 2.88Å; M119-A123 PolarHBondContact O-N 3.18Å
120	G	94.5	Very high	93.5	Very high	36 Å²	36	70.1 Å²	70.1	37%	0.371	38%	0.381	S	S	.	.	H	α-helix	trans	-61.1	-46.4	174	0	0	0	0	0	112.7	I116 L117 V118 Q122 A123 M124	I116-G120 PolarHBondContact O-N 3.45Å; L117-G120 PolarHBondContact O-N 2.82Å; V118-G120 VanDerWaalsContact C-N 3.32Å; V118-G120 PolarHBondContact O-N 2.85Å; G120-Q122 VanDerWaalsContact C-N 3.34Å; G120-Q122 PolarHBondContact O-N 2.82Å; G120-A123 PolarHBondContact O-N 3.3Å; G120-M124 WeakPolarHBondContact O-CG 3.37Å; G120-M124 PolarHBondContact O-N 3.06Å; G120-M124 VanDerWaalsContact O-N 3.09Å
121	M	95.6	Very high	93.8	Very high	105 Å²	105	64.8 Å²	64.8	52%	0.517	36%	0.363	S	S	.	.	H	α-helix	trans	-63.5	-39.6	176.4	-63.5	-167.2	-157.2	0	0	112.2	L117 V118 M124 L125	L117-M121 HydrophobicContact CD1-CE 4Å; L117-M121 HydrophobicContact CD2-CE 3.69Å; L117-M121 HydrophobicContact CG-CE 3.58Å; L117-M121 WeakPolarHBondContact O-CG 3.3Å; L117-M121 PolarHBondContact O-N 2.88Å; V118-M121 PolarHBondContact O-N 3.04Å; M121-M124 PolarHBondContact O-N 2.84Å; M121-L125 PolarHBondContact O-N 2.88Å
122	Q	96.8	Very high	94.2	Very high	1 Å²	1	64 Å²	64	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-62.1	-45.2	176.1	-179.5	174.3	24.2	0	0	111.9	F62 Y66 S94 Q98 V118 M119 G120 M124 L125 G126	F62-Q122 HydrophobicContact CB-CG 4.49Å; F62-Q122 HydrophobicContact CD1-CB 3.78Å; F62-Q122 HydrophobicContact CD1-CG 4.1Å; F62-Q122 HydrophobicContact CD2-CB 4.05Å; F62-Q122 HydrophobicContact CD2-CG 3.57Å; F62-Q122 HydrophobicContact CE1-CB 3.6Å; F62-Q122 HydrophobicContact CE1-CG 4.23Å; F62-Q122 HydrophobicContact CE2-CB 3.87Å; F62-Q122 HydrophobicContact CE2-CG 3.7Å; F62-Q122 HydrophobicContact CG-CB 4.02Å; F62-Q122 HydrophobicContact CG-CG 3.8Å; F62-Q122 HydrophobicContact CZ-CB 3.67Å; F62-Q122 HydrophobicContact CZ-CG 4.06Å; Y66-Q122 VanDerWaalsContact CZ-OE1 3.29Å; Y66-Q122 PolarHBondContact OH-OE1 3.49Å; S94-Q122 PolarHBondContact O-NE2 2.91Å; S94-Q122 PolarHBondContact OG-NE2 2.79Å; Q98-Q122 HydrophobicContact CB-CG 4.15Å; Q98-Q122 HydrophobicContact CG-CG 4.2Å; V118-Q122 WeakPolarHBondContact O-CB 3.47Å; V118-Q122 PolarHBondContact O-N 2.9Å; M119-Q122 PolarHBondContact O-N 2.88Å; G120-Q122 VanDerWaalsContact C-N 3.34Å; G120-Q122 PolarHBondContact O-N 2.82Å; Q122-M124 VanDerWaalsContact C-N 3.34Å; Q122-M124 PolarHBondContact O-N 2.8Å; Q122-L125 PolarHBondContact O-N 2.82Å; Q122-G126 PolarHBondContact O-N 3.01Å
123	A	95.5	Very high	94.4	Very high	49 Å²	49	65.7 Å²	65.7	41%	0.405	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-45.4	177.3	0	0	0	0	0	111.2	M119 G120 G126 V127	M119-A123 PolarHBondContact O-N 3.18Å; G120-A123 PolarHBondContact O-N 3.3Å; A123-G126 PolarHBondContact O-N 2.77Å; A123-V127 WeakPolarHBondContact O-CG2 3.33Å; A123-V127 PolarHBondContact O-N 3.06Å; A123-V127 VanDerWaalsContact O-N 3.11Å
124	M	95.9	Very high	94.7	Very high	139 Å²	139	66.3 Å²	66.3	69%	0.685	37%	0.369	S	S	*	.	H	α-helix	trans	-60.7	-48.3	176.6	-69.2	178.2	69.9	0	0	112.1	G120 M121 Q122 G126 V127 V128	G120-M124 WeakPolarHBondContact O-CG 3.37Å; G120-M124 PolarHBondContact O-N 3.06Å; G120-M124 VanDerWaalsContact O-N 3.09Å; M121-M124 PolarHBondContact O-N 2.84Å; Q122-M124 VanDerWaalsContact C-N 3.34Å; Q122-M124 PolarHBondContact O-N 2.8Å; M124-G126 VanDerWaalsContact C-N 3.34Å; M124-G126 PolarHBondContact O-N 3.4Å; M124-V127 PolarHBondContact O-N 3.02Å; M124-V128 WeakPolarHBondContact O-CG2 3.5Å; M124-V128 PolarHBondContact O-N 2.89Å; M124-V128 VanDerWaalsContact O-N 3.1Å
125	L	95.7	Very high	94.8	Very high	74 Å²	74	62.8 Å²	62.8	39%	0.387	36%	0.359	S	S	.	.	H	α-helix	trans	-64.6	-39.6	179.4	-172.9	63.8	0	0	0	111.9	F62 M121 Q122 V127 V128 I129	F62-L125 HydrophobicContact CE2-CB 4.45Å; F62-L125 HydrophobicContact CE2-CD2 3.78Å; F62-L125 HydrophobicContact CZ-CB 4.44Å; F62-L125 HydrophobicContact CZ-CD2 4.05Å; M121-L125 PolarHBondContact O-N 2.88Å; Q122-L125 PolarHBondContact O-N 2.82Å; L125-V127 PolarHBondContact O-N 3.33Å; L125-V128 PolarHBondContact O-N 2.96Å; L125-I129 HydrophobicContact CD1-CD1 4.31Å; L125-I129 HydrophobicContact CD1-CG1 4.38Å; L125-I129 HydrophobicContact CD2-CD1 4.33Å; L125-I129 HydrophobicContact CG-CD1 3.89Å; L125-I129 HydrophobicContact CG-CG1 4.36Å; L125-I129 WeakPolarHBondContact O-CG1 3.08Å; L125-I129 PolarHBondContact O-N 3.49Å
126	G	95.7	Very high	94.9	Very high	3 Å²	3	62.9 Å²	62.9	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-57.1	-47.4	176.7	0	0	0	0	0	112.1	Q122 A123 M124 I129 Q130	Q122-G126 PolarHBondContact O-N 3.01Å; A123-G126 PolarHBondContact O-N 2.77Å; M124-G126 VanDerWaalsContact C-N 3.34Å; M124-G126 PolarHBondContact O-N 3.4Å; G126-I129 PolarHBondContact O-N 2.79Å; G126-Q130 WeakPolarHBondContact O-CB 3.46Å; G126-Q130 PolarHBondContact O-N 2.82Å
127	V	96	Very high	94.9	Very high	96 Å²	96	60.3 Å²	60.3	58%	0.582	35%	0.348	S	S	*	.	H	α-helix	trans	-64.1	-40.7	177	174.1	0	0	0	0	111.8	A123 M124 L125 Q130 S131	A123-V127 WeakPolarHBondContact O-CG2 3.33Å; A123-V127 PolarHBondContact O-N 3.06Å; A123-V127 VanDerWaalsContact O-N 3.11Å; M124-V127 PolarHBondContact O-N 3.02Å; L125-V127 PolarHBondContact O-N 3.33Å; V127-Q130 PolarHBondContact O-N 3.35Å; V127-S131 VanDerWaalsContact O-CB 3.31Å; V127-S131 WeakPolarHBondContact O-CB 3.23Å; V127-S131 PolarHBondContact O-N 3Å; V127-S131 PolarHBondContact O-OG 2.83Å
128	V	95.4	Very high	94.9	Very high	76 Å²	76	62.7 Å²	62.7	46%	0.461	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-47.8	176.6	172.5	0	0	0	0	111.5	M124 L125 Q130 S131 L132	M124-V128 WeakPolarHBondContact O-CG2 3.5Å; M124-V128 PolarHBondContact O-N 2.89Å; M124-V128 VanDerWaalsContact O-N 3.1Å; L125-V128 PolarHBondContact O-N 2.96Å; V128-Q130 PolarHBondContact O-N 2.82Å; V128-S131 WeakPolarHBondContact CA-OG 3.32Å; V128-S131 PolarHBondContact O-N 2.77Å; V128-S131 PolarHBondContact O-OG 3.21Å; V128-L132 HydrophobicContact CG1-CD1 4.04Å; V128-L132 WeakPolarHBondContact O-CB 3.34Å; V128-L132 VanDerWaalsContact O-CG 3.3Å; V128-L132 WeakPolarHBondContact O-CG 3.04Å; V128-L132 PolarHBondContact O-N 3.34Å
129	I	94.1	Very high	94.7	Very high	24 Å²	24	63 Å²	63	12%	0.123	36%	0.359	C	S	.	.	H	α-helix	trans	-62.8	-44.6	178.8	-65.6	170.7	0	0	0	110.6	F55 L125 G126 L132 M133	F55-I129 HydrophobicContact CD1-CG2 4.08Å; F55-I129 HydrophobicContact CE1-CB 4.47Å; F55-I129 HydrophobicContact CE1-CG2 3.69Å; F55-I129 HydrophobicContact CE2-CG2 4.38Å; F55-I129 HydrophobicContact CZ-CG2 3.85Å; L125-I129 HydrophobicContact CD1-CD1 4.31Å; L125-I129 HydrophobicContact CD1-CG1 4.38Å; L125-I129 HydrophobicContact CD2-CD1 4.33Å; L125-I129 HydrophobicContact CG-CD1 3.89Å; L125-I129 HydrophobicContact CG-CG1 4.36Å; L125-I129 WeakPolarHBondContact O-CG1 3.08Å; L125-I129 PolarHBondContact O-N 3.49Å; G126-I129 PolarHBondContact O-N 2.79Å; I129-L132 PolarHBondContact O-N 2.95Å; I129-M133 PolarHBondContact O-N 2.84Å
130	Q	95	Very high	94.6	Very high	106 Å²	106	60.1 Å²	60.1	50%	0.495	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-44.5	179.9	-176	176.9	-16.2	0	0	112.1	G126 V127 V128 M133 V134	G126-Q130 WeakPolarHBondContact O-CB 3.46Å; G126-Q130 PolarHBondContact O-N 2.82Å; V127-Q130 PolarHBondContact O-N 3.35Å; V128-Q130 PolarHBondContact O-N 2.82Å; Q130-M133 PolarHBondContact O-N 2.89Å; Q130-V134 WeakPolarHBondContact O-CG2 3.27Å; Q130-V134 PolarHBondContact O-N 2.8Å
131	S	95.2	Very high	94.2	Very high	68 Å²	68	64.9 Å²	64.9	48%	0.476	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-40.8	177.7	58.7	0	0	0	0	112.5	V127 V128 M133 V134 G135	V127-S131 VanDerWaalsContact O-CB 3.31Å; V127-S131 WeakPolarHBondContact O-CB 3.23Å; V127-S131 PolarHBondContact O-N 3Å; V127-S131 PolarHBondContact O-OG 2.83Å; V128-S131 WeakPolarHBondContact CA-OG 3.32Å; V128-S131 PolarHBondContact O-N 2.77Å; V128-S131 PolarHBondContact O-OG 3.21Å; S131-M133 PolarHBondContact O-N 2.75Å; S131-V134 PolarHBondContact O-N 3.16Å; S131-G135 PolarHBondContact O-N 3.4Å
132	L	94	Very high	93.8	Very high	91 Å²	91	63.2 Å²	63.2	48%	0.476	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-43.1	173.8	-73.4	172.8	0	0	0	111.8	V128 I129 G135 V136	V128-L132 HydrophobicContact CG1-CD1 4.04Å; V128-L132 WeakPolarHBondContact O-CB 3.34Å; V128-L132 VanDerWaalsContact O-CG 3.3Å; V128-L132 WeakPolarHBondContact O-CG 3.04Å; V128-L132 PolarHBondContact O-N 3.34Å; I129-L132 PolarHBondContact O-N 2.95Å; L132-G135 PolarHBondContact O-N 3.34Å; L132-V136 WeakPolarHBondContact O-CG2 3.41Å; L132-V136 PolarHBondContact O-N 3.15Å
133	M	93.5	Very high	93.1	Very high	57 Å²	57	66.8 Å²	66.8	28%	0.281	37%	0.37	S	S	.	.	H	α-helix	trans	-59.5	-51.3	176.2	179.6	-171	168.3	0	0	111.4	F51 F55 I129 Q130 S131 G135 V136 V137	F51-M133 HydrophobicContact CB-CG 4.42Å; F51-M133 HydrophobicContact CB-SD 4.45Å; F51-M133 HydrophobicContact CD1-CB 3.8Å; F51-M133 HydrophobicContact CD1-CG 3.98Å; F51-M133 HydrophobicContact CD2-CG 3.91Å; F51-M133 HydrophobicContact CE1-CB 3.79Å; F51-M133 HydrophobicContact CE1-CG 4.22Å; F51-M133 HydrophobicContact CE2-CB 4.49Å; F51-M133 HydrophobicContact CE2-CG 4.12Å; F51-M133 HydrophobicContact CG-CB 4.21Å; F51-M133 HydrophobicContact CG-CG 3.84Å; F51-M133 HydrophobicContact CG-SD 4.49Å; F51-M133 HydrophobicContact CZ-CB 4.16Å; F51-M133 HydrophobicContact CZ-CG 4.3Å; F55-M133 HydrophobicContact CE2-SD 3.57Å; F55-M133 VanDerWaalsContact CE2-SD 3.57Å; F55-M133 HydrophobicContact CZ-SD 4.03Å; I129-M133 PolarHBondContact O-N 2.84Å; Q130-M133 PolarHBondContact O-N 2.89Å; S131-M133 PolarHBondContact O-N 2.75Å; M133-G135 VanDerWaalsContact C-N 3.3Å; M133-G135 PolarHBondContact O-N 3.46Å; M133-V136 PolarHBondContact O-N 2.9Å; M133-V137 HydrophobicContact CG-CG2 4.24Å; M133-V137 WeakPolarHBondContact O-CB 3.44Å; M133-V137 VanDerWaalsContact O-CG2 3.24Å; M133-V137 WeakPolarHBondContact O-CG2 3.19Å; M133-V137 PolarHBondContact O-N 2.7Å
134	V	95.2	Very high	92.1	Very high	92 Å²	92	66.3 Å²	66.3	56%	0.558	36%	0.363	S	S	*	.	H	α-helix	trans	-59.7	-43.3	179.5	173.4	0	0	0	0	110.6	Q130 S131 V137 F138	Q130-V134 WeakPolarHBondContact O-CG2 3.27Å; Q130-V134 PolarHBondContact O-N 2.8Å; S131-V134 PolarHBondContact O-N 3.16Å; V134-V137 PolarHBondContact O-N 3Å; V134-F138 VanDerWaalsContact O-CB 3.24Å; V134-F138 WeakPolarHBondContact O-CB 3.4Å; V134-F138 PolarHBondContact O-N 2.89Å
135	G	94.7	Very high	90.9	Very high	27 Å²	27	65.4 Å²	65.4	28%	0.278	35%	0.352	S	S	.	.	H	α-helix	trans	-60.6	-48.1	177.6	0	0	0	0	0	113.3	S131 L132 M133 F138 A139	S131-G135 PolarHBondContact O-N 3.4Å; L132-G135 PolarHBondContact O-N 3.34Å; M133-G135 VanDerWaalsContact C-N 3.3Å; M133-G135 PolarHBondContact O-N 3.46Å; G135-F138 PolarHBondContact O-N 3Å; G135-A139 WeakPolarHBondContact O-CB 3.34Å; G135-A139 PolarHBondContact O-N 3.45Å
136	V	94.2	Very high	90	Very high	2 Å²	2	67.1 Å²	67.1	1%	0.012	36%	0.361	C	S	.	.	H	α-helix	trans	-66.2	-43.9	178.5	170.7	0	0	0	0	111.3	W36 L39 V40 F51 L132 M133 F138 A139 K140	W36-V136 HydrophobicContact CE3-CG2 3.94Å; W36-V136 HydrophobicContact CH2-CG2 3.99Å; W36-V136 HydrophobicContact CZ3-CG2 3.57Å; L39-V136 HydrophobicContact CB-CG1 4.11Å; L39-V136 HydrophobicContact CB-CG2 4.43Å; V40-V136 HydrophobicContact CG2-CG1 4.24Å; F51-V136 HydrophobicContact CE2-CB 4.14Å; F51-V136 HydrophobicContact CE2-CG1 3.95Å; F51-V136 HydrophobicContact CZ-CB 3.73Å; F51-V136 HydrophobicContact CZ-CG1 3.9Å; F51-V136 HydrophobicContact CZ-CG2 4.03Å; L132-V136 WeakPolarHBondContact O-CG2 3.41Å; L132-V136 PolarHBondContact O-N 3.15Å; M133-V136 PolarHBondContact O-N 2.9Å; V136-F138 VanDerWaalsContact C-N 3.34Å; V136-F138 PolarHBondContact O-N 3.11Å; V136-A139 PolarHBondContact O-N 3.17Å; V136-K140 WeakPolarHBondContact O-CB 3.41Å; V136-K140 PolarHBondContact O-N 2.82Å
137	V	93.4	Very high	89.3	Confident	31 Å²	31	67.4 Å²	67.4	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-44.1	178.5	170.5	0	0	0	0	110.5	W44 M133 V134 K140 M141	W44-V137 HydrophobicContact CH2-CG1 4.26Å; W44-V137 HydrophobicContact CZ3-CG1 4.42Å; M133-V137 HydrophobicContact CG-CG2 4.24Å; M133-V137 WeakPolarHBondContact O-CB 3.44Å; M133-V137 VanDerWaalsContact O-CG2 3.24Å; M133-V137 WeakPolarHBondContact O-CG2 3.19Å; M133-V137 PolarHBondContact O-N 2.7Å; V134-V137 PolarHBondContact O-N 3Å; V137-K140 PolarHBondContact O-N 3.28Å; V137-M141 HydrophobicContact CG1-CE 4.47Å; V137-M141 HydrophobicContact CG1-SD 4.27Å; V137-M141 WeakPolarHBondContact O-CG 3.48Å; V137-M141 PolarHBondContact O-N 3.14Å
138	F	93	Very high	88.5	Confident	146 Å²	146	64.3 Å²	64.3	64%	0.64	35%	0.346	S	S	*	.	H	α-helix	trans	-61.3	-50.9	175.9	-178.6	-99.8	0	0	0	111.7	V134 G135 V136 K140 M141 T142	V134-F138 VanDerWaalsContact O-CB 3.24Å; V134-F138 WeakPolarHBondContact O-CB 3.4Å; V134-F138 PolarHBondContact O-N 2.89Å; G135-F138 PolarHBondContact O-N 3Å; V136-F138 VanDerWaalsContact C-N 3.34Å; V136-F138 PolarHBondContact O-N 3.11Å; F138-K140 VanDerWaalsContact C-N 3.25Å; F138-K140 PolarHBondContact O-N 3.06Å; F138-M141 PolarHBondContact O-N 3.07Å; F138-M141 VanDerWaalsContact O-N 3.14Å; F138-T142 HydrophobicContact CD1-CG2 4.32Å; F138-T142 HydrophobicContact CD2-CG2 4.5Å; F138-T142 HydrophobicContact CE1-CG2 3.96Å; F138-T142 HydrophobicContact CE2-CG2 4.15Å; F138-T142 HydrophobicContact CZ-CG2 3.86Å; F138-T142 WeakPolarHBondContact O-CG2 2.89Å; F138-T142 PolarHBondContact O-N 2.96Å; F138-T142 PolarHBondContact O-OG1 3.49Å
139	A	91.2	Very high	87.9	Confident	24 Å²	24	68.1 Å²	68.1	20%	0.198	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-36.6	177.5	0	0	0	0	0	112.6	W36 V40 G135 V136 T142 K143	W36-A139 HydrophobicContact CZ2-CB 4.19Å; V40-A139 HydrophobicContact CG2-CB 4.04Å; G135-A139 WeakPolarHBondContact O-CB 3.34Å; G135-A139 PolarHBondContact O-N 3.45Å; V136-A139 PolarHBondContact O-N 3.17Å; A139-T142 PolarHBondContact O-OG1 3.47Å; A139-T142 VanDerWaalsContact O-OG1 3.08Å; A139-K143 PolarHBondContact O-N 2.89Å
140	K	91.3	Very high	87.5	Confident	15 Å²	15	68.1 Å²	68.1	7%	0.065	36%	0.36	C	S	.	.	H	α-helix	trans	-70	-37.3	177.3	-166.1	179.4	-154.3	77.7	0	112.6	L39 V40 V42 W44 V136 V137 F138	L39-K140 PolarHBondContact O-NZ 3.21Å; L39-K140 VanDerWaalsContact O-NZ 3.16Å; V40-K140 VanDerWaalsContact C-NZ 3.35Å; V40-K140 PolarHBondContact O-NZ 3.08Å; V42-K140 VanDerWaalsContact O-CE 3.3Å; V42-K140 WeakPolarHBondContact O-CE 3.25Å; V42-K140 PolarHBondContact O-NZ 3.29Å; W44-K140 HydrophobicContact CD2-CD 3.72Å; W44-K140 HydrophobicContact CE3-CD 3.85Å; W44-K140 HydrophobicContact CG-CD 4.43Å; W44-K140 HydrophobicContact CH2-CB 4.28Å; W44-K140 HydrophobicContact CH2-CD 3.76Å; W44-K140 HydrophobicContact CH2-CG 4.15Å; W44-K140 HydrophobicContact CZ2-CB 4.24Å; W44-K140 HydrophobicContact CZ2-CD 3.64Å; W44-K140 HydrophobicContact CZ2-CG 3.75Å; W44-K140 HydrophobicContact CZ3-CD 3.86Å; V136-K140 WeakPolarHBondContact O-CB 3.41Å; V136-K140 PolarHBondContact O-N 2.82Å; V137-K140 PolarHBondContact O-N 3.28Å; F138-K140 VanDerWaalsContact C-N 3.25Å; F138-K140 PolarHBondContact O-N 3.06Å
141	M	87.9	Confident	87.4	Confident	137 Å²	137	63.6 Å²	63.6	68%	0.675	34%	0.339	S	S	*	.	H	α-helix	trans	-72	-33.8	177.2	-76.4	-175	158.9	0	0	112.8	W44 V137 F138	W44-M141 HydrophobicContact CH2-CE 4.25Å; W44-M141 HydrophobicContact CH2-CG 3.9Å; W44-M141 HydrophobicContact CZ2-CG 4.04Å; V137-M141 HydrophobicContact CG1-CE 4.47Å; V137-M141 HydrophobicContact CG1-SD 4.27Å; V137-M141 WeakPolarHBondContact O-CG 3.48Å; V137-M141 PolarHBondContact O-N 3.14Å; F138-M141 PolarHBondContact O-N 3.07Å; F138-M141 VanDerWaalsContact O-N 3.14Å
142	T	85.8	Confident	87.2	Confident	69 Å²	69	62.1 Å²	62.1	42%	0.423	33%	0.326	S	S	.	.	H	α-helix	trans	-78.4	-19.4	179.4	56.7	0	0	0	0	113.2	F138 A139 P144	F138-T142 HydrophobicContact CD1-CG2 4.32Å; F138-T142 HydrophobicContact CD2-CG2 4.5Å; F138-T142 HydrophobicContact CE1-CG2 3.96Å; F138-T142 HydrophobicContact CE2-CG2 4.15Å; F138-T142 HydrophobicContact CZ-CG2 3.86Å; F138-T142 WeakPolarHBondContact O-CG2 2.89Å; F138-T142 PolarHBondContact O-N 2.96Å; F138-T142 PolarHBondContact O-OG1 3.49Å; A139-T142 PolarHBondContact O-OG1 3.47Å; A139-T142 VanDerWaalsContact O-OG1 3.08Å; T142-P144 WeakPolarHBondContact O-CD 3.31Å
143	K	82.3	Confident	87.2	Confident	77 Å²	77	58.9 Å²	58.9	34%	0.335	31%	0.308	S	S	.	.	S	Bend	trans	-63.7	123.5	179.3	-163.9	170.1	-177.2	163.2	0	110.9	E41 A139 R145	E41-K143 IonicContact OE1-NZ 2.67Å; E41-K143 PolarHBondContact OE1-NZ 3.34Å; A139-K143 PolarHBondContact O-N 2.89Å; K143-R145 HydrophobicContact CD-CG 4.31Å; K143-R145 HydrophobicContact CG-CG 4.2Å; K143-R145 PolarHBondContact O-N 2.87Å
144	P	73.8	Confident	87.3	Confident	38 Å²	38	56.3 Å²	56.3	25%	0.247	30%	0.295	C	S	.	.			trans	-79.4	40	-172.3	33.1	-37.5	0	0	0	114.3	T142 N146 R147 I244 C249	T142-P144 WeakPolarHBondContact O-CD 3.31Å; P144-N146 VanDerWaalsContact C-N 3.27Å; P144-N146 PolarHBondContact O-N 3.16Å; P144-R147 HydrophobicContact CB-CB 4.02Å; P144-R147 VanDerWaalsContact O-CB 3.32Å; P144-R147 WeakPolarHBondContact O-CB 3.32Å; P144-R147 PolarHBondContact O-N 2.66Å; P144-I244 HydrophobicContact CB-CD1 3.38Å; P144-I244 HydrophobicContact CG-CD1 4.05Å; P144-C249 HydrophobicContact CG-CB 4.44Å
145	R	72.3	Confident	87.2	Confident	121 Å²	121	56.8 Å²	56.8	46%	0.457	29%	0.291	S	S	.	.	H	α-helix	trans	-55.2	-41.6	-176.8	-80.8	-176.3	160.1	169.8	-4.9	112.9	E41 K143 R147	E41-R145 PolarHBondContact O-NH1 3.4Å; E41-R145 PolarHBondContact O-NH2 2.94Å; K143-R145 HydrophobicContact CD-CG 4.31Å; K143-R145 HydrophobicContact CG-CG 4.2Å; K143-R145 PolarHBondContact O-N 2.87Å; R145-R147 PolarHBondContact O-N 2.71Å
146	N	75.7	Confident	87.3	Confident	109 Å²	109	59.5 Å²	59.5	58%	0.583	29%	0.294	S	S	*	.	H	α-helix	trans	-79.7	-5.8	-178.3	-60	-13.7	0	0	0	112.8	P144	P144-N146 VanDerWaalsContact C-N 3.27Å; P144-N146 PolarHBondContact O-N 3.16Å
147	R	81	Confident	87.3	Confident	10 Å²	10	59.4 Å²	59.4	4%	0.038	29%	0.293	C	S	.	.	H	α-helix	trans	-77.5	-42.3	-179.7	-169	67.2	169.8	113.6	1.7	111.3	P144 R145 Q149 T150 D174 R176 Y178 I244 T251	P144-R147 HydrophobicContact CB-CB 4.02Å; P144-R147 VanDerWaalsContact O-CB 3.32Å; P144-R147 WeakPolarHBondContact O-CB 3.32Å; P144-R147 PolarHBondContact O-N 2.66Å; R145-R147 PolarHBondContact O-N 2.71Å; R147-Q149 PolarHBondContact O-N 3.17Å; R147-T150 PolarHBondContact NH1-OG1 3.47Å; R147-T150 PolarHBondContact O-N 2.75Å; R147-T150 PolarHBondContact O-OG1 3.43Å; R147-D174 IonicContact CZ-OD1 3.85Å; R147-D174 IonicContact CZ-OD2 3.34Å; R147-D174 IonicContact NH1-OD1 2.77Å; R147-D174 PolarHBondContact NH1-OD1 2.91Å; R147-D174 IonicContact NH1-OD2 2.77Å; R147-D174 PolarHBondContact NH1-OD2 3.48Å; R147-D174 IonicContact NH2-OD1 3.93Å; R147-D174 IonicContact NH2-OD2 2.82Å; R147-D174 PolarHBondContact NH2-OD2 2.85Å; R147-R176 VanDerWaalsContact NH1-CB 3.34Å; R147-Y178 PolarHBondContact NH2-O 3.47Å; R147-I244 HydrophobicContact CB-CD1 4.06Å; R147-I244 HydrophobicContact CG-CD1 3.74Å; R147-I244 HydrophobicContact CG-CG1 4.02Å; R147-T251 HydrophobicContact CG-CG2 4.22Å
148	A	80.3	Confident	87.4	Confident	31 Å²	31	58 Å²	58	26%	0.256	29%	0.285	S	S	.	.	H	α-helix	trans	-55.7	-37.4	176.6	0	0	0	0	0	112.1	T150 L151 Q252 A253	A148-T150 PolarHBondContact O-N 2.87Å; A148-L151 WeakPolarHBondContact O-CB 3.47Å; A148-L151 PolarHBondContact O-N 3.27Å; A148-L151 VanDerWaalsContact O-N 3.14Å; A148-Q252 WeakPolarHBondContact CB-O 3.33Å; A148-A253 HydrophobicContact CB-CB 4.16Å
149	Q	82	Confident	87.5	Confident	155 Å²	155	51.2 Å²	51.2	72%	0.724	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.7	177.5	-64.8	-179.4	-16.7	0	0	114.6	R147	R147-Q149 PolarHBondContact O-N 3.17Å
150	T	87	Confident	87.6	Confident	25 Å²	25	50.3 Å²	50.3	15%	0.153	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-4.5	176.6	61.1	0	0	0	0	113.7	R147 A148 M175 R176	R147-T150 PolarHBondContact NH1-OG1 3.47Å; R147-T150 PolarHBondContact O-N 2.75Å; R147-T150 PolarHBondContact O-OG1 3.43Å; A148-T150 PolarHBondContact O-N 2.87Å; T150-M175 PolarHBondContact O-N 2.74Å; T150-R176 HydrophobicContact CG2-CG 4.15Å; T150-R176 PolarHBondContact OG1-NE 3.41Å
151	L	91.1	Very high	87.6	Confident	11 Å²	11	55.4 Å²	55.4	6%	0.058	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.1	170.3	-62.2	173.9	0	0	0	108.2	A148 D174 L180 L240 A253	A148-L151 WeakPolarHBondContact O-CB 3.47Å; A148-L151 PolarHBondContact O-N 3.27Å; A148-L151 VanDerWaalsContact O-N 3.14Å; L151-D174 HydrophobicContact CD2-CB 3.95Å; L151-L180 HydrophobicContact CD1-CD2 4.31Å; L151-L180 HydrophobicContact CD2-CD2 4.41Å; L151-L240 HydrophobicContact CD1-CD2 3.78Å; L151-A253 HydrophobicContact CB-CB 4.07Å; L151-A253 HydrophobicContact CD1-CB 3.64Å; L151-A253 HydrophobicContact CG-CB 4.47Å
152	L	91.9	Very high	87.6	Confident	37 Å²	37	53.6 Å²	53.6	19%	0.194	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	137.6	-178.5	-71.9	169.3	0	0	0	110.1	V172 G173 M175 Y287 F290	L152-V172 CarbonylContact O-C 3.51Å; L152-V172 WeakPolarHBondContact O-CA 2.96Å; L152-G173 PolarHBondContact N-O 3.37Å; L152-G173 PolarHBondContact O-N 3.26Å; L152-M175 HydrophobicContact CD1-CE 4.49Å; L152-M175 HydrophobicContact CD1-CG 3.22Å; L152-M175 HydrophobicContact CD1-SD 3.56Å; L152-M175 VanDerWaalsContact CD1-SD 3.56Å; L152-M175 HydrophobicContact CD2-SD 4.01Å; L152-M175 HydrophobicContact CG-CG 3.69Å; L152-M175 HydrophobicContact CG-SD 3.78Å; L152-Y287 HydrophobicContact CD1-CD1 3.52Å; L152-Y287 HydrophobicContact CD1-CE1 3.86Å; L152-Y287 HydrophobicContact CD1-CG 4.47Å; L152-F290 HydrophobicContact CB-CE1 3.91Å; L152-F290 HydrophobicContact CB-CE2 4.48Å; L152-F290 HydrophobicContact CB-CZ 3.88Å
153	F	94.4	Very high	87.5	Confident	23 Å²	23	56.5 Å²	56.5	10%	0.101	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	148.7	167.2	-59.8	-84.7	0	0	0	109.1	R171 V172 L238 L240 A253 T255 H291	F153-R171 CarbonylContact C-O 3.58Å; F153-R171 WeakPolarHBondContact CA-O 3.48Å; F153-V172 HydrophobicContact CD1-CG1 3.71Å; F153-V172 HydrophobicContact CE1-CG1 3.88Å; F153-L238 HydrophobicContact CD1-CD2 3.7Å; F153-L238 HydrophobicContact CE1-CD2 3.82Å; F153-L238 HydrophobicContact CE1-CG 4.22Å; F153-L240 HydrophobicContact CE1-CB 4.08Å; F153-L240 HydrophobicContact CE1-CD1 4.44Å; F153-L240 HydrophobicContact CZ-CB 3.9Å; F153-A253 HydrophobicContact CE2-CB 3.91Å; F153-A253 HydrophobicContact CZ-CB 4.07Å; F153-A253 WeakPolarHBondContact CZ-O 3.36Å; F153-T255 HydrophobicContact CB-CG2 3.62Å; F153-T255 HydrophobicContact CD1-CG2 3.65Å; F153-T255 HydrophobicContact CD2-CG2 3.85Å; F153-T255 HydrophobicContact CE1-CG2 4.25Å; F153-T255 HydrophobicContact CE2-CG2 4.42Å; F153-T255 HydrophobicContact CG-CG2 3.42Å; F153-T255 VanDerWaalsContact CG-CG2 3.42Å; F153-H291 PolarHBondContact O-CE1 3.4Å
154	S	94.7	Very high	87.6	Confident	2 Å²	2	63 Å²	63	1%	0.014	29%	0.287	C	S	.	.			trans	-58.4	149.3	171.8	43.1	0	0	0	0	110.4	Y156 R171 Y257 Y268	S154-Y156 VanDerWaalsContact C-N 3.34Å; S154-Y156 WeakPolarHBondContact CB-O 3.5Å; S154-Y156 PolarHBondContact OG-O 2.92Å; S154-R171 PolarHBondContact N-O 3.4Å; S154-R171 PolarHBondContact OG-N 3.19Å; S154-R171 VanDerWaalsContact OG-N 3.11Å; S154-R171 PolarHBondContact OG-O 3.4Å; S154-Y257 WeakPolarHBondContact O-CE1 3.47Å; S154-Y257 PolarHBondContact O-OH 3.04Å; S154-Y257 PolarHBondContact OG-OH 3.17Å; S154-Y268 PolarHBondContact OG-OH 3.36Å
155	E	93.9	Very high	88.3	Confident	102 Å²	102	65 Å²	65	48%	0.477	30%	0.296	S	S	.	.	S	Bend	trans	-69.5	-41.1	178.7	-174.8	175.3	-178	0	0	110.5	K15 H291	K15-E155 PolarHBondContact NZ-O 2.89Å; E155-H291 HydrophobicContact CB-CB 4.28Å; E155-H291 PolarHBondContact N-ND1 3.17Å; E155-H291 VanDerWaalsContact N-ND1 3.16Å
156	Y	95.5	Very high	89.2	Confident	84 Å²	84	59.4 Å²	59.4	33%	0.329	28%	0.275	S	S	.	.	S	Bend	trans	-111.3	141.6	178.5	-57.2	-80.6	0	0	0	111.1	S154 E261 L263 Y268	S154-Y156 VanDerWaalsContact C-N 3.34Å; S154-Y156 WeakPolarHBondContact CB-O 3.5Å; S154-Y156 PolarHBondContact OG-O 2.92Å; Y156-E261 VanDerWaalsContact CA-O 3.3Å; Y156-E261 WeakPolarHBondContact CA-O 3.46Å; Y156-L263 HydrophobicContact CD1-CD1 4.16Å; Y156-L263 HydrophobicContact CD1-CD2 4.35Å; Y156-L263 HydrophobicContact CD1-CG 4.12Å; Y156-L263 HydrophobicContact CD2-CD1 4.3Å; Y156-L263 HydrophobicContact CG-CD1 3.8Å; Y156-L263 HydrophobicContact CG-CG 4.17Å; Y156-Y268 PolarHBondContact O-OH 2.86Å
157	A	95.4	Very high	90	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	152.4	161.9	0	0	0	0	0	108.8	L168 V170 Y257 E261 I262 L263	A157-L168 HydrophobicContact CB-CD1 3.98Å; A157-V170 HydrophobicContact CB-CG2 3.8Å; A157-Y257 HydrophobicContact CB-CD1 3.69Å; A157-Y257 HydrophobicContact CB-CD2 4.41Å; A157-Y257 HydrophobicContact CB-CE1 4.03Å; A157-Y257 HydrophobicContact CB-CG 3.91Å; A157-E261 PolarHBondContact N-O 3.41Å; A157-I262 HydrophobicContact CB-CG1 4.23Å; A157-I262 CarbonylContact O-C 3.59Å; A157-I262 WeakPolarHBondContact O-CA 3.41Å; A157-L263 PolarHBondContact O-N 3.3Å
158	V	95.5	Very high	90.6	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138	-177.4	-55.7	0	0	0	0	111.5	L168 S169 L263 H266 Y268 T293	V158-L168 CarbonylContact O-C 3.53Å; V158-S169 PolarHBondContact N-O 2.95Å; V158-S169 PolarHBondContact O-N 3.3Å; V158-L263 CarbonylContact C-O 3.59Å; V158-L263 WeakPolarHBondContact CA-O 3.36Å; V158-L263 HydrophobicContact CG1-CB 4.36Å; V158-H266 HydrophobicContact CB-CB 4.12Å; V158-H266 WeakPolarHBondContact CB-O 3.26Å; V158-H266 HydrophobicContact CG1-CB 3.89Å; V158-H266 WeakPolarHBondContact CG2-O 3.48Å; V158-Y268 HydrophobicContact CG1-CE1 4.2Å; V158-Y268 HydrophobicContact CG1-CE2 4.44Å; V158-Y268 HydrophobicContact CG2-CD2 3.9Å; V158-Y268 HydrophobicContact CG2-CE2 3.55Å; V158-T293 HydrophobicContact CG1-CG2 3.6Å
159	I	94.9	Very high	91.3	Very high	3 Å²	3	53 Å²	53	2%	0.015	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.9	171.6	-64.3	174.7	0	0	0	108	L166 C167 L168 I215 I262 L263 W264 G265	I159-L166 HydrophobicContact CG2-CD2 4.41Å; I159-C167 WeakPolarHBondContact CA-O 3.44Å; I159-L168 HydrophobicContact CD1-CD1 4.19Å; I159-L168 HydrophobicContact CG1-CB 4.3Å; I159-L168 HydrophobicContact CG1-CD1 3.62Å; I159-I215 HydrophobicContact CD1-CD1 4.39Å; I159-I215 HydrophobicContact CG2-CD1 4.17Å; I159-I262 HydrophobicContact CD1-CG2 3.62Å; I159-I262 HydrophobicContact CG1-CG2 3.79Å; I159-L263 PolarHBondContact N-O 2.93Å; I159-W264 HydrophobicContact CB-CD2 4.33Å; I159-W264 HydrophobicContact CB-CE3 4.07Å; I159-W264 HydrophobicContact CD1-CE3 3.8Å; I159-W264 HydrophobicContact CD1-CZ3 3.91Å; I159-W264 HydrophobicContact CG2-CD2 4.07Å; I159-W264 HydrophobicContact CG2-CE3 3.85Å; I159-W264 HydrophobicContact CG2-CH2 4.22Å; I159-W264 HydrophobicContact CG2-CZ2 4.39Å; I159-W264 HydrophobicContact CG2-CZ3 3.94Å; I159-G265 WeakPolarHBondContact O-CA 3.35Å; I159-G265 PolarHBondContact O-N 3.23Å
160	A	93.4	Very high	91.9	Very high	5 Å²	5	45.7 Å²	45.7	4%	0.041	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.7	174.3	0	0	0	0	0	111.1	R162 C167 H266 R267	A160-R162 PolarHBondContact O-N 2.9Å; A160-C167 PolarHBondContact N-O 3.01Å; A160-C167 VanDerWaalsContact N-O 3.17Å; A160-C167 PolarHBondContact O-N 3.4Å; A160-H266 WeakPolarHBondContact CB-O 3.09Å; A160-R267 HydrophobicContact CB-CG 3.74Å
161	R	91.4	Very high	92.2	Very high	122 Å²	122	44.5 Å²	44.5	46%	0.46	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	129.4	172.1	-171.8	176.5	69.6	162.5	2.7	109.8	N165 L166 R267 T298 F306	R161-N165 CarbonylContact C-O 3.41Å; R161-N165 WeakPolarHBondContact CA-O 3.2Å; R161-L166 HydrophobicContact CB-CD2 4.48Å; R161-R267 PolarHBondContact O-NH2 3.38Å; R161-T298 HydrophobicContact CB-CG2 4.42Å; R161-F306 HydrophobicContact CG-CZ 4.39Å
162	R	87.5	Confident	92.3	Very high	100 Å²	100	44 Å²	44	38%	0.377	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	130.6	172.4	-179.7	176.5	-176.5	162.8	5.6	108.9	A160 R164 N165 C167 Y212	A160-R162 PolarHBondContact O-N 2.9Å; R162-R164 VanDerWaalsContact C-N 3.25Å; R162-R164 PolarHBondContact O-N 2.94Å; R162-R164 VanDerWaalsContact O-N 3.14Å; R162-N165 PolarHBondContact N-O 3.35Å; R162-N165 PolarHBondContact O-N 3.4Å; R162-C167 HydrophobicContact CB-CB 4.42Å; R162-Y212 VanDerWaalsContact NH1-CD1 3.28Å
163	D	83.8	Confident	92.2	Very high	129 Å²	129	42.2 Å²	42.2	69%	0.69	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	46.1	175.1	-52.4	-35.6	0	0	0	113.7	N165	D163-N165 PolarHBondContact O-N 3.46Å
164	R	84.7	Confident	92	Very high	214 Å²	214	41.2 Å²	41.2	81%	0.808	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.5	-1	-177.1	-51.4	179.4	-179.4	-176.9	-0.2	116.8	R162 F306	R162-R164 VanDerWaalsContact C-N 3.25Å; R162-R164 PolarHBondContact O-N 2.94Å; R162-R164 VanDerWaalsContact O-N 3.14Å; R164-F306 VanDerWaalsContact O-CE1 3.3Å; R164-F306 WeakPolarHBondContact O-CE1 3.44Å
165	N	88.6	Confident	91.6	Very high	81 Å²	81	46 Å²	46	43%	0.433	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	157	175.4	-62.6	-28.6	0	0	0	111.1	R161 R162 D163 V214	R161-N165 CarbonylContact C-O 3.41Å; R161-N165 WeakPolarHBondContact CA-O 3.2Å; R162-N165 PolarHBondContact N-O 3.35Å; R162-N165 PolarHBondContact O-N 3.4Å; D163-N165 PolarHBondContact O-N 3.46Å; N165-V214 HydrophobicContact CB-CG1 3.75Å
166	L	91.8	Very high	91.2	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	130.7	164.9	-76.2	173.5	0	0	0	108.1	I159 R161 I215 W264 T298 A303	I159-L166 HydrophobicContact CG2-CD2 4.41Å; R161-L166 HydrophobicContact CB-CD2 4.48Å; L166-I215 HydrophobicContact CB-CB 4.33Å; L166-I215 HydrophobicContact CB-CD1 4.21Å; L166-I215 VanDerWaalsContact O-CB 3.29Å; L166-I215 WeakPolarHBondContact O-CB 3.36Å; L166-I215 WeakPolarHBondContact O-CG1 3.4Å; L166-I215 PolarHBondContact O-N 3.28Å; L166-W264 HydrophobicContact CD1-CH2 4.01Å; L166-W264 HydrophobicContact CD1-CZ2 3.91Å; L166-W264 HydrophobicContact CD2-CZ2 4.35Å; L166-T298 HydrophobicContact CD2-CG2 3.73Å; L166-A303 HydrophobicContact CD1-CB 4.16Å
167	C	92.5	Very high	90.4	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.02	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.8	-179.4	-59.9	0	0	0	0	110.9	I159 A160 R162 Y212 H213	I159-C167 WeakPolarHBondContact CA-O 3.44Å; A160-C167 PolarHBondContact N-O 3.01Å; A160-C167 VanDerWaalsContact N-O 3.17Å; A160-C167 PolarHBondContact O-N 3.4Å; R162-C167 HydrophobicContact CB-CB 4.42Å; C167-Y212 HydrophobicContact CB-CD2 4.44Å; C167-H213 CarbonylContact C-O 3.48Å; C167-H213 WeakPolarHBondContact CA-O 3.5Å
168	L	93.6	Very high	89.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.7	166.4	175.5	70.3	0	0	0	108.3	A157 V158 I159 M187 Y212 H213 I215 L221 I236 I262	A157-L168 HydrophobicContact CB-CD1 3.98Å; V158-L168 CarbonylContact O-C 3.53Å; I159-L168 HydrophobicContact CD1-CD1 4.19Å; I159-L168 HydrophobicContact CG1-CB 4.3Å; I159-L168 HydrophobicContact CG1-CD1 3.62Å; L168-M187 HydrophobicContact CD2-CE 4.46Å; L168-M187 HydrophobicContact CD2-SD 3.71Å; L168-Y212 CarbonylContact O-C 3.58Å; L168-Y212 WeakPolarHBondContact O-CA 3.43Å; L168-H213 HydrophobicContact CB-CB 4.43Å; L168-H213 PolarHBondContact N-O 3.49Å; L168-H213 PolarHBondContact O-N 3.37Å; L168-I215 HydrophobicContact CB-CD1 4.46Å; L168-L221 HydrophobicContact CB-CD1 4.48Å; L168-L221 HydrophobicContact CD2-CD1 3.93Å; L168-I236 HydrophobicContact CD2-CD1 3.48Å; L168-I236 VanDerWaalsContact CD2-CD1 3.48Å; L168-I262 HydrophobicContact CD1-CG2 4.15Å
169	S	93.6	Very high	89.4	Confident	13 Å²	13	60.6 Å²	60.6	9%	0.091	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.7	-175.6	-55.8	0	0	0	0	111.5	V158 V211 Y212 Y268	V158-S169 PolarHBondContact N-O 2.95Å; V158-S169 PolarHBondContact O-N 3.3Å; S169-V211 CarbonylContact C-O 3.59Å; S169-V211 VanDerWaalsContact CA-O 3.3Å; S169-V211 WeakPolarHBondContact CA-O 3.05Å; S169-Y212 WeakPolarHBondContact OG-CB 3.47Å; S169-Y268 PolarHBondContact O-OH 3.14Å; S169-Y268 VanDerWaalsContact O-OH 3.11Å
170	V	94.5	Very high	89	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.6	175.7	175.7	0	0	0	0	109.3	A157 M187 I210 V211 L238 Y257 Y268	A157-V170 HydrophobicContact CB-CG2 3.8Å; V170-M187 HydrophobicContact CG2-CE 4.04Å; V170-I210 WeakPolarHBondContact O-CA 3.34Å; V170-V211 PolarHBondContact N-O 2.93Å; V170-V211 PolarHBondContact O-N 3.47Å; V170-V211 VanDerWaalsContact O-O 3.12Å; V170-L238 HydrophobicContact CB-CD2 4.06Å; V170-L238 HydrophobicContact CG1-CD2 3.43Å; V170-L238 VanDerWaalsContact CG1-CD2 3.43Å; V170-Y257 HydrophobicContact CG1-CE2 3.92Å; V170-Y257 WeakPolarHBondContact CG1-OH 3.33Å; V170-Y257 HydrophobicContact CG2-CD2 4.38Å; V170-Y257 HydrophobicContact CG2-CE2 3.83Å; V170-Y268 WeakPolarHBondContact CA-OH 3.47Å
171	R	93.3	Very high	88.8	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.2	175.2	-176.6	-178.7	-78.7	176.9	-15.4	110.3	F153 S154 P208 V209 I210 Y268 E269 F290	F153-R171 CarbonylContact C-O 3.58Å; F153-R171 WeakPolarHBondContact CA-O 3.48Å; S154-R171 PolarHBondContact N-O 3.4Å; S154-R171 PolarHBondContact OG-N 3.19Å; S154-R171 VanDerWaalsContact OG-N 3.11Å; S154-R171 PolarHBondContact OG-O 3.4Å; R171-P208 HydrophobicContact CG-CB 4.36Å; R171-V209 WeakPolarHBondContact CA-O 3.36Å; R171-I210 HydrophobicContact CB-CG1 4.48Å; R171-Y268 HydrophobicContact CB-CD1 4.31Å; R171-Y268 HydrophobicContact CB-CD2 4.33Å; R171-Y268 HydrophobicContact CB-CE1 4.14Å; R171-Y268 HydrophobicContact CB-CE2 4.12Å; R171-Y268 HydrophobicContact CB-CG 4.42Å; R171-Y268 VanDerWaalsContact CZ-CB 3.46Å; R171-Y268 PolarHBondContact N-OH 3.11Å; R171-E269 PolarHBondContact NH1-O 3.39Å; R171-E269 PolarHBondContact NH2-O 3.41Å; R171-F290 HydrophobicContact CB-CZ 4.46Å; R171-F290 WeakPolarHBondContact CD-O 3.39Å; R171-F290 HydrophobicContact CG-CD2 4.44Å; R171-F290 HydrophobicContact CG-CE1 4.34Å; R171-F290 HydrophobicContact CG-CE2 3.83Å; R171-F290 HydrophobicContact CG-CZ 3.77Å; R171-F290 PolarHBondContact NH1-O 3.35Å
172	V	93.1	Very high	88.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.7	175.8	-62.2	0	0	0	0	110.1	L152 F153 I185 L205 P208 V209 V211 L238 L240	L152-V172 CarbonylContact O-C 3.51Å; L152-V172 WeakPolarHBondContact O-CA 2.96Å; F153-V172 HydrophobicContact CD1-CG1 3.71Å; F153-V172 HydrophobicContact CE1-CG1 3.88Å; V172-I185 HydrophobicContact CG2-CD1 3.92Å; V172-L205 HydrophobicContact CG2-CD1 4.07Å; V172-P208 CarbonylContact O-C 3.51Å; V172-P208 WeakPolarHBondContact O-CA 3.22Å; V172-V209 HydrophobicContact CG2-CB 4.39Å; V172-V209 WeakPolarHBondContact CG2-O 3.2Å; V172-V209 PolarHBondContact N-O 2.89Å; V172-V209 PolarHBondContact O-N 3.46Å; V172-V211 HydrophobicContact CG2-CG2 3.94Å; V172-L238 HydrophobicContact CG1-CD2 3.99Å; V172-L240 HydrophobicContact CB-CD1 4.21Å; V172-L240 HydrophobicContact CG1-CD1 4.42Å
173	G	91	Very high	88.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	159.3	176.2	0	0	0	0	0	113.4	L152	L152-G173 PolarHBondContact N-O 3.37Å; L152-G173 PolarHBondContact O-N 3.26Å
174	D	90.5	Very high	89.2	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.011	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.7	173.1	-176.4	-2.8	0	0	0	109.1	R147 L151 R176 K179 L205 Y287	R147-D174 IonicContact CZ-OD1 3.85Å; R147-D174 IonicContact CZ-OD2 3.34Å; R147-D174 IonicContact NH1-OD1 2.77Å; R147-D174 PolarHBondContact NH1-OD1 2.91Å; R147-D174 IonicContact NH1-OD2 2.77Å; R147-D174 PolarHBondContact NH1-OD2 3.48Å; R147-D174 IonicContact NH2-OD1 3.93Å; R147-D174 IonicContact NH2-OD2 2.82Å; R147-D174 PolarHBondContact NH2-OD2 2.85Å; L151-D174 HydrophobicContact CD2-CB 3.95Å; D174-R176 VanDerWaalsContact C-N 3.34Å; D174-R176 PolarHBondContact OD1-N 3.2Å; D174-K179 PolarHBondContact O-NZ 2.88Å; D174-L205 HydrophobicContact CB-CD2 4.33Å; D174-Y287 PolarHBondContact O-OH 2.62Å
175	M	86.2	Confident	89.6	Confident	102 Å²	102	44.2 Å²	44.2	50%	0.502	20%	0.204	S	C	.	.			trans	-75	-20.3	178.4	-65	-177.6	75.6	0	0	113.6	T150 L152 Y287	T150-M175 PolarHBondContact O-N 2.74Å; L152-M175 HydrophobicContact CD1-CE 4.49Å; L152-M175 HydrophobicContact CD1-CG 3.22Å; L152-M175 HydrophobicContact CD1-SD 3.56Å; L152-M175 VanDerWaalsContact CD1-SD 3.56Å; L152-M175 HydrophobicContact CD2-SD 4.01Å; L152-M175 HydrophobicContact CG-CG 3.69Å; L152-M175 HydrophobicContact CG-SD 3.78Å; M175-Y287 HydrophobicContact CG-CD1 4.49Å; M175-Y287 HydrophobicContact CG-CE1 4.22Å
176	R	85	Confident	89.7	Confident	110 Å²	110	43.8 Å²	43.8	42%	0.415	20%	0.2	S	C	.	.	S	Bend	trans	-80.2	160.1	-174.5	-67.8	-159.7	-169.1	-172.4	-6.7	112.6	R147 T150 D174 K179	R147-R176 VanDerWaalsContact NH1-CB 3.34Å; T150-R176 HydrophobicContact CG2-CG 4.15Å; T150-R176 PolarHBondContact OG1-NE 3.41Å; D174-R176 VanDerWaalsContact C-N 3.34Å; D174-R176 PolarHBondContact OD1-N 3.2Å; R176-K179 WeakPolarHBondContact O-CE 3.45Å; R176-K179 PolarHBondContact O-NZ 3.44Å
177	K	79.2	Confident	89.6	Confident	183 Å²	183	44 Å²	44	80%	0.796	20%	0.201	S	C	*	.	S	Bend	trans	-64.6	-50.7	172.8	-174.5	-179.4	-178.8	-177.9	0	111.4
178	Y	83.6	Confident	89.5	Confident	160 Å²	160	47.4 Å²	47.4	63%	0.627	22%	0.217	S	C	*	.	S	Bend	trans	-76.7	127.2	173.3	-58.4	-75.3	0	0	0	109	R147	R147-Y178 PolarHBondContact NH2-O 3.47Å
179	K	85.9	Confident	89.3	Confident	42 Å²	42	47.4 Å²	47.4	18%	0.183	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-93.7	163.7	-170.2	-56.8	-57.7	-175	178.7	0	111.2	D174 R176 M204 A206 S245	D174-K179 PolarHBondContact O-NZ 2.88Å; R176-K179 WeakPolarHBondContact O-CE 3.45Å; R176-K179 PolarHBondContact O-NZ 3.44Å; K179-M204 HydrophobicContact CB-CG 3.9Å; K179-M204 HydrophobicContact CB-SD 4.02Å; K179-A206 WeakPolarHBondContact CE-O 3.42Å; K179-A206 HydrophobicContact CG-CB 4.38Å; K179-A206 PolarHBondContact NZ-O 3.45Å; K179-S245 PolarHBondContact O-OG 2.9Å; K179-S245 VanDerWaalsContact O-OG 3.06Å
180	L	86.9	Confident	88.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133	174.5	-159.4	71.3	0	0	0	109.7	L151 V183 M204 L205 L240 L243 I244 T251	L151-L180 HydrophobicContact CD1-CD2 4.31Å; L151-L180 HydrophobicContact CD2-CD2 4.41Å; L180-V183 HydrophobicContact CB-CG2 3.8Å; L180-V183 HydrophobicContact CD2-CG1 4.49Å; L180-V183 HydrophobicContact CD2-CG2 3.78Å; L180-V183 HydrophobicContact CG-CG2 3.83Å; L180-V183 WeakPolarHBondContact O-CG2 3.27Å; L180-M204 WeakPolarHBondContact O-CA 3.25Å; L180-L205 PolarHBondContact O-N 3.03Å; L180-L240 HydrophobicContact CD2-CD2 3.46Å; L180-L240 VanDerWaalsContact CD2-CD2 3.46Å; L180-L243 VanDerWaalsContact CD1-C 3.49Å; L180-L243 VanDerWaalsContact CD1-O 3.22Å; L180-L243 WeakPolarHBondContact CD1-O 3.3Å; L180-I244 HydrophobicContact CD1-CG1 4.3Å; L180-T251 HydrophobicContact CD1-CG2 3.41Å; L180-T251 VanDerWaalsContact CD1-CG2 3.41Å; L180-T251 HydrophobicContact CD2-CG2 4.19Å; L180-T251 HydrophobicContact CG-CG2 4.47Å
181	A	88.6	Confident	88	Confident	25 Å²	25	55 Å²	55	21%	0.207	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	157.1	177.2	0	0	0	0	0	110.9	V183 P203 L243	A181-V183 VanDerWaalsContact C-N 3.33Å; A181-V183 PolarHBondContact O-N 3.44Å; A181-P203 WeakPolarHBondContact CA-O 3.36Å; A181-L243 PolarHBondContact N-O 2.85Å; A181-L243 PolarHBondContact O-N 2.99Å
182	N	88.7	Confident	86.5	Confident	102 Å²	102	63.3 Å²	63.3	55%	0.545	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.4	53.3	179	-67.1	-7	0	0	0	112.4	K184 P203 L243	N182-K184 PolarHBondContact O-N 3.32Å; N182-P203 PolarHBondContact N-O 3.17Å; N182-L243 HydrophobicContact CB-CD1 4.16Å; N182-L243 HydrophobicContact CB-CG 4.43Å
183	V	91.1	Very high	84.8	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	122.5	-175.4	-176	0	0	0	0	109.4	L180 A181 I185 L202 L205 L240 D241	L180-V183 HydrophobicContact CB-CG2 3.8Å; L180-V183 HydrophobicContact CD2-CG1 4.49Å; L180-V183 HydrophobicContact CD2-CG2 3.78Å; L180-V183 HydrophobicContact CG-CG2 3.83Å; L180-V183 WeakPolarHBondContact O-CG2 3.27Å; A181-V183 VanDerWaalsContact C-N 3.33Å; A181-V183 PolarHBondContact O-N 3.44Å; V183-I185 HydrophobicContact CG1-CD1 4.3Å; V183-I185 HydrophobicContact CG1-CG1 4.05Å; V183-L202 HydrophobicContact CB-CB 4.23Å; V183-L202 PolarHBondContact N-O 2.95Å; V183-L202 PolarHBondContact O-N 2.93Å; V183-L205 HydrophobicContact CG2-CB 3.93Å; V183-L240 HydrophobicContact CG1-CD1 4.15Å; V183-L240 HydrophobicContact CG1-CD2 3.77Å; V183-L240 HydrophobicContact CG1-CG 3.73Å; V183-D241 CarbonylContact C-O 3.52Å; V183-D241 VanDerWaalsContact CA-O 3.25Å; V183-D241 WeakPolarHBondContact CA-O 3.37Å
184	K	91.7	Very high	83.4	Confident	102 Å²	102	75.6 Å²	75.6	44%	0.443	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.6	173.3	-57.3	-168.4	172.9	-176.6	0	108.9	N182 D201 L240 D241	N182-K184 PolarHBondContact O-N 3.32Å; K184-D201 WeakPolarHBondContact CG-OD1 3.31Å; K184-L240 WeakPolarHBondContact O-CA 3.44Å; K184-D241 HydrophobicContact CB-CB 4.44Å; K184-D241 PolarHBondContact N-O 3.11Å; K184-D241 PolarHBondContact O-N 2.99Å
185	I	91.6	Very high	82	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.6	-177.6	-57.7	179.5	0	0	0	107.8	V172 V183 L199 K200 L202 V211 L238 T239 L240	V172-I185 HydrophobicContact CG2-CD1 3.92Å; V183-I185 HydrophobicContact CG1-CD1 4.3Å; V183-I185 HydrophobicContact CG1-CG1 4.05Å; I185-L199 WeakPolarHBondContact O-CA 3.22Å; I185-K200 PolarHBondContact N-O 3.18Å; I185-K200 PolarHBondContact O-N 3.01Å; I185-L202 HydrophobicContact CD1-CD1 3.71Å; I185-L202 HydrophobicContact CG1-CD1 4.45Å; I185-V211 HydrophobicContact CD1-CG2 3.42Å; I185-V211 VanDerWaalsContact CD1-CG2 3.42Å; I185-V211 HydrophobicContact CG2-CG1 4.19Å; I185-V211 HydrophobicContact CG2-CG2 4.33Å; I185-L238 HydrophobicContact CG2-CD1 3.4Å; I185-L238 VanDerWaalsContact CG2-CD1 3.4Å; I185-L238 HydrophobicContact CG2-CG 4.17Å; I185-T239 WeakPolarHBondContact CA-O 3.42Å; I185-L240 HydrophobicContact CD1-CD1 4.43Å; I185-L240 HydrophobicContact CG1-CG 4.21Å
186	H	90.8	Very high	80.8	Confident	71 Å²	71	76.7 Å²	76.7	33%	0.329	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.9	-178.6	-62.5	-81.9	0	0	0	109.4	L199 L238 T239 D241	H186-L199 WeakPolarHBondContact CE1-CD1 3.32Å; H186-L238 WeakPolarHBondContact O-CA 3.2Å; H186-T239 PolarHBondContact N-O 3.47Å; H186-T239 PolarHBondContact O-N 3.24Å; H186-D241 IonicContact CD2-OD2 2.77Å
187	M	90.9	Very high	79.5	Confident	7 Å²	7	77.1 Å²	77.1	3%	0.034	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	143.8	175.5	-163.8	175.4	-74.5	0	0	109.4	L168 V170 I196 H213 I236 I237 L238	L168-M187 HydrophobicContact CD2-CE 4.46Å; L168-M187 HydrophobicContact CD2-SD 3.71Å; V170-M187 HydrophobicContact CG2-CE 4.04Å; M187-I196 CarbonylContact C-O 3.5Å; M187-I196 HydrophobicContact CB-CB 4.46Å; M187-I196 HydrophobicContact CG-CB 4.49Å; M187-I196 CarbonylContact O-C 3.53Å; M187-I196 HydrophobicContact SD-CG2 4.41Å; M187-H213 HydrophobicContact SD-CB 4.48Å; M187-I236 HydrophobicContact CG-CG2 3.44Å; M187-I236 VanDerWaalsContact CG-CG2 3.44Å; M187-I236 HydrophobicContact SD-CG2 3.7Å; M187-I237 CarbonylContact C-O 3.55Å; M187-I237 WeakPolarHBondContact CA-O 3.08Å; M187-L238 HydrophobicContact CB-CD1 4.17Å; M187-L238 HydrophobicContact CE-CD1 3.76Å; M187-L238 HydrophobicContact CG-CD1 4.38Å
188	M	89.3	Confident	78.4	Confident	74 Å²	74	69 Å²	69	37%	0.365	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	137.5	179.8	-169.4	-170.3	-169.1	0	0	109.6	I236 I237	M188-I236 CarbonylContact O-C 3.56Å; M188-I236 WeakPolarHBondContact O-CA 3.36Å; M188-I237 PolarHBondContact N-O 3.08Å; M188-I237 PolarHBondContact O-N 3.2Å
189	M	89.7	Confident	77.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.3	177.2	-175.4	-174.2	-177.6	0	0	111.3	Y191 A194 I196 P220 L221 F224 F234 I236	M189-Y191 HydrophobicContact CE-CD1 4.37Å; M189-Y191 HydrophobicContact CE-CG 4.45Å; M189-Y191 PolarHBondContact O-N 3.45Å; M189-A194 CarbonylContact C-O 3.47Å; M189-A194 PolarHBondContact N-O 2.82Å; M189-A194 PolarHBondContact O-N 3.49Å; M189-I196 HydrophobicContact CB-CD1 3.58Å; M189-I196 HydrophobicContact CB-CG1 3.75Å; M189-I196 HydrophobicContact CG-CD1 4.35Å; M189-I196 HydrophobicContact SD-CD1 4.16Å; M189-P220 HydrophobicContact CB-CG 4.3Å; M189-P220 HydrophobicContact SD-CB 3.59Å; M189-P220 VanDerWaalsContact SD-CB 3.59Å; M189-P220 HydrophobicContact SD-CG 3.44Å; M189-P220 WeakPolarHBondContact SD-CG 3.43Å; M189-L221 HydrophobicContact CE-CD2 3.71Å; M189-L221 HydrophobicContact SD-CD2 4.08Å; M189-L221 HydrophobicContact SD-CG 4.31Å; M189-F224 HydrophobicContact CE-CE2 4.19Å; M189-F224 HydrophobicContact CE-CZ 4.34Å; M189-F234 HydrophobicContact CE-CB 3.51Å; M189-F234 HydrophobicContact CE-CD1 3.34Å; M189-F234 HydrophobicContact CE-CD2 3.67Å; M189-F234 HydrophobicContact CE-CE1 3.88Å; M189-F234 HydrophobicContact CE-CE2 4.17Å; M189-F234 HydrophobicContact CE-CG 3.23Å; M189-F234 HydrophobicContact CE-CZ 4.27Å; M189-F234 HydrophobicContact CG-CB 4.16Å; M189-F234 HydrophobicContact CG-CD2 4.24Å; M189-F234 HydrophobicContact CG-CG 4.39Å; M189-I236 HydrophobicContact CG-CG1 4.37Å
190	I	86.1	Confident	76.6	Confident	58 Å²	58	67.3 Å²	67.3	30%	0.297	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	89.7	174.8	-54.4	-174.1	0	0	0	107.6	L12 F234 E235 I237	L12-I190 HydrophobicContact CD2-CD1 3.27Å; I190-F234 VanDerWaalsContact O-CA 3.31Å; I190-F234 WeakPolarHBondContact O-CA 3.42Å; I190-E235 HydrophobicContact CB-CB 4.49Å; I190-E235 PolarHBondContact N-O 2.85Å; I190-E235 PolarHBondContact O-N 3.43Å; I190-E235 VanDerWaalsContact O-N 3.07Å; I190-I237 HydrophobicContact CD1-CD1 3.45Å; I190-I237 VanDerWaalsContact CD1-CD1 3.45Å; I190-I237 HydrophobicContact CD1-CG1 4.19Å; I190-I237 HydrophobicContact CG1-CD1 4.34Å
191	Y	74.6	Confident	76.2	Confident	115 Å²	115	71.9 Å²	71.9	45%	0.451	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-38.6	167.2	-173.4	-140.9	0	0	0	111.5	M189 F224 R233 F234	M189-Y191 HydrophobicContact CE-CD1 4.37Å; M189-Y191 HydrophobicContact CE-CG 4.45Å; M189-Y191 PolarHBondContact O-N 3.45Å; Y191-F224 HydrophobicContact CE1-CZ 4.16Å; Y191-R233 WeakPolarHBondContact CD2-O 3.1Å; Y191-R233 HydrophobicContact CE2-CB 4.38Å; Y191-R233 VanDerWaalsContact CE2-O 3.32Å; Y191-R233 WeakPolarHBondContact CE2-O 3.37Å; Y191-F234 HydrophobicContact CD2-CB 4.17Å; Y191-F234 HydrophobicContact CG-CB 4.02Å
192	K	61.4	Low	75.8	Confident	176 Å²	176	71.8 Å²	71.8	77%	0.765	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.3	29.7	176.6	-69.1	-174.9	175.1	176.8	0	111.8
193	R	58.5	Low	75.4	Confident	228 Å²	228	72 Å²	72	86%	0.86	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	58.8	-164.2	-64.7	-179	-177.6	170.3	0.8	111.8
194	A	60.9	Low	75	Confident	31 Å²	31	77 Å²	77	26%	0.256	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.6	171.1	0	0	0	0	0	108.8	M189 P220	M189-A194 CarbonylContact C-O 3.47Å; M189-A194 PolarHBondContact N-O 2.82Å; M189-A194 PolarHBondContact O-N 3.49Å; A194-P220 HydrophobicContact CB-CB 4.02Å; A194-P220 HydrophobicContact CB-CG 4.2Å
195	Q	62	Low	74.8	Confident	124 Å²	124	72.1 Å²	72.1	58%	0.579	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	129.9	172.6	-170.9	165.6	-42.7	0	0	108.3	D197	Q195-D197 WeakPolarHBondContact CG-OD1 3.46Å; Q195-D197 PolarHBondContact NE2-OD1 2.88Å
196	I	60.3	Low	74.4	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.015	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	97.4	170.4	-63.6	-174.2	0	0	0	105.4	M187 M189 G198 H213 P220 L221	M187-I196 CarbonylContact C-O 3.5Å; M187-I196 HydrophobicContact CB-CB 4.46Å; M187-I196 HydrophobicContact CG-CB 4.49Å; M187-I196 CarbonylContact O-C 3.53Å; M187-I196 HydrophobicContact SD-CG2 4.41Å; M189-I196 HydrophobicContact CB-CD1 3.58Å; M189-I196 HydrophobicContact CB-CG1 3.75Å; M189-I196 HydrophobicContact CG-CD1 4.35Å; M189-I196 HydrophobicContact SD-CD1 4.16Å; I196-G198 PolarHBondContact O-N 2.98Å; I196-H213 HydrophobicContact CG2-CB 4.26Å; I196-H213 VanDerWaalsContact CG2-CE1 3.46Å; I196-H213 WeakPolarHBondContact CG2-CE1 3.46Å; I196-H213 VanDerWaalsContact CG2-ND1 3.33Å; I196-H213 WeakPolarHBondContact CG2-ND1 3.5Å; I196-P220 HydrophobicContact CD1-CG 3.77Å; I196-P220 HydrophobicContact CG1-CG 3.48Å; I196-P220 VanDerWaalsContact CG1-CG 3.48Å; I196-L221 HydrophobicContact CD1-CD1 4.41Å
197	D	56.9	Low	74.2	Confident	118 Å²	118	77 Å²	77	63%	0.631	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	80.1	178.7	-82.5	-24.8	0	0	0	111.4	Q195	Q195-D197 WeakPolarHBondContact CG-OD1 3.46Å; Q195-D197 PolarHBondContact NE2-OD1 2.88Å
198	G	56	Low	74.2	Confident	14 Å²	14	76.9 Å²	76.9	14%	0.144	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	55.8	168.6	0	0	0	0	0	110.4	I196 K200	I196-G198 PolarHBondContact O-N 2.98Å; G198-K200 PolarHBondContact O-N 2.75Å
199	L	60.7	Low	74.2	Confident	98 Å²	98	74.3 Å²	74.3	51%	0.513	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	108.6	177.8	-172.6	72.1	0	0	0	109.4	I185 H186	I185-L199 WeakPolarHBondContact O-CA 3.22Å; H186-L199 WeakPolarHBondContact CE1-CD1 3.32Å
200	K	72.2	Confident	74.3	Confident	68 Å²	68	76.4 Å²	76.4	30%	0.296	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	109	167.7	-165.9	171.5	-178.2	173.2	0	109.6	I185 G198 L202 V211	I185-K200 PolarHBondContact N-O 3.18Å; I185-K200 PolarHBondContact O-N 3.01Å; G198-K200 PolarHBondContact O-N 2.75Å; K200-L202 HydrophobicContact CB-CD1 4.38Å; K200-L202 HydrophobicContact CD-CD1 4.07Å; K200-L202 HydrophobicContact CG-CD1 3.87Å; K200-L202 HydrophobicContact CG-CG 4.21Å; K200-V211 HydrophobicContact CB-CG1 4.34Å; K200-V211 HydrophobicContact CD-CG1 4.44Å; K200-V211 HydrophobicContact CD-CG2 4.48Å
201	D	78.8	Confident	74.5	Confident	95 Å²	95	73.9 Å²	73.9	51%	0.508	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	118.7	170.8	-74.2	-4.7	0	0	0	108.9	K184	K184-D201 WeakPolarHBondContact CG-OD1 3.31Å
202	L	80	Confident	75.3	Confident	24 Å²	24	72.5 Å²	72.5	13%	0.126	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127	175.8	-71.7	122.4	0	0	0	108.8	V183 I185 K200 M204 V209	V183-L202 HydrophobicContact CB-CB 4.23Å; V183-L202 PolarHBondContact N-O 2.95Å; V183-L202 PolarHBondContact O-N 2.93Å; I185-L202 HydrophobicContact CD1-CD1 3.71Å; I185-L202 HydrophobicContact CG1-CD1 4.45Å; K200-L202 HydrophobicContact CB-CD1 4.38Å; K200-L202 HydrophobicContact CD-CD1 4.07Å; K200-L202 HydrophobicContact CG-CD1 3.87Å; K200-L202 HydrophobicContact CG-CG 4.21Å; L202-M204 PolarHBondContact O-N 3.29Å; L202-V209 HydrophobicContact CD2-CG1 4.04Å; L202-V209 HydrophobicContact CD2-CG2 4.15Å
203	P	79.6	Confident	76.7	Confident	107 Å²	107	65 Å²	65	70%	0.695	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	-35.5	178.7	24.3	-33.2	0	0	0	111.6	A181 N182	A181-P203 WeakPolarHBondContact CA-O 3.36Å; N182-P203 PolarHBondContact N-O 3.17Å
204	M	83.8	Confident	78.3	Confident	104 Å²	104	56.3 Å²	56.3	51%	0.512	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	137	178.4	-177.7	172.2	54.2	0	0	111.6	K179 L180 L202 A206	K179-M204 HydrophobicContact CB-CG 3.9Å; K179-M204 HydrophobicContact CB-SD 4.02Å; L180-M204 WeakPolarHBondContact O-CA 3.25Å; L202-M204 PolarHBondContact O-N 3.29Å; M204-A206 HydrophobicContact CE-CB 3.96Å; M204-A206 HydrophobicContact CG-CB 4.25Å; M204-A206 PolarHBondContact O-N 3.5Å; M204-A206 HydrophobicContact SD-CB 4.41Å
205	L	86.2	Confident	79.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	75.3	172.2	-173	65.5	0	0	0	110.4	V172 D174 L180 V183 W207 V209 L240	V172-L205 HydrophobicContact CG2-CD1 4.07Å; D174-L205 HydrophobicContact CB-CD2 4.33Å; L180-L205 PolarHBondContact O-N 3.03Å; V183-L205 HydrophobicContact CG2-CB 3.93Å; L205-W207 WeakPolarHBondContact CD1-O 3.49Å; L205-V209 HydrophobicContact CD1-CB 4.05Å; L205-V209 HydrophobicContact CD1-CG2 3.9Å; L205-L240 HydrophobicContact CD2-CD1 4.11Å
206	A	84.3	Confident	81	Confident	24 Å²	24	52.7 Å²	52.7	20%	0.198	27%	0.273	C	S	.	.			trans	-81.6	-33.5	-175.7	0	0	0	0	0	114.3	K179 M204	K179-A206 WeakPolarHBondContact CE-O 3.42Å; K179-A206 HydrophobicContact CG-CB 4.38Å; K179-A206 PolarHBondContact NZ-O 3.45Å; M204-A206 HydrophobicContact CE-CB 3.96Å; M204-A206 HydrophobicContact CG-CB 4.25Å; M204-A206 PolarHBondContact O-N 3.5Å; M204-A206 HydrophobicContact SD-CB 4.41Å
207	W	86.6	Confident	82.3	Confident	149 Å²	149	55.8 Å²	55.8	56%	0.564	30%	0.298	S	S	*	.	S	Bend	trans	-133	167.2	175.4	56.9	90	0	0	0	109.7	L205 V209 L285	L205-W207 WeakPolarHBondContact CD1-O 3.49Å; W207-V209 PolarHBondContact O-N 3.04Å; W207-L285 HydrophobicContact CB-CD1 4.43Å
208	P	90.1	Very high	83.7	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.032	31%	0.307	C	S	.	.			trans	-55.1	120.7	173.2	-31.8	40	0	0	0	112.6	R171 V172 L273 L285 Y287 F290	R171-P208 HydrophobicContact CG-CB 4.36Å; V172-P208 CarbonylContact O-C 3.51Å; V172-P208 WeakPolarHBondContact O-CA 3.22Å; P208-L273 HydrophobicContact CB-CD2 3.79Å; P208-L273 HydrophobicContact CG-CD2 3.93Å; P208-L285 HydrophobicContact CG-CD2 4.35Å; P208-Y287 HydrophobicContact CG-CE1 4.47Å; P208-F290 HydrophobicContact CB-CD2 4.12Å; P208-F290 HydrophobicContact CB-CE2 3.74Å; P208-F290 HydrophobicContact CG-CD2 4.02Å; P208-F290 HydrophobicContact CG-CE2 3.89Å
209	V	90.4	Very high	85.3	Confident	19 Å²	19	57 Å²	57	12%	0.115	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	142.2	179.6	174.1	0	0	0	0	109.4	R171 V172 L202 L205 W207	R171-V209 WeakPolarHBondContact CA-O 3.36Å; V172-V209 HydrophobicContact CG2-CB 4.39Å; V172-V209 WeakPolarHBondContact CG2-O 3.2Å; V172-V209 PolarHBondContact N-O 2.89Å; V172-V209 PolarHBondContact O-N 3.46Å; L202-V209 HydrophobicContact CD2-CG1 4.04Å; L202-V209 HydrophobicContact CD2-CG2 4.15Å; L205-V209 HydrophobicContact CD1-CB 4.05Å; L205-V209 HydrophobicContact CD1-CG2 3.9Å; W207-V209 PolarHBondContact O-N 3.04Å
210	I	91.1	Very high	86.6	Confident	45 Å²	45	54.1 Å²	54.1	23%	0.231	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.7	168.7	-57.9	168.6	0	0	0	107.5	V170 R171 Y268	V170-I210 WeakPolarHBondContact O-CA 3.34Å; R171-I210 HydrophobicContact CB-CG1 4.48Å; I210-Y268 HydrophobicContact CD1-CD2 3.95Å; I210-Y268 HydrophobicContact CD1-CG 4.41Å; I210-Y268 HydrophobicContact CG1-CD2 4.04Å; I210-Y268 HydrophobicContact CG2-CD2 4.12Å; I210-Y268 HydrophobicContact CG2-CE2 4.29Å
211	V	90.8	Very high	87.4	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.024	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.7	168.2	-176	0	0	0	0	106.6	S169 V170 V172 I185 K200	S169-V211 CarbonylContact C-O 3.59Å; S169-V211 VanDerWaalsContact CA-O 3.3Å; S169-V211 WeakPolarHBondContact CA-O 3.05Å; V170-V211 PolarHBondContact N-O 2.93Å; V170-V211 PolarHBondContact O-N 3.47Å; V170-V211 VanDerWaalsContact O-O 3.12Å; V172-V211 HydrophobicContact CG2-CG2 3.94Å; I185-V211 HydrophobicContact CD1-CG2 3.42Å; I185-V211 VanDerWaalsContact CD1-CG2 3.42Å; I185-V211 HydrophobicContact CG2-CG1 4.19Å; I185-V211 HydrophobicContact CG2-CG2 4.33Å; K200-V211 HydrophobicContact CB-CG1 4.34Å; K200-V211 HydrophobicContact CD-CG1 4.44Å; K200-V211 HydrophobicContact CD-CG2 4.48Å
212	Y	90.6	Very high	87.9	Confident	86 Å²	86	49 Å²	49	34%	0.337	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	143.6	177.6	60.4	-88.8	0	0	0	110.4	R162 C167 L168 S169 V214	R162-Y212 VanDerWaalsContact NH1-CD1 3.28Å; C167-Y212 HydrophobicContact CB-CD2 4.44Å; L168-Y212 CarbonylContact O-C 3.58Å; L168-Y212 WeakPolarHBondContact O-CA 3.43Å; S169-Y212 WeakPolarHBondContact OG-CB 3.47Å; Y212-V214 HydrophobicContact CD2-CG2 4.4Å; Y212-V214 HydrophobicContact CE2-CG2 4.38Å
213	H	91.1	Very high	88.4	Confident	19 Å²	19	53.4 Å²	53.4	9%	0.088	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.7	171.7	178.2	64.9	0	0	0	108.3	C167 L168 M187 I196 S219	C167-H213 CarbonylContact C-O 3.48Å; C167-H213 WeakPolarHBondContact CA-O 3.5Å; L168-H213 HydrophobicContact CB-CB 4.43Å; L168-H213 PolarHBondContact N-O 3.49Å; L168-H213 PolarHBondContact O-N 3.37Å; M187-H213 HydrophobicContact SD-CB 4.48Å; I196-H213 HydrophobicContact CG2-CB 4.26Å; I196-H213 VanDerWaalsContact CG2-CE1 3.46Å; I196-H213 WeakPolarHBondContact CG2-CE1 3.46Å; I196-H213 VanDerWaalsContact CG2-ND1 3.33Å; I196-H213 WeakPolarHBondContact CG2-ND1 3.5Å; H213-S219 WeakPolarHBondContact NE2-CB 3.48Å; H213-S219 PolarHBondContact NE2-OG 2.97Å; H213-S219 VanDerWaalsContact NE2-OG 3.11Å
214	V	91.1	Very high	88.9	Confident	45 Å²	45	49.7 Å²	49.7	27%	0.273	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	123.5	175.5	-179.7	0	0	0	0	108	N165 Y212 D216	N165-V214 HydrophobicContact CB-CG1 3.75Å; Y212-V214 HydrophobicContact CD2-CG2 4.4Å; Y212-V214 HydrophobicContact CE2-CG2 4.38Å; V214-D216 VanDerWaalsContact C-N 3.29Å; V214-D216 PolarHBondContact O-N 3.23Å
215	I	91.4	Very high	89.2	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.051	25%	0.246	C	C	.	.			trans	-82.6	81.8	178.3	-53	174.6	0	0	0	107.8	I159 L166 L168 L221 A303	I159-I215 HydrophobicContact CD1-CD1 4.39Å; I159-I215 HydrophobicContact CG2-CD1 4.17Å; L166-I215 HydrophobicContact CB-CB 4.33Å; L166-I215 HydrophobicContact CB-CD1 4.21Å; L166-I215 VanDerWaalsContact O-CB 3.29Å; L166-I215 WeakPolarHBondContact O-CB 3.36Å; L166-I215 WeakPolarHBondContact O-CG1 3.4Å; L166-I215 PolarHBondContact O-N 3.28Å; L168-I215 HydrophobicContact CB-CD1 4.46Å; I215-L221 HydrophobicContact CD1-CB 4.29Å; I215-L221 HydrophobicContact CD1-CD1 4.43Å; I215-L221 HydrophobicContact CG1-CB 4.39Å; I215-L221 HydrophobicContact CG2-CB 3.89Å; I215-A303 HydrophobicContact CB-CB 4.22Å; I215-A303 HydrophobicContact CG2-CB 3.64Å; I215-A303 WeakPolarHBondContact O-CB 3.35Å
216	D	88.4	Confident	89.5	Confident	70 Å²	70	49 Å²	49	37%	0.374	25%	0.251	S	S	.	.			trans	-93.3	-175.1	173.1	57.3	14	0	0	0	111.6	V214 D218 S219 Y222	V214-D216 VanDerWaalsContact C-N 3.29Å; V214-D216 PolarHBondContact O-N 3.23Å; D216-D218 PolarHBondContact O-N 2.96Å; D216-D218 PolarHBondContact OD1-N 3.36Å; D216-S219 VanDerWaalsContact O-CB 3.23Å; D216-S219 WeakPolarHBondContact O-CB 3.37Å; D216-S219 PolarHBondContact O-N 3.42Å; D216-S219 VanDerWaalsContact O-N 3.1Å; D216-S219 PolarHBondContact OD1-N 2.96Å; D216-Y222 WeakPolarHBondContact O-CB 3.24Å; D216-Y222 WeakPolarHBondContact O-CD2 3.3Å
217	A	88.8	Confident	89.7	Confident	67 Å²	67	51.2 Å²	51.2	55%	0.554	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.1	-178	0	0	0	0	0	113.8	S219 Y222	A217-S219 VanDerWaalsContact C-N 3.34Å; A217-Y222 HydrophobicContact CB-CD1 4.5Å; A217-Y222 HydrophobicContact CB-CE1 4.18Å; A217-Y222 HydrophobicContact CB-CE2 4.34Å
218	D	86.8	Confident	89.9	Confident	153 Å²	153	46.6 Å²	46.6	82%	0.818	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-17	177.3	-64	-37.2	0	0	0	111.8	D216	D216-D218 PolarHBondContact O-N 2.96Å; D216-D218 PolarHBondContact OD1-N 3.36Å
219	S	87.9	Confident	89.8	Confident	5 Å²	5	47 Å²	47	4%	0.035	25%	0.253	C	S	.	.	S	Bend	trans	-68.1	132.4	177.2	-171.5	0	0	0	0	111.7	H213 D216 A217 L221 Y222	H213-S219 WeakPolarHBondContact NE2-CB 3.48Å; H213-S219 PolarHBondContact NE2-OG 2.97Å; H213-S219 VanDerWaalsContact NE2-OG 3.11Å; D216-S219 VanDerWaalsContact O-CB 3.23Å; D216-S219 WeakPolarHBondContact O-CB 3.37Å; D216-S219 PolarHBondContact O-N 3.42Å; D216-S219 VanDerWaalsContact O-N 3.1Å; D216-S219 PolarHBondContact OD1-N 2.96Å; A217-S219 VanDerWaalsContact C-N 3.34Å; S219-L221 PolarHBondContact O-N 3.35Å; S219-L221 PolarHBondContact OG-N 3.14Å; S219-Y222 WeakPolarHBondContact O-CB 3.33Å; S219-Y222 PolarHBondContact O-N 3.43Å
220	P	88.1	Confident	89.6	Confident	37 Å²	37	56.1 Å²	56.1	24%	0.24	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.3	173.1	29.1	-36.8	0	0	0	113.2	M189 A194 I196 F224	M189-P220 HydrophobicContact CB-CG 4.3Å; M189-P220 HydrophobicContact SD-CB 3.59Å; M189-P220 VanDerWaalsContact SD-CB 3.59Å; M189-P220 HydrophobicContact SD-CG 3.44Å; M189-P220 WeakPolarHBondContact SD-CG 3.43Å; A194-P220 HydrophobicContact CB-CB 4.02Å; A194-P220 HydrophobicContact CB-CG 4.2Å; I196-P220 HydrophobicContact CD1-CG 3.77Å; I196-P220 HydrophobicContact CG1-CG 3.48Å; I196-P220 VanDerWaalsContact CG1-CG 3.48Å; P220-F224 WeakPolarHBondContact O-CE2 3.21Å
221	L	89.8	Confident	89.4	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.026	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-2.7	174.4	-65.9	175.4	0	0	0	113.4	L168 M189 I196 I215 S219 H223 F224 F234 I236	L168-L221 HydrophobicContact CB-CD1 4.48Å; L168-L221 HydrophobicContact CD2-CD1 3.93Å; M189-L221 HydrophobicContact CE-CD2 3.71Å; M189-L221 HydrophobicContact SD-CD2 4.08Å; M189-L221 HydrophobicContact SD-CG 4.31Å; I196-L221 HydrophobicContact CD1-CD1 4.41Å; I215-L221 HydrophobicContact CD1-CB 4.29Å; I215-L221 HydrophobicContact CD1-CD1 4.43Å; I215-L221 HydrophobicContact CG1-CB 4.39Å; I215-L221 HydrophobicContact CG2-CB 3.89Å; S219-L221 PolarHBondContact O-N 3.35Å; S219-L221 PolarHBondContact OG-N 3.14Å; L221-H223 VanDerWaalsContact C-N 3.31Å; L221-H223 PolarHBondContact O-N 3.32Å; L221-F224 HydrophobicContact CD2-CD2 4.16Å; L221-F224 HydrophobicContact CD2-CE2 4.49Å; L221-F224 HydrophobicContact CD2-CG 4.48Å; L221-F224 PolarHBondContact O-N 2.84Å; L221-F224 VanDerWaalsContact O-N 3.12Å; L221-F234 HydrophobicContact CD2-CE1 4.14Å; L221-F234 HydrophobicContact CD2-CE2 4.3Å; L221-F234 HydrophobicContact CD2-CZ 3.83Å; L221-I236 HydrophobicContact CD1-CD1 4.22Å
222	Y	90	Very high	89.3	Confident	50 Å²	50	59.5 Å²	59.5	20%	0.196	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-40.3	-171.2	-173.2	-122.7	0	0	0	114.4	D216 A217 S219 A303 E304	D216-Y222 WeakPolarHBondContact O-CB 3.24Å; D216-Y222 WeakPolarHBondContact O-CD2 3.3Å; A217-Y222 HydrophobicContact CB-CD1 4.5Å; A217-Y222 HydrophobicContact CB-CE1 4.18Å; A217-Y222 HydrophobicContact CB-CE2 4.34Å; S219-Y222 WeakPolarHBondContact O-CB 3.33Å; S219-Y222 PolarHBondContact O-N 3.43Å; Y222-A303 HydrophobicContact CD2-CB 3.64Å; Y222-A303 HydrophobicContact CE2-CB 4.02Å; Y222-A303 PolarHBondContact O-N 3.17Å; Y222-A303 VanDerWaalsContact O-N 3.14Å; Y222-E304 HydrophobicContact CD1-CB 3.99Å; Y222-E304 HydrophobicContact CE1-CB 3.5Å; Y222-E304 VanDerWaalsContact CE1-CB 3.5Å; Y222-E304 HydrophobicContact CE1-CG 3.68Å; Y222-E304 HydrophobicContact CE2-CB 4.16Å; Y222-E304 VanDerWaalsContact CZ-CA 3.43Å; Y222-E304 PolarHBondContact O-N 2.99Å; Y222-E304 WeakPolarHBondContact OH-CA 3.26Å
223	H	90	Very high	89.1	Confident	117 Å²	117	63.5 Å²	63.5	54%	0.542	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.4	-176.9	-57.4	-68.2	0	0	0	114.4	L221 E304	L221-H223 VanDerWaalsContact C-N 3.31Å; L221-H223 PolarHBondContact O-N 3.32Å; H223-E304 IonicContact CE1-OE2 3.86Å; H223-E304 PolarHBondContact CE1-OE2 2.99Å; H223-E304 IonicContact ND1-OE2 3.46Å; H223-E304 PolarHBondContact ND1-OE2 3.26Å
224	F	89.5	Confident	89.1	Confident	29 Å²	29	63 Å²	63	13%	0.127	32%	0.323	C	S	.	.			trans	-79.1	131.4	-175.6	-80.6	-95.9	0	0	0	112.1	M189 Y191 P220 L221 D228 A232 F234 S302	M189-F224 HydrophobicContact CE-CE2 4.19Å; M189-F224 HydrophobicContact CE-CZ 4.34Å; Y191-F224 HydrophobicContact CE1-CZ 4.16Å; P220-F224 WeakPolarHBondContact O-CE2 3.21Å; L221-F224 HydrophobicContact CD2-CD2 4.16Å; L221-F224 HydrophobicContact CD2-CE2 4.49Å; L221-F224 HydrophobicContact CD2-CG 4.48Å; L221-F224 PolarHBondContact O-N 2.84Å; L221-F224 VanDerWaalsContact O-N 3.12Å; F224-D228 HydrophobicContact CD1-CB 3.98Å; F224-A232 HydrophobicContact CD1-CB 4.23Å; F224-A232 HydrophobicContact CE1-CB 3.61Å; F224-F234 HydrophobicContact CD1-CE1 4.26Å; F224-F234 HydrophobicContact CE1-CD1 4.14Å; F224-F234 AromaticContact CE1-CE1 3.86Å; F224-F234 HydrophobicContact CE1-CE1 3.86Å; F224-F234 HydrophobicContact CZ-CD1 4.07Å; F224-F234 HydrophobicContact CZ-CE1 4.11Å; F224-S302 VanDerWaalsContact O-CA 3.3Å; F224-S302 WeakPolarHBondContact O-CA 3.19Å
225	K	91.1	Very high	89.1	Confident	78 Å²	78	61.5 Å²	61.5	34%	0.339	31%	0.313	S	S	.	.			trans	-93	164.8	169.6	-59.5	178.6	179.5	-171.5	0	111.1	S227 D228 D305	K225-S227 PolarHBondContact O-N 3.4Å; K225-D228 WeakPolarHBondContact CB-OD2 3.49Å; K225-D228 PolarHBondContact N-OD2 3.41Å; K225-D228 WeakPolarHBondContact O-CB 3.32Å; K225-D228 PolarHBondContact O-N 3.22Å; K225-D305 WeakPolarHBondContact CE-OD2 3.35Å; K225-D305 IonicContact NZ-OD2 2.86Å; K225-D305 PolarHBondContact NZ-OD2 3.31Å
226	A	91.2	Very high	89.2	Confident	13 Å²	13	61 Å²	61	11%	0.107	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-35.2	175.5	0	0	0	0	0	112.6	D228 W264 N300	A226-D228 VanDerWaalsContact C-N 3.31Å; A226-W264 HydrophobicContact CB-CB 4.28Å; A226-W264 HydrophobicContact CB-CD2 3.66Å; A226-W264 HydrophobicContact CB-CE3 4.21Å; A226-W264 HydrophobicContact CB-CG 3.65Å; A226-W264 HydrophobicContact CB-CZ2 4.45Å; A226-N300 HydrophobicContact CB-CB 3.93Å; A226-N300 PolarHBondContact N-O 2.85Å
227	S	90.3	Very high	89.4	Confident	70 Å²	70	58.3 Å²	58.3	49%	0.49	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-30.4	175.1	49.9	0	0	0	0	113.3	K225 L229 Y230	K225-S227 PolarHBondContact O-N 3.4Å; S227-L229 VanDerWaalsContact C-N 3.3Å; S227-L229 PolarHBondContact O-N 3.1Å; S227-Y230 WeakPolarHBondContact O-CD2 3.34Å; S227-Y230 PolarHBondContact O-N 2.81Å
228	D	90	Very high	89.6	Confident	52 Å²	52	55.1 Å²	55.1	28%	0.278	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-75.9	-26.3	-170.6	-56.8	-16.2	0	0	0	110.7	F224 K225 A226 Y230 T231 A232	F224-D228 HydrophobicContact CD1-CB 3.98Å; K225-D228 WeakPolarHBondContact CB-OD2 3.49Å; K225-D228 PolarHBondContact N-OD2 3.41Å; K225-D228 WeakPolarHBondContact O-CB 3.32Å; K225-D228 PolarHBondContact O-N 3.22Å; A226-D228 VanDerWaalsContact C-N 3.31Å; D228-Y230 PolarHBondContact O-N 3.01Å; D228-Y230 VanDerWaalsContact O-N 3.16Å; D228-T231 CarbonylContact O-C 3.49Å; D228-T231 PolarHBondContact O-N 3.36Å; D228-T231 PolarHBondContact O-OG1 3.46Å; D228-T231 VanDerWaalsContact O-OG1 3.05Å; D228-A232 VanDerWaalsContact O-CB 3.3Å; D228-A232 WeakPolarHBondContact O-CB 3.33Å; D228-A232 PolarHBondContact O-N 2.92Å
229	L	88.5	Confident	89.9	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.073	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-54.7	-31.1	175	-71.5	-177.9	0	0	0	113.2	S227 T231 F234 P259 I262 W264	S227-L229 VanDerWaalsContact C-N 3.3Å; S227-L229 PolarHBondContact O-N 3.1Å; L229-T231 VanDerWaalsContact C-N 3.29Å; L229-T231 PolarHBondContact O-N 3.19Å; L229-F234 HydrophobicContact CD2-CE1 4.15Å; L229-F234 HydrophobicContact CD2-CZ 3.82Å; L229-P259 WeakPolarHBondContact O-CB 3.46Å; L229-I262 HydrophobicContact CD1-CG2 4.13Å; L229-W264 HydrophobicContact CD1-CB 4.28Å; L229-W264 HydrophobicContact CD1-CE3 3.8Å; L229-W264 HydrophobicContact CG-CE3 4.5Å
230	Y	85.3	Confident	90.1	Very high	210 Å²	210	48.7 Å²	48.7	82%	0.824	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-69.5	-27.7	177.8	-65.3	-75.1	0	0	0	113.2	S227 D228	S227-Y230 WeakPolarHBondContact O-CD2 3.34Å; S227-Y230 PolarHBondContact O-N 2.81Å; D228-Y230 PolarHBondContact O-N 3.01Å; D228-Y230 VanDerWaalsContact O-N 3.16Å
231	T	87.3	Confident	90.3	Very high	108 Å²	108	49 Å²	49	66%	0.663	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107	-12.5	-179	52	0	0	0	0	113.3	D228 L229	D228-T231 CarbonylContact O-C 3.49Å; D228-T231 PolarHBondContact O-N 3.36Å; D228-T231 PolarHBondContact O-OG1 3.46Å; D228-T231 VanDerWaalsContact O-OG1 3.05Å; L229-T231 VanDerWaalsContact C-N 3.29Å; L229-T231 PolarHBondContact O-N 3.19Å
232	A	87.4	Confident	90.3	Very high	11 Å²	11	49 Å²	49	9%	0.091	24%	0.237	C	C	.	.			trans	-62.7	146.4	-177.1	0	0	0	0	0	111.3	F224 D228 F234 P259	F224-A232 HydrophobicContact CD1-CB 4.23Å; F224-A232 HydrophobicContact CE1-CB 3.61Å; D228-A232 VanDerWaalsContact O-CB 3.3Å; D228-A232 WeakPolarHBondContact O-CB 3.33Å; D228-A232 PolarHBondContact O-N 2.92Å; A232-F234 HydrophobicContact CB-CD1 3.69Å; A232-F234 HydrophobicContact CB-CE1 3.5Å; A232-F234 VanDerWaalsContact CB-CE1 3.5Å; A232-P259 HydrophobicContact CB-CB 4.19Å; A232-P259 HydrophobicContact CB-CG 4.29Å
233	R	87.7	Confident	90.4	Very high	170 Å²	170	49.8 Å²	49.8	64%	0.642	24%	0.244	S	C	*	.			trans	-126.5	73.9	179.6	-69.2	-173.3	176.2	-176.8	-0	110.7	Y191	Y191-R233 WeakPolarHBondContact CD2-O 3.1Å; Y191-R233 HydrophobicContact CE2-CB 4.38Å; Y191-R233 VanDerWaalsContact CE2-O 3.32Å; Y191-R233 WeakPolarHBondContact CE2-O 3.37Å
234	F	90.3	Very high	90.3	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.035	22%	0.221	C	C	.	.			trans	-139.1	160.4	176.7	63.5	-103.8	0	0	0	111	M189 I190 Y191 L221 F224 L229 A232 I236 P259 I262	M189-F234 HydrophobicContact CE-CB 3.51Å; M189-F234 HydrophobicContact CE-CD1 3.34Å; M189-F234 HydrophobicContact CE-CD2 3.67Å; M189-F234 HydrophobicContact CE-CE1 3.88Å; M189-F234 HydrophobicContact CE-CE2 4.17Å; M189-F234 HydrophobicContact CE-CG 3.23Å; M189-F234 HydrophobicContact CE-CZ 4.27Å; M189-F234 HydrophobicContact CG-CB 4.16Å; M189-F234 HydrophobicContact CG-CD2 4.24Å; M189-F234 HydrophobicContact CG-CG 4.39Å; I190-F234 VanDerWaalsContact O-CA 3.31Å; I190-F234 WeakPolarHBondContact O-CA 3.42Å; Y191-F234 HydrophobicContact CD2-CB 4.17Å; Y191-F234 HydrophobicContact CG-CB 4.02Å; L221-F234 HydrophobicContact CD2-CE1 4.14Å; L221-F234 HydrophobicContact CD2-CE2 4.3Å; L221-F234 HydrophobicContact CD2-CZ 3.83Å; F224-F234 HydrophobicContact CD1-CE1 4.26Å; F224-F234 HydrophobicContact CE1-CD1 4.14Å; F224-F234 AromaticContact CE1-CE1 3.86Å; F224-F234 HydrophobicContact CE1-CE1 3.86Å; F224-F234 HydrophobicContact CZ-CD1 4.07Å; F224-F234 HydrophobicContact CZ-CE1 4.11Å; L229-F234 HydrophobicContact CD2-CE1 4.15Å; L229-F234 HydrophobicContact CD2-CZ 3.82Å; A232-F234 HydrophobicContact CB-CD1 3.69Å; A232-F234 HydrophobicContact CB-CE1 3.5Å; A232-F234 VanDerWaalsContact CB-CE1 3.5Å; F234-I236 HydrophobicContact CD2-CD1 4.33Å; F234-I236 HydrophobicContact CD2-CG1 3.83Å; F234-I236 HydrophobicContact CE2-CD1 3.77Å; F234-I236 HydrophobicContact CE2-CG1 3.77Å; F234-P259 HydrophobicContact CD1-CG 4.19Å; F234-P259 HydrophobicContact CD2-CG 4.24Å; F234-P259 HydrophobicContact CE1-CB 4.41Å; F234-P259 HydrophobicContact CE1-CG 4.22Å; F234-P259 HydrophobicContact CE2-CG 4.25Å; F234-P259 HydrophobicContact CG-CG 4.2Å; F234-P259 HydrophobicContact CZ-CB 4.29Å; F234-P259 HydrophobicContact CZ-CG 4.24Å; F234-P259 WeakPolarHBondContact O-CD 3.37Å; F234-P259 VanDerWaalsContact O-CG 3.25Å; F234-P259 WeakPolarHBondContact O-CG 3.27Å; F234-I262 HydrophobicContact CE2-CD1 3.53Å; F234-I262 HydrophobicContact CZ-CD1 3.81Å
235	E	92	Very high	90.1	Very high	14 Å²	14	47.1 Å²	47.1	7%	0.065	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129	172.3	-175.8	175.3	170.2	0	0	108.9	L12 L13 I190 I237 S256 L258	L12-E235 VanDerWaalsContact CB-OE2 3.31Å; L12-E235 WeakPolarHBondContact CB-OE2 3.24Å; L12-E235 PolarHBondContact N-OE1 3.26Å; L12-E235 PolarHBondContact N-OE2 3.08Å; L13-E235 PolarHBondContact N-OE1 3.33Å; I190-E235 HydrophobicContact CB-CB 4.49Å; I190-E235 PolarHBondContact N-O 2.85Å; I190-E235 PolarHBondContact O-N 3.43Å; I190-E235 VanDerWaalsContact O-N 3.07Å; E235-I237 HydrophobicContact CG-CG1 4.49Å; E235-S256 WeakPolarHBondContact OE1-CB 3.18Å; E235-S256 PolarHBondContact OE1-OG 2.93Å; E235-L258 HydrophobicContact CB-CD2 4.34Å; E235-L258 HydrophobicContact CG-CD2 4.18Å
236	I	92.3	Very high	89.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.6	175	-58.1	-178	0	0	0	108.3	L168 M187 M188 M189 L221 F234 S256 Y257 I262	L168-I236 HydrophobicContact CD2-CD1 3.48Å; L168-I236 VanDerWaalsContact CD2-CD1 3.48Å; M187-I236 HydrophobicContact CG-CG2 3.44Å; M187-I236 VanDerWaalsContact CG-CG2 3.44Å; M187-I236 HydrophobicContact SD-CG2 3.7Å; M188-I236 CarbonylContact O-C 3.56Å; M188-I236 WeakPolarHBondContact O-CA 3.36Å; M189-I236 HydrophobicContact CG-CG1 4.37Å; L221-I236 HydrophobicContact CD1-CD1 4.22Å; F234-I236 HydrophobicContact CD2-CD1 4.33Å; F234-I236 HydrophobicContact CD2-CG1 3.83Å; F234-I236 HydrophobicContact CE2-CD1 3.77Å; F234-I236 HydrophobicContact CE2-CG1 3.77Å; I236-S256 CarbonylContact O-C 3.43Å; I236-S256 VanDerWaalsContact O-CA 3.27Å; I236-S256 WeakPolarHBondContact O-CA 3.34Å; I236-Y257 PolarHBondContact N-O 2.85Å; I236-Y257 PolarHBondContact O-N 3.33Å; I236-I262 HydrophobicContact CD1-CD1 3.83Å
237	I	93.1	Very high	89.4	Confident	13 Å²	13	51.1 Å²	51.1	7%	0.067	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.2	173.5	-61.5	-176.3	0	0	0	108.6	L12 L13 M187 M188 I190 E235 T255	L12-I237 HydrophobicContact CD2-CD1 4.29Å; L13-I237 HydrophobicContact CB-CD1 4.25Å; L13-I237 HydrophobicContact CD2-CD1 4.43Å; L13-I237 HydrophobicContact CD2-CG1 4.37Å; L13-I237 HydrophobicContact CD2-CG2 3.76Å; M187-I237 CarbonylContact C-O 3.55Å; M187-I237 WeakPolarHBondContact CA-O 3.08Å; M188-I237 PolarHBondContact N-O 3.08Å; M188-I237 PolarHBondContact O-N 3.2Å; I190-I237 HydrophobicContact CD1-CD1 3.45Å; I190-I237 VanDerWaalsContact CD1-CD1 3.45Å; I190-I237 HydrophobicContact CD1-CG1 4.19Å; I190-I237 HydrophobicContact CG1-CD1 4.34Å; E235-I237 HydrophobicContact CG-CG1 4.49Å; I237-T255 WeakPolarHBondContact CA-O 3.48Å
238	L	93	Very high	89.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124	170.7	-175.5	70.4	0	0	0	108.5	F153 V170 V172 I185 H186 M187 S254 T255 Y257	F153-L238 HydrophobicContact CD1-CD2 3.7Å; F153-L238 HydrophobicContact CE1-CD2 3.82Å; F153-L238 HydrophobicContact CE1-CG 4.22Å; V170-L238 HydrophobicContact CB-CD2 4.06Å; V170-L238 HydrophobicContact CG1-CD2 3.43Å; V170-L238 VanDerWaalsContact CG1-CD2 3.43Å; V172-L238 HydrophobicContact CG1-CD2 3.99Å; I185-L238 HydrophobicContact CG2-CD1 3.4Å; I185-L238 VanDerWaalsContact CG2-CD1 3.4Å; I185-L238 HydrophobicContact CG2-CG 4.17Å; H186-L238 WeakPolarHBondContact O-CA 3.2Å; M187-L238 HydrophobicContact CB-CD1 4.17Å; M187-L238 HydrophobicContact CE-CD1 3.76Å; M187-L238 HydrophobicContact CG-CD1 4.38Å; L238-S254 CarbonylContact O-C 3.51Å; L238-S254 WeakPolarHBondContact O-CA 3.31Å; L238-T255 HydrophobicContact CB-CG2 4.16Å; L238-T255 PolarHBondContact N-O 3.45Å; L238-T255 PolarHBondContact O-N 3.28Å; L238-Y257 HydrophobicContact CB-CE2 4.38Å
239	T	93	Very high	89.1	Confident	22 Å²	22	50.3 Å²	50.3	14%	0.135	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.6	176.7	-64.3	0	0	0	0	109.2	I185 H186 Q252 S254	I185-T239 WeakPolarHBondContact CA-O 3.42Å; H186-T239 PolarHBondContact N-O 3.47Å; H186-T239 PolarHBondContact O-N 3.24Å; T239-Q252 HydrophobicContact CG2-CG 3.68Å; T239-Q252 VanDerWaalsContact CG2-NE2 3.33Å; T239-S254 WeakPolarHBondContact CG2-OG 3.36Å; T239-S254 PolarHBondContact OG1-OG 3.45Å
240	L	92.3	Very high	89.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.6	176.3	-176.4	164.2	0	0	0	108.2	L151 F153 V172 L180 V183 K184 I185 L205 Q252 A253	L151-L240 HydrophobicContact CD1-CD2 3.78Å; F153-L240 HydrophobicContact CE1-CB 4.08Å; F153-L240 HydrophobicContact CE1-CD1 4.44Å; F153-L240 HydrophobicContact CZ-CB 3.9Å; V172-L240 HydrophobicContact CB-CD1 4.21Å; V172-L240 HydrophobicContact CG1-CD1 4.42Å; L180-L240 HydrophobicContact CD2-CD2 3.46Å; L180-L240 VanDerWaalsContact CD2-CD2 3.46Å; V183-L240 HydrophobicContact CG1-CD1 4.15Å; V183-L240 HydrophobicContact CG1-CD2 3.77Å; V183-L240 HydrophobicContact CG1-CG 3.73Å; K184-L240 WeakPolarHBondContact O-CA 3.44Å; I185-L240 HydrophobicContact CD1-CD1 4.43Å; I185-L240 HydrophobicContact CG1-CG 4.21Å; L205-L240 HydrophobicContact CD2-CD1 4.11Å; L240-Q252 CarbonylContact O-C 3.57Å; L240-Q252 WeakPolarHBondContact O-CA 3.31Å; L240-A253 PolarHBondContact N-O 3.06Å; L240-A253 PolarHBondContact O-N 2.85Å
241	D	91.5	Very high	89.4	Confident	44 Å²	44	44.3 Å²	44.3	24%	0.235	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	141.4	175.5	-68.9	-44.1	0	0	0	109.6	V183 K184 H186 Q252	V183-D241 CarbonylContact C-O 3.52Å; V183-D241 VanDerWaalsContact CA-O 3.25Å; V183-D241 WeakPolarHBondContact CA-O 3.37Å; K184-D241 HydrophobicContact CB-CB 4.44Å; K184-D241 PolarHBondContact N-O 3.11Å; K184-D241 PolarHBondContact O-N 2.99Å; H186-D241 IonicContact CD2-OD2 2.77Å; D241-Q252 WeakPolarHBondContact OD1-CB 3.34Å; D241-Q252 VanDerWaalsContact OD1-CD 3.28Å; D241-Q252 WeakPolarHBondContact OD1-CG 3.23Å; D241-Q252 PolarHBondContact OD1-NE2 3.46Å; D241-Q252 PolarHBondContact OD2-NE2 3.38Å
242	G	91	Very high	89.5	Confident	5 Å²	5	44.2 Å²	44.2	5%	0.052	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	176.8	170.9	0	0	0	0	0	113.3	S250 T251	G242-S250 CarbonylContact O-C 3.45Å; G242-S250 WeakPolarHBondContact O-CA 3.35Å; G242-T251 PolarHBondContact N-O 3.42Å; G242-T251 PolarHBondContact O-N 3.38Å
243	L	91	Very high	89.8	Confident	65 Å²	65	44.1 Å²	44.1	34%	0.34	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.7	-176.3	-60.3	176.3	0	0	0	111	L180 A181 N182 S245	L180-L243 VanDerWaalsContact CD1-C 3.49Å; L180-L243 VanDerWaalsContact CD1-O 3.22Å; L180-L243 WeakPolarHBondContact CD1-O 3.3Å; A181-L243 PolarHBondContact N-O 2.85Å; A181-L243 PolarHBondContact O-N 2.99Å; N182-L243 HydrophobicContact CB-CD1 4.16Å; N182-L243 HydrophobicContact CB-CG 4.43Å; L243-S245 PolarHBondContact O-N 2.9Å
244	I	88.1	Confident	90.1	Very high	12 Å²	12	36.6 Å²	36.6	6%	0.062	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	113.2	174.5	-58	173.1	0	0	0	108.3	P144 R147 L180 S246 T247 G248 C249 T251	P144-I244 HydrophobicContact CB-CD1 3.38Å; P144-I244 HydrophobicContact CG-CD1 4.05Å; R147-I244 HydrophobicContact CB-CD1 4.06Å; R147-I244 HydrophobicContact CG-CD1 3.74Å; R147-I244 HydrophobicContact CG-CG1 4.02Å; L180-I244 HydrophobicContact CD1-CG1 4.3Å; I244-S246 WeakPolarHBondContact CG2-OG 3.39Å; I244-S246 PolarHBondContact O-N 2.93Å; I244-T247 PolarHBondContact O-N 3.1Å; I244-G248 WeakPolarHBondContact O-CA 3.42Å; I244-G248 PolarHBondContact O-N 3.02Å; I244-C249 PolarHBondContact N-O 3.46Å; I244-T251 HydrophobicContact CD1-CG2 4.41Å; I244-T251 HydrophobicContact CG1-CG2 3.95Å
245	S	85	Confident	90.3	Very high	78 Å²	78	36.3 Å²	36.3	55%	0.545	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.6	-174.6	-53.5	0	0	0	0	115.1	K179 L243	K179-S245 PolarHBondContact O-OG 2.9Å; K179-S245 VanDerWaalsContact O-OG 3.06Å; L243-S245 PolarHBondContact O-N 2.9Å
246	S	83.9	Confident	90.4	Very high	92 Å²	92	35.7 Å²	35.7	64%	0.643	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-27.6	-179.1	59.8	0	0	0	0	114.5	I244	I244-S246 WeakPolarHBondContact CG2-OG 3.39Å; I244-S246 PolarHBondContact O-N 2.93Å
247	T	84.6	Confident	90.5	Very high	83 Å²	83	35.7 Å²	35.7	51%	0.509	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-14.9	-175.5	62.4	0	0	0	0	113.3	I244 C249	I244-T247 PolarHBondContact O-N 3.1Å; T247-C249 PolarHBondContact O-N 3.25Å; T247-C249 VanDerWaalsContact O-N 3.15Å; T247-C249 WeakPolarHBondContact OG1-CB 3.35Å; T247-C249 PolarHBondContact OG1-N 2.77Å; T247-C249 PolarHBondContact OG1-SG 3.25Å; T247-C249 VanDerWaalsContact OG1-SG 3.4Å
248	G	85.3	Confident	90.5	Very high	55 Å²	55	35.9 Å²	35.9	57%	0.567	23%	0.232	S	C	*	.			trans	70.6	-3.5	-171.6	0	0	0	0	0	114.1	I244	I244-G248 WeakPolarHBondContact O-CA 3.42Å; I244-G248 PolarHBondContact O-N 3.02Å
249	C	87.5	Confident	90.5	Very high	50 Å²	50	36.5 Å²	36.5	34%	0.338	24%	0.237	S	C	.	.			trans	-69.6	143.2	178.7	-55.3	0	0	0	0	110.8	P144 I244 T247	P144-C249 HydrophobicContact CG-CB 4.44Å; I244-C249 PolarHBondContact N-O 3.46Å; T247-C249 PolarHBondContact O-N 3.25Å; T247-C249 VanDerWaalsContact O-N 3.15Å; T247-C249 WeakPolarHBondContact OG1-CB 3.35Å; T247-C249 PolarHBondContact OG1-N 2.77Å; T247-C249 PolarHBondContact OG1-SG 3.25Å; T247-C249 VanDerWaalsContact OG1-SG 3.4Å
250	S	90	Very high	90.4	Very high	90 Å²	90	40.1 Å²	40.1	63%	0.629	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	144.8	168.4	53.7	0	0	0	0	111.1	G242	G242-S250 CarbonylContact O-C 3.45Å; G242-S250 WeakPolarHBondContact O-CA 3.35Å
251	T	90.3	Very high	90.5	Very high	9 Å²	9	41.2 Å²	41.2	6%	0.055	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	139.7	170	-174	0	0	0	0	108.3	R147 L180 G242 I244	R147-T251 HydrophobicContact CG-CG2 4.22Å; L180-T251 HydrophobicContact CD1-CG2 3.41Å; L180-T251 VanDerWaalsContact CD1-CG2 3.41Å; L180-T251 HydrophobicContact CD2-CG2 4.19Å; L180-T251 HydrophobicContact CG-CG2 4.47Å; G242-T251 PolarHBondContact N-O 3.42Å; G242-T251 PolarHBondContact O-N 3.38Å; I244-T251 HydrophobicContact CD1-CG2 4.41Å; I244-T251 HydrophobicContact CG1-CG2 3.95Å
252	Q	90.9	Very high	90.7	Very high	105 Å²	105	39.6 Å²	39.6	49%	0.491	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.3	175.2	179.9	169.2	78.1	0	0	108.4	A148 T239 L240 D241	A148-Q252 WeakPolarHBondContact CB-O 3.33Å; T239-Q252 HydrophobicContact CG2-CG 3.68Å; T239-Q252 VanDerWaalsContact CG2-NE2 3.33Å; L240-Q252 CarbonylContact O-C 3.57Å; L240-Q252 WeakPolarHBondContact O-CA 3.31Å; D241-Q252 WeakPolarHBondContact OD1-CB 3.34Å; D241-Q252 VanDerWaalsContact OD1-CD 3.28Å; D241-Q252 WeakPolarHBondContact OD1-CG 3.23Å; D241-Q252 PolarHBondContact OD1-NE2 3.46Å; D241-Q252 PolarHBondContact OD2-NE2 3.38Å
253	A	92.5	Very high	90.9	Very high	10 Å²	10	41.4 Å²	41.4	8%	0.083	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	136.7	167.7	0	0	0	0	0	108.8	A148 L151 F153 L240	A148-A253 HydrophobicContact CB-CB 4.16Å; L151-A253 HydrophobicContact CB-CB 4.07Å; L151-A253 HydrophobicContact CD1-CB 3.64Å; L151-A253 HydrophobicContact CG-CB 4.47Å; F153-A253 HydrophobicContact CE2-CB 3.91Å; F153-A253 HydrophobicContact CZ-CB 4.07Å; F153-A253 WeakPolarHBondContact CZ-O 3.36Å; L240-A253 PolarHBondContact N-O 3.06Å; L240-A253 PolarHBondContact O-N 2.85Å
254	S	93.4	Very high	91	Very high	12 Å²	12	40.1 Å²	40.1	8%	0.084	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.6	-179.3	-57.9	0	0	0	0	110.6	G17 L238 T239	G17-S254 WeakPolarHBondContact CA-O 3.3Å; G17-S254 PolarHBondContact N-O 3.27Å; L238-S254 CarbonylContact O-C 3.51Å; L238-S254 WeakPolarHBondContact O-CA 3.31Å; T239-S254 WeakPolarHBondContact CG2-OG 3.36Å; T239-S254 PolarHBondContact OG1-OG 3.45Å
255	T	94.8	Very high	91.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	165.3	172.3	-159.5	0	0	0	0	109.7	K15 F153 I237 L238 Y257	K15-T255 PolarHBondContact O-OG1 3.41Å; F153-T255 HydrophobicContact CB-CG2 3.62Å; F153-T255 HydrophobicContact CD1-CG2 3.65Å; F153-T255 HydrophobicContact CD2-CG2 3.85Å; F153-T255 HydrophobicContact CE1-CG2 4.25Å; F153-T255 HydrophobicContact CE2-CG2 4.42Å; F153-T255 HydrophobicContact CG-CG2 3.42Å; F153-T255 VanDerWaalsContact CG-CG2 3.42Å; I237-T255 WeakPolarHBondContact CA-O 3.48Å; L238-T255 HydrophobicContact CB-CG2 4.16Å; L238-T255 PolarHBondContact N-O 3.45Å; L238-T255 PolarHBondContact O-N 3.28Å; T255-Y257 HydrophobicContact CG2-CE2 3.68Å
256	S	94.7	Very high	91.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	156.7	177.6	60.1	0	0	0	0	112.1	L13 K15 E235 I236	L13-S256 WeakPolarHBondContact O-CB 3.47Å; L13-S256 PolarHBondContact O-OG 2.97Å; K15-S256 WeakPolarHBondContact CD-O 3.43Å; K15-S256 WeakPolarHBondContact CE-O 3.45Å; K15-S256 PolarHBondContact NZ-O 2.96Å; E235-S256 WeakPolarHBondContact OE1-CB 3.18Å; E235-S256 PolarHBondContact OE1-OG 2.93Å; I236-S256 CarbonylContact O-C 3.43Å; I236-S256 VanDerWaalsContact O-CA 3.27Å; I236-S256 WeakPolarHBondContact O-CA 3.34Å
257	Y	94.6	Very high	92.2	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	116.7	169.9	-61	-86.6	0	0	0	109.6	S154 A157 V170 I236 L238 T255 E261	S154-Y257 WeakPolarHBondContact O-CE1 3.47Å; S154-Y257 PolarHBondContact O-OH 3.04Å; S154-Y257 PolarHBondContact OG-OH 3.17Å; A157-Y257 HydrophobicContact CB-CD1 3.69Å; A157-Y257 HydrophobicContact CB-CD2 4.41Å; A157-Y257 HydrophobicContact CB-CE1 4.03Å; A157-Y257 HydrophobicContact CB-CG 3.91Å; V170-Y257 HydrophobicContact CG1-CE2 3.92Å; V170-Y257 WeakPolarHBondContact CG1-OH 3.33Å; V170-Y257 HydrophobicContact CG2-CD2 4.38Å; V170-Y257 HydrophobicContact CG2-CE2 3.83Å; I236-Y257 PolarHBondContact N-O 2.85Å; I236-Y257 PolarHBondContact O-N 3.33Å; L238-Y257 HydrophobicContact CB-CE2 4.38Å; T255-Y257 HydrophobicContact CG2-CE2 3.68Å; Y257-E261 WeakPolarHBondContact CA-OE2 3.19Å
258	L	93.2	Very high	92.6	Very high	17 Å²	17	35.3 Å²	35.3	9%	0.089	21%	0.208	C	C	.	.			trans	-77.8	162.9	168.5	-63.4	176.9	0	0	0	110.3	R11 E235 S260 E261	R11-L258 HydrophobicContact CB-CD1 4.45Å; R11-L258 HydrophobicContact CB-CD2 4.25Å; E235-L258 HydrophobicContact CB-CD2 4.34Å; E235-L258 HydrophobicContact CG-CD2 4.18Å; L258-S260 PolarHBondContact O-N 3.18Å; L258-E261 HydrophobicContact CB-CG 4.22Å; L258-E261 PolarHBondContact N-OE2 2.63Å; L258-E261 WeakPolarHBondContact O-CA 3.17Å; L258-E261 WeakPolarHBondContact O-CB 3.22Å; L258-E261 PolarHBondContact O-N 3.43Å
259	P	92.5	Very high	92.6	Very high	14 Å²	14	34.4 Å²	34.4	9%	0.091	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-62.4	-30.4	-178.6	-23.1	38	0	0	0	112.3	L229 A232 F234 E261 I262	L229-P259 WeakPolarHBondContact O-CB 3.46Å; A232-P259 HydrophobicContact CB-CB 4.19Å; A232-P259 HydrophobicContact CB-CG 4.29Å; F234-P259 HydrophobicContact CD1-CG 4.19Å; F234-P259 HydrophobicContact CD2-CG 4.24Å; F234-P259 HydrophobicContact CE1-CB 4.41Å; F234-P259 HydrophobicContact CE1-CG 4.22Å; F234-P259 HydrophobicContact CE2-CG 4.25Å; F234-P259 HydrophobicContact CG-CG 4.2Å; F234-P259 HydrophobicContact CZ-CB 4.29Å; F234-P259 HydrophobicContact CZ-CG 4.24Å; F234-P259 WeakPolarHBondContact O-CD 3.37Å; F234-P259 VanDerWaalsContact O-CG 3.25Å; F234-P259 WeakPolarHBondContact O-CG 3.27Å; P259-E261 PolarHBondContact O-N 2.87Å; P259-I262 PolarHBondContact O-N 2.93Å
260	S	91.7	Very high	92.1	Very high	97 Å²	97	36.7 Å²	36.7	68%	0.678	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-69.2	-17	172.5	54.1	0	0	0	0	114.2	L258	L258-S260 PolarHBondContact O-N 3.18Å
261	E	94.2	Very high	91.1	Very high	24 Å²	24	40.8 Å²	40.8	11%	0.112	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-99	7.3	178.8	-58.7	170.6	160.2	0	0	111.6	R11 K15 Y156 A157 Y257 L258 P259	R11-E261 IonicContact CZ-OE1 3.26Å; R11-E261 IonicContact NH1-OE1 2.75Å; R11-E261 IonicContact NH2-OE1 3.77Å; R11-E261 PolarHBondContact NH2-OE1 3.25Å; K15-E261 VanDerWaalsContact CE-OE1 3.23Å; K15-E261 WeakPolarHBondContact CE-OE1 3.36Å; K15-E261 WeakPolarHBondContact CE-OE2 3.39Å; K15-E261 IonicContact NZ-OE1 2.74Å; K15-E261 IonicContact NZ-OE2 2.82Å; K15-E261 PolarHBondContact NZ-OE2 2.66Å; Y156-E261 VanDerWaalsContact CA-O 3.3Å; Y156-E261 WeakPolarHBondContact CA-O 3.46Å; A157-E261 PolarHBondContact N-O 3.41Å; Y257-E261 WeakPolarHBondContact CA-OE2 3.19Å; L258-E261 HydrophobicContact CB-CG 4.22Å; L258-E261 PolarHBondContact N-OE2 2.63Å; L258-E261 WeakPolarHBondContact O-CA 3.17Å; L258-E261 WeakPolarHBondContact O-CB 3.22Å; L258-E261 PolarHBondContact O-N 3.43Å; P259-E261 PolarHBondContact O-N 2.87Å
262	I	94.9	Very high	90	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.051	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.9	176.1	-59	174.2	0	0	0	109.1	A157 I159 L168 L229 F234 I236 P259	A157-I262 HydrophobicContact CB-CG1 4.23Å; A157-I262 CarbonylContact O-C 3.59Å; A157-I262 WeakPolarHBondContact O-CA 3.41Å; I159-I262 HydrophobicContact CD1-CG2 3.62Å; I159-I262 HydrophobicContact CG1-CG2 3.79Å; L168-I262 HydrophobicContact CD1-CG2 4.15Å; L229-I262 HydrophobicContact CD1-CG2 4.13Å; F234-I262 HydrophobicContact CE2-CD1 3.53Å; F234-I262 HydrophobicContact CZ-CD1 3.81Å; I236-I262 HydrophobicContact CD1-CD1 3.83Å; P259-I262 PolarHBondContact O-N 2.93Å
263	L	95.1	Very high	89.5	Confident	44 Å²	44	40.5 Å²	40.5	23%	0.23	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113.5	179.6	-58.7	175.6	0	0	0	110.4	Y156 A157 V158 I159 H266 T293	Y156-L263 HydrophobicContact CD1-CD1 4.16Å; Y156-L263 HydrophobicContact CD1-CD2 4.35Å; Y156-L263 HydrophobicContact CD1-CG 4.12Å; Y156-L263 HydrophobicContact CD2-CD1 4.3Å; Y156-L263 HydrophobicContact CG-CD1 3.8Å; Y156-L263 HydrophobicContact CG-CG 4.17Å; A157-L263 PolarHBondContact O-N 3.3Å; V158-L263 CarbonylContact C-O 3.59Å; V158-L263 WeakPolarHBondContact CA-O 3.36Å; V158-L263 HydrophobicContact CG1-CB 4.36Å; I159-L263 PolarHBondContact N-O 2.93Å; L263-H266 HydrophobicContact CB-CB 3.85Å; L263-T293 HydrophobicContact CD1-CG2 4.48Å
264	W	94.6	Very high	89	Confident	37 Å²	37	43.6 Å²	43.6	14%	0.14	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	136.3	173.8	-165.5	-78	0	0	0	111.3	I159 L166 A226 L229 H266 P299 L301	I159-W264 HydrophobicContact CB-CD2 4.33Å; I159-W264 HydrophobicContact CB-CE3 4.07Å; I159-W264 HydrophobicContact CD1-CE3 3.8Å; I159-W264 HydrophobicContact CD1-CZ3 3.91Å; I159-W264 HydrophobicContact CG2-CD2 4.07Å; I159-W264 HydrophobicContact CG2-CE3 3.85Å; I159-W264 HydrophobicContact CG2-CH2 4.22Å; I159-W264 HydrophobicContact CG2-CZ2 4.39Å; I159-W264 HydrophobicContact CG2-CZ3 3.94Å; L166-W264 HydrophobicContact CD1-CH2 4.01Å; L166-W264 HydrophobicContact CD1-CZ2 3.91Å; L166-W264 HydrophobicContact CD2-CZ2 4.35Å; A226-W264 HydrophobicContact CB-CB 4.28Å; A226-W264 HydrophobicContact CB-CD2 3.66Å; A226-W264 HydrophobicContact CB-CE3 4.21Å; A226-W264 HydrophobicContact CB-CG 3.65Å; A226-W264 HydrophobicContact CB-CZ2 4.45Å; L229-W264 HydrophobicContact CD1-CB 4.28Å; L229-W264 HydrophobicContact CD1-CE3 3.8Å; L229-W264 HydrophobicContact CG-CE3 4.5Å; W264-H266 PolarHBondContact O-CD2 3.06Å; W264-P299 WeakPolarHBondContact CZ2-O 3.36Å; W264-P299 PolarHBondContact NE1-O 3.23Å; W264-L301 VanDerWaalsContact CZ2-O 3.28Å; W264-L301 WeakPolarHBondContact CZ2-O 3.48Å
265	G	94.1	Very high	88.5	Confident	8 Å²	8	46.3 Å²	46.3	8%	0.082	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	31	-179.7	0	0	0	0	0	113.6	I159 P295 V296 T298	I159-G265 WeakPolarHBondContact O-CA 3.35Å; I159-G265 PolarHBondContact O-N 3.23Å; G265-P295 CarbonylContact O-C 3.55Å; G265-P295 WeakPolarHBondContact O-CA 3.17Å; G265-V296 PolarHBondContact O-N 3.24Å; G265-T298 WeakPolarHBondContact CA-OG1 3.47Å
266	H	94.9	Very high	88.1	Confident	47 Å²	47	52 Å²	52	22%	0.218	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	152	176.8	-83.4	-129.3	0	0	0	111.1	V158 A160 L263 W264 T293 Y294	V158-H266 HydrophobicContact CB-CB 4.12Å; V158-H266 WeakPolarHBondContact CB-O 3.26Å; V158-H266 HydrophobicContact CG1-CB 3.89Å; V158-H266 WeakPolarHBondContact CG2-O 3.48Å; A160-H266 WeakPolarHBondContact CB-O 3.09Å; L263-H266 HydrophobicContact CB-CB 3.85Å; W264-H266 PolarHBondContact O-CD2 3.06Å; H266-T293 PolarHBondContact ND1-OG1 3.5Å; H266-Y294 CarbonylContact C-O 3.51Å; H266-Y294 WeakPolarHBondContact CA-O 3.21Å
267	R	93.4	Very high	87.6	Confident	98 Å²	98	55.2 Å²	55.2	37%	0.37	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	155.3	169.3	-70.4	-170.3	-178.2	173.9	-2.5	110.2	A160 R161 T293 Y294 V296	A160-R267 HydrophobicContact CB-CG 3.74Å; R161-R267 PolarHBondContact O-NH2 3.38Å; R267-T293 CarbonylContact O-C 3.54Å; R267-T293 VanDerWaalsContact O-CA 3.22Å; R267-T293 WeakPolarHBondContact O-CA 3.38Å; R267-T293 WeakPolarHBondContact O-CB 3.4Å; R267-Y294 HydrophobicContact CB-CD1 4.49Å; R267-Y294 HydrophobicContact CB-CE1 3.82Å; R267-Y294 HydrophobicContact CB-CE2 4.27Å; R267-Y294 PolarHBondContact N-O 2.96Å; R267-Y294 VanDerWaalsContact O-CD1 3.23Å; R267-Y294 WeakPolarHBondContact O-CD1 3.18Å; R267-Y294 PolarHBondContact O-N 3.11Å; R267-V296 HydrophobicContact CB-CG2 3.96Å; R267-V296 HydrophobicContact CG-CB 4.35Å; R267-V296 HydrophobicContact CG-CG2 3.79Å
268	Y	92.1	Very high	87.1	Confident	11 Å²	11	64.4 Å²	64.4	4%	0.043	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.8	175.6	-62.7	-74	0	0	0	111.8	S154 Y156 V158 S169 V170 R171 I210 F270 T293 Y294	S154-Y268 PolarHBondContact OG-OH 3.36Å; Y156-Y268 PolarHBondContact O-OH 2.86Å; V158-Y268 HydrophobicContact CG1-CE1 4.2Å; V158-Y268 HydrophobicContact CG1-CE2 4.44Å; V158-Y268 HydrophobicContact CG2-CD2 3.9Å; V158-Y268 HydrophobicContact CG2-CE2 3.55Å; S169-Y268 PolarHBondContact O-OH 3.14Å; S169-Y268 VanDerWaalsContact O-OH 3.11Å; V170-Y268 WeakPolarHBondContact CA-OH 3.47Å; R171-Y268 HydrophobicContact CB-CD1 4.31Å; R171-Y268 HydrophobicContact CB-CD2 4.33Å; R171-Y268 HydrophobicContact CB-CE1 4.14Å; R171-Y268 HydrophobicContact CB-CE2 4.12Å; R171-Y268 HydrophobicContact CB-CG 4.42Å; R171-Y268 VanDerWaalsContact CZ-CB 3.46Å; R171-Y268 PolarHBondContact N-OH 3.11Å; I210-Y268 HydrophobicContact CD1-CD2 3.95Å; I210-Y268 HydrophobicContact CD1-CG 4.41Å; I210-Y268 HydrophobicContact CG1-CD2 4.04Å; I210-Y268 HydrophobicContact CG2-CD2 4.12Å; I210-Y268 HydrophobicContact CG2-CE2 4.29Å; Y268-F270 PolarHBondContact O-N 2.94Å; Y268-T293 HydrophobicContact CD1-CG2 3.69Å; Y268-T293 HydrophobicContact CE1-CG2 3.83Å; Y268-Y294 WeakPolarHBondContact O-CE1 3.31Å
269	E	86.2	Confident	86.8	Confident	37 Å²	37	73.1 Å²	73.1	17%	0.173	34%	0.343	C	S	.	.			trans	-72.5	118.8	175	-166.9	176.1	-159.7	0	0	109.3	R171 K272 R292 Y294	R171-E269 PolarHBondContact NH1-O 3.39Å; R171-E269 PolarHBondContact NH2-O 3.41Å; E269-K272 WeakPolarHBondContact OE1-CD 3.28Å; E269-K272 VanDerWaalsContact OE1-CE 3.23Å; E269-K272 WeakPolarHBondContact OE1-CE 3.49Å; E269-K272 IonicContact OE1-NZ 2.72Å; E269-K272 PolarHBondContact OE1-NZ 3.32Å; E269-R292 PolarHBondContact N-O 3.47Å; E269-Y294 HydrophobicContact CB-CD1 4.11Å
270	F	77.1	Confident	86.5	Confident	97 Å²	97	77.9 Å²	77.9	43%	0.425	37%	0.368	S	S	.	.			trans	-103.4	-39.3	179.8	-170.4	-95.1	0	0	0	112.4	Y268 K272 L273	Y268-F270 PolarHBondContact O-N 2.94Å; F270-K272 PolarHBondContact O-N 2.57Å; F270-L273 WeakPolarHBondContact O-CB 3.41Å; F270-L273 PolarHBondContact O-N 3.43Å
271	E	67.9	Low	86.2	Confident	176 Å²	176	75.1 Å²	75.1	82%	0.822	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.4	-171.4	-63.8	-177.7	168.3	0	0	113.9
272	K	68	Low	85.9	Confident	105 Å²	105	79.1 Å²	79.1	46%	0.457	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-4.8	-179.2	-60.1	-170.2	-171.4	134.8	0	114.4	E269 F270 K289	E269-K272 WeakPolarHBondContact OE1-CD 3.28Å; E269-K272 VanDerWaalsContact OE1-CE 3.23Å; E269-K272 WeakPolarHBondContact OE1-CE 3.49Å; E269-K272 IonicContact OE1-NZ 2.72Å; E269-K272 PolarHBondContact OE1-NZ 3.32Å; F270-K272 PolarHBondContact O-N 2.57Å; K272-K289 HydrophobicContact CB-CD 3.52Å; K272-K289 WeakPolarHBondContact O-CD 3.38Å; K272-K289 PolarHBondContact O-NZ 2.89Å
273	L	79.3	Confident	85.4	Confident	3 Å²	3	85.1 Å²	85.1	2%	0.016	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-37.2	-176.4	-171.4	71.2	0	0	0	111.5	P208 F270 L285 D286 K289 F290	P208-L273 HydrophobicContact CB-CD2 3.79Å; P208-L273 HydrophobicContact CG-CD2 3.93Å; F270-L273 WeakPolarHBondContact O-CB 3.41Å; F270-L273 PolarHBondContact O-N 3.43Å; L273-L285 HydrophobicContact CD2-CD2 4.49Å; L273-L285 HydrophobicContact CG-CD2 4.17Å; L273-L285 CarbonylContact O-C 3.55Å; L273-L285 WeakPolarHBondContact O-CA 3.3Å; L273-D286 WeakPolarHBondContact CD1-O 3.4Å; L273-D286 PolarHBondContact O-N 2.84Å; L273-K289 HydrophobicContact CD1-CB 4.46Å; L273-F290 HydrophobicContact CD1-CB 4.39Å
274	M	81.6	Confident	85	Confident	75 Å²	75	87.7 Å²	87.7	37%	0.369	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	111.1	-176.9	-174.4	170.7	62.8	0	0	109.6	F283 Q284 L285	M274-F283 HydrophobicContact CE-CD1 4.41Å; M274-F283 HydrophobicContact CG-CB 4.1Å; M274-F283 HydrophobicContact CG-CD1 3.82Å; M274-F283 HydrophobicContact CG-CG 4.34Å; M274-F283 HydrophobicContact SD-CB 4.24Å; M274-F283 HydrophobicContact SD-CD1 3.88Å; M274-F283 HydrophobicContact SD-CG 4.21Å; M274-Q284 WeakPolarHBondContact CA-O 3.47Å; M274-L285 HydrophobicContact CB-CD2 4.03Å; M274-L285 HydrophobicContact CG-CD2 4.34Å
275	T	83.7	Confident	84.6	Confident	70 Å²	70	88 Å²	88	43%	0.429	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.9	177.1	-56.4	0	0	0	0	109.4	Q277 Q284	T275-Q277 PolarHBondContact O-N 3.36Å; T275-Q284 PolarHBondContact N-O 3.49Å; T275-Q284 PolarHBondContact O-N 3.11Å
276	Y	85.6	Confident	84.3	Confident	122 Å²	122	89.8 Å²	89.8	48%	0.478	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	115.3	172.7	-176.6	-104.5	0	0	0	110.2	K278 G281 F283	Y276-K278 HydrophobicContact CD1-CG 4.12Å; Y276-K278 HydrophobicContact CE1-CG 4.2Å; Y276-K278 PolarHBondContact O-N 2.91Å; Y276-G281 WeakPolarHBondContact CE2-O 3.5Å; Y276-G281 WeakPolarHBondContact OH-CA 3.23Å; Y276-F283 AromaticContact CD2-CD1 3.92Å; Y276-F283 HydrophobicContact CD2-CD1 3.92Å; Y276-F283 HydrophobicContact CD2-CD2 4.29Å; Y276-F283 AromaticContact CD2-CE1 3.68Å; Y276-F283 HydrophobicContact CD2-CE1 3.68Å; Y276-F283 HydrophobicContact CD2-CE2 4.05Å; Y276-F283 HydrophobicContact CD2-CG 4.23Å; Y276-F283 AromaticContact CD2-CZ 3.75Å; Y276-F283 HydrophobicContact CD2-CZ 3.75Å; Y276-F283 HydrophobicContact CE2-CE2 4.32Å; Y276-F283 HydrophobicContact CE2-CZ 4.3Å; Y276-F283 HydrophobicContact CG-CE1 4.28Å
277	Q	85.6	Confident	83.9	Confident	67 Å²	67	90.3 Å²	90.3	31%	0.313	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	101.2	176.6	-68.5	-170.8	-31.8	0	0	110.2	T275 K279 N280 G281 L282 Q284	T275-Q277 PolarHBondContact O-N 3.36Å; Q277-K279 PolarHBondContact O-N 2.78Å; Q277-K279 VanDerWaalsContact O-N 3.08Å; Q277-N280 PolarHBondContact O-N 2.97Å; Q277-G281 PolarHBondContact O-N 3.46Å; Q277-L282 WeakPolarHBondContact CB-O 3.34Å; Q277-L282 PolarHBondContact N-O 2.9Å; Q277-Q284 HydrophobicContact CG-CB 3.9Å; Q277-Q284 VanDerWaalsContact NE2-CD 3.35Å
278	K	84.1	Confident	83.6	Confident	193 Å²	193	89.4 Å²	89.4	84%	0.839	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.2	177.4	-67.3	-173.4	178.8	-176.9	0	114	Y276	Y276-K278 HydrophobicContact CD1-CG 4.12Å; Y276-K278 HydrophobicContact CE1-CG 4.2Å; Y276-K278 PolarHBondContact O-N 2.91Å
279	K	86	Confident	83.4	Confident	201 Å²	201	90.8 Å²	90.8	87%	0.874	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-40.4	-178.4	-68.4	-173	177.1	-175.6	0	113.3	Q277	Q277-K279 PolarHBondContact O-N 2.78Å; Q277-K279 VanDerWaalsContact O-N 3.08Å
280	N	86.6	Confident	83.6	Confident	114 Å²	114	89 Å²	89	61%	0.61	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-4.2	-173.4	-62.2	13.7	0	0	0	112.3	Q277 L282	Q277-N280 PolarHBondContact O-N 2.97Å; N280-L282 HydrophobicContact CB-CD1 4.26Å; N280-L282 HydrophobicContact CB-CG 4.34Å; N280-L282 PolarHBondContact O-N 3.35Å
281	G	86.4	Confident	84.3	Confident	38 Å²	38	87.6 Å²	87.6	39%	0.392	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	11.4	-175.7	0	0	0	0	0	114.6	Y276 Q277	Y276-G281 WeakPolarHBondContact CE2-O 3.5Å; Y276-G281 WeakPolarHBondContact OH-CA 3.23Å; Q277-G281 PolarHBondContact O-N 3.46Å
282	L	85.9	Confident	85.5	Confident	109 Å²	109	85.3 Å²	85.3	57%	0.571	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.8	-175.2	-64.7	172.5	0	0	0	111.7	Q277 N280	Q277-L282 WeakPolarHBondContact CB-O 3.34Å; Q277-L282 PolarHBondContact N-O 2.9Å; N280-L282 HydrophobicContact CB-CD1 4.26Å; N280-L282 HydrophobicContact CB-CG 4.34Å; N280-L282 PolarHBondContact O-N 3.35Å
283	F	85.8	Confident	86.8	Confident	136 Å²	136	82.1 Å²	82.1	60%	0.596	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	121.7	167.4	-68.7	-83.6	0	0	0	109.8	M274 Y276	M274-F283 HydrophobicContact CE-CD1 4.41Å; M274-F283 HydrophobicContact CG-CB 4.1Å; M274-F283 HydrophobicContact CG-CD1 3.82Å; M274-F283 HydrophobicContact CG-CG 4.34Å; M274-F283 HydrophobicContact SD-CB 4.24Å; M274-F283 HydrophobicContact SD-CD1 3.88Å; M274-F283 HydrophobicContact SD-CG 4.21Å; Y276-F283 AromaticContact CD2-CD1 3.92Å; Y276-F283 HydrophobicContact CD2-CD1 3.92Å; Y276-F283 HydrophobicContact CD2-CD2 4.29Å; Y276-F283 AromaticContact CD2-CE1 3.68Å; Y276-F283 HydrophobicContact CD2-CE1 3.68Å; Y276-F283 HydrophobicContact CD2-CE2 4.05Å; Y276-F283 HydrophobicContact CD2-CG 4.23Å; Y276-F283 AromaticContact CD2-CZ 3.75Å; Y276-F283 HydrophobicContact CD2-CZ 3.75Å; Y276-F283 HydrophobicContact CE2-CE2 4.32Å; Y276-F283 HydrophobicContact CE2-CZ 4.3Å; Y276-F283 HydrophobicContact CG-CE1 4.28Å
284	Q	85.6	Confident	87.4	Confident	98 Å²	98	86.6 Å²	86.6	46%	0.458	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.9	173.6	-173.1	-175.3	11.8	0	0	109.7	M274 T275 Q277	M274-Q284 WeakPolarHBondContact CA-O 3.47Å; T275-Q284 PolarHBondContact N-O 3.49Å; T275-Q284 PolarHBondContact O-N 3.11Å; Q277-Q284 HydrophobicContact CG-CB 3.9Å; Q277-Q284 VanDerWaalsContact NE2-CD 3.35Å
285	L	87	Confident	88	Confident	42 Å²	42	87.7 Å²	87.7	22%	0.22	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.7	170.6	-74.7	165	0	0	0	110	W207 P208 L273 M274 Y287	W207-L285 HydrophobicContact CB-CD1 4.43Å; P208-L285 HydrophobicContact CG-CD2 4.35Å; L273-L285 HydrophobicContact CD2-CD2 4.49Å; L273-L285 HydrophobicContact CG-CD2 4.17Å; L273-L285 CarbonylContact O-C 3.55Å; L273-L285 WeakPolarHBondContact O-CA 3.3Å; M274-L285 HydrophobicContact CB-CD2 4.03Å; M274-L285 HydrophobicContact CG-CD2 4.34Å; L285-Y287 HydrophobicContact CB-CE2 4.06Å; L285-Y287 PolarHBondContact O-N 3.37Å
286	D	87.3	Confident	88.5	Confident	46 Å²	46	86.2 Å²	86.2	25%	0.246	42%	0.42	C	S	.	.			trans	-94.7	90.2	177.1	-177.1	4	0	0	0	110.6	L273 S288 K289	L273-D286 WeakPolarHBondContact CD1-O 3.4Å; L273-D286 PolarHBondContact O-N 2.84Å; D286-S288 PolarHBondContact O-N 3.37Å; D286-S288 VanDerWaalsContact O-N 3.1Å; D286-S288 VanDerWaalsContact OD1-CB 3.27Å; D286-S288 WeakPolarHBondContact OD1-CB 3.46Å; D286-S288 PolarHBondContact OD1-N 3.49Å; D286-S288 VanDerWaalsContact OD1-N 3.15Å; D286-S288 PolarHBondContact OD1-OG 3.09Å; D286-S288 PolarHBondContact OD2-OG 3.38Å; D286-K289 PolarHBondContact O-N 2.95Å; D286-K289 VanDerWaalsContact O-N 3.1Å; D286-K289 VanDerWaalsContact OD2-CE 3.31Å; D286-K289 WeakPolarHBondContact OD2-CE 3.41Å; D286-K289 IonicContact OD2-NZ 3.81Å; D286-K289 PolarHBondContact OD2-NZ 3.43Å
287	Y	86.5	Confident	88.8	Confident	58 Å²	58	88.6 Å²	88.6	23%	0.227	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-63	-14.5	-179.7	-70.9	-88	0	0	0	113.7	L152 D174 M175 P208 L285 K289 F290	L152-Y287 HydrophobicContact CD1-CD1 3.52Å; L152-Y287 HydrophobicContact CD1-CE1 3.86Å; L152-Y287 HydrophobicContact CD1-CG 4.47Å; D174-Y287 PolarHBondContact O-OH 2.62Å; M175-Y287 HydrophobicContact CG-CD1 4.49Å; M175-Y287 HydrophobicContact CG-CE1 4.22Å; P208-Y287 HydrophobicContact CG-CE1 4.47Å; L285-Y287 HydrophobicContact CB-CE2 4.06Å; L285-Y287 PolarHBondContact O-N 3.37Å; Y287-K289 PolarHBondContact O-N 2.83Å; Y287-F290 HydrophobicContact CD1-CB 4.5Å; Y287-F290 HydrophobicContact CD1-CD2 4.07Å; Y287-F290 HydrophobicContact CD1-CG 4.49Å; Y287-F290 HydrophobicContact CE1-CD2 4.43Å; Y287-F290 WeakPolarHBondContact O-CB 3.06Å; Y287-F290 PolarHBondContact O-N 3.4Å
288	S	87.3	Confident	89	Confident	80 Å²	80	86.1 Å²	86.1	56%	0.559	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-63.7	-21.4	173.4	75.7	0	0	0	0	112.9	D286	D286-S288 PolarHBondContact O-N 3.37Å; D286-S288 VanDerWaalsContact O-N 3.1Å; D286-S288 VanDerWaalsContact OD1-CB 3.27Å; D286-S288 WeakPolarHBondContact OD1-CB 3.46Å; D286-S288 PolarHBondContact OD1-N 3.49Å; D286-S288 VanDerWaalsContact OD1-N 3.15Å; D286-S288 PolarHBondContact OD1-OG 3.09Å; D286-S288 PolarHBondContact OD2-OG 3.38Å
289	K	87.8	Confident	89.2	Confident	39 Å²	39	78.6 Å²	78.6	17%	0.17	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-102	3.6	177.3	-58.2	-179.5	-171.7	119.7	0	112.8	K272 L273 D286 Y287 H291 R292	K272-K289 HydrophobicContact CB-CD 3.52Å; K272-K289 WeakPolarHBondContact O-CD 3.38Å; K272-K289 PolarHBondContact O-NZ 2.89Å; L273-K289 HydrophobicContact CD1-CB 4.46Å; D286-K289 PolarHBondContact O-N 2.95Å; D286-K289 VanDerWaalsContact O-N 3.1Å; D286-K289 VanDerWaalsContact OD2-CE 3.31Å; D286-K289 WeakPolarHBondContact OD2-CE 3.41Å; D286-K289 IonicContact OD2-NZ 3.81Å; D286-K289 PolarHBondContact OD2-NZ 3.43Å; Y287-K289 PolarHBondContact O-N 2.83Å; K289-H291 VanDerWaalsContact C-N 3.29Å; K289-H291 PolarHBondContact O-N 2.86Å; K289-R292 HydrophobicContact CB-CG 4.49Å; K289-R292 PolarHBondContact O-N 3.26Å
290	F	90.9	Very high	89.4	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-42	-176.4	-177	-90.9	0	0	0	112	L152 R171 P208 L273 Y287	L152-F290 HydrophobicContact CB-CE1 3.91Å; L152-F290 HydrophobicContact CB-CE2 4.48Å; L152-F290 HydrophobicContact CB-CZ 3.88Å; R171-F290 HydrophobicContact CB-CZ 4.46Å; R171-F290 WeakPolarHBondContact CD-O 3.39Å; R171-F290 HydrophobicContact CG-CD2 4.44Å; R171-F290 HydrophobicContact CG-CE1 4.34Å; R171-F290 HydrophobicContact CG-CE2 3.83Å; R171-F290 HydrophobicContact CG-CZ 3.77Å; R171-F290 PolarHBondContact NH1-O 3.35Å; P208-F290 HydrophobicContact CB-CD2 4.12Å; P208-F290 HydrophobicContact CB-CE2 3.74Å; P208-F290 HydrophobicContact CG-CD2 4.02Å; P208-F290 HydrophobicContact CG-CE2 3.89Å; L273-F290 HydrophobicContact CD1-CB 4.39Å; Y287-F290 HydrophobicContact CD1-CB 4.5Å; Y287-F290 HydrophobicContact CD1-CD2 4.07Å; Y287-F290 HydrophobicContact CD1-CG 4.49Å; Y287-F290 HydrophobicContact CE1-CD2 4.43Å; Y287-F290 WeakPolarHBondContact O-CB 3.06Å; Y287-F290 PolarHBondContact O-N 3.4Å
291	H	92.4	Very high	89.5	Confident	67 Å²	67	72.3 Å²	72.3	31%	0.31	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-6.9	-177.7	-52.4	-85.1	0	0	0	113.8	F153 E155 K289	F153-H291 PolarHBondContact O-CE1 3.4Å; E155-H291 HydrophobicContact CB-CB 4.28Å; E155-H291 PolarHBondContact N-ND1 3.17Å; E155-H291 VanDerWaalsContact N-ND1 3.16Å; K289-H291 VanDerWaalsContact C-N 3.29Å; K289-H291 PolarHBondContact O-N 2.86Å
292	R	92.5	Very high	89.7	Confident	129 Å²	129	70.6 Å²	70.6	49%	0.487	36%	0.358	S	S	.	.			trans	-71.5	135.1	-173.3	-68.6	-174.1	-174.6	-166.4	-1.4	112.1	E269 K289	E269-R292 PolarHBondContact N-O 3.47Å; K289-R292 HydrophobicContact CB-CG 4.49Å; K289-R292 PolarHBondContact O-N 3.26Å
293	T	93.9	Very high	89.9	Confident	37 Å²	37	65.8 Å²	65.8	23%	0.227	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.8	174.3	67.7	0	0	0	0	109.8	V158 L263 H266 R267 Y268	V158-T293 HydrophobicContact CG1-CG2 3.6Å; L263-T293 HydrophobicContact CD1-CG2 4.48Å; H266-T293 PolarHBondContact ND1-OG1 3.5Å; R267-T293 CarbonylContact O-C 3.54Å; R267-T293 VanDerWaalsContact O-CA 3.22Å; R267-T293 WeakPolarHBondContact O-CA 3.38Å; R267-T293 WeakPolarHBondContact O-CB 3.4Å; Y268-T293 HydrophobicContact CD1-CG2 3.69Å; Y268-T293 HydrophobicContact CE1-CG2 3.83Å
294	Y	93.7	Very high	90.1	Very high	98 Å²	98	61.7 Å²	61.7	38%	0.384	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.2	174	66.1	-84	0	0	0	110.1	H266 R267 Y268 E269 V296	H266-Y294 CarbonylContact C-O 3.51Å; H266-Y294 WeakPolarHBondContact CA-O 3.21Å; R267-Y294 HydrophobicContact CB-CD1 4.49Å; R267-Y294 HydrophobicContact CB-CE1 3.82Å; R267-Y294 HydrophobicContact CB-CE2 4.27Å; R267-Y294 PolarHBondContact N-O 2.96Å; R267-Y294 VanDerWaalsContact O-CD1 3.23Å; R267-Y294 WeakPolarHBondContact O-CD1 3.18Å; R267-Y294 PolarHBondContact O-N 3.11Å; Y268-Y294 WeakPolarHBondContact O-CE1 3.31Å; E269-Y294 HydrophobicContact CB-CD1 4.11Å; Y294-V296 HydrophobicContact CD2-CG2 3.63Å; Y294-V296 HydrophobicContact CE2-CG2 3.23Å
295	P	94.4	Very high	90.2	Very high	97 Å²	97	59.3 Å²	59.3	63%	0.63	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	143.7	178.9	29.5	-34.7	0	0	0	111.2	G265	G265-P295 CarbonylContact O-C 3.55Å; G265-P295 WeakPolarHBondContact O-CA 3.17Å
296	V	93.8	Very high	90.2	Very high	39 Å²	39	58.3 Å²	58.3	24%	0.236	30%	0.302	C	S	.	.			trans	-138.9	138.9	-179.7	179.7	0	0	0	0	109.1	G265 R267 Y294 T298	G265-V296 PolarHBondContact O-N 3.24Å; R267-V296 HydrophobicContact CB-CG2 3.96Å; R267-V296 HydrophobicContact CG-CB 4.35Å; R267-V296 HydrophobicContact CG-CG2 3.79Å; Y294-V296 HydrophobicContact CD2-CG2 3.63Å; Y294-V296 HydrophobicContact CE2-CG2 3.23Å; V296-T298 PolarHBondContact O-N 2.99Å; V296-T298 PolarHBondContact O-OG1 2.77Å
297	L	91.3	Very high	90	Very high	172 Å²	172	57 Å²	57	90%	0.901	30%	0.3	S	S	*	.			trans	-58.3	105.9	176.5	-168.3	73	0	0	0	110.5
298	T	89.7	Confident	89.9	Confident	15 Å²	15	59.9 Å²	59.9	9%	0.092	31%	0.313	C	S	.	.			trans	-131.2	136.5	-179.8	-58.2	0	0	0	0	108.1	R161 L166 G265 V296	R161-T298 HydrophobicContact CB-CG2 4.42Å; L166-T298 HydrophobicContact CD2-CG2 3.73Å; G265-T298 WeakPolarHBondContact CA-OG1 3.47Å; V296-T298 PolarHBondContact O-N 2.99Å; V296-T298 PolarHBondContact O-OG1 2.77Å
299	P	88.6	Confident	89.7	Confident	35 Å²	35	62.4 Å²	62.4	23%	0.227	31%	0.312	C	S	.	.			trans	-57.2	140.4	176.2	-22.3	32.3	0	0	0	111.6	W264 L301 F306	W264-P299 WeakPolarHBondContact CZ2-O 3.36Å; W264-P299 PolarHBondContact NE1-O 3.23Å; P299-L301 HydrophobicContact CB-CB 4.45Å; P299-L301 PolarHBondContact O-N 2.98Å; P299-F306 HydrophobicContact CB-CD2 4.03Å; P299-F306 HydrophobicContact CB-CE2 4.36Å; P299-F306 HydrophobicContact CG-CD2 3.68Å; P299-F306 HydrophobicContact CG-CE2 3.52Å; P299-F306 HydrophobicContact CG-CZ 4.44Å
300	N	89.8	Confident	89.3	Confident	115 Å²	115	62.9 Å²	62.9	62%	0.615	32%	0.319	S	S	*	.	S	Bend	trans	-83.8	9.8	174.5	-68.9	-22.8	0	0	0	113.1	A226	A226-N300 HydrophobicContact CB-CB 3.93Å; A226-N300 PolarHBondContact N-O 2.85Å
301	L	89.6	Confident	88.7	Confident	68 Å²	68	67.9 Å²	67.9	36%	0.356	35%	0.346	S	S	.	.	S	Bend	trans	-83.7	159.1	-178.1	-62.2	170.6	0	0	0	110.9	W264 P299 D305	W264-L301 VanDerWaalsContact CZ2-O 3.28Å; W264-L301 WeakPolarHBondContact CZ2-O 3.48Å; P299-L301 HydrophobicContact CB-CB 4.45Å; P299-L301 PolarHBondContact O-N 2.98Å; L301-D305 HydrophobicContact CB-CB 4.11Å; L301-D305 HydrophobicContact CD2-CB 4.43Å
302	S	90.9	Very high	88	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.014	35%	0.347	C	S	.	.			trans	-66.8	162.8	169.2	63.2	0	0	0	0	110.6	F224 E304 D305 F306	F224-S302 VanDerWaalsContact O-CA 3.3Å; F224-S302 WeakPolarHBondContact O-CA 3.19Å; S302-E304 PolarHBondContact O-N 3.02Å; S302-D305 PolarHBondContact O-N 3.47Å; S302-D305 WeakPolarHBondContact OG-CB 3.39Å; S302-D305 VanDerWaalsContact OG-CG 3.28Å; S302-D305 PolarHBondContact OG-N 3.1Å; S302-D305 VanDerWaalsContact OG-N 3.15Å; S302-D305 PolarHBondContact OG-OD2 3.45Å; S302-F306 WeakPolarHBondContact O-CB 3.42Å; S302-F306 PolarHBondContact O-N 2.91Å
303	A	89	Confident	87.3	Confident	9 Å²	9	64.3 Å²	64.3	7%	0.074	34%	0.342	C	S	.	.	H	α-helix	trans	-62.9	-33.9	176	0	0	0	0	0	111.7	L166 I215 Y222 F306 G307	L166-A303 HydrophobicContact CD1-CB 4.16Å; I215-A303 HydrophobicContact CB-CB 4.22Å; I215-A303 HydrophobicContact CG2-CB 3.64Å; I215-A303 WeakPolarHBondContact O-CB 3.35Å; Y222-A303 HydrophobicContact CD2-CB 3.64Å; Y222-A303 HydrophobicContact CE2-CB 4.02Å; Y222-A303 PolarHBondContact O-N 3.17Å; Y222-A303 VanDerWaalsContact O-N 3.14Å; A303-F306 PolarHBondContact O-N 3.33Å; A303-G307 PolarHBondContact O-N 2.99Å
304	E	89.9	Confident	86.5	Confident	49 Å²	49	65.4 Å²	65.4	23%	0.229	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-53.8	172.6	-173.1	-170.8	175.7	0	0	112.8	Y222 H223 S302 F306 G307 K308	Y222-E304 HydrophobicContact CD1-CB 3.99Å; Y222-E304 HydrophobicContact CE1-CB 3.5Å; Y222-E304 VanDerWaalsContact CE1-CB 3.5Å; Y222-E304 HydrophobicContact CE1-CG 3.68Å; Y222-E304 HydrophobicContact CE2-CB 4.16Å; Y222-E304 VanDerWaalsContact CZ-CA 3.43Å; Y222-E304 PolarHBondContact O-N 2.99Å; Y222-E304 WeakPolarHBondContact OH-CA 3.26Å; H223-E304 IonicContact CE1-OE2 3.86Å; H223-E304 PolarHBondContact CE1-OE2 2.99Å; H223-E304 IonicContact ND1-OE2 3.46Å; H223-E304 PolarHBondContact ND1-OE2 3.26Å; S302-E304 PolarHBondContact O-N 3.02Å; E304-F306 PolarHBondContact O-N 3.41Å; E304-G307 PolarHBondContact O-N 2.86Å; E304-K308 WeakPolarHBondContact O-CG 3.3Å; E304-K308 PolarHBondContact O-N 3.4Å; E304-K308 WeakPolarHBondContact OE1-CE 3.46Å; E304-K308 IonicContact OE1-NZ 3.03Å; E304-K308 PolarHBondContact OE1-NZ 3.46Å
305	D	88.9	Confident	85.6	Confident	49 Å²	49	64.9 Å²	64.9	26%	0.262	36%	0.362	S	S	.	.	H	α-helix	trans	-64.5	-35.2	-179.3	-72.7	-19.7	0	0	0	110.2	K225 L301 S302 Y309	K225-D305 WeakPolarHBondContact CE-OD2 3.35Å; K225-D305 IonicContact NZ-OD2 2.86Å; K225-D305 PolarHBondContact NZ-OD2 3.31Å; L301-D305 HydrophobicContact CB-CB 4.11Å; L301-D305 HydrophobicContact CD2-CB 4.43Å; S302-D305 PolarHBondContact O-N 3.47Å; S302-D305 WeakPolarHBondContact OG-CB 3.39Å; S302-D305 VanDerWaalsContact OG-CG 3.28Å; S302-D305 PolarHBondContact OG-N 3.1Å; S302-D305 VanDerWaalsContact OG-N 3.15Å; S302-D305 PolarHBondContact OG-OD2 3.45Å; D305-Y309 VanDerWaalsContact O-CB 3.28Å; D305-Y309 WeakPolarHBondContact O-CB 3.2Å; D305-Y309 PolarHBondContact O-N 3.36Å
306	F	86	Confident	84.6	Confident	20 Å²	20	67.9 Å²	67.9	9%	0.088	37%	0.365	C	S	.	.	H	α-helix	trans	-67.7	-41.7	176.2	-174.9	-106.3	0	0	0	112.6	R161 R164 P299 S302 A303 E304 Y309 S310	R161-F306 HydrophobicContact CG-CZ 4.39Å; R164-F306 VanDerWaalsContact O-CE1 3.3Å; R164-F306 WeakPolarHBondContact O-CE1 3.44Å; P299-F306 HydrophobicContact CB-CD2 4.03Å; P299-F306 HydrophobicContact CB-CE2 4.36Å; P299-F306 HydrophobicContact CG-CD2 3.68Å; P299-F306 HydrophobicContact CG-CE2 3.52Å; P299-F306 HydrophobicContact CG-CZ 4.44Å; S302-F306 WeakPolarHBondContact O-CB 3.42Å; S302-F306 PolarHBondContact O-N 2.91Å; A303-F306 PolarHBondContact O-N 3.33Å; E304-F306 PolarHBondContact O-N 3.41Å; F306-Y309 PolarHBondContact O-N 3.42Å; F306-S310 WeakPolarHBondContact O-CB 3.38Å; F306-S310 PolarHBondContact O-N 3.1Å; F306-S310 PolarHBondContact O-OG 3.3Å
307	G	83.2	Confident	83.5	Confident	20 Å²	20	70.5 Å²	70.5	21%	0.206	38%	0.381	C	S	.	.	H	α-helix	trans	-58.6	-53.5	173.8	0	0	0	0	0	111.4	A303 E304 Y309 S310 D311	A303-G307 PolarHBondContact O-N 2.99Å; E304-G307 PolarHBondContact O-N 2.86Å; G307-Y309 VanDerWaalsContact C-N 3.3Å; G307-Y309 PolarHBondContact O-N 3.14Å; G307-S310 PolarHBondContact O-N 3.32Å; G307-S310 PolarHBondContact O-OG 3.08Å; G307-D311 PolarHBondContact O-N 2.74Å
308	K	84.1	Confident	82.1	Confident	118 Å²	118	65.3 Å²	65.3	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-56.5	-42.3	176.4	-68.3	175	-172.8	167.4	0	112.4	E304 S312	E304-K308 WeakPolarHBondContact O-CG 3.3Å; E304-K308 PolarHBondContact O-N 3.4Å; E304-K308 WeakPolarHBondContact OE1-CE 3.46Å; E304-K308 IonicContact OE1-NZ 3.03Å; E304-K308 PolarHBondContact OE1-NZ 3.46Å; K308-S312 WeakPolarHBondContact O-CB 3.47Å; K308-S312 PolarHBondContact O-N 3.04Å
309	Y	82.8	Confident	80.5	Confident	133 Å²	133	71.7 Å²	71.7	52%	0.522	40%	0.403	S	S	.	.	H	α-helix	trans	-64.3	-43	176.9	-175.2	-103.2	0	0	0	111.7	D305 F306 G307 S312 I313	D305-Y309 VanDerWaalsContact O-CB 3.28Å; D305-Y309 WeakPolarHBondContact O-CB 3.2Å; D305-Y309 PolarHBondContact O-N 3.36Å; F306-Y309 PolarHBondContact O-N 3.42Å; G307-Y309 VanDerWaalsContact C-N 3.3Å; G307-Y309 PolarHBondContact O-N 3.14Å; Y309-S312 PolarHBondContact O-N 3.23Å; Y309-S312 PolarHBondContact O-OG 3.11Å; Y309-I313 HydrophobicContact CD1-CD1 3.85Å; Y309-I313 HydrophobicContact CE1-CD1 3.3Å; Y309-I313 HydrophobicContact CE1-CG1 4.39Å; Y309-I313 HydrophobicContact CE2-CD1 4.42Å; Y309-I313 PolarHBondContact O-N 3.07Å; Y309-I313 VanDerWaalsContact O-N 3.16Å
310	S	79.3	Confident	78.5	Confident	48 Å²	48	78.1 Å²	78.1	34%	0.336	44%	0.441	S	S	.	.	H	α-helix	trans	-64.9	-39.7	178.2	73.2	0	0	0	0	112.9	F306 G307 I313 A314	F306-S310 WeakPolarHBondContact O-CB 3.38Å; F306-S310 PolarHBondContact O-N 3.1Å; F306-S310 PolarHBondContact O-OG 3.3Å; G307-S310 PolarHBondContact O-N 3.32Å; G307-S310 PolarHBondContact O-OG 3.08Å; S310-I313 PolarHBondContact O-N 2.99Å; S310-A314 PolarHBondContact O-N 3.21Å
311	D	78.5	Confident	77.9	Confident	105 Å²	105	76.3 Å²	76.3	56%	0.561	43%	0.433	S	S	*	.	H	α-helix	trans	-67.7	-36.9	176.3	-66.1	-25.2	0	0	0	111.6	G307 I313 A314 T315	G307-D311 PolarHBondContact O-N 2.74Å; D311-I313 VanDerWaalsContact C-N 3.29Å; D311-I313 PolarHBondContact O-N 2.03Å; D311-A314 PolarHBondContact O-N 3.24Å; D311-T315 WeakPolarHBondContact O-CG2 3.43Å; D311-T315 PolarHBondContact O-N 3.47Å; D311-T315 PolarHBondContact O-OG1 3.1Å
312	S	78.6	Confident	77.3	Confident	46 Å²	46	76.7 Å²	76.7	32%	0.322	44%	0.437	S	S	.	.	H	α-helix	trans	-65.9	-30.5	175.9	80.4	0	0	0	0	113.1	K308 Y309 T315 K316	K308-S312 WeakPolarHBondContact O-CB 3.47Å; K308-S312 PolarHBondContact O-N 3.04Å; Y309-S312 PolarHBondContact O-N 3.23Å; Y309-S312 PolarHBondContact O-OG 3.11Å; S312-T315 WeakPolarHBondContact CA-OG1 3.32Å; S312-T315 PolarHBondContact O-OG1 3.18Å; S312-T315 VanDerWaalsContact O-OG1 3.09Å; S312-K316 WeakPolarHBondContact O-CG 3.05Å; S312-K316 PolarHBondContact O-N 2.87Å
313	I	77.9	Confident	76.5	Confident	75 Å²	75	80.9 Å²	80.9	39%	0.385	46%	0.46	S	S	.	.	H	α-helix	trans	-77.7	-43.6	174.9	-69.3	174	0	0	0	109.9	Y309 S310 D311 T315 K316 V317	Y309-I313 HydrophobicContact CD1-CD1 3.85Å; Y309-I313 HydrophobicContact CE1-CD1 3.3Å; Y309-I313 HydrophobicContact CE1-CG1 4.39Å; Y309-I313 HydrophobicContact CE2-CD1 4.42Å; Y309-I313 PolarHBondContact O-N 3.07Å; Y309-I313 VanDerWaalsContact O-N 3.16Å; S310-I313 PolarHBondContact O-N 2.99Å; D311-I313 VanDerWaalsContact C-N 3.29Å; D311-I313 PolarHBondContact O-N 2.03Å; I313-T315 VanDerWaalsContact C-N 3.31Å; I313-T315 PolarHBondContact O-N 3.42Å; I313-K316 PolarHBondContact O-N 3.15Å; I313-V317 HydrophobicContact CG2-CG2 4.35Å; I313-V317 WeakPolarHBondContact O-CG2 3.06Å; I313-V317 PolarHBondContact O-N 3.42Å
314	A	76.6	Confident	75.8	Confident	61 Å²	61	85.1 Å²	85.1	50%	0.504	48%	0.483	S	S	.	.	H	α-helix	trans	-59.8	-41.7	178.5	0	0	0	0	0	112.1	S310 D311 V317 G318	S310-A314 PolarHBondContact O-N 3.21Å; D311-A314 PolarHBondContact O-N 3.24Å; A314-V317 PolarHBondContact O-N 3.41Å; A314-G318 PolarHBondContact O-N 3.33Å
315	T	75.3	Confident	74.9	Confident	87 Å²	87	87.4 Å²	87.4	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-34.8	176	44.6	0	0	0	0	113.3	D311 S312 I313 N319	D311-T315 WeakPolarHBondContact O-CG2 3.43Å; D311-T315 PolarHBondContact O-N 3.47Å; D311-T315 PolarHBondContact O-OG1 3.1Å; S312-T315 WeakPolarHBondContact CA-OG1 3.32Å; S312-T315 PolarHBondContact O-OG1 3.18Å; S312-T315 VanDerWaalsContact O-OG1 3.09Å; I313-T315 VanDerWaalsContact C-N 3.31Å; I313-T315 PolarHBondContact O-N 3.42Å; T315-N319 PolarHBondContact O-N 3Å
316	K	72.5	Confident	74	Confident	160 Å²	160	89.9 Å²	89.9	70%	0.696	52%	0.515	S	S	*	.	H	α-helix	trans	-69.5	-36.6	174.8	-78.2	-179	179.7	-176.6	0	113.2	S312 I313	S312-K316 WeakPolarHBondContact O-CG 3.05Å; S312-K316 PolarHBondContact O-N 2.87Å; I313-K316 PolarHBondContact O-N 3.15Å
317	V	72.1	Confident	73.1	Confident	94 Å²	94	94.9 Å²	94.9	57%	0.57	55%	0.545	S	S	*	.	H	α-helix	trans	-79.6	-29.7	179.4	177.8	0	0	0	0	111.8	I313 A314 N319 T320	I313-V317 HydrophobicContact CG2-CG2 4.35Å; I313-V317 WeakPolarHBondContact O-CG2 3.06Å; I313-V317 PolarHBondContact O-N 3.42Å; A314-V317 PolarHBondContact O-N 3.41Å; V317-N319 VanDerWaalsContact C-N 3.31Å; V317-T320 PolarHBondContact O-OG1 3.33Å
318	G	61.5	Low	72.3	Confident	62 Å²	62	100.7 Å²	100.7	64%	0.639	57%	0.571	S	S	*	*	H	α-helix	trans	-76.2	-14.3	176.5	0	0	0	0	0	115	A314	A314-G318 PolarHBondContact O-N 3.33Å
319	N	55.3	Low	71.4	Confident	150 Å²	150	99.3 Å²	99.3	80%	0.802	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	11.3	178.3	-80.8	-7.9	0	0	0	113.4	T315 V317	T315-N319 PolarHBondContact O-N 3Å; V317-N319 VanDerWaalsContact C-N 3.31Å
320	T	45.9	Very low	70.3	Confident	170 Å²	170	96.2 Å²	96.2	100%	1.043	58%	0.581	S	S	*	*			trans	-116	0	171.5	48.3	0	0	0	0	110.3	V317	V317-T320 PolarHBondContact O-OG1 3.33Å

Retrieved 320 of 320 residues in 132.7 ms (Link to these results)

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