A0A077Z5T6_TRITR Loading...

Probable ubiquitin carboxyl-terminal hydrolase CY LD

AlphaFold DB , UniProt , Accession A0A077Z5T6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 404 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	45.1	Very low	44.4	Very low	205 Å²	205	152.3 Å²	152.3	100%	1.01	69%	0.69	S	S	*	*				0	-43.4	0	-72.1	-63.2	178.5	0	0	115.5	R3	M1-R3 PolarHBondContact O-N 2.85Å
2	P	40.7	Very low	44.9	Very low	105 Å²	105	148.8 Å²	148.8	68%	0.682	68%	0.68	S	S	*	*	H	α-helix	trans	-71.3	-30.3	-173.5	4.3	-0.1	0	0	0	115.7	R4 R5	P2-R4 PolarHBondContact O-N 2.81Å; P2-R5 PolarHBondContact O-N 3.09Å
3	R	43.8	Very low	45.1	Very low	228 Å²	228	146.9 Å²	146.9	86%	0.86	67%	0.673	S	S	*	*	H	α-helix	trans	-62.8	-37.1	-180	-80.9	-174.8	173.8	-176.6	-1.9	113.7	M1 R5 R6 L7	M1-R3 PolarHBondContact O-N 2.85Å; R3-R5 VanDerWaalsContact C-N 3.34Å; R3-R5 PolarHBondContact O-N 2.77Å; R3-R6 PolarHBondContact O-N 3.28Å; R3-L7 PolarHBondContact O-N 3.5Å
4	R	43.7	Very low	45	Very low	212 Å²	212	146.5 Å²	146.5	80%	0.8	67%	0.672	S	S	*	*	H	α-helix	trans	-66.4	-30.5	179.6	-76.8	-173.6	175.7	-177.3	-1.3	113.4	P2 R8	P2-R4 PolarHBondContact O-N 2.81Å; R4-R8 PolarHBondContact O-N 2.86Å
5	R	45.7	Very low	45.2	Very low	214 Å²	214	148.3 Å²	148.3	81%	0.808	67%	0.671	S	S	*	*	H	α-helix	trans	-73.3	-37.2	178	-79.4	-172	175.7	-177.3	-1.1	112.8	P2 R3 A9	P2-R5 PolarHBondContact O-N 3.09Å; R3-R5 VanDerWaalsContact C-N 3.34Å; R3-R5 PolarHBondContact O-N 2.77Å; R5-A9 PolarHBondContact O-N 3.29Å
6	R	42.6	Very low	45.2	Very low	207 Å²	207	145.8 Å²	145.8	78%	0.781	66%	0.66	S	S	*	*	H	α-helix	trans	-65.9	-37.1	177.1	-73.1	-172.8	-178.6	177.5	0.3	112.3	R3 A9 A10	R3-R6 PolarHBondContact O-N 3.28Å; R6-A9 PolarHBondContact O-N 2.81Å; R6-A10 PolarHBondContact O-N 2.81Å; R6-A10 VanDerWaalsContact O-N 3.17Å
7	L	43.7	Very low	45.3	Very low	118 Å²	118	142.8 Å²	142.8	62%	0.618	65%	0.651	S	S	*	*	H	α-helix	trans	-69.5	-40.8	-179.8	-159.9	73.9	0	0	0	112.9	R3 A9 A10 I11	R3-L7 PolarHBondContact O-N 3.5Å; L7-A9 VanDerWaalsContact C-N 3.3Å; L7-A9 PolarHBondContact O-N 3.46Å; L7-A10 PolarHBondContact O-N 3.14Å; L7-I11 WeakPolarHBondContact O-CG1 3.21Å; L7-I11 PolarHBondContact O-N 3.38Å
8	R	41.9	Very low	45.4	Very low	201 Å²	201	139.2 Å²	139.2	76%	0.758	64%	0.641	S	S	*	*	H	α-helix	trans	-62.5	-36.5	174.1	-100.1	-173.6	176	-174.4	-0.6	112.6	R4 L12	R4-R8 PolarHBondContact O-N 2.86Å; R8-L12 PolarHBondContact O-N 3.26Å; R8-L12 VanDerWaalsContact O-N 3.17Å
9	A	48	Very low	45.2	Very low	54 Å²	54	141.6 Å²	141.6	45%	0.446	65%	0.645	S	S	.	*	H	α-helix	trans	-66.1	-43.5	177.2	0	0	0	0	0	111.6	R5 R6 L7 I11 L12 Q13	R5-A9 PolarHBondContact O-N 3.29Å; R6-A9 PolarHBondContact O-N 2.81Å; L7-A9 VanDerWaalsContact C-N 3.3Å; L7-A9 PolarHBondContact O-N 3.46Å; A9-I11 PolarHBondContact O-N 2.99Å; A9-L12 PolarHBondContact O-N 3.08Å; A9-Q13 WeakPolarHBondContact O-CB 3.31Å; A9-Q13 PolarHBondContact O-N 3.31Å
10	A	49.2	Very low	45	Very low	49 Å²	49	141.3 Å²	141.3	41%	0.405	64%	0.642	S	S	.	*	H	α-helix	trans	-61.4	-43.2	178	0	0	0	0	0	112.7	R6 L7 Q13 E14	R6-A10 PolarHBondContact O-N 2.81Å; R6-A10 VanDerWaalsContact O-N 3.17Å; L7-A10 PolarHBondContact O-N 3.14Å; A10-Q13 PolarHBondContact O-N 2.74Å; A10-E14 PolarHBondContact O-N 3.44Å
11	I	44.5	Very low	45	Very low	82 Å²	82	142.2 Å²	142.2	42%	0.421	65%	0.647	S	S	.	*	H	α-helix	trans	-65.9	-39.6	178.6	-64.7	168.1	0	0	0	111.7	L7 A9 Q13 R15	L7-I11 WeakPolarHBondContact O-CG1 3.21Å; L7-I11 PolarHBondContact O-N 3.38Å; A9-I11 PolarHBondContact O-N 2.99Å; I11-Q13 VanDerWaalsContact C-N 3.31Å; I11-R15 WeakPolarHBondContact O-CB 3.46Å; I11-R15 WeakPolarHBondContact O-CG 3.42Å; I11-R15 PolarHBondContact O-N 2.83Å; I11-R15 VanDerWaalsContact O-N 3.08Å
12	L	49.5	Very low	44.7	Very low	110 Å²	110	140.4 Å²	140.4	58%	0.576	63%	0.634	S	S	*	*	H	α-helix	trans	-65.8	-36.8	175.1	-80.8	163.6	0	0	0	111.4	R8 A9 R15 E16	R8-L12 PolarHBondContact O-N 3.26Å; R8-L12 VanDerWaalsContact O-N 3.17Å; A9-L12 PolarHBondContact O-N 3.08Å; L12-R15 PolarHBondContact O-N 2.96Å; L12-E16 PolarHBondContact O-N 2.81Å
13	Q	47.6	Very low	44.2	Very low	125 Å²	125	142.5 Å²	142.5	58%	0.584	63%	0.634	S	S	*	*	H	α-helix	trans	-71.1	-39.7	-179.9	-140.2	171.1	2.4	0	0	112.3	A9 A10 I11 E16 N17	A9-Q13 WeakPolarHBondContact O-CB 3.31Å; A9-Q13 PolarHBondContact O-N 3.31Å; A10-Q13 PolarHBondContact O-N 2.74Å; I11-Q13 VanDerWaalsContact C-N 3.31Å; Q13-E16 PolarHBondContact O-N 3.12Å; Q13-N17 WeakPolarHBondContact O-CB 3.42Å; Q13-N17 VanDerWaalsContact O-CG 3.24Å; Q13-N17 PolarHBondContact O-N 3.43Å; Q13-N17 PolarHBondContact O-ND2 3.09Å
14	E	44.6	Very low	43.7	Very low	141 Å²	141	142 Å²	142	66%	0.659	63%	0.633	S	S	*	*	H	α-helix	trans	-62.3	-44.6	170.3	-97.3	179.8	163.3	0	0	111.6	A10 E16 N17 V18	A10-E14 PolarHBondContact O-N 3.44Å; E14-E16 VanDerWaalsContact C-N 3.33Å; E14-E16 PolarHBondContact O-N 3.33Å; E14-N17 PolarHBondContact O-N 2.89Å; E14-V18 VanDerWaalsContact O-CG2 3.3Å; E14-V18 WeakPolarHBondContact O-CG2 3.14Å; E14-V18 PolarHBondContact O-N 3.17Å
15	R	47.9	Very low	43.2	Very low	174 Å²	174	138.3 Å²	138.3	66%	0.657	64%	0.636	S	S	*	*	H	α-helix	trans	-61.4	-39.1	175.9	-75.8	178.9	173.7	-164.7	-3	112.7	I11 L12 R19	I11-R15 WeakPolarHBondContact O-CB 3.46Å; I11-R15 WeakPolarHBondContact O-CG 3.42Å; I11-R15 PolarHBondContact O-N 2.83Å; I11-R15 VanDerWaalsContact O-N 3.08Å; L12-R15 PolarHBondContact O-N 2.96Å; R15-R19 WeakPolarHBondContact O-CB 3.31Å; R15-R19 PolarHBondContact O-N 3.18Å
16	E	44.7	Very low	42.8	Very low	107 Å²	107	134.3 Å²	134.3	50%	0.5	64%	0.635	S	S	.	*	H	α-helix	trans	-70.2	-38.2	174.6	-83.7	-168.6	174	0	0	112.7	L12 Q13 E14 R19 K20	L12-E16 PolarHBondContact O-N 2.81Å; Q13-E16 PolarHBondContact O-N 3.12Å; E14-E16 VanDerWaalsContact C-N 3.33Å; E14-E16 PolarHBondContact O-N 3.33Å; E16-R19 PolarHBondContact O-N 3.05Å; E16-K20 WeakPolarHBondContact O-CB 3.39Å; E16-K20 WeakPolarHBondContact O-CG 2.77Å; E16-K20 PolarHBondContact O-N 3.48Å
17	N	46.9	Very low	42.3	Very low	95 Å²	95	131.4 Å²	131.4	51%	0.508	64%	0.635	S	S	.	*	H	α-helix	trans	-65.1	-42.2	177.2	-77	-17.2	0	0	0	111.2	Q13 E14 K20 Q21	Q13-N17 WeakPolarHBondContact O-CB 3.42Å; Q13-N17 VanDerWaalsContact O-CG 3.24Å; Q13-N17 PolarHBondContact O-N 3.43Å; Q13-N17 PolarHBondContact O-ND2 3.09Å; E14-N17 PolarHBondContact O-N 2.89Å; N17-K20 PolarHBondContact O-N 3.4Å; N17-Q21 PolarHBondContact O-N 2.85Å
18	V	46.7	Very low	42.2	Very low	78 Å²	78	131 Å²	131	47%	0.473	64%	0.64	S	S	.	*	H	α-helix	trans	-60.2	-50	172	176.1	0	0	0	0	109.7	E14 K20 Q21 F22	E14-V18 VanDerWaalsContact O-CG2 3.3Å; E14-V18 WeakPolarHBondContact O-CG2 3.14Å; E14-V18 PolarHBondContact O-N 3.17Å; V18-K20 PolarHBondContact O-N 3.45Å; V18-Q21 WeakPolarHBondContact O-CB 3.5Å; V18-Q21 PolarHBondContact O-N 3.23Å; V18-F22 HydrophobicContact CG1-CD2 4.06Å; V18-F22 HydrophobicContact CG1-CE2 3.8Å; V18-F22 WeakPolarHBondContact O-CD2 3.42Å; V18-F22 PolarHBondContact O-N 3.35Å
19	R	41.5	Very low	41.8	Very low	186 Å²	186	130 Å²	130	70%	0.702	64%	0.644	S	S	*	*	H	α-helix	trans	-59.2	-40.3	177.4	-86.2	-175.7	173.7	-174.7	-2	113.8	R15 E16 Q21 F22 Q23	R15-R19 WeakPolarHBondContact O-CB 3.31Å; R15-R19 PolarHBondContact O-N 3.18Å; E16-R19 PolarHBondContact O-N 3.05Å; R19-Q21 VanDerWaalsContact C-N 3.35Å; R19-F22 PolarHBondContact O-N 3.05Å; R19-Q23 PolarHBondContact O-N 3.1Å
20	K	41.2	Very low	40.9	Very low	135 Å²	135	133.1 Å²	133.1	59%	0.587	66%	0.661	S	S	*	*	H	α-helix	trans	-69.9	-31.8	178.7	-76.3	179.4	-177.4	172.6	0	112.2	E16 N17 V18 F22 Q23	E16-K20 WeakPolarHBondContact O-CB 3.39Å; E16-K20 WeakPolarHBondContact O-CG 2.77Å; E16-K20 PolarHBondContact O-N 3.48Å; N17-K20 PolarHBondContact O-N 3.4Å; V18-K20 PolarHBondContact O-N 3.45Å; K20-F22 PolarHBondContact O-N 2.92Å; K20-Q23 PolarHBondContact O-N 2.99Å
21	Q	44.7	Very low	40.2	Very low	160 Å²	160	138.3 Å²	138.3	75%	0.748	68%	0.681	S	S	*	*	H	α-helix	trans	-63.9	-27.3	173	-127.8	172.5	-2.7	0	0	112.2	N17 V18 R19	N17-Q21 PolarHBondContact O-N 2.85Å; V18-Q21 WeakPolarHBondContact O-CB 3.5Å; V18-Q21 PolarHBondContact O-N 3.23Å; R19-Q21 VanDerWaalsContact C-N 3.35Å
22	F	39.6	Very low	39.6	Very low	168 Å²	168	137 Å²	137	74%	0.737	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	0.1	177.7	-72.3	-71.7	0	0	0	115.2	V18 R19 K20	V18-F22 HydrophobicContact CG1-CD2 4.06Å; V18-F22 HydrophobicContact CG1-CE2 3.8Å; V18-F22 WeakPolarHBondContact O-CD2 3.42Å; V18-F22 PolarHBondContact O-N 3.35Å; R19-F22 PolarHBondContact O-N 3.05Å; K20-F22 PolarHBondContact O-N 2.92Å
23	Q	30.2	Very low	39.1	Very low	149 Å²	149	138.7 Å²	138.7	70%	0.696	70%	0.697	S	S	*	*			trans	-106.1	48.9	-180	-74.5	-175.9	-13.1	0	0	113.2	R19 K20	R19-Q23 PolarHBondContact O-N 3.1Å; K20-Q23 PolarHBondContact O-N 2.99Å
24	R	33.4	Very low	38.7	Very low	218 Å²	218	140.2 Å²	140.2	82%	0.823	71%	0.708	S	S	*	*			trans	-76	132.2	158.9	-77.5	-172.8	178.8	-174	0.6	108.6	T26	R24-T26 PolarHBondContact O-N 2.83Å; R24-T26 VanDerWaalsContact O-N 3.09Å
25	P	32.4	Very low	38.8	Very low	134 Å²	134	140.7 Å²	140.7	87%	0.87	71%	0.714	S	S	*	*			trans	-68.9	110.6	-173	27.7	-33.1	0	0	0	109.7
26	T	38.3	Very low	38.9	Very low	130 Å²	130	137.3 Å²	137.3	80%	0.798	71%	0.713	S	S	*	*			trans	-88.7	122.3	173	46.8	0	0	0	0	109.5	R24	R24-T26 PolarHBondContact O-N 2.83Å; R24-T26 VanDerWaalsContact O-N 3.09Å
27	D	31.8	Very low	39.5	Very low	145 Å²	145	141.6 Å²	141.6	78%	0.775	73%	0.73	S	S	*	*			trans	-51.8	133.5	176.3	-139.3	-22.7	0	0	0	111.3	Q29	D27-Q29 PolarHBondContact O-N 3.28Å
28	P	40.7	Very low	40.7	Very low	110 Å²	110	141.1 Å²	141.1	71%	0.714	73%	0.727	S	S	*	*	S	Bend	trans	-73.9	10.2	-166	-15.2	30.1	0	0	0	116.4
29	Q	34	Very low	42.4	Very low	179 Å²	179	141.1 Å²	141.1	84%	0.836	72%	0.724	S	S	*	*	S	Bend	trans	-115.1	67.2	-177.1	-74.2	-176.8	-6.3	0	0	111.7	D27	D27-Q29 PolarHBondContact O-N 3.28Å
30	C	29.7	Very low	44.7	Very low	121 Å²	121	133.8 Å²	133.8	82%	0.818	70%	0.697	S	S	*	*			trans	-178.2	58.2	155.2	-94.6	0	0	0	0	110.9	G32	C30-G32 PolarHBondContact O-N 3.42Å
31	I	33.7	Very low	47	Very low	158 Å²	158	128.1 Å²	128.1	81%	0.81	68%	0.677	S	S	*	*			trans	-92.7	56.4	164.1	-46.5	177	0	0	0	108.1
32	G	33.3	Very low	49.2	Very low	54 Å²	54	125.5 Å²	125.5	56%	0.557	68%	0.683	S	S	*	*			trans	-82.2	120.9	157.3	0	0	0	0	0	105.9	C30 L34	C30-G32 PolarHBondContact O-N 3.42Å; G32-L34 PolarHBondContact O-N 3.16Å
33	N	37.8	Very low	51.7	Low	146 Å²	146	121.8 Å²	121.8	78%	0.781	67%	0.67	S	S	*	*			trans	-48.5	84.3	177.9	-75.7	-26.4	0	0	0	111.7	L35	N33-L35 PolarHBondContact O-N 3.48Å
34	L	39.3	Very low	54.8	Low	157 Å²	157	118.1 Å²	118.1	82%	0.822	66%	0.655	S	S	*	*			trans	-70.3	74.4	158.7	-88.6	147.7	0	0	0	105.4	G32 V36	G32-L34 PolarHBondContact O-N 3.16Å; L34-V36 PolarHBondContact O-N 3.15Å
35	L	47	Very low	57.6	Low	151 Å²	151	108.4 Å²	108.4	79%	0.791	62%	0.621	S	S	*	*			trans	-58	89.3	153	-77.6	163	0	0	0	104.5	N33 K37	N33-L35 PolarHBondContact O-N 3.48Å; L35-K37 VanDerWaalsContact C-N 3.29Å; L35-K37 PolarHBondContact O-N 3.45Å
36	V	50.6	Low	60.6	Low	103 Å²	103	103.3 Å²	103.3	62%	0.624	59%	0.592	S	S	*	*			trans	-52.4	106.1	167	178.5	0	0	0	0	103.8	L34 L38	L34-V36 PolarHBondContact O-N 3.15Å; V36-L38 PolarHBondContact O-N 2.78Å
37	K	57.9	Low	63.3	Low	196 Å²	196	103.5 Å²	103.5	85%	0.852	58%	0.582	S	S	*	*			trans	-55.2	114.9	175.6	-90.3	-176.6	174.9	178.8	0	105	L35 D39	L35-K37 VanDerWaalsContact C-N 3.29Å; L35-K37 PolarHBondContact O-N 3.45Å; K37-D39 PolarHBondContact O-N 2.95Å
38	L	71.3	Confident	66.4	Low	85 Å²	85	97.3 Å²	97.3	45%	0.445	55%	0.549	S	S	.	.			trans	-56.5	115.1	174.9	-72.2	161.1	0	0	0	106.6	V36 F40	V36-L38 PolarHBondContact O-N 2.78Å; L38-F40 HydrophobicContact CB-CD2 4.5Å; L38-F40 HydrophobicContact CB-CE1 4.07Å; L38-F40 HydrophobicContact CB-CE2 3.77Å; L38-F40 HydrophobicContact CB-CZ 3.54Å; L38-F40 HydrophobicContact CD1-CZ 4.01Å; L38-F40 HydrophobicContact CG-CZ 4.37Å
39	D	81.8	Confident	68.8	Low	78 Å²	78	97.6 Å²	97.6	42%	0.417	55%	0.554	S	S	.	*			trans	-75.2	133.1	170.1	-176.3	21.1	0	0	0	107.7	K37 G41 S343 H345	K37-D39 PolarHBondContact O-N 2.95Å; D39-G41 PolarHBondContact OD1-N 3.49Å; D39-S343 WeakPolarHBondContact CB-O 3.39Å; D39-H345 WeakPolarHBondContact O-CB 2.97Å; D39-H345 IonicContact OD2-CE1 3.83Å; D39-H345 IonicContact OD2-ND1 3.84Å; D39-H345 PolarHBondContact OD2-ND1 3.41Å; D39-H345 VanDerWaalsContact OD2-ND1 3.16Å
40	F	90.1	Very high	71.6	Confident	33 Å²	33	92.1 Å²	92.1	15%	0.145	54%	0.536	C	S	.	.			trans	-121.9	6.1	175.5	-60.4	-64.7	0	0	0	111.3	L38 Q71 R124 A125 D126	L38-F40 HydrophobicContact CB-CD2 4.5Å; L38-F40 HydrophobicContact CB-CE1 4.07Å; L38-F40 HydrophobicContact CB-CE2 3.77Å; L38-F40 HydrophobicContact CB-CZ 3.54Å; L38-F40 HydrophobicContact CD1-CZ 4.01Å; L38-F40 HydrophobicContact CG-CZ 4.37Å; F40-Q71 PolarHBondContact O-NE2 2.92Å; F40-Q71 VanDerWaalsContact O-NE2 3.16Å; F40-Q71 PolarHBondContact O-OE1 3.27Å; F40-R124 VanDerWaalsContact CB-CD 3.5Å; F40-R124 HydrophobicContact CB-CG 3.7Å; F40-R124 VanDerWaalsContact O-CD 3.29Å; F40-R124 WeakPolarHBondContact O-CD 3.31Å; F40-R124 WeakPolarHBondContact O-CG 3.16Å; F40-A125 HydrophobicContact CD1-CB 3.73Å; F40-A125 HydrophobicContact CE1-CB 3.93Å; F40-D126 HydrophobicContact CD2-CB 3.76Å; F40-D126 HydrophobicContact CE2-CB 3.74Å; F40-D126 HydrophobicContact CG-CB 4.29Å; F40-D126 HydrophobicContact CZ-CB 4.26Å
41	G	89.6	Confident	74.7	Confident	15 Å²	15	92 Å²	92	16%	0.155	52%	0.519	C	S	.	.			trans	77.1	168.1	-171.8	0	0	0	0	0	113.3	D39 R124 H345	D39-G41 PolarHBondContact OD1-N 3.49Å; G41-R124 PolarHBondContact O-NH1 2.78Å; G41-H345 VanDerWaalsContact CA-CE1 3.4Å; G41-H345 WeakPolarHBondContact CA-CE1 3.46Å; G41-H345 PolarHBondContact N-ND1 2.92Å
42	A	90.2	Very high	77.7	Confident	106 Å²	106	85.4 Å²	85.4	88%	0.876	49%	0.486	S	S	*	.	S	Bend	trans	-78.5	-25.5	-176.5	0	0	0	0	0	113.6	D44	A42-D44 PolarHBondContact O-N 3.47Å
43	L	93	Very high	80.6	Confident	89 Å²	89	86.9 Å²	86.9	47%	0.466	49%	0.486	S	S	.	.			trans	-73	116.7	-177.9	-178.7	65.7	0	0	0	110.4	P67 Y122 R124	L43-P67 HydrophobicContact CD2-CB 4.34Å; L43-P67 HydrophobicContact CD2-CG 3.38Å; L43-Y122 HydrophobicContact CB-CE1 4.23Å; L43-Y122 HydrophobicContact CD2-CD1 3.68Å; L43-Y122 HydrophobicContact CD2-CD2 4.38Å; L43-Y122 HydrophobicContact CD2-CE1 3.81Å; L43-Y122 HydrophobicContact CD2-CE2 4.49Å; L43-Y122 HydrophobicContact CD2-CG 3.97Å; L43-Y122 HydrophobicContact CG-CD1 3.82Å; L43-Y122 HydrophobicContact CG-CE1 3.79Å; L43-Y122 WeakPolarHBondContact O-CE1 3.43Å; L43-R124 VanDerWaalsContact O-CD 3.27Å; L43-R124 WeakPolarHBondContact O-CD 3.16Å
44	D	94.5	Very high	83.3	Confident	72 Å²	72	81.4 Å²	81.4	39%	0.385	46%	0.458	S	S	.	.			trans	-121.5	129.6	176.2	-168.2	-11.1	0	0	0	110	A42 G46 R124 H127	A42-D44 PolarHBondContact O-N 3.47Å; D44-G46 PolarHBondContact O-N 3.34Å; D44-G46 PolarHBondContact OD1-N 3.13Å; D44-R124 VanDerWaalsContact CG-NH2 3.25Å; D44-R124 IonicContact OD1-NH2 2.72Å; D44-R124 IonicContact OD2-CZ 3.34Å; D44-R124 IonicContact OD2-NH1 2.64Å; D44-R124 IonicContact OD2-NH2 2.71Å; D44-R124 PolarHBondContact OD2-NH2 2.75Å; D44-H127 IonicContact OD1-CD2 3.59Å; D44-H127 IonicContact OD1-CE1 3.57Å; D44-H127 IonicContact OD1-NE2 3.47Å; D44-H127 PolarHBondContact OD1-NE2 3.43Å
45	S	92.9	Very high	85.8	Confident	15 Å²	15	74 Å²	74	11%	0.105	42%	0.42	C	S	.	.			trans	-72.1	-18.5	174.9	60.5	0	0	0	0	113.2	C120 Y122	S45-C120 PolarHBondContact O-SG 3.13Å; S45-Y122 WeakPolarHBondContact CB-O 3.42Å
46	G	94.6	Very high	87.8	Confident	26 Å²	26	68 Å²	68	27%	0.268	39%	0.394	S	S	.	.			trans	63.9	-172.1	-170.9	0	0	0	0	0	112.6	D44 P116	D44-G46 PolarHBondContact O-N 3.34Å; D44-G46 PolarHBondContact OD1-N 3.13Å; G46-P116 WeakPolarHBondContact O-CG 3.36Å
47	K	96	Very high	89.4	Confident	135 Å²	135	68.9 Å²	68.9	59%	0.587	40%	0.395	S	S	*	.			trans	-98.5	144.8	170.8	-67.5	-175.6	178.8	-177.8	0	110.1	S111 A112	K47-S111 CarbonylContact C-O 3.46Å; K47-S111 VanDerWaalsContact CA-O 3.31Å; K47-S111 WeakPolarHBondContact CA-O 3.47Å; K47-A112 HydrophobicContact CG-CB 4.3Å
48	V	96.5	Very high	90.7	Very high	14 Å²	14	63.8 Å²	63.8	9%	0.085	39%	0.389	C	S	.	.			trans	-121.3	119.6	173.9	179.2	0	0	0	0	107.5	V52 S111 Y115 P116	V48-V52 HydrophobicContact CG1-CG2 3.82Å; V48-S111 PolarHBondContact N-O 3.47Å; V48-S111 WeakPolarHBondContact O-CA 3.48Å; V48-S111 WeakPolarHBondContact O-CB 3.48Å; V48-Y115 WeakPolarHBondContact O-CD2 3.31Å; V48-P116 HydrophobicContact CB-CG 4.2Å; V48-P116 HydrophobicContact CG2-CB 4.35Å; V48-P116 HydrophobicContact CG2-CG 3.98Å
49	S	91.5	Very high	91.5	Very high	117 Å²	117	63 Å²	63	82%	0.818	39%	0.386	S	S	*	.			trans	-91.7	-26.4	-173.7	52.6	0	0	0	0	114
50	S	93.2	Very high	91.9	Very high	64 Å²	64	60 Å²	60	45%	0.448	37%	0.369	S	S	.	.	S	Bend	trans	-83	148.1	176.6	59.3	0	0	0	0	111.1	Y115	S50-Y115 WeakPolarHBondContact O-CD2 3.38Å
51	Y	94.9	Very high	92.1	Very high	118 Å²	118	62.7 Å²	62.7	46%	0.463	39%	0.393	S	S	.	.			trans	-53.2	140.4	170.2	176.8	-103.8	0	0	0	111.5	P53 D94 Y115	Y51-P53 HydrophobicContact CE1-CB 4.4Å; Y51-P53 HydrophobicContact CE1-CG 3.99Å; Y51-D94 WeakPolarHBondContact CE2-OD2 3.5Å; Y51-Y115 AromaticContact CD2-CE1 3.79Å; Y51-Y115 HydrophobicContact CD2-CE1 3.79Å; Y51-Y115 HydrophobicContact CE2-CE1 4.43Å
52	V	95	Very high	92.4	Very high	19 Å²	19	66 Å²	66	12%	0.115	41%	0.406	C	S	.	.			trans	-128.3	122.1	174.2	-175.5	0	0	0	0	107.5	V48 Y115 R118 R119	V48-V52 HydrophobicContact CG1-CG2 3.82Å; V52-Y115 HydrophobicContact CB-CD1 4.33Å; V52-Y115 HydrophobicContact CG2-CG 4.31Å; V52-R118 HydrophobicContact CB-CB 4.15Å; V52-R118 HydrophobicContact CG1-CB 3.59Å; V52-R118 VanDerWaalsContact O-CD 3.24Å; V52-R118 WeakPolarHBondContact O-CD 3.44Å; V52-R118 PolarHBondContact O-NH1 2.88Å; V52-R119 HydrophobicContact CG1-CB 4.15Å; V52-R119 HydrophobicContact CG2-CB 4.16Å
53	P	94.2	Very high	92.7	Very high	86 Å²	86	60.9 Å²	60.9	56%	0.558	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-56	152.3	174.1	-23.4	33.3	0	0	0	112.3	Y51 R118	Y51-P53 HydrophobicContact CE1-CB 4.4Å; Y51-P53 HydrophobicContact CE1-CG 3.99Å; P53-R118 WeakPolarHBondContact O-CD 3.46Å
54	C	94.6	Very high	92.9	Very high	30 Å²	30	59.3 Å²	59.3	20%	0.203	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-62.3	154.1	176	63.4	0	0	0	0	112.2	G56	C54-G56 PolarHBondContact O-N 3.08Å
55	I	92.9	Very high	93	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.01	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-66.1	122.2	-179.2	-69.6	172.2	0	0	0	109.3	D59 L63 C88 R118	I55-D59 HydrophobicContact CG2-CB 4.1Å; I55-L63 HydrophobicContact CD1-CB 4.36Å; I55-L63 HydrophobicContact CD1-CD1 3.88Å; I55-L63 HydrophobicContact CD1-CD2 3.82Å; I55-L63 HydrophobicContact CD1-CG 4.22Å; I55-L63 HydrophobicContact CG2-CD2 4.01Å; I55-C88 PolarHBondContact N-O 3.45Å; I55-R118 HydrophobicContact CG1-CB 4.43Å; I55-R118 HydrophobicContact CG1-CG 4.49Å
56	G	88.4	Confident	93.2	Very high	25 Å²	25	64.2 Å²	64.2	26%	0.258	38%	0.376	S	S	.	.			trans	-107.2	-172.4	171.7	0	0	0	0	0	112.4	C54 A58 D59 L60	C54-G56 PolarHBondContact O-N 3.08Å; G56-A58 PolarHBondContact O-N 2.62Å; G56-D59 PolarHBondContact O-N 2.57Å; G56-D59 VanDerWaalsContact O-N 3.15Å; G56-L60 PolarHBondContact O-N 3.13Å
57	L	84.5	Confident	93.3	Very high	121 Å²	121	65.4 Å²	65.4	63%	0.634	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-32.8	-179.7	-170	68.7	0	0	0	113.5	D59 L60 E328	L57-D59 VanDerWaalsContact C-N 3.28Å; L57-D59 PolarHBondContact O-N 2.62Å; L57-L60 HydrophobicContact CD1-CD2 4.07Å; L57-L60 WeakPolarHBondContact O-CB 3.33Å; L57-L60 PolarHBondContact O-N 2.78Å; L57-E328 HydrophobicContact CD1-CG 4.34Å
58	A	85.3	Confident	93.4	Very high	89 Å²	89	61.2 Å²	61.2	74%	0.736	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-28.3	-178.8	0	0	0	0	0	113.4	G56	G56-A58 PolarHBondContact O-N 2.62Å
59	D	87.2	Confident	93.5	Very high	69 Å²	69	60.6 Å²	60.6	37%	0.369	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-5.6	-177.5	-56.5	-63.8	0	0	0	112.3	I55 G56 L57 S61 N62 L63	I55-D59 HydrophobicContact CG2-CB 4.1Å; G56-D59 PolarHBondContact O-N 2.57Å; G56-D59 VanDerWaalsContact O-N 3.15Å; L57-D59 VanDerWaalsContact C-N 3.28Å; L57-D59 PolarHBondContact O-N 2.62Å; D59-S61 VanDerWaalsContact C-N 3.33Å; D59-S61 PolarHBondContact O-N 3.19Å; D59-N62 WeakPolarHBondContact O-CB 3.42Å; D59-N62 PolarHBondContact O-N 2.93Å; D59-L63 PolarHBondContact O-N 3.12Å
60	L	91	Very high	93.8	Very high	14 Å²	14	55 Å²	55	7%	0.073	32%	0.318	C	S	.	.	H	α-helix	trans	-55.4	-45.1	-172.5	179.1	54.6	0	0	0	112.5	G56 L57 N62 L63 L64 T321 E328 I330 L352	G56-L60 PolarHBondContact O-N 3.13Å; L57-L60 HydrophobicContact CD1-CD2 4.07Å; L57-L60 WeakPolarHBondContact O-CB 3.33Å; L57-L60 PolarHBondContact O-N 2.78Å; L60-N62 PolarHBondContact O-N 2.87Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-L64 HydrophobicContact CD1-CD2 4.04Å; L60-L64 HydrophobicContact CD1-CG 4.16Å; L60-L64 HydrophobicContact CG-CD1 4.41Å; L60-L64 HydrophobicContact CG-CG 4.46Å; L60-L64 WeakPolarHBondContact O-CG 3.37Å; L60-L64 PolarHBondContact O-N 3.47Å; L60-L64 VanDerWaalsContact O-N 3.16Å; L60-T321 HydrophobicContact CD1-CG2 3.84Å; L60-T321 HydrophobicContact CD2-CG2 4.29Å; L60-E328 HydrophobicContact CD2-CB 4.05Å; L60-E328 HydrophobicContact CD2-CG 4.32Å; L60-I330 HydrophobicContact CD1-CG2 3.51Å; L60-L352 HydrophobicContact CD2-CD1 4.21Å
61	S	94.4	Very high	94.1	Very high	91 Å²	91	52 Å²	52	64%	0.636	30%	0.297	S	S	*	.	H	α-helix	trans	-59.8	-28.7	179.2	57.6	0	0	0	0	113.4	D59	D59-S61 VanDerWaalsContact C-N 3.33Å; D59-S61 PolarHBondContact O-N 3.19Å
62	N	95.2	Very high	94.2	Very high	83 Å²	83	46.5 Å²	46.5	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-81.1	-22.1	177	-62.3	-44.8	0	0	0	112.7	D59 L60 K68	D59-N62 WeakPolarHBondContact O-CB 3.42Å; D59-N62 PolarHBondContact O-N 2.93Å; L60-N62 PolarHBondContact O-N 2.87Å; N62-K68 WeakPolarHBondContact O-CE 3.33Å; N62-K68 PolarHBondContact O-NZ 3.42Å
63	L	96.4	Very high	94.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-83.5	-27.5	177.2	-178.5	63.4	0	0	0	112.6	I55 D59 L60 K68 F84 H121 I330 V350	I55-L63 HydrophobicContact CD1-CB 4.36Å; I55-L63 HydrophobicContact CD1-CD1 3.88Å; I55-L63 HydrophobicContact CD1-CD2 3.82Å; I55-L63 HydrophobicContact CD1-CG 4.22Å; I55-L63 HydrophobicContact CG2-CD2 4.01Å; D59-L63 PolarHBondContact O-N 3.12Å; L60-L63 PolarHBondContact O-N 3.23Å; L63-K68 WeakPolarHBondContact O-CB 3.21Å; L63-K68 WeakPolarHBondContact O-CG 3.49Å; L63-F84 HydrophobicContact CD2-CZ 4.47Å; L63-H121 HydrophobicContact CD1-CB 3.97Å; L63-I330 HydrophobicContact CD2-CD1 3.48Å; L63-I330 VanDerWaalsContact CD2-CD1 3.48Å; L63-V350 HydrophobicContact CD1-CG2 4.18Å; L63-V350 HydrophobicContact CD2-CG1 4.22Å; L63-V350 HydrophobicContact CG-CB 4.34Å; L63-V350 HydrophobicContact CG-CG1 4.03Å; L63-V350 HydrophobicContact CG-CG2 4.33Å
64	L	97.5	Very high	94	Very high	55 Å²	55	45.4 Å²	45.4	29%	0.288	26%	0.264	S	S	.	.	S	Bend	trans	-72	146.4	-177.8	-62	178.6	0	0	0	112.8	L60 I330 V350 L352	L60-L64 HydrophobicContact CD1-CD2 4.04Å; L60-L64 HydrophobicContact CD1-CG 4.16Å; L60-L64 HydrophobicContact CG-CD1 4.41Å; L60-L64 HydrophobicContact CG-CG 4.46Å; L60-L64 WeakPolarHBondContact O-CG 3.37Å; L60-L64 PolarHBondContact O-N 3.47Å; L60-L64 VanDerWaalsContact O-N 3.16Å; L64-I330 HydrophobicContact CD2-CG2 3.99Å; L64-V350 HydrophobicContact CD2-CG1 4.22Å; L64-L352 HydrophobicContact CD1-CB 4.2Å; L64-L352 HydrophobicContact CD2-CB 4.26Å
65	G	97.7	Very high	93.9	Very high	28 Å²	28	48 Å²	48	29%	0.289	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	104.1	-154.7	175.2	0	0	0	0	0	114	K68 V350	G65-K68 VanDerWaalsContact O-CB 3.3Å; G65-K68 WeakPolarHBondContact O-CB 3.1Å; G65-K68 VanDerWaalsContact O-CG 3.28Å; G65-K68 WeakPolarHBondContact O-CG 3.48Å; G65-V350 PolarHBondContact N-O 2.9Å; G65-V350 PolarHBondContact O-N 2.91Å; G65-V350 VanDerWaalsContact O-N 3.12Å
66	R	96.7	Very high	94.1	Very high	163 Å²	163	48 Å²	48	62%	0.615	28%	0.276	S	S	*	.	S	Bend	trans	-136.8	145.8	-176.3	58.6	-175.7	161.5	-171.7	-8	111.4	D337 V347	R66-D337 IonicContact NH1-OD2 2.75Å; R66-V347 HydrophobicContact CB-CG1 4.14Å
67	P	96.4	Very high	94.4	Very high	50 Å²	50	47 Å²	47	33%	0.325	27%	0.265	S	S	.	.	S	Bend	cis	-73.4	127.9	-15.3	30.2	-33.9	0	0	0	111	L43 Y122 V347 P348	L43-P67 HydrophobicContact CD2-CB 4.34Å; L43-P67 HydrophobicContact CD2-CG 3.38Å; P67-Y122 HydrophobicContact CB-CD2 3.97Å; P67-Y122 HydrophobicContact CB-CE2 3.83Å; P67-V347 HydrophobicContact CB-CG1 4.14Å; P67-P348 WeakPolarHBondContact CA-O 3.46Å; P67-P348 HydrophobicContact CB-CG 4.48Å
68	K	98.1	Very high	95	Very high	48 Å²	48	41.2 Å²	41.2	21%	0.209	23%	0.234	C	C	.	.			trans	-143.1	148.7	178.6	-62	-71.8	175.3	175.1	0	112	N62 L63 G65 H121 P348 V350	N62-K68 WeakPolarHBondContact O-CE 3.33Å; N62-K68 PolarHBondContact O-NZ 3.42Å; L63-K68 WeakPolarHBondContact O-CB 3.21Å; L63-K68 WeakPolarHBondContact O-CG 3.49Å; G65-K68 VanDerWaalsContact O-CB 3.3Å; G65-K68 WeakPolarHBondContact O-CB 3.1Å; G65-K68 VanDerWaalsContact O-CG 3.28Å; G65-K68 WeakPolarHBondContact O-CG 3.48Å; K68-H121 CarbonylContact C-O 3.53Å; K68-H121 VanDerWaalsContact CA-O 3.3Å; K68-H121 WeakPolarHBondContact CA-O 3.39Å; K68-H121 HydrophobicContact CD-CB 3.82Å; K68-H121 WeakPolarHBondContact CD-O 3.14Å; K68-P348 PolarHBondContact N-O 3.05Å; K68-P348 CarbonylContact O-C 3.56Å; K68-P348 VanDerWaalsContact O-CB 3.28Å; K68-P348 WeakPolarHBondContact O-CB 3.3Å; K68-P348 WeakPolarHBondContact O-CG 3.19Å; K68-V350 HydrophobicContact CB-CB 4.17Å; K68-V350 HydrophobicContact CB-CG2 3.92Å
69	G	98.3	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.7	-143.7	-176.2	0	0	0	0	0	113.1	H121 Y122 V123	G69-H121 PolarHBondContact N-O 3.37Å; G69-Y122 CarbonylContact O-C 3.53Å; G69-Y122 WeakPolarHBondContact O-CA 3.15Å; G69-V123 PolarHBondContact O-N 3.13Å
70	I	98.7	Very high	96.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.6	-179.2	-57.4	175.9	0	0	0	109.1	G72 D80 L83 F84 I113 L117 V123 V128 F332 S334 P348	I70-G72 PolarHBondContact O-N 3.16Å; I70-D80 HydrophobicContact CB-CB 4.24Å; I70-D80 HydrophobicContact CG2-CB 3.98Å; I70-D80 WeakPolarHBondContact CG2-OD1 3.5Å; I70-L83 HydrophobicContact CD1-CB 3.72Å; I70-F84 HydrophobicContact CD1-CB 4.47Å; I70-I113 HydrophobicContact CD1-CG2 4.04Å; I70-L117 HydrophobicContact CD1-CD2 4.25Å; I70-L117 HydrophobicContact CG1-CD1 4.2Å; I70-L117 HydrophobicContact CG1-CD2 4.31Å; I70-V123 HydrophobicContact CG1-CB 4.24Å; I70-V123 HydrophobicContact CG1-CG2 4.34Å; I70-V123 HydrophobicContact CG2-CB 4.45Å; I70-V128 HydrophobicContact CG2-CG2 3.55Å; I70-F332 HydrophobicContact CB-CZ 3.89Å; I70-F332 VanDerWaalsContact N-CE2 3.26Å; I70-F332 VanDerWaalsContact O-CZ 3.26Å; I70-F332 WeakPolarHBondContact O-CZ 3.35Å; I70-S334 WeakPolarHBondContact O-CA 3.5Å; I70-S334 VanDerWaalsContact O-CB 3.27Å; I70-S334 WeakPolarHBondContact O-CB 3.13Å; I70-P348 WeakPolarHBondContact O-CB 3.48Å
71	Q	98.3	Very high	96.4	Very high	2 Å²	2	33 Å²	33	1%	0.009	18%	0.178	C	C	.	.			trans	-71.9	122.7	176.9	-177.3	-173.8	48.9	0	0	110.7	F40 Y122 V123 A125 H345 N346 P348	F40-Q71 PolarHBondContact O-NE2 2.92Å; F40-Q71 VanDerWaalsContact O-NE2 3.16Å; F40-Q71 PolarHBondContact O-OE1 3.27Å; Q71-Y122 HydrophobicContact CB-CE2 4.1Å; Q71-Y122 VanDerWaalsContact CD-OH 3.32Å; Q71-Y122 PolarHBondContact NE2-OH 3.09Å; Q71-Y122 PolarHBondContact OE1-OH 3.25Å; Q71-V123 WeakPolarHBondContact CB-O 3.23Å; Q71-V123 PolarHBondContact N-O 3.5Å; Q71-A125 HydrophobicContact CB-CB 4.17Å; Q71-A125 HydrophobicContact CG-CB 4.02Å; Q71-A125 VanDerWaalsContact O-CB 3.31Å; Q71-A125 WeakPolarHBondContact O-CB 3.48Å; Q71-H345 PolarHBondContact NE2-CD2 2.96Å; Q71-H345 VanDerWaalsContact NE2-CD2 3.28Å; Q71-N346 VanDerWaalsContact CG-O 3.31Å; Q71-N346 WeakPolarHBondContact CG-O 3.37Å; Q71-N346 PolarHBondContact NE2-O 2.9Å; Q71-P348 HydrophobicContact CB-CG 4.17Å
72	G	96.6	Very high	96.6	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.01	15%	0.148	C	C	.	.			trans	-77.9	146.8	176.5	0	0	0	0	0	113.1	I70 D80 S334 N346	I70-G72 PolarHBondContact O-N 3.16Å; G72-D80 VanDerWaalsContact CA-OD2 3.28Å; G72-D80 WeakPolarHBondContact CA-OD2 3.31Å; G72-S334 PolarHBondContact N-O 3.43Å; G72-N346 WeakPolarHBondContact O-CB 3.39Å; G72-N346 PolarHBondContact O-ND2 2.75Å
73	S	94.4	Very high	96.7	Very high	20 Å²	20	24.8 Å²	24.8	14%	0.14	13%	0.127	C	C	.	.			trans	-161	140.2	175.1	-171.2	0	0	0	0	111.7	S76 R132	S73-S76 PolarHBondContact N-OG 2.7Å; S73-S76 WeakPolarHBondContact O-CB 3.38Å; S73-S76 PolarHBondContact O-N 2.95Å; S73-S76 PolarHBondContact O-OG 2.76Å; S73-R132 PolarHBondContact O-NH1 2.94Å
74	Q	91.5	Very high	96.8	Very high	62 Å²	62	24.8 Å²	24.8	29%	0.29	13%	0.127	S	C	.	.	S	Bend	trans	51.1	62.7	174.8	-60.7	-175	-32.6	0	0	113.1	S76 M129 R132	Q74-S76 PolarHBondContact O-N 3.18Å; Q74-M129 HydrophobicContact CB-CE 4.41Å; Q74-R132 PolarHBondContact O-NH1 3.47Å; Q74-R132 PolarHBondContact O-NH2 2.9Å
75	N	93	Very high	96.8	Very high	84 Å²	84	22.3 Å²	22.3	45%	0.449	11%	0.114	S	C	.	.	S	Bend	trans	57.2	29	177.4	-54.6	-43.3	0	0	0	114.4	Y78 E147 E149	N75-Y78 WeakPolarHBondContact O-CD1 3.49Å; N75-Y78 WeakPolarHBondContact O-CE1 3.27Å; N75-E147 PolarHBondContact ND2-O 3.4Å; N75-E149 HydrophobicContact CB-CB 4.15Å
76	S	95.6	Very high	96.7	Very high	2 Å²	2	21 Å²	21	1%	0.014	10%	0.101	C	C	.	.			trans	-83.1	-6.8	-177.4	60.1	0	0	0	0	115.4	S73 Q74 Y78 M79 D80	S73-S76 PolarHBondContact N-OG 2.7Å; S73-S76 WeakPolarHBondContact O-CB 3.38Å; S73-S76 PolarHBondContact O-N 2.95Å; S73-S76 PolarHBondContact O-OG 2.76Å; Q74-S76 PolarHBondContact O-N 3.18Å; S76-Y78 PolarHBondContact O-N 3.21Å; S76-M79 WeakPolarHBondContact O-CA 3.28Å; S76-M79 WeakPolarHBondContact O-CB 3.28Å; S76-M79 PolarHBondContact O-N 3.26Å; S76-D80 VanDerWaalsContact CB-OD2 3.24Å; S76-D80 WeakPolarHBondContact CB-OD2 3.25Å; S76-D80 PolarHBondContact O-N 3.03Å; S76-D80 VanDerWaalsContact O-OD2 3.1Å; S76-D80 PolarHBondContact OG-OD2 3.25Å
77	C	96.5	Very high	96.7	Very high	4 Å²	4	13.4 Å²	13.4	3%	0.027	7%	0.072	C	C	.	.	H	α-helix	trans	-55.5	-32.6	-167.7	59.5	0	0	0	0	113.9	M79 D80 A81 M335	C77-M79 VanDerWaalsContact C-N 3.28Å; C77-M79 PolarHBondContact O-N 2.96Å; C77-D80 WeakPolarHBondContact CA-OD2 3.13Å; C77-D80 PolarHBondContact N-OD2 3.03Å; C77-D80 PolarHBondContact O-N 3.39Å; C77-A81 WeakPolarHBondContact O-CB 3.22Å; C77-A81 PolarHBondContact O-N 2.92Å; C77-M335 HydrophobicContact CB-CE 3.65Å; C77-M335 HydrophobicContact CB-SD 4.48Å
78	Y	96.3	Very high	96.8	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-57.5	-40.5	173	71.8	-91.4	0	0	0	112.5	N75 S76 A82 F145 K150 F155	N75-Y78 WeakPolarHBondContact O-CD1 3.49Å; N75-Y78 WeakPolarHBondContact O-CE1 3.27Å; S76-Y78 PolarHBondContact O-N 3.21Å; Y78-A82 VanDerWaalsContact O-CB 3.24Å; Y78-A82 WeakPolarHBondContact O-CB 3.33Å; Y78-A82 PolarHBondContact O-N 2.76Å; Y78-F145 HydrophobicContact CE2-CD1 4.44Å; Y78-F145 HydrophobicContact CE2-CE1 4.23Å; Y78-F145 VanDerWaalsContact OH-CD1 3.29Å; Y78-F145 WeakPolarHBondContact OH-CD1 3.33Å; Y78-F145 PolarHBondContact OH-O 3.32Å; Y78-K150 WeakPolarHBondContact CB-O 3.36Å; Y78-K150 HydrophobicContact CD1-CB 4.24Å; Y78-K150 HydrophobicContact CD2-CB 4.18Å; Y78-K150 HydrophobicContact CE1-CB 3.82Å; Y78-K150 HydrophobicContact CE1-CG 4.3Å; Y78-K150 HydrophobicContact CE2-CB 3.8Å; Y78-K150 HydrophobicContact CG-CB 4.41Å; Y78-K150 VanDerWaalsContact CG-O 3.27Å; Y78-F155 HydrophobicContact CD2-CB 4.22Å; Y78-F155 HydrophobicContact CE2-CB 4.03Å; Y78-F155 HydrophobicContact CE2-CG 4.47Å
79	M	97.1	Very high	96.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-79.4	-43.6	179.5	-174.6	176.5	-63.9	0	0	110.5	S76 C77 A81 A82 L83 V128 F131 R132 L135 F145 F155	S76-M79 WeakPolarHBondContact O-CA 3.28Å; S76-M79 WeakPolarHBondContact O-CB 3.28Å; S76-M79 PolarHBondContact O-N 3.26Å; C77-M79 VanDerWaalsContact C-N 3.28Å; C77-M79 PolarHBondContact O-N 2.96Å; M79-A81 PolarHBondContact O-N 3.49Å; M79-A82 PolarHBondContact O-N 2.95Å; M79-L83 HydrophobicContact CG-CD1 3.69Å; M79-L83 HydrophobicContact CG-CG 4.12Å; M79-L83 VanDerWaalsContact O-CB 3.3Å; M79-L83 WeakPolarHBondContact O-CB 3.34Å; M79-L83 WeakPolarHBondContact O-CG 3.24Å; M79-L83 PolarHBondContact O-N 3.32Å; M79-L83 HydrophobicContact SD-CD1 4.39Å; M79-V128 HydrophobicContact SD-CG1 4.03Å; M79-F131 HydrophobicContact SD-CD1 3.88Å; M79-F131 HydrophobicContact SD-CE1 4.05Å; M79-R132 HydrophobicContact CE-CG 3.91Å; M79-R132 HydrophobicContact SD-CG 3.69Å; M79-L135 HydrophobicContact CE-CD1 3.88Å; M79-F145 HydrophobicContact CE-CD1 3.78Å; M79-F145 HydrophobicContact CE-CE1 4.15Å; M79-F155 HydrophobicContact CE-CD2 3.76Å; M79-F155 HydrophobicContact CE-CE2 3.88Å; M79-F155 HydrophobicContact CE-CG 4.36Å; M79-F155 HydrophobicContact CG-CD1 4.35Å; M79-F155 HydrophobicContact CG-CD2 4.49Å; M79-F155 HydrophobicContact CG-CE1 3.97Å; M79-F155 HydrophobicContact CG-CE2 4.14Å; M79-F155 HydrophobicContact CG-CZ 3.87Å; M79-F155 HydrophobicContact SD-CE2 4.3Å
80	D	98.2	Very high	96.4	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-62.1	-47.1	-179	-52.8	-41.4	0	0	0	110.8	I70 G72 S76 C77 L83 F84 F332	I70-D80 HydrophobicContact CB-CB 4.24Å; I70-D80 HydrophobicContact CG2-CB 3.98Å; I70-D80 WeakPolarHBondContact CG2-OD1 3.5Å; G72-D80 VanDerWaalsContact CA-OD2 3.28Å; G72-D80 WeakPolarHBondContact CA-OD2 3.31Å; S76-D80 VanDerWaalsContact CB-OD2 3.24Å; S76-D80 WeakPolarHBondContact CB-OD2 3.25Å; S76-D80 PolarHBondContact O-N 3.03Å; S76-D80 VanDerWaalsContact O-OD2 3.1Å; S76-D80 PolarHBondContact OG-OD2 3.25Å; C77-D80 WeakPolarHBondContact CA-OD2 3.13Å; C77-D80 PolarHBondContact N-OD2 3.03Å; C77-D80 PolarHBondContact O-N 3.39Å; D80-L83 PolarHBondContact O-N 3.01Å; D80-F84 VanDerWaalsContact O-CB 3.32Å; D80-F84 WeakPolarHBondContact O-CB 3.5Å; D80-F84 PolarHBondContact O-N 3.28Å; D80-F332 HydrophobicContact CB-CE1 4.48Å
81	A	98.4	Very high	96	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.6	-45.2	175.5	0	0	0	0	0	111.5	C77 M79 F84 S85 M308 S317	C77-A81 WeakPolarHBondContact O-CB 3.22Å; C77-A81 PolarHBondContact O-N 2.92Å; M79-A81 PolarHBondContact O-N 3.49Å; A81-F84 PolarHBondContact O-N 2.95Å; A81-S85 VanDerWaalsContact O-CB 3.31Å; A81-S85 WeakPolarHBondContact O-CB 3.28Å; A81-S85 PolarHBondContact O-N 2.9Å; A81-S85 PolarHBondContact O-OG 3.47Å; A81-M308 HydrophobicContact CB-CE 3.86Å; A81-S317 WeakPolarHBondContact CA-OG 3.25Å; A81-S317 VanDerWaalsContact CB-OG 3.27Å; A81-S317 WeakPolarHBondContact CB-OG 3.44Å; A81-S317 PolarHBondContact O-OG 3.32Å
82	A	97.6	Very high	95.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62.6	-47.1	177.4	0	0	0	0	0	112.4	Y78 M79 F84 S85 M86 F155 L156 M308	Y78-A82 VanDerWaalsContact O-CB 3.24Å; Y78-A82 WeakPolarHBondContact O-CB 3.33Å; Y78-A82 PolarHBondContact O-N 2.76Å; M79-A82 PolarHBondContact O-N 2.95Å; A82-F84 PolarHBondContact O-N 3.03Å; A82-S85 PolarHBondContact O-N 3.5Å; A82-M86 HydrophobicContact CB-CE 4.15Å; A82-M86 WeakPolarHBondContact O-CB 3.49Å; A82-M86 VanDerWaalsContact O-CE 3.28Å; A82-M86 WeakPolarHBondContact O-CE 3.48Å; A82-M86 WeakPolarHBondContact O-CG 3.34Å; A82-M86 PolarHBondContact O-N 3.25Å; A82-F155 HydrophobicContact CB-CD1 3.94Å; A82-F155 HydrophobicContact CB-CE1 3.88Å; A82-L156 HydrophobicContact CB-CD2 4.46Å; A82-M308 WeakPolarHBondContact CA-SD 3.26Å; A82-M308 HydrophobicContact CB-CE 3.87Å; A82-M308 HydrophobicContact CB-SD 3.73Å
83	L	97.9	Very high	95.2	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-62.3	-43.3	178.2	-71.4	174.7	0	0	0	111.3	I70 M79 D80 M86 F87 L109 I113 F155	I70-L83 HydrophobicContact CD1-CB 3.72Å; M79-L83 HydrophobicContact CG-CD1 3.69Å; M79-L83 HydrophobicContact CG-CG 4.12Å; M79-L83 VanDerWaalsContact O-CB 3.3Å; M79-L83 WeakPolarHBondContact O-CB 3.34Å; M79-L83 WeakPolarHBondContact O-CG 3.24Å; M79-L83 PolarHBondContact O-N 3.32Å; M79-L83 HydrophobicContact SD-CD1 4.39Å; D80-L83 PolarHBondContact O-N 3.01Å; L83-M86 HydrophobicContact CD2-CE 4.27Å; L83-M86 PolarHBondContact O-N 3.36Å; L83-F87 HydrophobicContact CD2-CD2 3.95Å; L83-F87 HydrophobicContact CD2-CE2 3.74Å; L83-F87 WeakPolarHBondContact O-CB 3.47Å; L83-F87 VanDerWaalsContact O-CD2 3.31Å; L83-F87 WeakPolarHBondContact O-CD2 3.44Å; L83-F87 PolarHBondContact O-N 3.42Å; L83-L109 HydrophobicContact CD2-CD1 3.65Å; L83-I113 HydrophobicContact CD1-CD1 4.13Å; L83-I113 HydrophobicContact CD1-CG2 4.28Å; L83-F155 HydrophobicContact CD2-CE1 4.28Å; L83-F155 HydrophobicContact CD2-CZ 3.91Å; L83-F155 HydrophobicContact CG-CE1 4.29Å; L83-F155 HydrophobicContact CG-CZ 4.2Å
84	F	98.6	Very high	95	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.1	-48.4	175.1	-170.7	-83.7	0	0	0	111.6	L63 I70 D80 A81 A82 M86 F87 C88 L117 A319 I330 F332 V350	L63-F84 HydrophobicContact CD2-CZ 4.47Å; I70-F84 HydrophobicContact CD1-CB 4.47Å; D80-F84 VanDerWaalsContact O-CB 3.32Å; D80-F84 WeakPolarHBondContact O-CB 3.5Å; D80-F84 PolarHBondContact O-N 3.28Å; A81-F84 PolarHBondContact O-N 2.95Å; A82-F84 PolarHBondContact O-N 3.03Å; F84-M86 VanDerWaalsContact C-N 3.27Å; F84-M86 PolarHBondContact O-N 3.39Å; F84-F87 PolarHBondContact O-N 3.07Å; F84-C88 HydrophobicContact CD1-CB 4.03Å; F84-C88 HydrophobicContact CD2-CB 4.02Å; F84-C88 HydrophobicContact CE1-CB 3.94Å; F84-C88 HydrophobicContact CE2-CB 3.95Å; F84-C88 VanDerWaalsContact CE2-SG 3.53Å; F84-C88 HydrophobicContact CG-CB 4.06Å; F84-C88 HydrophobicContact CZ-CB 3.9Å; F84-C88 WeakPolarHBondContact CZ-SG 3.24Å; F84-C88 WeakPolarHBondContact O-CB 3.18Å; F84-C88 PolarHBondContact O-N 2.75Å; F84-L117 HydrophobicContact CD2-CD1 4.25Å; F84-L117 HydrophobicContact CD2-CD2 4.27Å; F84-L117 HydrophobicContact CE2-CD1 4.36Å; F84-A319 HydrophobicContact CE1-CB 4.11Å; F84-I330 HydrophobicContact CE1-CD1 4Å; F84-I330 HydrophobicContact CE1-CG1 4.49Å; F84-I330 HydrophobicContact CZ-CD1 3.78Å; F84-F332 HydrophobicContact CB-CD1 3.42Å; F84-F332 VanDerWaalsContact CB-CD1 3.42Å; F84-F332 HydrophobicContact CB-CE1 3.53Å; F84-F332 HydrophobicContact CB-CG 4.23Å; F84-F332 HydrophobicContact CB-CZ 4.43Å; F84-F332 HydrophobicContact CD1-CB 3.63Å; F84-F332 AromaticContact CD1-CD1 3.7Å; F84-F332 HydrophobicContact CD1-CD1 3.7Å; F84-F332 AromaticContact CD1-CG 3.8Å; F84-F332 HydrophobicContact CD1-CG 3.8Å; F84-F332 HydrophobicContact CD2-CB 4.1Å; F84-F332 AromaticContact CD2-CD1 3.62Å; F84-F332 HydrophobicContact CD2-CD1 3.62Å; F84-F332 AromaticContact CD2-CD2 3.84Å; F84-F332 HydrophobicContact CD2-CD2 3.84Å; F84-F332 AromaticContact CD2-CE1 3.95Å; F84-F332 HydrophobicContact CD2-CE1 3.95Å; F84-F332 HydrophobicContact CD2-CE2 4.17Å; F84-F332 AromaticContact CD2-CG 3.55Å; F84-F332 HydrophobicContact CD2-CG 3.55Å; F84-F332 HydrophobicContact CD2-CZ 4.21Å; F84-F332 HydrophobicContact CE1-CB 3.44Å; F84-F332 VanDerWaalsContact CE1-CB 3.44Å; F84-F332 HydrophobicContact CE1-CD1 4.36Å; F84-F332 AromaticContact CE1-CG 3.99Å; F84-F332 HydrophobicContact CE1-CG 3.99Å; F84-F332 HydrophobicContact CE2-CB 3.92Å; F84-F332 HydrophobicContact CE2-CD1 4.28Å; F84-F332 AromaticContact CE2-CD2 3.87Å; F84-F332 HydrophobicContact CE2-CD2 3.87Å; F84-F332 AromaticContact CE2-CG 3.74Å; F84-F332 HydrophobicContact CE2-CG 3.74Å; F84-F332 HydrophobicContact CG-CB 3.97Å; F84-F332 AromaticContact CG-CD1 3.28Å; F84-F332 HydrophobicContact CG-CD1 3.28Å; F84-F332 HydrophobicContact CG-CD2 4.33Å; F84-F332 AromaticContact CG-CE1 3.8Å; F84-F332 HydrophobicContact CG-CE1 3.8Å; F84-F332 AromaticContact CG-CG 3.58Å; F84-F332 HydrophobicContact CG-CG 3.58Å; F84-F332 HydrophobicContact CZ-CB 3.59Å; F84-F332 HydrophobicContact CZ-CD2 4.39Å; F84-F332 AromaticContact CZ-CG 3.96Å; F84-F332 HydrophobicContact CZ-CG 3.96Å; F84-V350 HydrophobicContact CE2-CG2 3.91Å; F84-V350 HydrophobicContact CZ-CG1 4.4Å; F84-V350 HydrophobicContact CZ-CG2 3.98Å
85	S	97.9	Very high	94.7	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.021	7%	0.067	C	C	.	.	H	α-helix	trans	-58	-37.3	178.5	-73.5	0	0	0	0	113.2	A81 A82 S306 M308 S317	A81-S85 VanDerWaalsContact O-CB 3.31Å; A81-S85 WeakPolarHBondContact O-CB 3.28Å; A81-S85 PolarHBondContact O-N 2.9Å; A81-S85 PolarHBondContact O-OG 3.47Å; A82-S85 PolarHBondContact O-N 3.5Å; S85-S306 WeakPolarHBondContact CB-OG 3.38Å; S85-S306 WeakPolarHBondContact O-CB 3.42Å; S85-S306 PolarHBondContact O-OG 2.8Å; S85-M308 WeakPolarHBondContact OG-CG 3.44Å; S85-S317 WeakPolarHBondContact OG-CB 3.27Å; S85-S317 PolarHBondContact OG-OG 3.33Å
86	M	95.7	Very high	93.6	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-84.3	-31.6	-178.3	-71.2	-176.4	-69.8	0	0	113.5	A82 L83 F84 T90 F93 F155 L156 L159 F160 F394	A82-M86 HydrophobicContact CB-CE 4.15Å; A82-M86 WeakPolarHBondContact O-CB 3.49Å; A82-M86 VanDerWaalsContact O-CE 3.28Å; A82-M86 WeakPolarHBondContact O-CE 3.48Å; A82-M86 WeakPolarHBondContact O-CG 3.34Å; A82-M86 PolarHBondContact O-N 3.25Å; L83-M86 HydrophobicContact CD2-CE 4.27Å; L83-M86 PolarHBondContact O-N 3.36Å; F84-M86 VanDerWaalsContact C-N 3.27Å; F84-M86 PolarHBondContact O-N 3.39Å; M86-T90 WeakPolarHBondContact O-CG2 3.42Å; M86-F93 HydrophobicContact CB-CB 4.13Å; M86-F93 HydrophobicContact CB-CD2 3.62Å; M86-F93 HydrophobicContact CB-CE2 4.26Å; M86-F93 HydrophobicContact CB-CG 4.02Å; M86-F93 HydrophobicContact CG-CD2 3.77Å; M86-F93 HydrophobicContact CG-CE2 4.02Å; M86-F93 HydrophobicContact CG-CG 4.09Å; M86-F93 VanDerWaalsContact O-CD2 3.31Å; M86-F93 WeakPolarHBondContact O-CD2 2.95Å; M86-F93 HydrophobicContact SD-CG 4.49Å; M86-F155 HydrophobicContact CE-CE1 4.06Å; M86-L156 HydrophobicContact CE-CD2 3.69Å; M86-L156 HydrophobicContact SD-CD2 3.62Å; M86-L159 HydrophobicContact CE-CD2 3.74Å; M86-L159 HydrophobicContact SD-CD2 4.19Å; M86-F160 HydrophobicContact SD-CE2 3.84Å; M86-F160 HydrophobicContact SD-CZ 3.59Å; M86-F160 VanDerWaalsContact SD-CZ 3.59Å; M86-F394 HydrophobicContact CG-CD1 4.06Å; M86-F394 HydrophobicContact CG-CE1 3.69Å; M86-F394 HydrophobicContact CG-CZ 4.5Å; M86-F394 HydrophobicContact SD-CE1 4.27Å
87	F	96.4	Very high	92.4	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.018	12%	0.115	C	C	.	.	H	α-helix	trans	-124.3	-13.3	-163.4	-60.9	-64.7	0	0	0	115.2	L83 F84 F93 D94 L109 V114 R118 F164	L83-F87 HydrophobicContact CD2-CD2 3.95Å; L83-F87 HydrophobicContact CD2-CE2 3.74Å; L83-F87 WeakPolarHBondContact O-CB 3.47Å; L83-F87 VanDerWaalsContact O-CD2 3.31Å; L83-F87 WeakPolarHBondContact O-CD2 3.44Å; L83-F87 PolarHBondContact O-N 3.42Å; F84-F87 PolarHBondContact O-N 3.07Å; F87-F93 HydrophobicContact CD1-CB 4.21Å; F87-F93 HydrophobicContact CE1-CB 3.6Å; F87-F93 WeakPolarHBondContact CE1-O 3.3Å; F87-F93 HydrophobicContact CZ-CB 4.06Å; F87-D94 WeakPolarHBondContact CD1-OD1 3.38Å; F87-L109 HydrophobicContact CE2-CD2 4.29Å; F87-L109 HydrophobicContact CZ-CD2 4.27Å; F87-V114 HydrophobicContact CB-CB 4.42Å; F87-V114 HydrophobicContact CB-CG1 3.96Å; F87-V114 HydrophobicContact CB-CG2 3.87Å; F87-V114 HydrophobicContact CD1-CG1 4.32Å; F87-V114 HydrophobicContact CD1-CG2 3.95Å; F87-V114 HydrophobicContact CD2-CG2 3.88Å; F87-V114 HydrophobicContact CE1-CG2 4.46Å; F87-V114 HydrophobicContact CE2-CG2 4.42Å; F87-V114 HydrophobicContact CG-CG1 4.32Å; F87-V114 HydrophobicContact CG-CG2 3.63Å; F87-R118 VanDerWaalsContact O-CZ 3.27Å; F87-R118 PolarHBondContact O-NE 3.3Å; F87-R118 PolarHBondContact O-NH2 2.84Å; F87-F164 HydrophobicContact CZ-CE2 4.09Å; F87-F164 HydrophobicContact CZ-CZ 4.05Å
88	C	97.4	Very high	91.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	-68.9	-62.9	-176	-171.9	0	0	0	0	112	I55 F84 L117	I55-C88 PolarHBondContact N-O 3.45Å; F84-C88 HydrophobicContact CD1-CB 4.03Å; F84-C88 HydrophobicContact CD2-CB 4.02Å; F84-C88 HydrophobicContact CE1-CB 3.94Å; F84-C88 HydrophobicContact CE2-CB 3.95Å; F84-C88 VanDerWaalsContact CE2-SG 3.53Å; F84-C88 HydrophobicContact CG-CB 4.06Å; F84-C88 HydrophobicContact CZ-CB 3.9Å; F84-C88 WeakPolarHBondContact CZ-SG 3.24Å; F84-C88 WeakPolarHBondContact O-CB 3.18Å; F84-C88 PolarHBondContact O-N 2.75Å; C88-L117 HydrophobicContact CB-CD2 3.99Å
89	C	95.6	Very high	90.8	Very high	10 Å²	10	26.9 Å²	26.9	7%	0.068	15%	0.147	C	C	.	.	S	Bend	trans	-108.3	12.2	-172.3	-61.2	0	0	0	0	113.8	R320	C89-R320 WeakPolarHBondContact CB-O 3.36Å
90	T	92.1	Very high	90.1	Very high	6 Å²	6	35.9 Å²	35.9	4%	0.037	19%	0.189	C	C	.	.			trans	-147.4	151.6	176.7	-171.4	0	0	0	0	110.7	M86 I92 F93 R118 A305	M86-T90 WeakPolarHBondContact O-CG2 3.42Å; T90-I92 HydrophobicContact CG2-CD1 4.13Å; T90-I92 HydrophobicContact CG2-CG1 3.88Å; T90-I92 WeakPolarHBondContact OG1-CG1 3.17Å; T90-I92 WeakPolarHBondContact OG1-CG2 2.95Å; T90-I92 PolarHBondContact OG1-N 3.27Å; T90-F93 HydrophobicContact CG2-CD2 4.27Å; T90-R118 PolarHBondContact O-NH2 2.88Å; T90-A305 HydrophobicContact CG2-CB 4.49Å
91	D	90.8	Very high	89.3	Confident	64 Å²	64	42 Å²	42	34%	0.342	22%	0.216	S	C	.	.			trans	-109.7	1.4	176.5	61.5	-3.6	0	0	0	112.3	F93 D94	D91-F93 PolarHBondContact O-N 2.93Å; D91-D94 VanDerWaalsContact O-CB 3.26Å; D91-D94 WeakPolarHBondContact O-CB 3.24Å; D91-D94 PolarHBondContact O-N 3.48Å
92	I	88.5	Confident	88.9	Confident	3 Å²	3	44 Å²	44	2%	0.015	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.7	-176.6	63.2	-178	0	0	0	112.2	T90 R210 A305 Y396 L401	T90-I92 HydrophobicContact CG2-CD1 4.13Å; T90-I92 HydrophobicContact CG2-CG1 3.88Å; T90-I92 WeakPolarHBondContact OG1-CG1 3.17Å; T90-I92 WeakPolarHBondContact OG1-CG2 2.95Å; T90-I92 PolarHBondContact OG1-N 3.27Å; I92-R210 PolarHBondContact O-NE 3.08Å; I92-R210 PolarHBondContact O-NH2 3.45Å; I92-A305 HydrophobicContact CD1-CB 4.31Å; I92-Y396 HydrophobicContact CD1-CD1 3.97Å; I92-Y396 HydrophobicContact CD1-CG 3.96Å; I92-Y396 HydrophobicContact CG2-CD2 4.07Å; I92-Y396 HydrophobicContact CG2-CG 4.04Å; I92-L401 HydrophobicContact CB-CD2 4.45Å; I92-L401 HydrophobicContact CG2-CD1 3.97Å; I92-L401 HydrophobicContact CG2-CD2 3.94Å
93	F	90	Very high	88.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-2.9	-178.6	-61.2	-68.6	0	0	0	113.2	M86 F87 T90 D91 F160 R210 F394	M86-F93 HydrophobicContact CB-CB 4.13Å; M86-F93 HydrophobicContact CB-CD2 3.62Å; M86-F93 HydrophobicContact CB-CE2 4.26Å; M86-F93 HydrophobicContact CB-CG 4.02Å; M86-F93 HydrophobicContact CG-CD2 3.77Å; M86-F93 HydrophobicContact CG-CE2 4.02Å; M86-F93 HydrophobicContact CG-CG 4.09Å; M86-F93 VanDerWaalsContact O-CD2 3.31Å; M86-F93 WeakPolarHBondContact O-CD2 2.95Å; M86-F93 HydrophobicContact SD-CG 4.49Å; F87-F93 HydrophobicContact CD1-CB 4.21Å; F87-F93 HydrophobicContact CE1-CB 3.6Å; F87-F93 WeakPolarHBondContact CE1-O 3.3Å; F87-F93 HydrophobicContact CZ-CB 4.06Å; T90-F93 HydrophobicContact CG2-CD2 4.27Å; D91-F93 PolarHBondContact O-N 2.93Å; F93-F160 AromaticContact CD1-CE1 3.78Å; F93-F160 HydrophobicContact CD1-CE1 3.78Å; F93-F160 AromaticContact CD1-CZ 3.5Å; F93-F160 HydrophobicContact CD1-CZ 3.5Å; F93-F160 VanDerWaalsContact CD1-CZ 3.5Å; F93-F160 HydrophobicContact CE1-CE1 4.47Å; F93-F160 AromaticContact CE1-CZ 3.93Å; F93-F160 HydrophobicContact CE1-CZ 3.93Å; F93-F160 HydrophobicContact CG-CZ 4.3Å; F93-R210 HydrophobicContact CE1-CB 4.2Å; F93-R210 HydrophobicContact CE1-CG 4.35Å; F93-F394 HydrophobicContact CE2-CB 4.39Å; F93-F394 AromaticContact CE2-CD1 3.99Å; F93-F394 HydrophobicContact CE2-CD1 3.99Å; F93-F394 HydrophobicContact CZ-CB 4.32Å; F93-F394 AromaticContact CZ-CD1 3.78Å; F93-F394 HydrophobicContact CZ-CD1 3.78Å
94	D	90.7	Very high	88.3	Confident	32 Å²	32	53.5 Å²	53.5	17%	0.171	27%	0.266	C	S	.	.			trans	-60.8	140.2	-176.7	-76.3	20.8	0	0	0	111.4	Y51 F87 D91 R118	Y51-D94 WeakPolarHBondContact CE2-OD2 3.5Å; F87-D94 WeakPolarHBondContact CD1-OD1 3.38Å; D91-D94 VanDerWaalsContact O-CB 3.26Å; D91-D94 WeakPolarHBondContact O-CB 3.24Å; D91-D94 PolarHBondContact O-N 3.48Å; D94-R118 IonicContact OD1-CZ 3.11Å; D94-R118 IonicContact OD1-NH1 3.06Å; D94-R118 IonicContact OD1-NH2 3.02Å; D94-R118 PolarHBondContact OD1-NH2 2.84Å; D94-R118 IonicContact OD2-CZ 2.83Å; D94-R118 IonicContact OD2-NH1 3.69Å; D94-R118 PolarHBondContact OD2-NH1 3.25Å; D94-R118 IonicContact OD2-NH2 2.8Å; D94-R118 PolarHBondContact OD2-NH2 3.22Å
95	R	83.5	Confident	88	Confident	64 Å²	64	53.6 Å²	53.6	24%	0.242	27%	0.266	C	S	.	.			trans	-132.1	130.8	174.3	-66	-62.2	178.9	-165.7	-2.5	109.8	I106 F164	R95-I106 HydrophobicContact CB-CG2 4.06Å; R95-I106 VanDerWaalsContact O-CG2 3.26Å; R95-I106 WeakPolarHBondContact O-CG2 3.44Å; R95-F164 HydrophobicContact CB-CD1 4.06Å; R95-F164 HydrophobicContact CB-CE1 3.97Å; R95-F164 HydrophobicContact CB-CG 4.4Å; R95-F164 HydrophobicContact CB-CZ 4.2Å; R95-F164 HydrophobicContact CG-CB 4.07Å; R95-F164 HydrophobicContact CG-CD1 3.72Å; R95-F164 HydrophobicContact CG-CD2 3.57Å; R95-F164 HydrophobicContact CG-CE1 3.91Å; R95-F164 HydrophobicContact CG-CE2 3.77Å; R95-F164 HydrophobicContact CG-CG 3.55Å; R95-F164 HydrophobicContact CG-CZ 3.93Å
96	S	70	Confident	87.8	Confident	99 Å²	99	53.6 Å²	53.6	69%	0.692	27%	0.266	S	S	*	.			trans	-101.5	-25.4	-178.3	58.5	0	0	0	0	113.1
97	K	71.9	Confident	87.7	Confident	177 Å²	177	57 Å²	57	77%	0.77	29%	0.287	S	S	*	.			trans	-146.8	143.9	-174.5	-62.8	-174.7	-177.7	178.5	0	111.7
98	G	74.7	Confident	87.6	Confident	32 Å²	32	58 Å²	58	33%	0.33	29%	0.292	S	S	.	.			trans	-131.2	-173.4	161.4	0	0	0	0	0	108.8
99	D	84.9	Confident	87.6	Confident	70 Å²	70	58 Å²	58	37%	0.374	29%	0.293	S	S	.	.			trans	-61.6	175.4	167.3	67.9	17.9	0	0	0	111.9	K101 R102 S103	D99-K101 PolarHBondContact O-N 3.5Å; D99-K101 PolarHBondContact OD1-N 3.06Å; D99-K101 VanDerWaalsContact OD1-N 3.16Å; D99-R102 PolarHBondContact O-N 3.14Å; D99-R102 VanDerWaalsContact OD1-CB 3.26Å; D99-R102 WeakPolarHBondContact OD1-CB 3.33Å; D99-R102 WeakPolarHBondContact OD1-CD 3.49Å; D99-R102 VanDerWaalsContact OD1-CG 3.26Å; D99-R102 WeakPolarHBondContact OD1-CG 3.31Å; D99-R102 PolarHBondContact OD1-N 2.95Å; D99-R102 IonicContact OD2-CZ 3.69Å; D99-R102 IonicContact OD2-NH1 3.88Å; D99-R102 PolarHBondContact OD2-NH1 3.16Å; D99-S103 WeakPolarHBondContact O-CB 3.47Å; D99-S103 PolarHBondContact O-N 2.84Å
100	E	81.1	Confident	87.6	Confident	188 Å²	188	58.2 Å²	58.2	88%	0.879	29%	0.294	S	S	*	.	H	α-helix	trans	-52.6	-41.1	-177.5	-169.7	177.5	-177.3	0	0	113
101	K	81.4	Confident	87.8	Confident	130 Å²	130	58.7 Å²	58.7	57%	0.565	30%	0.298	S	S	*	.	H	α-helix	trans	-72.3	-43.2	-178	-155.3	-164.5	168.4	-164.4	0	111.5	D99 F138	D99-K101 PolarHBondContact O-N 3.5Å; D99-K101 PolarHBondContact OD1-N 3.06Å; D99-K101 VanDerWaalsContact OD1-N 3.16Å; K101-F138 HydrophobicContact CB-CE2 3.75Å; K101-F138 HydrophobicContact CD-CD2 3.73Å; K101-F138 HydrophobicContact CD-CE2 3.25Å; K101-F138 HydrophobicContact CD-CZ 3.86Å; K101-F138 VanDerWaalsContact CE-CD2 3.4Å; K101-F138 VanDerWaalsContact CE-CE2 3.49Å; K101-F138 HydrophobicContact CG-CD2 3.76Å; K101-F138 HydrophobicContact CG-CE2 3.31Å; K101-F138 HydrophobicContact CG-CZ 4.3Å; K101-F138 PolarHBondContact NZ-O 2.87Å
102	R	89.4	Confident	88.1	Confident	42 Å²	42	55.7 Å²	55.7	16%	0.158	28%	0.281	C	S	.	.	H	α-helix	trans	-79.7	-29.5	-176.7	-69.3	164	174.2	117.3	10.2	112.6	D99 R104 I105 I106 F138 R162 I163 Q165	D99-R102 PolarHBondContact O-N 3.14Å; D99-R102 VanDerWaalsContact OD1-CB 3.26Å; D99-R102 WeakPolarHBondContact OD1-CB 3.33Å; D99-R102 WeakPolarHBondContact OD1-CD 3.49Å; D99-R102 VanDerWaalsContact OD1-CG 3.26Å; D99-R102 WeakPolarHBondContact OD1-CG 3.31Å; D99-R102 PolarHBondContact OD1-N 2.95Å; D99-R102 IonicContact OD2-CZ 3.69Å; D99-R102 IonicContact OD2-NH1 3.88Å; D99-R102 PolarHBondContact OD2-NH1 3.16Å; R102-R104 PolarHBondContact O-N 3.3Å; R102-I105 PolarHBondContact O-N 3.43Å; R102-I106 HydrophobicContact CB-CD1 4.19Å; R102-I106 WeakPolarHBondContact O-CG1 3.36Å; R102-I106 PolarHBondContact O-N 3.3Å; R102-F138 HydrophobicContact CG-CE1 4.46Å; R102-F138 HydrophobicContact CG-CE2 3.89Å; R102-F138 HydrophobicContact CG-CZ 3.5Å; R102-R162 PolarHBondContact NE-O 2.91Å; R102-R162 PolarHBondContact NH2-O 3.1Å; R102-I163 VanDerWaalsContact CD-O 3.27Å; R102-I163 WeakPolarHBondContact CD-O 3.46Å; R102-Q165 VanDerWaalsContact CZ-OE1 3.24Å
103	S	90.7	Very high	88.6	Confident	45 Å²	45	55.6 Å²	55.6	32%	0.315	28%	0.281	S	S	.	.	H	α-helix	trans	-54.4	-38.7	179.4	-176.4	0	0	0	0	111.4	D99 I105 T107	D99-S103 WeakPolarHBondContact O-CB 3.47Å; D99-S103 PolarHBondContact O-N 2.84Å; S103-I105 VanDerWaalsContact C-N 3.35Å; S103-I105 PolarHBondContact O-N 3.17Å; S103-T107 WeakPolarHBondContact O-CB 3.41Å; S103-T107 PolarHBondContact O-N 2.99Å; S103-T107 PolarHBondContact O-OG1 2.8Å
104	R	92.2	Very high	89	Confident	154 Å²	154	55.8 Å²	55.8	58%	0.581	28%	0.282	S	S	*	.	H	α-helix	trans	-58.2	-43.6	174.2	-172.3	-178	172.7	-149.7	-7.2	112.6	R102 L108 L134 E137	R102-R104 PolarHBondContact O-N 3.3Å; R104-L108 WeakPolarHBondContact O-CB 3.39Å; R104-L108 PolarHBondContact O-N 3.2Å; R104-L134 HydrophobicContact CG-CD2 4.04Å; R104-E137 IonicContact CZ-OE2 3.43Å; R104-E137 IonicContact NH1-OE2 3.24Å; R104-E137 PolarHBondContact NH1-OE2 3.14Å; R104-E137 IonicContact NH2-OE2 3.79Å
105	I	92.9	Very high	89.3	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-74.4	-46.1	-178	-62	170.3	0	0	0	111.1	R102 S103 T107 L108 L109 F131 L134 L135 F138 I163	R102-I105 PolarHBondContact O-N 3.43Å; S103-I105 VanDerWaalsContact C-N 3.35Å; S103-I105 PolarHBondContact O-N 3.17Å; I105-T107 VanDerWaalsContact C-N 3.3Å; I105-T107 PolarHBondContact O-N 3.37Å; I105-L108 PolarHBondContact O-N 3.39Å; I105-L109 WeakPolarHBondContact O-CB 3.36Å; I105-L109 PolarHBondContact O-N 3.41Å; I105-F131 HydrophobicContact CG2-CD2 4.28Å; I105-F131 HydrophobicContact CG2-CE2 3.62Å; I105-L134 HydrophobicContact CB-CD2 4.21Å; I105-L134 HydrophobicContact CD1-CG 4.5Å; I105-L134 HydrophobicContact CG1-CD2 3.56Å; I105-L134 HydrophobicContact CG1-CG 3.72Å; I105-L135 HydrophobicContact CG2-CD2 4.11Å; I105-F138 HydrophobicContact CD1-CB 3.38Å; I105-F138 HydrophobicContact CD1-CD1 3.89Å; I105-F138 HydrophobicContact CD1-CD2 3.3Å; I105-F138 HydrophobicContact CD1-CE2 3.96Å; I105-F138 HydrophobicContact CD1-CG 3.26Å; I105-F138 HydrophobicContact CG1-CD2 4.42Å; I105-I163 HydrophobicContact CB-CG2 4.17Å; I105-I163 HydrophobicContact CG2-CD1 3.86Å; I105-I163 HydrophobicContact CG2-CG1 4.48Å; I105-I163 HydrophobicContact CG2-CG2 3.87Å
106	I	93.9	Very high	90	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.015	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-44.8	177.6	-65.1	168.7	0	0	0	109.5	R95 R102 L108 L109 S110 I163 F164	R95-I106 HydrophobicContact CB-CG2 4.06Å; R95-I106 VanDerWaalsContact O-CG2 3.26Å; R95-I106 WeakPolarHBondContact O-CG2 3.44Å; R102-I106 HydrophobicContact CB-CD1 4.19Å; R102-I106 WeakPolarHBondContact O-CG1 3.36Å; R102-I106 PolarHBondContact O-N 3.3Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 3.02Å; I106-L109 PolarHBondContact O-N 3.17Å; I106-S110 WeakPolarHBondContact O-CB 3.44Å; I106-S110 PolarHBondContact O-N 3.19Å; I106-S110 PolarHBondContact O-OG 3.32Å; I106-I163 HydrophobicContact CD1-CG2 4.43Å; I106-I163 HydrophobicContact CG1-CG2 3.81Å; I106-F164 HydrophobicContact CD1-CD1 4.33Å; I106-F164 HydrophobicContact CG1-CD1 4.06Å; I106-F164 HydrophobicContact CG1-CE1 4.05Å
107	T	93.9	Very high	91.3	Very high	73 Å²	73	47.8 Å²	47.8	45%	0.448	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-41.2	176.6	-59.3	0	0	0	0	111.6	S103 I105 S111	S103-T107 WeakPolarHBondContact O-CB 3.41Å; S103-T107 PolarHBondContact O-N 2.99Å; S103-T107 PolarHBondContact O-OG1 2.8Å; I105-T107 VanDerWaalsContact C-N 3.3Å; I105-T107 PolarHBondContact O-N 3.37Å; T107-S111 VanDerWaalsContact O-CB 3.24Å; T107-S111 WeakPolarHBondContact O-CB 3.35Å; T107-S111 PolarHBondContact O-N 3.46Å; T107-S111 PolarHBondContact O-OG 3.39Å
108	L	94.8	Very high	92.5	Very high	23 Å²	23	39.7 Å²	39.7	12%	0.12	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-48	177.7	-177.3	66.5	0	0	0	111.4	R104 I105 I106 S110 A112 K130 F131 L134	R104-L108 WeakPolarHBondContact O-CB 3.39Å; R104-L108 PolarHBondContact O-N 3.2Å; I105-L108 PolarHBondContact O-N 3.39Å; I106-L108 VanDerWaalsContact C-N 3.34Å; I106-L108 PolarHBondContact O-N 3.02Å; L108-S110 VanDerWaalsContact C-N 3.35Å; L108-S110 PolarHBondContact O-N 3.07Å; L108-A112 HydrophobicContact CD1-CB 3.94Å; L108-A112 WeakPolarHBondContact O-CB 3.41Å; L108-A112 PolarHBondContact O-N 3.33Å; L108-K130 HydrophobicContact CD2-CB 4.48Å; L108-F131 HydrophobicContact CD2-CB 4.34Å; L108-L134 HydrophobicContact CB-CD2 4.23Å; L108-L134 HydrophobicContact CD2-CB 4.05Å; L108-L134 HydrophobicContact CD2-CD2 3.62Å; L108-L134 HydrophobicContact CD2-CG 4.5Å
109	L	96.6	Very high	93.5	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-55.6	-51.2	176.2	174.6	58.9	0	0	0	110.8	L83 F87 I105 I106 I113 V114 F131 L159 F164	L83-L109 HydrophobicContact CD2-CD1 3.65Å; F87-L109 HydrophobicContact CE2-CD2 4.29Å; F87-L109 HydrophobicContact CZ-CD2 4.27Å; I105-L109 WeakPolarHBondContact O-CB 3.36Å; I105-L109 PolarHBondContact O-N 3.41Å; I106-L109 PolarHBondContact O-N 3.17Å; L109-I113 HydrophobicContact CD1-CB 4.3Å; L109-I113 HydrophobicContact CD1-CD1 4.11Å; L109-I113 WeakPolarHBondContact O-CA 3.47Å; L109-I113 WeakPolarHBondContact O-CB 3.38Å; L109-I113 PolarHBondContact O-N 3.08Å; L109-I113 VanDerWaalsContact O-N 3.1Å; L109-V114 HydrophobicContact CD1-CG2 4.23Å; L109-V114 HydrophobicContact CG-CG2 4.18Å; L109-V114 PolarHBondContact O-N 3.25Å; L109-F131 HydrophobicContact CB-CD2 4.19Å; L109-F131 HydrophobicContact CB-CE2 3.79Å; L109-F131 HydrophobicContact CB-CZ 4.36Å; L109-F131 HydrophobicContact CD1-CE1 4.33Å; L109-F131 HydrophobicContact CD1-CE2 4.26Å; L109-F131 HydrophobicContact CD1-CZ 4.09Å; L109-F131 HydrophobicContact CD2-CE2 4.44Å; L109-F131 HydrophobicContact CD2-CZ 4.28Å; L109-F131 HydrophobicContact CG-CE2 4.38Å; L109-F131 HydrophobicContact CG-CZ 4.48Å; L109-L159 HydrophobicContact CD2-CD1 4.06Å; L109-F164 HydrophobicContact CD2-CE1 3.94Å; L109-F164 HydrophobicContact CD2-CZ 3.63Å
110	S	96.3	Very high	94.1	Very high	13 Å²	13	44.6 Å²	44.6	9%	0.091	21%	0.209	C	C	.	.	I	π-helix	trans	-65.4	-50.8	-177.7	-58.3	0	0	0	0	111.7	I106 L108 V114 Y115	I106-S110 WeakPolarHBondContact O-CB 3.44Å; I106-S110 PolarHBondContact O-N 3.19Å; I106-S110 PolarHBondContact O-OG 3.32Å; L108-S110 VanDerWaalsContact C-N 3.35Å; L108-S110 PolarHBondContact O-N 3.07Å; S110-V114 PolarHBondContact O-N 2.88Å; S110-Y115 WeakPolarHBondContact O-CB 3.36Å; S110-Y115 WeakPolarHBondContact O-CD2 3.29Å; S110-Y115 VanDerWaalsContact O-CG 3.23Å; S110-Y115 PolarHBondContact O-N 2.81Å
111	S	96	Very high	94.8	Very high	17 Å²	17	36.7 Å²	36.7	12%	0.119	17%	0.172	C	C	.	.	I	π-helix	trans	-82	-23	-170.9	66.4	0	0	0	0	115.7	K47 V48 T107 P116	K47-S111 CarbonylContact C-O 3.46Å; K47-S111 VanDerWaalsContact CA-O 3.31Å; K47-S111 WeakPolarHBondContact CA-O 3.47Å; V48-S111 PolarHBondContact N-O 3.47Å; V48-S111 WeakPolarHBondContact O-CA 3.48Å; V48-S111 WeakPolarHBondContact O-CB 3.48Å; T107-S111 VanDerWaalsContact O-CB 3.24Å; T107-S111 WeakPolarHBondContact O-CB 3.35Å; T107-S111 PolarHBondContact O-N 3.46Å; T107-S111 PolarHBondContact O-OG 3.39Å; S111-P116 WeakPolarHBondContact O-CD 3.48Å; S111-P116 VanDerWaalsContact O-CG 3.3Å; S111-P116 WeakPolarHBondContact O-CG 3.34Å
112	A	97.2	Very high	95.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.	I	π-helix	trans	-106.5	-16.1	-178.7	0	0	0	0	0	113.4	K47 L108 H127	K47-A112 HydrophobicContact CG-CB 4.3Å; L108-A112 HydrophobicContact CD1-CB 3.94Å; L108-A112 WeakPolarHBondContact O-CB 3.41Å; L108-A112 PolarHBondContact O-N 3.33Å; A112-H127 HydrophobicContact CB-CB 4.18Å; A112-H127 WeakPolarHBondContact O-CB 3.47Å
113	I	98.3	Very high	96.1	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	14%	0.14	C	C	.	.	I	π-helix	trans	-125.7	-63	-178	-53.7	176.1	0	0	0	111	I70 L83 L109 P116 L117 V123 V128 F131	I70-I113 HydrophobicContact CD1-CG2 4.04Å; L83-I113 HydrophobicContact CD1-CD1 4.13Å; L83-I113 HydrophobicContact CD1-CG2 4.28Å; L109-I113 HydrophobicContact CD1-CB 4.3Å; L109-I113 HydrophobicContact CD1-CD1 4.11Å; L109-I113 WeakPolarHBondContact O-CA 3.47Å; L109-I113 WeakPolarHBondContact O-CB 3.38Å; L109-I113 PolarHBondContact O-N 3.08Å; L109-I113 VanDerWaalsContact O-N 3.1Å; I113-P116 WeakPolarHBondContact O-CD 3.1Å; I113-L117 WeakPolarHBondContact O-CB 3.04Å; I113-L117 PolarHBondContact O-N 3.24Å; I113-V123 HydrophobicContact CG1-CG1 4.4Å; I113-V123 HydrophobicContact CG2-CG1 4.38Å; I113-V123 HydrophobicContact CG2-CG2 4.41Å; I113-V123 WeakPolarHBondContact O-CG2 3.43Å; I113-V128 HydrophobicContact CD1-CG2 4.32Å; I113-F131 HydrophobicContact CD1-CB 3.79Å; I113-F131 HydrophobicContact CD1-CD1 4.06Å; I113-F131 HydrophobicContact CD1-CG 3.98Å
114	V	97.9	Very high	96.4	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.018	13%	0.132	C	C	.	.	I	π-helix	trans	-64.6	-53.2	-170.1	176.9	0	0	0	0	112.5	F87 L109 S110 L117 R118	F87-V114 HydrophobicContact CB-CB 4.42Å; F87-V114 HydrophobicContact CB-CG1 3.96Å; F87-V114 HydrophobicContact CB-CG2 3.87Å; F87-V114 HydrophobicContact CD1-CG1 4.32Å; F87-V114 HydrophobicContact CD1-CG2 3.95Å; F87-V114 HydrophobicContact CD2-CG2 3.88Å; F87-V114 HydrophobicContact CE1-CG2 4.46Å; F87-V114 HydrophobicContact CE2-CG2 4.42Å; F87-V114 HydrophobicContact CG-CG1 4.32Å; F87-V114 HydrophobicContact CG-CG2 3.63Å; L109-V114 HydrophobicContact CD1-CG2 4.23Å; L109-V114 HydrophobicContact CG-CG2 4.18Å; L109-V114 PolarHBondContact O-N 3.25Å; S110-V114 PolarHBondContact O-N 2.88Å; V114-L117 WeakPolarHBondContact O-CB 2.76Å; V114-L117 PolarHBondContact O-N 3.47Å; V114-R118 VanDerWaalsContact CG1-CZ 3.43Å; V114-R118 WeakPolarHBondContact O-CG 3.42Å; V114-R118 PolarHBondContact O-N 3.2Å; V114-R118 VanDerWaalsContact O-N 3.09Å
115	Y	97.6	Very high	96.6	Very high	27 Å²	27	21.6 Å²	21.6	11%	0.106	11%	0.106	C	C	.	.	H	α-helix	trans	-70.3	-40.9	-177.4	-55.4	-24.7	0	0	0	112.6	V48 S50 Y51 V52 S110 R118 R119	V48-Y115 WeakPolarHBondContact O-CD2 3.31Å; S50-Y115 WeakPolarHBondContact O-CD2 3.38Å; Y51-Y115 AromaticContact CD2-CE1 3.79Å; Y51-Y115 HydrophobicContact CD2-CE1 3.79Å; Y51-Y115 HydrophobicContact CE2-CE1 4.43Å; V52-Y115 HydrophobicContact CB-CD1 4.33Å; V52-Y115 HydrophobicContact CG2-CG 4.31Å; S110-Y115 WeakPolarHBondContact O-CB 3.36Å; S110-Y115 WeakPolarHBondContact O-CD2 3.29Å; S110-Y115 VanDerWaalsContact O-CG 3.23Å; S110-Y115 PolarHBondContact O-N 2.81Å; Y115-R118 PolarHBondContact O-N 3.26Å; Y115-R119 VanDerWaalsContact O-CB 3.27Å; Y115-R119 WeakPolarHBondContact O-CB 3.36Å; Y115-R119 PolarHBondContact O-N 2.76Å
116	P	98	Very high	96.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-39.2	170.3	-23.5	34.7	0	0	0	113.4	G46 V48 S111 I113 R118 R119 C120 H121 V123	G46-P116 WeakPolarHBondContact O-CG 3.36Å; V48-P116 HydrophobicContact CB-CG 4.2Å; V48-P116 HydrophobicContact CG2-CB 4.35Å; V48-P116 HydrophobicContact CG2-CG 3.98Å; S111-P116 WeakPolarHBondContact O-CD 3.48Å; S111-P116 VanDerWaalsContact O-CG 3.3Å; S111-P116 WeakPolarHBondContact O-CG 3.34Å; I113-P116 WeakPolarHBondContact O-CD 3.1Å; P116-R118 VanDerWaalsContact C-N 3.29Å; P116-R118 PolarHBondContact O-N 3.15Å; P116-R119 PolarHBondContact O-N 3.5Å; P116-C120 WeakPolarHBondContact O-CA 3.47Å; P116-C120 VanDerWaalsContact O-CB 3.24Å; P116-C120 WeakPolarHBondContact O-CB 3.41Å; P116-C120 PolarHBondContact O-N 3.37Å; P116-H121 PolarHBondContact O-N 2.93Å; P116-V123 HydrophobicContact CB-CG2 4.37Å
117	L	98	Very high	96.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-57.2	-45	174.6	176.5	61.5	0	0	0	111.1	I70 F84 C88 I113 V114 H121 V123	I70-L117 HydrophobicContact CD1-CD2 4.25Å; I70-L117 HydrophobicContact CG1-CD1 4.2Å; I70-L117 HydrophobicContact CG1-CD2 4.31Å; F84-L117 HydrophobicContact CD2-CD1 4.25Å; F84-L117 HydrophobicContact CD2-CD2 4.27Å; F84-L117 HydrophobicContact CE2-CD1 4.36Å; C88-L117 HydrophobicContact CB-CD2 3.99Å; I113-L117 WeakPolarHBondContact O-CB 3.04Å; I113-L117 PolarHBondContact O-N 3.24Å; V114-L117 WeakPolarHBondContact O-CB 2.76Å; V114-L117 PolarHBondContact O-N 3.47Å; L117-H121 WeakPolarHBondContact O-CA 3.17Å; L117-H121 PolarHBondContact O-N 3.32Å; L117-H121 VanDerWaalsContact O-N 3.1Å; L117-V123 HydrophobicContact CB-CG2 3.7Å; L117-V123 HydrophobicContact CD1-CG2 4.48Å
118	R	97	Very high	97	Very high	7 Å²	7	19.1 Å²	19.1	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-75.4	-34.2	-178.2	-67.5	167	175.7	174.1	8.6	113.6	V52 P53 I55 F87 T90 D94 V114 Y115 P116	V52-R118 HydrophobicContact CB-CB 4.15Å; V52-R118 HydrophobicContact CG1-CB 3.59Å; V52-R118 VanDerWaalsContact O-CD 3.24Å; V52-R118 WeakPolarHBondContact O-CD 3.44Å; V52-R118 PolarHBondContact O-NH1 2.88Å; P53-R118 WeakPolarHBondContact O-CD 3.46Å; I55-R118 HydrophobicContact CG1-CB 4.43Å; I55-R118 HydrophobicContact CG1-CG 4.49Å; F87-R118 VanDerWaalsContact O-CZ 3.27Å; F87-R118 PolarHBondContact O-NE 3.3Å; F87-R118 PolarHBondContact O-NH2 2.84Å; T90-R118 PolarHBondContact O-NH2 2.88Å; D94-R118 IonicContact OD1-CZ 3.11Å; D94-R118 IonicContact OD1-NH1 3.06Å; D94-R118 IonicContact OD1-NH2 3.02Å; D94-R118 PolarHBondContact OD1-NH2 2.84Å; D94-R118 IonicContact OD2-CZ 2.83Å; D94-R118 IonicContact OD2-NH1 3.69Å; D94-R118 PolarHBondContact OD2-NH1 3.25Å; D94-R118 IonicContact OD2-NH2 2.8Å; D94-R118 PolarHBondContact OD2-NH2 3.22Å; V114-R118 VanDerWaalsContact CG1-CZ 3.43Å; V114-R118 WeakPolarHBondContact O-CG 3.42Å; V114-R118 PolarHBondContact O-N 3.2Å; V114-R118 VanDerWaalsContact O-N 3.09Å; Y115-R118 PolarHBondContact O-N 3.26Å; P116-R118 VanDerWaalsContact C-N 3.29Å; P116-R118 PolarHBondContact O-N 3.15Å
119	R	96.4	Very high	97.1	Very high	157 Å²	157	18.8 Å²	18.8	59%	0.592	9%	0.088	S	C	*	.	H	α-helix	trans	-88.7	-45.3	-176.4	-179.9	172.3	176.1	133.9	0.6	113.4	V52 Y115 P116	V52-R119 HydrophobicContact CG1-CB 4.15Å; V52-R119 HydrophobicContact CG2-CB 4.16Å; Y115-R119 VanDerWaalsContact O-CB 3.27Å; Y115-R119 WeakPolarHBondContact O-CB 3.36Å; Y115-R119 PolarHBondContact O-N 2.76Å; P116-R119 PolarHBondContact O-N 3.5Å
120	C	96.1	Very high	97	Very high	48 Å²	48	22.8 Å²	22.8	32%	0.324	11%	0.105	S	C	.	.	H	α-helix	trans	-98	-11.2	-173.9	-55.6	0	0	0	0	111.5	S45 P116 Y122	S45-C120 PolarHBondContact O-SG 3.13Å; P116-C120 WeakPolarHBondContact O-CA 3.47Å; P116-C120 VanDerWaalsContact O-CB 3.24Å; P116-C120 WeakPolarHBondContact O-CB 3.41Å; P116-C120 PolarHBondContact O-N 3.37Å; C120-Y122 PolarHBondContact O-N 2.89Å; C120-Y122 VanDerWaalsContact O-N 3.14Å
121	H	97.3	Very high	97	Very high	22 Å²	22	22.1 Å²	22.1	10%	0.102	10%	0.1	C	C	.	.	S	Bend	trans	61.6	15.9	-177.4	-44.8	97.6	0	0	0	113.4	L63 K68 G69 P116 L117	L63-H121 HydrophobicContact CD1-CB 3.97Å; K68-H121 CarbonylContact C-O 3.53Å; K68-H121 VanDerWaalsContact CA-O 3.3Å; K68-H121 WeakPolarHBondContact CA-O 3.39Å; K68-H121 HydrophobicContact CD-CB 3.82Å; K68-H121 WeakPolarHBondContact CD-O 3.14Å; G69-H121 PolarHBondContact N-O 3.37Å; P116-H121 PolarHBondContact O-N 2.93Å; L117-H121 WeakPolarHBondContact O-CA 3.17Å; L117-H121 PolarHBondContact O-N 3.32Å; L117-H121 VanDerWaalsContact O-N 3.1Å
122	Y	98	Very high	96.9	Very high	12 Å²	12	21.4 Å²	21.4	5%	0.047	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	144.3	-177.2	178.7	-104.9	0	0	0	109.8	L43 S45 P67 G69 Q71 C120 R124 P348	L43-Y122 HydrophobicContact CB-CE1 4.23Å; L43-Y122 HydrophobicContact CD2-CD1 3.68Å; L43-Y122 HydrophobicContact CD2-CD2 4.38Å; L43-Y122 HydrophobicContact CD2-CE1 3.81Å; L43-Y122 HydrophobicContact CD2-CE2 4.49Å; L43-Y122 HydrophobicContact CD2-CG 3.97Å; L43-Y122 HydrophobicContact CG-CD1 3.82Å; L43-Y122 HydrophobicContact CG-CE1 3.79Å; L43-Y122 WeakPolarHBondContact O-CE1 3.43Å; S45-Y122 WeakPolarHBondContact CB-O 3.42Å; P67-Y122 HydrophobicContact CB-CD2 3.97Å; P67-Y122 HydrophobicContact CB-CE2 3.83Å; G69-Y122 CarbonylContact O-C 3.53Å; G69-Y122 WeakPolarHBondContact O-CA 3.15Å; Q71-Y122 HydrophobicContact CB-CE2 4.1Å; Q71-Y122 VanDerWaalsContact CD-OH 3.32Å; Q71-Y122 PolarHBondContact NE2-OH 3.09Å; Q71-Y122 PolarHBondContact OE1-OH 3.25Å; C120-Y122 PolarHBondContact O-N 2.89Å; C120-Y122 VanDerWaalsContact O-N 3.14Å; Y122-R124 HydrophobicContact CE1-CB 3.83Å; Y122-R124 HydrophobicContact CE1-CG 4.42Å; Y122-P348 HydrophobicContact CD2-CG 4.05Å; Y122-P348 HydrophobicContact CE2-CG 3.69Å
123	V	98.5	Very high	96.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	121.1	169.9	-178.5	0	0	0	0	108.4	G69 I70 Q71 I113 P116 L117 H127 V128	G69-V123 PolarHBondContact O-N 3.13Å; I70-V123 HydrophobicContact CG1-CB 4.24Å; I70-V123 HydrophobicContact CG1-CG2 4.34Å; I70-V123 HydrophobicContact CG2-CB 4.45Å; Q71-V123 WeakPolarHBondContact CB-O 3.23Å; Q71-V123 PolarHBondContact N-O 3.5Å; I113-V123 HydrophobicContact CG1-CG1 4.4Å; I113-V123 HydrophobicContact CG2-CG1 4.38Å; I113-V123 HydrophobicContact CG2-CG2 4.41Å; I113-V123 WeakPolarHBondContact O-CG2 3.43Å; P116-V123 HydrophobicContact CB-CG2 4.37Å; L117-V123 HydrophobicContact CB-CG2 3.7Å; L117-V123 HydrophobicContact CD1-CG2 4.48Å; V123-H127 HydrophobicContact CG1-CB 3.98Å; V123-V128 HydrophobicContact CG1-CG2 4.41Å
124	R	97.7	Very high	96.5	Very high	39 Å²	39	27 Å²	27	15%	0.147	12%	0.12	C	C	.	.			trans	-72.7	146.2	176.4	-163.5	176	62.8	-162.8	-12.2	111	F40 G41 L43 D44 Y122 D126 H127	F40-R124 VanDerWaalsContact CB-CD 3.5Å; F40-R124 HydrophobicContact CB-CG 3.7Å; F40-R124 VanDerWaalsContact O-CD 3.29Å; F40-R124 WeakPolarHBondContact O-CD 3.31Å; F40-R124 WeakPolarHBondContact O-CG 3.16Å; G41-R124 PolarHBondContact O-NH1 2.78Å; L43-R124 VanDerWaalsContact O-CD 3.27Å; L43-R124 WeakPolarHBondContact O-CD 3.16Å; D44-R124 VanDerWaalsContact CG-NH2 3.25Å; D44-R124 IonicContact OD1-NH2 2.72Å; D44-R124 IonicContact OD2-CZ 3.34Å; D44-R124 IonicContact OD2-NH1 2.64Å; D44-R124 IonicContact OD2-NH2 2.71Å; D44-R124 PolarHBondContact OD2-NH2 2.75Å; Y122-R124 HydrophobicContact CE1-CB 3.83Å; Y122-R124 HydrophobicContact CE1-CG 4.42Å; R124-D126 WeakPolarHBondContact CB-OD1 3.49Å; R124-D126 IonicContact CZ-OD1 3.46Å; R124-D126 IonicContact NE-OD1 3.87Å; R124-D126 PolarHBondContact NE-OD1 3.09Å; R124-D126 IonicContact NH2-OD1 2.74Å; R124-D126 PolarHBondContact NH2-OD1 2.92Å; R124-D126 IonicContact NH2-OD2 2.72Å; R124-D126 PolarHBondContact NH2-OD2 3.27Å; R124-D126 PolarHBondContact O-N 2.77Å; R124-D126 VanDerWaalsContact O-N 3.09Å; R124-H127 PolarHBondContact O-N 3.08Å; R124-H127 VanDerWaalsContact O-N 3.08Å
125	A	96.7	Very high	96.2	Very high	3 Å²	3	26.9 Å²	26.9	3%	0.025	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-22.1	-172.3	0	0	0	0	0	114.1	F40 Q71 H127 V128 M129	F40-A125 HydrophobicContact CD1-CB 3.73Å; F40-A125 HydrophobicContact CE1-CB 3.93Å; Q71-A125 HydrophobicContact CB-CB 4.17Å; Q71-A125 HydrophobicContact CG-CB 4.02Å; Q71-A125 VanDerWaalsContact O-CB 3.31Å; Q71-A125 WeakPolarHBondContact O-CB 3.48Å; A125-H127 VanDerWaalsContact C-N 3.25Å; A125-H127 PolarHBondContact O-N 3.16Å; A125-V128 PolarHBondContact O-N 3.05Å; A125-M129 WeakPolarHBondContact O-CB 3.34Å; A125-M129 PolarHBondContact O-N 3.09Å
126	D	95.7	Very high	95.9	Very high	19 Å²	19	26.9 Å²	26.9	10%	0.102	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-27	177	75.5	-62.2	0	0	0	113	F40 R124 K130	F40-D126 HydrophobicContact CD2-CB 3.76Å; F40-D126 HydrophobicContact CE2-CB 3.74Å; F40-D126 HydrophobicContact CG-CB 4.29Å; F40-D126 HydrophobicContact CZ-CB 4.26Å; R124-D126 WeakPolarHBondContact CB-OD1 3.49Å; R124-D126 IonicContact CZ-OD1 3.46Å; R124-D126 IonicContact NE-OD1 3.87Å; R124-D126 PolarHBondContact NE-OD1 3.09Å; R124-D126 IonicContact NH2-OD1 2.74Å; R124-D126 PolarHBondContact NH2-OD1 2.92Å; R124-D126 IonicContact NH2-OD2 2.72Å; R124-D126 PolarHBondContact NH2-OD2 3.27Å; R124-D126 PolarHBondContact O-N 2.77Å; R124-D126 VanDerWaalsContact O-N 3.09Å; D126-K130 VanDerWaalsContact O-CG 3.26Å; D126-K130 WeakPolarHBondContact O-CG 3.1Å; D126-K130 PolarHBondContact O-N 3.32Å; D126-K130 IonicContact OD2-NZ 3.88Å; D126-K130 PolarHBondContact OD2-NZ 3.34Å
127	H	97.3	Very high	95.5	Very high	5 Å²	5	32.4 Å²	32.4	2%	0.023	15%	0.149	C	C	.	.	H	α-helix	trans	-71.6	-41.5	173.6	-61.6	-68.1	0	0	0	111.6	D44 A112 V123 R124 A125 M129 K130 F131	D44-H127 IonicContact OD1-CD2 3.59Å; D44-H127 IonicContact OD1-CE1 3.57Å; D44-H127 IonicContact OD1-NE2 3.47Å; D44-H127 PolarHBondContact OD1-NE2 3.43Å; A112-H127 HydrophobicContact CB-CB 4.18Å; A112-H127 WeakPolarHBondContact O-CB 3.47Å; V123-H127 HydrophobicContact CG1-CB 3.98Å; R124-H127 PolarHBondContact O-N 3.08Å; R124-H127 VanDerWaalsContact O-N 3.08Å; A125-H127 VanDerWaalsContact C-N 3.25Å; A125-H127 PolarHBondContact O-N 3.16Å; H127-M129 VanDerWaalsContact C-N 3.34Å; H127-K130 PolarHBondContact O-N 3.47Å; H127-F131 PolarHBondContact O-N 3.34Å; H127-F131 VanDerWaalsContact O-N 3.08Å
128	V	96.7	Very high	95.1	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-42.3	172.6	-173.6	0	0	0	0	110.2	I70 M79 I113 V123 A125 K130 F131 R132	I70-V128 HydrophobicContact CG2-CG2 3.55Å; M79-V128 HydrophobicContact SD-CG1 4.03Å; I113-V128 HydrophobicContact CD1-CG2 4.32Å; V123-V128 HydrophobicContact CG1-CG2 4.41Å; A125-V128 PolarHBondContact O-N 3.05Å; V128-K130 PolarHBondContact O-N 3.21Å; V128-F131 CarbonylContact O-C 3.56Å; V128-F131 WeakPolarHBondContact O-CA 3.47Å; V128-F131 WeakPolarHBondContact O-CB 3.27Å; V128-F131 PolarHBondContact O-N 2.99Å; V128-F131 VanDerWaalsContact O-N 3.09Å; V128-R132 HydrophobicContact CG1-CG 4.33Å; V128-R132 VanDerWaalsContact O-CG 3.29Å; V128-R132 WeakPolarHBondContact O-CG 3.46Å; V128-R132 PolarHBondContact O-N 3.17Å
129	M	95.3	Very high	94.7	Very high	16 Å²	16	33.6 Å²	33.6	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-61.9	-40.5	176.3	-175.5	53.5	61.6	0	0	112.9	Q74 A125 H127 F131 R132 K133	Q74-M129 HydrophobicContact CB-CE 4.41Å; A125-M129 WeakPolarHBondContact O-CB 3.34Å; A125-M129 PolarHBondContact O-N 3.09Å; H127-M129 VanDerWaalsContact C-N 3.34Å; M129-F131 VanDerWaalsContact C-N 3.29Å; M129-F131 PolarHBondContact O-N 3.42Å; M129-R132 PolarHBondContact O-N 3.13Å; M129-K133 WeakPolarHBondContact O-CG 3.48Å; M129-K133 PolarHBondContact O-N 3.05Å
130	K	95.1	Very high	94.2	Very high	85 Å²	85	30.3 Å²	30.3	37%	0.37	15%	0.154	S	C	.	.	H	α-helix	trans	-61.3	-39.7	172.8	-72.7	163.8	-161	152.2	0	111.4	L108 D126 H127 V128 L134	L108-K130 HydrophobicContact CD2-CB 4.48Å; D126-K130 VanDerWaalsContact O-CG 3.26Å; D126-K130 WeakPolarHBondContact O-CG 3.1Å; D126-K130 PolarHBondContact O-N 3.32Å; D126-K130 IonicContact OD2-NZ 3.88Å; D126-K130 PolarHBondContact OD2-NZ 3.34Å; H127-K130 PolarHBondContact O-N 3.47Å; V128-K130 PolarHBondContact O-N 3.21Å; K130-L134 PolarHBondContact O-N 2.56Å; K130-L134 VanDerWaalsContact O-N 3.15Å
131	F	95.7	Very high	93.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-49.7	175	178.4	-115.5	0	0	0	111.5	M79 I105 L108 L109 I113 H127 V128 M129 K133 L134 L135 F155 L159	M79-F131 HydrophobicContact SD-CD1 3.88Å; M79-F131 HydrophobicContact SD-CE1 4.05Å; I105-F131 HydrophobicContact CG2-CD2 4.28Å; I105-F131 HydrophobicContact CG2-CE2 3.62Å; L108-F131 HydrophobicContact CD2-CB 4.34Å; L109-F131 HydrophobicContact CB-CD2 4.19Å; L109-F131 HydrophobicContact CB-CE2 3.79Å; L109-F131 HydrophobicContact CB-CZ 4.36Å; L109-F131 HydrophobicContact CD1-CE1 4.33Å; L109-F131 HydrophobicContact CD1-CE2 4.26Å; L109-F131 HydrophobicContact CD1-CZ 4.09Å; L109-F131 HydrophobicContact CD2-CE2 4.44Å; L109-F131 HydrophobicContact CD2-CZ 4.28Å; L109-F131 HydrophobicContact CG-CE2 4.38Å; L109-F131 HydrophobicContact CG-CZ 4.48Å; I113-F131 HydrophobicContact CD1-CB 3.79Å; I113-F131 HydrophobicContact CD1-CD1 4.06Å; I113-F131 HydrophobicContact CD1-CG 3.98Å; H127-F131 PolarHBondContact O-N 3.34Å; H127-F131 VanDerWaalsContact O-N 3.08Å; V128-F131 CarbonylContact O-C 3.56Å; V128-F131 WeakPolarHBondContact O-CA 3.47Å; V128-F131 WeakPolarHBondContact O-CB 3.27Å; V128-F131 PolarHBondContact O-N 2.99Å; V128-F131 VanDerWaalsContact O-N 3.09Å; M129-F131 VanDerWaalsContact C-N 3.29Å; M129-F131 PolarHBondContact O-N 3.42Å; F131-K133 VanDerWaalsContact C-N 3.31Å; F131-K133 PolarHBondContact O-N 3.36Å; F131-L134 PolarHBondContact O-N 2.85Å; F131-L135 HydrophobicContact CD1-CD1 4.03Å; F131-L135 HydrophobicContact CD1-CG 4.38Å; F131-L135 HydrophobicContact CD2-CG 4.47Å; F131-L135 HydrophobicContact CE1-CD1 3.64Å; F131-L135 HydrophobicContact CE1-CD2 4.31Å; F131-L135 HydrophobicContact CE1-CG 4.14Å; F131-L135 HydrophobicContact CE2-CD2 3.89Å; F131-L135 HydrophobicContact CE2-CG 4.21Å; F131-L135 HydrophobicContact CZ-CD1 3.95Å; F131-L135 HydrophobicContact CZ-CD2 3.75Å; F131-L135 HydrophobicContact CZ-CG 4.04Å; F131-L135 WeakPolarHBondContact O-CG 3.17Å; F131-L135 PolarHBondContact O-N 3.06Å; F131-F155 AromaticContact CE1-CE2 3.96Å; F131-F155 HydrophobicContact CE1-CE2 3.96Å; F131-F155 HydrophobicContact CE1-CZ 4.18Å; F131-F155 HydrophobicContact CZ-CE2 4.42Å; F131-L159 HydrophobicContact CZ-CD1 4.39Å
132	R	95	Very high	93.1	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-54.4	-42.5	176	-66.7	167.7	78.6	-179.2	7	112.8	S73 Q74 M79 V128 M129 L135 S136 F145 M146	S73-R132 PolarHBondContact O-NH1 2.94Å; Q74-R132 PolarHBondContact O-NH1 3.47Å; Q74-R132 PolarHBondContact O-NH2 2.9Å; M79-R132 HydrophobicContact CE-CG 3.91Å; M79-R132 HydrophobicContact SD-CG 3.69Å; V128-R132 HydrophobicContact CG1-CG 4.33Å; V128-R132 VanDerWaalsContact O-CG 3.29Å; V128-R132 WeakPolarHBondContact O-CG 3.46Å; V128-R132 PolarHBondContact O-N 3.17Å; M129-R132 PolarHBondContact O-N 3.13Å; R132-L135 PolarHBondContact O-N 2.93Å; R132-S136 PolarHBondContact O-N 2.79Å; R132-S136 VanDerWaalsContact O-N 3.11Å; R132-S136 PolarHBondContact O-OG 3.35Å; R132-F145 PolarHBondContact NE-O 3.22Å; R132-F145 PolarHBondContact NH2-O 2.88Å; R132-M146 HydrophobicContact CB-CG 4.45Å; R132-M146 VanDerWaalsContact CZ-C 3.5Å; R132-M146 PolarHBondContact NH1-O 2.89Å; R132-M146 PolarHBondContact NH2-O 2.94Å
133	K	93.6	Very high	92.5	Very high	108 Å²	108	37.4 Å²	37.4	47%	0.47	19%	0.192	S	C	.	.	H	α-helix	trans	-60.7	-48.2	174.6	-75.7	173	-179.6	-176.8	0	111.8	M129 F131 L135 S136 E137 M146	M129-K133 WeakPolarHBondContact O-CG 3.48Å; M129-K133 PolarHBondContact O-N 3.05Å; F131-K133 VanDerWaalsContact C-N 3.31Å; F131-K133 PolarHBondContact O-N 3.36Å; K133-L135 VanDerWaalsContact C-N 3.34Å; K133-L135 PolarHBondContact O-N 3.02Å; K133-S136 WeakPolarHBondContact O-CB 3.5Å; K133-S136 PolarHBondContact O-N 2.81Å; K133-S136 VanDerWaalsContact O-N 3.16Å; K133-E137 PolarHBondContact O-N 2.72Å; K133-M146 HydrophobicContact CG-CG 4.45Å; K133-M146 HydrophobicContact CG-SD 3.6Å
134	L	92.8	Very high	91.9	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-33.8	-179.3	-171.6	63.9	0	0	0	112.6	R104 I105 L108 K130 F131 S136 E137 F138	R104-L134 HydrophobicContact CG-CD2 4.04Å; I105-L134 HydrophobicContact CB-CD2 4.21Å; I105-L134 HydrophobicContact CD1-CG 4.5Å; I105-L134 HydrophobicContact CG1-CD2 3.56Å; I105-L134 HydrophobicContact CG1-CG 3.72Å; L108-L134 HydrophobicContact CB-CD2 4.23Å; L108-L134 HydrophobicContact CD2-CB 4.05Å; L108-L134 HydrophobicContact CD2-CD2 3.62Å; L108-L134 HydrophobicContact CD2-CG 4.5Å; K130-L134 PolarHBondContact O-N 2.56Å; K130-L134 VanDerWaalsContact O-N 3.15Å; F131-L134 PolarHBondContact O-N 2.85Å; L134-S136 VanDerWaalsContact C-N 3.33Å; L134-E137 WeakPolarHBondContact CD1-OE2 3.47Å; L134-E137 PolarHBondContact O-N 3.29Å; L134-F138 WeakPolarHBondContact O-CB 3.49Å; L134-F138 PolarHBondContact O-N 3.11Å
135	L	92.3	Very high	91.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-47.7	170.1	-67.3	-178.2	0	0	0	110.9	M79 I105 F131 R132 K133 E137 F138 V139 F155 L158 I163	M79-L135 HydrophobicContact CE-CD1 3.88Å; I105-L135 HydrophobicContact CG2-CD2 4.11Å; F131-L135 HydrophobicContact CD1-CD1 4.03Å; F131-L135 HydrophobicContact CD1-CG 4.38Å; F131-L135 HydrophobicContact CD2-CG 4.47Å; F131-L135 HydrophobicContact CE1-CD1 3.64Å; F131-L135 HydrophobicContact CE1-CD2 4.31Å; F131-L135 HydrophobicContact CE1-CG 4.14Å; F131-L135 HydrophobicContact CE2-CD2 3.89Å; F131-L135 HydrophobicContact CE2-CG 4.21Å; F131-L135 HydrophobicContact CZ-CD1 3.95Å; F131-L135 HydrophobicContact CZ-CD2 3.75Å; F131-L135 HydrophobicContact CZ-CG 4.04Å; F131-L135 WeakPolarHBondContact O-CG 3.17Å; F131-L135 PolarHBondContact O-N 3.06Å; R132-L135 PolarHBondContact O-N 2.93Å; K133-L135 VanDerWaalsContact C-N 3.34Å; K133-L135 PolarHBondContact O-N 3.02Å; L135-E137 VanDerWaalsContact C-N 3.32Å; L135-E137 PolarHBondContact O-N 2.75Å; L135-F138 PolarHBondContact O-N 2.6Å; L135-F138 VanDerWaalsContact O-N 3.15Å; L135-V139 PolarHBondContact O-N 3.49Å; L135-F155 HydrophobicContact CD1-CD2 4.43Å; L135-F155 HydrophobicContact CD1-CE2 4.14Å; L135-L158 HydrophobicContact CD2-CD2 3.8Å; L135-I163 HydrophobicContact CD2-CD1 3.18Å
136	S	90.5	Very high	90.6	Very high	28 Å²	28	39.6 Å²	39.6	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-33.7	179.7	-52.1	0	0	0	0	112.4	R132 K133 L134 P140	R132-S136 PolarHBondContact O-N 2.79Å; R132-S136 VanDerWaalsContact O-N 3.11Å; R132-S136 PolarHBondContact O-OG 3.35Å; K133-S136 WeakPolarHBondContact O-CB 3.5Å; K133-S136 PolarHBondContact O-N 2.81Å; K133-S136 VanDerWaalsContact O-N 3.16Å; L134-S136 VanDerWaalsContact C-N 3.33Å; S136-P140 WeakPolarHBondContact O-CA 3.41Å
137	E	90.9	Very high	90	Very high	116 Å²	116	44.9 Å²	44.9	54%	0.542	23%	0.233	S	C	.	.	H	α-helix	trans	-66.9	-37.6	172.5	-73.2	172.7	-151.8	0	0	112.3	R104 K133 L134 L135	R104-E137 IonicContact CZ-OE2 3.43Å; R104-E137 IonicContact NH1-OE2 3.24Å; R104-E137 PolarHBondContact NH1-OE2 3.14Å; R104-E137 IonicContact NH2-OE2 3.79Å; K133-E137 PolarHBondContact O-N 2.72Å; L134-E137 WeakPolarHBondContact CD1-OE2 3.47Å; L134-E137 PolarHBondContact O-N 3.29Å; L135-E137 VanDerWaalsContact C-N 3.32Å; L135-E137 PolarHBondContact O-N 2.75Å
138	F	88.3	Confident	89.5	Confident	25 Å²	25	49.7 Å²	49.7	11%	0.11	26%	0.255	C	S	.	.	H	α-helix	trans	-85.2	-32.9	-173.1	-175.3	-83.9	0	0	0	113.5	K101 R102 I105 L134 L135	K101-F138 HydrophobicContact CB-CE2 3.75Å; K101-F138 HydrophobicContact CD-CD2 3.73Å; K101-F138 HydrophobicContact CD-CE2 3.25Å; K101-F138 HydrophobicContact CD-CZ 3.86Å; K101-F138 VanDerWaalsContact CE-CD2 3.4Å; K101-F138 VanDerWaalsContact CE-CE2 3.49Å; K101-F138 HydrophobicContact CG-CD2 3.76Å; K101-F138 HydrophobicContact CG-CE2 3.31Å; K101-F138 HydrophobicContact CG-CZ 4.3Å; K101-F138 PolarHBondContact NZ-O 2.87Å; R102-F138 HydrophobicContact CG-CE1 4.46Å; R102-F138 HydrophobicContact CG-CE2 3.89Å; R102-F138 HydrophobicContact CG-CZ 3.5Å; I105-F138 HydrophobicContact CD1-CB 3.38Å; I105-F138 HydrophobicContact CD1-CD1 3.89Å; I105-F138 HydrophobicContact CD1-CD2 3.3Å; I105-F138 HydrophobicContact CD1-CE2 3.96Å; I105-F138 HydrophobicContact CD1-CG 3.26Å; I105-F138 HydrophobicContact CG1-CD2 4.42Å; L134-F138 WeakPolarHBondContact O-CB 3.49Å; L134-F138 PolarHBondContact O-N 3.11Å; L135-F138 PolarHBondContact O-N 2.6Å; L135-F138 VanDerWaalsContact O-N 3.15Å
139	V	88.3	Confident	88.9	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.042	27%	0.274	C	S	.	.			trans	-123.2	74	175.5	-165.8	0	0	0	0	109	L135 E141 A142 L158 R162	L135-V139 PolarHBondContact O-N 3.49Å; V139-E141 HydrophobicContact CG1-CG 3.73Å; V139-E141 WeakPolarHBondContact CG1-OE1 3.46Å; V139-E141 PolarHBondContact O-N 3.11Å; V139-E141 VanDerWaalsContact O-N 3.14Å; V139-A142 HydrophobicContact CB-CB 4.15Å; V139-A142 HydrophobicContact CG1-CB 3.7Å; V139-A142 PolarHBondContact O-N 2.98Å; V139-L158 HydrophobicContact CB-CD1 3.98Å; V139-L158 HydrophobicContact CG1-CD1 4.13Å; V139-L158 HydrophobicContact CG2-CD1 3.92Å; V139-L158 HydrophobicContact CG2-CD2 4.27Å; V139-L158 HydrophobicContact CG2-CG 4.04Å; V139-R162 HydrophobicContact CG2-CB 4.46Å
140	P	86.1	Confident	88.6	Confident	89 Å²	89	54.1 Å²	54.1	58%	0.578	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.8	-177	-23.3	34.9	0	0	0	113.9	S136 A142	S136-P140 WeakPolarHBondContact O-CA 3.41Å; P140-A142 PolarHBondContact O-N 3.16Å
141	E	87.9	Confident	88.3	Confident	121 Å²	121	54 Å²	54	57%	0.565	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.8	174.7	65	-90.1	-152.5	0	0	113.5	V139 T143 R162	V139-E141 HydrophobicContact CG1-CG 3.73Å; V139-E141 WeakPolarHBondContact CG1-OE1 3.46Å; V139-E141 PolarHBondContact O-N 3.11Å; V139-E141 VanDerWaalsContact O-N 3.14Å; E141-T143 PolarHBondContact O-N 2.79Å; E141-R162 IonicContact OE1-CZ 3.39Å; E141-R162 IonicContact OE1-NH2 3.87Å; E141-R162 PolarHBondContact OE1-NH2 3.37Å
142	A	83.7	Confident	88.2	Confident	15 Å²	15	54 Å²	54	12%	0.124	28%	0.279	C	S	.	.	S	Bend	trans	-94.9	89.6	179.7	0	0	0	0	0	109.8	V139 P140 F145 L158	V139-A142 HydrophobicContact CB-CB 4.15Å; V139-A142 HydrophobicContact CG1-CB 3.7Å; V139-A142 PolarHBondContact O-N 2.98Å; P140-A142 PolarHBondContact O-N 3.16Å; A142-F145 HydrophobicContact CB-CD2 4.04Å; A142-F145 HydrophobicContact CB-CE2 3.63Å; A142-F145 WeakPolarHBondContact O-CD2 3.49Å; A142-L158 HydrophobicContact CB-CD1 3.7Å
143	T	85.2	Confident	88	Confident	94 Å²	94	55.8 Å²	55.8	58%	0.577	29%	0.287	S	S	*	.			trans	-84.6	164.5	-175.7	60	0	0	0	0	112.2	E141 F145 K150	E141-T143 PolarHBondContact O-N 2.79Å; T143-F145 VanDerWaalsContact C-N 3.27Å; T143-F145 PolarHBondContact O-N 2.96Å; T143-K150 WeakPolarHBondContact O-CE 3.38Å; T143-K150 PolarHBondContact O-NZ 3.08Å
144	G	85.6	Confident	87.8	Confident	17 Å²	17	54 Å²	54	18%	0.175	28%	0.28	C	S	.	.			trans	85.1	-12.8	170.9	0	0	0	0	0	115	M146 E147 E148	G144-M146 PolarHBondContact O-N 3.17Å; G144-E147 PolarHBondContact O-N 3.31Å; G144-E147 VanDerWaalsContact O-N 3.13Å; G144-E148 WeakPolarHBondContact CA-OE2 3.32Å; G144-E148 WeakPolarHBondContact O-CB 3.47Å; G144-E148 PolarHBondContact O-N 3.04Å
145	F	84.7	Confident	87.8	Confident	1 Å²	1	53.5 Å²	53.5	0%	0.004	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-24.3	-177.6	-89.6	-70	0	0	0	114.8	Y78 M79 R132 A142 T143 F155 L158	Y78-F145 HydrophobicContact CE2-CD1 4.44Å; Y78-F145 HydrophobicContact CE2-CE1 4.23Å; Y78-F145 VanDerWaalsContact OH-CD1 3.29Å; Y78-F145 WeakPolarHBondContact OH-CD1 3.33Å; Y78-F145 PolarHBondContact OH-O 3.32Å; M79-F145 HydrophobicContact CE-CD1 3.78Å; M79-F145 HydrophobicContact CE-CE1 4.15Å; R132-F145 PolarHBondContact NE-O 3.22Å; R132-F145 PolarHBondContact NH2-O 2.88Å; A142-F145 HydrophobicContact CB-CD2 4.04Å; A142-F145 HydrophobicContact CB-CE2 3.63Å; A142-F145 WeakPolarHBondContact O-CD2 3.49Å; T143-F145 VanDerWaalsContact C-N 3.27Å; T143-F145 PolarHBondContact O-N 2.96Å; F145-F155 HydrophobicContact CE1-CB 4.09Å; F145-F155 HydrophobicContact CE1-CD2 4.2Å; F145-L158 HydrophobicContact CD2-CD1 4.36Å; F145-L158 HydrophobicContact CE2-CD1 3.5Å; F145-L158 VanDerWaalsContact CE2-CD1 3.5Å; F145-L158 HydrophobicContact CZ-CD1 3.87Å
146	M	82.8	Confident	87.8	Confident	71 Å²	71	53.5 Å²	53.5	35%	0.35	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-27.1	-178.3	-64.4	-172.7	-65	0	0	115	R132 K133 G144	R132-M146 HydrophobicContact CB-CG 4.45Å; R132-M146 VanDerWaalsContact CZ-C 3.5Å; R132-M146 PolarHBondContact NH1-O 2.89Å; R132-M146 PolarHBondContact NH2-O 2.94Å; K133-M146 HydrophobicContact CG-CG 4.45Å; K133-M146 HydrophobicContact CG-SD 3.6Å; G144-M146 PolarHBondContact O-N 3.17Å
147	E	81.5	Confident	87.8	Confident	129 Å²	129	55.8 Å²	55.8	60%	0.603	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.4	-21.7	-169.1	-57.7	-156.9	-153.9	0	0	114	N75 G144	N75-E147 PolarHBondContact ND2-O 3.4Å; G144-E147 PolarHBondContact O-N 3.31Å; G144-E147 VanDerWaalsContact O-N 3.13Å
148	E	87.4	Confident	87.8	Confident	106 Å²	106	50.8 Å²	50.8	50%	0.495	27%	0.265	S	S	.	.	S	Bend	trans	-89.1	145.7	-180	-60.1	176.8	-177.6	0	0	110.5	G144	G144-E148 WeakPolarHBondContact CA-OE2 3.32Å; G144-E148 WeakPolarHBondContact O-CB 3.47Å; G144-E148 PolarHBondContact O-N 3.04Å
149	E	83.9	Confident	87.9	Confident	88 Å²	88	49.6 Å²	49.6	41%	0.411	26%	0.26	S	S	.	.			trans	-67.2	133.2	163.8	-168.8	-177.1	164.9	0	0	108.7	N75 S313	N75-E149 HydrophobicContact CB-CB 4.15Å; E149-S313 VanDerWaalsContact OE1-CA 3.29Å; E149-S313 WeakPolarHBondContact OE1-CA 3.28Å; E149-S313 WeakPolarHBondContact OE1-CB 3.3Å; E149-S313 WeakPolarHBondContact OE2-CB 3.42Å
150	K	89.9	Confident	87.9	Confident	24 Å²	24	49.3 Å²	49.3	10%	0.104	26%	0.258	C	S	.	.			trans	-128.3	161.6	-179.7	-65.3	-61.7	-158.2	140.8	0	110.4	Y78 T143 E154	Y78-K150 WeakPolarHBondContact CB-O 3.36Å; Y78-K150 HydrophobicContact CD1-CB 4.24Å; Y78-K150 HydrophobicContact CD2-CB 4.18Å; Y78-K150 HydrophobicContact CE1-CB 3.82Å; Y78-K150 HydrophobicContact CE1-CG 4.3Å; Y78-K150 HydrophobicContact CE2-CB 3.8Å; Y78-K150 HydrophobicContact CG-CB 4.41Å; Y78-K150 VanDerWaalsContact CG-O 3.27Å; T143-K150 WeakPolarHBondContact O-CE 3.38Å; T143-K150 PolarHBondContact O-NZ 3.08Å; K150-E154 WeakPolarHBondContact CD-OE2 3.38Å; K150-E154 IonicContact NZ-OE1 3.62Å; K150-E154 PolarHBondContact NZ-OE1 2.81Å; K150-E154 IonicContact NZ-OE2 3.4Å; K150-E154 PolarHBondContact NZ-OE2 2.85Å; K150-E154 VanDerWaalsContact NZ-OE2 3.11Å
151	D	89.3	Confident	87.9	Confident	82 Å²	82	47.1 Å²	47.1	44%	0.439	25%	0.251	S	S	.	.			trans	-80.9	137.5	172.5	-61.3	-44.6	0	0	0	110.2	E153 E154 F155	D151-E153 VanDerWaalsContact CB-CD 3.48Å; D151-E153 HydrophobicContact CB-CG 4.05Å; D151-E153 PolarHBondContact O-N 2.9Å; D151-E154 PolarHBondContact O-N 2.87Å; D151-E154 VanDerWaalsContact O-N 3.13Å; D151-F155 PolarHBondContact O-N 2.84Å
152	P	92.5	Very high	87.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-53.2	-35	177	-28.5	32.5	0	0	0	113.7	E154 F155 L156 M308 Y315 Y391 L392	P152-E154 PolarHBondContact O-N 2.96Å; P152-F155 WeakPolarHBondContact O-CB 3.45Å; P152-F155 PolarHBondContact O-N 2.96Å; P152-L156 WeakPolarHBondContact O-CB 3.5Å; P152-L156 WeakPolarHBondContact O-CG 3.03Å; P152-L156 PolarHBondContact O-N 3.33Å; P152-M308 HydrophobicContact CB-CE 3.85Å; P152-M308 HydrophobicContact CG-CE 3.69Å; P152-Y315 WeakPolarHBondContact CD-OH 3.43Å; P152-Y315 HydrophobicContact CG-CD1 3.81Å; P152-Y315 HydrophobicContact CG-CE1 3.32Å; P152-Y315 HydrophobicContact CG-CE2 4.24Å; P152-Y315 HydrophobicContact CG-CG 4.43Å; P152-Y391 HydrophobicContact CB-CE1 4.37Å; P152-Y391 HydrophobicContact CG-CD1 4.3Å; P152-Y391 HydrophobicContact CG-CE1 3.89Å; P152-L392 HydrophobicContact CB-CD1 3.75Å
153	E	90.6	Very high	88	Confident	39 Å²	39	46.9 Å²	46.9	18%	0.182	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-39.4	177.6	56.6	-95.6	-138.6	0	0	113.2	D151 F155 L156 D157 F170 Q214 Y391	D151-E153 VanDerWaalsContact CB-CD 3.48Å; D151-E153 HydrophobicContact CB-CG 4.05Å; D151-E153 PolarHBondContact O-N 2.9Å; E153-F155 VanDerWaalsContact C-N 3.27Å; E153-F155 PolarHBondContact O-N 2.88Å; E153-L156 PolarHBondContact O-N 3.48Å; E153-D157 VanDerWaalsContact O-CB 3.3Å; E153-D157 WeakPolarHBondContact O-CB 3.28Å; E153-D157 PolarHBondContact O-N 2.91Å; E153-F170 HydrophobicContact CB-CE1 4.32Å; E153-F170 HydrophobicContact CB-CE2 4.24Å; E153-F170 HydrophobicContact CB-CZ 3.69Å; E153-Q214 PolarHBondContact OE1-NE2 2.91Å; E153-Y391 PolarHBondContact OE1-OH 3.45Å; E153-Y391 PolarHBondContact OE2-OH 2.71Å
154	E	89.9	Confident	88	Confident	71 Å²	71	43.4 Å²	43.4	33%	0.332	22%	0.219	S	C	.	.	H	α-helix	trans	-63.3	-39.7	176.8	-172.4	-175.4	164.1	0	0	110.1	K150 D151 P152 L158	K150-E154 WeakPolarHBondContact CD-OE2 3.38Å; K150-E154 IonicContact NZ-OE1 3.62Å; K150-E154 PolarHBondContact NZ-OE1 2.81Å; K150-E154 IonicContact NZ-OE2 3.4Å; K150-E154 PolarHBondContact NZ-OE2 2.85Å; K150-E154 VanDerWaalsContact NZ-OE2 3.11Å; D151-E154 PolarHBondContact O-N 2.87Å; D151-E154 VanDerWaalsContact O-N 3.13Å; P152-E154 PolarHBondContact O-N 2.96Å; E154-L158 WeakPolarHBondContact O-CB 3.13Å; E154-L158 PolarHBondContact O-N 2.84Å; E154-L158 VanDerWaalsContact O-N 3.16Å
155	F	93	Very high	87.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-46.8	174.1	170	-122.3	0	0	0	112.5	Y78 M79 A82 L83 M86 F131 L135 F145 D151 P152 E153 L158 L159	Y78-F155 HydrophobicContact CD2-CB 4.22Å; Y78-F155 HydrophobicContact CE2-CB 4.03Å; Y78-F155 HydrophobicContact CE2-CG 4.47Å; M79-F155 HydrophobicContact CE-CD2 3.76Å; M79-F155 HydrophobicContact CE-CE2 3.88Å; M79-F155 HydrophobicContact CE-CG 4.36Å; M79-F155 HydrophobicContact CG-CD1 4.35Å; M79-F155 HydrophobicContact CG-CD2 4.49Å; M79-F155 HydrophobicContact CG-CE1 3.97Å; M79-F155 HydrophobicContact CG-CE2 4.14Å; M79-F155 HydrophobicContact CG-CZ 3.87Å; M79-F155 HydrophobicContact SD-CE2 4.3Å; A82-F155 HydrophobicContact CB-CD1 3.94Å; A82-F155 HydrophobicContact CB-CE1 3.88Å; L83-F155 HydrophobicContact CD2-CE1 4.28Å; L83-F155 HydrophobicContact CD2-CZ 3.91Å; L83-F155 HydrophobicContact CG-CE1 4.29Å; L83-F155 HydrophobicContact CG-CZ 4.2Å; M86-F155 HydrophobicContact CE-CE1 4.06Å; F131-F155 AromaticContact CE1-CE2 3.96Å; F131-F155 HydrophobicContact CE1-CE2 3.96Å; F131-F155 HydrophobicContact CE1-CZ 4.18Å; F131-F155 HydrophobicContact CZ-CE2 4.42Å; L135-F155 HydrophobicContact CD1-CD2 4.43Å; L135-F155 HydrophobicContact CD1-CE2 4.14Å; F145-F155 HydrophobicContact CE1-CB 4.09Å; F145-F155 HydrophobicContact CE1-CD2 4.2Å; D151-F155 PolarHBondContact O-N 2.84Å; P152-F155 WeakPolarHBondContact O-CB 3.45Å; P152-F155 PolarHBondContact O-N 2.96Å; E153-F155 VanDerWaalsContact C-N 3.27Å; E153-F155 PolarHBondContact O-N 2.88Å; F155-L158 PolarHBondContact O-N 3.34Å; F155-L159 HydrophobicContact CE1-CD2 4.4Å; F155-L159 HydrophobicContact CE2-CB 4.32Å; F155-L159 HydrophobicContact CZ-CB 4.5Å; F155-L159 HydrophobicContact CZ-CD2 3.99Å; F155-L159 WeakPolarHBondContact O-CB 3.36Å; F155-L159 PolarHBondContact O-N 3.21Å
156	L	92.8	Very high	87.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-38.5	-178	-66.7	170.3	0	0	0	111.3	A82 M86 P152 E153 L159 F160 F170 I212 L392 F394	A82-L156 HydrophobicContact CB-CD2 4.46Å; M86-L156 HydrophobicContact CE-CD2 3.69Å; M86-L156 HydrophobicContact SD-CD2 3.62Å; P152-L156 WeakPolarHBondContact O-CB 3.5Å; P152-L156 WeakPolarHBondContact O-CG 3.03Å; P152-L156 PolarHBondContact O-N 3.33Å; E153-L156 PolarHBondContact O-N 3.48Å; L156-L159 PolarHBondContact O-N 2.69Å; L156-F160 HydrophobicContact CB-CD2 4.3Å; L156-F160 HydrophobicContact CB-CE2 4.48Å; L156-F160 HydrophobicContact CD2-CD2 4.46Å; L156-F160 HydrophobicContact CD2-CE2 3.87Å; L156-F160 VanDerWaalsContact O-CD2 3.31Å; L156-F160 WeakPolarHBondContact O-CD2 3.39Å; L156-F160 PolarHBondContact O-N 3.34Å; L156-F170 HydrophobicContact CD1-CE2 4.21Å; L156-I212 HydrophobicContact CD1-CD1 4.25Å; L156-I212 HydrophobicContact CD1-CG2 4.38Å; L156-L392 HydrophobicContact CD1-CD1 3.48Å; L156-L392 VanDerWaalsContact CD1-CD1 3.48Å; L156-F394 HydrophobicContact CD1-CE1 4.43Å; L156-F394 HydrophobicContact CD1-CZ 4.28Å; L156-F394 HydrophobicContact CD2-CE1 4.45Å
157	D	89.3	Confident	86.4	Confident	77 Å²	77	52.4 Å²	52.4	41%	0.412	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-40.6	175.1	-77.4	-11.1	0	0	0	112.2	E153 G161 Y168	E153-D157 VanDerWaalsContact O-CB 3.3Å; E153-D157 WeakPolarHBondContact O-CB 3.28Å; E153-D157 PolarHBondContact O-N 2.91Å; D157-G161 VanDerWaalsContact O-CA 3.24Å; D157-G161 WeakPolarHBondContact O-CA 3.18Å; D157-G161 PolarHBondContact O-N 3.41Å; D157-Y168 WeakPolarHBondContact CA-OH 3.47Å; D157-Y168 PolarHBondContact OD1-OH 3.19Å
158	L	90.2	Very high	86.1	Confident	11 Å²	11	48.3 Å²	48.3	6%	0.058	24%	0.242	C	C	.	.	I	π-helix	trans	-64.4	-49.6	171.9	-171.7	155.5	0	0	0	110.9	L135 V139 A142 F145 E154 F155 R162 I163	L135-L158 HydrophobicContact CD2-CD2 3.8Å; V139-L158 HydrophobicContact CB-CD1 3.98Å; V139-L158 HydrophobicContact CG1-CD1 4.13Å; V139-L158 HydrophobicContact CG2-CD1 3.92Å; V139-L158 HydrophobicContact CG2-CD2 4.27Å; V139-L158 HydrophobicContact CG2-CG 4.04Å; A142-L158 HydrophobicContact CB-CD1 3.7Å; F145-L158 HydrophobicContact CD2-CD1 4.36Å; F145-L158 HydrophobicContact CE2-CD1 3.5Å; F145-L158 VanDerWaalsContact CE2-CD1 3.5Å; F145-L158 HydrophobicContact CZ-CD1 3.87Å; E154-L158 WeakPolarHBondContact O-CB 3.13Å; E154-L158 PolarHBondContact O-N 2.84Å; E154-L158 VanDerWaalsContact O-N 3.16Å; F155-L158 PolarHBondContact O-N 3.34Å; L158-R162 WeakPolarHBondContact O-CA 3.46Å; L158-R162 VanDerWaalsContact O-CB 3.27Å; L158-R162 WeakPolarHBondContact O-CB 3.36Å; L158-R162 PolarHBondContact O-N 3.43Å; L158-I163 HydrophobicContact CD2-CD1 3.43Å; L158-I163 VanDerWaalsContact CD2-CD1 3.43Å; L158-I163 HydrophobicContact CD2-CG1 4.05Å; L158-I163 PolarHBondContact O-N 2.86Å
159	L	91.6	Very high	85.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-60.8	-54.4	-176.1	-177.2	64.6	0	0	0	111.3	M86 L109 F131 F155 L156 I163 F164	M86-L159 HydrophobicContact CE-CD2 3.74Å; M86-L159 HydrophobicContact SD-CD2 4.19Å; L109-L159 HydrophobicContact CD2-CD1 4.06Å; F131-L159 HydrophobicContact CZ-CD1 4.39Å; F155-L159 HydrophobicContact CE1-CD2 4.4Å; F155-L159 HydrophobicContact CE2-CB 4.32Å; F155-L159 HydrophobicContact CZ-CB 4.5Å; F155-L159 HydrophobicContact CZ-CD2 3.99Å; F155-L159 WeakPolarHBondContact O-CB 3.36Å; F155-L159 PolarHBondContact O-N 3.21Å; L156-L159 PolarHBondContact O-N 2.69Å; L159-I163 HydrophobicContact CD1-CB 4.45Å; L159-I163 HydrophobicContact CD1-CD1 4.13Å; L159-I163 CarbonylContact O-C 3.37Å; L159-I163 WeakPolarHBondContact O-CA 3.25Å; L159-I163 VanDerWaalsContact O-CB 3.25Å; L159-I163 WeakPolarHBondContact O-CB 3.3Å; L159-I163 PolarHBondContact O-N 2.67Å; L159-F164 HydrophobicContact CD1-CD1 4.29Å; L159-F164 HydrophobicContact CD1-CE1 3.84Å; L159-F164 HydrophobicContact CD1-CE2 4.2Å; L159-F164 HydrophobicContact CD1-CZ 3.8Å; L159-F164 HydrophobicContact CD2-CE2 4.12Å; L159-F164 HydrophobicContact CD2-CZ 4.33Å; L159-F164 HydrophobicContact CG-CD2 4.24Å; L159-F164 HydrophobicContact CG-CE1 4.46Å; L159-F164 HydrophobicContact CG-CE2 3.99Å; L159-F164 HydrophobicContact CG-CZ 4.12Å; L159-F164 PolarHBondContact O-N 3Å
160	F	88.9	Confident	85.6	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	22%	0.22	C	C	.	.	I	π-helix	trans	-82.7	-39.5	-174.9	-68.3	-67.4	0	0	0	113.1	M86 F93 L156 F164 Q165 A166 Y168 I212	M86-F160 HydrophobicContact SD-CE2 3.84Å; M86-F160 HydrophobicContact SD-CZ 3.59Å; M86-F160 VanDerWaalsContact SD-CZ 3.59Å; F93-F160 AromaticContact CD1-CE1 3.78Å; F93-F160 HydrophobicContact CD1-CE1 3.78Å; F93-F160 AromaticContact CD1-CZ 3.5Å; F93-F160 HydrophobicContact CD1-CZ 3.5Å; F93-F160 VanDerWaalsContact CD1-CZ 3.5Å; F93-F160 HydrophobicContact CE1-CE1 4.47Å; F93-F160 AromaticContact CE1-CZ 3.93Å; F93-F160 HydrophobicContact CE1-CZ 3.93Å; F93-F160 HydrophobicContact CG-CZ 4.3Å; L156-F160 HydrophobicContact CB-CD2 4.3Å; L156-F160 HydrophobicContact CB-CE2 4.48Å; L156-F160 HydrophobicContact CD2-CD2 4.46Å; L156-F160 HydrophobicContact CD2-CE2 3.87Å; L156-F160 VanDerWaalsContact O-CD2 3.31Å; L156-F160 WeakPolarHBondContact O-CD2 3.39Å; L156-F160 PolarHBondContact O-N 3.34Å; F160-F164 HydrophobicContact CD1-CB 4.44Å; F160-F164 AromaticContact CD1-CD2 3.57Å; F160-F164 HydrophobicContact CD1-CD2 3.57Å; F160-F164 HydrophobicContact CD1-CE2 4.33Å; F160-F164 HydrophobicContact CD1-CG 4.43Å; F160-F164 AromaticContact CE1-CD2 3.68Å; F160-F164 HydrophobicContact CE1-CD2 3.68Å; F160-F164 HydrophobicContact CE1-CE2 4.03Å; F160-Q165 WeakPolarHBondContact O-CA 3.48Å; F160-Q165 PolarHBondContact O-N 2.99Å; F160-A166 HydrophobicContact CD1-CB 4.25Å; F160-A166 PolarHBondContact O-N 3.26Å; F160-Y168 HydrophobicContact CB-CD1 3.16Å; F160-Y168 HydrophobicContact CB-CD2 4.09Å; F160-Y168 HydrophobicContact CB-CE1 3.01Å; F160-Y168 HydrophobicContact CB-CE2 3.93Å; F160-Y168 HydrophobicContact CB-CG 3.74Å; F160-Y168 VanDerWaalsContact CB-CZ 3.43Å; F160-Y168 HydrophobicContact CD1-CD1 4.28Å; F160-Y168 HydrophobicContact CD1-CG 4.22Å; F160-Y168 HydrophobicContact CD2-CD1 4.18Å; F160-Y168 AromaticContact CD2-CD2 3.56Å; F160-Y168 HydrophobicContact CD2-CD2 3.56Å; F160-Y168 HydrophobicContact CD2-CE1 4.28Å; F160-Y168 AromaticContact CD2-CE2 3.6Å; F160-Y168 HydrophobicContact CD2-CE2 3.6Å; F160-Y168 AromaticContact CD2-CG 3.85Å; F160-Y168 HydrophobicContact CD2-CG 3.85Å; F160-Y168 AromaticContact CD2-CZ 4Å; F160-Y168 HydrophobicContact CE2-CD2 4.15Å; F160-Y168 HydrophobicContact CE2-CE2 4.47Å; F160-Y168 AromaticContact CG-CD1 3.67Å; F160-Y168 HydrophobicContact CG-CD1 3.67Å; F160-Y168 AromaticContact CG-CD2 3.9Å; F160-Y168 HydrophobicContact CG-CD2 3.9Å; F160-Y168 AromaticContact CG-CE1 3.9Å; F160-Y168 HydrophobicContact CG-CE1 3.9Å; F160-Y168 HydrophobicContact CG-CE2 4.06Å; F160-Y168 AromaticContact CG-CG 3.69Å; F160-Y168 HydrophobicContact CG-CG 3.69Å; F160-I212 HydrophobicContact CD2-CD1 4.4Å; F160-I212 HydrophobicContact CE2-CD1 3.67Å; F160-I212 HydrophobicContact CZ-CD1 4.35Å
161	G	85	Confident	85.1	Confident	43 Å²	43	44.3 Å²	44.3	44%	0.443	22%	0.224	S	C	.	.	I	π-helix	trans	-74.7	-40.2	-178	0	0	0	0	0	113.4	D157	D157-G161 VanDerWaalsContact O-CA 3.24Å; D157-G161 WeakPolarHBondContact O-CA 3.18Å; D157-G161 PolarHBondContact O-N 3.41Å
162	R	86.6	Confident	84.7	Confident	128 Å²	128	44.5 Å²	44.5	48%	0.483	23%	0.225	S	C	.	.	I	π-helix	trans	-103.5	-32.4	-174.5	-54.8	-68.7	-111.3	-143.9	-3.7	113.8	R102 V139 E141 L158	R102-R162 PolarHBondContact NE-O 2.91Å; R102-R162 PolarHBondContact NH2-O 3.1Å; V139-R162 HydrophobicContact CG2-CB 4.46Å; E141-R162 IonicContact OE1-CZ 3.39Å; E141-R162 IonicContact OE1-NH2 3.87Å; E141-R162 PolarHBondContact OE1-NH2 3.37Å; L158-R162 WeakPolarHBondContact O-CA 3.46Å; L158-R162 VanDerWaalsContact O-CB 3.27Å; L158-R162 WeakPolarHBondContact O-CB 3.36Å; L158-R162 PolarHBondContact O-N 3.43Å
163	I	86.4	Confident	84.1	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	23%	0.225	C	C	.	.	I	π-helix	trans	-99.7	-55	-173.8	-56.6	169.7	0	0	0	111.6	R102 I105 I106 L135 L158 L159	R102-I163 VanDerWaalsContact CD-O 3.27Å; R102-I163 WeakPolarHBondContact CD-O 3.46Å; I105-I163 HydrophobicContact CB-CG2 4.17Å; I105-I163 HydrophobicContact CG2-CD1 3.86Å; I105-I163 HydrophobicContact CG2-CG1 4.48Å; I105-I163 HydrophobicContact CG2-CG2 3.87Å; I106-I163 HydrophobicContact CD1-CG2 4.43Å; I106-I163 HydrophobicContact CG1-CG2 3.81Å; L135-I163 HydrophobicContact CD2-CD1 3.18Å; L158-I163 HydrophobicContact CD2-CD1 3.43Å; L158-I163 VanDerWaalsContact CD2-CD1 3.43Å; L158-I163 HydrophobicContact CD2-CG1 4.05Å; L158-I163 PolarHBondContact O-N 2.86Å; L159-I163 HydrophobicContact CD1-CB 4.45Å; L159-I163 HydrophobicContact CD1-CD1 4.13Å; L159-I163 CarbonylContact O-C 3.37Å; L159-I163 WeakPolarHBondContact O-CA 3.25Å; L159-I163 VanDerWaalsContact O-CB 3.25Å; L159-I163 WeakPolarHBondContact O-CB 3.3Å; L159-I163 PolarHBondContact O-N 2.67Å
164	F	87.1	Confident	83.4	Confident	21 Å²	21	46.5 Å²	46.5	9%	0.092	24%	0.237	C	C	.	.	I	π-helix	trans	-81.7	-26.1	-177.2	-65.7	-10.1	0	0	0	113	F87 R95 I106 L109 L159 F160 A166	F87-F164 HydrophobicContact CZ-CE2 4.09Å; F87-F164 HydrophobicContact CZ-CZ 4.05Å; R95-F164 HydrophobicContact CB-CD1 4.06Å; R95-F164 HydrophobicContact CB-CE1 3.97Å; R95-F164 HydrophobicContact CB-CG 4.4Å; R95-F164 HydrophobicContact CB-CZ 4.2Å; R95-F164 HydrophobicContact CG-CB 4.07Å; R95-F164 HydrophobicContact CG-CD1 3.72Å; R95-F164 HydrophobicContact CG-CD2 3.57Å; R95-F164 HydrophobicContact CG-CE1 3.91Å; R95-F164 HydrophobicContact CG-CE2 3.77Å; R95-F164 HydrophobicContact CG-CG 3.55Å; R95-F164 HydrophobicContact CG-CZ 3.93Å; I106-F164 HydrophobicContact CD1-CD1 4.33Å; I106-F164 HydrophobicContact CG1-CD1 4.06Å; I106-F164 HydrophobicContact CG1-CE1 4.05Å; L109-F164 HydrophobicContact CD2-CE1 3.94Å; L109-F164 HydrophobicContact CD2-CZ 3.63Å; L159-F164 HydrophobicContact CD1-CD1 4.29Å; L159-F164 HydrophobicContact CD1-CE1 3.84Å; L159-F164 HydrophobicContact CD1-CE2 4.2Å; L159-F164 HydrophobicContact CD1-CZ 3.8Å; L159-F164 HydrophobicContact CD2-CE2 4.12Å; L159-F164 HydrophobicContact CD2-CZ 4.33Å; L159-F164 HydrophobicContact CG-CD2 4.24Å; L159-F164 HydrophobicContact CG-CE1 4.46Å; L159-F164 HydrophobicContact CG-CE2 3.99Å; L159-F164 HydrophobicContact CG-CZ 4.12Å; L159-F164 PolarHBondContact O-N 3Å; F160-F164 HydrophobicContact CD1-CB 4.44Å; F160-F164 AromaticContact CD1-CD2 3.57Å; F160-F164 HydrophobicContact CD1-CD2 3.57Å; F160-F164 HydrophobicContact CD1-CE2 4.33Å; F160-F164 HydrophobicContact CD1-CG 4.43Å; F160-F164 AromaticContact CE1-CD2 3.68Å; F160-F164 HydrophobicContact CE1-CD2 3.68Å; F160-F164 HydrophobicContact CE1-CE2 4.03Å; F164-A166 HydrophobicContact CB-CB 3.88Å; F164-A166 PolarHBondContact O-N 3.47Å
165	Q	78.9	Confident	82.4	Confident	120 Å²	120	43.1 Å²	43.1	56%	0.561	22%	0.221	S	C	*	.			trans	48.3	41.5	-171.5	-58	-174.4	-74.7	0	0	111.5	R102 F160	R102-Q165 VanDerWaalsContact CZ-OE1 3.24Å; F160-Q165 WeakPolarHBondContact O-CA 3.48Å; F160-Q165 PolarHBondContact O-N 2.99Å
166	A	71.5	Confident	81.2	Confident	13 Å²	13	48.9 Å²	48.9	11%	0.107	25%	0.248	C	C	.	.			trans	-94.9	145.9	-172.7	0	0	0	0	0	110.6	F160 F164 Y168	F160-A166 HydrophobicContact CD1-CB 4.25Å; F160-A166 PolarHBondContact O-N 3.26Å; F164-A166 HydrophobicContact CB-CB 3.88Å; F164-A166 PolarHBondContact O-N 3.47Å; A166-Y168 WeakPolarHBondContact O-CD1 3.41Å; A166-Y168 PolarHBondContact O-N 3.27Å
167	N	68.2	Low	79.7	Confident	146 Å²	146	54.3 Å²	54.3	78%	0.781	28%	0.277	S	S	*	.			trans	-71.9	100.1	162	-65.9	-24.2	0	0	0	108.2
168	Y	75.5	Confident	78	Confident	43 Å²	43	55.7 Å²	55.7	17%	0.169	29%	0.293	C	S	.	.			trans	-120.3	143.4	161.3	75.3	-60.1	0	0	0	106.3	D157 F160 A166 F170 I212	D157-Y168 WeakPolarHBondContact CA-OH 3.47Å; D157-Y168 PolarHBondContact OD1-OH 3.19Å; F160-Y168 HydrophobicContact CB-CD1 3.16Å; F160-Y168 HydrophobicContact CB-CD2 4.09Å; F160-Y168 HydrophobicContact CB-CE1 3.01Å; F160-Y168 HydrophobicContact CB-CE2 3.93Å; F160-Y168 HydrophobicContact CB-CG 3.74Å; F160-Y168 VanDerWaalsContact CB-CZ 3.43Å; F160-Y168 HydrophobicContact CD1-CD1 4.28Å; F160-Y168 HydrophobicContact CD1-CG 4.22Å; F160-Y168 HydrophobicContact CD2-CD1 4.18Å; F160-Y168 AromaticContact CD2-CD2 3.56Å; F160-Y168 HydrophobicContact CD2-CD2 3.56Å; F160-Y168 HydrophobicContact CD2-CE1 4.28Å; F160-Y168 AromaticContact CD2-CE2 3.6Å; F160-Y168 HydrophobicContact CD2-CE2 3.6Å; F160-Y168 AromaticContact CD2-CG 3.85Å; F160-Y168 HydrophobicContact CD2-CG 3.85Å; F160-Y168 AromaticContact CD2-CZ 4Å; F160-Y168 HydrophobicContact CE2-CD2 4.15Å; F160-Y168 HydrophobicContact CE2-CE2 4.47Å; F160-Y168 AromaticContact CG-CD1 3.67Å; F160-Y168 HydrophobicContact CG-CD1 3.67Å; F160-Y168 AromaticContact CG-CD2 3.9Å; F160-Y168 HydrophobicContact CG-CD2 3.9Å; F160-Y168 AromaticContact CG-CE1 3.9Å; F160-Y168 HydrophobicContact CG-CE1 3.9Å; F160-Y168 HydrophobicContact CG-CE2 4.06Å; F160-Y168 AromaticContact CG-CG 3.69Å; F160-Y168 HydrophobicContact CG-CG 3.69Å; A166-Y168 WeakPolarHBondContact O-CD1 3.41Å; A166-Y168 PolarHBondContact O-N 3.27Å; Y168-F170 HydrophobicContact CD2-CB 4.08Å; Y168-F170 HydrophobicContact CE2-CB 3.61Å; Y168-F170 HydrophobicContact CE2-CD2 4.37Å; Y168-F170 HydrophobicContact CE2-CG 4.41Å; Y168-I212 HydrophobicContact CD2-CD1 4.11Å
169	L	78.4	Confident	76.7	Confident	49 Å²	49	55.5 Å²	55.5	26%	0.257	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.2	169.8	-179	60	0	0	0	107.6	L204 P208 R210 L211 I212	L169-L204 HydrophobicContact CD2-CD1 4.07Å; L169-L204 HydrophobicContact CD2-CD2 3.44Å; L169-L204 VanDerWaalsContact CD2-CD2 3.44Å; L169-L204 HydrophobicContact CD2-CG 4.41Å; L169-P208 HydrophobicContact CB-CB 4.1Å; L169-P208 HydrophobicContact CD2-CB 4.02Å; L169-P208 HydrophobicContact CD2-CG 4.4Å; L169-R210 PolarHBondContact N-O 3.33Å; L169-R210 VanDerWaalsContact N-O 3.08Å; L169-L211 HydrophobicContact CB-CD1 3.94Å; L169-L211 HydrophobicContact CD2-CD1 3.77Å; L169-L211 HydrophobicContact CG-CD1 3.73Å; L169-L211 WeakPolarHBondContact O-CA 3.19Å; L169-L211 WeakPolarHBondContact O-CD1 3.15Å; L169-I212 PolarHBondContact O-N 3.2Å
170	F	81	Confident	75.7	Confident	43 Å²	43	57.8 Å²	57.8	19%	0.189	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120.3	166.1	-170.3	-84.6	0	0	0	107.9	E153 L156 Y168 I212 Q214 L392	E153-F170 HydrophobicContact CB-CE1 4.32Å; E153-F170 HydrophobicContact CB-CE2 4.24Å; E153-F170 HydrophobicContact CB-CZ 3.69Å; L156-F170 HydrophobicContact CD1-CE2 4.21Å; Y168-F170 HydrophobicContact CD2-CB 4.08Å; Y168-F170 HydrophobicContact CE2-CB 3.61Å; Y168-F170 HydrophobicContact CE2-CD2 4.37Å; Y168-F170 HydrophobicContact CE2-CG 4.41Å; F170-I212 WeakPolarHBondContact CA-O 3.46Å; F170-I212 HydrophobicContact CD2-CB 3.84Å; F170-I212 HydrophobicContact CD2-CG2 3.72Å; F170-I212 HydrophobicContact CE2-CB 4.37Å; F170-I212 HydrophobicContact CE2-CG2 3.73Å; F170-Q214 HydrophobicContact CE1-CB 4.09Å; F170-Q214 HydrophobicContact CZ-CB 3.8Å; F170-Q214 HydrophobicContact CZ-CG 4.43Å; F170-L392 HydrophobicContact CE2-CD2 4.12Å; F170-L392 HydrophobicContact CZ-CD2 4.13Å
171	Q	80.4	Confident	74.8	Confident	42 Å²	42	57.8 Å²	57.8	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	119.6	-178.2	-177.5	69.1	39.7	0	0	109.4	F197 L211 I212 L213 Q214	Q171-F197 HydrophobicContact CG-CE2 4.02Å; Q171-F197 HydrophobicContact CG-CZ 4.39Å; Q171-L211 HydrophobicContact CB-CD1 4.32Å; Q171-I212 PolarHBondContact N-O 3.01Å; Q171-L213 HydrophobicContact CB-CD2 3.81Å; Q171-L213 HydrophobicContact CG-CD2 4.32Å; Q171-L213 WeakPolarHBondContact O-CA 3.29Å; Q171-Q214 PolarHBondContact O-N 3.44Å
172	L	80.7	Confident	74	Confident	86 Å²	86	57.7 Å²	57.7	45%	0.45	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	124.6	164.2	178.5	64.3	0	0	0	108.5	N174 Q214	L172-N174 PolarHBondContact O-N 2.99Å; L172-Q214 HydrophobicContact CD1-CB 3.99Å; L172-Q214 HydrophobicContact CD1-CG 3.89Å
173	I	79.5	Confident	73.3	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	31%	0.313	C	S	.	.			trans	-74.4	112.1	169.2	-67.1	-179.5	0	0	0	107.2	T175 V189 L192 L213 Q214 I215 P216	I173-T175 HydrophobicContact CG2-CG2 4.14Å; I173-V189 HydrophobicContact CD1-CG1 4.45Å; I173-L192 HydrophobicContact CD1-CB 3.84Å; I173-L192 HydrophobicContact CG2-CB 3.73Å; I173-L192 HydrophobicContact CG2-CD2 4.46Å; I173-L192 HydrophobicContact CG2-CG 4.48Å; I173-L213 HydrophobicContact CD1-CB 4.41Å; I173-L213 HydrophobicContact CD1-CD1 4.41Å; I173-Q214 WeakPolarHBondContact CB-O 3.45Å; I173-Q214 PolarHBondContact N-O 2.86Å; I173-Q214 VanDerWaalsContact N-O 3.08Å; I173-I215 HydrophobicContact CD1-CD1 3.79Å; I173-P216 HydrophobicContact CG2-CG 4.2Å; I173-P216 WeakPolarHBondContact O-CB 3.45Å
174	N	76.5	Confident	73	Confident	79 Å²	79	63.1 Å²	63.1	42%	0.422	33%	0.326	S	S	.	.			trans	-106	124.5	173.1	-168.7	3.5	0	0	0	109.5	L172 S196	L172-N174 PolarHBondContact O-N 2.99Å; N174-S196 PolarHBondContact N-OG 2.83Å; N174-S196 VanDerWaalsContact O-CA 3.24Å; N174-S196 WeakPolarHBondContact O-CA 3.46Å; N174-S196 WeakPolarHBondContact O-CB 3.33Å; N174-S196 PolarHBondContact O-OG 2.85Å
175	T	68.9	Low	72.9	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	34%	0.339	C	S	.	.			trans	-128	127.8	175.9	57.1	0	0	0	0	109.2	I173 Q182 L192 K195	I173-T175 HydrophobicContact CG2-CG2 4.14Å; T175-Q182 PolarHBondContact O-NE2 3.1Å; T175-Q182 VanDerWaalsContact O-NE2 3.07Å; T175-L192 HydrophobicContact CG2-CD2 3.99Å; T175-K195 HydrophobicContact CG2-CB 4.44Å; T175-K195 HydrophobicContact CG2-CG 4.2Å
176	E	67.1	Low	73.5	Confident	120 Å²	120	59.2 Å²	59.2	56%	0.561	32%	0.315	S	S	*	.			trans	-70.1	147.4	179.5	-63.1	-170.7	160.4	0	0	113.3	S178 S179 Q182	E176-S178 PolarHBondContact O-N 3.2Å; E176-S178 VanDerWaalsContact O-N 3.13Å; E176-S179 PolarHBondContact O-N 3.32Å; E176-S179 PolarHBondContact O-OG 3.04Å; E176-S179 VanDerWaalsContact O-OG 3.08Å; E176-Q182 VanDerWaalsContact C-NE2 3.31Å; E176-Q182 PolarHBondContact O-NE2 3.29Å; E176-Q182 VanDerWaalsContact O-NE2 3.13Å
177	D	61.1	Low	74.5	Confident	115 Å²	115	58.6 Å²	58.6	62%	0.615	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25	-170.9	-75.5	-13.8	0	0	0	115.2	Q182	D177-Q182 VanDerWaalsContact CA-CD 3.5Å; D177-Q182 VanDerWaalsContact CA-NE2 3.35Å; D177-Q182 VanDerWaalsContact CA-OE1 3.25Å; D177-Q182 PolarHBondContact O-OE1 2.86Å; D177-Q182 VanDerWaalsContact O-OE1 3.12Å; D177-Q182 PolarHBondContact OD1-NE2 3.43Å
178	S	55.1	Low	75.7	Confident	105 Å²	105	52.4 Å²	52.4	73%	0.734	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	13.8	-173.5	58.8	0	0	0	0	114.5	E176	E176-S178 PolarHBondContact O-N 3.2Å; E176-S178 VanDerWaalsContact O-N 3.13Å
179	S	62.4	Low	76.7	Confident	8 Å²	8	50.4 Å²	50.4	6%	0.056	27%	0.269	C	S	.	.			trans	-85.2	150.4	-170.7	66.2	0	0	0	0	114.9	E176 I181 Q182 Q183 K195	E176-S179 PolarHBondContact O-N 3.32Å; E176-S179 PolarHBondContact O-OG 3.04Å; E176-S179 VanDerWaalsContact O-OG 3.08Å; S179-I181 PolarHBondContact O-N 2.79Å; S179-I181 VanDerWaalsContact O-N 3.1Å; S179-Q182 PolarHBondContact O-N 2.93Å; S179-Q183 PolarHBondContact O-N 2.95Å; S179-K195 VanDerWaalsContact CB-CE 3.44Å
180	A	70.2	Confident	77.5	Confident	47 Å²	47	49.4 Å²	49.4	39%	0.388	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-24	174.5	0	0	0	0	0	113.5
181	I	70.5	Confident	78	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-40.7	175.9	-74.6	167.9	0	0	0	111.1	S179 Q183 R184 V187 Q191 L192 K195 F224 L262	S179-I181 PolarHBondContact O-N 2.79Å; S179-I181 VanDerWaalsContact O-N 3.1Å; I181-Q183 PolarHBondContact O-N 3.08Å; I181-R184 VanDerWaalsContact O-CB 3.28Å; I181-R184 WeakPolarHBondContact O-CB 3.46Å; I181-R184 PolarHBondContact O-N 3.29Å; I181-V187 HydrophobicContact CG2-CG1 3.79Å; I181-Q191 HydrophobicContact CD1-CB 4.48Å; I181-L192 HydrophobicContact CG2-CD2 4.14Å; I181-K195 HydrophobicContact CD1-CB 3.49Å; I181-K195 VanDerWaalsContact CD1-CB 3.49Å; I181-K195 HydrophobicContact CD1-CD 4.01Å; I181-K195 HydrophobicContact CD1-CG 3.69Å; I181-F224 HydrophobicContact CG2-CE1 4.14Å; I181-F224 HydrophobicContact CG2-CZ 4.19Å; I181-L262 HydrophobicContact CD1-CD1 3.76Å; I181-L262 HydrophobicContact CD1-CD2 4.24Å; I181-L262 HydrophobicContact CG1-CD1 4.11Å; I181-L262 HydrophobicContact CG1-CD2 4.42Å
182	Q	68	Low	78.6	Confident	42 Å²	42	46.7 Å²	46.7	20%	0.196	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20	175.9	-74.7	-157.2	14.1	0	0	113.7	T175 E176 D177 S179 R184 F224	T175-Q182 PolarHBondContact O-NE2 3.1Å; T175-Q182 VanDerWaalsContact O-NE2 3.07Å; E176-Q182 VanDerWaalsContact C-NE2 3.31Å; E176-Q182 PolarHBondContact O-NE2 3.29Å; E176-Q182 VanDerWaalsContact O-NE2 3.13Å; D177-Q182 VanDerWaalsContact CA-CD 3.5Å; D177-Q182 VanDerWaalsContact CA-NE2 3.35Å; D177-Q182 VanDerWaalsContact CA-OE1 3.25Å; D177-Q182 PolarHBondContact O-OE1 2.86Å; D177-Q182 VanDerWaalsContact O-OE1 3.12Å; D177-Q182 PolarHBondContact OD1-NE2 3.43Å; S179-Q182 PolarHBondContact O-N 2.93Å; Q182-R184 PolarHBondContact O-N 2.8Å; Q182-F224 HydrophobicContact CG-CZ 4.28Å
183	Q	71.2	Confident	79.3	Confident	164 Å²	164	42.7 Å²	42.7	77%	0.766	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-12	171.7	-62.4	-179.3	2.1	0	0	113	S179 I181	S179-Q183 PolarHBondContact O-N 2.95Å; I181-Q183 PolarHBondContact O-N 3.08Å
184	R	81.2	Confident	79.9	Confident	79 Å²	79	42.9 Å²	42.9	30%	0.298	23%	0.231	S	C	.	.			trans	-87.2	135.7	177.5	-58.2	-176.3	177.8	-175.9	-0.8	110.2	I181 Q182 V187 F224	I181-R184 VanDerWaalsContact O-CB 3.28Å; I181-R184 WeakPolarHBondContact O-CB 3.46Å; I181-R184 PolarHBondContact O-N 3.29Å; Q182-R184 PolarHBondContact O-N 2.8Å; R184-V187 HydrophobicContact CB-CG1 3.86Å; R184-F224 WeakPolarHBondContact O-CD1 3.43Å
185	S	85.2	Confident	80.6	Confident	51 Å²	51	39.9 Å²	39.9	36%	0.357	21%	0.214	S	C	.	.	S	Bend	trans	-71.2	-35.3	170.8	52.5	0	0	0	0	112.1	R225 A226	S185-R225 WeakPolarHBondContact O-CA 2.95Å; S185-R225 VanDerWaalsContact O-CB 3.31Å; S185-R225 WeakPolarHBondContact O-CB 3.43Å; S185-R225 PolarHBondContact O-N 2.85Å; S185-A226 PolarHBondContact O-N 3.21Å
186	V	91	Very high	81.6	Confident	9 Å²	9	39.8 Å²	39.8	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	128.8	-176.6	-176.4	0	0	0	0	109.3	A226 I228 V369 L372	V186-A226 WeakPolarHBondContact CA-O 3.41Å; V186-A226 HydrophobicContact CG1-CB 4.31Å; V186-A226 HydrophobicContact CG2-CB 4.3Å; V186-I228 HydrophobicContact CG1-CD1 3.63Å; V186-I228 HydrophobicContact CG1-CG1 4.03Å; V186-V369 HydrophobicContact CB-CG1 4.46Å; V186-V369 HydrophobicContact CG1-CG2 4.25Å; V186-L372 HydrophobicContact CG1-CD1 3.88Å; V186-L372 HydrophobicContact CG2-CB 3.76Å
187	V	92.3	Very high	82.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	161.2	-179.8	-63.7	0	0	0	0	110.5	I181 R184 L192 F224 A226 V227 I228	I181-V187 HydrophobicContact CG2-CG1 3.79Å; R184-V187 HydrophobicContact CB-CG1 3.86Å; V187-L192 HydrophobicContact CB-CG 4.44Å; V187-L192 HydrophobicContact CG2-CD1 3.9Å; V187-L192 HydrophobicContact CG2-CD2 4.04Å; V187-L192 HydrophobicContact CG2-CG 3.9Å; V187-F224 HydrophobicContact CB-CD1 4.27Å; V187-F224 HydrophobicContact CB-CE1 4.42Å; V187-F224 HydrophobicContact CG1-CD1 3.59Å; V187-F224 HydrophobicContact CG1-CE1 3.58Å; V187-F224 HydrophobicContact CG1-CG 4.39Å; V187-F224 HydrophobicContact CG1-CZ 4.39Å; V187-F224 HydrophobicContact CG2-CB 4.1Å; V187-F224 HydrophobicContact CG2-CD1 3.62Å; V187-F224 HydrophobicContact CG2-CD2 3.85Å; V187-F224 HydrophobicContact CG2-CE1 3.98Å; V187-F224 HydrophobicContact CG2-CE2 4.21Å; V187-F224 HydrophobicContact CG2-CG 3.55Å; V187-F224 HydrophobicContact CG2-CZ 4.27Å; V187-A226 PolarHBondContact N-O 3.4Å; V187-A226 VanDerWaalsContact N-O 3.08Å; V187-V227 HydrophobicContact CG2-CB 4.45Å; V187-V227 HydrophobicContact CG2-CG1 4.45Å; V187-V227 HydrophobicContact CG2-CG2 3.88Å; V187-V227 CarbonylContact O-C 3.59Å; V187-V227 WeakPolarHBondContact O-CA 3.37Å; V187-I228 PolarHBondContact O-N 3.29Å
188	T	94.1	Very high	84	Confident	16 Å²	16	31.8 Å²	31.8	10%	0.098	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	157.3	171.4	69.7	0	0	0	0	111.5	Q190 Q191 L192 I228 Y365	T188-Q190 VanDerWaalsContact C-N 3.27Å; T188-Q190 PolarHBondContact O-N 3.39Å; T188-Q191 VanDerWaalsContact N-OE1 3.09Å; T188-Q191 PolarHBondContact O-N 2.79Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.43Å; T188-Q191 PolarHBondContact OG1-N 2.9Å; T188-Q191 VanDerWaalsContact OG1-N 3.17Å; T188-L192 WeakPolarHBondContact O-CG 3.3Å; T188-L192 PolarHBondContact O-N 3.01Å; T188-I228 WeakPolarHBondContact CA-O 3.4Å; T188-I228 HydrophobicContact CG2-CB 4.34Å; T188-Y365 HydrophobicContact CG2-CE2 3.66Å; T188-Y365 WeakPolarHBondContact CG2-OH 3.26Å
189	V	95.1	Very high	85.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-37.6	172.9	176.6	0	0	0	0	111.6	I173 Q191 L192 L193 L213 I215 V227 I228 L233 Y395	I173-V189 HydrophobicContact CD1-CG1 4.45Å; V189-Q191 PolarHBondContact O-N 3.46Å; V189-L192 PolarHBondContact O-N 3.46Å; V189-L193 WeakPolarHBondContact O-CB 3Å; V189-L193 PolarHBondContact O-N 2.94Å; V189-L213 HydrophobicContact CG1-CD1 3.62Å; V189-I215 HydrophobicContact CG1-CD1 4.4Å; V189-I215 HydrophobicContact CG2-CD1 3.88Å; V189-V227 HydrophobicContact CG2-CG1 3.78Å; V189-I228 PolarHBondContact N-O 3.41Å; V189-L233 HydrophobicContact CG1-CD1 4.12Å; V189-Y395 HydrophobicContact CG1-CE2 4.17Å
190	Q	95.3	Very high	86.8	Confident	28 Å²	28	32 Å²	32	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-55.9	-49	172.5	-176.9	70.2	36.1	0	0	112.1	T188 L192 L193 E194 S230 L233 D234	T188-Q190 VanDerWaalsContact C-N 3.27Å; T188-Q190 PolarHBondContact O-N 3.39Å; Q190-L192 VanDerWaalsContact C-N 3.34Å; Q190-L192 PolarHBondContact O-N 2.65Å; Q190-L193 PolarHBondContact O-N 2.94Å; Q190-E194 PolarHBondContact NE2-OE1 3.38Å; Q190-E194 WeakPolarHBondContact O-CB 3.08Å; Q190-E194 WeakPolarHBondContact O-CG 3.3Å; Q190-E194 PolarHBondContact O-N 2.99Å; Q190-S230 WeakPolarHBondContact CB-OG 3.49Å; Q190-S230 PolarHBondContact N-OG 3.02Å; Q190-L233 HydrophobicContact CB-CD1 4.31Å; Q190-D234 PolarHBondContact NE2-O 3.1Å
191	Q	93.1	Very high	87.6	Confident	29 Å²	29	35.2 Å²	35.2	14%	0.136	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-42.7	180	-74.6	167.9	-15.1	0	0	111.6	I181 T188 V189 K195	I181-Q191 HydrophobicContact CD1-CB 4.48Å; T188-Q191 VanDerWaalsContact N-OE1 3.09Å; T188-Q191 PolarHBondContact O-N 2.79Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.43Å; T188-Q191 PolarHBondContact OG1-N 2.9Å; T188-Q191 VanDerWaalsContact OG1-N 3.17Å; V189-Q191 PolarHBondContact O-N 3.46Å; Q191-K195 VanDerWaalsContact O-CB 3.24Å; Q191-K195 WeakPolarHBondContact O-CB 3.47Å; Q191-K195 PolarHBondContact O-N 3.23Å
192	L	93	Very high	88.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-43.8	178.2	-74.7	-178.8	0	0	0	112.3	I173 T175 I181 V187 T188 V189 Q190 S196 I215 F224 V227	I173-L192 HydrophobicContact CD1-CB 3.84Å; I173-L192 HydrophobicContact CG2-CB 3.73Å; I173-L192 HydrophobicContact CG2-CD2 4.46Å; I173-L192 HydrophobicContact CG2-CG 4.48Å; T175-L192 HydrophobicContact CG2-CD2 3.99Å; I181-L192 HydrophobicContact CG2-CD2 4.14Å; V187-L192 HydrophobicContact CB-CG 4.44Å; V187-L192 HydrophobicContact CG2-CD1 3.9Å; V187-L192 HydrophobicContact CG2-CD2 4.04Å; V187-L192 HydrophobicContact CG2-CG 3.9Å; T188-L192 WeakPolarHBondContact O-CG 3.3Å; T188-L192 PolarHBondContact O-N 3.01Å; V189-L192 PolarHBondContact O-N 3.46Å; Q190-L192 VanDerWaalsContact C-N 3.34Å; Q190-L192 PolarHBondContact O-N 2.65Å; L192-S196 WeakPolarHBondContact O-CB 3.29Å; L192-S196 PolarHBondContact O-N 2.82Å; L192-I215 HydrophobicContact CD1-CG2 4.42Å; L192-F224 HydrophobicContact CD1-CE2 4.45Å; L192-F224 HydrophobicContact CD2-CD2 4.44Å; L192-F224 HydrophobicContact CD2-CE2 3.58Å; L192-F224 HydrophobicContact CD2-CZ 3.64Å; L192-V227 HydrophobicContact CD1-CG1 3.62Å; L192-V227 HydrophobicContact CD1-CG2 4.15Å
193	L	94.1	Very high	89.4	Confident	2 Å²	2	40 Å²	40	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-54.4	177.3	179.5	72	0	0	0	111.5	V189 Q190 K195 S196 F197 L213 L233 V235 I238	V189-L193 WeakPolarHBondContact O-CB 3Å; V189-L193 PolarHBondContact O-N 2.94Å; Q190-L193 PolarHBondContact O-N 2.94Å; L193-K195 VanDerWaalsContact C-N 3.25Å; L193-K195 PolarHBondContact O-N 2.84Å; L193-S196 PolarHBondContact O-N 2.89Å; L193-S196 VanDerWaalsContact O-N 3.14Å; L193-F197 HydrophobicContact CD1-CD2 3.81Å; L193-F197 HydrophobicContact CD1-CE2 3.55Å; L193-F197 HydrophobicContact CG-CD2 4.31Å; L193-F197 HydrophobicContact CG-CE2 4.46Å; L193-F197 WeakPolarHBondContact O-CD2 3.43Å; L193-F197 PolarHBondContact O-N 2.83Å; L193-L213 HydrophobicContact CD1-CD1 4.26Å; L193-L213 HydrophobicContact CD1-CD2 4.02Å; L193-L233 HydrophobicContact CD2-CD1 3.99Å; L193-L233 HydrophobicContact CD2-CD2 3.89Å; L193-L233 HydrophobicContact CD2-CG 3.98Å; L193-V235 HydrophobicContact CD2-CG1 4.21Å; L193-I238 HydrophobicContact CD1-CD1 4.07Å; L193-I238 HydrophobicContact CD2-CD1 3.74Å; L193-I238 HydrophobicContact CG-CD1 3.91Å
194	E	92.8	Very high	90.2	Very high	4 Å²	4	33 Å²	33	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-55.7	-44.3	179.9	-74.6	179.1	-177.7	0	0	111.1	Q190 F197 F198 Y261 L268	Q190-E194 PolarHBondContact NE2-OE1 3.38Å; Q190-E194 WeakPolarHBondContact O-CB 3.08Å; Q190-E194 WeakPolarHBondContact O-CG 3.3Å; Q190-E194 PolarHBondContact O-N 2.99Å; E194-F197 PolarHBondContact O-N 3.03Å; E194-F198 VanDerWaalsContact O-CB 3.23Å; E194-F198 WeakPolarHBondContact O-CB 3.31Å; E194-F198 PolarHBondContact O-N 3.34Å; E194-Y261 VanDerWaalsContact CB-OH 3.28Å; E194-Y261 WeakPolarHBondContact CB-OH 3.32Å; E194-Y261 PolarHBondContact OE2-OH 2.9Å; E194-L268 HydrophobicContact CB-CB 4.07Å; E194-L268 HydrophobicContact CB-CD2 4.43Å; E194-L268 HydrophobicContact CG-CB 3.87Å; E194-L268 PolarHBondContact OE2-N 3.16Å
195	K	90.3	Very high	90.5	Very high	16 Å²	16	33.7 Å²	33.7	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-44.1	178	-174.3	55.3	158.7	79.1	0	112.6	T175 S179 I181 Q191 L193 F197 F198 D199 Y261 L262	T175-K195 HydrophobicContact CG2-CB 4.44Å; T175-K195 HydrophobicContact CG2-CG 4.2Å; S179-K195 VanDerWaalsContact CB-CE 3.44Å; I181-K195 HydrophobicContact CD1-CB 3.49Å; I181-K195 VanDerWaalsContact CD1-CB 3.49Å; I181-K195 HydrophobicContact CD1-CD 4.01Å; I181-K195 HydrophobicContact CD1-CG 3.69Å; Q191-K195 VanDerWaalsContact O-CB 3.24Å; Q191-K195 WeakPolarHBondContact O-CB 3.47Å; Q191-K195 PolarHBondContact O-N 3.23Å; L193-K195 VanDerWaalsContact C-N 3.25Å; L193-K195 PolarHBondContact O-N 2.84Å; K195-F197 PolarHBondContact O-N 3.49Å; K195-F198 WeakPolarHBondContact O-CB 3.32Å; K195-F198 PolarHBondContact O-N 3.38Å; K195-D199 IonicContact NZ-OD1 3.71Å; K195-D199 PolarHBondContact NZ-OD1 3.13Å; K195-D199 IonicContact NZ-OD2 3.92Å; K195-D199 PolarHBondContact NZ-OD2 2.83Å; K195-D199 WeakPolarHBondContact O-CB 3.46Å; K195-D199 VanDerWaalsContact O-CG 3.27Å; K195-D199 PolarHBondContact O-N 2.92Å; K195-Y261 HydrophobicContact CD-CE1 4.2Å; K195-Y261 PolarHBondContact N-OH 3.26Å; K195-L262 HydrophobicContact CD-CD1 3.83Å
196	S	90.7	Very high	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-45.6	-179.2	-167.3	0	0	0	0	111.7	N174 L192 L193 F198 D199 L200	N174-S196 PolarHBondContact N-OG 2.83Å; N174-S196 VanDerWaalsContact O-CA 3.24Å; N174-S196 WeakPolarHBondContact O-CA 3.46Å; N174-S196 WeakPolarHBondContact O-CB 3.33Å; N174-S196 PolarHBondContact O-OG 2.85Å; L192-S196 WeakPolarHBondContact O-CB 3.29Å; L192-S196 PolarHBondContact O-N 2.82Å; L193-S196 PolarHBondContact O-N 2.89Å; L193-S196 VanDerWaalsContact O-N 3.14Å; S196-F198 VanDerWaalsContact C-N 3.34Å; S196-D199 PolarHBondContact O-N 2.8Å; S196-L200 WeakPolarHBondContact O-CB 3.44Å; S196-L200 VanDerWaalsContact O-CG 3.24Å; S196-L200 WeakPolarHBondContact O-CG 3.49Å; S196-L200 PolarHBondContact O-N 2.66Å
197	F	90.9	Very high	90.3	Very high	7 Å²	7	41.4 Å²	41.4	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-35.9	177	-85.1	-105.8	0	0	0	112.6	Q171 L193 E194 K195 N201 V202 L204 I238	Q171-F197 HydrophobicContact CG-CE2 4.02Å; Q171-F197 HydrophobicContact CG-CZ 4.39Å; L193-F197 HydrophobicContact CD1-CD2 3.81Å; L193-F197 HydrophobicContact CD1-CE2 3.55Å; L193-F197 HydrophobicContact CG-CD2 4.31Å; L193-F197 HydrophobicContact CG-CE2 4.46Å; L193-F197 WeakPolarHBondContact O-CD2 3.43Å; L193-F197 PolarHBondContact O-N 2.83Å; E194-F197 PolarHBondContact O-N 3.03Å; K195-F197 PolarHBondContact O-N 3.49Å; F197-N201 WeakPolarHBondContact O-CA 3.25Å; F197-N201 PolarHBondContact O-N 3.09Å; F197-V202 HydrophobicContact CD1-CG2 3.86Å; F197-V202 WeakPolarHBondContact CD1-O 3.39Å; F197-V202 HydrophobicContact CE1-CG2 4.09Å; F197-V202 HydrophobicContact CG-CG2 4.39Å; F197-V202 PolarHBondContact O-N 2.97Å; F197-L204 HydrophobicContact CE1-CD2 3.66Å; F197-L204 HydrophobicContact CE1-CG 3.64Å; F197-L204 HydrophobicContact CZ-CD1 4.46Å; F197-L204 HydrophobicContact CZ-CD2 3.67Å; F197-L204 HydrophobicContact CZ-CG 3.93Å; F197-I238 HydrophobicContact CB-CB 4.23Å; F197-I238 HydrophobicContact CB-CG2 3.61Å; F197-I238 HydrophobicContact CD1-CB 3.72Å; F197-I238 HydrophobicContact CD1-CD1 4.08Å; F197-I238 HydrophobicContact CD1-CG1 4.45Å; F197-I238 HydrophobicContact CD1-CG2 4.08Å; F197-I238 HydrophobicContact CD2-CD1 4.01Å; F197-I238 HydrophobicContact CD2-CG2 4.48Å; F197-I238 HydrophobicContact CE1-CB 4.31Å; F197-I238 HydrophobicContact CE1-CD1 4.03Å; F197-I238 HydrophobicContact CE2-CD1 3.93Å; F197-I238 HydrophobicContact CG-CB 3.95Å; F197-I238 HydrophobicContact CG-CD1 4.09Å; F197-I238 HydrophobicContact CG-CG2 3.79Å; F197-I238 HydrophobicContact CZ-CD1 3.96Å
198	F	88.4	Confident	90.1	Very high	59 Å²	59	41.9 Å²	41.9	26%	0.259	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-49.9	174.4	-178.7	-91.6	0	0	0	111.8	E194 K195 S196 N201 K258 Y261 L268	E194-F198 VanDerWaalsContact O-CB 3.23Å; E194-F198 WeakPolarHBondContact O-CB 3.31Å; E194-F198 PolarHBondContact O-N 3.34Å; K195-F198 WeakPolarHBondContact O-CB 3.32Å; K195-F198 PolarHBondContact O-N 3.38Å; S196-F198 VanDerWaalsContact C-N 3.34Å; F198-N201 PolarHBondContact O-N 3.03Å; F198-N201 VanDerWaalsContact O-N 3.15Å; F198-K258 HydrophobicContact CE2-CB 3.74Å; F198-K258 HydrophobicContact CE2-CD 4.44Å; F198-K258 HydrophobicContact CE2-CG 4.17Å; F198-K258 VanDerWaalsContact CE2-O 3.31Å; F198-K258 WeakPolarHBondContact CE2-O 3.2Å; F198-K258 HydrophobicContact CZ-CB 4.44Å; F198-Y261 HydrophobicContact CB-CD1 4.15Å; F198-Y261 HydrophobicContact CB-CE1 4.03Å; F198-Y261 HydrophobicContact CD1-CD1 4.01Å; F198-Y261 HydrophobicContact CD1-CE1 4.41Å; F198-Y261 AromaticContact CD2-CD1 3.56Å; F198-Y261 HydrophobicContact CD2-CD1 3.56Å; F198-Y261 HydrophobicContact CD2-CE1 4.29Å; F198-Y261 HydrophobicContact CD2-CG 4.29Å; F198-Y261 HydrophobicContact CE1-CD1 4.29Å; F198-Y261 AromaticContact CE2-CD1 3.85Å; F198-Y261 HydrophobicContact CE2-CD1 3.85Å; F198-Y261 HydrophobicContact CE2-CG 4.33Å; F198-Y261 AromaticContact CG-CD1 3.64Å; F198-Y261 HydrophobicContact CG-CD1 3.64Å; F198-Y261 AromaticContact CG-CE1 4Å; F198-Y261 HydrophobicContact CG-CE1 4Å; F198-Y261 HydrophobicContact CZ-CD1 4.21Å; F198-L268 HydrophobicContact CD2-CD1 4.12Å
199	D	87.3	Confident	89.9	Confident	42 Å²	42	42.8 Å²	42.8	23%	0.225	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-44.4	-178.4	-71	-11.3	0	0	0	112.2	K195 S196 N201	K195-D199 IonicContact NZ-OD1 3.71Å; K195-D199 PolarHBondContact NZ-OD1 3.13Å; K195-D199 IonicContact NZ-OD2 3.92Å; K195-D199 PolarHBondContact NZ-OD2 2.83Å; K195-D199 WeakPolarHBondContact O-CB 3.46Å; K195-D199 VanDerWaalsContact O-CG 3.27Å; K195-D199 PolarHBondContact O-N 2.92Å; S196-D199 PolarHBondContact O-N 2.8Å; D199-N201 PolarHBondContact O-N 3.32Å
200	L	87.6	Confident	89.7	Confident	77 Å²	77	43.9 Å²	43.9	40%	0.403	23%	0.229	S	C	.	.	H	α-helix	trans	-73.1	-13.3	178	-65.3	174.8	0	0	0	112.3	S196 V202	S196-L200 WeakPolarHBondContact O-CB 3.44Å; S196-L200 VanDerWaalsContact O-CG 3.24Å; S196-L200 WeakPolarHBondContact O-CG 3.49Å; S196-L200 PolarHBondContact O-N 2.66Å; L200-V202 HydrophobicContact CB-CG1 4.25Å; L200-V202 HydrophobicContact CB-CG2 3.8Å; L200-V202 HydrophobicContact CD1-CG2 4.49Å; L200-V202 WeakPolarHBondContact O-CG1 3.29Å; L200-V202 PolarHBondContact O-N 2.89Å
201	N	86.3	Confident	89.6	Confident	113 Å²	113	42.7 Å²	42.7	60%	0.604	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.4	43.4	-173.8	-169.7	38.9	0	0	0	112.7	F197 F198 D199 K258	F197-N201 WeakPolarHBondContact O-CA 3.25Å; F197-N201 PolarHBondContact O-N 3.09Å; F198-N201 PolarHBondContact O-N 3.03Å; F198-N201 VanDerWaalsContact O-N 3.15Å; D199-N201 PolarHBondContact O-N 3.32Å; N201-K258 PolarHBondContact OD1-NZ 2.8Å
202	V	88.1	Confident	89.7	Confident	66 Å²	66	41.3 Å²	41.3	40%	0.4	22%	0.217	S	C	.	.			trans	-114.5	160.4	178.3	-64.2	0	0	0	0	110.9	F197 L200	F197-V202 HydrophobicContact CD1-CG2 3.86Å; F197-V202 WeakPolarHBondContact CD1-O 3.39Å; F197-V202 HydrophobicContact CE1-CG2 4.09Å; F197-V202 HydrophobicContact CG-CG2 4.39Å; F197-V202 PolarHBondContact O-N 2.97Å; L200-V202 HydrophobicContact CB-CG1 4.25Å; L200-V202 HydrophobicContact CB-CG2 3.8Å; L200-V202 HydrophobicContact CD1-CG2 4.49Å; L200-V202 WeakPolarHBondContact O-CG1 3.29Å; L200-V202 PolarHBondContact O-N 2.89Å
203	L	88.3	Confident	89.8	Confident	78 Å²	78	41.3 Å²	41.3	41%	0.408	22%	0.217	S	C	.	.			trans	-136.1	152.6	173.5	-63.8	174	0	0	0	109.7	I238 L240	L203-I238 CarbonylContact C-O 3.55Å; L203-I238 WeakPolarHBondContact CA-O 3.5Å; L203-L240 HydrophobicContact CB-CB 4.11Å; L203-L240 HydrophobicContact CD1-CD1 4Å
204	L	89.1	Confident	89.8	Confident	17 Å²	17	42.3 Å²	42.3	9%	0.089	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-75.9	121.5	173.9	-64.7	-177.5	0	0	0	110.4	L169 F197 K206 P208 I238 L239 L240	L169-L204 HydrophobicContact CD2-CD1 4.07Å; L169-L204 HydrophobicContact CD2-CD2 3.44Å; L169-L204 VanDerWaalsContact CD2-CD2 3.44Å; L169-L204 HydrophobicContact CD2-CG 4.41Å; F197-L204 HydrophobicContact CE1-CD2 3.66Å; F197-L204 HydrophobicContact CE1-CG 3.64Å; F197-L204 HydrophobicContact CZ-CD1 4.46Å; F197-L204 HydrophobicContact CZ-CD2 3.67Å; F197-L204 HydrophobicContact CZ-CG 3.93Å; L204-K206 PolarHBondContact O-N 2.9Å; L204-P208 HydrophobicContact CD1-CG 4Å; L204-I238 HydrophobicContact CD1-CD1 3.82Å; L204-I238 HydrophobicContact CD1-CG1 4.23Å; L204-I238 HydrophobicContact CG-CD1 4.29Å; L204-I238 PolarHBondContact N-O 3.34Å; L204-L239 HydrophobicContact CB-CD2 3.78Å; L204-L239 HydrophobicContact CD1-CD2 4.37Å; L204-L240 WeakPolarHBondContact O-CB 3.1Å; L204-L240 PolarHBondContact O-N 3.4Å
205	S	86.9	Confident	89.7	Confident	93 Å²	93	42.3 Å²	42.3	65%	0.65	22%	0.222	S	C	*	.	S	Bend	trans	-70.9	-17	178.1	60.4	0	0	0	0	114.2
206	K	85.5	Confident	89.3	Confident	168 Å²	168	42.3 Å²	42.3	73%	0.73	22%	0.224	S	C	*	.	S	Bend	trans	-145.9	154.1	-178.7	-63.5	-177	-177.8	178	0	110.3	L204 P208 L239	L204-K206 PolarHBondContact O-N 2.9Å; K206-P208 WeakPolarHBondContact O-CD 3.12Å; K206-L239 WeakPolarHBondContact O-CD2 3.48Å
207	I	87.1	Confident	88.6	Confident	54 Å²	54	45 Å²	45	28%	0.277	23%	0.234	S	C	.	.			trans	-65	123.9	172	-61.1	167.6	0	0	0	109.1	T209 L239 I300 W397	I207-T209 PolarHBondContact O-N 3.32Å; I207-L239 HydrophobicContact CG1-CD1 3.86Å; I207-L239 HydrophobicContact CG1-CD2 4.08Å; I207-I300 HydrophobicContact CB-CG2 4.49Å; I207-I300 HydrophobicContact CD1-CD1 3.72Å; I207-I300 HydrophobicContact CD1-CG1 3.87Å; I207-I300 HydrophobicContact CD1-CG2 4.23Å; I207-I300 HydrophobicContact CG1-CG1 4.28Å; I207-I300 HydrophobicContact CG1-CG2 4.16Å; I207-I300 HydrophobicContact CG2-CG2 3.57Å; I207-W397 HydrophobicContact CB-CE3 4.28Å; I207-W397 HydrophobicContact CB-CZ3 4.31Å; I207-W397 HydrophobicContact CD1-CH2 3.83Å; I207-W397 HydrophobicContact CD1-CZ2 4.23Å; I207-W397 HydrophobicContact CD1-CZ3 4.02Å; I207-W397 HydrophobicContact CG2-CD2 3.7Å; I207-W397 HydrophobicContact CG2-CE3 3.42Å; I207-W397 VanDerWaalsContact CG2-CE3 3.42Å; I207-W397 HydrophobicContact CG2-CG 4.21Å; I207-W397 HydrophobicContact CG2-CZ3 3.89Å
208	P	88.5	Confident	87.4	Confident	10 Å²	10	50.4 Å²	50.4	7%	0.065	26%	0.255	C	S	.	.			trans	-76.6	113	175.1	31	-32.8	0	0	0	109.6	L169 L204 K206 R210 L211 L302	L169-P208 HydrophobicContact CB-CB 4.1Å; L169-P208 HydrophobicContact CD2-CB 4.02Å; L169-P208 HydrophobicContact CD2-CG 4.4Å; L204-P208 HydrophobicContact CD1-CG 4Å; K206-P208 WeakPolarHBondContact O-CD 3.12Å; P208-R210 PolarHBondContact O-N 3.22Å; P208-L211 HydrophobicContact CB-CB 4.19Å; P208-L211 HydrophobicContact CG-CB 4.35Å; P208-L211 HydrophobicContact CG-CD2 4.44Å; P208-L302 HydrophobicContact CG-CD1 4.08Å
209	T	88.8	Confident	86.2	Confident	36 Å²	36	50.9 Å²	50.9	22%	0.221	28%	0.276	C	S	.	.	S	Bend	trans	-69.3	-27.4	174.1	54.3	0	0	0	0	112.2	I207 Y396 W397	I207-T209 PolarHBondContact O-N 3.32Å; T209-Y396 VanDerWaalsContact O-CA 3.29Å; T209-Y396 WeakPolarHBondContact O-CA 3.24Å; T209-W397 HydrophobicContact CG2-CE3 4.32Å; T209-W397 PolarHBondContact O-N 2.86Å
210	R	90.6	Very high	85	Confident	22 Å²	22	57.6 Å²	57.6	8%	0.083	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	122.9	175.3	-57.2	171	-178.3	99.6	3.9	108	I92 F93 L169 P208	I92-R210 PolarHBondContact O-NE 3.08Å; I92-R210 PolarHBondContact O-NH2 3.45Å; F93-R210 HydrophobicContact CE1-CB 4.2Å; F93-R210 HydrophobicContact CE1-CG 4.35Å; L169-R210 PolarHBondContact N-O 3.33Å; L169-R210 VanDerWaalsContact N-O 3.08Å; P208-R210 PolarHBondContact O-N 3.22Å
211	L	93.5	Very high	84	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.016	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.9	-179.1	175	62	0	0	0	109.2	L169 Q171 P208 L213 L233 V235 L302 Y395	L169-L211 HydrophobicContact CB-CD1 3.94Å; L169-L211 HydrophobicContact CD2-CD1 3.77Å; L169-L211 HydrophobicContact CG-CD1 3.73Å; L169-L211 WeakPolarHBondContact O-CA 3.19Å; L169-L211 WeakPolarHBondContact O-CD1 3.15Å; Q171-L211 HydrophobicContact CB-CD1 4.32Å; P208-L211 HydrophobicContact CB-CB 4.19Å; P208-L211 HydrophobicContact CG-CB 4.35Å; P208-L211 HydrophobicContact CG-CD2 4.44Å; L211-L213 HydrophobicContact CD1-CD2 3.7Å; L211-L213 HydrophobicContact CD1-CG 4.35Å; L211-L213 HydrophobicContact CD2-CD1 4.28Å; L211-L213 HydrophobicContact CD2-CD2 3.93Å; L211-L213 HydrophobicContact CD2-CG 4.07Å; L211-L213 HydrophobicContact CG-CD2 3.82Å; L211-L213 HydrophobicContact CG-CG 3.95Å; L211-L233 HydrophobicContact CD2-CD2 3.86Å; L211-V235 HydrophobicContact CD2-CG1 4.46Å; L211-L302 HydrophobicContact CB-CD1 3.9Å; L211-L302 HydrophobicContact CD2-CD1 3.65Å; L211-L302 HydrophobicContact CG-CD1 4.44Å; L211-Y395 PolarHBondContact N-O 3.14Å; L211-Y395 PolarHBondContact O-N 2.83Å
212	I	95.1	Very high	83.4	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.4	170.9	-55.5	177.1	0	0	0	106.9	L156 F160 Y168 L169 F170 Q171 L392 C393 F394	L156-I212 HydrophobicContact CD1-CD1 4.25Å; L156-I212 HydrophobicContact CD1-CG2 4.38Å; F160-I212 HydrophobicContact CD2-CD1 4.4Å; F160-I212 HydrophobicContact CE2-CD1 3.67Å; F160-I212 HydrophobicContact CZ-CD1 4.35Å; Y168-I212 HydrophobicContact CD2-CD1 4.11Å; L169-I212 PolarHBondContact O-N 3.2Å; F170-I212 WeakPolarHBondContact CA-O 3.46Å; F170-I212 HydrophobicContact CD2-CB 3.84Å; F170-I212 HydrophobicContact CD2-CG2 3.72Å; F170-I212 HydrophobicContact CE2-CB 4.37Å; F170-I212 HydrophobicContact CE2-CG2 3.73Å; Q171-I212 PolarHBondContact N-O 3.01Å; I212-L392 HydrophobicContact CG2-CB 4.4Å; I212-L392 HydrophobicContact CG2-CD1 4.48Å; I212-L392 HydrophobicContact CG2-CD2 4.45Å; I212-C393 WeakPolarHBondContact CA-O 3.37Å; I212-F394 HydrophobicContact CD1-CD1 3.89Å; I212-F394 HydrophobicContact CD1-CE1 3.67Å; I212-F394 HydrophobicContact CG1-CD1 3.8Å; I212-F394 HydrophobicContact CG1-CE1 4.03Å; I212-F394 HydrophobicContact CG2-CD1 4.45Å; I212-F394 HydrophobicContact CG2-CE1 4.24Å; I212-F394 HydrophobicContact CG2-CZ 4.45Å
213	L	95.6	Very high	83	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.2	177.6	-65.4	-176.8	0	0	0	110	Q171 I173 V189 L193 L211 L233 L392 C393 Y395	Q171-L213 HydrophobicContact CB-CD2 3.81Å; Q171-L213 HydrophobicContact CG-CD2 4.32Å; Q171-L213 WeakPolarHBondContact O-CA 3.29Å; I173-L213 HydrophobicContact CD1-CB 4.41Å; I173-L213 HydrophobicContact CD1-CD1 4.41Å; V189-L213 HydrophobicContact CG1-CD1 3.62Å; L193-L213 HydrophobicContact CD1-CD1 4.26Å; L193-L213 HydrophobicContact CD1-CD2 4.02Å; L211-L213 HydrophobicContact CD1-CD2 3.7Å; L211-L213 HydrophobicContact CD1-CG 4.35Å; L211-L213 HydrophobicContact CD2-CD1 4.28Å; L211-L213 HydrophobicContact CD2-CD2 3.93Å; L211-L213 HydrophobicContact CD2-CG 4.07Å; L211-L213 HydrophobicContact CG-CD2 3.82Å; L211-L213 HydrophobicContact CG-CG 3.95Å; L213-L233 HydrophobicContact CD1-CD2 3.79Å; L213-L392 CarbonylContact O-C 3.54Å; L213-L392 VanDerWaalsContact O-CA 3.32Å; L213-L392 WeakPolarHBondContact O-CA 3.35Å; L213-C393 HydrophobicContact CB-CB 4.43Å; L213-C393 PolarHBondContact N-O 3.04Å; L213-C393 PolarHBondContact O-N 2.9Å; L213-Y395 HydrophobicContact CD1-CD2 4.17Å; L213-Y395 HydrophobicContact CD1-CE2 3.95Å; L213-Y395 HydrophobicContact CG-CD2 4.36Å; L213-Y395 HydrophobicContact CG-CE2 4.49Å
214	Q	94.2	Very high	83	Confident	24 Å²	24	55.6 Å²	55.6	11%	0.112	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.7	169.6	-173.6	178.4	14.4	0	0	109.8	E153 F170 Q171 L172 I173 Y391 L392	E153-Q214 PolarHBondContact OE1-NE2 2.91Å; F170-Q214 HydrophobicContact CE1-CB 4.09Å; F170-Q214 HydrophobicContact CZ-CB 3.8Å; F170-Q214 HydrophobicContact CZ-CG 4.43Å; Q171-Q214 PolarHBondContact O-N 3.44Å; L172-Q214 HydrophobicContact CD1-CB 3.99Å; L172-Q214 HydrophobicContact CD1-CG 3.89Å; I173-Q214 WeakPolarHBondContact CB-O 3.45Å; I173-Q214 PolarHBondContact N-O 2.86Å; I173-Q214 VanDerWaalsContact N-O 3.08Å; Q214-Y391 HydrophobicContact CG-CE2 4.33Å; Q214-Y391 PolarHBondContact NE2-OH 3.11Å; Q214-L392 HydrophobicContact CB-CD2 3.65Å; Q214-L392 HydrophobicContact CG-CD2 3.77Å
215	I	91.8	Very high	82.9	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.021	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-78.3	133.9	177.6	-55	-48.5	0	0	0	108.9	I173 V189 L192 R217 V227 C390 Y391	I173-I215 HydrophobicContact CD1-CD1 3.79Å; V189-I215 HydrophobicContact CG1-CD1 4.4Å; V189-I215 HydrophobicContact CG2-CD1 3.88Å; L192-I215 HydrophobicContact CD1-CG2 4.42Å; I215-R217 PolarHBondContact O-N 3.24Å; I215-V227 HydrophobicContact CD1-CG1 4.31Å; I215-V227 HydrophobicContact CG1-CG1 4.48Å; I215-V227 HydrophobicContact CG2-CB 4.18Å; I215-V227 HydrophobicContact CG2-CG1 4.03Å; I215-V227 HydrophobicContact CG2-CG2 3.8Å; I215-C390 HydrophobicContact CG1-CB 4.47Å; I215-Y391 PolarHBondContact N-O 2.83Å
216	P	81	Confident	83.1	Confident	16 Å²	16	55.5 Å²	55.5	10%	0.104	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-68.9	134.6	-172	27.5	-34.7	0	0	0	111.9	I173 L223 F224	I173-P216 HydrophobicContact CG2-CG 4.2Å; I173-P216 WeakPolarHBondContact O-CB 3.45Å; P216-L223 HydrophobicContact CB-CD1 3.84Å; P216-L223 HydrophobicContact CG-CD1 3.97Å; P216-F224 HydrophobicContact CG-CE2 4.38Å
217	R	75.9	Confident	83.5	Confident	57 Å²	57	47.9 Å²	47.9	22%	0.215	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	140.5	174.1	-69.1	-173.4	165.5	-136.1	3.4	110.1	I215 I310 D389	I215-R217 PolarHBondContact O-N 3.24Å; R217-I310 VanDerWaalsContact CZ-CG2 3.48Å; R217-I310 VanDerWaalsContact CZ-O 3.27Å; R217-I310 PolarHBondContact NH1-O 2.83Å; R217-I310 PolarHBondContact NH2-O 3.39Å; R217-D389 PolarHBondContact NH2-O 3.22Å; R217-D389 IonicContact NH2-OD1 2.6Å
218	Y	64.9	Low	83.9	Confident	119 Å²	119	45.8 Å²	45.8	47%	0.467	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	85.8	174	-72.5	-60.9	0	0	0	110.4	K220 E221 L223	Y218-K220 PolarHBondContact O-N 3.46Å; Y218-K220 VanDerWaalsContact O-N 3.13Å; Y218-E221 PolarHBondContact N-O 3.13Å; Y218-E221 PolarHBondContact O-N 3.47Å; Y218-L223 HydrophobicContact CD2-CD1 4.01Å; Y218-L223 HydrophobicContact CD2-CD2 3.57Å; Y218-L223 HydrophobicContact CD2-CG 3.62Å; Y218-L223 HydrophobicContact CE2-CD1 3.57Å; Y218-L223 HydrophobicContact CE2-CD2 3.35Å; Y218-L223 HydrophobicContact CE2-CG 3.58Å
219	G	64.4	Low	84.2	Confident	69 Å²	69	45.4 Å²	45.4	71%	0.711	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	-115.2	-173.4	0	0	0	0	0	110.4
220	K	61.9	Low	84.5	Confident	183 Å²	183	44.4 Å²	44.4	80%	0.796	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-11.6	175	-62.8	-168.8	177	-167.6	0	113.6	Y218	Y218-K220 PolarHBondContact O-N 3.46Å; Y218-K220 VanDerWaalsContact O-N 3.13Å
221	E	67.3	Low	84.7	Confident	151 Å²	151	44.9 Å²	44.9	71%	0.706	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.7	-177.3	-66.9	-172.7	177.2	0	0	110.5	Y218	Y218-E221 PolarHBondContact N-O 3.13Å; Y218-E221 PolarHBondContact O-N 3.47Å
222	K	73.2	Confident	84.7	Confident	87 Å²	87	50.2 Å²	50.2	38%	0.378	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	134.6	175.4	-57.9	174.7	-177.9	-179.5	0	108.7	F224 S388 D389	K222-F224 WeakPolarHBondContact CB-O 3.3Å; K222-S388 VanDerWaalsContact CD-O 3.31Å; K222-S388 WeakPolarHBondContact CD-O 3.37Å; K222-S388 WeakPolarHBondContact CE-O 3.27Å; K222-S388 PolarHBondContact NZ-O 3.38Å; K222-D389 WeakPolarHBondContact CE-OD1 3.49Å; K222-D389 IonicContact NZ-OD1 2.62Å; K222-D389 PolarHBondContact NZ-OD1 2.76Å
223	L	79.7	Confident	84.7	Confident	45 Å²	45	50.2 Å²	50.2	24%	0.236	24%	0.244	C	C	.	.	S	Bend	trans	-69.5	-39.9	174.6	-86.1	172.2	0	0	0	112.4	P216 Y218	P216-L223 HydrophobicContact CB-CD1 3.84Å; P216-L223 HydrophobicContact CG-CD1 3.97Å; Y218-L223 HydrophobicContact CD2-CD1 4.01Å; Y218-L223 HydrophobicContact CD2-CD2 3.57Å; Y218-L223 HydrophobicContact CD2-CG 3.62Å; Y218-L223 HydrophobicContact CE2-CD1 3.57Å; Y218-L223 HydrophobicContact CE2-CD2 3.35Å; Y218-L223 HydrophobicContact CE2-CG 3.58Å
224	F	87.5	Confident	84.6	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.039	26%	0.255	C	S	.	.	S	Bend	trans	-114.4	150.3	-177.9	-54.4	-78.2	0	0	0	108.9	I181 Q182 R184 V187 L192 P216 K222 A226 V227	I181-F224 HydrophobicContact CG2-CE1 4.14Å; I181-F224 HydrophobicContact CG2-CZ 4.19Å; Q182-F224 HydrophobicContact CG-CZ 4.28Å; R184-F224 WeakPolarHBondContact O-CD1 3.43Å; V187-F224 HydrophobicContact CB-CD1 4.27Å; V187-F224 HydrophobicContact CB-CE1 4.42Å; V187-F224 HydrophobicContact CG1-CD1 3.59Å; V187-F224 HydrophobicContact CG1-CE1 3.58Å; V187-F224 HydrophobicContact CG1-CG 4.39Å; V187-F224 HydrophobicContact CG1-CZ 4.39Å; V187-F224 HydrophobicContact CG2-CB 4.1Å; V187-F224 HydrophobicContact CG2-CD1 3.62Å; V187-F224 HydrophobicContact CG2-CD2 3.85Å; V187-F224 HydrophobicContact CG2-CE1 3.98Å; V187-F224 HydrophobicContact CG2-CE2 4.21Å; V187-F224 HydrophobicContact CG2-CG 3.55Å; V187-F224 HydrophobicContact CG2-CZ 4.27Å; L192-F224 HydrophobicContact CD1-CE2 4.45Å; L192-F224 HydrophobicContact CD2-CD2 4.44Å; L192-F224 HydrophobicContact CD2-CE2 3.58Å; L192-F224 HydrophobicContact CD2-CZ 3.64Å; P216-F224 HydrophobicContact CG-CE2 4.38Å; K222-F224 WeakPolarHBondContact CB-O 3.3Å; F224-A226 VanDerWaalsContact C-N 3.33Å; F224-V227 HydrophobicContact CB-CG2 3.94Å; F224-V227 HydrophobicContact CD2-CG2 3.97Å; F224-V227 HydrophobicContact CG-CG2 4.24Å
225	R	87.4	Confident	84.5	Confident	107 Å²	107	51.1 Å²	51.1	40%	0.404	25%	0.249	S	C	.	.	S	Bend	trans	-64.9	-44.9	170	176.7	179.5	172.8	61.1	42.2	110	S185 L372	S185-R225 WeakPolarHBondContact O-CA 2.95Å; S185-R225 VanDerWaalsContact O-CB 3.31Å; S185-R225 WeakPolarHBondContact O-CB 3.43Å; S185-R225 PolarHBondContact O-N 2.85Å; R225-L372 WeakPolarHBondContact CD-O 3.37Å; R225-L372 PolarHBondContact NE-O 3.29Å
226	A	92.1	Very high	84.4	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	138.4	178.7	0	0	0	0	0	111.3	S185 V186 V187 F224 L372 V387	S185-A226 PolarHBondContact O-N 3.21Å; V186-A226 WeakPolarHBondContact CA-O 3.41Å; V186-A226 HydrophobicContact CG1-CB 4.31Å; V186-A226 HydrophobicContact CG2-CB 4.3Å; V187-A226 PolarHBondContact N-O 3.4Å; V187-A226 VanDerWaalsContact N-O 3.08Å; F224-A226 VanDerWaalsContact C-N 3.33Å; A226-L372 HydrophobicContact CB-CD1 4.02Å; A226-L372 HydrophobicContact CB-CD2 3.97Å; A226-L372 HydrophobicContact CB-CG 4.44Å; A226-V387 CarbonylContact C-O 3.59Å; A226-V387 WeakPolarHBondContact CA-O 3.47Å; A226-V387 HydrophobicContact CB-CB 4.18Å; A226-V387 HydrophobicContact CB-CG2 4.01Å
227	V	94	Very high	84.8	Confident	9 Å²	9	50.6 Å²	50.6	6%	0.055	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	108.4	170.5	-179.2	0	0	0	0	107.4	V187 V189 L192 I215 F224 P229 V387 C390	V187-V227 HydrophobicContact CG2-CB 4.45Å; V187-V227 HydrophobicContact CG2-CG1 4.45Å; V187-V227 HydrophobicContact CG2-CG2 3.88Å; V187-V227 CarbonylContact O-C 3.59Å; V187-V227 WeakPolarHBondContact O-CA 3.37Å; V189-V227 HydrophobicContact CG2-CG1 3.78Å; L192-V227 HydrophobicContact CD1-CG1 3.62Å; L192-V227 HydrophobicContact CD1-CG2 4.15Å; I215-V227 HydrophobicContact CD1-CG1 4.31Å; I215-V227 HydrophobicContact CG1-CG1 4.48Å; I215-V227 HydrophobicContact CG2-CB 4.18Å; I215-V227 HydrophobicContact CG2-CG1 4.03Å; I215-V227 HydrophobicContact CG2-CG2 3.8Å; F224-V227 HydrophobicContact CB-CG2 3.94Å; F224-V227 HydrophobicContact CD2-CG2 3.97Å; F224-V227 HydrophobicContact CG-CG2 4.24Å; V227-P229 VanDerWaalsContact O-CD 3.27Å; V227-P229 WeakPolarHBondContact O-CD 3.31Å; V227-V387 PolarHBondContact N-O 3.45Å; V227-V387 WeakPolarHBondContact O-CA 3.35Å; V227-C390 HydrophobicContact CB-CB 4.4Å
228	I	95	Very high	85.4	Confident	9 Å²	9	48 Å²	48	5%	0.046	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	116.7	-179.3	-57.5	170.2	0	0	0	108.6	V186 V187 T188 V189 S230 F360 Y365 L368 V369 L372 V387	V186-I228 HydrophobicContact CG1-CD1 3.63Å; V186-I228 HydrophobicContact CG1-CG1 4.03Å; V187-I228 PolarHBondContact O-N 3.29Å; T188-I228 WeakPolarHBondContact CA-O 3.4Å; T188-I228 HydrophobicContact CG2-CB 4.34Å; V189-I228 PolarHBondContact N-O 3.41Å; I228-S230 PolarHBondContact O-N 3.2Å; I228-F360 HydrophobicContact CG2-CE1 4.46Å; I228-Y365 HydrophobicContact CD1-CE2 3.94Å; I228-L368 HydrophobicContact CD1-CD2 3.92Å; I228-L368 HydrophobicContact CD1-CG 4.26Å; I228-L368 HydrophobicContact CG1-CD2 4.41Å; I228-L368 HydrophobicContact CG2-CD2 4.31Å; I228-V369 HydrophobicContact CD1-CG2 4.16Å; I228-L372 HydrophobicContact CD1-CD1 3.89Å; I228-L372 HydrophobicContact CG1-CD1 3.95Å; I228-V387 HydrophobicContact CG1-CG1 4.47Å
229	P	95.3	Very high	86.5	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.013	22%	0.217	C	C	.	.			trans	-59.8	129.9	173.4	-21.8	34.3	0	0	0	110.5	V227 L231 L304 V307 F360 L386	V227-P229 VanDerWaalsContact O-CD 3.27Å; V227-P229 WeakPolarHBondContact O-CD 3.31Å; P229-L231 PolarHBondContact O-N 3.32Å; P229-L304 HydrophobicContact CB-CD2 3.58Å; P229-V307 HydrophobicContact CB-CG2 4.05Å; P229-V307 HydrophobicContact CG-CG1 4.49Å; P229-V307 HydrophobicContact CG-CG2 4.04Å; P229-F360 HydrophobicContact CB-CE1 4.45Å; P229-F360 WeakPolarHBondContact O-CE1 3.35Å; P229-L386 HydrophobicContact CG-CD1 4.2Å; P229-L386 HydrophobicContact CG-CD2 4.39Å; P229-L386 HydrophobicContact CG-CG 4.1Å
230	S	94.6	Very high	87.4	Confident	15 Å²	15	43.4 Å²	43.4	11%	0.105	20%	0.204	C	C	.	.			trans	-81.4	113.9	175.3	-57.7	0	0	0	0	108.2	Q190 I228 Q232 Y395	Q190-S230 WeakPolarHBondContact CB-OG 3.49Å; Q190-S230 PolarHBondContact N-OG 3.02Å; I228-S230 PolarHBondContact O-N 3.2Å; S230-Q232 WeakPolarHBondContact CB-O 3.22Å; S230-Q232 PolarHBondContact O-N 3.05Å; S230-Y395 PolarHBondContact N-OH 2.64Å; S230-Y395 WeakPolarHBondContact O-CE1 3.12Å; S230-Y395 PolarHBondContact O-OH 2.87Å
231	L	93.8	Very high	88.1	Confident	33 Å²	33	40.4 Å²	40.4	17%	0.173	20%	0.196	C	C	.	.	S	Bend	trans	-56.8	-36.9	178.4	-71.5	-168.2	0	0	0	112.3	P229 L304 W329 F360	P229-L231 PolarHBondContact O-N 3.32Å; L231-L304 HydrophobicContact CD2-CD2 4.18Å; L231-L304 PolarHBondContact O-N 3.27Å; L231-W329 HydrophobicContact CD2-CH2 4.43Å; L231-W329 HydrophobicContact CD2-CZ2 3.52Å; L231-F360 HydrophobicContact CD1-CB 3.56Å; L231-F360 HydrophobicContact CD1-CD1 4.38Å; L231-F360 HydrophobicContact CD1-CD2 4.36Å; L231-F360 HydrophobicContact CD1-CG 3.9Å; L231-F360 HydrophobicContact CD2-CD1 4.03Å; L231-F360 HydrophobicContact CD2-CD2 3.96Å; L231-F360 HydrophobicContact CD2-CE1 4.14Å; L231-F360 HydrophobicContact CD2-CE2 4.06Å; L231-F360 HydrophobicContact CD2-CG 3.94Å; L231-F360 HydrophobicContact CD2-CZ 4.13Å; L231-F360 HydrophobicContact CG-CB 4.01Å; L231-F360 HydrophobicContact CG-CD1 3.87Å; L231-F360 HydrophobicContact CG-CD2 4.36Å; L231-F360 HydrophobicContact CG-CE1 4.38Å; L231-F360 HydrophobicContact CG-CG 3.85Å
232	Q	94	Very high	88.6	Confident	115 Å²	115	34.6 Å²	34.6	54%	0.537	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.8	172.1	-66.3	-167	-16.6	0	0	108.2	S230 V301 L302	S230-Q232 WeakPolarHBondContact CB-O 3.22Å; S230-Q232 PolarHBondContact O-N 3.05Å; Q232-V301 HydrophobicContact CB-CG1 3.63Å; Q232-V301 HydrophobicContact CG-CG1 4.12Å; Q232-L302 WeakPolarHBondContact CA-O 3.18Å
233	L	95.2	Very high	89	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110.3	-178.8	-171.7	79.7	0	0	0	108.5	V189 Q190 L193 L211 L213 V235 V301 L302 Y395	V189-L233 HydrophobicContact CG1-CD1 4.12Å; Q190-L233 HydrophobicContact CB-CD1 4.31Å; L193-L233 HydrophobicContact CD2-CD1 3.99Å; L193-L233 HydrophobicContact CD2-CD2 3.89Å; L193-L233 HydrophobicContact CD2-CG 3.98Å; L211-L233 HydrophobicContact CD2-CD2 3.86Å; L213-L233 HydrophobicContact CD1-CD2 3.79Å; L233-V235 HydrophobicContact CD2-CG1 4.17Å; L233-V235 HydrophobicContact CG-CG1 4.33Å; L233-V235 PolarHBondContact O-N 3.27Å; L233-V301 WeakPolarHBondContact O-CA 3.19Å; L233-L302 HydrophobicContact CB-CB 4.34Å; L233-L302 HydrophobicContact CD2-CD1 4.37Å; L233-L302 PolarHBondContact N-O 2.85Å; L233-L302 PolarHBondContact O-N 3.33Å; L233-Y395 HydrophobicContact CB-CD1 3.81Å; L233-Y395 HydrophobicContact CB-CE1 3.53Å; L233-Y395 HydrophobicContact CD2-CD1 4.09Å; L233-Y395 HydrophobicContact CD2-CD2 3.91Å; L233-Y395 HydrophobicContact CD2-CE1 4.13Å; L233-Y395 HydrophobicContact CD2-CE2 3.92Å; L233-Y395 HydrophobicContact CD2-CG 3.98Å; L233-Y395 HydrophobicContact CG-CE1 4.34Å
234	D	93.6	Very high	89.2	Confident	42 Å²	42	30.5 Å²	30.5	23%	0.225	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	106.8	178.7	-177.6	6.1	0	0	0	109.1	Q190 S236	Q190-D234 PolarHBondContact NE2-O 3.1Å; D234-S236 WeakPolarHBondContact OD1-CB 3.43Å; D234-S236 PolarHBondContact OD1-N 3.32Å; D234-S236 PolarHBondContact OD1-OG 3.47Å
235	V	93.1	Very high	89.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.			trans	-95	-1.5	178.4	-61.5	0	0	0	0	112.3	L193 L211 L233 P237 I238 L239 I300 L302	L193-V235 HydrophobicContact CD2-CG1 4.21Å; L211-V235 HydrophobicContact CD2-CG1 4.46Å; L233-V235 HydrophobicContact CD2-CG1 4.17Å; L233-V235 HydrophobicContact CG-CG1 4.33Å; L233-V235 PolarHBondContact O-N 3.27Å; V235-P237 VanDerWaalsContact C-CD 3.45Å; V235-P237 VanDerWaalsContact C-N 3.35Å; V235-I238 HydrophobicContact CB-CD1 4.24Å; V235-I238 HydrophobicContact CB-CG1 4.06Å; V235-I238 HydrophobicContact CG1-CD1 4.33Å; V235-I238 WeakPolarHBondContact O-CG1 3.29Å; V235-I238 PolarHBondContact O-N 3.19Å; V235-I238 VanDerWaalsContact O-N 3.09Å; V235-L239 HydrophobicContact CG2-CD1 4.18Å; V235-L239 WeakPolarHBondContact O-CG 3.41Å; V235-L239 PolarHBondContact O-N 3.25Å; V235-I300 HydrophobicContact CG2-CB 4.06Å; V235-I300 HydrophobicContact CG2-CG2 3.63Å; V235-I300 WeakPolarHBondContact CG2-O 3.31Å; V235-I300 PolarHBondContact N-O 3.26Å; V235-L302 HydrophobicContact CG1-CD1 3.76Å; V235-L302 HydrophobicContact CG1-CG 4.02Å; V235-L302 HydrophobicContact CG2-CD1 4.46Å; V235-L302 HydrophobicContact CG2-CD2 4.38Å; V235-L302 HydrophobicContact CG2-CG 4.15Å
236	S	88.8	Confident	89.2	Confident	7 Å²	7	27.3 Å²	27.3	5%	0.049	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-49.3	-51.1	-179.8	-41.1	0	0	0	0	111.9	D234 I238 L239 H244 P299 I300	D234-S236 WeakPolarHBondContact OD1-CB 3.43Å; D234-S236 PolarHBondContact OD1-N 3.32Å; D234-S236 PolarHBondContact OD1-OG 3.47Å; S236-I238 PolarHBondContact O-N 3.34Å; S236-L239 PolarHBondContact O-N 3.02Å; S236-L239 VanDerWaalsContact O-N 3.16Å; S236-H244 VanDerWaalsContact C-CE1 3.5Å; S236-H244 PolarHBondContact O-CE1 3.29Å; S236-P299 WeakPolarHBondContact OG-CA 3.38Å; S236-I300 PolarHBondContact OG-N 3.35Å
237	P	88.5	Confident	89	Confident	3 Å²	3	31 Å²	31	2%	0.019	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-62.7	-17	-175.4	-24.8	38.1	0	0	0	115.3	V235 L268 F272	V235-P237 VanDerWaalsContact C-CD 3.45Å; V235-P237 VanDerWaalsContact C-N 3.35Å; P237-L268 HydrophobicContact CB-CB 4Å; P237-L268 HydrophobicContact CB-CD2 3.89Å; P237-L268 HydrophobicContact CB-CG 3.85Å; P237-F272 HydrophobicContact CB-CE2 4.14Å
238	I	90.2	Very high	88.8	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-109.8	8.8	-176.4	64.4	163.8	0	0	0	112.5	L193 F197 L203 L204 V235 S236 L268	L193-I238 HydrophobicContact CD1-CD1 4.07Å; L193-I238 HydrophobicContact CD2-CD1 3.74Å; L193-I238 HydrophobicContact CG-CD1 3.91Å; F197-I238 HydrophobicContact CB-CB 4.23Å; F197-I238 HydrophobicContact CB-CG2 3.61Å; F197-I238 HydrophobicContact CD1-CB 3.72Å; F197-I238 HydrophobicContact CD1-CD1 4.08Å; F197-I238 HydrophobicContact CD1-CG1 4.45Å; F197-I238 HydrophobicContact CD1-CG2 4.08Å; F197-I238 HydrophobicContact CD2-CD1 4.01Å; F197-I238 HydrophobicContact CD2-CG2 4.48Å; F197-I238 HydrophobicContact CE1-CB 4.31Å; F197-I238 HydrophobicContact CE1-CD1 4.03Å; F197-I238 HydrophobicContact CE2-CD1 3.93Å; F197-I238 HydrophobicContact CG-CB 3.95Å; F197-I238 HydrophobicContact CG-CD1 4.09Å; F197-I238 HydrophobicContact CG-CG2 3.79Å; F197-I238 HydrophobicContact CZ-CD1 3.96Å; L203-I238 CarbonylContact C-O 3.55Å; L203-I238 WeakPolarHBondContact CA-O 3.5Å; L204-I238 HydrophobicContact CD1-CD1 3.82Å; L204-I238 HydrophobicContact CD1-CG1 4.23Å; L204-I238 HydrophobicContact CG-CD1 4.29Å; L204-I238 PolarHBondContact N-O 3.34Å; V235-I238 HydrophobicContact CB-CD1 4.24Å; V235-I238 HydrophobicContact CB-CG1 4.06Å; V235-I238 HydrophobicContact CG1-CD1 4.33Å; V235-I238 WeakPolarHBondContact O-CG1 3.29Å; V235-I238 PolarHBondContact O-N 3.19Å; V235-I238 VanDerWaalsContact O-N 3.09Å; S236-I238 PolarHBondContact O-N 3.34Å; I238-L268 HydrophobicContact CG2-CD2 3.94Å
239	L	87.6	Confident	88.7	Confident	8 Å²	8	38.3 Å²	38.3	4%	0.042	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-92.8	134.7	176.3	-72.4	166.5	0	0	0	111.3	L204 K206 I207 V235 S236 H242 I300	L204-L239 HydrophobicContact CB-CD2 3.78Å; L204-L239 HydrophobicContact CD1-CD2 4.37Å; K206-L239 WeakPolarHBondContact O-CD2 3.48Å; I207-L239 HydrophobicContact CG1-CD1 3.86Å; I207-L239 HydrophobicContact CG1-CD2 4.08Å; V235-L239 HydrophobicContact CG2-CD1 4.18Å; V235-L239 WeakPolarHBondContact O-CG 3.41Å; V235-L239 PolarHBondContact O-N 3.25Å; S236-L239 PolarHBondContact O-N 3.02Å; S236-L239 VanDerWaalsContact O-N 3.16Å; L239-H242 HydrophobicContact CB-CB 3.51Å; L239-H242 HydrophobicContact CD1-CB 4.37Å; L239-I300 HydrophobicContact CD1-CB 3.95Å; L239-I300 HydrophobicContact CD1-CG1 3.85Å; L239-I300 HydrophobicContact CD1-CG2 4.24Å
240	L	83.4	Confident	88.4	Confident	82 Å²	82	44.2 Å²	44.2	43%	0.429	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	135.2	173.8	-175.2	68	0	0	0	110	L203 L204 H242	L203-L240 HydrophobicContact CB-CB 4.11Å; L203-L240 HydrophobicContact CD1-CD1 4Å; L204-L240 WeakPolarHBondContact O-CB 3.1Å; L204-L240 PolarHBondContact O-N 3.4Å; L240-H242 PolarHBondContact O-N 3.37Å; L240-H242 VanDerWaalsContact O-N 3.09Å
241	N	75.3	Confident	88.1	Confident	121 Å²	121	50.8 Å²	50.8	65%	0.647	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	19.5	179.7	-54.5	-36.2	0	0	0	114.1
242	H	79	Confident	87.7	Confident	28 Å²	28	51.1 Å²	51.1	13%	0.13	25%	0.248	C	C	.	.			trans	-81	134.7	172.9	-170.9	74	0	0	0	109.7	L239 L240 H244 I300	L239-H242 HydrophobicContact CB-CB 3.51Å; L239-H242 HydrophobicContact CD1-CB 4.37Å; L240-H242 PolarHBondContact O-N 3.37Å; L240-H242 VanDerWaalsContact O-N 3.09Å; H242-H244 PolarHBondContact O-CD2 2.9Å; H242-H244 PolarHBondContact O-NE2 3.43Å; H242-I300 VanDerWaalsContact CE1-CG1 3.49Å; H242-I300 WeakPolarHBondContact CE1-CG1 3.48Å
243	P	80.7	Confident	87.3	Confident	17 Å²	17	45.8 Å²	45.8	11%	0.11	22%	0.224	C	C	.	.			trans	-71.1	145.3	178	29.8	-38.6	0	0	0	112.7	V294 L295 T297	P243-V294 VanDerWaalsContact CA-O 3.3Å; P243-V294 WeakPolarHBondContact CA-O 3.3Å; P243-V294 VanDerWaalsContact CB-C 3.47Å; P243-V294 HydrophobicContact CB-CB 4.17Å; P243-V294 HydrophobicContact CB-CG1 4.41Å; P243-V294 WeakPolarHBondContact CB-O 3.32Å; P243-L295 WeakPolarHBondContact CB-O 3.47Å; P243-L295 WeakPolarHBondContact CG-O 3.31Å; P243-T297 HydrophobicContact CG-CG2 4.34Å; P243-T297 WeakPolarHBondContact CG-OG1 3.24Å
244	H	84.7	Confident	86.7	Confident	29 Å²	29	48.4 Å²	48.4	13%	0.134	24%	0.236	C	C	.	.			trans	-124.8	149.8	-179.8	-67.4	-73.2	0	0	0	112.5	S236 H242 A253 F272	S236-H244 VanDerWaalsContact C-CE1 3.5Å; S236-H244 PolarHBondContact O-CE1 3.29Å; H242-H244 PolarHBondContact O-CD2 2.9Å; H242-H244 PolarHBondContact O-NE2 3.43Å; H244-A253 HydrophobicContact CB-CB 4.02Å; H244-A253 VanDerWaalsContact O-CB 3.28Å; H244-A253 WeakPolarHBondContact O-CB 3.37Å; H244-A253 PolarHBondContact O-N 2.88Å; H244-F272 HydrophobicContact CB-CB 3.87Å; H244-F272 HydrophobicContact CB-CD1 3.57Å; H244-F272 HydrophobicContact CB-CD2 4.13Å; H244-F272 HydrophobicContact CB-CE1 4.1Å; H244-F272 HydrophobicContact CB-CG 3.58Å; H244-F272 AromaticContact CD2-CD1 3.61Å; H244-F272 AromaticContact CD2-CE1 3.17Å; H244-F272 WeakPolarHBondContact CD2-CE1 3.15Å; H244-F272 AromaticContact CD2-CZ 3.42Å; H244-F272 VanDerWaalsContact CD2-CZ 3.42Å; H244-F272 WeakPolarHBondContact CD2-CZ 3.39Å; H244-F272 AromaticContact CE1-CE2 3.75Å; H244-F272 AromaticContact CE1-CZ 3.6Å; H244-F272 AromaticContact CG-CD1 3.53Å; H244-F272 AromaticContact CG-CD2 3.86Å; H244-F272 AromaticContact CG-CE1 3.53Å; H244-F272 AromaticContact CG-CE2 3.86Å; H244-F272 AromaticContact CG-CG 3.69Å; H244-F272 AromaticContact CG-CZ 3.68Å; H244-F272 AromaticContact ND1-CD2 3.85Å; H244-F272 AromaticContact ND1-CE2 3.66Å; H244-F272 AromaticContact ND1-CZ 3.79Å; H244-F272 AromaticContact NE2-CE1 3.62Å; H244-F272 AromaticContact NE2-CE2 3.99Å; H244-F272 AromaticContact NE2-CZ 3.36Å; H244-F272 WeakPolarHBondContact NE2-CZ 3.5Å
245	S	86.4	Confident	86.3	Confident	49 Å²	49	47.5 Å²	47.5	34%	0.343	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-92.4	139.3	170.2	-64.5	0	0	0	0	109.8	W247 R251	S245-W247 PolarHBondContact O-N 2.73Å; S245-R251 CarbonylContact C-O 3.54Å
246	C	88.8	Confident	85.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.			trans	-58.9	115.7	169.7	174.4	0	0	0	0	108.8	R248 C249 N250 R251 F272 C274	C246-R248 PolarHBondContact O-N 2.7Å; C246-C249 PolarHBondContact O-N 2.91Å; C246-N250 VanDerWaalsContact O-CA 3.25Å; C246-N250 WeakPolarHBondContact O-CA 3.12Å; C246-N250 PolarHBondContact O-N 3.03Å; C246-R251 WeakPolarHBondContact CB-O 3.45Å; C246-R251 PolarHBondContact N-O 3.06Å; C246-F272 CarbonylContact C-O 3.54Å; C246-F272 VanDerWaalsContact CA-O 3.31Å; C246-F272 WeakPolarHBondContact CA-O 3.41Å; C246-C274 HydrophobicContact CB-CB 3.92Å; C246-C274 VanDerWaalsContact CB-N 3.33Å; C246-C274 PolarHBondContact SG-N 3.4Å
247	W	87.3	Confident	85.7	Confident	80 Å²	80	49.3 Å²	49.3	30%	0.303	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.8	-174.7	78.2	-89.6	0	0	0	113.4	S245 D270 F272 F273 F281	S245-W247 PolarHBondContact O-N 2.73Å; W247-D270 HydrophobicContact CB-CB 4.43Å; W247-D270 HydrophobicContact CD2-CB 4.43Å; W247-D270 HydrophobicContact CG-CB 4.35Å; W247-D270 PolarHBondContact NE1-O 2.8Å; W247-D270 VanDerWaalsContact NE1-O 3.16Å; W247-F272 VanDerWaalsContact CD1-O 3.23Å; W247-F272 PolarHBondContact N-O 3.13Å; W247-F273 AromaticContact CD1-CD1 3.93Å; W247-F273 AromaticContact CD1-CE1 3.76Å; W247-F273 AromaticContact CD1-CZ 3.87Å; W247-F273 AromaticContact CE2-CE1 3.84Å; W247-F273 HydrophobicContact CZ2-CE1 4.25Å; W247-F273 HydrophobicContact CZ2-CZ 4.48Å; W247-F273 AromaticContact NE1-CD1 3.49Å; W247-F273 AromaticContact NE1-CE1 2.89Å; W247-F273 AromaticContact NE1-CE2 3.77Å; W247-F273 AromaticContact NE1-CZ 3.05Å; W247-F281 HydrophobicContact CZ2-CD2 4.48Å; W247-F281 HydrophobicContact CZ2-CE2 4.15Å; W247-F281 HydrophobicContact CZ2-CZ 4.24Å
248	R	90.2	Very high	85.5	Confident	130 Å²	130	52.2 Å²	52.2	49%	0.491	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-37.3	-179.8	-73.5	-140.9	167.4	-156.1	-8.8	115.1	C246 C277	C246-R248 PolarHBondContact O-N 2.7Å; R248-C277 HydrophobicContact CB-CB 4.13Å
249	C	92.6	Very high	85.1	Confident	40 Å²	40	57.5 Å²	57.5	27%	0.27	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	3.7	-172.5	72.8	0	0	0	0	114.5	C246 R251 C274	C246-C249 PolarHBondContact O-N 2.91Å; C249-R251 PolarHBondContact O-N 3.02Å; C249-C274 VanDerWaalsContact SG-SG 3.7Å
250	N	88.8	Confident	85	Confident	126 Å²	126	57.4 Å²	57.4	67%	0.674	28%	0.277	S	S	*	.	S	Bend	trans	57.6	9.7	180	-59.4	-30.6	0	0	0	115.6	C246	C246-N250 VanDerWaalsContact O-CA 3.25Å; C246-N250 WeakPolarHBondContact O-CA 3.12Å; C246-N250 PolarHBondContact O-N 3.03Å
251	R	87.8	Confident	85.2	Confident	153 Å²	153	53.8 Å²	53.8	58%	0.577	26%	0.257	S	S	*	.	S	Bend	trans	-77.4	167.3	168.5	-70.6	-175.1	-95.5	-163.1	-11.3	110.5	S245 C246 C249 A253	S245-R251 CarbonylContact C-O 3.54Å; C246-R251 WeakPolarHBondContact CB-O 3.45Å; C246-R251 PolarHBondContact N-O 3.06Å; C249-R251 PolarHBondContact O-N 3.02Å; R251-A253 PolarHBondContact O-N 3.04Å
252	L	84.9	Confident	85.5	Confident	40 Å²	40	49.9 Å²	49.9	21%	0.209	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-46	122.9	174.1	-173.1	61.4	0	0	0	112.5	Q254 C274 V294 L295	L252-Q254 PolarHBondContact O-OE1 2.97Å; L252-C274 WeakPolarHBondContact O-CB 3.34Å; L252-V294 VanDerWaalsContact CD1-C 3.46Å; L252-V294 WeakPolarHBondContact CD1-O 3.34Å; L252-L295 VanDerWaalsContact CD1-CA 3.47Å; L252-L295 HydrophobicContact CD2-CD2 4.4Å
253	A	86.4	Confident	85.7	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.033	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-75.9	137.8	169.2	0	0	0	0	0	109.6	H244 R251 F272 F273	H244-A253 HydrophobicContact CB-CB 4.02Å; H244-A253 VanDerWaalsContact O-CB 3.28Å; H244-A253 WeakPolarHBondContact O-CB 3.37Å; H244-A253 PolarHBondContact O-N 2.88Å; R251-A253 PolarHBondContact O-N 3.04Å; A253-F272 HydrophobicContact CB-CB 3.77Å; A253-F273 CarbonylContact C-O 3.53Å; A253-F273 VanDerWaalsContact CA-O 3.27Å; A253-F273 WeakPolarHBondContact CA-O 3.27Å; A253-F273 WeakPolarHBondContact CB-O 3.41Å
254	Q	83.5	Confident	85.8	Confident	54 Å²	54	60 Å²	60	25%	0.252	29%	0.287	S	S	.	.			trans	-115.1	-13.9	171.7	-63.1	97.8	-5.1	0	0	112	L252 F273 H291 V293	L252-Q254 PolarHBondContact O-OE1 2.97Å; Q254-F273 PolarHBondContact N-O 2.83Å; Q254-H291 WeakPolarHBondContact O-CB 3.24Å; Q254-V293 HydrophobicContact CB-CG2 3.98Å; Q254-V293 HydrophobicContact CG-CG1 4.05Å; Q254-V293 HydrophobicContact CG-CG2 4.33Å
255	L	84.1	Confident	85.7	Confident	24 Å²	24	59 Å²	59	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151.1	-170.3	-49	176.1	0	0	0	109.8	F272 F273 T275 F278 H291	L255-F272 CarbonylContact O-C 3.49Å; L255-F272 WeakPolarHBondContact O-CA 3.44Å; L255-F273 PolarHBondContact N-O 2.83Å; L255-F273 PolarHBondContact O-N 2.87Å; L255-T275 HydrophobicContact CD1-CG2 4.38Å; L255-F278 HydrophobicContact CB-CB 4.49Å; L255-F278 HydrophobicContact CB-CD2 3.95Å; L255-F278 HydrophobicContact CB-CG 4.34Å; L255-F278 HydrophobicContact CD1-CB 3.43Å; L255-F278 VanDerWaalsContact CD1-CB 3.43Å; L255-F278 HydrophobicContact CD1-CD1 3.79Å; L255-F278 HydrophobicContact CD1-CD2 3.89Å; L255-F278 HydrophobicContact CD1-CG 3.44Å; L255-F278 VanDerWaalsContact CD1-CG 3.44Å; L255-H291 WeakPolarHBondContact CA-CD2 3.49Å; L255-H291 WeakPolarHBondContact CB-NE2 3.18Å; L255-H291 HydrophobicContact CD2-CB 3.88Å; L255-H291 VanDerWaalsContact CD2-CE1 3.42Å; L255-H291 WeakPolarHBondContact CD2-CE1 3.4Å; L255-H291 VanDerWaalsContact CD2-CG 3.42Å; L255-H291 WeakPolarHBondContact CD2-ND1 3.28Å
256	Q	85.5	Confident	85.7	Confident	37 Å²	37	61.2 Å²	61.2	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	117.9	175.5	-172.1	-173	18.4	0	0	108.6	K258 T271 F272 H291	Q256-K258 HydrophobicContact CG-CG 4.43Å; Q256-T271 CarbonylContact C-O 3.55Å; Q256-T271 VanDerWaalsContact CA-O 3.25Å; Q256-T271 WeakPolarHBondContact CA-O 3.48Å; Q256-T271 WeakPolarHBondContact CG-OG1 3.36Å; Q256-T271 PolarHBondContact NE2-OG1 3.29Å; Q256-T271 VanDerWaalsContact NE2-OG1 3.13Å; Q256-F272 HydrophobicContact CB-CD1 3.83Å; Q256-F272 HydrophobicContact CB-CE1 3.86Å; Q256-F272 VanDerWaalsContact CD-CE1 3.45Å; Q256-F272 HydrophobicContact CG-CD1 3.85Å; Q256-F272 HydrophobicContact CG-CE1 3.67Å; Q256-F272 HydrophobicContact CG-CG 4.37Å; Q256-F272 HydrophobicContact CG-CZ 4.05Å; Q256-F272 VanDerWaalsContact NE2-CZ 3.28Å; Q256-H291 PolarHBondContact N-CD2 2.97Å; Q256-H291 PolarHBondContact N-NE2 3.31Å; Q256-H291 PolarHBondContact O-CD2 2.73Å; Q256-H291 PolarHBondContact O-NE2 3.32Å
257	C	84.9	Confident	85.8	Confident	8 Å²	8	67 Å²	67	5%	0.054	31%	0.313	C	S	.	.			trans	-99.2	92.6	175.1	-169.5	0	0	0	0	110.1	E259 C260 T271 F273 F278 H282	C257-E259 PolarHBondContact O-N 2.89Å; C257-C260 HydrophobicContact CB-CB 4.3Å; C257-C260 WeakPolarHBondContact O-CB 3.31Å; C257-C260 PolarHBondContact O-N 3.39Å; C257-C260 VanDerWaalsContact O-N 3.12Å; C257-C260 PolarHBondContact SG-SG 2.85Å; C257-T271 PolarHBondContact N-O 3.35Å; C257-T271 WeakPolarHBondContact O-CB 3.27Å; C257-F273 HydrophobicContact CB-CD2 4.39Å; C257-F273 HydrophobicContact CB-CE2 3.93Å; C257-F278 HydrophobicContact CB-CE2 3.9Å; C257-H282 PolarHBondContact SG-NE2 2.91Å
258	K	83.1	Confident	85.8	Confident	63 Å²	63	63.6 Å²	63.6	27%	0.274	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-62.1	-31.7	179.5	-78.4	-172.6	-178.3	-178.8	0	112.6	F198 N201 Q256 C260 Y261	F198-K258 HydrophobicContact CE2-CB 3.74Å; F198-K258 HydrophobicContact CE2-CD 4.44Å; F198-K258 HydrophobicContact CE2-CG 4.17Å; F198-K258 VanDerWaalsContact CE2-O 3.31Å; F198-K258 WeakPolarHBondContact CE2-O 3.2Å; F198-K258 HydrophobicContact CZ-CB 4.44Å; N201-K258 PolarHBondContact OD1-NZ 2.8Å; Q256-K258 HydrophobicContact CG-CG 4.43Å; K258-C260 PolarHBondContact O-N 2.95Å; K258-Y261 WeakPolarHBondContact O-CB 3.39Å; K258-Y261 PolarHBondContact O-N 3.05Å
259	E	82.8	Confident	85.8	Confident	115 Å²	115	58.9 Å²	58.9	54%	0.537	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-63.2	-20.5	176.2	-64.6	-179.4	-174.5	0	0	113.7	C257 Y261 V263 Q289	C257-E259 PolarHBondContact O-N 2.89Å; E259-Y261 VanDerWaalsContact C-N 3.3Å; E259-V263 WeakPolarHBondContact O-CB 3.43Å; E259-V263 WeakPolarHBondContact O-CG2 3.43Å; E259-Q289 PolarHBondContact OE1-NE2 2.82Å
260	C	84	Confident	85.6	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.041	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-73.2	-24.2	174.8	-74.7	0	0	0	0	113.1	C257 K258 L262 V263 K264 T265 H282	C257-C260 HydrophobicContact CB-CB 4.3Å; C257-C260 WeakPolarHBondContact O-CB 3.31Å; C257-C260 PolarHBondContact O-N 3.39Å; C257-C260 VanDerWaalsContact O-N 3.12Å; C257-C260 PolarHBondContact SG-SG 2.85Å; K258-C260 PolarHBondContact O-N 2.95Å; C260-L262 PolarHBondContact O-N 3.17Å; C260-V263 PolarHBondContact O-N 3.38Å; C260-K264 HydrophobicContact CB-CB 4.2Å; C260-K264 PolarHBondContact O-N 2.94Å; C260-T265 HydrophobicContact CB-CG2 4.36Å; C260-T265 PolarHBondContact O-N 3.24Å; C260-T265 PolarHBondContact O-OG1 2.9Å; C260-H282 PolarHBondContact SG-NE2 3.49Å
261	Y	87.6	Confident	85.6	Confident	6 Å²	6	53.2 Å²	53.2	2%	0.024	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-63.8	127.9	-177.6	-174.9	-127.6	0	0	0	110.9	E194 K195 F198 K258 E259 V263 L268	E194-Y261 VanDerWaalsContact CB-OH 3.28Å; E194-Y261 WeakPolarHBondContact CB-OH 3.32Å; E194-Y261 PolarHBondContact OE2-OH 2.9Å; K195-Y261 HydrophobicContact CD-CE1 4.2Å; K195-Y261 PolarHBondContact N-OH 3.26Å; F198-Y261 HydrophobicContact CB-CD1 4.15Å; F198-Y261 HydrophobicContact CB-CE1 4.03Å; F198-Y261 HydrophobicContact CD1-CD1 4.01Å; F198-Y261 HydrophobicContact CD1-CE1 4.41Å; F198-Y261 AromaticContact CD2-CD1 3.56Å; F198-Y261 HydrophobicContact CD2-CD1 3.56Å; F198-Y261 HydrophobicContact CD2-CE1 4.29Å; F198-Y261 HydrophobicContact CD2-CG 4.29Å; F198-Y261 HydrophobicContact CE1-CD1 4.29Å; F198-Y261 AromaticContact CE2-CD1 3.85Å; F198-Y261 HydrophobicContact CE2-CD1 3.85Å; F198-Y261 HydrophobicContact CE2-CG 4.33Å; F198-Y261 AromaticContact CG-CD1 3.64Å; F198-Y261 HydrophobicContact CG-CD1 3.64Å; F198-Y261 AromaticContact CG-CE1 4Å; F198-Y261 HydrophobicContact CG-CE1 4Å; F198-Y261 HydrophobicContact CZ-CD1 4.21Å; K258-Y261 WeakPolarHBondContact O-CB 3.39Å; K258-Y261 PolarHBondContact O-N 3.05Å; E259-Y261 VanDerWaalsContact C-N 3.3Å; Y261-V263 PolarHBondContact O-N 2.77Å; Y261-L268 HydrophobicContact CD1-CD1 4.42Å; Y261-L268 HydrophobicContact CD2-CB 4.27Å; Y261-L268 HydrophobicContact CD2-CD1 4.34Å; Y261-L268 HydrophobicContact CE2-CB 4.1Å; Y261-L268 HydrophobicContact CG-CD1 4.16Å
262	L	83.5	Confident	85.6	Confident	39 Å²	39	46.6 Å²	46.6	20%	0.204	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	0.4	-177	-54.1	176.4	0	0	0	115.8	I181 K195 C260 T265	I181-L262 HydrophobicContact CD1-CD1 3.76Å; I181-L262 HydrophobicContact CD1-CD2 4.24Å; I181-L262 HydrophobicContact CG1-CD1 4.11Å; I181-L262 HydrophobicContact CG1-CD2 4.42Å; K195-L262 HydrophobicContact CD-CD1 3.83Å; C260-L262 PolarHBondContact O-N 3.17Å; L262-T265 WeakPolarHBondContact CA-O 3.21Å; L262-T265 PolarHBondContact N-O 2.83Å
263	V	82.8	Confident	85.7	Confident	109 Å²	109	44.7 Å²	44.7	66%	0.661	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-47.9	174.4	-178.8	0	0	0	0	110.9	E259 C260 Y261	E259-V263 WeakPolarHBondContact O-CB 3.43Å; E259-V263 WeakPolarHBondContact O-CG2 3.43Å; C260-V263 PolarHBondContact O-N 3.38Å; Y261-V263 PolarHBondContact O-N 2.77Å
264	K	82.2	Confident	85.8	Confident	148 Å²	148	45 Å²	45	64%	0.643	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-26.6	-179.6	-61.2	-59.3	-175.7	-176.5	0	112.5	C260 F281	C260-K264 HydrophobicContact CB-CB 4.2Å; C260-K264 PolarHBondContact O-N 2.94Å; K264-F281 HydrophobicContact CB-CE1 4.37Å; K264-F281 HydrophobicContact CB-CZ 4.06Å; K264-F281 HydrophobicContact CG-CZ 4.5Å
265	T	83.7	Confident	86	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.043	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-126	159.6	-180	69.1	0	0	0	0	110.7	C260 L262 K267 D270	C260-T265 HydrophobicContact CB-CG2 4.36Å; C260-T265 PolarHBondContact O-N 3.24Å; C260-T265 PolarHBondContact O-OG1 2.9Å; L262-T265 WeakPolarHBondContact CA-O 3.21Å; L262-T265 PolarHBondContact N-O 2.83Å; T265-K267 PolarHBondContact OG1-O 2.95Å; T265-D270 HydrophobicContact CG2-CB 3.84Å; T265-D270 WeakPolarHBondContact CG2-O 3.15Å
266	Q	85.6	Confident	86.3	Confident	97 Å²	97	50.1 Å²	50.1	45%	0.453	25%	0.247	S	C	.	.	S	Bend	trans	-101.9	-21.4	-179.6	-64	-60.2	-43.9	0	0	113
267	K	90.1	Very high	86.6	Confident	122 Å²	122	48.8 Å²	48.8	53%	0.53	24%	0.242	S	C	.	.	S	Bend	trans	-115.2	147.1	-179	-57.1	177.3	-179.7	177.7	0	110.4	T265 S269 D270	T265-K267 PolarHBondContact OG1-O 2.95Å; K267-S269 VanDerWaalsContact C-N 3.25Å; K267-S269 PolarHBondContact O-N 3.34Å; K267-D270 WeakPolarHBondContact O-CB 3.47Å; K267-D270 PolarHBondContact O-N 2.9Å; K267-D270 VanDerWaalsContact O-N 3.16Å
268	L	88.8	Confident	86.8	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.037	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-66.2	-32.2	175.5	-171.2	59.7	0	0	0	111.3	E194 F198 P237 I238 Y261 D270 T271	E194-L268 HydrophobicContact CB-CB 4.07Å; E194-L268 HydrophobicContact CB-CD2 4.43Å; E194-L268 HydrophobicContact CG-CB 3.87Å; E194-L268 PolarHBondContact OE2-N 3.16Å; F198-L268 HydrophobicContact CD2-CD1 4.12Å; P237-L268 HydrophobicContact CB-CB 4Å; P237-L268 HydrophobicContact CB-CD2 3.89Å; P237-L268 HydrophobicContact CB-CG 3.85Å; I238-L268 HydrophobicContact CG2-CD2 3.94Å; Y261-L268 HydrophobicContact CD1-CD1 4.42Å; Y261-L268 HydrophobicContact CD2-CB 4.27Å; Y261-L268 HydrophobicContact CD2-CD1 4.34Å; Y261-L268 HydrophobicContact CE2-CB 4.1Å; Y261-L268 HydrophobicContact CG-CD1 4.16Å; L268-D270 PolarHBondContact O-N 3.28Å; L268-T271 HydrophobicContact CD1-CG2 4.27Å; L268-T271 WeakPolarHBondContact O-CB 3.26Å; L268-T271 WeakPolarHBondContact O-CG2 3.29Å; L268-T271 PolarHBondContact O-N 2.9Å; L268-T271 VanDerWaalsContact O-N 3.09Å; L268-T271 PolarHBondContact O-OG1 2.91Å
269	S	88.4	Confident	87	Confident	32 Å²	32	50.6 Å²	50.6	22%	0.224	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-60.9	-25.5	173.4	49.9	0	0	0	0	113.8	K267 T271	K267-S269 VanDerWaalsContact C-N 3.25Å; K267-S269 PolarHBondContact O-N 3.34Å; S269-T271 PolarHBondContact O-N 3.19Å
270	D	90.4	Very high	87.4	Confident	46 Å²	46	50.4 Å²	50.4	25%	0.246	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-81.6	5.6	178	-60.4	-25	0	0	0	112.6	W247 T265 K267 L268	W247-D270 HydrophobicContact CB-CB 4.43Å; W247-D270 HydrophobicContact CD2-CB 4.43Å; W247-D270 HydrophobicContact CG-CB 4.35Å; W247-D270 PolarHBondContact NE1-O 2.8Å; W247-D270 VanDerWaalsContact NE1-O 3.16Å; T265-D270 HydrophobicContact CG2-CB 3.84Å; T265-D270 WeakPolarHBondContact CG2-O 3.15Å; K267-D270 WeakPolarHBondContact O-CB 3.47Å; K267-D270 PolarHBondContact O-N 2.9Å; K267-D270 VanDerWaalsContact O-N 3.16Å; L268-D270 PolarHBondContact O-N 3.28Å
271	T	87.5	Confident	87.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-94	-4.4	177.9	66.4	0	0	0	0	113.7	Q256 C257 L268 S269 F273	Q256-T271 CarbonylContact C-O 3.55Å; Q256-T271 VanDerWaalsContact CA-O 3.25Å; Q256-T271 WeakPolarHBondContact CA-O 3.48Å; Q256-T271 WeakPolarHBondContact CG-OG1 3.36Å; Q256-T271 PolarHBondContact NE2-OG1 3.29Å; Q256-T271 VanDerWaalsContact NE2-OG1 3.13Å; C257-T271 PolarHBondContact N-O 3.35Å; C257-T271 WeakPolarHBondContact O-CB 3.27Å; L268-T271 HydrophobicContact CD1-CG2 4.27Å; L268-T271 WeakPolarHBondContact O-CB 3.26Å; L268-T271 WeakPolarHBondContact O-CG2 3.29Å; L268-T271 PolarHBondContact O-N 2.9Å; L268-T271 VanDerWaalsContact O-N 3.09Å; L268-T271 PolarHBondContact O-OG1 2.91Å; S269-T271 PolarHBondContact O-N 3.19Å; T271-F273 WeakPolarHBondContact O-CD2 3.24Å; T271-F273 WeakPolarHBondContact O-CE2 3.34Å
272	F	88.7	Confident	87.4	Confident	15 Å²	15	52.9 Å²	52.9	7%	0.066	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.7	-177.4	-65.4	-83.1	0	0	0	111.7	P237 H244 C246 W247 A253 L255 Q256	P237-F272 HydrophobicContact CB-CE2 4.14Å; H244-F272 HydrophobicContact CB-CB 3.87Å; H244-F272 HydrophobicContact CB-CD1 3.57Å; H244-F272 HydrophobicContact CB-CD2 4.13Å; H244-F272 HydrophobicContact CB-CE1 4.1Å; H244-F272 HydrophobicContact CB-CG 3.58Å; H244-F272 AromaticContact CD2-CD1 3.61Å; H244-F272 AromaticContact CD2-CE1 3.17Å; H244-F272 WeakPolarHBondContact CD2-CE1 3.15Å; H244-F272 AromaticContact CD2-CZ 3.42Å; H244-F272 VanDerWaalsContact CD2-CZ 3.42Å; H244-F272 WeakPolarHBondContact CD2-CZ 3.39Å; H244-F272 AromaticContact CE1-CE2 3.75Å; H244-F272 AromaticContact CE1-CZ 3.6Å; H244-F272 AromaticContact CG-CD1 3.53Å; H244-F272 AromaticContact CG-CD2 3.86Å; H244-F272 AromaticContact CG-CE1 3.53Å; H244-F272 AromaticContact CG-CE2 3.86Å; H244-F272 AromaticContact CG-CG 3.69Å; H244-F272 AromaticContact CG-CZ 3.68Å; H244-F272 AromaticContact ND1-CD2 3.85Å; H244-F272 AromaticContact ND1-CE2 3.66Å; H244-F272 AromaticContact ND1-CZ 3.79Å; H244-F272 AromaticContact NE2-CE1 3.62Å; H244-F272 AromaticContact NE2-CE2 3.99Å; H244-F272 AromaticContact NE2-CZ 3.36Å; H244-F272 WeakPolarHBondContact NE2-CZ 3.5Å; C246-F272 CarbonylContact C-O 3.54Å; C246-F272 VanDerWaalsContact CA-O 3.31Å; C246-F272 WeakPolarHBondContact CA-O 3.41Å; W247-F272 VanDerWaalsContact CD1-O 3.23Å; W247-F272 PolarHBondContact N-O 3.13Å; A253-F272 HydrophobicContact CB-CB 3.77Å; L255-F272 CarbonylContact O-C 3.49Å; L255-F272 WeakPolarHBondContact O-CA 3.44Å; Q256-F272 HydrophobicContact CB-CD1 3.83Å; Q256-F272 HydrophobicContact CB-CE1 3.86Å; Q256-F272 VanDerWaalsContact CD-CE1 3.45Å; Q256-F272 HydrophobicContact CG-CD1 3.85Å; Q256-F272 HydrophobicContact CG-CE1 3.67Å; Q256-F272 HydrophobicContact CG-CG 4.37Å; Q256-F272 HydrophobicContact CG-CZ 4.05Å; Q256-F272 VanDerWaalsContact NE2-CZ 3.28Å
273	F	87.1	Confident	87.2	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.3	-174.7	-61.8	-101.6	0	0	0	111.2	W247 A253 Q254 L255 C257 T271 C277 F278 F281 H282	W247-F273 AromaticContact CD1-CD1 3.93Å; W247-F273 AromaticContact CD1-CE1 3.76Å; W247-F273 AromaticContact CD1-CZ 3.87Å; W247-F273 AromaticContact CE2-CE1 3.84Å; W247-F273 HydrophobicContact CZ2-CE1 4.25Å; W247-F273 HydrophobicContact CZ2-CZ 4.48Å; W247-F273 AromaticContact NE1-CD1 3.49Å; W247-F273 AromaticContact NE1-CE1 2.89Å; W247-F273 AromaticContact NE1-CE2 3.77Å; W247-F273 AromaticContact NE1-CZ 3.05Å; A253-F273 CarbonylContact C-O 3.53Å; A253-F273 VanDerWaalsContact CA-O 3.27Å; A253-F273 WeakPolarHBondContact CA-O 3.27Å; A253-F273 WeakPolarHBondContact CB-O 3.41Å; Q254-F273 PolarHBondContact N-O 2.83Å; L255-F273 PolarHBondContact N-O 2.83Å; L255-F273 PolarHBondContact O-N 2.87Å; C257-F273 HydrophobicContact CB-CD2 4.39Å; C257-F273 HydrophobicContact CB-CE2 3.93Å; T271-F273 WeakPolarHBondContact O-CD2 3.24Å; T271-F273 WeakPolarHBondContact O-CE2 3.34Å; F273-C277 HydrophobicContact CD1-CB 4.43Å; F273-F278 HydrophobicContact CB-CB 3.73Å; F273-F278 HydrophobicContact CB-CD2 4.22Å; F273-F278 HydrophobicContact CB-CG 4.5Å; F273-F278 HydrophobicContact CD2-CD2 4.13Å; F273-F278 HydrophobicContact CG-CB 4.2Å; F273-F278 HydrophobicContact CG-CD2 4.22Å; F273-F281 HydrophobicContact CD1-CB 4.43Å; F273-F281 HydrophobicContact CE1-CB 3.81Å; F273-F281 AromaticContact CE1-CD1 3.43Å; F273-F281 HydrophobicContact CE1-CD1 3.43Å; F273-F281 VanDerWaalsContact CE1-CD1 3.43Å; F273-F281 HydrophobicContact CE1-CE1 4.12Å; F273-F281 AromaticContact CE1-CG 3.71Å; F273-F281 HydrophobicContact CE1-CG 3.71Å; F273-F281 AromaticContact CZ-CD1 3.44Å; F273-F281 HydrophobicContact CZ-CD1 3.44Å; F273-F281 VanDerWaalsContact CZ-CD1 3.44Å; F273-F281 AromaticContact CZ-CE1 3.76Å; F273-F281 HydrophobicContact CZ-CE1 3.76Å; F273-F281 HydrophobicContact CZ-CG 4.19Å; F273-H282 AromaticContact CE2-CE1 3.87Å; F273-H282 AromaticContact CZ-CE1 3.77Å
274	C	88.5	Confident	86.7	Confident	10 Å²	10	55.9 Å²	55.9	7%	0.068	29%	0.289	C	S	.	.			trans	-79.4	156.9	157.3	75.1	0	0	0	0	110.1	C246 C249 L252 K276 C277 F278	C246-C274 HydrophobicContact CB-CB 3.92Å; C246-C274 VanDerWaalsContact CB-N 3.33Å; C246-C274 PolarHBondContact SG-N 3.4Å; C249-C274 VanDerWaalsContact SG-SG 3.7Å; L252-C274 WeakPolarHBondContact O-CB 3.34Å; C274-K276 VanDerWaalsContact C-N 3.27Å; C274-K276 PolarHBondContact O-N 2.81Å; C274-C277 PolarHBondContact O-N 2.95Å; C274-C277 VanDerWaalsContact O-N 3.09Å; C274-C277 PolarHBondContact SG-N 3.48Å; C274-F278 WeakPolarHBondContact O-CB 3.4Å; C274-F278 PolarHBondContact O-N 3.05Å
275	T	87.3	Confident	85.7	Confident	59 Å²	59	53.7 Å²	53.7	36%	0.362	28%	0.283	S	S	.	.	H	α-helix	trans	-50.5	-46	-177.1	-50.8	0	0	0	0	113.1	L255 F278 H279	L255-T275 HydrophobicContact CD1-CG2 4.38Å; T275-F278 PolarHBondContact O-N 2.85Å; T275-H279 PolarHBondContact O-CD2 2.52Å; T275-H279 PolarHBondContact O-N 2.94Å; T275-H279 VanDerWaalsContact O-N 3.14Å
276	K	90.9	Very high	84.3	Confident	127 Å²	127	59 Å²	59	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-60.4	-53	178	179.5	176.1	173.1	174.9	0	112.1	C274 F278 H279 E280	C274-K276 VanDerWaalsContact C-N 3.27Å; C274-K276 PolarHBondContact O-N 2.81Å; K276-F278 VanDerWaalsContact C-N 3.27Å; K276-F278 PolarHBondContact O-N 2.73Å; K276-H279 PolarHBondContact O-N 2.86Å; K276-E280 WeakPolarHBondContact CE-OE1 3.29Å; K276-E280 IonicContact NZ-OE1 3.62Å; K276-E280 WeakPolarHBondContact O-CG 3.43Å; K276-E280 PolarHBondContact O-N 2.97Å
277	C	91.9	Very high	82.9	Confident	9 Å²	9	58.1 Å²	58.1	6%	0.061	32%	0.319	C	S	.	.	H	α-helix	trans	-67.6	-29.3	-177.9	-69.2	0	0	0	0	112.4	R248 F273 C274 F281	R248-C277 HydrophobicContact CB-CB 4.13Å; F273-C277 HydrophobicContact CD1-CB 4.43Å; C274-C277 PolarHBondContact O-N 2.95Å; C274-C277 VanDerWaalsContact O-N 3.09Å; C274-C277 PolarHBondContact SG-N 3.48Å; C277-F281 WeakPolarHBondContact O-CB 3.35Å; C277-F281 PolarHBondContact O-N 3.17Å
278	F	88	Confident	81.3	Confident	10 Å²	10	59.3 Å²	59.3	4%	0.044	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-53	172.8	-178.4	-87	0	0	0	110.5	L255 C257 F273 C274 T275 K276 E280 F281 H282	L255-F278 HydrophobicContact CB-CB 4.49Å; L255-F278 HydrophobicContact CB-CD2 3.95Å; L255-F278 HydrophobicContact CB-CG 4.34Å; L255-F278 HydrophobicContact CD1-CB 3.43Å; L255-F278 VanDerWaalsContact CD1-CB 3.43Å; L255-F278 HydrophobicContact CD1-CD1 3.79Å; L255-F278 HydrophobicContact CD1-CD2 3.89Å; L255-F278 HydrophobicContact CD1-CG 3.44Å; L255-F278 VanDerWaalsContact CD1-CG 3.44Å; C257-F278 HydrophobicContact CB-CE2 3.9Å; F273-F278 HydrophobicContact CB-CB 3.73Å; F273-F278 HydrophobicContact CB-CD2 4.22Å; F273-F278 HydrophobicContact CB-CG 4.5Å; F273-F278 HydrophobicContact CD2-CD2 4.13Å; F273-F278 HydrophobicContact CG-CB 4.2Å; F273-F278 HydrophobicContact CG-CD2 4.22Å; C274-F278 WeakPolarHBondContact O-CB 3.4Å; C274-F278 PolarHBondContact O-N 3.05Å; T275-F278 PolarHBondContact O-N 2.85Å; K276-F278 VanDerWaalsContact C-N 3.27Å; K276-F278 PolarHBondContact O-N 2.73Å; F278-E280 PolarHBondContact O-N 2.69Å; F278-F281 PolarHBondContact O-N 3.39Å; F278-H282 AromaticContact CD1-ND1 3.83Å; F278-H282 AromaticContact CD2-CE1 3.42Å; F278-H282 VanDerWaalsContact CD2-CE1 3.42Å; F278-H282 WeakPolarHBondContact CD2-CE1 3.37Å; F278-H282 AromaticContact CD2-ND1 3.42Å; F278-H282 WeakPolarHBondContact CD2-ND1 3.11Å; F278-H282 HydrophobicContact CE1-CB 4.38Å; F278-H282 AromaticContact CE1-ND1 3.96Å; F278-H282 AromaticContact CE2-CE1 3.46Å; F278-H282 VanDerWaalsContact CE2-CE1 3.46Å; F278-H282 WeakPolarHBondContact CE2-CE1 3.28Å; F278-H282 AromaticContact CE2-ND1 3.59Å; F278-H282 AromaticContact CG-ND1 3.54Å; F278-H282 AromaticContact CZ-ND1 3.84Å; F278-H282 VanDerWaalsContact O-CB 3.31Å; F278-H282 WeakPolarHBondContact O-CB 3.25Å; F278-H282 PolarHBondContact O-N 3.34Å; F278-H282 PolarHBondContact O-ND1 2.79Å
279	H	87.9	Confident	79.6	Confident	99 Å²	99	62.2 Å²	62.2	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-37	-179.8	-66.7	-60.1	0	0	0	112.7	T275 K276 F281 H282 S283	T275-H279 PolarHBondContact O-CD2 2.52Å; T275-H279 PolarHBondContact O-N 2.94Å; T275-H279 VanDerWaalsContact O-N 3.14Å; K276-H279 PolarHBondContact O-N 2.86Å; H279-F281 VanDerWaalsContact C-N 3.34Å; H279-H282 CarbonylContact O-C 3.55Å; H279-H282 PolarHBondContact O-N 2.98Å; H279-S283 WeakPolarHBondContact O-CA 3.41Å; H279-S283 VanDerWaalsContact O-CB 3.31Å; H279-S283 WeakPolarHBondContact O-CB 3.19Å; H279-S283 PolarHBondContact O-N 3.46Å
280	E	90.2	Very high	78	Confident	111 Å²	111	68.7 Å²	68.7	52%	0.519	38%	0.377	S	S	.	.	H	α-helix	trans	-62.1	-44	174.6	-73.6	174.1	168.8	0	0	111.1	K276 F278 S283	K276-E280 WeakPolarHBondContact CE-OE1 3.29Å; K276-E280 IonicContact NZ-OE1 3.62Å; K276-E280 WeakPolarHBondContact O-CG 3.43Å; K276-E280 PolarHBondContact O-N 2.97Å; F278-E280 PolarHBondContact O-N 2.69Å; E280-S283 PolarHBondContact O-OG 2.82Å; E280-S283 VanDerWaalsContact O-OG 3.09Å
281	F	86.4	Confident	76.2	Confident	51 Å²	51	69 Å²	69	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-72.3	-34.7	-179.9	-171.7	-113.8	0	0	0	113.3	W247 K264 F273 C277 F278 H279	W247-F281 HydrophobicContact CZ2-CD2 4.48Å; W247-F281 HydrophobicContact CZ2-CE2 4.15Å; W247-F281 HydrophobicContact CZ2-CZ 4.24Å; K264-F281 HydrophobicContact CB-CE1 4.37Å; K264-F281 HydrophobicContact CB-CZ 4.06Å; K264-F281 HydrophobicContact CG-CZ 4.5Å; F273-F281 HydrophobicContact CD1-CB 4.43Å; F273-F281 HydrophobicContact CE1-CB 3.81Å; F273-F281 AromaticContact CE1-CD1 3.43Å; F273-F281 HydrophobicContact CE1-CD1 3.43Å; F273-F281 VanDerWaalsContact CE1-CD1 3.43Å; F273-F281 HydrophobicContact CE1-CE1 4.12Å; F273-F281 AromaticContact CE1-CG 3.71Å; F273-F281 HydrophobicContact CE1-CG 3.71Å; F273-F281 AromaticContact CZ-CD1 3.44Å; F273-F281 HydrophobicContact CZ-CD1 3.44Å; F273-F281 VanDerWaalsContact CZ-CD1 3.44Å; F273-F281 AromaticContact CZ-CE1 3.76Å; F273-F281 HydrophobicContact CZ-CE1 3.76Å; F273-F281 HydrophobicContact CZ-CG 4.19Å; C277-F281 WeakPolarHBondContact O-CB 3.35Å; C277-F281 PolarHBondContact O-N 3.17Å; F278-F281 PolarHBondContact O-N 3.39Å; H279-F281 VanDerWaalsContact C-N 3.34Å
282	H	85	Confident	74.5	Confident	13 Å²	13	72.6 Å²	72.6	6%	0.06	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	22.3	-177.5	-55.8	98.4	0	0	0	112.8	C257 C260 F273 F278 H279 S284 L285	C257-H282 PolarHBondContact SG-NE2 2.91Å; C260-H282 PolarHBondContact SG-NE2 3.49Å; F273-H282 AromaticContact CE2-CE1 3.87Å; F273-H282 AromaticContact CZ-CE1 3.77Å; F278-H282 AromaticContact CD1-ND1 3.83Å; F278-H282 AromaticContact CD2-CE1 3.42Å; F278-H282 VanDerWaalsContact CD2-CE1 3.42Å; F278-H282 WeakPolarHBondContact CD2-CE1 3.37Å; F278-H282 AromaticContact CD2-ND1 3.42Å; F278-H282 WeakPolarHBondContact CD2-ND1 3.11Å; F278-H282 HydrophobicContact CE1-CB 4.38Å; F278-H282 AromaticContact CE1-ND1 3.96Å; F278-H282 AromaticContact CE2-CE1 3.46Å; F278-H282 VanDerWaalsContact CE2-CE1 3.46Å; F278-H282 WeakPolarHBondContact CE2-CE1 3.28Å; F278-H282 AromaticContact CE2-ND1 3.59Å; F278-H282 AromaticContact CG-ND1 3.54Å; F278-H282 AromaticContact CZ-ND1 3.84Å; F278-H282 VanDerWaalsContact O-CB 3.31Å; F278-H282 WeakPolarHBondContact O-CB 3.25Å; F278-H282 PolarHBondContact O-N 3.34Å; F278-H282 PolarHBondContact O-ND1 2.79Å; H279-H282 CarbonylContact O-C 3.55Å; H279-H282 PolarHBondContact O-N 2.98Å; H282-S284 PolarHBondContact O-N 3.49Å; H282-L285 HydrophobicContact CB-CB 4.33Å; H282-L285 HydrophobicContact CB-CD1 4.38Å; H282-L285 PolarHBondContact O-N 2.96Å
283	S	80.3	Confident	72.5	Confident	104 Å²	104	76.1 Å²	76.1	73%	0.727	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-7.8	-177.5	47.4	0	0	0	0	114.9	H279 E280	H279-S283 WeakPolarHBondContact O-CA 3.41Å; H279-S283 VanDerWaalsContact O-CB 3.31Å; H279-S283 WeakPolarHBondContact O-CB 3.19Å; H279-S283 PolarHBondContact O-N 3.46Å; E280-S283 PolarHBondContact O-OG 2.82Å; E280-S283 VanDerWaalsContact O-OG 3.09Å
284	S	71.9	Confident	70.4	Confident	107 Å²	107	79.4 Å²	79.4	75%	0.748	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	1.3	176.1	46.8	0	0	0	0	114.7	H282	H282-S284 PolarHBondContact O-N 3.49Å
285	L	62	Low	68.2	Low	101 Å²	101	85.3 Å²	85.3	53%	0.529	48%	0.479	S	S	.	.			trans	-120.8	132.2	-172.6	-69.9	163.2	0	0	0	111.8	H282	H282-L285 HydrophobicContact CB-CB 4.33Å; H282-L285 HydrophobicContact CB-CD1 4.38Å; H282-L285 PolarHBondContact O-N 2.96Å
286	P	52.8	Low	66	Low	118 Å²	118	87 Å²	87	77%	0.766	49%	0.489	S	S	*	.			trans	-96	92.3	177.7	33.9	-27.7	0	0	0	110.8
287	T	57	Low	64.4	Low	79 Å²	79	84.9 Å²	84.9	49%	0.485	49%	0.487	S	S	.	.			trans	-166	126.8	166.2	16.4	0	0	0	0	111.8
288	D	55.4	Low	63.4	Low	147 Å²	147	88 Å²	88	79%	0.786	51%	0.514	S	S	*	.			trans	-85.1	105.7	155.4	-83.1	-32.3	0	0	0	107.1
289	Q	54.4	Low	63.1	Low	68 Å²	68	91.6 Å²	91.6	32%	0.318	54%	0.538	S	S	.	.			trans	-89.1	167.6	167.2	-71	-164.7	-5.7	0	0	110.7	E259 H291	E259-Q289 PolarHBondContact OE1-NE2 2.82Å; Q289-H291 VanDerWaalsContact C-CE1 3.48Å; Q289-H291 PolarHBondContact O-CE1 3.41Å; Q289-H291 PolarHBondContact O-ND1 3.37Å
290	D	53.9	Low	63.1	Low	168 Å²	168	87.6 Å²	87.6	90%	0.898	52%	0.52	S	S	*	.			trans	-80.4	143.6	-177.2	-107	-27.1	0	0	0	111.9
291	H	52.6	Low	63.2	Low	52 Å²	52	84 Å²	84	24%	0.241	51%	0.505	C	S	.	.			trans	-145.6	147.3	-167.7	-57.1	117.1	0	0	0	116.2	Q254 L255 Q256 Q289	Q254-H291 WeakPolarHBondContact O-CB 3.24Å; L255-H291 WeakPolarHBondContact CA-CD2 3.49Å; L255-H291 WeakPolarHBondContact CB-NE2 3.18Å; L255-H291 HydrophobicContact CD2-CB 3.88Å; L255-H291 VanDerWaalsContact CD2-CE1 3.42Å; L255-H291 WeakPolarHBondContact CD2-CE1 3.4Å; L255-H291 VanDerWaalsContact CD2-CG 3.42Å; L255-H291 WeakPolarHBondContact CD2-ND1 3.28Å; Q256-H291 PolarHBondContact N-CD2 2.97Å; Q256-H291 PolarHBondContact N-NE2 3.31Å; Q256-H291 PolarHBondContact O-CD2 2.73Å; Q256-H291 PolarHBondContact O-NE2 3.32Å; Q289-H291 VanDerWaalsContact C-CE1 3.48Å; Q289-H291 PolarHBondContact O-CE1 3.41Å; Q289-H291 PolarHBondContact O-ND1 3.37Å
292	A	51.9	Low	63.6	Low	76 Å²	76	81.6 Å²	81.6	63%	0.628	50%	0.495	S	S	*	.			trans	-100.9	139.4	172.8	0	0	0	0	0	111.3
293	V	47.2	Very low	64	Low	89 Å²	89	82.1 Å²	82.1	54%	0.539	50%	0.497	S	S	.	.			trans	-126.9	112.3	-175	-178.8	0	0	0	0	109.8	Q254	Q254-V293 HydrophobicContact CB-CG2 3.98Å; Q254-V293 HydrophobicContact CG-CG1 4.05Å; Q254-V293 HydrophobicContact CG-CG2 4.33Å
294	V	43.2	Very low	64.8	Low	69 Å²	69	77.1 Å²	77.1	42%	0.418	46%	0.463	S	S	.	.			trans	-157	145.4	171.4	-165.1	0	0	0	0	112.4	P243 L252	P243-V294 VanDerWaalsContact CA-O 3.3Å; P243-V294 WeakPolarHBondContact CA-O 3.3Å; P243-V294 VanDerWaalsContact CB-C 3.47Å; P243-V294 HydrophobicContact CB-CB 4.17Å; P243-V294 HydrophobicContact CB-CG1 4.41Å; P243-V294 WeakPolarHBondContact CB-O 3.32Å; L252-V294 VanDerWaalsContact CD1-C 3.46Å; L252-V294 WeakPolarHBondContact CD1-O 3.34Å
295	L	41	Very low	65.9	Low	134 Å²	134	72.5 Å²	72.5	70%	0.702	43%	0.431	S	S	*	.			trans	-58.9	144.5	-170.6	-73	162.5	0	0	0	118.8	P243 L252 T297	P243-L295 WeakPolarHBondContact CB-O 3.47Å; P243-L295 WeakPolarHBondContact CG-O 3.31Å; L252-L295 VanDerWaalsContact CD1-CA 3.47Å; L252-L295 HydrophobicContact CD2-CD2 4.4Å; L295-T297 PolarHBondContact O-N 2.89Å
296	V	41.5	Very low	67.6	Low	94 Å²	94	67.7 Å²	67.7	57%	0.57	41%	0.406	S	S	*	.			trans	-47.1	119.7	-179.5	-175.2	0	0	0	0	114.7
297	T	57.6	Low	69.7	Low	84 Å²	84	62.1 Å²	62.1	52%	0.515	37%	0.369	S	S	.	.			trans	-126.7	167.8	154.9	57.5	0	0	0	0	109.7	P243 L295	P243-T297 HydrophobicContact CG-CG2 4.34Å; P243-T297 WeakPolarHBondContact CG-OG1 3.24Å; L295-T297 PolarHBondContact O-N 2.89Å
298	A	70.5	Confident	71.7	Confident	74 Å²	74	58.3 Å²	58.3	61%	0.612	35%	0.346	S	S	*	.			trans	-61.5	150	177.7	0	0	0	0	0	112.2
299	P	81.9	Confident	73.6	Confident	86 Å²	86	51.3 Å²	51.3	56%	0.558	31%	0.309	S	S	*	.			trans	-60.5	141.7	176.2	26.5	-34.8	0	0	0	111	S236 V301	S236-P299 WeakPolarHBondContact OG-CA 3.38Å; P299-V301 HydrophobicContact CB-CG2 4.1Å; P299-V301 HydrophobicContact CG-CG2 4.32Å; P299-V301 PolarHBondContact O-N 3.39Å
300	I	88.5	Confident	75.5	Confident	15 Å²	15	48.8 Å²	48.8	8%	0.077	30%	0.297	C	S	.	.			trans	-88.8	97.9	175.5	-54.5	-55.8	0	0	0	108.6	I207 V235 S236 L239 H242 W397	I207-I300 HydrophobicContact CB-CG2 4.49Å; I207-I300 HydrophobicContact CD1-CD1 3.72Å; I207-I300 HydrophobicContact CD1-CG1 3.87Å; I207-I300 HydrophobicContact CD1-CG2 4.23Å; I207-I300 HydrophobicContact CG1-CG1 4.28Å; I207-I300 HydrophobicContact CG1-CG2 4.16Å; I207-I300 HydrophobicContact CG2-CG2 3.57Å; V235-I300 HydrophobicContact CG2-CB 4.06Å; V235-I300 HydrophobicContact CG2-CG2 3.63Å; V235-I300 WeakPolarHBondContact CG2-O 3.31Å; V235-I300 PolarHBondContact N-O 3.26Å; S236-I300 PolarHBondContact OG-N 3.35Å; L239-I300 HydrophobicContact CD1-CB 3.95Å; L239-I300 HydrophobicContact CD1-CG1 3.85Å; L239-I300 HydrophobicContact CD1-CG2 4.24Å; H242-I300 VanDerWaalsContact CE1-CG1 3.49Å; H242-I300 WeakPolarHBondContact CE1-CG1 3.48Å; I300-W397 HydrophobicContact CD1-CZ2 4.02Å
301	V	92.2	Very high	77.3	Confident	35 Å²	35	45.7 Å²	45.7	21%	0.212	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.3	-178.1	-177.1	0	0	0	0	109.9	Q232 L233 P299	Q232-V301 HydrophobicContact CB-CG1 3.63Å; Q232-V301 HydrophobicContact CG-CG1 4.12Å; L233-V301 WeakPolarHBondContact O-CA 3.19Å; P299-V301 HydrophobicContact CB-CG2 4.1Å; P299-V301 HydrophobicContact CG-CG2 4.32Å; P299-V301 PolarHBondContact O-N 3.39Å
302	L	94.2	Very high	79	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	153.5	171.3	-48.3	-175.5	0	0	0	110.3	P208 L211 Q232 L233 V235 Y395 Y396 W397	P208-L302 HydrophobicContact CG-CD1 4.08Å; L211-L302 HydrophobicContact CB-CD1 3.9Å; L211-L302 HydrophobicContact CD2-CD1 3.65Å; L211-L302 HydrophobicContact CG-CD1 4.44Å; Q232-L302 WeakPolarHBondContact CA-O 3.18Å; L233-L302 HydrophobicContact CB-CB 4.34Å; L233-L302 HydrophobicContact CD2-CD1 4.37Å; L233-L302 PolarHBondContact N-O 2.85Å; L233-L302 PolarHBondContact O-N 3.33Å; V235-L302 HydrophobicContact CG1-CD1 3.76Å; V235-L302 HydrophobicContact CG1-CG 4.02Å; V235-L302 HydrophobicContact CG2-CD1 4.46Å; V235-L302 HydrophobicContact CG2-CD2 4.38Å; V235-L302 HydrophobicContact CG2-CG 4.15Å; L302-Y395 HydrophobicContact CB-CD1 4.2Å; L302-Y396 CarbonylContact C-O 3.58Å; L302-Y396 VanDerWaalsContact CA-O 3.29Å; L302-Y396 WeakPolarHBondContact CA-O 3.44Å; L302-Y396 WeakPolarHBondContact CB-O 3.22Å; L302-W397 HydrophobicContact CD2-CB 3.46Å; L302-W397 VanDerWaalsContact CD2-CB 3.46Å; L302-W397 HydrophobicContact CD2-CG 4Å
303	Q	94.8	Very high	80.7	Confident	24 Å²	24	46.8 Å²	46.8	11%	0.112	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	136.7	176.9	-61.1	-63.5	-44.8	0	0	110.1	A305 Y395 Y396 P398	Q303-A305 PolarHBondContact O-N 2.99Å; Q303-Y395 WeakPolarHBondContact O-CA 3.2Å; Q303-Y396 HydrophobicContact CB-CD1 4.31Å; Q303-Y396 HydrophobicContact CB-CE1 3.65Å; Q303-Y396 HydrophobicContact CB-CE2 4.36Å; Q303-Y396 PolarHBondContact N-O 2.69Å; Q303-Y396 VanDerWaalsContact O-CD1 3.25Å; Q303-Y396 WeakPolarHBondContact O-CD1 3.39Å; Q303-Y396 WeakPolarHBondContact O-CE1 3.37Å; Q303-Y396 PolarHBondContact O-N 2.82Å; Q303-P398 HydrophobicContact CB-CG 4.25Å; Q303-P398 HydrophobicContact CG-CG 3.37Å
304	L	95.6	Very high	83	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	123.8	172.9	-173.3	66.3	0	0	0	109.7	P229 L231 V307 W329 C393 Y395	P229-L304 HydrophobicContact CB-CD2 3.58Å; L231-L304 HydrophobicContact CD2-CD2 4.18Å; L231-L304 PolarHBondContact O-N 3.27Å; L304-V307 HydrophobicContact CD1-CG2 3.92Å; L304-V307 HydrophobicContact CD2-CG2 3.76Å; L304-V307 HydrophobicContact CG-CG2 4.19Å; L304-W329 HydrophobicContact CD2-CH2 3.68Å; L304-W329 HydrophobicContact CD2-CZ2 4.21Å; L304-W329 HydrophobicContact CG-CH2 3.97Å; L304-C393 HydrophobicContact CD1-CB 3.91Å; L304-Y395 HydrophobicContact CB-CD1 4.07Å; L304-Y395 HydrophobicContact CB-CE1 3.62Å; L304-Y395 HydrophobicContact CD1-CD1 4.22Å; L304-Y395 HydrophobicContact CD1-CD2 4.27Å; L304-Y395 HydrophobicContact CD1-CE1 3.77Å; L304-Y395 HydrophobicContact CD1-CE2 3.84Å; L304-Y395 HydrophobicContact CD1-CG 4.44Å; L304-Y395 HydrophobicContact CG-CE1 4.25Å
305	A	95.6	Very high	85.5	Confident	10 Å²	10	41.6 Å²	41.6	8%	0.083	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-45.6	175.8	0	0	0	0	0	111.8	T90 I92 Q303 R320 F394 Y396	T90-A305 HydrophobicContact CG2-CB 4.49Å; I92-A305 HydrophobicContact CD1-CB 4.31Å; Q303-A305 PolarHBondContact O-N 2.99Å; A305-R320 PolarHBondContact O-N 3.33Å; A305-F394 PolarHBondContact N-O 2.84Å; A305-Y396 HydrophobicContact CB-CD1 3.9Å; A305-Y396 HydrophobicContact CB-CE1 4.01Å
306	S	97.2	Very high	88.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	161	-175.9	53.5	0	0	0	0	111.9	S85 F318 F394	S85-S306 WeakPolarHBondContact CB-OG 3.38Å; S85-S306 WeakPolarHBondContact O-CB 3.42Å; S85-S306 PolarHBondContact O-OG 2.8Å; S306-F318 CarbonylContact C-O 3.59Å; S306-F318 WeakPolarHBondContact CA-O 3.27Å; S306-F318 WeakPolarHBondContact CB-O 3.46Å; S306-F394 PolarHBondContact O-N 3.16Å; S306-F394 WeakPolarHBondContact OG-CB 3.26Å
307	V	97.9	Very high	91	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	126.9	177.2	-177.1	0	0	0	0	108.5	P229 L304 S317 F318 L386 L392	P229-V307 HydrophobicContact CB-CG2 4.05Å; P229-V307 HydrophobicContact CG-CG1 4.49Å; P229-V307 HydrophobicContact CG-CG2 4.04Å; L304-V307 HydrophobicContact CD1-CG2 3.92Å; L304-V307 HydrophobicContact CD2-CG2 3.76Å; L304-V307 HydrophobicContact CG-CG2 4.19Å; V307-S317 WeakPolarHBondContact O-CA 3.16Å; V307-F318 HydrophobicContact CB-CB 4.47Å; V307-F318 PolarHBondContact N-O 3.26Å; V307-F318 PolarHBondContact O-N 3.33Å; V307-L386 HydrophobicContact CB-CD1 3.71Å; V307-L386 HydrophobicContact CG1-CD1 3.78Å; V307-L386 HydrophobicContact CG2-CD1 4.02Å; V307-L392 CarbonylContact C-O 3.53Å; V307-L392 VanDerWaalsContact CA-O 3.31Å; V307-L392 WeakPolarHBondContact CA-O 3.3Å
308	M	97.6	Very high	92.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	137.5	165.6	-69.6	172.7	66.3	0	0	109.6	A81 A82 S85 P152 Y315 V316 Y391 L392 F394	A81-M308 HydrophobicContact CB-CE 3.86Å; A82-M308 WeakPolarHBondContact CA-SD 3.26Å; A82-M308 HydrophobicContact CB-CE 3.87Å; A82-M308 HydrophobicContact CB-SD 3.73Å; S85-M308 WeakPolarHBondContact OG-CG 3.44Å; P152-M308 HydrophobicContact CB-CE 3.85Å; P152-M308 HydrophobicContact CG-CE 3.69Å; M308-Y315 HydrophobicContact CE-CD1 4.2Å; M308-V316 WeakPolarHBondContact CA-O 3.17Å; M308-Y391 WeakPolarHBondContact O-CA 3.31Å; M308-Y391 WeakPolarHBondContact O-CB 3.46Å; M308-Y391 PolarHBondContact O-N 3.14Å; M308-L392 HydrophobicContact CB-CB 4.19Å; M308-L392 PolarHBondContact N-O 3.31Å; M308-L392 PolarHBondContact O-N 3.07Å; M308-L392 VanDerWaalsContact O-N 3.13Å; M308-L392 HydrophobicContact SD-CD1 4Å; M308-F394 HydrophobicContact CB-CE2 4.44Å; M308-F394 HydrophobicContact CG-CE2 3.75Å; M308-F394 HydrophobicContact CG-CZ 4.35Å; M308-F394 HydrophobicContact SD-CE2 3.66Å; M308-F394 HydrophobicContact SD-CZ 3.66Å
309	C	96.7	Very high	94.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	150.5	176.1	-63.6	0	0	0	0	110.4	Y315 V316 F318 D389	C309-Y315 WeakPolarHBondContact O-CA 3.44Å; C309-V316 HydrophobicContact CB-CG2 3.89Å; C309-V316 PolarHBondContact N-O 3.15Å; C309-V316 PolarHBondContact O-N 2.95Å; C309-F318 HydrophobicContact CB-CE2 4.3Å; C309-D389 CarbonylContact C-O 3.03Å; C309-D389 WeakPolarHBondContact CA-O 3.46Å; C309-D389 HydrophobicContact CB-CB 3.92Å; C309-D389 WeakPolarHBondContact CB-O 3.42Å
310	I	94.2	Very high	94.8	Very high	14 Å²	14	19.8 Å²	19.8	7%	0.072	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.7	176	-166.3	-162	0	0	0	111.6	R217 Y315 D389 Y391	R217-I310 VanDerWaalsContact CZ-CG2 3.48Å; R217-I310 VanDerWaalsContact CZ-O 3.27Å; R217-I310 PolarHBondContact NH1-O 2.83Å; R217-I310 PolarHBondContact NH2-O 3.39Å; I310-Y315 HydrophobicContact CB-CD1 3.65Å; I310-Y315 HydrophobicContact CB-CE1 3.52Å; I310-Y315 HydrophobicContact CB-CG 4.41Å; I310-Y315 HydrophobicContact CD1-CD1 4.23Å; I310-Y315 HydrophobicContact CD1-CD2 4.39Å; I310-Y315 HydrophobicContact CD1-CE1 3.52Å; I310-Y315 HydrophobicContact CD1-CE2 3.73Å; I310-Y315 VanDerWaalsContact CD1-OH 3.3Å; I310-Y315 WeakPolarHBondContact CD1-OH 3.38Å; I310-Y315 HydrophobicContact CG1-CD1 3.8Å; I310-Y315 HydrophobicContact CG1-CD2 4.29Å; I310-Y315 HydrophobicContact CG1-CE1 3.58Å; I310-Y315 HydrophobicContact CG1-CE2 4.11Å; I310-Y315 HydrophobicContact CG1-CG 4.16Å; I310-Y315 HydrophobicContact CG2-CE1 4.14Å; I310-D389 PolarHBondContact N-O 3.28Å; I310-D389 WeakPolarHBondContact O-CB 3.4Å; I310-Y391 HydrophobicContact CG2-CD1 4.41Å; I310-Y391 HydrophobicContact CG2-CD2 3.95Å; I310-Y391 HydrophobicContact CG2-CG 3.81Å
311	E	91.8	Very high	94.9	Very high	103 Å²	103	19.2 Å²	19.2	48%	0.481	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.3	163.8	179.6	-174.1	-135.7	0	0	109.3	S313 H314 R385	E311-S313 VanDerWaalsContact C-N 3.34Å; E311-S313 PolarHBondContact O-N 3.12Å; E311-H314 PolarHBondContact N-O 2.98Å; E311-H314 PolarHBondContact O-N 3.16Å; E311-R385 VanDerWaalsContact CB-NH2 3.26Å; E311-R385 IonicContact OE1-NH1 3.31Å; E311-R385 IonicContact OE2-CZ 3.85Å; E311-R385 IonicContact OE2-NH1 3.93Å; E311-R385 PolarHBondContact OE2-NH1 2.81Å; E311-R385 IonicContact OE2-NH2 3.74Å
312	S	87.1	Confident	94.7	Very high	93 Å²	93	18.7 Å²	18.7	65%	0.65	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	-91.5	-171.6	-58.7	0	0	0	0	112.1
313	S	88.7	Confident	94	Very high	59 Å²	59	23.9 Å²	23.9	41%	0.413	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	11.7	-177.4	51.8	0	0	0	0	111.9	E149 E311	E149-S313 VanDerWaalsContact OE1-CA 3.29Å; E149-S313 WeakPolarHBondContact OE1-CA 3.28Å; E149-S313 WeakPolarHBondContact OE1-CB 3.3Å; E149-S313 WeakPolarHBondContact OE2-CB 3.42Å; E311-S313 VanDerWaalsContact C-N 3.34Å; E311-S313 PolarHBondContact O-N 3.12Å
314	H	94.4	Very high	93.5	Very high	46 Å²	46	29.9 Å²	29.9	21%	0.213	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	107.9	-173.3	-171	49.5	0	0	0	111.3	E311 D333 M335 R385	E311-H314 PolarHBondContact N-O 2.98Å; E311-H314 PolarHBondContact O-N 3.16Å; H314-D333 IonicContact CD2-OD2 2.79Å; H314-D333 IonicContact CE1-OD1 3.91Å; H314-D333 PolarHBondContact CE1-OD1 3.17Å; H314-D333 IonicContact CE1-OD2 2.67Å; H314-D333 IonicContact NE2-OD1 2.86Å; H314-D333 PolarHBondContact NE2-OD1 3.39Å; H314-D333 IonicContact NE2-OD2 3.43Å; H314-D333 PolarHBondContact NE2-OD2 3.41Å; H314-M335 VanDerWaalsContact ND1-CE 3.32Å; H314-M335 WeakPolarHBondContact ND1-CE 3.38Å; H314-R385 PolarHBondContact O-NH2 3.44Å
315	Y	97.2	Very high	92.7	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.2	177.2	-68.3	-82.7	0	0	0	111.4	P152 M308 C309 I310 Y391	P152-Y315 WeakPolarHBondContact CD-OH 3.43Å; P152-Y315 HydrophobicContact CG-CD1 3.81Å; P152-Y315 HydrophobicContact CG-CE1 3.32Å; P152-Y315 HydrophobicContact CG-CE2 4.24Å; P152-Y315 HydrophobicContact CG-CG 4.43Å; M308-Y315 HydrophobicContact CE-CD1 4.2Å; C309-Y315 WeakPolarHBondContact O-CA 3.44Å; I310-Y315 HydrophobicContact CB-CD1 3.65Å; I310-Y315 HydrophobicContact CB-CE1 3.52Å; I310-Y315 HydrophobicContact CB-CG 4.41Å; I310-Y315 HydrophobicContact CD1-CD1 4.23Å; I310-Y315 HydrophobicContact CD1-CD2 4.39Å; I310-Y315 HydrophobicContact CD1-CE1 3.52Å; I310-Y315 HydrophobicContact CD1-CE2 3.73Å; I310-Y315 VanDerWaalsContact CD1-OH 3.3Å; I310-Y315 WeakPolarHBondContact CD1-OH 3.38Å; I310-Y315 HydrophobicContact CG1-CD1 3.8Å; I310-Y315 HydrophobicContact CG1-CD2 4.29Å; I310-Y315 HydrophobicContact CG1-CE1 3.58Å; I310-Y315 HydrophobicContact CG1-CE2 4.11Å; I310-Y315 HydrophobicContact CG1-CG 4.16Å; I310-Y315 HydrophobicContact CG2-CE1 4.14Å; Y315-Y391 AromaticContact CE1-CD1 3.78Å; Y315-Y391 HydrophobicContact CE1-CD1 3.78Å; Y315-Y391 AromaticContact CE1-CE1 3.95Å; Y315-Y391 HydrophobicContact CE1-CE1 3.95Å
316	V	98.2	Very high	92.2	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	162.3	176.9	-62.1	0	0	0	0	109.3	M308 C309 F331 D333 R385	M308-V316 WeakPolarHBondContact CA-O 3.17Å; C309-V316 HydrophobicContact CB-CG2 3.89Å; C309-V316 PolarHBondContact N-O 3.15Å; C309-V316 PolarHBondContact O-N 2.95Å; V316-F331 HydrophobicContact CB-CE2 3.62Å; V316-F331 HydrophobicContact CB-CZ 3.93Å; V316-F331 HydrophobicContact CG1-CE2 4.13Å; V316-F331 HydrophobicContact CG1-CZ 3.91Å; V316-F331 HydrophobicContact CG2-CE2 3.64Å; V316-F331 HydrophobicContact CG2-CZ 4.22Å; V316-D333 HydrophobicContact CG1-CB 4.18Å; V316-R385 HydrophobicContact CG2-CG 4.34Å
317	S	98.5	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142	-176.9	-63.2	0	0	0	0	112.7	A81 S85 V307 F331 F332	A81-S317 WeakPolarHBondContact CA-OG 3.25Å; A81-S317 VanDerWaalsContact CB-OG 3.27Å; A81-S317 WeakPolarHBondContact CB-OG 3.44Å; A81-S317 PolarHBondContact O-OG 3.32Å; S85-S317 WeakPolarHBondContact OG-CB 3.27Å; S85-S317 PolarHBondContact OG-OG 3.33Å; V307-S317 WeakPolarHBondContact O-CA 3.16Å; S317-F331 CarbonylContact O-C 3.35Å; S317-F331 WeakPolarHBondContact O-CA 3.41Å; S317-F332 PolarHBondContact N-O 3.18Å; S317-F332 PolarHBondContact O-N 3.09Å
318	F	98.1	Very high	91.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.7	165.5	-63.6	-91.9	0	0	0	108.4	S306 V307 C309 W329 I330 F331 F356 Q382 R385 L386	S306-F318 CarbonylContact C-O 3.59Å; S306-F318 WeakPolarHBondContact CA-O 3.27Å; S306-F318 WeakPolarHBondContact CB-O 3.46Å; V307-F318 HydrophobicContact CB-CB 4.47Å; V307-F318 PolarHBondContact N-O 3.26Å; V307-F318 PolarHBondContact O-N 3.33Å; C309-F318 HydrophobicContact CB-CE2 4.3Å; F318-W329 HydrophobicContact CB-CE3 4.05Å; F318-W329 HydrophobicContact CB-CZ3 4.13Å; F318-I330 CarbonylContact C-O 3.59Å; F318-I330 VanDerWaalsContact CA-O 3.24Å; F318-I330 WeakPolarHBondContact CA-O 3.45Å; F318-F331 HydrophobicContact CD1-CB 4.16Å; F318-F331 AromaticContact CD1-CD2 3.97Å; F318-F331 HydrophobicContact CD1-CD2 3.97Å; F318-F331 HydrophobicContact CD2-CD2 4.42Å; F318-F331 HydrophobicContact CE1-CB 3.99Å; F318-F331 AromaticContact CE1-CD2 3.42Å; F318-F331 HydrophobicContact CE1-CD2 3.42Å; F318-F331 VanDerWaalsContact CE1-CD2 3.42Å; F318-F331 HydrophobicContact CE1-CE2 4.28Å; F318-F331 HydrophobicContact CE1-CG 4.11Å; F318-F331 AromaticContact CE2-CD2 3.93Å; F318-F331 HydrophobicContact CE2-CD2 3.93Å; F318-F331 HydrophobicContact CE2-CE2 4.15Å; F318-F331 HydrophobicContact CG-CD2 4.45Å; F318-F331 AromaticContact CZ-CD2 3.4Å; F318-F331 HydrophobicContact CZ-CD2 3.4Å; F318-F331 VanDerWaalsContact CZ-CD2 3.4Å; F318-F331 AromaticContact CZ-CE2 3.81Å; F318-F331 HydrophobicContact CZ-CE2 3.81Å; F318-F331 HydrophobicContact CZ-CG 4.45Å; F318-F356 AromaticContact CD1-CE2 3.55Å; F318-F356 HydrophobicContact CD1-CE2 3.55Å; F318-F356 AromaticContact CD1-CZ 3.75Å; F318-F356 HydrophobicContact CD1-CZ 3.75Å; F318-F356 AromaticContact CE1-CE2 3.88Å; F318-F356 HydrophobicContact CE1-CE2 3.88Å; F318-F356 AromaticContact CE1-CZ 3.54Å; F318-F356 HydrophobicContact CE1-CZ 3.54Å; F318-F356 HydrophobicContact CG-CE2 4.37Å; F318-F356 HydrophobicContact CZ-CZ 4.43Å; F318-Q382 HydrophobicContact CE1-CB 4.21Å; F318-Q382 WeakPolarHBondContact CE1-O 3.49Å; F318-Q382 WeakPolarHBondContact CZ-O 3.35Å; F318-R385 HydrophobicContact CE2-CG 4.06Å; F318-R385 HydrophobicContact CZ-CB 4.15Å; F318-R385 HydrophobicContact CZ-CG 3.94Å; F318-L386 HydrophobicContact CB-CD1 3.95Å; F318-L386 HydrophobicContact CD1-CD1 4.36Å; F318-L386 HydrophobicContact CD2-CB 4.29Å; F318-L386 HydrophobicContact CD2-CD1 3.51Å; F318-L386 HydrophobicContact CE1-CB 4.35Å; F318-L386 HydrophobicContact CE2-CB 3.97Å; F318-L386 HydrophobicContact CE2-CD1 4.05Å; F318-L386 HydrophobicContact CG-CD1 3.69Å; F318-L386 HydrophobicContact CZ-CB 3.99Å
319	A	96.9	Very high	91.5	Very high	2 Å²	2	43.2 Å²	43.2	2%	0.017	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.9	178.8	0	0	0	0	0	110.9	F84 W329 I330	F84-A319 HydrophobicContact CE1-CB 4.11Å; A319-W329 WeakPolarHBondContact O-CA 3.45Å; A319-I330 HydrophobicContact CB-CD1 4.37Å; A319-I330 HydrophobicContact CB-CG1 4.02Å; A319-I330 PolarHBondContact N-O 2.91Å; A319-I330 WeakPolarHBondContact O-CG1 3.31Å; A319-I330 PolarHBondContact O-N 2.76Å
320	R	94.4	Very high	91.5	Very high	9 Å²	9	43.2 Å²	43.2	3%	0.034	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130.8	176	-165.2	-178.5	175.9	-171.6	-3	109.6	C89 A305 G322 H323 K324 P325 A327 W329	C89-R320 WeakPolarHBondContact CB-O 3.36Å; A305-R320 PolarHBondContact O-N 3.33Å; R320-G322 WeakPolarHBondContact CD-O 3.29Å; R320-G322 WeakPolarHBondContact CG-O 3.39Å; R320-G322 PolarHBondContact NE-O 3.14Å; R320-G322 PolarHBondContact O-N 3.37Å; R320-G322 VanDerWaalsContact O-N 3.17Å; R320-H323 PolarHBondContact NH2-O 3.39Å; R320-K324 PolarHBondContact NH2-O 3.31Å; R320-P325 VanDerWaalsContact NH2-CA 3.33Å; R320-A327 HydrophobicContact CG-CB 3.88Å; R320-W329 HydrophobicContact CB-CD2 4.2Å; R320-W329 HydrophobicContact CB-CE3 4.4Å; R320-W329 HydrophobicContact CB-CH2 4.08Å; R320-W329 HydrophobicContact CB-CZ2 3.84Å; R320-W329 HydrophobicContact CB-CZ3 4.36Å; R320-W329 HydrophobicContact CG-CD2 4.45Å; R320-W329 HydrophobicContact CG-CZ2 4.03Å
321	T	92.2	Very high	91.7	Very high	4 Å²	4	44 Å²	44	3%	0.025	24%	0.24	C	C	.	.	S	Bend	trans	-86.7	21.4	-172	69.9	0	0	0	0	113.6	L60 E328 I330	L60-T321 HydrophobicContact CD1-CG2 3.84Å; L60-T321 HydrophobicContact CD2-CG2 4.29Å; T321-E328 PolarHBondContact N-O 3.44Å; T321-E328 PolarHBondContact OG1-O 3.2Å; T321-I330 HydrophobicContact CG2-CD1 4.25Å; T321-I330 HydrophobicContact CG2-CG1 4.12Å; T321-I330 HydrophobicContact CG2-CG2 3.81Å
322	G	86.3	Confident	92	Very high	24 Å²	24	39.2 Å²	39.2	25%	0.247	22%	0.218	C	C	.	.	S	Bend	trans	165.2	175.3	-178.5	0	0	0	0	0	113.3	R320 A327	R320-G322 WeakPolarHBondContact CD-O 3.29Å; R320-G322 WeakPolarHBondContact CG-O 3.39Å; R320-G322 PolarHBondContact NE-O 3.14Å; R320-G322 PolarHBondContact O-N 3.37Å; R320-G322 VanDerWaalsContact O-N 3.17Å; G322-A327 WeakPolarHBondContact O-CB 3.48Å
323	H	80.7	Confident	92.6	Very high	108 Å²	108	35.8 Å²	35.8	50%	0.5	19%	0.192	S	C	.	.	S	Bend	trans	-93.2	-14.5	-173.8	-51.6	-53.4	0	0	0	114.2	R320 Y396	R320-H323 PolarHBondContact NH2-O 3.39Å; H323-Y396 AromaticContact ND1-CZ 3.57Å; H323-Y396 PolarHBondContact ND1-OH 3.39Å
324	K	83.7	Confident	93	Very high	150 Å²	150	33 Å²	33	65%	0.652	17%	0.173	S	C	*	.	S	Bend	trans	-68.9	145.1	-177.5	-63.8	-174.2	178.3	-179.9	0	111.1	R320 D326 A327	R320-K324 PolarHBondContact NH2-O 3.31Å; K324-D326 WeakPolarHBondContact CB-OD1 3.26Å; K324-D326 PolarHBondContact O-N 2.64Å; K324-D326 VanDerWaalsContact O-N 3.09Å; K324-A327 WeakPolarHBondContact O-CB 3.49Å; K324-A327 PolarHBondContact O-N 2.91Å
325	P	79.5	Confident	93.1	Very high	105 Å²	105	33.6 Å²	33.6	68%	0.682	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-34.2	-179.4	-29.4	36.5	0	0	0	115	R320	R320-P325 VanDerWaalsContact NH2-CA 3.33Å
326	D	84.4	Confident	93	Very high	107 Å²	107	35.4 Å²	35.4	57%	0.572	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	9.8	179.9	63.4	-24.8	0	0	0	113.9	K324 E328 N357	K324-D326 WeakPolarHBondContact CB-OD1 3.26Å; K324-D326 PolarHBondContact O-N 2.64Å; K324-D326 VanDerWaalsContact O-N 3.09Å; D326-E328 PolarHBondContact O-N 3.15Å; D326-N357 PolarHBondContact O-ND2 2.74Å; D326-N357 VanDerWaalsContact O-ND2 3.08Å
327	A	89.9	Confident	92.9	Very high	10 Å²	10	39.1 Å²	39.1	8%	0.083	21%	0.212	C	C	.	.			trans	-58.2	138.3	178.7	0	0	0	0	0	111.2	R320 G322 K324 N357	R320-A327 HydrophobicContact CG-CB 3.88Å; G322-A327 WeakPolarHBondContact O-CB 3.48Å; K324-A327 WeakPolarHBondContact O-CB 3.49Å; K324-A327 PolarHBondContact O-N 2.91Å; A327-N357 PolarHBondContact O-ND2 3.26Å; A327-N357 PolarHBondContact O-OD1 2.98Å
328	E	92.8	Very high	92.6	Very high	67 Å²	67	44.3 Å²	44.3	31%	0.313	23%	0.231	S	C	.	.			trans	-65.7	157.4	177.9	-66.8	-63	158.9	0	0	111.9	L57 L60 T321 D326 L352	L57-E328 HydrophobicContact CD1-CG 4.34Å; L60-E328 HydrophobicContact CD2-CB 4.05Å; L60-E328 HydrophobicContact CD2-CG 4.32Å; T321-E328 PolarHBondContact N-O 3.44Å; T321-E328 PolarHBondContact OG1-O 3.2Å; D326-E328 PolarHBondContact O-N 3.15Å; E328-L352 HydrophobicContact CB-CD1 3.98Å; E328-L352 HydrophobicContact CG-CD1 4.29Å
329	W	95.6	Very high	92.3	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.9	175.6	-77.7	79.8	0	0	0	110.1	L231 L304 F318 A319 R320 C353 F356 F360	L231-W329 HydrophobicContact CD2-CH2 4.43Å; L231-W329 HydrophobicContact CD2-CZ2 3.52Å; L304-W329 HydrophobicContact CD2-CH2 3.68Å; L304-W329 HydrophobicContact CD2-CZ2 4.21Å; L304-W329 HydrophobicContact CG-CH2 3.97Å; F318-W329 HydrophobicContact CB-CE3 4.05Å; F318-W329 HydrophobicContact CB-CZ3 4.13Å; A319-W329 WeakPolarHBondContact O-CA 3.45Å; R320-W329 HydrophobicContact CB-CD2 4.2Å; R320-W329 HydrophobicContact CB-CE3 4.4Å; R320-W329 HydrophobicContact CB-CH2 4.08Å; R320-W329 HydrophobicContact CB-CZ2 3.84Å; R320-W329 HydrophobicContact CB-CZ3 4.36Å; R320-W329 HydrophobicContact CG-CD2 4.45Å; R320-W329 HydrophobicContact CG-CZ2 4.03Å; W329-C353 HydrophobicContact CB-CB 3.75Å; W329-C353 WeakPolarHBondContact O-CB 3.11Å; W329-C353 PolarHBondContact O-N 2.91Å; W329-F356 HydrophobicContact CB-CB 4.14Å; W329-F356 HydrophobicContact CB-CD2 3.6Å; W329-F356 HydrophobicContact CB-CE2 4.39Å; W329-F356 HydrophobicContact CB-CG 4.18Å; W329-F356 HydrophobicContact CD2-CD2 4.11Å; W329-F356 HydrophobicContact CE3-CD2 4.45Å; W329-F356 HydrophobicContact CG-CB 4.23Å; W329-F356 AromaticContact CG-CD2 3.75Å; W329-F356 HydrophobicContact CG-CD2 3.75Å; W329-F356 HydrophobicContact CG-CG 4.45Å; W329-F360 HydrophobicContact CZ2-CE2 4.5Å
330	I	97.3	Very high	91.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.7	174.8	55.1	173.9	0	0	0	110.7	L60 L63 L64 F84 F318 A319 T321 V350 S351 C353	L60-I330 HydrophobicContact CD1-CG2 3.51Å; L63-I330 HydrophobicContact CD2-CD1 3.48Å; L63-I330 VanDerWaalsContact CD2-CD1 3.48Å; L64-I330 HydrophobicContact CD2-CG2 3.99Å; F84-I330 HydrophobicContact CE1-CD1 4Å; F84-I330 HydrophobicContact CE1-CG1 4.49Å; F84-I330 HydrophobicContact CZ-CD1 3.78Å; F318-I330 CarbonylContact C-O 3.59Å; F318-I330 VanDerWaalsContact CA-O 3.24Å; F318-I330 WeakPolarHBondContact CA-O 3.45Å; A319-I330 HydrophobicContact CB-CD1 4.37Å; A319-I330 HydrophobicContact CB-CG1 4.02Å; A319-I330 PolarHBondContact N-O 2.91Å; A319-I330 WeakPolarHBondContact O-CG1 3.31Å; A319-I330 PolarHBondContact O-N 2.76Å; T321-I330 HydrophobicContact CG2-CD1 4.25Å; T321-I330 HydrophobicContact CG2-CG1 4.12Å; T321-I330 HydrophobicContact CG2-CG2 3.81Å; I330-V350 HydrophobicContact CB-CG1 3.9Å; I330-V350 HydrophobicContact CD1-CG1 3.98Å; I330-V350 HydrophobicContact CG1-CG1 4.43Å; I330-V350 HydrophobicContact CG2-CG1 4.28Å; I330-S351 CarbonylContact C-O 3.58Å; I330-S351 VanDerWaalsContact CA-O 3.29Å; I330-S351 WeakPolarHBondContact CA-O 3.48Å; I330-C353 VanDerWaalsContact C-SG 3.51Å
331	F	98.2	Very high	91.3	Very high	32 Å²	32	59.9 Å²	59.9	14%	0.14	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.1	172.7	172.6	-105.4	0	0	0	109	V316 S317 F318 D333 V350 S351 C353 Q382	V316-F331 HydrophobicContact CB-CE2 3.62Å; V316-F331 HydrophobicContact CB-CZ 3.93Å; V316-F331 HydrophobicContact CG1-CE2 4.13Å; V316-F331 HydrophobicContact CG1-CZ 3.91Å; V316-F331 HydrophobicContact CG2-CE2 3.64Å; V316-F331 HydrophobicContact CG2-CZ 4.22Å; S317-F331 CarbonylContact O-C 3.35Å; S317-F331 WeakPolarHBondContact O-CA 3.41Å; F318-F331 HydrophobicContact CD1-CB 4.16Å; F318-F331 AromaticContact CD1-CD2 3.97Å; F318-F331 HydrophobicContact CD1-CD2 3.97Å; F318-F331 HydrophobicContact CD2-CD2 4.42Å; F318-F331 HydrophobicContact CE1-CB 3.99Å; F318-F331 AromaticContact CE1-CD2 3.42Å; F318-F331 HydrophobicContact CE1-CD2 3.42Å; F318-F331 VanDerWaalsContact CE1-CD2 3.42Å; F318-F331 HydrophobicContact CE1-CE2 4.28Å; F318-F331 HydrophobicContact CE1-CG 4.11Å; F318-F331 AromaticContact CE2-CD2 3.93Å; F318-F331 HydrophobicContact CE2-CD2 3.93Å; F318-F331 HydrophobicContact CE2-CE2 4.15Å; F318-F331 HydrophobicContact CG-CD2 4.45Å; F318-F331 AromaticContact CZ-CD2 3.4Å; F318-F331 HydrophobicContact CZ-CD2 3.4Å; F318-F331 VanDerWaalsContact CZ-CD2 3.4Å; F318-F331 AromaticContact CZ-CE2 3.81Å; F318-F331 HydrophobicContact CZ-CE2 3.81Å; F318-F331 HydrophobicContact CZ-CG 4.45Å; F331-D333 HydrophobicContact CE1-CB 3.89Å; F331-D333 HydrophobicContact CZ-CB 4.1Å; F331-V350 CarbonylContact O-C 3.58Å; F331-V350 VanDerWaalsContact O-CA 3.26Å; F331-V350 WeakPolarHBondContact O-CA 3.31Å; F331-S351 PolarHBondContact N-O 3.11Å; F331-S351 PolarHBondContact O-N 3.44Å; F331-C353 VanDerWaalsContact CB-SG 3.58Å; F331-C353 PolarHBondContact N-SG 3.16Å; F331-C353 VanDerWaalsContact N-SG 3.39Å; F331-Q382 HydrophobicContact CG-CG 4.49Å
332	F	98.6	Very high	90.6	Very high	1 Å²	1	64.1 Å²	64.1	0%	0.004	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.6	178.3	164.9	-112.7	0	0	0	111	I70 D80 F84 S317 P348 E349 V350	I70-F332 HydrophobicContact CB-CZ 3.89Å; I70-F332 VanDerWaalsContact N-CE2 3.26Å; I70-F332 VanDerWaalsContact O-CZ 3.26Å; I70-F332 WeakPolarHBondContact O-CZ 3.35Å; D80-F332 HydrophobicContact CB-CE1 4.48Å; F84-F332 HydrophobicContact CB-CD1 3.42Å; F84-F332 VanDerWaalsContact CB-CD1 3.42Å; F84-F332 HydrophobicContact CB-CE1 3.53Å; F84-F332 HydrophobicContact CB-CG 4.23Å; F84-F332 HydrophobicContact CB-CZ 4.43Å; F84-F332 HydrophobicContact CD1-CB 3.63Å; F84-F332 AromaticContact CD1-CD1 3.7Å; F84-F332 HydrophobicContact CD1-CD1 3.7Å; F84-F332 AromaticContact CD1-CG 3.8Å; F84-F332 HydrophobicContact CD1-CG 3.8Å; F84-F332 HydrophobicContact CD2-CB 4.1Å; F84-F332 AromaticContact CD2-CD1 3.62Å; F84-F332 HydrophobicContact CD2-CD1 3.62Å; F84-F332 AromaticContact CD2-CD2 3.84Å; F84-F332 HydrophobicContact CD2-CD2 3.84Å; F84-F332 AromaticContact CD2-CE1 3.95Å; F84-F332 HydrophobicContact CD2-CE1 3.95Å; F84-F332 HydrophobicContact CD2-CE2 4.17Å; F84-F332 AromaticContact CD2-CG 3.55Å; F84-F332 HydrophobicContact CD2-CG 3.55Å; F84-F332 HydrophobicContact CD2-CZ 4.21Å; F84-F332 HydrophobicContact CE1-CB 3.44Å; F84-F332 VanDerWaalsContact CE1-CB 3.44Å; F84-F332 HydrophobicContact CE1-CD1 4.36Å; F84-F332 AromaticContact CE1-CG 3.99Å; F84-F332 HydrophobicContact CE1-CG 3.99Å; F84-F332 HydrophobicContact CE2-CB 3.92Å; F84-F332 HydrophobicContact CE2-CD1 4.28Å; F84-F332 AromaticContact CE2-CD2 3.87Å; F84-F332 HydrophobicContact CE2-CD2 3.87Å; F84-F332 AromaticContact CE2-CG 3.74Å; F84-F332 HydrophobicContact CE2-CG 3.74Å; F84-F332 HydrophobicContact CG-CB 3.97Å; F84-F332 AromaticContact CG-CD1 3.28Å; F84-F332 HydrophobicContact CG-CD1 3.28Å; F84-F332 HydrophobicContact CG-CD2 4.33Å; F84-F332 AromaticContact CG-CE1 3.8Å; F84-F332 HydrophobicContact CG-CE1 3.8Å; F84-F332 AromaticContact CG-CG 3.58Å; F84-F332 HydrophobicContact CG-CG 3.58Å; F84-F332 HydrophobicContact CZ-CB 3.59Å; F84-F332 HydrophobicContact CZ-CD2 4.39Å; F84-F332 AromaticContact CZ-CG 3.96Å; F84-F332 HydrophobicContact CZ-CG 3.96Å; S317-F332 PolarHBondContact N-O 3.18Å; S317-F332 PolarHBondContact O-N 3.09Å; F332-P348 HydrophobicContact CE2-CB 4.09Å; F332-E349 WeakPolarHBondContact CA-O 3.43Å; F332-V350 HydrophobicContact CB-CG2 4.36Å; F332-V350 HydrophobicContact CD2-CG2 3.89Å
333	D	98.6	Very high	90.4	Very high	21 Å²	21	67 Å²	67	11%	0.112	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.5	170.9	-172.7	-18.1	0	0	0	109.9	H314 V316 F331 M335 A336 P348 E349	H314-D333 IonicContact CD2-OD2 2.79Å; H314-D333 IonicContact CE1-OD1 3.91Å; H314-D333 PolarHBondContact CE1-OD1 3.17Å; H314-D333 IonicContact CE1-OD2 2.67Å; H314-D333 IonicContact NE2-OD1 2.86Å; H314-D333 PolarHBondContact NE2-OD1 3.39Å; H314-D333 IonicContact NE2-OD2 3.43Å; H314-D333 PolarHBondContact NE2-OD2 3.41Å; V316-D333 HydrophobicContact CG1-CB 4.18Å; F331-D333 HydrophobicContact CE1-CB 3.89Å; F331-D333 HydrophobicContact CZ-CB 4.1Å; D333-M335 PolarHBondContact O-N 2.89Å; D333-M335 PolarHBondContact OD1-N 2.6Å; D333-A336 HydrophobicContact CB-CB 4.04Å; D333-A336 PolarHBondContact OD1-N 3.01Å; D333-P348 CarbonylContact O-C 3.41Å; D333-P348 VanDerWaalsContact O-CA 3.26Å; D333-P348 WeakPolarHBondContact O-CA 3.28Å; D333-E349 PolarHBondContact N-O 3.32Å; D333-E349 PolarHBondContact O-N 2.67Å
334	S	98	Very high	90.9	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.007	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-16.3	-179.4	64.6	0	0	0	0	114.2	I70 G72	I70-S334 WeakPolarHBondContact O-CA 3.5Å; I70-S334 VanDerWaalsContact O-CB 3.27Å; I70-S334 WeakPolarHBondContact O-CB 3.13Å; G72-S334 PolarHBondContact N-O 3.43Å
335	M	95.8	Very high	91.4	Very high	58 Å²	58	56.6 Å²	56.6	29%	0.286	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	36.8	-175	-52.4	-177.3	-60.9	0	0	111.4	C77 H314 D333 D337 N346	C77-M335 HydrophobicContact CB-CE 3.65Å; C77-M335 HydrophobicContact CB-SD 4.48Å; H314-M335 VanDerWaalsContact ND1-CE 3.32Å; H314-M335 WeakPolarHBondContact ND1-CE 3.38Å; D333-M335 PolarHBondContact O-N 2.89Å; D333-M335 PolarHBondContact OD1-N 2.6Å; M335-D337 PolarHBondContact O-N 3.37Å; M335-N346 HydrophobicContact CB-CB 4.3Å; M335-N346 HydrophobicContact CG-CB 4.16Å
336	A	96.2	Very high	92.2	Very high	41 Å²	41	53.1 Å²	53.1	34%	0.339	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	-33.8	-177.4	0	0	0	0	0	113.4	D333 V347 E349	D333-A336 HydrophobicContact CB-CB 4.04Å; D333-A336 PolarHBondContact OD1-N 3.01Å; A336-V347 PolarHBondContact N-O 2.94Å; A336-E349 HydrophobicContact CB-CB 3.52Å
337	D	94.8	Very high	92.8	Very high	81 Å²	81	48.4 Å²	48.4	43%	0.433	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	176.7	177.1	-158.3	-5.2	0	0	0	110.3	R66 M335 N346 V347	R66-D337 IonicContact NH1-OD2 2.75Å; M335-D337 PolarHBondContact O-N 3.37Å; D337-N346 CarbonylContact O-C 3.58Å; D337-N346 WeakPolarHBondContact O-CA 3.24Å; D337-V347 HydrophobicContact CB-CB 4.21Å; D337-V347 PolarHBondContact N-O 2.9Å; D337-V347 VanDerWaalsContact N-O 3.16Å; D337-V347 PolarHBondContact O-N 2.84Å
338	R	93.6	Very high	93.2	Very high	108 Å²	108	47.9 Å²	47.9	41%	0.408	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	126.7	179.1	-166.7	171.4	-168.5	-124.2	-9.2	112.1	E341 A342 G344 H345	R338-E341 PolarHBondContact NH1-O 2.71Å; R338-E341 PolarHBondContact NH2-O 2.92Å; R338-A342 PolarHBondContact NH2-O 2.96Å; R338-G344 PolarHBondContact NH2-O 3.34Å; R338-H345 WeakPolarHBondContact CG-O 3.03Å
339	E	91.9	Very high	93.5	Very high	114 Å²	114	47.9 Å²	47.9	53%	0.533	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122	173.4	-80.3	-179.2	-162.4	0	0	110.6	G344 H345 V347	E339-G344 CarbonylContact O-C 3.59Å; E339-G344 WeakPolarHBondContact O-CA 3.44Å; E339-H345 PolarHBondContact N-O 3.02Å; E339-H345 PolarHBondContact O-N 2.85Å; E339-H345 IonicContact OE2-NE2 2.77Å; E339-V347 HydrophobicContact CB-CG2 4.09Å; E339-V347 HydrophobicContact CG-CG2 3.67Å
340	G	87.6	Confident	93.6	Very high	56 Å²	56	47.8 Å²	47.8	58%	0.577	27%	0.274	S	S	*	.	S	Bend	trans	89.3	158.1	-173.3	0	0	0	0	0	113.4
341	E	80.9	Confident	93.6	Very high	169 Å²	169	48.9 Å²	48.9	79%	0.79	28%	0.282	S	S	*	.	S	Bend	trans	-76.1	-137.4	178.1	-61.4	-171.3	172.3	0	0	111	R338 S343 G344	R338-E341 PolarHBondContact NH1-O 2.71Å; R338-E341 PolarHBondContact NH2-O 2.92Å; E341-S343 PolarHBondContact O-N 2.72Å; E341-G344 PolarHBondContact O-N 2.99Å
342	A	78.1	Confident	93.5	Very high	92 Å²	92	50.2 Å²	50.2	76%	0.76	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-34	-174.1	0	0	0	0	0	114.5	R338	R338-A342 PolarHBondContact NH2-O 2.96Å
343	S	82.4	Confident	93.4	Very high	84 Å²	84	50.2 Å²	50.2	59%	0.587	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	6.6	178.2	62.9	0	0	0	0	114.7	D39 E341	D39-S343 WeakPolarHBondContact CB-O 3.39Å; E341-S343 PolarHBondContact O-N 2.72Å
344	G	91.2	Very high	92.9	Very high	12 Å²	12	53.8 Å²	53.8	12%	0.124	31%	0.313	C	S	.	.			trans	-78	179.3	179.5	0	0	0	0	0	114	R338 E339 E341	R338-G344 PolarHBondContact NH2-O 3.34Å; E339-G344 CarbonylContact O-C 3.59Å; E339-G344 WeakPolarHBondContact O-CA 3.44Å; E341-G344 PolarHBondContact O-N 2.99Å
345	H	94.2	Very high	92.3	Very high	29 Å²	29	57.7 Å²	57.7	13%	0.134	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	153	-177.7	60.1	-88.6	0	0	0	111.5	D39 G41 Q71 R338 E339	D39-H345 WeakPolarHBondContact O-CB 2.97Å; D39-H345 IonicContact OD2-CE1 3.83Å; D39-H345 IonicContact OD2-ND1 3.84Å; D39-H345 PolarHBondContact OD2-ND1 3.41Å; D39-H345 VanDerWaalsContact OD2-ND1 3.16Å; G41-H345 VanDerWaalsContact CA-CE1 3.4Å; G41-H345 WeakPolarHBondContact CA-CE1 3.46Å; G41-H345 PolarHBondContact N-ND1 2.92Å; Q71-H345 PolarHBondContact NE2-CD2 2.96Å; Q71-H345 VanDerWaalsContact NE2-CD2 3.28Å; R338-H345 WeakPolarHBondContact CG-O 3.03Å; E339-H345 PolarHBondContact N-O 3.02Å; E339-H345 PolarHBondContact O-N 2.85Å; E339-H345 IonicContact OE2-NE2 2.77Å
346	N	96	Very high	92.1	Very high	31 Å²	31	55 Å²	55	17%	0.166	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	151.1	176.9	-63.3	-40.2	0	0	0	110.6	Q71 G72 M335 D337	Q71-N346 VanDerWaalsContact CG-O 3.31Å; Q71-N346 WeakPolarHBondContact CG-O 3.37Å; Q71-N346 PolarHBondContact NE2-O 2.9Å; G72-N346 WeakPolarHBondContact O-CB 3.39Å; G72-N346 PolarHBondContact O-ND2 2.75Å; M335-N346 HydrophobicContact CB-CB 4.3Å; M335-N346 HydrophobicContact CG-CB 4.16Å; D337-N346 CarbonylContact O-C 3.58Å; D337-N346 WeakPolarHBondContact O-CA 3.24Å
347	V	97.2	Very high	91.7	Very high	8 Å²	8	55.3 Å²	55.3	5%	0.048	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.7	175.1	178.6	0	0	0	0	107.7	R66 P67 A336 D337 E339	R66-V347 HydrophobicContact CB-CG1 4.14Å; P67-V347 HydrophobicContact CB-CG1 4.14Å; A336-V347 PolarHBondContact N-O 2.94Å; D337-V347 HydrophobicContact CB-CB 4.21Å; D337-V347 PolarHBondContact N-O 2.9Å; D337-V347 VanDerWaalsContact N-O 3.16Å; D337-V347 PolarHBondContact O-N 2.84Å; E339-V347 HydrophobicContact CB-CG2 4.09Å; E339-V347 HydrophobicContact CG-CG2 3.67Å
348	P	98.4	Very high	91.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	151.1	179.1	35.5	-37.5	0	0	0	111.3	P67 K68 I70 Q71 Y122 F332 D333	P67-P348 WeakPolarHBondContact CA-O 3.46Å; P67-P348 HydrophobicContact CB-CG 4.48Å; K68-P348 PolarHBondContact N-O 3.05Å; K68-P348 CarbonylContact O-C 3.56Å; K68-P348 VanDerWaalsContact O-CB 3.28Å; K68-P348 WeakPolarHBondContact O-CB 3.3Å; K68-P348 WeakPolarHBondContact O-CG 3.19Å; I70-P348 WeakPolarHBondContact O-CB 3.48Å; Q71-P348 HydrophobicContact CB-CG 4.17Å; Y122-P348 HydrophobicContact CD2-CG 4.05Å; Y122-P348 HydrophobicContact CE2-CG 3.69Å; F332-P348 HydrophobicContact CE2-CB 4.09Å; D333-P348 CarbonylContact O-C 3.41Å; D333-P348 VanDerWaalsContact O-CA 3.26Å; D333-P348 WeakPolarHBondContact O-CA 3.28Å
349	E	98.6	Very high	91.2	Very high	66 Å²	66	52.8 Å²	52.8	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.6	179.7	-174.6	172	171.4	0	0	111.2	F332 D333 A336	F332-E349 WeakPolarHBondContact CA-O 3.43Å; D333-E349 PolarHBondContact N-O 3.32Å; D333-E349 PolarHBondContact O-N 2.67Å; A336-E349 HydrophobicContact CB-CB 3.52Å
350	V	98.5	Very high	91.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.2	165.8	-176.3	0	0	0	0	108.9	L63 L64 G65 K68 F84 I330 F331 F332	L63-V350 HydrophobicContact CD1-CG2 4.18Å; L63-V350 HydrophobicContact CD2-CG1 4.22Å; L63-V350 HydrophobicContact CG-CB 4.34Å; L63-V350 HydrophobicContact CG-CG1 4.03Å; L63-V350 HydrophobicContact CG-CG2 4.33Å; L64-V350 HydrophobicContact CD2-CG1 4.22Å; G65-V350 PolarHBondContact N-O 2.9Å; G65-V350 PolarHBondContact O-N 2.91Å; G65-V350 VanDerWaalsContact O-N 3.12Å; K68-V350 HydrophobicContact CB-CB 4.17Å; K68-V350 HydrophobicContact CB-CG2 3.92Å; F84-V350 HydrophobicContact CE2-CG2 3.91Å; F84-V350 HydrophobicContact CZ-CG1 4.4Å; F84-V350 HydrophobicContact CZ-CG2 3.98Å; I330-V350 HydrophobicContact CB-CG1 3.9Å; I330-V350 HydrophobicContact CD1-CG1 3.98Å; I330-V350 HydrophobicContact CG1-CG1 4.43Å; I330-V350 HydrophobicContact CG2-CG1 4.28Å; F331-V350 CarbonylContact O-C 3.58Å; F331-V350 VanDerWaalsContact O-CA 3.26Å; F331-V350 WeakPolarHBondContact O-CA 3.31Å; F332-V350 HydrophobicContact CB-CG2 4.36Å; F332-V350 HydrophobicContact CD2-CG2 3.89Å
351	S	97.5	Very high	91.1	Very high	23 Å²	23	47.9 Å²	47.9	16%	0.161	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	155.5	179.5	57.3	0	0	0	0	111.5	I330 F331 Q382	I330-S351 CarbonylContact C-O 3.58Å; I330-S351 VanDerWaalsContact CA-O 3.29Å; I330-S351 WeakPolarHBondContact CA-O 3.48Å; F331-S351 PolarHBondContact N-O 3.11Å; F331-S351 PolarHBondContact O-N 3.44Å; S351-Q382 PolarHBondContact OG-NE2 2.87Å
352	L	96.2	Very high	91.3	Very high	59 Å²	59	44.9 Å²	44.9	31%	0.309	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.6	177.8	-173.3	71.5	0	0	0	110	L60 L64 E328 V354	L60-L352 HydrophobicContact CD2-CD1 4.21Å; L64-L352 HydrophobicContact CD1-CB 4.2Å; L64-L352 HydrophobicContact CD2-CB 4.26Å; E328-L352 HydrophobicContact CB-CD1 3.98Å; E328-L352 HydrophobicContact CG-CD1 4.29Å; L352-V354 HydrophobicContact CD2-CG2 4.5Å; L352-V354 PolarHBondContact O-N 2.88Å; L352-V354 VanDerWaalsContact O-N 3.14Å
353	C	95.6	Very high	91.8	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.007	26%	0.256	C	S	.	.			trans	-84.5	83	176	-65.1	0	0	0	0	110.5	W329 I330 F331 F356	W329-C353 HydrophobicContact CB-CB 3.75Å; W329-C353 WeakPolarHBondContact O-CB 3.11Å; W329-C353 PolarHBondContact O-N 2.91Å; I330-C353 VanDerWaalsContact C-SG 3.51Å; F331-C353 VanDerWaalsContact CB-SG 3.58Å; F331-C353 PolarHBondContact N-SG 3.16Å; F331-C353 VanDerWaalsContact N-SG 3.39Å; C353-F356 HydrophobicContact CB-CB 4.27Å; C353-F356 HydrophobicContact CB-CD1 3.61Å; C353-F356 HydrophobicContact CB-CD2 3.64Å; C353-F356 HydrophobicContact CB-CE1 3.78Å; C353-F356 HydrophobicContact CB-CE2 3.79Å; C353-F356 HydrophobicContact CB-CG 3.57Å; C353-F356 HydrophobicContact CB-CZ 3.89Å; C353-F356 PolarHBondContact O-N 3.27Å
354	V	88.3	Confident	92.2	Very high	97 Å²	97	45.6 Å²	45.6	59%	0.588	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	141.1	-179.1	-165.1	0	0	0	0	110	L352 F356	L352-V354 HydrophobicContact CD2-CG2 4.5Å; L352-V354 PolarHBondContact O-N 2.88Å; L352-V354 VanDerWaalsContact O-N 3.14Å; V354-F356 PolarHBondContact O-N 3.02Å
355	E	85.8	Confident	92.1	Very high	83 Å²	83	49 Å²	49	39%	0.388	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	2.2	179.1	-48.2	-169.4	90.1	0	0	116.8	N357 R358 W359	E355-N357 VanDerWaalsContact C-N 3.28Å; E355-N357 PolarHBondContact O-N 3.28Å; E355-R358 HydrophobicContact CB-CB 4.43Å; E355-R358 WeakPolarHBondContact O-CB 3.36Å; E355-R358 PolarHBondContact O-N 3.06Å; E355-R358 IonicContact OE1-CZ 2.57Å; E355-R358 IonicContact OE1-NH1 2.69Å; E355-R358 PolarHBondContact OE1-NH1 3.1Å; E355-W359 VanDerWaalsContact O-CD1 3.25Å; E355-W359 PolarHBondContact O-N 2.79Å; E355-W359 VanDerWaalsContact O-N 3.11Å
356	F	92.1	Very high	91.9	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.009	28%	0.278	C	S	.	.	H	α-helix	trans	-56.1	-43.6	176.6	-92.8	34.6	0	0	0	112.2	F318 W329 C353 V354 R358 W359 F360 Q382 F383 L386	F318-F356 AromaticContact CD1-CE2 3.55Å; F318-F356 HydrophobicContact CD1-CE2 3.55Å; F318-F356 AromaticContact CD1-CZ 3.75Å; F318-F356 HydrophobicContact CD1-CZ 3.75Å; F318-F356 AromaticContact CE1-CE2 3.88Å; F318-F356 HydrophobicContact CE1-CE2 3.88Å; F318-F356 AromaticContact CE1-CZ 3.54Å; F318-F356 HydrophobicContact CE1-CZ 3.54Å; F318-F356 HydrophobicContact CG-CE2 4.37Å; F318-F356 HydrophobicContact CZ-CZ 4.43Å; W329-F356 HydrophobicContact CB-CB 4.14Å; W329-F356 HydrophobicContact CB-CD2 3.6Å; W329-F356 HydrophobicContact CB-CE2 4.39Å; W329-F356 HydrophobicContact CB-CG 4.18Å; W329-F356 HydrophobicContact CD2-CD2 4.11Å; W329-F356 HydrophobicContact CE3-CD2 4.45Å; W329-F356 HydrophobicContact CG-CB 4.23Å; W329-F356 AromaticContact CG-CD2 3.75Å; W329-F356 HydrophobicContact CG-CD2 3.75Å; W329-F356 HydrophobicContact CG-CG 4.45Å; C353-F356 HydrophobicContact CB-CB 4.27Å; C353-F356 HydrophobicContact CB-CD1 3.61Å; C353-F356 HydrophobicContact CB-CD2 3.64Å; C353-F356 HydrophobicContact CB-CE1 3.78Å; C353-F356 HydrophobicContact CB-CE2 3.79Å; C353-F356 HydrophobicContact CB-CG 3.57Å; C353-F356 HydrophobicContact CB-CZ 3.89Å; C353-F356 PolarHBondContact O-N 3.27Å; V354-F356 PolarHBondContact O-N 3.02Å; F356-R358 VanDerWaalsContact C-N 3.27Å; F356-R358 PolarHBondContact O-N 3.37Å; F356-W359 PolarHBondContact O-N 3.2Å; F356-W359 VanDerWaalsContact O-N 3.16Å; F356-F360 HydrophobicContact CB-CD2 4.29Å; F356-F360 HydrophobicContact CB-CE2 4.45Å; F356-F360 AromaticContact CD2-CE2 3.96Å; F356-F360 HydrophobicContact CD2-CE2 3.96Å; F356-F360 HydrophobicContact CG-CE2 4.43Å; F356-F360 WeakPolarHBondContact O-CB 3.1Å; F356-F360 VanDerWaalsContact O-CD2 3.29Å; F356-F360 WeakPolarHBondContact O-CD2 3.11Å; F356-F360 PolarHBondContact O-N 3.17Å; F356-Q382 HydrophobicContact CE1-CB 4.32Å; F356-Q382 HydrophobicContact CZ-CB 4.46Å; F356-F383 HydrophobicContact CD1-CB 4.22Å; F356-F383 AromaticContact CD1-CD2 3.48Å; F356-F383 HydrophobicContact CD1-CD2 3.48Å; F356-F383 VanDerWaalsContact CD1-CD2 3.48Å; F356-F383 HydrophobicContact CD1-CE2 4.34Å; F356-F383 HydrophobicContact CD1-CG 4.33Å; F356-F383 VanDerWaalsContact CE1-CA 3.46Å; F356-F383 HydrophobicContact CE1-CB 3.59Å; F356-F383 AromaticContact CE1-CD2 3.5Å; F356-F383 HydrophobicContact CE1-CD2 3.5Å; F356-F383 HydrophobicContact CE1-CG 4.01Å; F356-F383 HydrophobicContact CG-CD2 4.05Å; F356-F383 HydrophobicContact CZ-CB 4.35Å; F356-F383 HydrophobicContact CZ-CD2 4.12Å; F356-L386 HydrophobicContact CD2-CD2 4.13Å; F356-L386 HydrophobicContact CE2-CB 4.36Å; F356-L386 HydrophobicContact CE2-CD2 3.47Å; F356-L386 VanDerWaalsContact CE2-CD2 3.47Å; F356-L386 HydrophobicContact CE2-CG 4.37Å; F356-L386 HydrophobicContact CZ-CB 4.07Å; F356-L386 HydrophobicContact CZ-CD2 3.87Å
357	N	87.6	Confident	91.7	Very high	47 Å²	47	57.8 Å²	57.8	25%	0.251	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-34.3	177.5	-73.4	-27	0	0	0	112.8	D326 A327 E355 C361	D326-N357 PolarHBondContact O-ND2 2.74Å; D326-N357 VanDerWaalsContact O-ND2 3.08Å; A327-N357 PolarHBondContact O-ND2 3.26Å; A327-N357 PolarHBondContact O-OD1 2.98Å; E355-N357 VanDerWaalsContact C-N 3.28Å; E355-N357 PolarHBondContact O-N 3.28Å; N357-C361 PolarHBondContact O-N 3.45Å
358	R	89.9	Confident	91.4	Very high	119 Å²	119	57.5 Å²	57.5	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-64.9	-47.6	174.4	173.6	-171.6	172.5	-173.2	-1.1	110.6	E355 F356 C361 N364	E355-R358 HydrophobicContact CB-CB 4.43Å; E355-R358 WeakPolarHBondContact O-CB 3.36Å; E355-R358 PolarHBondContact O-N 3.06Å; E355-R358 IonicContact OE1-CZ 2.57Å; E355-R358 IonicContact OE1-NH1 2.69Å; E355-R358 PolarHBondContact OE1-NH1 3.1Å; F356-R358 VanDerWaalsContact C-N 3.27Å; F356-R358 PolarHBondContact O-N 3.37Å; R358-C361 WeakPolarHBondContact O-CB 3.19Å; R358-C361 PolarHBondContact O-N 2.96Å; R358-N364 PolarHBondContact O-ND2 2.78Å
359	W	88.1	Confident	91.1	Very high	16 Å²	16	59.3 Å²	59.3	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-72.7	-32.1	-177.7	-69.5	115.7	0	0	0	113.4	E355 F356 C361 Q367 L368 Q371 L379 F383	E355-W359 VanDerWaalsContact O-CD1 3.25Å; E355-W359 PolarHBondContact O-N 2.79Å; E355-W359 VanDerWaalsContact O-N 3.11Å; F356-W359 PolarHBondContact O-N 3.2Å; F356-W359 VanDerWaalsContact O-N 3.16Å; W359-C361 VanDerWaalsContact C-N 3.28Å; W359-C361 PolarHBondContact O-N 3.16Å; W359-Q367 HydrophobicContact CZ3-CG 4.47Å; W359-L368 HydrophobicContact CD2-CD1 4.29Å; W359-L368 HydrophobicContact CE3-CB 4.07Å; W359-L368 HydrophobicContact CE3-CD1 3.72Å; W359-L368 HydrophobicContact CE3-CG 4.42Å; W359-L368 HydrophobicContact CZ3-CB 4.45Å; W359-L368 HydrophobicContact CZ3-CD1 4.27Å; W359-Q371 HydrophobicContact CH2-CG 4.19Å; W359-Q371 HydrophobicContact CZ3-CB 4.49Å; W359-L379 HydrophobicContact CD2-CD2 4.12Å; W359-L379 HydrophobicContact CE3-CD2 4.32Å; W359-L379 HydrophobicContact CH2-CD2 3.9Å; W359-L379 HydrophobicContact CZ2-CD2 3.68Å; W359-L379 HydrophobicContact CZ3-CD2 4.22Å; W359-F383 HydrophobicContact CB-CD2 3.82Å; W359-F383 HydrophobicContact CB-CE1 4.11Å; W359-F383 HydrophobicContact CB-CE2 3.27Å; W359-F383 HydrophobicContact CB-CG 4.46Å; W359-F383 HydrophobicContact CB-CZ 3.43Å; W359-F383 VanDerWaalsContact CB-CZ 3.43Å; W359-F383 AromaticContact CD1-CD2 3.89Å; W359-F383 HydrophobicContact CG-CD2 4.07Å; W359-F383 HydrophobicContact CG-CE1 4.43Å; W359-F383 AromaticContact CG-CE2 3.99Å; W359-F383 HydrophobicContact CG-CE2 3.99Å; W359-F383 HydrophobicContact CG-CG 4.35Å; W359-F383 HydrophobicContact CG-CZ 4.17Å
360	F	88.4	Confident	90.7	Very high	22 Å²	22	62.4 Å²	62.4	10%	0.096	31%	0.312	C	S	.	.	H	α-helix	trans	-78.5	-8.8	174.4	-78.2	-56.4	0	0	0	114.4	I228 P229 L231 W329 F356 P362 F383 L386	I228-F360 HydrophobicContact CG2-CE1 4.46Å; P229-F360 HydrophobicContact CB-CE1 4.45Å; P229-F360 WeakPolarHBondContact O-CE1 3.35Å; L231-F360 HydrophobicContact CD1-CB 3.56Å; L231-F360 HydrophobicContact CD1-CD1 4.38Å; L231-F360 HydrophobicContact CD1-CD2 4.36Å; L231-F360 HydrophobicContact CD1-CG 3.9Å; L231-F360 HydrophobicContact CD2-CD1 4.03Å; L231-F360 HydrophobicContact CD2-CD2 3.96Å; L231-F360 HydrophobicContact CD2-CE1 4.14Å; L231-F360 HydrophobicContact CD2-CE2 4.06Å; L231-F360 HydrophobicContact CD2-CG 3.94Å; L231-F360 HydrophobicContact CD2-CZ 4.13Å; L231-F360 HydrophobicContact CG-CB 4.01Å; L231-F360 HydrophobicContact CG-CD1 3.87Å; L231-F360 HydrophobicContact CG-CD2 4.36Å; L231-F360 HydrophobicContact CG-CE1 4.38Å; L231-F360 HydrophobicContact CG-CG 3.85Å; W329-F360 HydrophobicContact CZ2-CE2 4.5Å; F356-F360 HydrophobicContact CB-CD2 4.29Å; F356-F360 HydrophobicContact CB-CE2 4.45Å; F356-F360 AromaticContact CD2-CE2 3.96Å; F356-F360 HydrophobicContact CD2-CE2 3.96Å; F356-F360 HydrophobicContact CG-CE2 4.43Å; F356-F360 WeakPolarHBondContact O-CB 3.1Å; F356-F360 VanDerWaalsContact O-CD2 3.29Å; F356-F360 WeakPolarHBondContact O-CD2 3.11Å; F356-F360 PolarHBondContact O-N 3.17Å; F360-P362 WeakPolarHBondContact O-CD 3.41Å; F360-F383 HydrophobicContact CD2-CE2 4.46Å; F360-F383 HydrophobicContact CE2-CE2 4.31Å; F360-F383 HydrophobicContact CZ-CE2 4.48Å; F360-L386 HydrophobicContact CE1-CD2 4.49Å; F360-L386 HydrophobicContact CE2-CD2 3.85Å; F360-L386 HydrophobicContact CZ-CD2 3.43Å; F360-L386 VanDerWaalsContact CZ-CD2 3.43Å
361	C	87.4	Confident	90.3	Very high	45 Å²	45	63.7 Å²	63.7	30%	0.304	32%	0.318	S	S	.	.			trans	-57.5	122.8	176.3	-153.6	0	0	0	0	109.8	N357 R358 W359 E363 N364	N357-C361 PolarHBondContact O-N 3.45Å; R358-C361 WeakPolarHBondContact O-CB 3.19Å; R358-C361 PolarHBondContact O-N 2.96Å; W359-C361 VanDerWaalsContact C-N 3.28Å; W359-C361 PolarHBondContact O-N 3.16Å; C361-E363 PolarHBondContact O-N 3.3Å; C361-E363 VanDerWaalsContact O-N 3.13Å; C361-E363 PolarHBondContact SG-OE2 2.89Å; C361-N364 HydrophobicContact CB-CB 4.28Å; C361-N364 PolarHBondContact O-N 2.98Å
362	P	85.5	Confident	90	Very high	106 Å²	106	62.6 Å²	62.6	69%	0.688	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-54.8	-33.9	-178.1	-28.1	35.8	0	0	0	113.9	F360 N364 Y365	F360-P362 WeakPolarHBondContact O-CD 3.41Å; P362-N364 PolarHBondContact O-N 3.06Å; P362-Y365 VanDerWaalsContact O-CB 3.29Å; P362-Y365 WeakPolarHBondContact O-CB 3.44Å; P362-Y365 PolarHBondContact O-N 3.15Å
363	E	88.6	Confident	89.6	Confident	151 Å²	151	63 Å²	63	71%	0.706	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-63.2	-27.4	176.8	-63.8	73.9	-164.9	0	0	112.5	C361	C361-E363 PolarHBondContact O-N 3.3Å; C361-E363 VanDerWaalsContact O-N 3.13Å; C361-E363 PolarHBondContact SG-OE2 2.89Å
364	N	90.4	Very high	89.2	Confident	41 Å²	41	66.6 Å²	66.6	22%	0.219	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-93.9	3.5	179.8	-64.4	-24	0	0	0	113	R358 C361 P362 E366 Q367 L368	R358-N364 PolarHBondContact O-ND2 2.78Å; C361-N364 HydrophobicContact CB-CB 4.28Å; C361-N364 PolarHBondContact O-N 2.98Å; P362-N364 PolarHBondContact O-N 3.06Å; N364-E366 PolarHBondContact O-N 2.92Å; N364-Q367 WeakPolarHBondContact O-CB 3.26Å; N364-Q367 PolarHBondContact O-N 2.87Å; N364-L368 WeakPolarHBondContact O-CB 3.14Å; N364-L368 PolarHBondContact O-N 2.94Å
365	Y	89.8	Confident	89.2	Confident	83 Å²	83	65.8 Å²	65.8	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-46.3	-174.6	176.6	-102.2	0	0	0	113.1	T188 I228 P362 Q367 L368 V369	T188-Y365 HydrophobicContact CG2-CE2 3.66Å; T188-Y365 WeakPolarHBondContact CG2-OH 3.26Å; I228-Y365 HydrophobicContact CD1-CE2 3.94Å; P362-Y365 VanDerWaalsContact O-CB 3.29Å; P362-Y365 WeakPolarHBondContact O-CB 3.44Å; P362-Y365 PolarHBondContact O-N 3.15Å; Y365-Q367 VanDerWaalsContact C-N 3.34Å; Y365-Q367 PolarHBondContact O-N 3.44Å; Y365-L368 PolarHBondContact O-N 2.83Å; Y365-V369 HydrophobicContact CD1-CG2 4.33Å; Y365-V369 HydrophobicContact CD2-CG2 4.31Å; Y365-V369 HydrophobicContact CE1-CG2 3.87Å; Y365-V369 HydrophobicContact CE2-CG2 3.84Å; Y365-V369 WeakPolarHBondContact O-CG2 3.35Å; Y365-V369 PolarHBondContact O-N 3.41Å
366	E	90	Very high	89.1	Confident	163 Å²	163	63.2 Å²	63.2	76%	0.762	32%	0.323	S	S	*	.	H	α-helix	trans	-63.1	-42.3	179.1	-66.4	-172.6	169.9	0	0	111.6	N364 L368 V369 Q370	N364-E366 PolarHBondContact O-N 2.92Å; E366-L368 PolarHBondContact O-N 3.17Å; E366-V369 PolarHBondContact O-N 3.21Å; E366-Q370 WeakPolarHBondContact O-CB 3.43Å; E366-Q370 PolarHBondContact O-N 3.09Å
367	Q	91.3	Very high	88.7	Confident	82 Å²	82	68 Å²	68	38%	0.383	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-45.2	174.7	-177.4	-179.2	15.2	0	0	111	W359 N364 Y365 V369 Q370 Q371	W359-Q367 HydrophobicContact CZ3-CG 4.47Å; N364-Q367 WeakPolarHBondContact O-CB 3.26Å; N364-Q367 PolarHBondContact O-N 2.87Å; Y365-Q367 VanDerWaalsContact C-N 3.34Å; Y365-Q367 PolarHBondContact O-N 3.44Å; Q367-V369 PolarHBondContact O-N 2.95Å; Q367-Q370 PolarHBondContact O-N 3.08Å; Q367-Q371 WeakPolarHBondContact O-CB 3.46Å; Q367-Q371 PolarHBondContact O-N 3.35Å
368	L	92.1	Very high	88.7	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-61.5	-45.5	178.6	174.2	59.4	0	0	0	111.4	I228 W359 N364 Y365 E366 Q370 Q371 L372 L379 F383	I228-L368 HydrophobicContact CD1-CD2 3.92Å; I228-L368 HydrophobicContact CD1-CG 4.26Å; I228-L368 HydrophobicContact CG1-CD2 4.41Å; I228-L368 HydrophobicContact CG2-CD2 4.31Å; W359-L368 HydrophobicContact CD2-CD1 4.29Å; W359-L368 HydrophobicContact CE3-CB 4.07Å; W359-L368 HydrophobicContact CE3-CD1 3.72Å; W359-L368 HydrophobicContact CE3-CG 4.42Å; W359-L368 HydrophobicContact CZ3-CB 4.45Å; W359-L368 HydrophobicContact CZ3-CD1 4.27Å; N364-L368 WeakPolarHBondContact O-CB 3.14Å; N364-L368 PolarHBondContact O-N 2.94Å; Y365-L368 PolarHBondContact O-N 2.83Å; E366-L368 PolarHBondContact O-N 3.17Å; L368-Q370 VanDerWaalsContact C-N 3.34Å; L368-Q370 PolarHBondContact O-N 3.42Å; L368-Q371 WeakPolarHBondContact O-CB 3.26Å; L368-Q371 PolarHBondContact O-N 3Å; L368-L372 HydrophobicContact CD1-CD1 3.79Å; L368-L372 HydrophobicContact CD1-CG 3.96Å; L368-L372 HydrophobicContact CG-CD1 3.87Å; L368-L372 HydrophobicContact CG-CG 4.46Å; L368-L372 WeakPolarHBondContact O-CB 3.47Å; L368-L372 WeakPolarHBondContact O-CG 3.36Å; L368-L372 PolarHBondContact O-N 2.91Å; L368-L379 HydrophobicContact CD1-CD2 4.18Å; L368-F383 HydrophobicContact CD1-CD1 4.34Å; L368-F383 HydrophobicContact CD1-CE1 3.51Å; L368-F383 HydrophobicContact CD1-CZ 4.08Å; L368-F383 HydrophobicContact CD2-CE1 4.06Å; L368-F383 HydrophobicContact CD2-CZ 3.88Å; L368-F383 HydrophobicContact CG-CE1 4.43Å
369	V	91	Very high	88.6	Confident	38 Å²	38	66.9 Å²	66.9	23%	0.23	36%	0.362	C	S	.	.	H	α-helix	trans	-62.1	-42.7	177.7	171.6	0	0	0	0	111	V186 I228 Y365 E366 Q367 L372 T373	V186-V369 HydrophobicContact CB-CG1 4.46Å; V186-V369 HydrophobicContact CG1-CG2 4.25Å; I228-V369 HydrophobicContact CD1-CG2 4.16Å; Y365-V369 HydrophobicContact CD1-CG2 4.33Å; Y365-V369 HydrophobicContact CD2-CG2 4.31Å; Y365-V369 HydrophobicContact CE1-CG2 3.87Å; Y365-V369 HydrophobicContact CE2-CG2 3.84Å; Y365-V369 WeakPolarHBondContact O-CG2 3.35Å; Y365-V369 PolarHBondContact O-N 3.41Å; E366-V369 PolarHBondContact O-N 3.21Å; Q367-V369 PolarHBondContact O-N 2.95Å; V369-L372 PolarHBondContact O-N 3.45Å; V369-T373 WeakPolarHBondContact O-CB 3.2Å; V369-T373 PolarHBondContact O-N 3.46Å; V369-T373 PolarHBondContact O-OG1 3.42Å
370	Q	90.5	Very high	88.8	Confident	131 Å²	131	67.6 Å²	67.6	61%	0.612	37%	0.369	S	S	*	.	H	α-helix	trans	-62.3	-44.3	175.2	-174.7	179.2	8.8	0	0	111.4	E366 Q367 L368 T373 S374	E366-Q370 WeakPolarHBondContact O-CB 3.43Å; E366-Q370 PolarHBondContact O-N 3.09Å; Q367-Q370 PolarHBondContact O-N 3.08Å; L368-Q370 VanDerWaalsContact C-N 3.34Å; L368-Q370 PolarHBondContact O-N 3.42Å; Q370-T373 PolarHBondContact O-N 2.9Å; Q370-S374 WeakPolarHBondContact O-CB 3.4Å; Q370-S374 PolarHBondContact O-N 3.02Å
371	Q	90.7	Very high	88.9	Confident	27 Å²	27	71.8 Å²	71.8	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-60.6	-49	178.5	-162.2	70.9	24	0	0	111	W359 Q367 L368 T373 N375 P376 E378 L379	W359-Q371 HydrophobicContact CH2-CG 4.19Å; W359-Q371 HydrophobicContact CZ3-CB 4.49Å; Q367-Q371 WeakPolarHBondContact O-CB 3.46Å; Q367-Q371 PolarHBondContact O-N 3.35Å; L368-Q371 WeakPolarHBondContact O-CB 3.26Å; L368-Q371 PolarHBondContact O-N 3Å; Q371-T373 VanDerWaalsContact C-N 3.25Å; Q371-T373 PolarHBondContact O-N 3.37Å; Q371-N375 PolarHBondContact NE2-O 2.92Å; Q371-N375 VanDerWaalsContact NE2-O 3.15Å; Q371-N375 CarbonylContact O-C 3.59Å; Q371-N375 WeakPolarHBondContact O-CA 3.47Å; Q371-N375 PolarHBondContact O-N 2.78Å; Q371-P376 VanDerWaalsContact O-N 3.13Å; Q371-E378 PolarHBondContact NE2-OE2 3.09Å; Q371-L379 HydrophobicContact CB-CD2 4.5Å; Q371-L379 HydrophobicContact CG-CD1 4.39Å; Q371-L379 HydrophobicContact CG-CD2 3.85Å; Q371-L379 HydrophobicContact CG-CG 3.84Å
372	L	90.6	Very high	89.2	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-63.2	-31	178.5	-75.8	168.2	0	0	0	113.1	V186 R225 A226 I228 L368 V369 L379 V387	V186-L372 HydrophobicContact CG1-CD1 3.88Å; V186-L372 HydrophobicContact CG2-CB 3.76Å; R225-L372 WeakPolarHBondContact CD-O 3.37Å; R225-L372 PolarHBondContact NE-O 3.29Å; A226-L372 HydrophobicContact CB-CD1 4.02Å; A226-L372 HydrophobicContact CB-CD2 3.97Å; A226-L372 HydrophobicContact CB-CG 4.44Å; I228-L372 HydrophobicContact CD1-CD1 3.89Å; I228-L372 HydrophobicContact CG1-CD1 3.95Å; L368-L372 HydrophobicContact CD1-CD1 3.79Å; L368-L372 HydrophobicContact CD1-CG 3.96Å; L368-L372 HydrophobicContact CG-CD1 3.87Å; L368-L372 HydrophobicContact CG-CG 4.46Å; L368-L372 WeakPolarHBondContact O-CB 3.47Å; L368-L372 WeakPolarHBondContact O-CG 3.36Å; L368-L372 PolarHBondContact O-N 2.91Å; V369-L372 PolarHBondContact O-N 3.45Å; L372-L379 HydrophobicContact CD2-CD1 3.24Å; L372-L379 HydrophobicContact CG-CD1 3.81Å; L372-V387 HydrophobicContact CD1-CG2 4.33Å; L372-V387 HydrophobicContact CD2-CG2 3.53Å
373	T	87.8	Confident	89.6	Confident	68 Å²	68	67.2 Å²	67.2	42%	0.417	36%	0.363	S	S	.	.	H	α-helix	trans	-83.4	-44	-177.7	-57.3	0	0	0	0	112.2	V369 Q370 Q371	V369-T373 WeakPolarHBondContact O-CB 3.2Å; V369-T373 PolarHBondContact O-N 3.46Å; V369-T373 PolarHBondContact O-OG1 3.42Å; Q370-T373 PolarHBondContact O-N 2.9Å; Q371-T373 VanDerWaalsContact C-N 3.25Å; Q371-T373 PolarHBondContact O-N 3.37Å
374	S	88.2	Confident	89.8	Confident	75 Å²	75	62.3 Å²	62.3	52%	0.524	34%	0.342	S	S	.	.	H	α-helix	trans	-102.6	-44.1	-169.4	-58.6	0	0	0	0	113.4	Q370 P376	Q370-S374 WeakPolarHBondContact O-CB 3.4Å; Q370-S374 PolarHBondContact O-N 3.02Å; S374-P376 VanDerWaalsContact C-CD 3.45Å
375	N	87.8	Confident	90	Very high	81 Å²	81	61.9 Å²	61.9	43%	0.433	34%	0.337	S	S	.	.			trans	-132.6	57.5	-170.9	-62.2	-29.3	0	0	0	112.3	Q371 A377 E378	Q371-N375 PolarHBondContact NE2-O 2.92Å; Q371-N375 VanDerWaalsContact NE2-O 3.15Å; Q371-N375 CarbonylContact O-C 3.59Å; Q371-N375 WeakPolarHBondContact O-CA 3.47Å; Q371-N375 PolarHBondContact O-N 2.78Å; N375-A377 VanDerWaalsContact C-N 3.26Å; N375-A377 PolarHBondContact O-N 3.08Å; N375-E378 PolarHBondContact O-N 2.87Å
376	P	82.6	Confident	90.3	Very high	28 Å²	28	57.9 Å²	57.9	18%	0.182	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-66.3	-27.1	-173.9	28.2	-38.2	0	0	0	113.8	Q371 S374 E378 L379	Q371-P376 VanDerWaalsContact O-N 3.13Å; S374-P376 VanDerWaalsContact C-CD 3.45Å; P376-E378 PolarHBondContact O-N 3.25Å; P376-E378 VanDerWaalsContact O-N 3.14Å; P376-L379 WeakPolarHBondContact O-CB 3.39Å; P376-L379 PolarHBondContact O-N 3.34Å; P376-L379 VanDerWaalsContact O-N 3.11Å
377	A	84	Confident	90.4	Very high	103 Å²	103	50.2 Å²	50.2	85%	0.851	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-66.1	-13.3	-179.1	0	0	0	0	0	113.8	N375	N375-A377 VanDerWaalsContact C-N 3.26Å; N375-A377 PolarHBondContact O-N 3.08Å
378	E	87.3	Confident	90.5	Very high	134 Å²	134	47 Å²	47	63%	0.626	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-89.6	-9.4	177	-71.3	176.3	-172.5	0	0	112.9	Q371 N375 P376	Q371-E378 PolarHBondContact NE2-OE2 3.09Å; N375-E378 PolarHBondContact O-N 2.87Å; P376-E378 PolarHBondContact O-N 3.25Å; P376-E378 VanDerWaalsContact O-N 3.14Å
379	L	89.1	Confident	90.5	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.042	27%	0.274	C	S	.	.	S	Bend	trans	-71.8	146.8	175.2	-74.4	165.8	0	0	0	110.6	W359 L368 Q371 L372 P376 F383 D384	W359-L379 HydrophobicContact CD2-CD2 4.12Å; W359-L379 HydrophobicContact CE3-CD2 4.32Å; W359-L379 HydrophobicContact CH2-CD2 3.9Å; W359-L379 HydrophobicContact CZ2-CD2 3.68Å; W359-L379 HydrophobicContact CZ3-CD2 4.22Å; L368-L379 HydrophobicContact CD1-CD2 4.18Å; Q371-L379 HydrophobicContact CB-CD2 4.5Å; Q371-L379 HydrophobicContact CG-CD1 4.39Å; Q371-L379 HydrophobicContact CG-CD2 3.85Å; Q371-L379 HydrophobicContact CG-CG 3.84Å; L372-L379 HydrophobicContact CD2-CD1 3.24Å; L372-L379 HydrophobicContact CG-CD1 3.81Å; P376-L379 WeakPolarHBondContact O-CB 3.39Å; P376-L379 PolarHBondContact O-N 3.34Å; P376-L379 VanDerWaalsContact O-N 3.11Å; L379-F383 HydrophobicContact CD2-CD1 4.17Å; L379-D384 HydrophobicContact CB-CB 4.4Å
380	P	90.9	Very high	90.7	Very high	31 Å²	31	45.7 Å²	45.7	20%	0.201	26%	0.264	C	S	.	.			trans	-52.5	132.7	169.6	-25.5	34.4	0	0	0	110.2	Q382 F383 D384	P380-Q382 PolarHBondContact O-N 3.1Å; P380-Q382 VanDerWaalsContact O-N 3.1Å; P380-F383 HydrophobicContact CB-CB 4.23Å; P380-F383 WeakPolarHBondContact O-CA 3.43Å; P380-F383 WeakPolarHBondContact O-CB 3.35Å; P380-F383 PolarHBondContact O-N 3.38Å; P380-D384 PolarHBondContact O-N 3Å
381	P	92.1	Very high	90.9	Very high	111 Å²	111	40.1 Å²	40.1	72%	0.721	24%	0.238	S	C	*	.	H	α-helix	trans	-54.6	-36.2	-174.2	-30.1	35.3	0	0	0	114.2	R385	P381-R385 VanDerWaalsContact O-CB 3.25Å; P381-R385 WeakPolarHBondContact O-CB 3.44Å; P381-R385 PolarHBondContact O-N 3.02Å
382	Q	94	Very high	91.2	Very high	54 Å²	54	38.9 Å²	38.9	25%	0.252	23%	0.232	S	C	.	.	H	α-helix	trans	-67.8	-34.8	175.6	-72.4	179.7	-20.2	0	0	112.8	F318 F331 S351 F356 P380 R385 L386	F318-Q382 HydrophobicContact CE1-CB 4.21Å; F318-Q382 WeakPolarHBondContact CE1-O 3.49Å; F318-Q382 WeakPolarHBondContact CZ-O 3.35Å; F331-Q382 HydrophobicContact CG-CG 4.49Å; S351-Q382 PolarHBondContact OG-NE2 2.87Å; F356-Q382 HydrophobicContact CE1-CB 4.32Å; F356-Q382 HydrophobicContact CZ-CB 4.46Å; P380-Q382 PolarHBondContact O-N 3.1Å; P380-Q382 VanDerWaalsContact O-N 3.1Å; Q382-R385 WeakPolarHBondContact O-CB 3.49Å; Q382-L386 PolarHBondContact O-N 2.84Å
383	F	93.8	Very high	91.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-72.3	-43.5	176.6	-165.6	-83.2	0	0	0	110.6	F356 W359 F360 L368 L379 P380 R385 L386 V387	F356-F383 HydrophobicContact CD1-CB 4.22Å; F356-F383 AromaticContact CD1-CD2 3.48Å; F356-F383 HydrophobicContact CD1-CD2 3.48Å; F356-F383 VanDerWaalsContact CD1-CD2 3.48Å; F356-F383 HydrophobicContact CD1-CE2 4.34Å; F356-F383 HydrophobicContact CD1-CG 4.33Å; F356-F383 VanDerWaalsContact CE1-CA 3.46Å; F356-F383 HydrophobicContact CE1-CB 3.59Å; F356-F383 AromaticContact CE1-CD2 3.5Å; F356-F383 HydrophobicContact CE1-CD2 3.5Å; F356-F383 HydrophobicContact CE1-CG 4.01Å; F356-F383 HydrophobicContact CG-CD2 4.05Å; F356-F383 HydrophobicContact CZ-CB 4.35Å; F356-F383 HydrophobicContact CZ-CD2 4.12Å; W359-F383 HydrophobicContact CB-CD2 3.82Å; W359-F383 HydrophobicContact CB-CE1 4.11Å; W359-F383 HydrophobicContact CB-CE2 3.27Å; W359-F383 HydrophobicContact CB-CG 4.46Å; W359-F383 HydrophobicContact CB-CZ 3.43Å; W359-F383 VanDerWaalsContact CB-CZ 3.43Å; W359-F383 AromaticContact CD1-CD2 3.89Å; W359-F383 HydrophobicContact CG-CD2 4.07Å; W359-F383 HydrophobicContact CG-CE1 4.43Å; W359-F383 AromaticContact CG-CE2 3.99Å; W359-F383 HydrophobicContact CG-CE2 3.99Å; W359-F383 HydrophobicContact CG-CG 4.35Å; W359-F383 HydrophobicContact CG-CZ 4.17Å; F360-F383 HydrophobicContact CD2-CE2 4.46Å; F360-F383 HydrophobicContact CE2-CE2 4.31Å; F360-F383 HydrophobicContact CZ-CE2 4.48Å; L368-F383 HydrophobicContact CD1-CD1 4.34Å; L368-F383 HydrophobicContact CD1-CE1 3.51Å; L368-F383 HydrophobicContact CD1-CZ 4.08Å; L368-F383 HydrophobicContact CD2-CE1 4.06Å; L368-F383 HydrophobicContact CD2-CZ 3.88Å; L368-F383 HydrophobicContact CG-CE1 4.43Å; L379-F383 HydrophobicContact CD2-CD1 4.17Å; P380-F383 HydrophobicContact CB-CB 4.23Å; P380-F383 WeakPolarHBondContact O-CA 3.43Å; P380-F383 WeakPolarHBondContact O-CB 3.35Å; P380-F383 PolarHBondContact O-N 3.38Å; F383-R385 VanDerWaalsContact C-N 3.3Å; F383-R385 PolarHBondContact O-N 3.39Å; F383-L386 HydrophobicContact CE2-CD2 4.46Å; F383-L386 WeakPolarHBondContact O-CB 3.45Å; F383-L386 PolarHBondContact O-N 3.37Å; F383-V387 HydrophobicContact CD1-CG1 4.25Å; F383-V387 HydrophobicContact CD1-CG2 4.49Å; F383-V387 HydrophobicContact CE1-CG1 3.63Å; F383-V387 HydrophobicContact CE1-CG2 4.4Å; F383-V387 HydrophobicContact CZ-CG1 4.02Å; F383-V387 WeakPolarHBondContact O-CG2 3.49Å; F383-V387 PolarHBondContact O-N 3.09Å
384	D	92.6	Very high	91.9	Very high	49 Å²	49	35.6 Å²	35.6	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-59.1	-44.5	172.7	-176.4	49.3	0	0	0	110.5	L379 P380 L386 V387 S388	L379-D384 HydrophobicContact CB-CB 4.4Å; P380-D384 PolarHBondContact O-N 3Å; D384-L386 VanDerWaalsContact C-N 3.32Å; D384-L386 PolarHBondContact O-N 3.34Å; D384-V387 PolarHBondContact O-N 3.37Å; D384-S388 WeakPolarHBondContact O-CA 3.4Å; D384-S388 WeakPolarHBondContact O-CB 3.24Å; D384-S388 PolarHBondContact O-N 2.77Å; D384-S388 PolarHBondContact O-OG 2.91Å; D384-S388 PolarHBondContact OD1-OG 3.16Å
385	R	93.5	Very high	92.3	Very high	31 Å²	31	32 Å²	32	12%	0.117	19%	0.187	C	C	.	.	H	α-helix	trans	-53.3	-47.5	173.8	179	54.4	169.2	-142.5	-5.4	112.3	E311 H314 V316 F318 P381 Q382 F383 V387 D389	E311-R385 VanDerWaalsContact CB-NH2 3.26Å; E311-R385 IonicContact OE1-NH1 3.31Å; E311-R385 IonicContact OE2-CZ 3.85Å; E311-R385 IonicContact OE2-NH1 3.93Å; E311-R385 PolarHBondContact OE2-NH1 2.81Å; E311-R385 IonicContact OE2-NH2 3.74Å; H314-R385 PolarHBondContact O-NH2 3.44Å; V316-R385 HydrophobicContact CG2-CG 4.34Å; F318-R385 HydrophobicContact CE2-CG 4.06Å; F318-R385 HydrophobicContact CZ-CB 4.15Å; F318-R385 HydrophobicContact CZ-CG 3.94Å; P381-R385 VanDerWaalsContact O-CB 3.25Å; P381-R385 WeakPolarHBondContact O-CB 3.44Å; P381-R385 PolarHBondContact O-N 3.02Å; Q382-R385 WeakPolarHBondContact O-CB 3.49Å; F383-R385 VanDerWaalsContact C-N 3.3Å; F383-R385 PolarHBondContact O-N 3.39Å; R385-V387 PolarHBondContact O-N 2.87Å; R385-D389 WeakPolarHBondContact CD-OD2 3.15Å; R385-D389 IonicContact CZ-OD2 3.16Å; R385-D389 IonicContact NE-OD2 3.81Å; R385-D389 PolarHBondContact NE-OD2 3.16Å; R385-D389 IonicContact NH1-OD2 3.66Å; R385-D389 PolarHBondContact NH1-OD2 3.4Å; R385-D389 WeakPolarHBondContact O-CA 3.42Å; R385-D389 VanDerWaalsContact O-CB 3.28Å; R385-D389 WeakPolarHBondContact O-CB 3.34Å; R385-D389 PolarHBondContact O-N 3.41Å
386	L	95.6	Very high	92.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57.7	-49.9	180	177	70.5	0	0	0	112.3	P229 V307 F318 F356 F360 Q382 F383 D384 C390	P229-L386 HydrophobicContact CG-CD1 4.2Å; P229-L386 HydrophobicContact CG-CD2 4.39Å; P229-L386 HydrophobicContact CG-CG 4.1Å; V307-L386 HydrophobicContact CB-CD1 3.71Å; V307-L386 HydrophobicContact CG1-CD1 3.78Å; V307-L386 HydrophobicContact CG2-CD1 4.02Å; F318-L386 HydrophobicContact CB-CD1 3.95Å; F318-L386 HydrophobicContact CD1-CD1 4.36Å; F318-L386 HydrophobicContact CD2-CB 4.29Å; F318-L386 HydrophobicContact CD2-CD1 3.51Å; F318-L386 HydrophobicContact CE1-CB 4.35Å; F318-L386 HydrophobicContact CE2-CB 3.97Å; F318-L386 HydrophobicContact CE2-CD1 4.05Å; F318-L386 HydrophobicContact CG-CD1 3.69Å; F318-L386 HydrophobicContact CZ-CB 3.99Å; F356-L386 HydrophobicContact CD2-CD2 4.13Å; F356-L386 HydrophobicContact CE2-CB 4.36Å; F356-L386 HydrophobicContact CE2-CD2 3.47Å; F356-L386 VanDerWaalsContact CE2-CD2 3.47Å; F356-L386 HydrophobicContact CE2-CG 4.37Å; F356-L386 HydrophobicContact CZ-CB 4.07Å; F356-L386 HydrophobicContact CZ-CD2 3.87Å; F360-L386 HydrophobicContact CE1-CD2 4.49Å; F360-L386 HydrophobicContact CE2-CD2 3.85Å; F360-L386 HydrophobicContact CZ-CD2 3.43Å; F360-L386 VanDerWaalsContact CZ-CD2 3.43Å; Q382-L386 PolarHBondContact O-N 2.84Å; F383-L386 HydrophobicContact CE2-CD2 4.46Å; F383-L386 WeakPolarHBondContact O-CB 3.45Å; F383-L386 PolarHBondContact O-N 3.37Å; D384-L386 VanDerWaalsContact C-N 3.32Å; D384-L386 PolarHBondContact O-N 3.34Å; L386-C390 WeakPolarHBondContact O-CA 3.26Å; L386-C390 VanDerWaalsContact O-CB 3.3Å; L386-C390 WeakPolarHBondContact O-CB 3.24Å; L386-C390 PolarHBondContact O-N 2.88Å
387	V	94.1	Very high	92.9	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-87.6	-32.2	-171.2	-57.8	0	0	0	0	112.9	A226 V227 I228 L372 F383 D384 R385	A226-V387 CarbonylContact C-O 3.59Å; A226-V387 WeakPolarHBondContact CA-O 3.47Å; A226-V387 HydrophobicContact CB-CB 4.18Å; A226-V387 HydrophobicContact CB-CG2 4.01Å; V227-V387 PolarHBondContact N-O 3.45Å; V227-V387 WeakPolarHBondContact O-CA 3.35Å; I228-V387 HydrophobicContact CG1-CG1 4.47Å; L372-V387 HydrophobicContact CD1-CG2 4.33Å; L372-V387 HydrophobicContact CD2-CG2 3.53Å; F383-V387 HydrophobicContact CD1-CG1 4.25Å; F383-V387 HydrophobicContact CD1-CG2 4.49Å; F383-V387 HydrophobicContact CE1-CG1 3.63Å; F383-V387 HydrophobicContact CE1-CG2 4.4Å; F383-V387 HydrophobicContact CZ-CG1 4.02Å; F383-V387 WeakPolarHBondContact O-CG2 3.49Å; F383-V387 PolarHBondContact O-N 3.09Å; D384-V387 PolarHBondContact O-N 3.37Å; R385-V387 PolarHBondContact O-N 2.87Å
388	S	91.5	Very high	93	Very high	15 Å²	15	26.2 Å²	26.2	11%	0.105	14%	0.14	C	C	.	.	H	α-helix	trans	-81.5	-29	179.5	-66.8	0	0	0	0	111.7	K222 D384	K222-S388 VanDerWaalsContact CD-O 3.31Å; K222-S388 WeakPolarHBondContact CD-O 3.37Å; K222-S388 WeakPolarHBondContact CE-O 3.27Å; K222-S388 PolarHBondContact NZ-O 3.38Å; D384-S388 WeakPolarHBondContact O-CA 3.4Å; D384-S388 WeakPolarHBondContact O-CB 3.24Å; D384-S388 PolarHBondContact O-N 2.77Å; D384-S388 PolarHBondContact O-OG 2.91Å; D384-S388 PolarHBondContact OD1-OG 3.16Å
389	D	93.5	Very high	92.7	Very high	6 Å²	6	24.3 Å²	24.3	3%	0.032	13%	0.134	C	C	.	.	S	Bend	trans	-113.7	10.6	-178	-64.9	-52.2	0	0	0	115.1	R217 K222 C309 I310 R385 Y391	R217-D389 PolarHBondContact NH2-O 3.22Å; R217-D389 IonicContact NH2-OD1 2.6Å; K222-D389 WeakPolarHBondContact CE-OD1 3.49Å; K222-D389 IonicContact NZ-OD1 2.62Å; K222-D389 PolarHBondContact NZ-OD1 2.76Å; C309-D389 CarbonylContact C-O 3.03Å; C309-D389 WeakPolarHBondContact CA-O 3.46Å; C309-D389 HydrophobicContact CB-CB 3.92Å; C309-D389 WeakPolarHBondContact CB-O 3.42Å; I310-D389 PolarHBondContact N-O 3.28Å; I310-D389 WeakPolarHBondContact O-CB 3.4Å; R385-D389 WeakPolarHBondContact CD-OD2 3.15Å; R385-D389 IonicContact CZ-OD2 3.16Å; R385-D389 IonicContact NE-OD2 3.81Å; R385-D389 PolarHBondContact NE-OD2 3.16Å; R385-D389 IonicContact NH1-OD2 3.66Å; R385-D389 PolarHBondContact NH1-OD2 3.4Å; R385-D389 WeakPolarHBondContact O-CA 3.42Å; R385-D389 VanDerWaalsContact O-CB 3.28Å; R385-D389 WeakPolarHBondContact O-CB 3.34Å; R385-D389 PolarHBondContact O-N 3.41Å; D389-Y391 PolarHBondContact O-N 3.31Å
390	C	94.5	Very high	91.9	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.034	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-46	131.4	176.2	-166.5	0	0	0	0	111.8	I215 V227 L386 C393	I215-C390 HydrophobicContact CG1-CB 4.47Å; V227-C390 HydrophobicContact CB-CB 4.4Å; L386-C390 WeakPolarHBondContact O-CA 3.26Å; L386-C390 VanDerWaalsContact O-CB 3.3Å; L386-C390 WeakPolarHBondContact O-CB 3.24Å; L386-C390 PolarHBondContact O-N 2.88Å; C390-C393 PolarHBondContact SG-SG 2.65Å
391	Y	94.7	Very high	90.5	Very high	15 Å²	15	25.4 Å²	25.4	6%	0.059	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	-60.5	-177.3	-173.5	-119.9	0	0	0	112.7	P152 E153 Q214 I215 M308 I310 Y315 D389	P152-Y391 HydrophobicContact CB-CE1 4.37Å; P152-Y391 HydrophobicContact CG-CD1 4.3Å; P152-Y391 HydrophobicContact CG-CE1 3.89Å; E153-Y391 PolarHBondContact OE1-OH 3.45Å; E153-Y391 PolarHBondContact OE2-OH 2.71Å; Q214-Y391 HydrophobicContact CG-CE2 4.33Å; Q214-Y391 PolarHBondContact NE2-OH 3.11Å; I215-Y391 PolarHBondContact N-O 2.83Å; M308-Y391 WeakPolarHBondContact O-CA 3.31Å; M308-Y391 WeakPolarHBondContact O-CB 3.46Å; M308-Y391 PolarHBondContact O-N 3.14Å; I310-Y391 HydrophobicContact CG2-CD1 4.41Å; I310-Y391 HydrophobicContact CG2-CD2 3.95Å; I310-Y391 HydrophobicContact CG2-CG 3.81Å; Y315-Y391 AromaticContact CE1-CD1 3.78Å; Y315-Y391 HydrophobicContact CE1-CD1 3.78Å; Y315-Y391 AromaticContact CE1-CE1 3.95Å; Y315-Y391 HydrophobicContact CE1-CE1 3.95Å; D389-Y391 PolarHBondContact O-N 3.31Å
392	L	96.3	Very high	88.8	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.6	174.3	-58.9	-178	0	0	0	110.3	P152 L156 F170 I212 L213 Q214 V307 M308 F394	P152-L392 HydrophobicContact CB-CD1 3.75Å; L156-L392 HydrophobicContact CD1-CD1 3.48Å; L156-L392 VanDerWaalsContact CD1-CD1 3.48Å; F170-L392 HydrophobicContact CE2-CD2 4.12Å; F170-L392 HydrophobicContact CZ-CD2 4.13Å; I212-L392 HydrophobicContact CG2-CB 4.4Å; I212-L392 HydrophobicContact CG2-CD1 4.48Å; I212-L392 HydrophobicContact CG2-CD2 4.45Å; L213-L392 CarbonylContact O-C 3.54Å; L213-L392 VanDerWaalsContact O-CA 3.32Å; L213-L392 WeakPolarHBondContact O-CA 3.35Å; Q214-L392 HydrophobicContact CB-CD2 3.65Å; Q214-L392 HydrophobicContact CG-CD2 3.77Å; V307-L392 CarbonylContact C-O 3.53Å; V307-L392 VanDerWaalsContact CA-O 3.31Å; V307-L392 WeakPolarHBondContact CA-O 3.3Å; M308-L392 HydrophobicContact CB-CB 4.19Å; M308-L392 PolarHBondContact N-O 3.31Å; M308-L392 PolarHBondContact O-N 3.07Å; M308-L392 VanDerWaalsContact O-N 3.13Å; M308-L392 HydrophobicContact SD-CD1 4Å; L392-F394 HydrophobicContact CB-CE2 3.8Å; L392-F394 HydrophobicContact CB-CZ 4.28Å; L392-F394 HydrophobicContact CD1-CZ 4.21Å
393	C	97.7	Very high	86.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.8	171.6	-63.5	0	0	0	0	110	I212 L213 L304 C390 Y395	I212-C393 WeakPolarHBondContact CA-O 3.37Å; L213-C393 HydrophobicContact CB-CB 4.43Å; L213-C393 PolarHBondContact N-O 3.04Å; L213-C393 PolarHBondContact O-N 2.9Å; L304-C393 HydrophobicContact CD1-CB 3.91Å; C390-C393 PolarHBondContact SG-SG 2.65Å; C393-Y395 HydrophobicContact CB-CD2 4Å; C393-Y395 HydrophobicContact CB-CE2 3.42Å; C393-Y395 VanDerWaalsContact CB-CE2 3.42Å
394	F	96.5	Very high	84.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	113.6	-179.3	-63	-102.6	0	0	0	109.5	M86 F93 L156 I212 A305 S306 M308 L392	M86-F394 HydrophobicContact CG-CD1 4.06Å; M86-F394 HydrophobicContact CG-CE1 3.69Å; M86-F394 HydrophobicContact CG-CZ 4.5Å; M86-F394 HydrophobicContact SD-CE1 4.27Å; F93-F394 HydrophobicContact CE2-CB 4.39Å; F93-F394 AromaticContact CE2-CD1 3.99Å; F93-F394 HydrophobicContact CE2-CD1 3.99Å; F93-F394 HydrophobicContact CZ-CB 4.32Å; F93-F394 AromaticContact CZ-CD1 3.78Å; F93-F394 HydrophobicContact CZ-CD1 3.78Å; L156-F394 HydrophobicContact CD1-CE1 4.43Å; L156-F394 HydrophobicContact CD1-CZ 4.28Å; L156-F394 HydrophobicContact CD2-CE1 4.45Å; I212-F394 HydrophobicContact CD1-CD1 3.89Å; I212-F394 HydrophobicContact CD1-CE1 3.67Å; I212-F394 HydrophobicContact CG1-CD1 3.8Å; I212-F394 HydrophobicContact CG1-CE1 4.03Å; I212-F394 HydrophobicContact CG2-CD1 4.45Å; I212-F394 HydrophobicContact CG2-CE1 4.24Å; I212-F394 HydrophobicContact CG2-CZ 4.45Å; A305-F394 PolarHBondContact N-O 2.84Å; S306-F394 PolarHBondContact O-N 3.16Å; S306-F394 WeakPolarHBondContact OG-CB 3.26Å; M308-F394 HydrophobicContact CB-CE2 4.44Å; M308-F394 HydrophobicContact CG-CE2 3.75Å; M308-F394 HydrophobicContact CG-CZ 4.35Å; M308-F394 HydrophobicContact SD-CE2 3.66Å; M308-F394 HydrophobicContact SD-CZ 3.66Å; L392-F394 HydrophobicContact CB-CE2 3.8Å; L392-F394 HydrophobicContact CB-CZ 4.28Å; L392-F394 HydrophobicContact CD1-CZ 4.21Å
395	Y	95.8	Very high	83.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	150.8	-179.8	-72.1	-83.7	0	0	0	111.4	V189 L211 L213 S230 L233 L302 Q303 L304 C393	V189-Y395 HydrophobicContact CG1-CE2 4.17Å; L211-Y395 PolarHBondContact N-O 3.14Å; L211-Y395 PolarHBondContact O-N 2.83Å; L213-Y395 HydrophobicContact CD1-CD2 4.17Å; L213-Y395 HydrophobicContact CD1-CE2 3.95Å; L213-Y395 HydrophobicContact CG-CD2 4.36Å; L213-Y395 HydrophobicContact CG-CE2 4.49Å; S230-Y395 PolarHBondContact N-OH 2.64Å; S230-Y395 WeakPolarHBondContact O-CE1 3.12Å; S230-Y395 PolarHBondContact O-OH 2.87Å; L233-Y395 HydrophobicContact CB-CD1 3.81Å; L233-Y395 HydrophobicContact CB-CE1 3.53Å; L233-Y395 HydrophobicContact CD2-CD1 4.09Å; L233-Y395 HydrophobicContact CD2-CD2 3.91Å; L233-Y395 HydrophobicContact CD2-CE1 4.13Å; L233-Y395 HydrophobicContact CD2-CE2 3.92Å; L233-Y395 HydrophobicContact CD2-CG 3.98Å; L233-Y395 HydrophobicContact CG-CE1 4.34Å; L302-Y395 HydrophobicContact CB-CD1 4.2Å; Q303-Y395 WeakPolarHBondContact O-CA 3.2Å; L304-Y395 HydrophobicContact CB-CD1 4.07Å; L304-Y395 HydrophobicContact CB-CE1 3.62Å; L304-Y395 HydrophobicContact CD1-CD1 4.22Å; L304-Y395 HydrophobicContact CD1-CD2 4.27Å; L304-Y395 HydrophobicContact CD1-CE1 3.77Å; L304-Y395 HydrophobicContact CD1-CE2 3.84Å; L304-Y395 HydrophobicContact CD1-CG 4.44Å; L304-Y395 HydrophobicContact CG-CE1 4.25Å; C393-Y395 HydrophobicContact CB-CD2 4Å; C393-Y395 HydrophobicContact CB-CE2 3.42Å; C393-Y395 VanDerWaalsContact CB-CE2 3.42Å
396	Y	93	Very high	83.2	Confident	7 Å²	7	38.7 Å²	38.7	3%	0.027	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155.6	171.7	69.2	-77.1	0	0	0	111.3	I92 T209 L302 Q303 A305 H323 P398 L401	I92-Y396 HydrophobicContact CD1-CD1 3.97Å; I92-Y396 HydrophobicContact CD1-CG 3.96Å; I92-Y396 HydrophobicContact CG2-CD2 4.07Å; I92-Y396 HydrophobicContact CG2-CG 4.04Å; T209-Y396 VanDerWaalsContact O-CA 3.29Å; T209-Y396 WeakPolarHBondContact O-CA 3.24Å; L302-Y396 CarbonylContact C-O 3.58Å; L302-Y396 VanDerWaalsContact CA-O 3.29Å; L302-Y396 WeakPolarHBondContact CA-O 3.44Å; L302-Y396 WeakPolarHBondContact CB-O 3.22Å; Q303-Y396 HydrophobicContact CB-CD1 4.31Å; Q303-Y396 HydrophobicContact CB-CE1 3.65Å; Q303-Y396 HydrophobicContact CB-CE2 4.36Å; Q303-Y396 PolarHBondContact N-O 2.69Å; Q303-Y396 VanDerWaalsContact O-CD1 3.25Å; Q303-Y396 WeakPolarHBondContact O-CD1 3.39Å; Q303-Y396 WeakPolarHBondContact O-CE1 3.37Å; Q303-Y396 PolarHBondContact O-N 2.82Å; A305-Y396 HydrophobicContact CB-CD1 3.9Å; A305-Y396 HydrophobicContact CB-CE1 4.01Å; H323-Y396 AromaticContact ND1-CZ 3.57Å; H323-Y396 PolarHBondContact ND1-OH 3.39Å; Y396-P398 HydrophobicContact CD2-CG 4.4Å; Y396-P398 HydrophobicContact CE2-CB 4.24Å; Y396-P398 HydrophobicContact CE2-CG 3.88Å; Y396-P398 WeakPolarHBondContact O-CD 3.29Å; Y396-L401 HydrophobicContact CD2-CD1 4.23Å; Y396-L401 HydrophobicContact CE2-CD1 4.49Å
397	W	91	Very high	82.6	Confident	34 Å²	34	40.9 Å²	40.9	13%	0.129	21%	0.213	C	C	.	.			trans	-93.3	113.9	172.6	-173	30.6	0	0	0	109.6	I207 T209 I300 L302 D399 G400	I207-W397 HydrophobicContact CB-CE3 4.28Å; I207-W397 HydrophobicContact CB-CZ3 4.31Å; I207-W397 HydrophobicContact CD1-CH2 3.83Å; I207-W397 HydrophobicContact CD1-CZ2 4.23Å; I207-W397 HydrophobicContact CD1-CZ3 4.02Å; I207-W397 HydrophobicContact CG2-CD2 3.7Å; I207-W397 HydrophobicContact CG2-CE3 3.42Å; I207-W397 VanDerWaalsContact CG2-CE3 3.42Å; I207-W397 HydrophobicContact CG2-CG 4.21Å; I207-W397 HydrophobicContact CG2-CZ3 3.89Å; T209-W397 HydrophobicContact CG2-CE3 4.32Å; T209-W397 PolarHBondContact O-N 2.86Å; I300-W397 HydrophobicContact CD1-CZ2 4.02Å; L302-W397 HydrophobicContact CD2-CB 3.46Å; L302-W397 VanDerWaalsContact CD2-CB 3.46Å; L302-W397 HydrophobicContact CD2-CG 4Å; W397-D399 VanDerWaalsContact C-N 3.33Å; W397-D399 HydrophobicContact CD2-CB 4.44Å; W397-D399 HydrophobicContact CH2-CB 4.49Å; W397-D399 HydrophobicContact CZ2-CB 3.8Å; W397-D399 PolarHBondContact NE1-OD2 3.24Å; W397-D399 PolarHBondContact O-N 3.34Å; W397-G400 PolarHBondContact O-N 2.75Å; W397-G400 VanDerWaalsContact O-N 3.1Å
398	P	86.3	Confident	81.9	Confident	48 Å²	48	43.2 Å²	43.2	31%	0.312	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-42.4	-176.9	-26.8	35.6	0	0	0	113.7	Q303 Y396 G400	Q303-P398 HydrophobicContact CB-CG 4.25Å; Q303-P398 HydrophobicContact CG-CG 3.37Å; Y396-P398 HydrophobicContact CD2-CG 4.4Å; Y396-P398 HydrophobicContact CE2-CB 4.24Å; Y396-P398 HydrophobicContact CE2-CG 3.88Å; Y396-P398 WeakPolarHBondContact O-CD 3.29Å; P398-G400 VanDerWaalsContact C-N 3.29Å; P398-G400 PolarHBondContact O-N 2.74Å
399	D	80.3	Confident	81.3	Confident	94 Å²	94	44.9 Å²	44.9	50%	0.503	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-76.5	-20.6	-179.1	-50.8	-46.2	0	0	0	112.3	W397 L401 L402 Y403	W397-D399 VanDerWaalsContact C-N 3.33Å; W397-D399 HydrophobicContact CD2-CB 4.44Å; W397-D399 HydrophobicContact CH2-CB 4.49Å; W397-D399 HydrophobicContact CZ2-CB 3.8Å; W397-D399 PolarHBondContact NE1-OD2 3.24Å; W397-D399 PolarHBondContact O-N 3.34Å; D399-L401 PolarHBondContact O-N 3.5Å; D399-L402 WeakPolarHBondContact O-CB 3.27Å; D399-L402 PolarHBondContact O-N 2.72Å; D399-Y403 WeakPolarHBondContact O-CD2 2.98Å
400	G	71.9	Confident	80.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-66.6	-24.4	179.3	0	0	0	0	0	113.7	W397 P398 L402 Y403 S404	W397-G400 PolarHBondContact O-N 2.75Å; W397-G400 VanDerWaalsContact O-N 3.1Å; P398-G400 VanDerWaalsContact C-N 3.29Å; P398-G400 PolarHBondContact O-N 2.74Å; G400-L402 PolarHBondContact O-N 2.85Å; G400-Y403 PolarHBondContact O-N 3.44Å; G400-S404 PolarHBondContact O-N 3.32Å
401	L	62.4	Low	79.5	Confident	62 Å²	62	50.6 Å²	50.6	33%	0.325	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-67.6	-17.8	178.5	-64.8	169.9	0	0	0	112.7	I92 Y396 D399 Y403	I92-L401 HydrophobicContact CB-CD2 4.45Å; I92-L401 HydrophobicContact CG2-CD1 3.97Å; I92-L401 HydrophobicContact CG2-CD2 3.94Å; Y396-L401 HydrophobicContact CD2-CD1 4.23Å; Y396-L401 HydrophobicContact CE2-CD1 4.49Å; D399-L401 PolarHBondContact O-N 3.5Å; L401-Y403 VanDerWaalsContact C-N 3.27Å
402	L	55.6	Low	78.3	Confident	145 Å²	145	53.3 Å²	53.3	76%	0.759	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-75.8	-16.2	172.7	-63.7	169.5	0	0	0	112.8	D399 G400	D399-L402 WeakPolarHBondContact O-CB 3.27Å; D399-L402 PolarHBondContact O-N 2.72Å; G400-L402 PolarHBondContact O-N 2.85Å
403	Y	46.7	Very low	76.8	Confident	189 Å²	189	57.8 Å²	57.8	74%	0.741	30%	0.299	S	S	*	.			trans	-114.4	-2.1	-173	-61.5	-76.6	0	0	0	114.2	D399 G400 L401	D399-Y403 WeakPolarHBondContact O-CD2 2.98Å; G400-Y403 PolarHBondContact O-N 3.44Å; L401-Y403 VanDerWaalsContact C-N 3.27Å
404	S	44.5	Very low	74.9	Confident	114 Å²	114	63 Å²	63	80%	0.797	33%	0.327	S	S	*	.			trans	-100.8	0	176.3	68.1	0	0	0	0	111.8	G400	G400-S404 PolarHBondContact O-N 3.32Å

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