A0A087XCW6_POEFO Loading...

CD209 antigen-like protein E

AlphaFold DB , UniProt , Accession A0A087XCW6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 235 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	33.7	Very low	45.1	Very low	233 Å²	233	137.6 Å²	137.6	100%	1.148	73%	0.729	S	S	*	*				0	118.8	0	-62.6	158.4	87.8	0	0	104.5
2	S	43	Very low	45.4	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	70%	0.702	S	S	*	*				55.5	126.6	57.4	-161.1	0	0	0	0	110.6
3	S	42.2	Very low	45.9	Very low	95 Å²	95	129.2 Å²	129.2	66%	0.664	69%	0.687	S	S	*	*			cis	-143.4	-168.4	-9.3	58.7	0	0	0	0	107.9
4	D	44.9	Very low	46.3	Very low	103 Å²	103	130.1 Å²	130.1	55%	0.551	68%	0.682	S	S	*	*			cis	-160	145.3	16.6	-145.2	-65.6	0	0	0	112.7	Y6	D4-Y6 WeakPolarHBondContact OD1-CD2 3.38Å; D4-Y6 PolarHBondContact OD1-N 2.96Å
5	I	40.8	Very low	46.7	Very low	173 Å²	173	126.2 Å²	126.2	89%	0.887	67%	0.665	S	S	*	*			trans	-145.8	53.8	164.2	-41.1	178.9	0	0	0	110.4	A7	I5-A7 PolarHBondContact O-N 3.07Å
6	Y	41.1	Very low	46.8	Very low	205 Å²	205	127.4 Å²	127.4	80%	0.804	66%	0.658	S	S	*	*			trans	-74.6	117.1	156.7	-82.2	-82.5	0	0	0	109.8	D4 K8	D4-Y6 WeakPolarHBondContact OD1-CD2 3.38Å; D4-Y6 PolarHBondContact OD1-N 2.96Å; Y6-K8 PolarHBondContact O-N 3.47Å; Y6-K8 VanDerWaalsContact O-N 3.07Å
7	A	47.6	Very low	46.9	Very low	84 Å²	84	125.6 Å²	125.6	69%	0.694	64%	0.642	S	S	*	*			trans	-57.5	115.5	168.3	0	0	0	0	0	109.1	I5 V9	I5-A7 PolarHBondContact O-N 3.07Å; A7-V9 PolarHBondContact O-N 3.14Å
8	K	47.7	Very low	47.1	Very low	170 Å²	170	123.6 Å²	123.6	74%	0.739	64%	0.636	S	S	*	*			trans	-71.2	114.6	-172.7	-168.7	172.2	-176.4	176.9	0	109.8	Y6 Q10	Y6-K8 PolarHBondContact O-N 3.47Å; Y6-K8 VanDerWaalsContact O-N 3.07Å; K8-Q10 PolarHBondContact O-N 3.2Å; K8-Q10 VanDerWaalsContact O-N 3.14Å
9	V	48.8	Very low	47.3	Very low	64 Å²	64	126.6 Å²	126.6	39%	0.388	64%	0.639	S	S	.	*			trans	-57.2	115.8	168.9	172.3	0	0	0	0	108.3	A7 N34	A7-V9 PolarHBondContact O-N 3.14Å; V9-N34 HydrophobicContact CG1-CB 3.84Å; V9-N34 VanDerWaalsContact CG1-CG 3.42Å; V9-N34 HydrophobicContact CG2-CB 4.45Å
10	Q	56.3	Low	47.2	Very low	145 Å²	145	130.4 Å²	130.4	68%	0.678	65%	0.651	S	S	*	*			trans	-94.8	-18.3	-172.7	-80.7	-77.2	-16.9	0	0	114.2	K8	K8-Q10 PolarHBondContact O-N 3.2Å; K8-Q10 VanDerWaalsContact O-N 3.14Å
11	L	49.9	Very low	47.2	Very low	126 Å²	126	133 Å²	133	66%	0.66	66%	0.661	S	S	*	*			trans	-158.6	136	168.9	-137.5	73.9	0	0	0	111.4
12	S	49.5	Very low	47.4	Very low	57 Å²	57	130.8 Å²	130.8	40%	0.399	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.6	141.7	160.2	71.1	0	0	0	0	109.3	E32 N34	S12-E32 WeakPolarHBondContact CB-OE2 3.33Å; S12-E32 PolarHBondContact OG-OE2 3.44Å; S12-N34 WeakPolarHBondContact CB-OD1 3.41Å
13	Q	50.9	Low	47.6	Very low	108 Å²	108	134.3 Å²	134.3	51%	0.505	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.2	131	175.3	-169.2	170	-7.5	0	0	109.3	V15 V33	Q13-V15 PolarHBondContact O-N 2.79Å; Q13-V33 PolarHBondContact N-O 3.05Å; Q13-V33 PolarHBondContact O-N 2.86Å
14	K	52.5	Low	48	Very low	143 Å²	143	138 Å²	138	62%	0.622	66%	0.664	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.5	119.5	170.8	-76.5	-174.6	-178.6	-175.5	0	109.1	E32	K14-E32 HydrophobicContact CB-CG 4.49Å; K14-E32 HydrophobicContact CD-CG 4.4Å; K14-E32 WeakPolarHBondContact CE-OE1 3.48Å; K14-E32 HydrophobicContact CG-CG 3.43Å; K14-E32 VanDerWaalsContact CG-CG 3.43Å; K14-E32 IonicContact NZ-OE1 3.65Å
15	V	51.3	Low	48.3	Very low	71 Å²	71	143.8 Å²	143.8	43%	0.43	68%	0.678	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.1	129.2	176.2	-170.5	0	0	0	0	108.1	Q13 K31 V33	Q13-V15 PolarHBondContact O-N 2.79Å; V15-K31 PolarHBondContact N-O 3.41Å; V15-K31 PolarHBondContact O-N 3.06Å; V15-V33 HydrophobicContact CG2-CG2 3.75Å
16	R	48.3	Very low	48.7	Very low	145 Å²	145	141.3 Å²	141.3	55%	0.547	67%	0.671	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.4	130.7	178.8	-177.7	171.8	-66.9	171	3.3	109.5	W28 D30	R16-W28 HydrophobicContact CG-CB 4.26Å; R16-W28 HydrophobicContact CG-CD2 4.22Å; R16-W28 HydrophobicContact CG-CE3 3.48Å; R16-W28 VanDerWaalsContact CG-CE3 3.48Å; R16-W28 HydrophobicContact CG-CZ3 4.11Å; R16-D30 WeakPolarHBondContact CB-OD1 3.43Å; R16-D30 WeakPolarHBondContact CG-OD1 2.86Å; R16-D30 IonicContact CZ-OD1 3.93Å; R16-D30 IonicContact CZ-OD2 3.83Å; R16-D30 IonicContact NE-OD1 2.66Å; R16-D30 PolarHBondContact NE-OD1 3.05Å; R16-D30 IonicContact NE-OD2 3.18Å; R16-D30 IonicContact NH2-OD1 2.61Å; R16-D30 PolarHBondContact NH2-OD1 2.9Å; R16-D30 IonicContact NH2-OD2 2.68Å; R16-D30 PolarHBondContact NH2-OD2 2.87Å
17	Y	49	Very low	49.1	Very low	98 Å²	98	137.7 Å²	137.7	38%	0.384	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.3	153.5	177.9	66.6	-90.8	0	0	0	111.6	E29 K31	Y17-E29 PolarHBondContact N-O 3.18Å; Y17-E29 PolarHBondContact OH-OE2 3.42Å; Y17-K31 HydrophobicContact CE1-CB 3.82Å; Y17-K31 HydrophobicContact CE1-CD 4.08Å
18	T	50.1	Low	49.1	Very low	89 Å²	89	140.1 Å²	140.1	55%	0.546	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-90.4	134.7	173.8	38.4	0	0	0	0	111.2	W28	T18-W28 HydrophobicContact CG2-CE3 3.85Å; T18-W28 HydrophobicContact CG2-CH2 3.77Å; T18-W28 HydrophobicContact CG2-CZ2 4.44Å; T18-W28 HydrophobicContact CG2-CZ3 3.44Å; T18-W28 VanDerWaalsContact CG2-CZ3 3.44Å
19	R	51.8	Low	49.4	Very low	181 Å²	181	135.6 Å²	135.6	68%	0.683	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-79.5	135.9	163.6	-168.9	176.5	-65.2	166.3	4.1	108.2	E21 E29	R19-E21 PolarHBondContact O-N 2.88Å; R19-E29 IonicContact CZ-OE1 2.79Å; R19-E29 IonicContact CZ-OE2 2.65Å; R19-E29 IonicContact NH2-OE1 3.38Å; R19-E29 PolarHBondContact NH2-OE1 2.99Å; R19-E29 IonicContact NH2-OE2 2.71Å; R19-E29 PolarHBondContact NH2-OE2 2.78Å
20	K	44.7	Very low	49.3	Very low	202 Å²	202	136.6 Å²	136.6	88%	0.878	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-68.7	116.1	-178.8	-79.9	-168.8	172.4	-172	0	111.5
21	E	46.8	Very low	49.2	Very low	186 Å²	186	135.6 Å²	135.6	87%	0.869	64%	0.635	S	S	*	*			trans	20.8	112.7	158.7	-65.7	173.6	148.8	0	0	119.5	R19	R19-E21 PolarHBondContact O-N 2.88Å
22	Q	38.7	Very low	49.3	Very low	185 Å²	185	134.3 Å²	134.3	86%	0.864	63%	0.626	S	S	*	*				-131.1	154.2	128.6	-153.4	166.9	-2.2	0	0	107.8
23	E	47.5	Very low	49.4	Very low	191 Å²	191	134.9 Å²	134.9	89%	0.893	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	136.2	-148.1	-66.6	170.2	120.3	0	0	117.5	R25	E23-R25 PolarHBondContact O-N 2.94Å
24	N	50.3	Low	49.2	Very low	172 Å²	172	133.4 Å²	133.4	92%	0.92	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	67	33.3	151.5	-140.1	5.6	0	0	0	119.3
25	R	50.7	Low	49.1	Very low	224 Å²	224	131.5 Å²	131.5	85%	0.845	62%	0.618	S	S	*	*			trans	-147.9	116.6	153.6	-174	174	-73.8	-168.1	-3.1	111.4	E23 D27	E23-R25 PolarHBondContact O-N 2.94Å; R25-D27 PolarHBondContact O-N 2.8Å; R25-D27 VanDerWaalsContact O-N 3.14Å
26	T	48.8	Very low	48.8	Very low	121 Å²	121	136 Å²	136	74%	0.742	63%	0.628	S	S	*	*			trans	-79.3	89.8	173.5	27.4	0	0	0	0	111
27	D	49	Very low	48.7	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	64%	0.644	S	S	*	*			trans	-91.2	144.3	170.9	-162	14.5	0	0	0	111.1	R25	R25-D27 PolarHBondContact O-N 2.8Å; R25-D27 VanDerWaalsContact O-N 3.14Å
28	W	49.5	Very low	48.4	Very low	136 Å²	136	139.1 Å²	139.1	52%	0.515	67%	0.665	S	S	.	*			trans	-125.7	118.7	-171.5	-66.2	96.8	0	0	0	111.1	R16 T18	R16-W28 HydrophobicContact CG-CB 4.26Å; R16-W28 HydrophobicContact CG-CD2 4.22Å; R16-W28 HydrophobicContact CG-CE3 3.48Å; R16-W28 VanDerWaalsContact CG-CE3 3.48Å; R16-W28 HydrophobicContact CG-CZ3 4.11Å; T18-W28 HydrophobicContact CG2-CE3 3.85Å; T18-W28 HydrophobicContact CG2-CH2 3.77Å; T18-W28 HydrophobicContact CG2-CZ2 4.44Å; T18-W28 HydrophobicContact CG2-CZ3 3.44Å; T18-W28 VanDerWaalsContact CG2-CZ3 3.44Å
29	E	52.3	Low	48.5	Very low	74 Å²	74	139.1 Å²	139.1	35%	0.346	68%	0.675	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.3	127.6	173.2	-69.3	178.5	156.5	0	0	110.6	Y17 R19	Y17-E29 PolarHBondContact N-O 3.18Å; Y17-E29 PolarHBondContact OH-OE2 3.42Å; R19-E29 IonicContact CZ-OE1 2.79Å; R19-E29 IonicContact CZ-OE2 2.65Å; R19-E29 IonicContact NH2-OE1 3.38Å; R19-E29 PolarHBondContact NH2-OE1 2.99Å; R19-E29 IonicContact NH2-OE2 2.71Å; R19-E29 PolarHBondContact NH2-OE2 2.78Å
30	D	47.9	Very low	47.8	Very low	85 Å²	85	139.1 Å²	139.1	46%	0.455	68%	0.682	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.9	130.3	170	-71.9	-19.2	0	0	0	109.5	R16	R16-D30 WeakPolarHBondContact CB-OD1 3.43Å; R16-D30 WeakPolarHBondContact CG-OD1 2.86Å; R16-D30 IonicContact CZ-OD1 3.93Å; R16-D30 IonicContact CZ-OD2 3.83Å; R16-D30 IonicContact NE-OD1 2.66Å; R16-D30 PolarHBondContact NE-OD1 3.05Å; R16-D30 IonicContact NE-OD2 3.18Å; R16-D30 IonicContact NH2-OD1 2.61Å; R16-D30 PolarHBondContact NH2-OD1 2.9Å; R16-D30 IonicContact NH2-OD2 2.68Å; R16-D30 PolarHBondContact NH2-OD2 2.87Å
31	K	54.5	Low	47.4	Very low	124 Å²	124	136.9 Å²	136.9	54%	0.539	68%	0.68	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.7	137.6	178.7	-169.1	171.7	-175.1	175.2	0	111.6	V15 Y17	V15-K31 PolarHBondContact N-O 3.41Å; V15-K31 PolarHBondContact O-N 3.06Å; Y17-K31 HydrophobicContact CE1-CB 3.82Å; Y17-K31 HydrophobicContact CE1-CD 4.08Å
32	E	51.1	Low	47	Very low	100 Å²	100	135 Å²	135	47%	0.467	68%	0.681	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.9	136.6	175.4	-72.9	-172.5	-152.4	0	0	111.6	S12 K14	S12-E32 WeakPolarHBondContact CB-OE2 3.33Å; S12-E32 PolarHBondContact OG-OE2 3.44Å; K14-E32 HydrophobicContact CB-CG 4.49Å; K14-E32 HydrophobicContact CD-CG 4.4Å; K14-E32 WeakPolarHBondContact CE-OE1 3.48Å; K14-E32 HydrophobicContact CG-CG 3.43Å; K14-E32 VanDerWaalsContact CG-CG 3.43Å; K14-E32 IonicContact NZ-OE1 3.65Å
33	V	50.9	Low	46.9	Very low	69 Å²	69	133.7 Å²	133.7	42%	0.418	68%	0.68	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.7	146.4	173.7	-75.5	0	0	0	0	110.2	Q13 V15	Q13-V33 PolarHBondContact N-O 3.05Å; Q13-V33 PolarHBondContact O-N 2.86Å; V15-V33 HydrophobicContact CG2-CG2 3.75Å
34	N	47.1	Very low	46.4	Very low	76 Å²	76	131.3 Å²	131.3	41%	0.406	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.9	131.1	-178	-63.6	-20.3	0	0	0	109.5	V9 S12	V9-N34 HydrophobicContact CG1-CB 3.84Å; V9-N34 VanDerWaalsContact CG1-CG 3.42Å; V9-N34 HydrophobicContact CG2-CB 4.45Å; S12-N34 WeakPolarHBondContact CB-OD1 3.41Å
35	I	50.2	Low	45.4	Very low	104 Å²	104	131 Å²	131	53%	0.533	66%	0.661	S	S	.	*			trans	-104.9	131.8	-178.7	-55.8	177.3	0	0	0	109.1
36	Y	46.8	Very low	44.3	Very low	164 Å²	164	130.3 Å²	130.3	64%	0.643	66%	0.659	S	S	*	*			trans	-105.7	134.7	172.8	-55.7	-83.1	0	0	0	108.9
37	Q	45.8	Very low	43.8	Very low	191 Å²	191	128.5 Å²	128.5	89%	0.893	65%	0.652	S	S	*	*			trans	-92.3	118.7	178.8	-84.8	177	-42.4	0	0	111
38	S	41.9	Very low	42.8	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	66%	0.656	S	S	*	*			trans	72.9	149.1	178	-155.1	0	0	0	0	116.4
39	A	52.6	Low	42	Very low	90 Å²	90	126.8 Å²	126.8	74%	0.744	66%	0.664	S	S	*	*			trans	-150.4	92.3	177.2	0	0	0	0	0	109.6
40	E	37.4	Very low	40.9	Very low	181 Å²	181	131.1 Å²	131.1	85%	0.846	69%	0.685	S	S	*	*			trans	-161.2	133.2	165.1	-108.3	152.5	-145.8	0	0	108.4
41	D	36.4	Very low	40.2	Very low	154 Å²	154	132.5 Å²	132.5	82%	0.824	70%	0.699	S	S	*	*			trans	48.2	121.4	172.4	-57.7	-21	0	0	0	121.4
42	V	37.1	Very low	38.9	Very low	148 Å²	148	134.7 Å²	134.7	90%	0.897	71%	0.711	S	S	*	*				-163.9	128.7	116.3	165.4	0	0	0	0	108.7
43	D	38.1	Very low	37.7	Very low	157 Å²	157	138.9 Å²	138.9	84%	0.84	73%	0.73	S	S	*	*			trans	-97.4	142.8	169.8	-124.3	-21.3	0	0	0	110.8
44	D	37	Very low	36.5	Very low	140 Å²	140	144.8 Å²	144.8	75%	0.749	75%	0.753	S	S	*	*			trans	42.7	139.9	156.5	-139.7	5	0	0	0	125
45	Y	28.5	Very low	35.4	Very low	167 Å²	167	144.9 Å²	144.9	66%	0.655	77%	0.772	S	S	*	*			trans	96	142.6	143.1	-129.7	-93.2	0	0	0	125.6
46	Y	28.6	Very low	34.4	Very low	209 Å²	209	149.4 Å²	149.4	82%	0.82	79%	0.791	S	S	*	*			trans	90.3	135	174.1	-72	-80.4	0	0	0	118.7
47	S	37	Very low	33.4	Very low	83 Å²	83	150.7 Å²	150.7	58%	0.58	80%	0.803	S	S	*	*			cis	165.4	-178.1	-18.8	-91	0	0	0	0	108.7
48	V	28.3	Very low	32.9	Very low	130 Å²	130	147.9 Å²	147.9	79%	0.788	80%	0.799	S	S	*	*			trans	91.3	97.2	168.7	-171.3	0	0	0	0	114.8
49	S	32.7	Very low	32.4	Very low	98 Å²	98	150.3 Å²	150.3	69%	0.685	80%	0.797	S	S	*	*				72.5	146.2	85.9	-63.1	0	0	0	0	114.8
50	Q	29.8	Very low	32	Very low	165 Å²	165	157.2 Å²	157.2	77%	0.771	80%	0.804	S	S	*	*			cis	-157.9	-161.1	2.4	-121.4	168.1	-89.8	0	0	108.5
51	P	32.8	Very low	31.7	Very low	115 Å²	115	156.7 Å²	156.7	75%	0.747	80%	0.801	S	S	*	*			cis	-126.9	-101.2	8.8	39.1	-17.2	0	0	0	116.1
52	Q	26.9	Very low	31.5	Very low	170 Å²	170	154.7 Å²	154.7	79%	0.794	80%	0.797	S	S	*	*			trans	-144.9	151.8	-167.7	-69.3	163.2	-109.4	0	0	112
53	E	26.1	Very low	31.7	Very low	188 Å²	188	152.5 Å²	152.5	88%	0.879	79%	0.794	S	S	*	*				-167.9	173.8	112.1	-111.8	176.7	-163.8	0	0	113
54	E	25.3	Very low	31.8	Very low	193 Å²	193	150.8 Å²	150.8	90%	0.902	79%	0.789	S	S	*	*			trans	-65.7	164.4	-157.2	-53.7	178.2	140.8	0	0	117.9
55	G	25	Very low	32	Very low	77 Å²	77	155.3 Å²	155.3	79%	0.794	80%	0.796	S	S	*	*			trans	152.6	95.8	159.9	0	0	0	0	0	116
56	Q	27.6	Very low	32.5	Very low	200 Å²	200	156.5 Å²	156.5	94%	0.935	80%	0.804	S	S	*	*			trans	-72.5	127.8	165	-70.3	170.3	-75	0	0	110.8
57	Q	26.9	Very low	33	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	80%	0.801	S	S	*	*			trans	-155.6	126.4	136.1	-121.4	171.8	3	0	0	114.2	Q59	Q57-Q59 PolarHBondContact O-N 3.45Å
58	T	36.1	Very low	33.5	Very low	132 Å²	132	152 Å²	152	81%	0.81	80%	0.803	S	S	*	*			trans	-71.9	117.2	175.8	-58.1	0	0	0	0	110.7
59	Q	30.1	Very low	34.7	Very low	169 Å²	169	150 Å²	150	79%	0.79	80%	0.795	S	S	*	*			trans	-133.9	106.3	164.4	-157.3	155.6	-4.6	0	0	111.5	Q57 Q61	Q57-Q59 PolarHBondContact O-N 3.45Å; Q59-Q61 PolarHBondContact O-N 2.99Å
60	R	43.9	Very low	35.8	Very low	236 Å²	236	156.3 Å²	156.3	89%	0.891	80%	0.804	S	S	*	*			trans	-70.3	121.1	174.7	-83.8	-175.2	-90.4	-164.4	-7.5	109.7
61	Q	30.9	Very low	37.1	Very low	170 Å²	170	159.6 Å²	159.6	79%	0.794	81%	0.81	S	S	*	*			trans	-129.3	154.5	159.4	-80.4	-160.6	-9.9	0	0	110	Q59	Q59-Q61 PolarHBondContact O-N 2.99Å
62	P	33.7	Very low	38.2	Very low	111 Å²	111	158.3 Å²	158.3	72%	0.721	80%	0.799	S	S	*	*			trans	-81.2	163.2	-145.2	30.7	-36.5	0	0	0	114.2	V64	P62-V64 PolarHBondContact O-N 3.18Å
63	A	40.5	Very low	39.6	Very low	103 Å²	103	159.4 Å²	159.4	85%	0.851	80%	0.801	S	S	*	*			trans	-62.5	95.5	175.6	0	0	0	0	0	111.6	R65	A63-R65 PolarHBondContact O-N 2.72Å
64	V	39.6	Very low	40.9	Very low	121 Å²	121	157.8 Å²	157.8	73%	0.733	80%	0.798	S	S	*	*			trans	-69.9	98.5	166.8	179.1	0	0	0	0	108.1	P62 K66	P62-V64 PolarHBondContact O-N 3.18Å; V64-K66 VanDerWaalsContact C-N 3.28Å; V64-K66 PolarHBondContact O-N 3.44Å
65	R	42.7	Very low	42.5	Very low	235 Å²	235	152.4 Å²	152.4	89%	0.887	78%	0.781	S	S	*	*			trans	-64.6	84.6	175.8	-169.9	-177.5	-169.4	-174.6	4.8	109.8	A63 S67	A63-R65 PolarHBondContact O-N 2.72Å; R65-S67 PolarHBondContact O-N 3.45Å
66	K	38.8	Very low	44.4	Very low	191 Å²	191	156.3 Å²	156.3	83%	0.83	78%	0.776	S	S	*	*			trans	-61.8	98.8	169.6	-78.6	-172.5	177.5	178.7	0	108.7	V64 S68	V64-K66 VanDerWaalsContact C-N 3.28Å; V64-K66 PolarHBondContact O-N 3.44Å; K66-S68 PolarHBondContact O-N 3.02Å
67	S	39	Very low	46.7	Very low	108 Å²	108	152 Å²	152	76%	0.755	76%	0.757	S	S	*	*			trans	-59.5	101.8	170.9	-179.2	0	0	0	0	108.9	R65 S69	R65-S67 PolarHBondContact O-N 3.45Å; S67-S69 VanDerWaalsContact C-N 3.25Å; S67-S69 PolarHBondContact O-N 3.12Å
68	S	47.4	Very low	49.3	Very low	89 Å²	89	148 Å²	148	62%	0.622	74%	0.741	S	S	*	*			trans	-67	86.8	169.6	159.3	0	0	0	0	108.6	K66 R70	K66-S68 PolarHBondContact O-N 3.02Å; S68-R70 PolarHBondContact O-N 3.39Å
69	S	52.3	Low	51.7	Low	89 Å²	89	145.1 Å²	145.1	62%	0.622	73%	0.725	S	S	*	*			trans	-70.5	74.1	172.8	-169.2	0	0	0	0	111	S67 R71	S67-S69 VanDerWaalsContact C-N 3.25Å; S67-S69 PolarHBondContact O-N 3.12Å; S69-R71 PolarHBondContact O-N 2.9Å
70	R	56	Low	54.3	Low	231 Å²	231	146.5 Å²	146.5	87%	0.872	72%	0.723	S	S	*	*			trans	-73.3	22.2	170.5	-86.4	-177.8	-178.4	-167.7	0.8	112.7	S68	S68-R70 PolarHBondContact O-N 3.39Å
71	R	57.1	Low	56.5	Low	234 Å²	234	139.6 Å²	139.6	88%	0.883	70%	0.703	S	S	*	*			trans	-122.8	27.8	-171	-73.8	-166.1	174.9	-165.2	0.1	115.5	S69	S69-R71 PolarHBondContact O-N 2.9Å
72	V	56.9	Low	59.4	Low	87 Å²	87	134.4 Å²	134.4	53%	0.527	69%	0.689	S	S	.	*	S	Bend	trans	-136.6	36.6	171.6	-149.9	0	0	0	0	114.6	C75	V72-C75 HydrophobicContact CG1-CB 4.49Å
73	K	54.8	Low	62.1	Low	193 Å²	193	134.9 Å²	134.9	84%	0.839	68%	0.683	S	S	*	*	S	Bend	trans	-101	-32.5	164.1	-71.7	-166.9	176.3	-172.3	0	113.4	C75	K73-C75 PolarHBondContact O-N 3.34Å
74	L	54.9	Low	64.5	Low	154 Å²	154	132.6 Å²	132.6	81%	0.806	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-66.1	-35.1	178.6	-133.5	73.3	0	0	0	113.2	K76 M77	L74-K76 VanDerWaalsContact C-N 3.32Å; L74-K76 PolarHBondContact O-N 2.93Å; L74-M77 PolarHBondContact O-N 2.99Å
75	C	58	Low	67.2	Low	81 Å²	81	131 Å²	131	55%	0.547	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-71.2	-22.3	-172.5	-154.4	0	0	0	0	114	V72 K73 P79	V72-C75 HydrophobicContact CG1-CB 4.49Å; K73-C75 PolarHBondContact O-N 3.34Å; C75-P79 VanDerWaalsContact O-CD 3.26Å; C75-P79 WeakPolarHBondContact O-CD 3.31Å
76	K	65.5	Low	69.6	Low	158 Å²	158	122 Å²	122	69%	0.687	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-80.8	-19.4	179.1	-68.8	-168.1	176.5	-171.2	0	114	L74 W80	L74-K76 VanDerWaalsContact C-N 3.32Å; L74-K76 PolarHBondContact O-N 2.93Å; K76-W80 VanDerWaalsContact O-CD1 3.31Å
77	M	74.7	Confident	72.2	Confident	111 Å²	111	117.4 Å²	117.4	55%	0.547	61%	0.61	S	S	.	*	H	α-helix	trans	-84.6	-27.1	178.2	-57.3	-54	-67.6	0	0	112.2	L74 W80 I81	L74-M77 PolarHBondContact O-N 2.99Å; M77-W80 PolarHBondContact O-N 3.33Å; M77-W80 VanDerWaalsContact O-N 3.12Å; M77-I81 HydrophobicContact CB-CD1 4.18Å; M77-I81 VanDerWaalsContact O-CG1 3.31Å; M77-I81 WeakPolarHBondContact O-CG1 3.48Å; M77-I81 PolarHBondContact O-N 3.38Å
78	L	83.4	Confident	74.9	Confident	105 Å²	105	116.7 Å²	116.7	55%	0.55	60%	0.597	S	S	.	*	H	α-helix	trans	-58.4	-43.4	-179.3	-66.7	170.3	0	0	0	113.6	W80 I81 A82	L78-W80 VanDerWaalsContact C-N 3.34Å; L78-W80 PolarHBondContact O-N 2.92Å; L78-I81 PolarHBondContact O-N 3.47Å; L78-A82 WeakPolarHBondContact O-CB 3.26Å; L78-A82 PolarHBondContact O-N 3.5Å
79	P	86.1	Confident	77.1	Confident	72 Å²	72	115.6 Å²	115.6	47%	0.468	59%	0.589	S	S	.	*	H	α-helix	trans	-61.8	-39.4	173.4	-23.7	34.1	0	0	0	113	C75 A82 M83	C75-P79 VanDerWaalsContact O-CD 3.26Å; C75-P79 WeakPolarHBondContact O-CD 3.31Å; P79-A82 PolarHBondContact O-N 3.35Å; P79-M83 WeakPolarHBondContact O-CB 3.42Å; P79-M83 VanDerWaalsContact O-CG 3.25Å; P79-M83 WeakPolarHBondContact O-CG 3.49Å; P79-M83 PolarHBondContact O-N 2.88Å
80	W	84.5	Confident	79.1	Confident	198 Å²	198	117.2 Å²	117.2	75%	0.75	59%	0.59	S	S	*	*	H	α-helix	trans	-69.1	-40.1	-179.5	-73.4	64.3	0	0	0	111.8	K76 M77 L78 M83 S84	K76-W80 VanDerWaalsContact O-CD1 3.31Å; M77-W80 PolarHBondContact O-N 3.33Å; M77-W80 VanDerWaalsContact O-N 3.12Å; L78-W80 VanDerWaalsContact C-N 3.34Å; L78-W80 PolarHBondContact O-N 2.92Å; W80-M83 PolarHBondContact O-N 2.9Å; W80-S84 WeakPolarHBondContact O-CB 3.44Å; W80-S84 PolarHBondContact O-N 2.91Å; W80-S84 PolarHBondContact O-OG 3.42Å
81	I	90.5	Very high	80.9	Confident	91 Å²	91	109.8 Å²	109.8	47%	0.467	57%	0.571	S	S	.	*	H	α-helix	trans	-66.1	-44	173.9	-65.6	163.1	0	0	0	110.4	M77 L78 M83 S84 V85	M77-I81 HydrophobicContact CB-CD1 4.18Å; M77-I81 VanDerWaalsContact O-CG1 3.31Å; M77-I81 WeakPolarHBondContact O-CG1 3.48Å; M77-I81 PolarHBondContact O-N 3.38Å; L78-I81 PolarHBondContact O-N 3.47Å; I81-M83 PolarHBondContact O-N 3.45Å; I81-S84 PolarHBondContact O-N 2.72Å; I81-S84 PolarHBondContact O-OG 3.18Å; I81-V85 HydrophobicContact CG2-CG2 4.41Å; I81-V85 WeakPolarHBondContact O-CB 3.45Å; I81-V85 VanDerWaalsContact O-CG2 3.27Å; I81-V85 WeakPolarHBondContact O-CG2 3.21Å; I81-V85 PolarHBondContact O-N 2.88Å
82	A	91.3	Very high	82.7	Confident	60 Å²	60	102.9 Å²	102.9	50%	0.496	55%	0.55	S	S	.	*	H	α-helix	trans	-61.9	-42.8	176.7	0	0	0	0	0	112	L78 P79 A86	L78-A82 WeakPolarHBondContact O-CB 3.26Å; L78-A82 PolarHBondContact O-N 3.5Å; P79-A82 PolarHBondContact O-N 3.35Å; A82-A86 WeakPolarHBondContact O-CB 3.41Å; A82-A86 PolarHBondContact O-N 3.31Å
83	M	90.3	Very high	84.4	Confident	122 Å²	122	101.4 Å²	101.4	60%	0.601	54%	0.543	S	S	*	.	H	α-helix	trans	-64.9	-42.3	175.1	-72.2	-59.7	-62.9	0	0	112.3	P79 W80 I81 A86 I87	P79-M83 WeakPolarHBondContact O-CB 3.42Å; P79-M83 VanDerWaalsContact O-CG 3.25Å; P79-M83 WeakPolarHBondContact O-CG 3.49Å; P79-M83 PolarHBondContact O-N 2.88Å; W80-M83 PolarHBondContact O-N 2.9Å; I81-M83 PolarHBondContact O-N 3.45Å; M83-A86 PolarHBondContact O-N 3.46Å; M83-I87 WeakPolarHBondContact O-CD1 3.31Å; M83-I87 VanDerWaalsContact O-CG1 3.27Å; M83-I87 WeakPolarHBondContact O-CG1 3.27Å; M83-I87 PolarHBondContact O-N 3.39Å
84	S	91.9	Very high	86.1	Confident	54 Å²	54	99 Å²	99	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-40.3	177.9	69.3	0	0	0	0	112	W80 I81 I87 I88	W80-S84 WeakPolarHBondContact O-CB 3.44Å; W80-S84 PolarHBondContact O-N 2.91Å; W80-S84 PolarHBondContact O-OG 3.42Å; I81-S84 PolarHBondContact O-N 2.72Å; I81-S84 PolarHBondContact O-OG 3.18Å; S84-I87 PolarHBondContact O-N 2.68Å; S84-I88 WeakPolarHBondContact O-CB 3.27Å; S84-I88 WeakPolarHBondContact O-CD1 3.47Å; S84-I88 WeakPolarHBondContact O-CG1 3.33Å; S84-I88 PolarHBondContact O-N 2.91Å
85	V	94.9	Very high	87.9	Confident	89 Å²	89	95.1 Å²	95.1	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-40.3	174.2	171.4	0	0	0	0	111.4	I81 I88 S89	I81-V85 HydrophobicContact CG2-CG2 4.41Å; I81-V85 WeakPolarHBondContact O-CB 3.45Å; I81-V85 VanDerWaalsContact O-CG2 3.27Å; I81-V85 WeakPolarHBondContact O-CG2 3.21Å; I81-V85 PolarHBondContact O-N 2.88Å; V85-I88 PolarHBondContact O-N 3.18Å; V85-S89 VanDerWaalsContact O-CB 3.32Å; V85-S89 WeakPolarHBondContact O-CB 3.28Å; V85-S89 PolarHBondContact O-N 3.35Å
86	A	93.9	Very high	89.3	Confident	44 Å²	44	95.3 Å²	95.3	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-63.6	-43.8	175.3	0	0	0	0	0	112.1	A82 M83 S89 L90	A82-A86 WeakPolarHBondContact O-CB 3.41Å; A82-A86 PolarHBondContact O-N 3.31Å; M83-A86 PolarHBondContact O-N 3.46Å; A86-S89 PolarHBondContact O-N 3.1Å; A86-L90 WeakPolarHBondContact O-CB 3.25Å; A86-L90 VanDerWaalsContact O-CG 3.31Å; A86-L90 WeakPolarHBondContact O-CG 3.38Å; A86-L90 PolarHBondContact O-N 2.92Å
87	I	93.9	Very high	90.5	Very high	96 Å²	96	91.7 Å²	91.7	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-45.8	175.8	-67.5	163	0	0	0	110.8	M83 S84 S89 L90 T91	M83-I87 WeakPolarHBondContact O-CD1 3.31Å; M83-I87 VanDerWaalsContact O-CG1 3.27Å; M83-I87 WeakPolarHBondContact O-CG1 3.27Å; M83-I87 PolarHBondContact O-N 3.39Å; S84-I87 PolarHBondContact O-N 2.68Å; I87-S89 VanDerWaalsContact C-N 3.35Å; I87-S89 PolarHBondContact O-N 2.97Å; I87-L90 PolarHBondContact O-N 3.34Å; I87-T91 HydrophobicContact CG2-CG2 4.41Å; I87-T91 WeakPolarHBondContact O-CG2 3.25Å; I87-T91 PolarHBondContact O-N 2.95Å; I87-T91 PolarHBondContact O-OG1 2.91Å; I87-T91 VanDerWaalsContact O-OG1 3.1Å
88	I	94.8	Very high	90.9	Very high	92 Å²	92	89.4 Å²	89.4	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-60.6	-45.3	177	-69.6	163.8	0	0	0	110.2	S84 V85 L90 T91 I92	S84-I88 WeakPolarHBondContact O-CB 3.27Å; S84-I88 WeakPolarHBondContact O-CD1 3.47Å; S84-I88 WeakPolarHBondContact O-CG1 3.33Å; S84-I88 PolarHBondContact O-N 2.91Å; V85-I88 PolarHBondContact O-N 3.18Å; I88-L90 PolarHBondContact O-N 2.84Å; I88-T91 WeakPolarHBondContact CA-OG1 3.43Å; I88-T91 PolarHBondContact O-N 3.48Å; I88-T91 PolarHBondContact O-OG1 3.36Å; I88-I92 HydrophobicContact CG2-CD1 3.66Å; I88-I92 HydrophobicContact CG2-CG1 4.41Å; I88-I92 WeakPolarHBondContact O-CB 3.45Å; I88-I92 VanDerWaalsContact O-CG1 3.25Å; I88-I92 WeakPolarHBondContact O-CG1 3.4Å; I88-I92 PolarHBondContact O-N 2.89Å
89	S	93.9	Very high	90.9	Very high	66 Å²	66	88.2 Å²	88.2	46%	0.462	48%	0.479	S	S	.	.	H	α-helix	trans	-59.4	-47.8	176	-170.8	0	0	0	0	112.2	V85 A86 I87 T91 I92 C93	V85-S89 VanDerWaalsContact O-CB 3.32Å; V85-S89 WeakPolarHBondContact O-CB 3.28Å; V85-S89 PolarHBondContact O-N 3.35Å; A86-S89 PolarHBondContact O-N 3.1Å; I87-S89 VanDerWaalsContact C-N 3.35Å; I87-S89 PolarHBondContact O-N 2.97Å; S89-T91 PolarHBondContact O-N 3.38Å; S89-I92 PolarHBondContact O-N 2.86Å; S89-C93 PolarHBondContact O-N 3.28Å; S89-C93 PolarHBondContact O-SG 2.91Å; S89-C93 VanDerWaalsContact O-SG 3.36Å
90	L	93.4	Very high	90.8	Very high	124 Å²	124	90.9 Å²	90.9	65%	0.649	48%	0.483	S	S	*	.	H	α-helix	trans	-63.5	-41.4	178.5	-73.1	169.1	0	0	0	112.7	A86 I87 I88 C93 F94	A86-L90 WeakPolarHBondContact O-CB 3.25Å; A86-L90 VanDerWaalsContact O-CG 3.31Å; A86-L90 WeakPolarHBondContact O-CG 3.38Å; A86-L90 PolarHBondContact O-N 2.92Å; I87-L90 PolarHBondContact O-N 3.34Å; I88-L90 PolarHBondContact O-N 2.84Å; L90-C93 PolarHBondContact O-N 2.9Å; L90-F94 WeakPolarHBondContact O-CB 3.4Å; L90-F94 PolarHBondContact O-N 3.46Å
91	T	94.6	Very high	90.4	Very high	75 Å²	75	87 Å²	87	46%	0.46	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-36.9	175.7	56.8	0	0	0	0	112.3	I87 I88 S89 T95	I87-T91 HydrophobicContact CG2-CG2 4.41Å; I87-T91 WeakPolarHBondContact O-CG2 3.25Å; I87-T91 PolarHBondContact O-N 2.95Å; I87-T91 PolarHBondContact O-OG1 2.91Å; I87-T91 VanDerWaalsContact O-OG1 3.1Å; I88-T91 WeakPolarHBondContact CA-OG1 3.43Å; I88-T91 PolarHBondContact O-N 3.48Å; I88-T91 PolarHBondContact O-OG1 3.36Å; S89-T91 PolarHBondContact O-N 3.38Å; T91-T95 WeakPolarHBondContact O-CB 3.35Å; T91-T95 VanDerWaalsContact O-CG2 3.28Å; T91-T95 WeakPolarHBondContact O-CG2 3.35Å; T91-T95 PolarHBondContact O-N 2.83Å; T91-T95 PolarHBondContact O-OG1 3.49Å
92	I	94.5	Very high	89.7	Confident	88 Å²	88	89.3 Å²	89.3	45%	0.451	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-48.4	173.4	-70.8	168.5	0	0	0	110.1	I88 S89 T95 L96	I88-I92 HydrophobicContact CG2-CD1 3.66Å; I88-I92 HydrophobicContact CG2-CG1 4.41Å; I88-I92 WeakPolarHBondContact O-CB 3.45Å; I88-I92 VanDerWaalsContact O-CG1 3.25Å; I88-I92 WeakPolarHBondContact O-CG1 3.4Å; I88-I92 PolarHBondContact O-N 2.89Å; S89-I92 PolarHBondContact O-N 2.86Å; I92-T95 WeakPolarHBondContact CA-OG1 3.18Å; I92-T95 PolarHBondContact O-N 3.44Å; I92-T95 PolarHBondContact O-OG1 2.91Å; I92-L96 HydrophobicContact CG2-CD1 3.82Å; I92-L96 HydrophobicContact CG2-CG 4.33Å; I92-L96 WeakPolarHBondContact O-CB 3.32Å; I92-L96 VanDerWaalsContact O-CG 3.24Å; I92-L96 WeakPolarHBondContact O-CG 3.43Å; I92-L96 PolarHBondContact O-N 2.94Å
93	C	92	Very high	88.6	Confident	57 Å²	57	91.1 Å²	91.1	39%	0.385	49%	0.485	S	S	.	.	H	α-helix	trans	-55.8	-56.8	174.6	-68.2	0	0	0	0	111	S89 L90 T95 L96 E97	S89-C93 PolarHBondContact O-N 3.28Å; S89-C93 PolarHBondContact O-SG 2.91Å; S89-C93 VanDerWaalsContact O-SG 3.36Å; L90-C93 PolarHBondContact O-N 2.9Å; C93-T95 VanDerWaalsContact C-N 3.27Å; C93-T95 PolarHBondContact O-N 3.3Å; C93-L96 CarbonylContact O-C 3.5Å; C93-L96 WeakPolarHBondContact O-CA 3.4Å; C93-L96 WeakPolarHBondContact O-CB 3.44Å; C93-L96 PolarHBondContact O-N 2.96Å; C93-E97 VanDerWaalsContact O-CD 3.28Å; C93-E97 PolarHBondContact O-N 3.14Å
94	F	91.2	Very high	87.3	Confident	143 Å²	143	89 Å²	89	63%	0.627	48%	0.482	S	S	*	.	H	α-helix	trans	-56.3	-39.5	-178.8	-170.2	-99.6	0	0	0	112.9	L90 E97 I98	L90-F94 WeakPolarHBondContact O-CB 3.4Å; L90-F94 PolarHBondContact O-N 3.46Å; F94-E97 PolarHBondContact O-N 3.44Å; F94-I98 HydrophobicContact CD1-CG1 4.24Å; F94-I98 HydrophobicContact CE1-CD1 4.38Å; F94-I98 HydrophobicContact CE1-CG1 3.97Å; F94-I98 HydrophobicContact CZ-CD1 4.35Å; F94-I98 HydrophobicContact CZ-CG1 4.33Å; F94-I98 VanDerWaalsContact O-CG1 3.25Å; F94-I98 WeakPolarHBondContact O-CG1 3.46Å; F94-I98 PolarHBondContact O-N 2.61Å
95	T	92	Very high	85.8	Confident	71 Å²	71	93.5 Å²	93.5	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-36.8	174.8	53.6	0	0	0	0	112.8	T91 I92 C93 I98 I99	T91-T95 WeakPolarHBondContact O-CB 3.35Å; T91-T95 VanDerWaalsContact O-CG2 3.28Å; T91-T95 WeakPolarHBondContact O-CG2 3.35Å; T91-T95 PolarHBondContact O-N 2.83Å; T91-T95 PolarHBondContact O-OG1 3.49Å; I92-T95 WeakPolarHBondContact CA-OG1 3.18Å; I92-T95 PolarHBondContact O-N 3.44Å; I92-T95 PolarHBondContact O-OG1 2.91Å; C93-T95 VanDerWaalsContact C-N 3.27Å; C93-T95 PolarHBondContact O-N 3.3Å; T95-I98 PolarHBondContact O-N 3.34Å; T95-I99 WeakPolarHBondContact O-CB 3.08Å; T95-I99 WeakPolarHBondContact O-CD1 3.32Å; T95-I99 WeakPolarHBondContact O-CG1 3Å; T95-I99 PolarHBondContact O-N 3.34Å
96	L	89.2	Confident	84	Confident	86 Å²	86	92.8 Å²	92.8	45%	0.45	50%	0.495	S	S	.	.	H	α-helix	trans	-64.8	-39.6	172.6	-69.8	171	0	0	0	112.3	I92 C93 I99 K100	I92-L96 HydrophobicContact CG2-CD1 3.82Å; I92-L96 HydrophobicContact CG2-CG 4.33Å; I92-L96 WeakPolarHBondContact O-CB 3.32Å; I92-L96 VanDerWaalsContact O-CG 3.24Å; I92-L96 WeakPolarHBondContact O-CG 3.43Å; I92-L96 PolarHBondContact O-N 2.94Å; C93-L96 CarbonylContact O-C 3.5Å; C93-L96 WeakPolarHBondContact O-CA 3.4Å; C93-L96 WeakPolarHBondContact O-CB 3.44Å; C93-L96 PolarHBondContact O-N 2.96Å; L96-I99 PolarHBondContact O-N 3.5Å; L96-K100 VanDerWaalsContact O-CG 3.29Å; L96-K100 WeakPolarHBondContact O-CG 3.24Å; L96-K100 PolarHBondContact O-N 2.7Å
97	E	88.7	Confident	82	Confident	82 Å²	82	99 Å²	99	38%	0.383	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-45.7	172	-88.7	63	-93	0	0	111.4	C93 F94 I99 K100 L101	C93-E97 VanDerWaalsContact O-CD 3.28Å; C93-E97 PolarHBondContact O-N 3.14Å; F94-E97 PolarHBondContact O-N 3.44Å; E97-I99 VanDerWaalsContact C-N 3.33Å; E97-I99 PolarHBondContact O-N 3.39Å; E97-K100 WeakPolarHBondContact O-CB 3.47Å; E97-K100 PolarHBondContact O-N 3.19Å; E97-K100 IonicContact OE1-NZ 3.71Å; E97-K100 PolarHBondContact OE1-NZ 3.07Å; E97-L101 WeakPolarHBondContact O-CG 3.28Å; E97-L101 PolarHBondContact O-N 3.11Å
98	I	83.5	Confident	80.2	Confident	62 Å²	62	100.1 Å²	100.1	32%	0.318	52%	0.523	S	S	.	.	H	α-helix	trans	-63.8	-36.1	174.8	-67.3	-70.1	0	0	0	111.9	F94 T95 L101 K102	F94-I98 HydrophobicContact CD1-CG1 4.24Å; F94-I98 HydrophobicContact CE1-CD1 4.38Å; F94-I98 HydrophobicContact CE1-CG1 3.97Å; F94-I98 HydrophobicContact CZ-CD1 4.35Å; F94-I98 HydrophobicContact CZ-CG1 4.33Å; F94-I98 VanDerWaalsContact O-CG1 3.25Å; F94-I98 WeakPolarHBondContact O-CG1 3.46Å; F94-I98 PolarHBondContact O-N 2.61Å; T95-I98 PolarHBondContact O-N 3.34Å; I98-L101 HydrophobicContact CD1-CD1 4.44Å; I98-L101 PolarHBondContact O-N 3.42Å; I98-K102 HydrophobicContact CG2-CD 4.18Å; I98-K102 WeakPolarHBondContact O-CG 3.37Å; I98-K102 PolarHBondContact O-N 2.93Å
99	I	83.5	Confident	78.3	Confident	80 Å²	80	100 Å²	100	41%	0.41	53%	0.53	S	S	.	.	H	α-helix	trans	-68.1	-40.5	175.1	-70.6	160.9	0	0	0	110.8	T95 L96 E97 L101 K102 N103	T95-I99 WeakPolarHBondContact O-CB 3.08Å; T95-I99 WeakPolarHBondContact O-CD1 3.32Å; T95-I99 WeakPolarHBondContact O-CG1 3Å; T95-I99 PolarHBondContact O-N 3.34Å; L96-I99 PolarHBondContact O-N 3.5Å; E97-I99 VanDerWaalsContact C-N 3.33Å; E97-I99 PolarHBondContact O-N 3.39Å; I99-L101 VanDerWaalsContact C-N 3.33Å; I99-L101 PolarHBondContact O-N 3.49Å; I99-K102 PolarHBondContact O-N 3.41Å; I99-N103 WeakPolarHBondContact O-CB 3.47Å; I99-N103 VanDerWaalsContact O-CG 3.3Å; I99-N103 PolarHBondContact O-N 2.79Å
100	K	84.8	Confident	76.6	Confident	129 Å²	129	100 Å²	100	56%	0.561	54%	0.541	S	S	*	.	H	α-helix	trans	-58.9	-44.1	172.9	-70.3	164.1	-170.1	166.2	0	111.3	L96 E97 N103 S104	L96-K100 VanDerWaalsContact O-CG 3.29Å; L96-K100 WeakPolarHBondContact O-CG 3.24Å; L96-K100 PolarHBondContact O-N 2.7Å; E97-K100 WeakPolarHBondContact O-CB 3.47Å; E97-K100 PolarHBondContact O-N 3.19Å; E97-K100 IonicContact OE1-NZ 3.71Å; E97-K100 PolarHBondContact OE1-NZ 3.07Å; K100-N103 PolarHBondContact O-N 3.17Å; K100-S104 WeakPolarHBondContact O-CB 3.48Å; K100-S104 PolarHBondContact O-N 3.04Å
101	L	75.2	Confident	75.1	Confident	115 Å²	115	100.6 Å²	100.6	60%	0.602	54%	0.538	S	S	*	.	H	α-helix	trans	-64	-44	176.8	-68.8	170.2	0	0	0	112.3	E97 I98 I99 S104 H105	E97-L101 WeakPolarHBondContact O-CG 3.28Å; E97-L101 PolarHBondContact O-N 3.11Å; I98-L101 HydrophobicContact CD1-CD1 4.44Å; I98-L101 PolarHBondContact O-N 3.42Å; I99-L101 VanDerWaalsContact C-N 3.33Å; I99-L101 PolarHBondContact O-N 3.49Å; L101-S104 WeakPolarHBondContact O-CB 3.23Å; L101-S104 PolarHBondContact O-N 3.11Å; L101-H105 PolarHBondContact O-N 3Å; L101-H105 VanDerWaalsContact O-N 3.14Å
102	K	75.6	Confident	74.5	Confident	141 Å²	141	104.8 Å²	104.8	61%	0.613	55%	0.546	S	S	*	.	H	α-helix	trans	-64.5	-40.3	175	-73.7	176.1	179.1	-177.4	0	112.5	I98 I99 H105 S106	I98-K102 HydrophobicContact CG2-CD 4.18Å; I98-K102 WeakPolarHBondContact O-CG 3.37Å; I98-K102 PolarHBondContact O-N 2.93Å; I99-K102 PolarHBondContact O-N 3.41Å; K102-H105 WeakPolarHBondContact O-CB 3.33Å; K102-H105 PolarHBondContact O-N 3.47Å; K102-S106 PolarHBondContact O-N 2.78Å
103	N	68.8	Low	74.4	Confident	98 Å²	98	101.5 Å²	101.5	52%	0.524	53%	0.531	S	S	.	.	H	α-helix	trans	-67	-39.1	177.3	-75.7	2.2	0	0	0	111.6	I99 K100 H105 S106 H107	I99-N103 WeakPolarHBondContact O-CB 3.47Å; I99-N103 VanDerWaalsContact O-CG 3.3Å; I99-N103 PolarHBondContact O-N 2.79Å; K100-N103 PolarHBondContact O-N 3.17Å; N103-H105 VanDerWaalsContact C-N 3.32Å; N103-H105 PolarHBondContact O-N 3.38Å; N103-S106 WeakPolarHBondContact CA-OG 3.37Å; N103-S106 PolarHBondContact O-N 3.14Å; N103-S106 PolarHBondContact O-OG 3.42Å; N103-H107 PolarHBondContact O-N 3.2Å
104	S	63.8	Low	74.4	Confident	77 Å²	77	101.6 Å²	101.6	54%	0.538	53%	0.531	S	S	.	.	H	α-helix	trans	-56.4	-46.2	171.3	-168.6	0	0	0	0	111.5	K100 L101 S106 H107	K100-S104 WeakPolarHBondContact O-CB 3.48Å; K100-S104 PolarHBondContact O-N 3.04Å; L101-S104 WeakPolarHBondContact O-CB 3.23Å; L101-S104 PolarHBondContact O-N 3.11Å; S104-S106 VanDerWaalsContact C-N 3.33Å; S104-S106 PolarHBondContact O-N 2.8Å; S104-H107 PolarHBondContact O-N 3.39Å
105	H	60.6	Low	74.5	Confident	149 Å²	149	100.8 Å²	100.8	69%	0.69	53%	0.533	S	S	*	.	H	α-helix	trans	-60.2	-37.8	172.3	-108.1	-83	0	0	0	113.5	L101 K102 N103 H107 L108	L101-H105 PolarHBondContact O-N 3Å; L101-H105 VanDerWaalsContact O-N 3.14Å; K102-H105 WeakPolarHBondContact O-CB 3.33Å; K102-H105 PolarHBondContact O-N 3.47Å; N103-H105 VanDerWaalsContact C-N 3.32Å; N103-H105 PolarHBondContact O-N 3.38Å; H105-H107 VanDerWaalsContact C-N 3.33Å; H105-L108 PolarHBondContact O-N 3.48Å
106	S	56.7	Low	74.5	Confident	73 Å²	73	100.5 Å²	100.5	51%	0.51	54%	0.544	S	S	.	.	H	α-helix	trans	-70.7	-26.5	177.1	74.2	0	0	0	0	113.5	K102 N103 S104 L108 S109	K102-S106 PolarHBondContact O-N 2.78Å; N103-S106 WeakPolarHBondContact CA-OG 3.37Å; N103-S106 PolarHBondContact O-N 3.14Å; N103-S106 PolarHBondContact O-OG 3.42Å; S104-S106 VanDerWaalsContact C-N 3.33Å; S104-S106 PolarHBondContact O-N 2.8Å; S106-L108 PolarHBondContact O-N 3.37Å; S106-S109 WeakPolarHBondContact O-CB 3.49Å; S106-S109 PolarHBondContact O-N 2.95Å
107	H	52	Low	74.8	Confident	176 Å²	176	98.1 Å²	98.1	82%	0.815	53%	0.529	S	S	*	.	H	α-helix	trans	-76.2	-10.3	177.1	-155.5	-71.6	0	0	0	113	N103 S104 H105 S109	N103-H107 PolarHBondContact O-N 3.2Å; S104-H107 PolarHBondContact O-N 3.39Å; H105-H107 VanDerWaalsContact C-N 3.33Å; H107-S109 VanDerWaalsContact C-N 3.31Å
108	L	56.1	Low	75.2	Confident	118 Å²	118	97.2 Å²	97.2	62%	0.618	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	5.4	166.3	-77.3	146.9	0	0	0	112.9	H105 S106 G110	H105-L108 PolarHBondContact O-N 3.48Å; S106-L108 PolarHBondContact O-N 3.37Å; L108-G110 PolarHBondContact O-N 3.12Å
109	S	53.8	Low	75.7	Confident	89 Å²	89	99.9 Å²	99.9	62%	0.622	54%	0.535	S	S	*	.			trans	-74.1	22.1	-178.1	-169.1	0	0	0	0	114.9	S106 H107	S106-S109 WeakPolarHBondContact O-CB 3.49Å; S106-S109 PolarHBondContact O-N 2.95Å; H107-S109 VanDerWaalsContact C-N 3.31Å
110	G	58.4	Low	76.3	Confident	68 Å²	68	99.2 Å²	99.2	70%	0.701	53%	0.529	S	S	*	.	S	Bend	trans	-102.8	78.6	177	0	0	0	0	0	112.1	L108	L108-G110 PolarHBondContact O-N 3.12Å
111	K	62.5	Low	76.6	Confident	135 Å²	135	95.3 Å²	95.3	59%	0.587	53%	0.526	S	S	*	.			trans	59.2	108.9	-171	-64	-166.8	-179.3	-173.1	0	114.1	C113 D115	K111-C113 PolarHBondContact O-N 3.32Å; K111-D115 IonicContact NZ-OD1 3.79Å; K111-D115 PolarHBondContact NZ-OD1 3.04Å; K111-D115 IonicContact NZ-OD2 2.99Å; K111-D115 PolarHBondContact NZ-OD2 3.19Å
112	W	81.1	Confident	77.4	Confident	163 Å²	163	95.9 Å²	95.9	62%	0.617	54%	0.538	S	S	*	.	S	Bend	trans	-67.7	-16.7	178.9	-72.7	-8.4	0	0	0	114.9	R119 C124	W112-R119 VanDerWaalsContact CE3-NH1 3.34Å; W112-R119 VanDerWaalsContact CZ3-NH1 3.34Å; W112-C124 PolarHBondContact O-SG 2.95Å
113	C	92.7	Very high	78.4	Confident	20 Å²	20	90.5 Å²	90.5	14%	0.135	52%	0.519	C	S	.	.	S	Bend	trans	-140.2	153.6	166.8	-67.8	0	0	0	0	110.3	K111 W117 R119 C124	K111-C113 PolarHBondContact O-N 3.32Å; C113-W117 HydrophobicContact CB-CB 3.96Å; C113-R119 VanDerWaalsContact SG-CB 3.55Å; C113-C124 WeakPolarHBondContact CA-SG 3.41Å; C113-C124 HydrophobicContact CB-CB 3.81Å; C113-C124 WeakPolarHBondContact CB-SG 3.49Å; C113-C124 VanDerWaalsContact SG-CA 3.58Å; C113-C124 WeakPolarHBondContact SG-CB 3.42Å; C113-C124 CovalentContact SG-SG 2.03Å; C113-C124 PolarHBondContact SG-SG 3.42Å
114	P	92.6	Very high	79.7	Confident	59 Å²	59	86.3 Å²	86.3	38%	0.383	50%	0.497	S	S	.	.			trans	-63.7	161.6	173.8	-16	29	0	0	0	112.2	G116 W117 K235	P114-G116 PolarHBondContact O-N 3.45Å; P114-W117 HydrophobicContact CB-CG 4.24Å; P114-W117 HydrophobicContact CG-CG 4.23Å; P114-W117 WeakPolarHBondContact O-CB 3.25Å; P114-W117 PolarHBondContact O-N 3.26Å; P114-K235 HydrophobicContact CG-CD 4.3Å
115	D	92.2	Very high	81.4	Confident	125 Å²	125	82.8 Å²	82.8	67%	0.668	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	134.2	176.8	-68.1	-51.8	0	0	0	111.4	K111	K111-D115 IonicContact NZ-OD1 3.79Å; K111-D115 PolarHBondContact NZ-OD1 3.04Å; K111-D115 IonicContact NZ-OD2 2.99Å; K111-D115 PolarHBondContact NZ-OD2 3.19Å
116	G	92.2	Very high	83.2	Confident	66 Å²	66	77.5 Å²	77.5	68%	0.68	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-4.3	-172.1	0	0	0	0	0	115.3	P114	P114-G116 PolarHBondContact O-N 3.45Å
117	W	96.3	Very high	85.1	Confident	36 Å²	36	76.3 Å²	76.3	14%	0.136	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-100.7	140.3	177.4	-64.5	64.2	0	0	0	111.4	C113 P114 C124 Y125 F126 K144 A146 C233 K235	C113-W117 HydrophobicContact CB-CB 3.96Å; P114-W117 HydrophobicContact CB-CG 4.24Å; P114-W117 HydrophobicContact CG-CG 4.23Å; P114-W117 WeakPolarHBondContact O-CB 3.25Å; P114-W117 PolarHBondContact O-N 3.26Å; W117-C124 HydrophobicContact CB-CB 4.28Å; W117-C124 HydrophobicContact CE3-CB 3.95Å; W117-C124 WeakPolarHBondContact CZ3-O 3.26Å; W117-Y125 CarbonylContact C-O 3.57Å; W117-Y125 WeakPolarHBondContact CA-O 3.42Å; W117-F126 HydrophobicContact CD2-CB 3.59Å; W117-F126 HydrophobicContact CE3-CB 3.61Å; W117-F126 HydrophobicContact CG-CB 4.22Å; W117-F126 HydrophobicContact CH2-CB 3.77Å; W117-F126 HydrophobicContact CZ2-CB 3.74Å; W117-F126 HydrophobicContact CZ2-CG 4.28Å; W117-F126 HydrophobicContact CZ3-CB 3.71Å; W117-K144 HydrophobicContact CH2-CB 4.35Å; W117-K144 HydrophobicContact CZ2-CB 3.85Å; W117-K144 HydrophobicContact CZ2-CG 4.29Å; W117-A146 HydrophobicContact CH2-CB 3.58Å; W117-A146 HydrophobicContact CZ3-CB 4.14Å; W117-C233 HydrophobicContact CH2-CB 3.63Å; W117-C233 HydrophobicContact CZ3-CB 3.91Å; W117-K235 HydrophobicContact CD2-CD 4.31Å; W117-K235 HydrophobicContact CE3-CD 3.99Å; W117-K235 HydrophobicContact CE3-CG 3.99Å; W117-K235 HydrophobicContact CH2-CD 4.06Å; W117-K235 HydrophobicContact CH2-CG 4.33Å; W117-K235 HydrophobicContact CZ2-CD 4.35Å; W117-K235 HydrophobicContact CZ3-CB 4.46Å; W117-K235 HydrophobicContact CZ3-CD 3.86Å; W117-K235 HydrophobicContact CZ3-CG 3.74Å
118	T	96.1	Very high	87.1	Confident	62 Å²	62	68 Å²	68	38%	0.38	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.5	177.4	-62.3	0	0	0	0	110	Y125 F159 F163	T118-Y125 PolarHBondContact N-O 3.4Å; T118-Y125 PolarHBondContact O-N 2.86Å; T118-F159 HydrophobicContact CG2-CE2 4.14Å; T118-F159 HydrophobicContact CG2-CZ 4.1Å; T118-F163 HydrophobicContact CG2-CD2 4.35Å; T118-F163 HydrophobicContact CG2-CE2 4.17Å; T118-F163 WeakPolarHBondContact OG1-CE2 3.48Å
119	R	95.2	Very high	88.9	Confident	118 Å²	118	71.4 Å²	71.4	45%	0.445	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.5	-179.3	-171.9	166.6	172.5	-97.1	0.4	112	W112 C113 G121	W112-R119 VanDerWaalsContact CE3-NH1 3.34Å; W112-R119 VanDerWaalsContact CZ3-NH1 3.34Å; C113-R119 VanDerWaalsContact SG-CB 3.55Å; R119-G121 PolarHBondContact NE-O 3.19Å; R119-G121 PolarHBondContact NH2-O 2.81Å
120	F	95.3	Very high	90.8	Very high	66 Å²	66	72 Å²	72	29%	0.289	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	129.9	163.9	174.3	-95.8	0	0	0	109.5	C122 S123 Y125 A155 E156 F159	F120-C122 PolarHBondContact O-N 2.03Å; F120-S123 PolarHBondContact N-O 2.88Å; F120-S123 PolarHBondContact O-N 2.66Å; F120-S123 VanDerWaalsContact O-N 3.12Å; F120-S123 VanDerWaalsContact O-O 3.12Å; F120-Y125 HydrophobicContact CB-CD2 4.1Å; F120-Y125 HydrophobicContact CB-CE2 3.63Å; F120-Y125 HydrophobicContact CD1-CE2 4.27Å; F120-Y125 HydrophobicContact CG-CE2 4.47Å; F120-A155 HydrophobicContact CZ-CB 4.09Å; F120-A155 WeakPolarHBondContact CZ-O 3.41Å; F120-E156 HydrophobicContact CE1-CB 4.05Å; F120-F159 HydrophobicContact CB-CD1 3.72Å; F120-F159 HydrophobicContact CB-CD2 3.81Å; F120-F159 HydrophobicContact CB-CE1 3.7Å; F120-F159 HydrophobicContact CB-CE2 3.78Å; F120-F159 HydrophobicContact CB-CG 3.79Å; F120-F159 HydrophobicContact CB-CZ 3.73Å; F120-F159 HydrophobicContact CD1-CB 4.1Å; F120-F159 AromaticContact CD1-CD1 3.88Å; F120-F159 HydrophobicContact CD1-CD1 3.88Å; F120-F159 AromaticContact CD1-CG 3.96Å; F120-F159 HydrophobicContact CD1-CG 3.96Å; F120-F159 HydrophobicContact CD2-CB 3.71Å; F120-F159 HydrophobicContact CD2-CD1 4.29Å; F120-F159 AromaticContact CD2-CD2 3.7Å; F120-F159 HydrophobicContact CD2-CD2 3.7Å; F120-F159 HydrophobicContact CD2-CE2 4.45Å; F120-F159 AromaticContact CD2-CG 3.61Å; F120-F159 HydrophobicContact CD2-CG 3.61Å; F120-F159 HydrophobicContact CE1-CB 4.09Å; F120-F159 HydrophobicContact CE1-CG 4.46Å; F120-F159 HydrophobicContact CE2-CB 3.69Å; F120-F159 HydrophobicContact CE2-CD2 4.46Å; F120-F159 HydrophobicContact CE2-CG 4.14Å; F120-F159 HydrophobicContact CG-CB 3.92Å; F120-F159 AromaticContact CG-CD1 3.71Å; F120-F159 HydrophobicContact CG-CD1 3.71Å; F120-F159 AromaticContact CG-CD2 3.84Å; F120-F159 HydrophobicContact CG-CD2 3.84Å; F120-F159 HydrophobicContact CG-CE1 4.22Å; F120-F159 HydrophobicContact CG-CE2 4.33Å; F120-F159 AromaticContact CG-CG 3.5Å; F120-F159 HydrophobicContact CG-CG 3.5Å; F120-F159 HydrophobicContact CZ-CB 3.89Å
121	G	92.4	Very high	92.7	Very high	48 Å²	48	75.4 Å²	75.4	50%	0.495	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	-120.8	-172.6	0	0	0	0	0	112.8	R119	R119-G121 PolarHBondContact NE-O 3.19Å; R119-G121 PolarHBondContact NH2-O 2.81Å
122	C	92	Very high	94.3	Very high	127 Å²	127	71 Å²	71	86%	0.858	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-9	176.4	-67.4	0	0	0	0	113.8	F120	F120-C122 PolarHBondContact O-N 2.03Å
123	S	95.9	Very high	95.1	Very high	28 Å²	28	64.1 Å²	64.1	20%	0.196	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	160.8	-176.8	-50.8	0	0	0	0	112.2	F120 E234 K235	F120-S123 PolarHBondContact N-O 2.88Å; F120-S123 PolarHBondContact O-N 2.66Å; F120-S123 VanDerWaalsContact O-N 3.12Å; F120-S123 VanDerWaalsContact O-O 3.12Å; S123-E234 VanDerWaalsContact CB-OE1 3.22Å; S123-E234 WeakPolarHBondContact CB-OE1 3.44Å; S123-E234 PolarHBondContact OG-OE1 3.13Å; S123-K235 CarbonylContact C-O 3.57Å; S123-K235 WeakPolarHBondContact CA-O 3.27Å
124	C	97.1	Very high	95.4	Very high	10 Å²	10	63.3 Å²	63.3	7%	0.068	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.1	173.3	-62.1	0	0	0	0	110.3	W112 C113 W117 E234 K235	W112-C124 PolarHBondContact O-SG 2.95Å; C113-C124 WeakPolarHBondContact CA-SG 3.41Å; C113-C124 HydrophobicContact CB-CB 3.81Å; C113-C124 WeakPolarHBondContact CB-SG 3.49Å; C113-C124 VanDerWaalsContact SG-CA 3.58Å; C113-C124 WeakPolarHBondContact SG-CB 3.42Å; C113-C124 CovalentContact SG-SG 2.03Å; C113-C124 PolarHBondContact SG-SG 3.42Å; W117-C124 HydrophobicContact CB-CB 4.28Å; W117-C124 HydrophobicContact CE3-CB 3.95Å; W117-C124 WeakPolarHBondContact CZ3-O 3.26Å; C124-E234 WeakPolarHBondContact O-CA 3.44Å; C124-K235 HydrophobicContact CB-CD 4.45Å; C124-K235 HydrophobicContact CB-CG 3.82Å; C124-K235 PolarHBondContact N-O 3.31Å; C124-K235 PolarHBondContact O-N 3.16Å
125	Y	98.1	Very high	95.6	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.008	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.9	-174.9	-54.1	-100.1	0	0	0	111.7	W117 T118 F120 V149 E156 F159 I160 I232 C233 E234	W117-Y125 CarbonylContact C-O 3.57Å; W117-Y125 WeakPolarHBondContact CA-O 3.42Å; T118-Y125 PolarHBondContact N-O 3.4Å; T118-Y125 PolarHBondContact O-N 2.86Å; F120-Y125 HydrophobicContact CB-CD2 4.1Å; F120-Y125 HydrophobicContact CB-CE2 3.63Å; F120-Y125 HydrophobicContact CD1-CE2 4.27Å; F120-Y125 HydrophobicContact CG-CE2 4.47Å; Y125-V149 HydrophobicContact CD1-CG2 3.93Å; Y125-V149 HydrophobicContact CE1-CG2 3.68Å; Y125-E156 PolarHBondContact OH-OE1 2.66Å; Y125-F159 AromaticContact CD1-CE1 4Å; Y125-F159 HydrophobicContact CD1-CE1 4Å; Y125-F159 HydrophobicContact CD2-CD1 4.48Å; Y125-F159 AromaticContact CD2-CE1 3.51Å; Y125-F159 HydrophobicContact CD2-CE1 3.51Å; Y125-F159 AromaticContact CD2-CZ 3.94Å; Y125-F159 HydrophobicContact CD2-CZ 3.94Å; Y125-F159 HydrophobicContact CE1-CE1 4.24Å; Y125-F159 HydrophobicContact CE2-CD1 4.39Å; Y125-F159 AromaticContact CE2-CE1 3.83Å; Y125-F159 HydrophobicContact CE2-CE1 3.83Å; Y125-F159 AromaticContact CG-CE1 3.61Å; Y125-F159 HydrophobicContact CG-CE1 3.61Å; Y125-F159 HydrophobicContact CG-CZ 4.19Å; Y125-I160 HydrophobicContact CD1-CD1 3.89Å; Y125-I160 HydrophobicContact CE1-CD1 4.11Å; Y125-I232 HydrophobicContact CD1-CG2 4.43Å; Y125-C233 VanDerWaalsContact CA-O 3.25Å; Y125-C233 WeakPolarHBondContact CA-O 3.29Å; Y125-E234 HydrophobicContact CD1-CB 4.09Å; Y125-E234 HydrophobicContact CD1-CG 4Å; Y125-E234 HydrophobicContact CE1-CB 4.13Å; Y125-E234 HydrophobicContact CE1-CG 3.65Å
126	F	97.8	Very high	95.9	Very high	39 Å²	39	64.4 Å²	64.4	17%	0.171	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.5	176.5	170	-91.4	0	0	0	109.8	W117 Y140 W231 I232 C233	W117-F126 HydrophobicContact CD2-CB 3.59Å; W117-F126 HydrophobicContact CE3-CB 3.61Å; W117-F126 HydrophobicContact CG-CB 4.22Å; W117-F126 HydrophobicContact CH2-CB 3.77Å; W117-F126 HydrophobicContact CZ2-CB 3.74Å; W117-F126 HydrophobicContact CZ2-CG 4.28Å; W117-F126 HydrophobicContact CZ3-CB 3.71Å; F126-Y140 AromaticContact CD1-CE1 3.94Å; F126-Y140 HydrophobicContact CD1-CE1 3.94Å; F126-Y140 HydrophobicContact CE1-CD1 4.46Å; F126-Y140 AromaticContact CE1-CE1 3.52Å; F126-Y140 HydrophobicContact CE1-CE1 3.52Å; F126-Y140 AromaticContact CE1-CZ 3.86Å; F126-Y140 HydrophobicContact CZ-CE1 4.29Å; F126-W231 HydrophobicContact CE1-CZ2 4.27Å; F126-I232 CarbonylContact O-C 3.14Å; F126-I232 VanDerWaalsContact O-CA 3.29Å; F126-I232 WeakPolarHBondContact O-CA 3.44Å; F126-C233 HydrophobicContact CB-CB 4.39Å; F126-C233 PolarHBondContact N-O 2.95Å; F126-C233 VanDerWaalsContact N-O 3.11Å; F126-C233 PolarHBondContact O-N 2.82Å
127	K	96.8	Very high	96.2	Very high	48 Å²	48	61.2 Å²	61.2	21%	0.209	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.2	174.2	180	169.8	170.1	175.5	0	109.8	F163 N164 S169 W231 I232	K127-F163 HydrophobicContact CB-CE1 3.74Å; K127-F163 HydrophobicContact CB-CZ 3.91Å; K127-N164 WeakPolarHBondContact CE-OD1 3.17Å; K127-N164 PolarHBondContact NZ-O 2.93Å; K127-N164 PolarHBondContact NZ-OD1 3.02Å; K127-S169 WeakPolarHBondContact CE-OG 3.03Å; K127-W231 CarbonylContact C-O 3.55Å; K127-W231 VanDerWaalsContact CA-O 3.3Å; K127-W231 WeakPolarHBondContact CA-O 3.46Å; K127-I232 HydrophobicContact CB-CG1 4.26Å; K127-I232 HydrophobicContact CG-CG1 4.28Å
128	G	95.3	Very high	96.3	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.01	31%	0.308	C	S	.	.			trans	-70.3	135.1	173.8	0	0	0	0	0	111.9	N230 W231	G128-N230 PolarHBondContact O-ND2 2.92Å; G128-W231 PolarHBondContact N-O 3.28Å
129	E	93.1	Very high	96.5	Very high	190 Å²	190	62.1 Å²	62.1	89%	0.888	31%	0.308	S	S	*	.	S	Bend	trans	-81.3	-35.2	-179.6	-63.2	-178	173.6	0	0	113.1	N230	E129-N230 VanDerWaalsContact C-ND2 3.3Å; E129-N230 PolarHBondContact O-ND2 3.37Å
130	E	94.9	Very high	96.6	Very high	102 Å²	102	59.1 Å²	59.1	48%	0.477	30%	0.297	S	S	.	.	S	Bend	trans	-78.2	167.9	173.2	61.8	179.7	155	0	0	111.6	K132 N230 W231	E130-K132 WeakPolarHBondContact OE1-CE 3.33Å; E130-K132 IonicContact OE1-NZ 2.72Å; E130-K132 PolarHBondContact OE1-NZ 3.27Å; E130-K132 IonicContact OE2-NZ 3.69Å; E130-K132 PolarHBondContact OE2-NZ 3.44Å; E130-N230 PolarHBondContact O-ND2 3.01Å; E130-N230 VanDerWaalsContact O-ND2 3.14Å; E130-W231 HydrophobicContact CG-CH2 3.57Å; E130-W231 HydrophobicContact CG-CZ3 3.64Å; E130-W231 VanDerWaalsContact O-CZ3 3.22Å; E130-W231 WeakPolarHBondContact O-CZ3 3.38Å
131	R	96.6	Very high	96.8	Very high	139 Å²	139	56 Å²	56	53%	0.525	28%	0.283	S	S	.	.			trans	-105.6	137.9	176.4	-62	176.5	71.9	151.3	7.4	110.4	Y228 N229	R131-Y228 PolarHBondContact NE-O 3.06Å; R131-Y228 PolarHBondContact NH2-O 3.36Å; R131-N229 CarbonylContact C-O 3.53Å; R131-N229 VanDerWaalsContact CA-O 3.25Å; R131-N229 WeakPolarHBondContact CA-O 3.37Å; R131-N229 PolarHBondContact NH2-OD1 3.38Å
132	K	97.6	Very high	97.1	Very high	42 Å²	42	58.1 Å²	58.1	18%	0.183	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-141.5	162.7	-175.9	-72.5	-168.9	-166.3	-54.8	0	111.6	E130 D136 S137 W170 Y228 N229 W231	E130-K132 WeakPolarHBondContact OE1-CE 3.33Å; E130-K132 IonicContact OE1-NZ 2.72Å; E130-K132 PolarHBondContact OE1-NZ 3.27Å; E130-K132 IonicContact OE2-NZ 3.69Å; E130-K132 PolarHBondContact OE2-NZ 3.44Å; K132-D136 HydrophobicContact CB-CB 4.06Å; K132-D136 HydrophobicContact CD-CB 4.05Å; K132-D136 HydrophobicContact CG-CB 4.44Å; K132-S137 WeakPolarHBondContact CB-OG 3.47Å; K132-W170 PolarHBondContact O-NE1 2.87Å; K132-Y228 WeakPolarHBondContact O-CA 3.39Å; K132-N229 PolarHBondContact N-O 3.39Å; K132-N229 PolarHBondContact O-N 2.77Å; K132-W231 HydrophobicContact CB-CE3 4.19Å; K132-W231 HydrophobicContact CB-CZ3 4.16Å; K132-W231 HydrophobicContact CD-CE3 4.28Å; K132-W231 HydrophobicContact CD-CH2 3.86Å; K132-W231 HydrophobicContact CD-CZ3 3.7Å; K132-W231 VanDerWaalsContact CE-CH2 3.46Å; K132-W231 HydrophobicContact CG-CE3 4.25Å; K132-W231 HydrophobicContact CG-CH2 4.33Å; K132-W231 HydrophobicContact CG-CZ3 3.72Å
133	T	98.1	Very high	97.4	Very high	19 Å²	19	59.1 Å²	59.1	12%	0.117	27%	0.272	C	S	.	.			trans	-62.1	161.5	166.9	72.6	0	0	0	0	110.3	Y135 D136 S137 Y225 Y227 Y228	T133-Y135 VanDerWaalsContact C-N 3.29Å; T133-Y135 PolarHBondContact O-N 2.93Å; T133-D136 WeakPolarHBondContact CG2-OD2 3.38Å; T133-D136 PolarHBondContact O-N 3.4Å; T133-D136 WeakPolarHBondContact OG1-CB 3.5Å; T133-D136 PolarHBondContact OG1-N 2.82Å; T133-D136 PolarHBondContact OG1-OD2 2.94Å; T133-S137 VanDerWaalsContact O-CB 3.29Å; T133-S137 WeakPolarHBondContact O-CB 3.49Å; T133-S137 PolarHBondContact O-N 3.14Å; T133-S137 PolarHBondContact O-OG 2.65Å; T133-Y225 WeakPolarHBondContact CB-O 3.34Å; T133-Y227 WeakPolarHBondContact CA-O 3.43Å; T133-Y228 HydrophobicContact CG2-CE1 4.2Å
134	W	97.9	Very high	97.4	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-40.2	178	-174.8	90.2	0	0	0	111.6	S137 R138 L148 W170 I171 Q174 V189 A211 Y225	W134-S137 WeakPolarHBondContact O-CB 3.48Å; W134-S137 PolarHBondContact O-N 3.2Å; W134-R138 WeakPolarHBondContact O-CB 3.48Å; W134-R138 PolarHBondContact O-N 3.41Å; W134-L148 HydrophobicContact CD2-CD1 4.03Å; W134-L148 HydrophobicContact CG-CD1 4.25Å; W134-L148 HydrophobicContact CZ2-CD1 3.94Å; W134-W170 HydrophobicContact CB-CD2 4.05Å; W134-W170 HydrophobicContact CB-CE3 4.39Å; W134-W170 HydrophobicContact CB-CG 4.4Å; W134-W170 HydrophobicContact CB-CZ2 4.33Å; W134-W170 AromaticContact CD1-CD2 3.76Å; W134-W170 AromaticContact CD1-CE3 3.66Å; W134-W170 AromaticContact CD1-CG 3.91Å; W134-W170 HydrophobicContact CG-CD2 4.34Å; W134-W170 HydrophobicContact CG-CE3 4.43Å; W134-I171 PolarHBondContact NE1-O 2.91Å; W134-Q174 HydrophobicContact CH2-CB 4.31Å; W134-Q174 HydrophobicContact CH2-CG 4.11Å; W134-Q174 HydrophobicContact CZ2-CB 4.11Å; W134-Q174 HydrophobicContact CZ2-CG 4.2Å; W134-V189 HydrophobicContact CH2-CG1 3.8Å; W134-V189 HydrophobicContact CZ2-CG1 3.68Å; W134-A211 HydrophobicContact CB-CB 3.8Å; W134-A211 VanDerWaalsContact CD1-CB 3.47Å; W134-A211 HydrophobicContact CD2-CB 4.24Å; W134-A211 HydrophobicContact CG-CB 3.56Å; W134-Y225 HydrophobicContact CB-CD1 4.09Å; W134-Y225 HydrophobicContact CD2-CD1 4.17Å; W134-Y225 HydrophobicContact CD2-CE1 4.11Å; W134-Y225 AromaticContact CE3-CD1 3.88Å; W134-Y225 HydrophobicContact CE3-CD1 3.88Å; W134-Y225 AromaticContact CE3-CE1 3.74Å; W134-Y225 HydrophobicContact CE3-CE1 3.74Å; W134-Y225 HydrophobicContact CG-CD1 4.3Å; W134-Y225 HydrophobicContact CZ3-CE1 4.12Å; W134-Y225 PolarHBondContact N-O 3.41Å; W134-Y225 VanDerWaalsContact N-O 3.15Å
135	Y	97.8	Very high	97.4	Very high	124 Å²	124	65 Å²	65	49%	0.486	31%	0.309	S	S	.	.	H	α-helix	trans	-67.8	-42.1	178.5	-65.3	-64.7	0	0	0	113.1	T133 S137 R138 T139 Y225	T133-Y135 VanDerWaalsContact C-N 3.29Å; T133-Y135 PolarHBondContact O-N 2.93Å; Y135-S137 VanDerWaalsContact C-N 3.33Å; Y135-R138 PolarHBondContact O-N 2.71Å; Y135-T139 WeakPolarHBondContact O-CB 3.04Å; Y135-T139 PolarHBondContact O-N 2.78Å; Y135-T139 PolarHBondContact O-OG1 3.32Å; Y135-Y225 HydrophobicContact CD2-CD1 4.1Å; Y135-Y225 HydrophobicContact CE1-CD1 4.1Å; Y135-Y225 HydrophobicContact CE1-CE1 4.09Å; Y135-Y225 AromaticContact CE2-CD1 3.42Å; Y135-Y225 HydrophobicContact CE2-CD1 3.42Å; Y135-Y225 VanDerWaalsContact CE2-CD1 3.42Å; Y135-Y225 HydrophobicContact CE2-CE1 4.13Å; Y135-Y225 AromaticContact CE2-CG 3.76Å; Y135-Y225 HydrophobicContact CE2-CG 3.76Å; Y135-Y225 AromaticContact CZ-CD1 3.41Å; Y135-Y225 VanDerWaalsContact CZ-CD1 3.41Å; Y135-Y225 AromaticContact CZ-CE1 3.62Å; Y135-Y225 WeakPolarHBondContact OH-CE1 3.16Å
136	D	98.5	Very high	97.4	Very high	83 Å²	83	65.6 Å²	65.6	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-66.4	-38	176.2	-65.5	-44	0	0	0	111.4	K132 T133 T139 Y140	K132-D136 HydrophobicContact CB-CB 4.06Å; K132-D136 HydrophobicContact CD-CB 4.05Å; K132-D136 HydrophobicContact CG-CB 4.44Å; T133-D136 WeakPolarHBondContact CG2-OD2 3.38Å; T133-D136 PolarHBondContact O-N 3.4Å; T133-D136 WeakPolarHBondContact OG1-CB 3.5Å; T133-D136 PolarHBondContact OG1-N 2.82Å; T133-D136 PolarHBondContact OG1-OD2 2.94Å; D136-T139 PolarHBondContact O-N 3.04Å; D136-Y140 PolarHBondContact O-N 3.25Å
137	S	98.5	Very high	97.5	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-46	174.9	-58.7	0	0	0	0	111.4	K132 T133 W134 Y135 Y140 C141	K132-S137 WeakPolarHBondContact CB-OG 3.47Å; T133-S137 VanDerWaalsContact O-CB 3.29Å; T133-S137 WeakPolarHBondContact O-CB 3.49Å; T133-S137 PolarHBondContact O-N 3.14Å; T133-S137 PolarHBondContact O-OG 2.65Å; W134-S137 WeakPolarHBondContact O-CB 3.48Å; W134-S137 PolarHBondContact O-N 3.2Å; Y135-S137 VanDerWaalsContact C-N 3.33Å; S137-Y140 WeakPolarHBondContact O-CB 3.35Å; S137-Y140 PolarHBondContact O-N 3.07Å; S137-C141 PolarHBondContact O-N 3.36Å; S137-C141 VanDerWaalsContact O-N 3.14Å; S137-C141 PolarHBondContact O-SG 2.98Å; S137-C141 VanDerWaalsContact O-SG 3.34Å
138	R	98.4	Very high	97.6	Very high	54 Å²	54	63.1 Å²	63.1	20%	0.204	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-46.2	175.2	-160.1	-173.3	173.1	179.6	-6.9	111.9	W134 Y135 Y140 C141 Q142 D147 L148 V189	W134-R138 WeakPolarHBondContact O-CB 3.48Å; W134-R138 PolarHBondContact O-N 3.41Å; Y135-R138 PolarHBondContact O-N 2.71Å; R138-Y140 VanDerWaalsContact C-N 3.29Å; R138-Y140 PolarHBondContact O-N 3.48Å; R138-C141 PolarHBondContact O-N 2.84Å; R138-C141 VanDerWaalsContact O-N 3.14Å; R138-Q142 VanDerWaalsContact NE-NE2 3.16Å; R138-Q142 WeakPolarHBondContact O-CG 3.3Å; R138-Q142 PolarHBondContact O-N 2.81Å; R138-D147 WeakPolarHBondContact CG-OD1 3.01Å; R138-D147 IonicContact CZ-OD1 2.86Å; R138-D147 IonicContact CZ-OD2 3.38Å; R138-D147 IonicContact NE-OD1 2.79Å; R138-D147 PolarHBondContact NE-OD1 2.98Å; R138-D147 IonicContact NE-OD2 3.12Å; R138-D147 PolarHBondContact NE-OD2 2.72Å; R138-D147 VanDerWaalsContact NE-OD2 3.12Å; R138-D147 IonicContact NH2-OD1 2.74Å; R138-D147 IonicContact NH2-OD2 2.76Å; R138-D147 PolarHBondContact NH2-OD2 3.11Å; R138-L148 HydrophobicContact CB-CD1 3.78Å; R138-L148 HydrophobicContact CB-CG 4.12Å; R138-L148 HydrophobicContact CG-CD1 4.08Å; R138-L148 HydrophobicContact CG-CG 4.19Å; R138-V189 HydrophobicContact CG-CG1 4.25Å; R138-V189 VanDerWaalsContact CZ-CB 3.5Å; R138-V189 VanDerWaalsContact CZ-CG1 3.48Å; R138-V189 VanDerWaalsContact NE-CG1 3.33Å; R138-V189 PolarHBondContact NH2-O 3.17Å
139	T	98.7	Very high	97.7	Very high	63 Å²	63	63 Å²	63	39%	0.387	30%	0.304	S	S	.	.	H	α-helix	trans	-58.5	-41.3	177.2	-58	0	0	0	0	111.4	Y135 D136 Q142 Q143	Y135-T139 WeakPolarHBondContact O-CB 3.04Å; Y135-T139 PolarHBondContact O-N 2.78Å; Y135-T139 PolarHBondContact O-OG1 3.32Å; D136-T139 PolarHBondContact O-N 3.04Å; T139-Q142 PolarHBondContact O-N 3.26Å; T139-Q143 VanDerWaalsContact O-CG 3.3Å; T139-Q143 WeakPolarHBondContact O-CG 3.39Å; T139-Q143 PolarHBondContact O-N 3.48Å
140	Y	98.5	Very high	97.9	Very high	55 Å²	55	55 Å²	55	22%	0.216	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-49.1	173.9	-178.8	-78.3	0	0	0	111.9	F126 D136 S137 R138 Q142 Q143 K144 W231	F126-Y140 AromaticContact CD1-CE1 3.94Å; F126-Y140 HydrophobicContact CD1-CE1 3.94Å; F126-Y140 HydrophobicContact CE1-CD1 4.46Å; F126-Y140 AromaticContact CE1-CE1 3.52Å; F126-Y140 HydrophobicContact CE1-CE1 3.52Å; F126-Y140 AromaticContact CE1-CZ 3.86Å; F126-Y140 HydrophobicContact CZ-CE1 4.29Å; D136-Y140 PolarHBondContact O-N 3.25Å; S137-Y140 WeakPolarHBondContact O-CB 3.35Å; S137-Y140 PolarHBondContact O-N 3.07Å; R138-Y140 VanDerWaalsContact C-N 3.29Å; R138-Y140 PolarHBondContact O-N 3.48Å; Y140-Q142 VanDerWaalsContact C-N 3.33Å; Y140-Q142 PolarHBondContact O-N 3.4Å; Y140-Q143 PolarHBondContact O-N 2.96Å; Y140-K144 HydrophobicContact CD1-CG 4.32Å; Y140-K144 HydrophobicContact CE1-CG 3.9Å; Y140-K144 PolarHBondContact O-N 3.01Å; Y140-K144 WeakPolarHBondContact OH-CE 3.49Å; Y140-W231 AromaticContact CD1-CE2 3.82Å; Y140-W231 AromaticContact CD1-CZ2 3.61Å; Y140-W231 HydrophobicContact CD1-CZ2 3.61Å; Y140-W231 AromaticContact CD1-NE1 3.48Å; Y140-W231 HydrophobicContact CD2-CH2 4.47Å; Y140-W231 AromaticContact CD2-CZ2 3.81Å; Y140-W231 HydrophobicContact CD2-CZ2 3.81Å; Y140-W231 AromaticContact CE1-CZ2 3.9Å; Y140-W231 HydrophobicContact CE1-CZ2 3.9Å; Y140-W231 HydrophobicContact CE2-CZ2 4.05Å; Y140-W231 AromaticContact CG-CZ2 3.59Å; Y140-W231 HydrophobicContact CG-CZ2 3.59Å
141	C	98.6	Very high	98.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.9	-45.1	179.4	-59.1	0	0	0	0	111.2	S137 R138 Q143 K144 G145 A146 D147 W231 C233	S137-C141 PolarHBondContact O-N 3.36Å; S137-C141 VanDerWaalsContact O-N 3.14Å; S137-C141 PolarHBondContact O-SG 2.98Å; S137-C141 VanDerWaalsContact O-SG 3.34Å; R138-C141 PolarHBondContact O-N 2.84Å; R138-C141 VanDerWaalsContact O-N 3.14Å; C141-Q143 VanDerWaalsContact C-N 3.33Å; C141-Q143 PolarHBondContact O-N 2.82Å; C141-K144 CarbonylContact O-C 3.59Å; C141-K144 WeakPolarHBondContact O-CA 3.22Å; C141-K144 WeakPolarHBondContact O-CB 3.36Å; C141-K144 PolarHBondContact O-N 2.83Å; C141-G145 PolarHBondContact O-N 2.99Å; C141-A146 CarbonylContact C-O 3.57Å; C141-A146 HydrophobicContact CB-CB 4.15Å; C141-A146 CarbonylContact O-C 3.39Å; C141-A146 WeakPolarHBondContact O-CA 3.46Å; C141-A146 WeakPolarHBondContact O-CB 3.25Å; C141-A146 PolarHBondContact O-N 3.1Å; C141-A146 VanDerWaalsContact O-O 3.13Å; C141-D147 VanDerWaalsContact CB-C 3.45Å; C141-W231 VanDerWaalsContact SG-CD1 3.54Å; C141-C233 WeakPolarHBondContact CA-SG 3.42Å; C141-C233 HydrophobicContact CB-CB 3.71Å; C141-C233 WeakPolarHBondContact CB-SG 3.3Å; C141-C233 WeakPolarHBondContact SG-CA 3.35Å; C141-C233 WeakPolarHBondContact SG-CB 3.38Å; C141-C233 CovalentContact SG-SG 2.04Å; C141-C233 PolarHBondContact SG-SG 3.43Å
142	Q	98.6	Very high	97.9	Very high	93 Å²	93	47.9 Å²	47.9	44%	0.435	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-38	178.6	-69.5	178.1	-16.1	0	0	112.6	R138 T139 Y140 K144 G145 A146 D147	R138-Q142 VanDerWaalsContact NE-NE2 3.16Å; R138-Q142 WeakPolarHBondContact O-CG 3.3Å; R138-Q142 PolarHBondContact O-N 2.81Å; T139-Q142 PolarHBondContact O-N 3.26Å; Y140-Q142 VanDerWaalsContact C-N 3.33Å; Y140-Q142 PolarHBondContact O-N 3.4Å; Q142-K144 PolarHBondContact O-N 2.64Å; Q142-G145 PolarHBondContact O-N 2.89Å; Q142-A146 WeakPolarHBondContact CA-O 3.42Å; Q142-A146 PolarHBondContact N-O 2.66Å; Q142-D147 PolarHBondContact NE2-OD2 2.81Å
143	Q	98.3	Very high	97.8	Very high	147 Å²	147	47.9 Å²	47.9	69%	0.687	25%	0.248	S	C	*	.	H	α-helix	trans	-64.6	-15.7	171.8	-71	174.2	10.7	0	0	114.2	T139 Y140 C141	T139-Q143 VanDerWaalsContact O-CG 3.3Å; T139-Q143 WeakPolarHBondContact O-CG 3.39Å; T139-Q143 PolarHBondContact O-N 3.48Å; Y140-Q143 PolarHBondContact O-N 2.96Å; C141-Q143 VanDerWaalsContact C-N 3.33Å; C141-Q143 PolarHBondContact O-N 2.82Å
144	K	97	Very high	97.7	Very high	108 Å²	108	53.2 Å²	53.2	47%	0.47	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	7.3	172.2	-56.3	-58.8	-177.1	-178.5	0	113.3	W117 Y140 C141 Q142 K235	W117-K144 HydrophobicContact CH2-CB 4.35Å; W117-K144 HydrophobicContact CZ2-CB 3.85Å; W117-K144 HydrophobicContact CZ2-CG 4.29Å; Y140-K144 HydrophobicContact CD1-CG 4.32Å; Y140-K144 HydrophobicContact CE1-CG 3.9Å; Y140-K144 PolarHBondContact O-N 3.01Å; Y140-K144 WeakPolarHBondContact OH-CE 3.49Å; C141-K144 CarbonylContact O-C 3.59Å; C141-K144 WeakPolarHBondContact O-CA 3.22Å; C141-K144 WeakPolarHBondContact O-CB 3.36Å; C141-K144 PolarHBondContact O-N 2.83Å; Q142-K144 PolarHBondContact O-N 2.64Å; K144-K235 PolarHBondContact O-NZ 3.14Å
145	G	97.3	Very high	97.6	Very high	55 Å²	55	56.1 Å²	56.1	57%	0.567	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	42.4	-173.1	0	0	0	0	0	111.9	C141 Q142 K235	C141-G145 PolarHBondContact O-N 2.99Å; Q142-G145 PolarHBondContact O-N 2.89Å; G145-K235 PolarHBondContact O-NZ 2.95Å
146	A	98.1	Very high	97.6	Very high	13 Å²	13	51 Å²	51	11%	0.107	27%	0.274	C	S	.	.			trans	-134.5	177.5	179.8	0	0	0	0	0	108.4	W117 C141 Q142 C233 E234 K235	W117-A146 HydrophobicContact CH2-CB 3.58Å; W117-A146 HydrophobicContact CZ3-CB 4.14Å; C141-A146 CarbonylContact C-O 3.57Å; C141-A146 HydrophobicContact CB-CB 4.15Å; C141-A146 CarbonylContact O-C 3.39Å; C141-A146 WeakPolarHBondContact O-CA 3.46Å; C141-A146 WeakPolarHBondContact O-CB 3.25Å; C141-A146 PolarHBondContact O-N 3.1Å; C141-A146 VanDerWaalsContact O-O 3.13Å; Q142-A146 WeakPolarHBondContact CA-O 3.42Å; Q142-A146 PolarHBondContact N-O 2.66Å; A146-C233 HydrophobicContact CB-CB 4.12Å; A146-E234 VanDerWaalsContact CA-O 3.32Å; A146-E234 WeakPolarHBondContact CA-O 3.37Å; A146-E234 VanDerWaalsContact CB-O 3.23Å; A146-E234 WeakPolarHBondContact CB-O 3.38Å; A146-K235 HydrophobicContact CB-CB 3.81Å
147	D	98.6	Very high	97.5	Very high	34 Å²	34	47.2 Å²	47.2	18%	0.182	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	-178.4	160.7	-146.1	-46.3	0	0	0	109	R138 C141 Q142 V189 C233 E234	R138-D147 WeakPolarHBondContact CG-OD1 3.01Å; R138-D147 IonicContact CZ-OD1 2.86Å; R138-D147 IonicContact CZ-OD2 3.38Å; R138-D147 IonicContact NE-OD1 2.79Å; R138-D147 PolarHBondContact NE-OD1 2.98Å; R138-D147 IonicContact NE-OD2 3.12Å; R138-D147 PolarHBondContact NE-OD2 2.72Å; R138-D147 VanDerWaalsContact NE-OD2 3.12Å; R138-D147 IonicContact NH2-OD1 2.74Å; R138-D147 IonicContact NH2-OD2 2.76Å; R138-D147 PolarHBondContact NH2-OD2 3.11Å; C141-D147 VanDerWaalsContact CB-C 3.45Å; Q142-D147 PolarHBondContact NE2-OD2 2.81Å; D147-V189 HydrophobicContact CB-CG2 3.97Å; D147-V189 WeakPolarHBondContact OD1-CB 3.44Å; D147-C233 CarbonylContact O-C 3.49Å; D147-C233 WeakPolarHBondContact O-CA 3.35Å; D147-E234 PolarHBondContact N-O 2.98Å; D147-E234 PolarHBondContact O-N 2.94Å
148	L	98.7	Very high	97.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	141.5	170.5	-73.3	170.7	0	0	0	110.2	W134 R138 I150 W170 G172 V189 W231 I232	W134-L148 HydrophobicContact CD2-CD1 4.03Å; W134-L148 HydrophobicContact CG-CD1 4.25Å; W134-L148 HydrophobicContact CZ2-CD1 3.94Å; R138-L148 HydrophobicContact CB-CD1 3.78Å; R138-L148 HydrophobicContact CB-CG 4.12Å; R138-L148 HydrophobicContact CG-CD1 4.08Å; R138-L148 HydrophobicContact CG-CG 4.19Å; L148-I150 PolarHBondContact O-N 2.79Å; L148-W170 HydrophobicContact CD2-CB 4.38Å; L148-G172 VanDerWaalsContact CB-CA 3.47Å; L148-V189 HydrophobicContact CB-CG1 4.26Å; L148-V189 VanDerWaalsContact O-CG2 3.24Å; L148-V189 WeakPolarHBondContact O-CG2 3.29Å; L148-W231 HydrophobicContact CD2-CB 3.84Å; L148-W231 HydrophobicContact CD2-CG 4.32Å; L148-I232 WeakPolarHBondContact CA-O 3.45Å
149	V	98.4	Very high	97.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.27	C	S	.	.			trans	-54.6	134.8	-173	60.1	0	0	0	0	113.5	Y125 I151 I160 I171 G172 I232 E234	Y125-V149 HydrophobicContact CD1-CG2 3.93Å; Y125-V149 HydrophobicContact CE1-CG2 3.68Å; V149-I151 HydrophobicContact CG2-CG1 4.08Å; V149-I160 HydrophobicContact CG1-CD1 4.48Å; V149-I160 HydrophobicContact CG2-CD1 3.9Å; V149-I160 HydrophobicContact CG2-CG1 4.33Å; V149-I171 HydrophobicContact CG1-CB 3.94Å; V149-I171 HydrophobicContact CG1-CG2 3.72Å; V149-G172 WeakPolarHBondContact O-CA 3.36Å; V149-G172 PolarHBondContact O-N 3.03Å; V149-I232 HydrophobicContact CB-CB 4.4Å; V149-I232 HydrophobicContact CB-CG2 3.96Å; V149-I232 HydrophobicContact CG1-CB 3.75Å; V149-I232 HydrophobicContact CG1-CG2 3.8Å; V149-I232 PolarHBondContact N-O 3.15Å; V149-E234 HydrophobicContact CB-CB 4.1Å; V149-E234 HydrophobicContact CG2-CB 4.2Å
150	I	97.8	Very high	97.3	Very high	22 Å²	22	47.2 Å²	47.2	11%	0.113	25%	0.251	C	S	.	.			trans	-105.3	124.1	175.1	-58	-178.7	0	0	0	107.2	L148 N152 W188 V189 D190 E234	L148-I150 PolarHBondContact O-N 2.79Å; I150-N152 WeakPolarHBondContact CG2-ND2 3.38Å; I150-W188 HydrophobicContact CB-CD2 4.4Å; I150-W188 HydrophobicContact CB-CE3 4.13Å; I150-W188 HydrophobicContact CD1-CB 4.28Å; I150-W188 HydrophobicContact CG1-CB 4.37Å; I150-W188 HydrophobicContact CG1-CE3 4.19Å; I150-W188 HydrophobicContact CG2-CB 4.2Å; I150-W188 HydrophobicContact CG2-CD2 3.63Å; I150-W188 HydrophobicContact CG2-CE3 3.85Å; I150-W188 HydrophobicContact CG2-CG 3.78Å; I150-W188 HydrophobicContact CG2-CZ3 4.44Å; I150-V189 HydrophobicContact CD1-CG2 3.91Å; I150-V189 HydrophobicContact CG1-CG2 3.79Å; I150-D190 HydrophobicContact CD1-CB 3.69Å; I150-D190 VanDerWaalsContact CD1-CG 3.42Å; I150-E234 PolarHBondContact N-OE2 3.05Å; I150-E234 VanDerWaalsContact N-OE2 3.11Å
151	I	97.3	Very high	97.1	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.257	C	S	.	.			trans	-105.6	97.2	-174.5	-57	176.9	0	0	0	109.2	V149 E156 Q157 I160 I171 W188 F198 W220	V149-I151 HydrophobicContact CG2-CG1 4.08Å; I151-E156 WeakPolarHBondContact CA-OE2 3.29Å; I151-E156 HydrophobicContact CG2-CB 4.45Å; I151-E156 HydrophobicContact CG2-CG 4.18Å; I151-Q157 VanDerWaalsContact CD1-OE1 3.31Å; I151-Q157 HydrophobicContact CG2-CB 3.9Å; I151-I160 HydrophobicContact CD1-CB 4.18Å; I151-I160 HydrophobicContact CD1-CG1 4.09Å; I151-I160 HydrophobicContact CD1-CG2 3.93Å; I151-I160 HydrophobicContact CG1-CG1 4.34Å; I151-I171 HydrophobicContact CD1-CD1 4.26Å; I151-I171 HydrophobicContact CD1-CG2 4.19Å; I151-W188 HydrophobicContact CB-CH2 3.89Å; I151-W188 HydrophobicContact CB-CZ2 4.45Å; I151-W188 HydrophobicContact CG1-CH2 4.38Å; I151-W188 VanDerWaalsContact N-CH2 3.26Å; I151-W188 WeakPolarHBondContact O-CZ2 3.47Å; I151-F198 HydrophobicContact CG2-CD2 4.43Å; I151-F198 HydrophobicContact CG2-CE2 4.26Å; I151-W220 HydrophobicContact CB-CZ2 3.81Å; I151-W220 HydrophobicContact CD1-CZ2 4.23Å; I151-W220 HydrophobicContact CG2-CZ2 3.98Å
152	N	93	Very high	96.9	Very high	88 Å²	88	52.9 Å²	52.9	47%	0.471	28%	0.279	S	S	.	.			trans	-104.5	0.3	-172.7	-76.5	-37.2	0	0	0	113.6	I150 E156	I150-N152 WeakPolarHBondContact CG2-ND2 3.38Å; N152-E156 PolarHBondContact N-OE2 3.41Å
153	S	95.3	Very high	96.7	Very high	43 Å²	43	50.7 Å²	50.7	30%	0.301	27%	0.268	S	S	.	.	S	Bend	trans	-147.4	156.6	177.3	75.6	0	0	0	0	113.9	A155 E156 Q157	S153-A155 VanDerWaalsContact C-N 3.28Å; S153-A155 PolarHBondContact O-N 3.38Å; S153-E156 PolarHBondContact O-N 3.31Å; S153-E156 VanDerWaalsContact OG-CB 3.23Å; S153-E156 WeakPolarHBondContact OG-CB 3.47Å; S153-E156 PolarHBondContact OG-N 3.19Å; S153-E156 VanDerWaalsContact OG-N 3.11Å; S153-Q157 PolarHBondContact O-N 3.29Å
154	K	96.4	Very high	96.5	Very high	131 Å²	131	43.8 Å²	43.8	57%	0.57	24%	0.236	S	C	*	.	H	α-helix	trans	-60.5	-36.7	171.5	-177	178.9	177.2	-175.8	0	112.6	E156 Q157 E158 F198	K154-E156 VanDerWaalsContact C-N 3.31Å; K154-E156 PolarHBondContact O-N 2.88Å; K154-Q157 PolarHBondContact O-N 2.88Å; K154-E158 WeakPolarHBondContact O-CG 3.5Å; K154-E158 PolarHBondContact O-N 2.79Å; K154-F198 HydrophobicContact CB-CE1 4.18Å; K154-F198 HydrophobicContact CB-CZ 4.17Å; K154-F198 HydrophobicContact CG-CE1 4.3Å
155	A	96.9	Very high	95.8	Very high	63 Å²	63	44.2 Å²	44.2	52%	0.521	24%	0.238	S	C	.	.	H	α-helix	trans	-64.7	-40.5	-179.9	0	0	0	0	0	111.1	F120 S153 F159	F120-A155 HydrophobicContact CZ-CB 4.09Å; F120-A155 WeakPolarHBondContact CZ-O 3.41Å; S153-A155 VanDerWaalsContact C-N 3.28Å; S153-A155 PolarHBondContact O-N 3.38Å; A155-F159 PolarHBondContact O-N 2.83Å
156	E	97.2	Very high	94.7	Very high	15 Å²	15	49.7 Å²	49.7	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-41.9	173.3	-178.5	165.3	-122.2	0	0	112.7	F120 Y125 I151 N152 S153 K154 E158 F159 I160	F120-E156 HydrophobicContact CE1-CB 4.05Å; Y125-E156 PolarHBondContact OH-OE1 2.66Å; I151-E156 WeakPolarHBondContact CA-OE2 3.29Å; I151-E156 HydrophobicContact CG2-CB 4.45Å; I151-E156 HydrophobicContact CG2-CG 4.18Å; N152-E156 PolarHBondContact N-OE2 3.41Å; S153-E156 PolarHBondContact O-N 3.31Å; S153-E156 VanDerWaalsContact OG-CB 3.23Å; S153-E156 WeakPolarHBondContact OG-CB 3.47Å; S153-E156 PolarHBondContact OG-N 3.19Å; S153-E156 VanDerWaalsContact OG-N 3.11Å; K154-E156 VanDerWaalsContact C-N 3.31Å; K154-E156 PolarHBondContact O-N 2.88Å; E156-E158 VanDerWaalsContact C-N 3.34Å; E156-E158 PolarHBondContact O-N 2.82Å; E156-F159 WeakPolarHBondContact O-CB 3.44Å; E156-F159 PolarHBondContact O-N 3.05Å; E156-I160 HydrophobicContact CG-CG1 4.35Å; E156-I160 WeakPolarHBondContact O-CB 3.24Å; E156-I160 WeakPolarHBondContact O-CG1 3.2Å; E156-I160 PolarHBondContact O-N 3.08Å
157	Q	96.5	Very high	93.8	Very high	5 Å²	5	49.6 Å²	49.6	2%	0.023	25%	0.254	C	S	.	.	H	α-helix	trans	-58.6	-43.6	174.3	179.4	60.5	26.3	0	0	112.3	I151 S153 K154 I160 K161 F198 G218	I151-Q157 VanDerWaalsContact CD1-OE1 3.31Å; I151-Q157 HydrophobicContact CG2-CB 3.9Å; S153-Q157 PolarHBondContact O-N 3.29Å; K154-Q157 PolarHBondContact O-N 2.88Å; Q157-I160 PolarHBondContact O-N 3.06Å; Q157-K161 WeakPolarHBondContact O-CB 3.16Å; Q157-K161 PolarHBondContact O-N 2.79Å; Q157-F198 HydrophobicContact CB-CD1 3.99Å; Q157-F198 HydrophobicContact CB-CD2 4.19Å; Q157-F198 HydrophobicContact CB-CE1 3.93Å; Q157-F198 HydrophobicContact CB-CE2 4.13Å; Q157-F198 HydrophobicContact CB-CG 4.1Å; Q157-F198 HydrophobicContact CB-CZ 3.99Å; Q157-F198 HydrophobicContact CG-CB 3.95Å; Q157-F198 HydrophobicContact CG-CD1 3.64Å; Q157-F198 HydrophobicContact CG-CD2 4.18Å; Q157-F198 HydrophobicContact CG-CE1 4.1Å; Q157-F198 HydrophobicContact CG-CG 3.66Å; Q157-G218 PolarHBondContact NE2-O 2.75Å
158	E	96.4	Very high	93.6	Very high	82 Å²	82	49.9 Å²	49.9	38%	0.383	26%	0.255	S	S	.	.	H	α-helix	trans	-68.2	-36.9	176.8	-61.6	-67.7	170.9	0	0	111.4	K154 E156 K161 E162	K154-E158 WeakPolarHBondContact O-CG 3.5Å; K154-E158 PolarHBondContact O-N 2.79Å; E156-E158 VanDerWaalsContact C-N 3.34Å; E156-E158 PolarHBondContact O-N 2.82Å; E158-K161 PolarHBondContact O-N 2.9Å; E158-K161 IonicContact OE2-NZ 2.66Å; E158-K161 PolarHBondContact OE2-NZ 3.11Å; E158-E162 WeakPolarHBondContact O-CG 3.17Å; E158-E162 PolarHBondContact O-N 3.45Å; E158-E162 VanDerWaalsContact O-N 3.11Å
159	F	96.8	Very high	93.5	Very high	34 Å²	34	49.9 Å²	49.9	15%	0.149	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-48.7	170.8	165.4	-104	0	0	0	111.8	T118 F120 Y125 A155 E156 K161 E162 F163	T118-F159 HydrophobicContact CG2-CE2 4.14Å; T118-F159 HydrophobicContact CG2-CZ 4.1Å; F120-F159 HydrophobicContact CB-CD1 3.72Å; F120-F159 HydrophobicContact CB-CD2 3.81Å; F120-F159 HydrophobicContact CB-CE1 3.7Å; F120-F159 HydrophobicContact CB-CE2 3.78Å; F120-F159 HydrophobicContact CB-CG 3.79Å; F120-F159 HydrophobicContact CB-CZ 3.73Å; F120-F159 HydrophobicContact CD1-CB 4.1Å; F120-F159 AromaticContact CD1-CD1 3.88Å; F120-F159 HydrophobicContact CD1-CD1 3.88Å; F120-F159 AromaticContact CD1-CG 3.96Å; F120-F159 HydrophobicContact CD1-CG 3.96Å; F120-F159 HydrophobicContact CD2-CB 3.71Å; F120-F159 HydrophobicContact CD2-CD1 4.29Å; F120-F159 AromaticContact CD2-CD2 3.7Å; F120-F159 HydrophobicContact CD2-CD2 3.7Å; F120-F159 HydrophobicContact CD2-CE2 4.45Å; F120-F159 AromaticContact CD2-CG 3.61Å; F120-F159 HydrophobicContact CD2-CG 3.61Å; F120-F159 HydrophobicContact CE1-CB 4.09Å; F120-F159 HydrophobicContact CE1-CG 4.46Å; F120-F159 HydrophobicContact CE2-CB 3.69Å; F120-F159 HydrophobicContact CE2-CD2 4.46Å; F120-F159 HydrophobicContact CE2-CG 4.14Å; F120-F159 HydrophobicContact CG-CB 3.92Å; F120-F159 AromaticContact CG-CD1 3.71Å; F120-F159 HydrophobicContact CG-CD1 3.71Å; F120-F159 AromaticContact CG-CD2 3.84Å; F120-F159 HydrophobicContact CG-CD2 3.84Å; F120-F159 HydrophobicContact CG-CE1 4.22Å; F120-F159 HydrophobicContact CG-CE2 4.33Å; F120-F159 AromaticContact CG-CG 3.5Å; F120-F159 HydrophobicContact CG-CG 3.5Å; F120-F159 HydrophobicContact CZ-CB 3.89Å; Y125-F159 AromaticContact CD1-CE1 4Å; Y125-F159 HydrophobicContact CD1-CE1 4Å; Y125-F159 HydrophobicContact CD2-CD1 4.48Å; Y125-F159 AromaticContact CD2-CE1 3.51Å; Y125-F159 HydrophobicContact CD2-CE1 3.51Å; Y125-F159 AromaticContact CD2-CZ 3.94Å; Y125-F159 HydrophobicContact CD2-CZ 3.94Å; Y125-F159 HydrophobicContact CE1-CE1 4.24Å; Y125-F159 HydrophobicContact CE2-CD1 4.39Å; Y125-F159 AromaticContact CE2-CE1 3.83Å; Y125-F159 HydrophobicContact CE2-CE1 3.83Å; Y125-F159 AromaticContact CG-CE1 3.61Å; Y125-F159 HydrophobicContact CG-CE1 3.61Å; Y125-F159 HydrophobicContact CG-CZ 4.19Å; A155-F159 PolarHBondContact O-N 2.83Å; E156-F159 WeakPolarHBondContact O-CB 3.44Å; E156-F159 PolarHBondContact O-N 3.05Å; F159-K161 VanDerWaalsContact C-N 3.32Å; F159-K161 PolarHBondContact O-N 3.15Å; F159-E162 PolarHBondContact O-N 2.91Å; F159-E162 VanDerWaalsContact O-N 3.14Å; F159-F163 HydrophobicContact CE1-CB 4.36Å; F159-F163 HydrophobicContact CE1-CG 4.42Å; F159-F163 HydrophobicContact CE2-CB 4.21Å; F159-F163 HydrophobicContact CE2-CG 4.49Å; F159-F163 HydrophobicContact CZ-CB 4.05Å; F159-F163 HydrophobicContact CZ-CD1 4.45Å; F159-F163 HydrophobicContact CZ-CD2 4.17Å; F159-F163 AromaticContact CZ-CG 3.99Å; F159-F163 HydrophobicContact CZ-CG 3.99Å; F159-F163 VanDerWaalsContact O-CB 3.26Å; F159-F163 WeakPolarHBondContact O-CB 3.33Å; F159-F163 PolarHBondContact O-N 3.14Å
160	I	96.8	Very high	93.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-37.6	-179.5	-68.6	-64.3	0	0	0	111.5	Y125 V149 I151 E156 Q157 F163 N164 C214 I232	Y125-I160 HydrophobicContact CD1-CD1 3.89Å; Y125-I160 HydrophobicContact CE1-CD1 4.11Å; V149-I160 HydrophobicContact CG1-CD1 4.48Å; V149-I160 HydrophobicContact CG2-CD1 3.9Å; V149-I160 HydrophobicContact CG2-CG1 4.33Å; I151-I160 HydrophobicContact CD1-CB 4.18Å; I151-I160 HydrophobicContact CD1-CG1 4.09Å; I151-I160 HydrophobicContact CD1-CG2 3.93Å; I151-I160 HydrophobicContact CG1-CG1 4.34Å; E156-I160 HydrophobicContact CG-CG1 4.35Å; E156-I160 WeakPolarHBondContact O-CB 3.24Å; E156-I160 WeakPolarHBondContact O-CG1 3.2Å; E156-I160 PolarHBondContact O-N 3.08Å; Q157-I160 PolarHBondContact O-N 3.06Å; I160-F163 HydrophobicContact CD1-CD1 4.49Å; I160-F163 PolarHBondContact O-N 2.79Å; I160-N164 WeakPolarHBondContact O-CA 3.39Å; I160-N164 WeakPolarHBondContact O-CB 3.45Å; I160-N164 PolarHBondContact O-N 2.83Å; I160-C214 HydrophobicContact CG2-CB 4.49Å; I160-I232 HydrophobicContact CD1-CD1 4.38Å; I160-I232 HydrophobicContact CD1-CG2 4.06Å; I160-I232 HydrophobicContact CG2-CD1 3.93Å
161	K	95.3	Very high	93.5	Very high	76 Å²	76	48.8 Å²	48.8	33%	0.33	25%	0.249	S	C	.	.	H	α-helix	trans	-58.6	-46.8	171.3	169	177.9	165.8	-155.4	0	112.2	Q157 E158 F159	Q157-K161 WeakPolarHBondContact O-CB 3.16Å; Q157-K161 PolarHBondContact O-N 2.79Å; E158-K161 PolarHBondContact O-N 2.9Å; E158-K161 IonicContact OE2-NZ 2.66Å; E158-K161 PolarHBondContact OE2-NZ 3.11Å; F159-K161 VanDerWaalsContact C-N 3.32Å; F159-K161 PolarHBondContact O-N 3.15Å
162	E	94.8	Very high	93.6	Very high	99 Å²	99	48.7 Å²	48.7	46%	0.463	25%	0.249	S	C	.	.	H	α-helix	trans	-71.4	-34.6	179.2	-66.5	-66.7	112.1	0	0	112.5	E158 F159 K165	E158-E162 WeakPolarHBondContact O-CG 3.17Å; E158-E162 PolarHBondContact O-N 3.45Å; E158-E162 VanDerWaalsContact O-N 3.11Å; F159-E162 PolarHBondContact O-N 2.91Å; F159-E162 VanDerWaalsContact O-N 3.14Å; E162-K165 VanDerWaalsContact O-CD 3.32Å; E162-K165 WeakPolarHBondContact O-CD 3.35Å; E162-K165 VanDerWaalsContact O-CG 3.27Å; E162-K165 WeakPolarHBondContact O-CG 3.48Å; E162-K165 WeakPolarHBondContact OE2-CE 3.47Å; E162-K165 IonicContact OE2-NZ 3.39Å; E162-K165 PolarHBondContact OE2-NZ 2.91Å
163	F	94.6	Very high	93.8	Very high	46 Å²	46	44.5 Å²	44.5	20%	0.202	23%	0.226	C	C	.	.	H	α-helix	trans	-72.6	-31.8	176	-174.1	-118.7	0	0	0	112.5	T118 K127 F159 I160 K165 I232	T118-F163 HydrophobicContact CG2-CD2 4.35Å; T118-F163 HydrophobicContact CG2-CE2 4.17Å; T118-F163 WeakPolarHBondContact OG1-CE2 3.48Å; K127-F163 HydrophobicContact CB-CE1 3.74Å; K127-F163 HydrophobicContact CB-CZ 3.91Å; F159-F163 HydrophobicContact CE1-CB 4.36Å; F159-F163 HydrophobicContact CE1-CG 4.42Å; F159-F163 HydrophobicContact CE2-CB 4.21Å; F159-F163 HydrophobicContact CE2-CG 4.49Å; F159-F163 HydrophobicContact CZ-CB 4.05Å; F159-F163 HydrophobicContact CZ-CD1 4.45Å; F159-F163 HydrophobicContact CZ-CD2 4.17Å; F159-F163 AromaticContact CZ-CG 3.99Å; F159-F163 HydrophobicContact CZ-CG 3.99Å; F159-F163 VanDerWaalsContact O-CB 3.26Å; F159-F163 WeakPolarHBondContact O-CB 3.33Å; F159-F163 PolarHBondContact O-N 3.14Å; I160-F163 HydrophobicContact CD1-CD1 4.49Å; I160-F163 PolarHBondContact O-N 2.79Å; F163-K165 VanDerWaalsContact C-N 3.34Å; F163-K165 PolarHBondContact O-N 3.32Å; F163-I232 HydrophobicContact CD1-CD1 4.14Å; F163-I232 HydrophobicContact CD1-CG1 4.34Å; F163-I232 HydrophobicContact CD1-CG2 4.21Å; F163-I232 HydrophobicContact CE1-CG1 4.3Å; F163-I232 HydrophobicContact CE1-CG2 3.93Å
164	N	92.8	Very high	93.7	Very high	2 Å²	2	43 Å²	43	1%	0.011	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	1.9	-179.2	-169.1	37	0	0	0	114.2	K127 I160 N166 G167 S169 C214 D215 I232	K127-N164 WeakPolarHBondContact CE-OD1 3.17Å; K127-N164 PolarHBondContact NZ-O 2.93Å; K127-N164 PolarHBondContact NZ-OD1 3.02Å; I160-N164 WeakPolarHBondContact O-CA 3.39Å; I160-N164 WeakPolarHBondContact O-CB 3.45Å; I160-N164 PolarHBondContact O-N 2.83Å; N164-N166 PolarHBondContact O-N 3.28Å; N164-G167 PolarHBondContact ND2-O 2.65Å; N164-G167 PolarHBondContact O-N 2.04Å; N164-G167 PolarHBondContact OD1-O 2.96Å; N164-S169 WeakPolarHBondContact OD1-CB 3.25Å; N164-S169 PolarHBondContact OD1-OG 3.29Å; N164-C214 PolarHBondContact ND2-O 3.35Å; N164-D215 PolarHBondContact ND2-O 2.83Å; N164-I232 HydrophobicContact CB-CD1 4.07Å
165	K	83.4	Confident	93.5	Very high	118 Å²	118	38.3 Å²	38.3	51%	0.513	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-37.6	132.7	-177.7	-83.9	171.8	-176.8	166.7	0	113.9	E162 F163 G167	E162-K165 VanDerWaalsContact O-CD 3.32Å; E162-K165 WeakPolarHBondContact O-CD 3.35Å; E162-K165 VanDerWaalsContact O-CG 3.27Å; E162-K165 WeakPolarHBondContact O-CG 3.48Å; E162-K165 WeakPolarHBondContact OE2-CE 3.47Å; E162-K165 IonicContact OE2-NZ 3.39Å; E162-K165 PolarHBondContact OE2-NZ 2.91Å; F163-K165 VanDerWaalsContact C-N 3.34Å; F163-K165 PolarHBondContact O-N 3.32Å; K165-G167 PolarHBondContact O-N 3.15Å
166	N	73.3	Confident	92.9	Very high	169 Å²	169	38.4 Å²	38.4	90%	0.904	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	17.1	179.9	-51.1	-31.8	0	0	0	115.7	N164	N164-N166 PolarHBondContact O-N 3.28Å
167	G	80.7	Confident	92.3	Very high	12 Å²	12	40.8 Å²	40.8	12%	0.124	19%	0.193	C	C	.	.			trans	-133.9	167.3	173.8	0	0	0	0	0	113	N164 K165	N164-G167 PolarHBondContact ND2-O 2.65Å; N164-G167 PolarHBondContact O-N 2.04Å; N164-G167 PolarHBondContact OD1-O 2.96Å; K165-G167 PolarHBondContact O-N 3.15Å
168	E	93.4	Very high	91.5	Very high	40 Å²	40	42.8 Å²	42.8	19%	0.187	20%	0.203	C	C	.	.			trans	-118.6	118.3	171.4	-177.2	174.1	95.8	0	0	106.7	C213 C214 K221 N229 N230	E168-C213 HydrophobicContact CG-CB 4.3Å; E168-C214 WeakPolarHBondContact CA-O 3.29Å; E168-K221 VanDerWaalsContact OE1-CE 3.29Å; E168-K221 WeakPolarHBondContact OE1-CE 3.38Å; E168-K221 IonicContact OE1-NZ 2.72Å; E168-K221 PolarHBondContact OE1-NZ 2.94Å; E168-K221 WeakPolarHBondContact OE2-CE 3.3Å; E168-K221 IonicContact OE2-NZ 3.98Å; E168-K221 PolarHBondContact OE2-NZ 3.43Å; E168-N229 PolarHBondContact OE1-OD1 2.98Å; E168-N229 VanDerWaalsContact OE1-OD1 3.08Å; E168-N230 WeakPolarHBondContact O-CB 3.29Å; E168-N230 PolarHBondContact O-N 3.02Å
169	S	97.3	Very high	90.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.7	-168.5	-60.6	0	0	0	0	112.5	K127 N164 C213 C214 N230	K127-S169 WeakPolarHBondContact CE-OG 3.03Å; N164-S169 WeakPolarHBondContact OD1-CB 3.25Å; N164-S169 PolarHBondContact OD1-OG 3.29Å; S169-C213 VanDerWaalsContact C-CB 3.47Å; S169-C213 CarbonylContact O-C 3.52Å; S169-C213 WeakPolarHBondContact O-CA 3.38Å; S169-C213 WeakPolarHBondContact O-CB 3.44Å; S169-C214 PolarHBondContact N-O 3.25Å; S169-C214 PolarHBondContact O-N 2.97Å; S169-N230 CarbonylContact C-O 3.51Å; S169-N230 VanDerWaalsContact CA-O 3.25Å; S169-N230 WeakPolarHBondContact CA-O 3.06Å; S169-N230 WeakPolarHBondContact OG-CB 3.47Å
170	W	98.3	Very high	88.9	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	136.6	167.9	-66.8	127	0	0	0	111.8	K132 W134 L148 A211 C213 D223 Y224 Y227 N229 N230 W231 I232	K132-W170 PolarHBondContact O-NE1 2.87Å; W134-W170 HydrophobicContact CB-CD2 4.05Å; W134-W170 HydrophobicContact CB-CE3 4.39Å; W134-W170 HydrophobicContact CB-CG 4.4Å; W134-W170 HydrophobicContact CB-CZ2 4.33Å; W134-W170 AromaticContact CD1-CD2 3.76Å; W134-W170 AromaticContact CD1-CE3 3.66Å; W134-W170 AromaticContact CD1-CG 3.91Å; W134-W170 HydrophobicContact CG-CD2 4.34Å; W134-W170 HydrophobicContact CG-CE3 4.43Å; L148-W170 HydrophobicContact CD2-CB 4.38Å; W170-A211 HydrophobicContact CE3-CB 3.9Å; W170-A211 HydrophobicContact CH2-CB 3.91Å; W170-A211 HydrophobicContact CZ3-CB 3.41Å; W170-A211 VanDerWaalsContact CZ3-CB 3.41Å; W170-C213 HydrophobicContact CD2-CB 4.34Å; W170-C213 HydrophobicContact CE3-CB 3.69Å; W170-C213 HydrophobicContact CZ3-CB 4.11Å; W170-D223 HydrophobicContact CH2-CB 3.56Å; W170-D223 HydrophobicContact CZ3-CB 3.78Å; W170-Y224 WeakPolarHBondContact CH2-O 3.41Å; W170-Y224 WeakPolarHBondContact CZ2-O 3.04Å; W170-Y227 WeakPolarHBondContact CZ2-O 3.46Å; W170-N229 HydrophobicContact CD2-CB 4.15Å; W170-N229 HydrophobicContact CG-CB 4.24Å; W170-N229 HydrophobicContact CZ2-CB 4.3Å; W170-N229 VanDerWaalsContact CZ2-ND2 3.34Å; W170-N229 WeakPolarHBondContact CZ2-ND2 3.46Å; W170-N230 PolarHBondContact N-O 3.05Å; W170-W231 HydrophobicContact CB-CB 3.97Å; W170-I232 PolarHBondContact O-N 3.01Å; W170-I232 VanDerWaalsContact O-N 3.15Å
171	I	98.3	Very high	87.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	169.2	169.5	66	169.1	0	0	0	109.2	W134 V149 I151 L173 W188 V212 C214 W220	W134-I171 PolarHBondContact NE1-O 2.91Å; V149-I171 HydrophobicContact CG1-CB 3.94Å; V149-I171 HydrophobicContact CG1-CG2 3.72Å; I151-I171 HydrophobicContact CD1-CD1 4.26Å; I151-I171 HydrophobicContact CD1-CG2 4.19Å; I171-L173 HydrophobicContact CD1-CB 4.18Å; I171-L173 HydrophobicContact CG1-CB 4.22Å; I171-L173 PolarHBondContact O-N 2.83Å; I171-W188 HydrophobicContact CD1-CH2 4.09Å; I171-W188 HydrophobicContact CD1-CZ3 4.12Å; I171-W188 HydrophobicContact CG1-CZ3 4.49Å; I171-V212 HydrophobicContact CD1-CB 4.3Å; I171-V212 HydrophobicContact CD1-CG1 3.76Å; I171-V212 HydrophobicContact CG1-CB 4.01Å; I171-V212 HydrophobicContact CG1-CG1 3.92Å; I171-V212 WeakPolarHBondContact CG1-O 3.23Å; I171-V212 PolarHBondContact N-O 3.04Å; I171-C214 HydrophobicContact CG2-CB 4.12Å; I171-W220 HydrophobicContact CD1-CD2 3.91Å; I171-W220 HydrophobicContact CD1-CG 4.08Å; I171-W220 HydrophobicContact CD1-CZ2 4.28Å
172	G	98.1	Very high	86.8	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	12.1	-174.1	0	0	0	0	0	116	L148 V149 W188 V189	L148-G172 VanDerWaalsContact CB-CA 3.47Å; V149-G172 WeakPolarHBondContact O-CA 3.36Å; V149-G172 PolarHBondContact O-N 3.03Å; G172-W188 VanDerWaalsContact C-CE3 3.48Å; G172-W188 CarbonylContact O-C 3.48Å; G172-W188 VanDerWaalsContact O-CA 3.29Å; G172-W188 WeakPolarHBondContact O-CA 3.32Å; G172-V189 WeakPolarHBondContact O-CG1 3.33Å; G172-V189 PolarHBondContact O-N 3.15Å
173	L	96.9	Very high	86.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.4	-176.9	-174.8	62.9	0	0	0	111.1	I171 W186 W188 L194 W199 V212 W220	I171-L173 HydrophobicContact CD1-CB 4.18Å; I171-L173 HydrophobicContact CG1-CB 4.22Å; I171-L173 PolarHBondContact O-N 2.83Å; L173-W186 HydrophobicContact CD1-CB 4.16Å; L173-W186 HydrophobicContact CD1-CE3 4.18Å; L173-W186 HydrophobicContact CD2-CE3 4.22Å; L173-W186 HydrophobicContact CG-CE3 3.84Å; L173-W186 HydrophobicContact CG-CZ3 4.43Å; L173-W188 HydrophobicContact CB-CD2 4.24Å; L173-W188 HydrophobicContact CB-CE3 3.71Å; L173-W188 HydrophobicContact CB-CH2 3.97Å; L173-W188 HydrophobicContact CB-CZ3 3.57Å; L173-W188 HydrophobicContact CD1-CD2 3.95Å; L173-W188 HydrophobicContact CD1-CE3 4.29Å; L173-W188 HydrophobicContact CD1-CG 4.33Å; L173-W188 HydrophobicContact CD1-CZ2 4.42Å; L173-W188 HydrophobicContact CD2-CH2 4.38Å; L173-W188 HydrophobicContact CD2-CZ2 4.45Å; L173-L194 HydrophobicContact CD1-CB 4.24Å; L173-L194 HydrophobicContact CD1-CD1 4.46Å; L173-L194 HydrophobicContact CD1-CD2 4.5Å; L173-L194 HydrophobicContact CD2-CD1 4.19Å; L173-L194 HydrophobicContact CD2-CD2 4.02Å; L173-W199 HydrophobicContact CD2-CH2 3.82Å; L173-W199 HydrophobicContact CD2-CZ2 4.17Å; L173-V212 HydrophobicContact CB-CB 3.95Å; L173-V212 HydrophobicContact CB-CG2 3.95Å; L173-V212 HydrophobicContact CD2-CB 4.38Å; L173-V212 HydrophobicContact CD2-CG1 4.38Å; L173-V212 HydrophobicContact CD2-CG2 3.92Å; L173-V212 HydrophobicContact CG-CB 4.32Å; L173-V212 HydrophobicContact CG-CG2 3.8Å; L173-V212 WeakPolarHBondContact O-CB 3.25Å; L173-V212 WeakPolarHBondContact O-CG2 3.4Å; L173-V212 PolarHBondContact O-N 3.41Å; L173-W220 HydrophobicContact CD2-CE3 3.69Å; L173-W220 HydrophobicContact CD2-CH2 4.35Å; L173-W220 HydrophobicContact CD2-CZ3 3.48Å; L173-W220 VanDerWaalsContact CD2-CZ3 3.48Å
174	Q	94.3	Very high	85.7	Confident	12 Å²	12	62.7 Å²	62.7	6%	0.056	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	152.9	-179.8	53.1	170.2	-14.1	0	0	112.5	W134 K176 W186 E187 Y225	W134-Q174 HydrophobicContact CH2-CB 4.31Å; W134-Q174 HydrophobicContact CH2-CG 4.11Å; W134-Q174 HydrophobicContact CZ2-CB 4.11Å; W134-Q174 HydrophobicContact CZ2-CG 4.2Å; Q174-K176 HydrophobicContact CG-CD 4.35Å; Q174-K176 HydrophobicContact CG-CG 4.29Å; Q174-W186 WeakPolarHBondContact O-CA 3.25Å; Q174-E187 VanDerWaalsContact CG-O 3.24Å; Q174-E187 WeakPolarHBondContact CG-O 3.39Å; Q174-E187 PolarHBondContact N-O 3.14Å; Q174-E187 PolarHBondContact O-N 3.34Å; Q174-Y225 HydrophobicContact CB-CE1 4.41Å; Q174-Y225 WeakPolarHBondContact CB-OH 3.22Å; Q174-Y225 PolarHBondContact OE1-OH 2.91Å; Q174-Y225 VanDerWaalsContact OE1-OH 3.11Å
175	Y	91.4	Very high	85.6	Confident	32 Å²	32	66.7 Å²	66.7	13%	0.125	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	105.3	172	-170	-114.9	0	0	0	110	Y184 D185 W186 Q208 S209 Y210	Y175-Y184 HydrophobicContact CD1-CD1 4.42Å; Y175-Y184 VanDerWaalsContact CE1-CB 3.48Å; Y175-Y184 HydrophobicContact CE1-CD1 4.32Å; Y175-Y184 HydrophobicContact CE1-CG 4.19Å; Y175-Y184 WeakPolarHBondContact CE2-O 3.4Å; Y175-Y184 WeakPolarHBondContact OH-CB 3.29Å; Y175-Y184 PolarHBondContact OH-O 2.86Å; Y175-D185 WeakPolarHBondContact CA-O 3.49Å; Y175-D185 VanDerWaalsContact CD2-C 3.49Å; Y175-W186 AromaticContact CD2-CD2 3.95Å; Y175-W186 HydrophobicContact CD2-CD2 3.95Å; Y175-W186 AromaticContact CD2-CE2 3.74Å; Y175-W186 HydrophobicContact CD2-CE3 4.44Å; Y175-W186 HydrophobicContact CD2-CG 4.21Å; Y175-W186 HydrophobicContact CD2-CZ2 4.06Å; Y175-W186 AromaticContact CD2-NE1 3.86Å; Y175-W186 HydrophobicContact CG-CH2 4.3Å; Y175-W186 HydrophobicContact CG-CZ2 4.17Å; Y175-Q208 VanDerWaalsContact CD1-O 3.3Å; Y175-Q208 WeakPolarHBondContact CD1-O 3.36Å; Y175-S209 WeakPolarHBondContact O-CA 3.03Å; Y175-S209 PolarHBondContact O-OG 3.42Å; Y175-Y210 PolarHBondContact N-O 2.9Å
176	K	85.5	Confident	86	Confident	64 Å²	64	61.9 Å²	61.9	28%	0.278	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	162.4	-175.3	55.7	166.1	-90.4	-121.4	0	111.6	Q174 I178 Y184 D185 E187	Q174-K176 HydrophobicContact CG-CD 4.35Å; Q174-K176 HydrophobicContact CG-CG 4.29Å; K176-I178 PolarHBondContact O-N 2.85Å; K176-Y184 WeakPolarHBondContact O-CA 3.47Å; K176-D185 PolarHBondContact N-O 3.31Å; K176-D185 PolarHBondContact O-N 2.69Å; K176-D185 VanDerWaalsContact O-N 3.15Å; K176-E187 WeakPolarHBondContact CD-OE2 3.42Å; K176-E187 IonicContact NZ-OE1 2.98Å; K176-E187 PolarHBondContact NZ-OE1 2.99Å; K176-E187 IonicContact NZ-OE2 2.61Å; K176-E187 PolarHBondContact NZ-OE2 3.41Å
177	Q	83.9	Confident	86.9	Confident	65 Å²	65	55.4 Å²	55.4	30%	0.304	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	130.4	174.1	-173.6	-173	-24.2	0	0	110.6	T183 Y184	Q177-T183 CarbonylContact C-O 3.49Å; Q177-T183 WeakPolarHBondContact CA-O 3.47Å; Q177-Y184 HydrophobicContact CB-CD1 4.26Å; Q177-Y184 HydrophobicContact CB-CE1 3.98Å; Q177-Y184 HydrophobicContact CB-CE2 4.31Å
178	I	79.5	Confident	87.7	Confident	47 Å²	47	54.9 Å²	54.9	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.9	169.8	-54.2	-170.5	0	0	0	108.7	K176 V180 T183 D185	K176-I178 PolarHBondContact O-N 2.85Å; I178-V180 HydrophobicContact CG2-CG2 3.98Å; I178-V180 PolarHBondContact O-N 2.81Å; I178-V180 VanDerWaalsContact O-N 3.14Å; I178-T183 PolarHBondContact N-O 3.02Å; I178-D185 HydrophobicContact CD1-CB 3.63Å; I178-D185 HydrophobicContact CG1-CB 4.34Å
179	S	69.1	Low	87.9	Confident	112 Å²	112	53.5 Å²	53.5	78%	0.783	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.2	-166.7	55.5	0	0	0	0	115.2	Q181	S179-Q181 VanDerWaalsContact C-N 3.29Å; S179-Q181 PolarHBondContact O-N 2.72Å
180	V	69.4	Low	87.8	Confident	113 Å²	113	58.3 Å²	58.3	69%	0.685	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-12.4	-170	-137.3	0	0	0	0	114.2	I178	I178-V180 HydrophobicContact CG2-CG2 3.98Å; I178-V180 PolarHBondContact O-N 2.81Å; I178-V180 VanDerWaalsContact O-N 3.14Å
181	Q	73.4	Confident	87.5	Confident	142 Å²	142	60.4 Å²	60.4	66%	0.664	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-160.9	7.4	-169.7	-119.5	143.1	93.6	0	0	118	S179 T183	S179-Q181 VanDerWaalsContact C-N 3.29Å; S179-Q181 PolarHBondContact O-N 2.72Å; Q181-T183 HydrophobicContact CB-CG2 3.99Å; Q181-T183 PolarHBondContact O-N 2.83Å; Q181-T183 VanDerWaalsContact O-N 3.13Å
182	W	74.9	Confident	87.3	Confident	208 Å²	208	61.9 Å²	61.9	79%	0.788	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	15.8	-167.6	-58	88.2	0	0	0	114
183	T	80.8	Confident	87.1	Confident	70 Å²	70	66.1 Å²	66.1	43%	0.429	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	150.4	172.7	43.8	0	0	0	0	110.4	Q177 I178 Q181	Q177-T183 CarbonylContact C-O 3.49Å; Q177-T183 WeakPolarHBondContact CA-O 3.47Å; I178-T183 PolarHBondContact N-O 3.02Å; Q181-T183 HydrophobicContact CB-CG2 3.99Å; Q181-T183 PolarHBondContact O-N 2.83Å; Q181-T183 VanDerWaalsContact O-N 3.13Å
184	Y	86	Confident	86.9	Confident	110 Å²	110	68 Å²	68	43%	0.431	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.5	172.6	-69.8	-110.4	0	0	0	108.7	Y175 K176 Q177	Y175-Y184 HydrophobicContact CD1-CD1 4.42Å; Y175-Y184 VanDerWaalsContact CE1-CB 3.48Å; Y175-Y184 HydrophobicContact CE1-CD1 4.32Å; Y175-Y184 HydrophobicContact CE1-CG 4.19Å; Y175-Y184 WeakPolarHBondContact CE2-O 3.4Å; Y175-Y184 WeakPolarHBondContact OH-CB 3.29Å; Y175-Y184 PolarHBondContact OH-O 2.86Å; K176-Y184 WeakPolarHBondContact O-CA 3.47Å; Q177-Y184 HydrophobicContact CB-CD1 4.26Å; Q177-Y184 HydrophobicContact CB-CE1 3.98Å; Q177-Y184 HydrophobicContact CB-CE2 4.31Å
185	D	89.3	Confident	86.8	Confident	87 Å²	87	72.6 Å²	72.6	47%	0.465	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	172.3	176.5	-149.2	-11.9	0	0	0	111.4	Y175 K176 I178	Y175-D185 WeakPolarHBondContact CA-O 3.49Å; Y175-D185 VanDerWaalsContact CD2-C 3.49Å; K176-D185 PolarHBondContact N-O 3.31Å; K176-D185 PolarHBondContact O-N 2.69Å; K176-D185 VanDerWaalsContact O-N 3.15Å; I178-D185 HydrophobicContact CD1-CB 3.63Å; I178-D185 HydrophobicContact CG1-CB 4.34Å
186	W	91.9	Very high	86.8	Confident	17 Å²	17	75 Å²	75	6%	0.064	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	113.3	179.1	-68.5	103.9	0	0	0	111.5	L173 Q174 Y175 L194 W199 P204 V212 Q222	L173-W186 HydrophobicContact CD1-CB 4.16Å; L173-W186 HydrophobicContact CD1-CE3 4.18Å; L173-W186 HydrophobicContact CD2-CE3 4.22Å; L173-W186 HydrophobicContact CG-CE3 3.84Å; L173-W186 HydrophobicContact CG-CZ3 4.43Å; Q174-W186 WeakPolarHBondContact O-CA 3.25Å; Y175-W186 AromaticContact CD2-CD2 3.95Å; Y175-W186 HydrophobicContact CD2-CD2 3.95Å; Y175-W186 AromaticContact CD2-CE2 3.74Å; Y175-W186 HydrophobicContact CD2-CE3 4.44Å; Y175-W186 HydrophobicContact CD2-CG 4.21Å; Y175-W186 HydrophobicContact CD2-CZ2 4.06Å; Y175-W186 AromaticContact CD2-NE1 3.86Å; Y175-W186 HydrophobicContact CG-CH2 4.3Å; Y175-W186 HydrophobicContact CG-CZ2 4.17Å; W186-L194 HydrophobicContact CB-CB 3.61Å; W186-L194 HydrophobicContact CB-CD2 3.77Å; W186-L194 HydrophobicContact CB-CG 4.36Å; W186-L194 HydrophobicContact CG-CD2 3.92Å; W186-L194 PolarHBondContact O-N 2.67Å; W186-L194 VanDerWaalsContact O-N 3.15Å; W186-W199 AromaticContact CD2-CH2 3.96Å; W186-W199 HydrophobicContact CD2-CH2 3.96Å; W186-W199 AromaticContact CD2-CZ2 3.88Å; W186-W199 HydrophobicContact CD2-CZ2 3.88Å; W186-W199 AromaticContact CE2-CH2 3.87Å; W186-W199 AromaticContact CE2-CZ2 3.74Å; W186-W199 AromaticContact CE3-CH2 3.89Å; W186-W199 HydrophobicContact CE3-CH2 3.89Å; W186-W199 HydrophobicContact CE3-CZ2 4.27Å; W186-W199 HydrophobicContact CG-CZ2 4.39Å; W186-W199 AromaticContact CH2-CH2 3.7Å; W186-W199 HydrophobicContact CH2-CH2 3.7Å; W186-W199 HydrophobicContact CH2-CZ2 4.4Å; W186-W199 HydrophobicContact CH2-CZ3 4.46Å; W186-W199 AromaticContact CZ2-CH2 3.76Å; W186-W199 HydrophobicContact CZ2-CH2 3.76Å; W186-W199 HydrophobicContact CZ2-CZ2 4.02Å; W186-W199 AromaticContact CZ3-CH2 3.76Å; W186-W199 HydrophobicContact CZ3-CH2 3.76Å; W186-P204 HydrophobicContact CZ2-CB 3.67Å; W186-P204 HydrophobicContact CZ2-CG 4.34Å; W186-V212 HydrophobicContact CE3-CG2 4.07Å; W186-V212 HydrophobicContact CH2-CG2 3.99Å; W186-V212 HydrophobicContact CZ3-CG2 3.32Å; W186-Q222 HydrophobicContact CH2-CG 3.81Å; W186-Q222 HydrophobicContact CZ2-CG 4.31Å
187	E	93.1	Very high	87.2	Confident	32 Å²	32	75.1 Å²	75.1	15%	0.15	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.6	-178.3	-164.7	-163.4	-110.2	0	0	109.7	Q174 K176	Q174-E187 VanDerWaalsContact CG-O 3.24Å; Q174-E187 WeakPolarHBondContact CG-O 3.39Å; Q174-E187 PolarHBondContact N-O 3.14Å; Q174-E187 PolarHBondContact O-N 3.34Å; K176-E187 WeakPolarHBondContact CD-OE2 3.42Å; K176-E187 IonicContact NZ-OE1 2.98Å; K176-E187 PolarHBondContact NZ-OE1 2.99Å; K176-E187 IonicContact NZ-OE2 2.61Å; K176-E187 PolarHBondContact NZ-OE2 3.41Å
188	W	96.7	Very high	87.7	Confident	1 Å²	1	73.2 Å²	73.2	0%	0.004	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	165	170.7	-68.5	109.7	0	0	0	111.6	I150 I151 I171 G172 L173 D190 G191 S192 L194 W220	I150-W188 HydrophobicContact CB-CD2 4.4Å; I150-W188 HydrophobicContact CB-CE3 4.13Å; I150-W188 HydrophobicContact CD1-CB 4.28Å; I150-W188 HydrophobicContact CG1-CB 4.37Å; I150-W188 HydrophobicContact CG1-CE3 4.19Å; I150-W188 HydrophobicContact CG2-CB 4.2Å; I150-W188 HydrophobicContact CG2-CD2 3.63Å; I150-W188 HydrophobicContact CG2-CE3 3.85Å; I150-W188 HydrophobicContact CG2-CG 3.78Å; I150-W188 HydrophobicContact CG2-CZ3 4.44Å; I151-W188 HydrophobicContact CB-CH2 3.89Å; I151-W188 HydrophobicContact CB-CZ2 4.45Å; I151-W188 HydrophobicContact CG1-CH2 4.38Å; I151-W188 VanDerWaalsContact N-CH2 3.26Å; I151-W188 WeakPolarHBondContact O-CZ2 3.47Å; I171-W188 HydrophobicContact CD1-CH2 4.09Å; I171-W188 HydrophobicContact CD1-CZ3 4.12Å; I171-W188 HydrophobicContact CG1-CZ3 4.49Å; G172-W188 VanDerWaalsContact C-CE3 3.48Å; G172-W188 CarbonylContact O-C 3.48Å; G172-W188 VanDerWaalsContact O-CA 3.29Å; G172-W188 WeakPolarHBondContact O-CA 3.32Å; L173-W188 HydrophobicContact CB-CD2 4.24Å; L173-W188 HydrophobicContact CB-CE3 3.71Å; L173-W188 HydrophobicContact CB-CH2 3.97Å; L173-W188 HydrophobicContact CB-CZ3 3.57Å; L173-W188 HydrophobicContact CD1-CD2 3.95Å; L173-W188 HydrophobicContact CD1-CE3 4.29Å; L173-W188 HydrophobicContact CD1-CG 4.33Å; L173-W188 HydrophobicContact CD1-CZ2 4.42Å; L173-W188 HydrophobicContact CD2-CH2 4.38Å; L173-W188 HydrophobicContact CD2-CZ2 4.45Å; W188-D190 VanDerWaalsContact CB-OD1 3.29Å; W188-D190 WeakPolarHBondContact CB-OD1 3.39Å; W188-D190 PolarHBondContact O-N 3.35Å; W188-D190 VanDerWaalsContact O-N 3.15Å; W188-G191 PolarHBondContact O-N 3.43Å; W188-S192 PolarHBondContact N-O 3.34Å; W188-L194 HydrophobicContact CZ2-CD1 4.04Å; W188-W220 AromaticContact CH2-CH2 3.7Å; W188-W220 HydrophobicContact CH2-CH2 3.7Å; W188-W220 AromaticContact CH2-CZ2 3.92Å; W188-W220 HydrophobicContact CH2-CZ2 3.92Å; W188-W220 HydrophobicContact CH2-CZ3 4.37Å; W188-W220 AromaticContact CZ2-CH2 3.64Å; W188-W220 HydrophobicContact CZ2-CH2 3.64Å; W188-W220 HydrophobicContact CZ2-CZ2 4.27Å; W188-W220 HydrophobicContact CZ2-CZ3 4.31Å
189	V	96.9	Very high	88.4	Confident	11 Å²	11	73 Å²	73	7%	0.067	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-25	179.6	-78	0	0	0	0	114.4	W134 R138 D147 L148 I150 G172 G191	W134-V189 HydrophobicContact CH2-CG1 3.8Å; W134-V189 HydrophobicContact CZ2-CG1 3.68Å; R138-V189 HydrophobicContact CG-CG1 4.25Å; R138-V189 VanDerWaalsContact CZ-CB 3.5Å; R138-V189 VanDerWaalsContact CZ-CG1 3.48Å; R138-V189 VanDerWaalsContact NE-CG1 3.33Å; R138-V189 PolarHBondContact NH2-O 3.17Å; D147-V189 HydrophobicContact CB-CG2 3.97Å; D147-V189 WeakPolarHBondContact OD1-CB 3.44Å; L148-V189 HydrophobicContact CB-CG1 4.26Å; L148-V189 VanDerWaalsContact O-CG2 3.24Å; L148-V189 WeakPolarHBondContact O-CG2 3.29Å; I150-V189 HydrophobicContact CD1-CG2 3.91Å; I150-V189 HydrophobicContact CG1-CG2 3.79Å; G172-V189 WeakPolarHBondContact O-CG1 3.33Å; G172-V189 PolarHBondContact O-N 3.15Å; V189-G191 VanDerWaalsContact C-N 3.33Å
190	D	95.5	Very high	89.4	Confident	102 Å²	102	68.3 Å²	68.3	55%	0.545	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-4.6	174.4	71.8	-20	0	0	0	114.2	I150 W188 S192	I150-D190 HydrophobicContact CD1-CB 3.69Å; I150-D190 VanDerWaalsContact CD1-CG 3.42Å; W188-D190 VanDerWaalsContact CB-OD1 3.29Å; W188-D190 WeakPolarHBondContact CB-OD1 3.39Å; W188-D190 PolarHBondContact O-N 3.35Å; W188-D190 VanDerWaalsContact O-N 3.15Å; D190-S192 VanDerWaalsContact OD1-CB 3.25Å; D190-S192 WeakPolarHBondContact OD1-CB 3.5Å; D190-S192 PolarHBondContact OD1-N 2.89Å; D190-S192 PolarHBondContact OD1-OG 2.97Å; D190-S192 PolarHBondContact OD2-OG 3.14Å
191	G	93.6	Very high	90.2	Very high	44 Å²	44	70.4 Å²	70.4	45%	0.454	38%	0.377	S	S	.	.	S	Bend	trans	86.7	3.9	-174.8	0	0	0	0	0	114.6	W188 V189	W188-G191 PolarHBondContact O-N 3.43Å; V189-G191 VanDerWaalsContact C-N 3.33Å
192	S	94	Very high	90.6	Very high	30 Å²	30	67.2 Å²	67.2	21%	0.21	38%	0.383	C	S	.	.			trans	-75.3	145.3	174.8	67.5	0	0	0	0	111.6	W188 D190	W188-S192 PolarHBondContact N-O 3.34Å; D190-S192 VanDerWaalsContact OD1-CB 3.25Å; D190-S192 WeakPolarHBondContact OD1-CB 3.5Å; D190-S192 PolarHBondContact OD1-N 2.89Å; D190-S192 PolarHBondContact OD1-OG 2.97Å; D190-S192 PolarHBondContact OD2-OG 3.14Å
193	P	93.3	Very high	91.1	Very high	90 Å²	90	59.7 Å²	59.7	58%	0.584	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-76.3	152.2	178.4	31.9	-35.5	0	0	0	111.5	T195	P193-T195 PolarHBondContact O-N 2.74Å
194	L	93.3	Very high	91.2	Very high	38 Å²	38	58.3 Å²	58.3	20%	0.199	35%	0.35	C	S	.	.			trans	-66.7	115.2	173.3	177.9	59.4	0	0	0	111.9	L173 W186 W188 P197 W199 W220	L173-L194 HydrophobicContact CD1-CB 4.24Å; L173-L194 HydrophobicContact CD1-CD1 4.46Å; L173-L194 HydrophobicContact CD1-CD2 4.5Å; L173-L194 HydrophobicContact CD2-CD1 4.19Å; L173-L194 HydrophobicContact CD2-CD2 4.02Å; W186-L194 HydrophobicContact CB-CB 3.61Å; W186-L194 HydrophobicContact CB-CD2 3.77Å; W186-L194 HydrophobicContact CB-CG 4.36Å; W186-L194 HydrophobicContact CG-CD2 3.92Å; W186-L194 PolarHBondContact O-N 2.67Å; W186-L194 VanDerWaalsContact O-N 3.15Å; W188-L194 HydrophobicContact CZ2-CD1 4.04Å; L194-P197 HydrophobicContact CD2-CB 4.28Å; L194-W199 HydrophobicContact CD2-CZ2 3.81Å; L194-W220 HydrophobicContact CD1-CH2 3.99Å; L194-W220 HydrophobicContact CD1-CZ3 3.69Å; L194-W220 HydrophobicContact CD2-CZ3 4.47Å
195	T	91.4	Very high	90.7	Very high	109 Å²	109	55.8 Å²	55.8	67%	0.669	34%	0.344	S	S	*	.			trans	-102.5	-40.5	178.2	54.8	0	0	0	0	113.5	P193	P193-T195 PolarHBondContact O-N 2.74Å
196	Q	91.5	Very high	89.7	Confident	82 Å²	82	55.6 Å²	55.6	38%	0.383	34%	0.343	S	S	.	.	S	Bend	trans	-125.7	103	-179	-171.4	172.7	19	0	0	111.6	F198 W220	Q196-F198 HydrophobicContact CB-CE2 4.26Å; Q196-F198 HydrophobicContact CG-CD2 4.5Å; Q196-F198 HydrophobicContact CG-CE1 4.48Å; Q196-F198 HydrophobicContact CG-CE2 3.7Å; Q196-F198 HydrophobicContact CG-CZ 3.7Å; Q196-F198 WeakPolarHBondContact O-CD2 3.34Å; Q196-W220 WeakPolarHBondContact O-CH2 3.32Å
197	P	92.9	Very high	88.5	Confident	68 Å²	68	64.7 Å²	64.7	44%	0.442	38%	0.379	S	S	.	.			trans	-81.6	145.5	177.9	29.8	-33	0	0	0	113.7	L194 W199 W220	L194-P197 HydrophobicContact CD2-CB 4.28Å; P197-W199 HydrophobicContact CB-CG 4.2Å; P197-W199 VanDerWaalsContact CB-NE1 3.3Å; P197-W220 HydrophobicContact CB-CZ3 4.47Å
198	F	95.1	Very high	87.3	Confident	25 Å²	25	67.7 Å²	67.7	11%	0.11	39%	0.393	C	S	.	.			trans	-123.5	38.3	171.5	-58.8	-92.9	0	0	0	112.8	I151 K154 Q157 Q196 W220	I151-F198 HydrophobicContact CG2-CD2 4.43Å; I151-F198 HydrophobicContact CG2-CE2 4.26Å; K154-F198 HydrophobicContact CB-CE1 4.18Å; K154-F198 HydrophobicContact CB-CZ 4.17Å; K154-F198 HydrophobicContact CG-CE1 4.3Å; Q157-F198 HydrophobicContact CB-CD1 3.99Å; Q157-F198 HydrophobicContact CB-CD2 4.19Å; Q157-F198 HydrophobicContact CB-CE1 3.93Å; Q157-F198 HydrophobicContact CB-CE2 4.13Å; Q157-F198 HydrophobicContact CB-CG 4.1Å; Q157-F198 HydrophobicContact CB-CZ 3.99Å; Q157-F198 HydrophobicContact CG-CB 3.95Å; Q157-F198 HydrophobicContact CG-CD1 3.64Å; Q157-F198 HydrophobicContact CG-CD2 4.18Å; Q157-F198 HydrophobicContact CG-CE1 4.1Å; Q157-F198 HydrophobicContact CG-CG 3.66Å; Q196-F198 HydrophobicContact CB-CE2 4.26Å; Q196-F198 HydrophobicContact CG-CD2 4.5Å; Q196-F198 HydrophobicContact CG-CE1 4.48Å; Q196-F198 HydrophobicContact CG-CE2 3.7Å; Q196-F198 HydrophobicContact CG-CZ 3.7Å; Q196-F198 WeakPolarHBondContact O-CD2 3.34Å; F198-W220 HydrophobicContact CB-CD2 4.06Å; F198-W220 HydrophobicContact CB-CG 4.39Å; F198-W220 HydrophobicContact CB-CZ2 4.03Å; F198-W220 AromaticContact CD2-CH2 3.76Å; F198-W220 HydrophobicContact CD2-CH2 3.76Å; F198-W220 AromaticContact CD2-CZ2 3.43Å; F198-W220 HydrophobicContact CD2-CZ2 3.43Å; F198-W220 VanDerWaalsContact CD2-CZ2 3.43Å; F198-W220 HydrophobicContact CE2-CZ2 4.34Å; F198-W220 HydrophobicContact CG-CZ2 4.19Å; F198-W220 PolarHBondContact O-N 2.79Å
199	W	94.4	Very high	86.1	Confident	41 Å²	41	70 Å²	70	16%	0.155	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-51.2	148.7	179.7	-59.3	125.2	0	0	0	114.8	L173 W186 L194 P197 L203 P204 V212 W220 Q222	L173-W199 HydrophobicContact CD2-CH2 3.82Å; L173-W199 HydrophobicContact CD2-CZ2 4.17Å; W186-W199 AromaticContact CD2-CH2 3.96Å; W186-W199 HydrophobicContact CD2-CH2 3.96Å; W186-W199 AromaticContact CD2-CZ2 3.88Å; W186-W199 HydrophobicContact CD2-CZ2 3.88Å; W186-W199 AromaticContact CE2-CH2 3.87Å; W186-W199 AromaticContact CE2-CZ2 3.74Å; W186-W199 AromaticContact CE3-CH2 3.89Å; W186-W199 HydrophobicContact CE3-CH2 3.89Å; W186-W199 HydrophobicContact CE3-CZ2 4.27Å; W186-W199 HydrophobicContact CG-CZ2 4.39Å; W186-W199 AromaticContact CH2-CH2 3.7Å; W186-W199 HydrophobicContact CH2-CH2 3.7Å; W186-W199 HydrophobicContact CH2-CZ2 4.4Å; W186-W199 HydrophobicContact CH2-CZ3 4.46Å; W186-W199 AromaticContact CZ2-CH2 3.76Å; W186-W199 HydrophobicContact CZ2-CH2 3.76Å; W186-W199 HydrophobicContact CZ2-CZ2 4.02Å; W186-W199 AromaticContact CZ3-CH2 3.76Å; W186-W199 HydrophobicContact CZ3-CH2 3.76Å; L194-W199 HydrophobicContact CD2-CZ2 3.81Å; P197-W199 HydrophobicContact CB-CG 4.2Å; P197-W199 VanDerWaalsContact CB-NE1 3.3Å; W199-L203 HydrophobicContact CB-CB 4.28Å; W199-P204 HydrophobicContact CH2-CB 4.5Å; W199-P204 HydrophobicContact CZ2-CB 4.26Å; W199-P204 HydrophobicContact CZ2-CG 4.31Å; W199-V212 HydrophobicContact CH2-CG1 4.38Å; W199-V212 HydrophobicContact CH2-CG2 3.77Å; W199-V212 HydrophobicContact CZ3-CG1 3.81Å; W199-V212 HydrophobicContact CZ3-CG2 3.87Å; W199-W220 HydrophobicContact CD2-CB 4.48Å; W199-W220 HydrophobicContact CD2-CE3 4.32Å; W199-W220 HydrophobicContact CE3-CB 3.64Å; W199-W220 HydrophobicContact CE3-CE3 4.23Å; W199-W220 HydrophobicContact CH2-CE3 4.4Å; W199-W220 HydrophobicContact CZ2-CE3 4.5Å; W199-W220 HydrophobicContact CZ3-CB 3.99Å; W199-W220 HydrophobicContact CZ3-CE3 4.27Å; W199-Q222 HydrophobicContact CZ3-CG 4.29Å
200	G	90.4	Very high	85.6	Confident	15 Å²	15	70.3 Å²	70.3	16%	0.155	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-69.4	166.7	161.6	0	0	0	0	0	112.6	G202 L203 W220	G200-G202 PolarHBondContact O-N 3.33Å; G200-L203 PolarHBondContact O-N 3.19Å; G200-W220 PolarHBondContact N-O 3.15Å
201	T	86.3	Confident	85.5	Confident	156 Å²	156	65.5 Å²	65.5	96%	0.957	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	125.9	-178.3	-51.8	0	0	0	0	111.4
202	G	81.4	Confident	85.6	Confident	75 Å²	75	63.4 Å²	63.4	77%	0.773	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	11.5	177.4	0	0	0	0	0	115.5	G200	G200-G202 PolarHBondContact O-N 3.33Å
203	L	84.9	Confident	85.6	Confident	50 Å²	50	62 Å²	62	26%	0.262	35%	0.352	S	S	.	.			trans	-115.4	154.4	178.3	-64.5	-177.8	0	0	0	111.9	W199 G200 K221	W199-L203 HydrophobicContact CB-CB 4.28Å; G200-L203 PolarHBondContact O-N 3.19Å; L203-K221 HydrophobicContact CD1-CB 3.88Å
204	P	82.6	Confident	85.8	Confident	42 Å²	42	57.7 Å²	57.7	27%	0.273	32%	0.324	S	S	.	.			cis	-85.4	151.6	3.2	34.4	-33.9	0	0	0	114	W186 W199 N206	W186-P204 HydrophobicContact CZ2-CB 3.67Å; W186-P204 HydrophobicContact CZ2-CG 4.34Å; W199-P204 HydrophobicContact CH2-CB 4.5Å; W199-P204 HydrophobicContact CZ2-CB 4.26Å; W199-P204 HydrophobicContact CZ2-CG 4.31Å; P204-N206 WeakPolarHBondContact CB-OD1 3.49Å; P204-N206 WeakPolarHBondContact CG-OD1 3.22Å
205	N	76.6	Confident	85.7	Confident	56 Å²	56	57.1 Å²	57.1	30%	0.299	32%	0.321	S	S	.	.			trans	-92.1	113.4	162.4	72.9	69.5	0	0	0	109.3	Y207 Y210 Q222	N205-Y207 VanDerWaalsContact C-N 3.31Å; N205-Y207 HydrophobicContact CB-CD2 4.08Å; N205-Y207 HydrophobicContact CB-CE2 4.41Å; N205-Y207 PolarHBondContact O-N 2.81Å; N205-Y210 WeakPolarHBondContact OD1-CE2 3.24Å; N205-Y210 PolarHBondContact OD1-OH 3.44Å; N205-Q222 PolarHBondContact ND2-OE1 3.21Å; N205-Q222 PolarHBondContact O-NE2 3.27Å; N205-Q222 PolarHBondContact O-OE1 2.99Å
206	N	68.5	Low	85.6	Confident	84 Å²	84	61.1 Å²	61.1	45%	0.449	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	39.3	-167.2	-64.8	-20.1	0	0	0	113.1	P204	P204-N206 WeakPolarHBondContact CB-OD1 3.49Å; P204-N206 WeakPolarHBondContact CG-OD1 3.22Å
207	Y	65.7	Low	85.4	Confident	207 Å²	207	59 Å²	59	81%	0.812	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-18	-170.7	-64	-69.9	0	0	0	115	N205	N205-Y207 VanDerWaalsContact C-N 3.31Å; N205-Y207 HydrophobicContact CB-CD2 4.08Å; N205-Y207 HydrophobicContact CB-CE2 4.41Å; N205-Y207 PolarHBondContact O-N 2.81Å
208	Q	68.6	Low	85.3	Confident	96 Å²	96	56.1 Å²	56.1	45%	0.449	31%	0.308	S	S	.	.	S	Bend	trans	-147.4	164.1	-177.3	-61.6	-179.4	-19.4	0	0	110.7	Y175 Y210 Y224	Y175-Q208 VanDerWaalsContact CD1-O 3.3Å; Y175-Q208 WeakPolarHBondContact CD1-O 3.36Å; Q208-Y210 HydrophobicContact CB-CD2 4.29Å; Q208-Y210 HydrophobicContact CB-CE1 4.35Å; Q208-Y210 HydrophobicContact CB-CE2 3.75Å; Q208-Y210 WeakPolarHBondContact O-CD2 3.2Å; Q208-Y210 PolarHBondContact O-N 3.14Å; Q208-Y210 PolarHBondContact OE1-OH 3.32Å; Q208-Y224 PolarHBondContact OE1-OH 3.06Å
209	S	71.7	Confident	85.3	Confident	49 Å²	49	59.6 Å²	59.6	34%	0.343	32%	0.323	S	S	.	.			trans	-72.3	118.7	172.9	-163.8	0	0	0	0	109.5	Y175	Y175-S209 WeakPolarHBondContact O-CA 3.03Å; Y175-S209 PolarHBondContact O-OG 3.42Å
210	Y	85.8	Confident	85.3	Confident	18 Å²	18	57.7 Å²	57.7	7%	0.071	32%	0.316	C	S	.	.			trans	-129.3	148.6	-173.7	-70.9	-65.6	0	0	0	112.2	Y175 N205 Q208 Q222 Y224	Y175-Y210 PolarHBondContact N-O 2.9Å; N205-Y210 WeakPolarHBondContact OD1-CE2 3.24Å; N205-Y210 PolarHBondContact OD1-OH 3.44Å; Q208-Y210 HydrophobicContact CB-CD2 4.29Å; Q208-Y210 HydrophobicContact CB-CE1 4.35Å; Q208-Y210 HydrophobicContact CB-CE2 3.75Å; Q208-Y210 WeakPolarHBondContact O-CD2 3.2Å; Q208-Y210 PolarHBondContact O-N 3.14Å; Q208-Y210 PolarHBondContact OE1-OH 3.32Å; Y210-Q222 HydrophobicContact CD1-CB 4.47Å; Y210-Q222 HydrophobicContact CD2-CB 4.23Å; Y210-Q222 HydrophobicContact CG-CB 4.03Å; Y210-Y224 HydrophobicContact CD1-CD1 4.42Å; Y210-Y224 HydrophobicContact CD1-CG 4.5Å; Y210-Y224 AromaticContact CE1-CD1 3.99Å; Y210-Y224 HydrophobicContact CE1-CD1 3.99Å; Y210-Y224 HydrophobicContact CE1-CD2 4.22Å; Y210-Y224 AromaticContact CE1-CE1 3.78Å; Y210-Y224 HydrophobicContact CE1-CE1 3.78Å; Y210-Y224 AromaticContact CE1-CE2 4Å; Y210-Y224 HydrophobicContact CE1-CE2 4Å; Y210-Y224 HydrophobicContact CE1-CG 4.2Å; Y210-Y224 AromaticContact CE1-CZ 3.77Å
211	A	93.1	Very high	85.4	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	165.5	161	0	0	0	0	0	110.1	W134 W170 Q222 D223 Y225	W134-A211 HydrophobicContact CB-CB 3.8Å; W134-A211 VanDerWaalsContact CD1-CB 3.47Å; W134-A211 HydrophobicContact CD2-CB 4.24Å; W134-A211 HydrophobicContact CG-CB 3.56Å; W170-A211 HydrophobicContact CE3-CB 3.9Å; W170-A211 HydrophobicContact CH2-CB 3.91Å; W170-A211 HydrophobicContact CZ3-CB 3.41Å; W170-A211 VanDerWaalsContact CZ3-CB 3.41Å; A211-Q222 WeakPolarHBondContact O-CA 3.1Å; A211-D223 PolarHBondContact N-O 3.12Å; A211-D223 PolarHBondContact O-N 2.76Å; A211-D223 VanDerWaalsContact O-O 3.11Å; A211-Y225 HydrophobicContact CB-CD1 3.97Å; A211-Y225 HydrophobicContact CB-CE1 4.12Å; A211-Y225 HydrophobicContact CB-CG 4.31Å
212	V	95.6	Very high	85.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.4	178.1	-175	0	0	0	0	110.8	I171 L173 W186 W199 W220 K221	I171-V212 HydrophobicContact CD1-CB 4.3Å; I171-V212 HydrophobicContact CD1-CG1 3.76Å; I171-V212 HydrophobicContact CG1-CB 4.01Å; I171-V212 HydrophobicContact CG1-CG1 3.92Å; I171-V212 WeakPolarHBondContact CG1-O 3.23Å; I171-V212 PolarHBondContact N-O 3.04Å; L173-V212 HydrophobicContact CB-CB 3.95Å; L173-V212 HydrophobicContact CB-CG2 3.95Å; L173-V212 HydrophobicContact CD2-CB 4.38Å; L173-V212 HydrophobicContact CD2-CG1 4.38Å; L173-V212 HydrophobicContact CD2-CG2 3.92Å; L173-V212 HydrophobicContact CG-CB 4.32Å; L173-V212 HydrophobicContact CG-CG2 3.8Å; L173-V212 WeakPolarHBondContact O-CB 3.25Å; L173-V212 WeakPolarHBondContact O-CG2 3.4Å; L173-V212 PolarHBondContact O-N 3.41Å; W186-V212 HydrophobicContact CE3-CG2 4.07Å; W186-V212 HydrophobicContact CH2-CG2 3.99Å; W186-V212 HydrophobicContact CZ3-CG2 3.32Å; W199-V212 HydrophobicContact CH2-CG1 4.38Å; W199-V212 HydrophobicContact CH2-CG2 3.77Å; W199-V212 HydrophobicContact CZ3-CG1 3.81Å; W199-V212 HydrophobicContact CZ3-CG2 3.87Å; V212-W220 HydrophobicContact CG1-CB 3.74Å; V212-W220 HydrophobicContact CG1-CG 4.17Å; V212-K221 WeakPolarHBondContact CA-O 3.16Å; V212-K221 WeakPolarHBondContact CG1-O 3Å
213	C	95.4	Very high	86.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	155.1	169.1	47.1	0	0	0	0	111.3	E168 S169 W170 W220 K221	E168-C213 HydrophobicContact CG-CB 4.3Å; S169-C213 VanDerWaalsContact C-CB 3.47Å; S169-C213 CarbonylContact O-C 3.52Å; S169-C213 WeakPolarHBondContact O-CA 3.38Å; S169-C213 WeakPolarHBondContact O-CB 3.44Å; W170-C213 HydrophobicContact CD2-CB 4.34Å; W170-C213 HydrophobicContact CE3-CB 3.69Å; W170-C213 HydrophobicContact CZ3-CB 4.11Å; C213-W220 WeakPolarHBondContact O-CA 3.45Å; C213-K221 PolarHBondContact N-O 3.39Å; C213-K221 PolarHBondContact O-N 3.15Å; C213-K221 WeakPolarHBondContact SG-CE 3.46Å; C213-K221 WeakPolarHBondContact SG-CG 3.19Å
214	C	95.8	Very high	86.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.3	170.3	-163	0	0	0	0	108.6	I160 N164 E168 S169 I171 K219	I160-C214 HydrophobicContact CG2-CB 4.49Å; N164-C214 PolarHBondContact ND2-O 3.35Å; E168-C214 WeakPolarHBondContact CA-O 3.29Å; S169-C214 PolarHBondContact N-O 3.25Å; S169-C214 PolarHBondContact O-N 2.97Å; I171-C214 HydrophobicContact CG2-CB 4.12Å; C214-K219 WeakPolarHBondContact CA-O 3.39Å
215	D	92.7	Very high	87	Confident	27 Å²	27	51.4 Å²	51.4	14%	0.144	24%	0.241	C	C	.	.			trans	-80.4	-179.9	-179.5	75.8	11.2	0	0	0	112.9	N164 G217 G218 K219	N164-D215 PolarHBondContact ND2-O 2.83Å; D215-G217 PolarHBondContact O-N 2.61Å; D215-G217 VanDerWaalsContact OD1-CA 3.28Å; D215-G217 WeakPolarHBondContact OD1-CA 3.46Å; D215-G217 PolarHBondContact OD1-N 2.88Å; D215-G218 PolarHBondContact O-N 2.99Å; D215-G218 VanDerWaalsContact O-N 3.1Å; D215-G218 PolarHBondContact OD1-N 3.11Å; D215-K219 VanDerWaalsContact CG-O 3.26Å; D215-K219 PolarHBondContact N-O 3.03Å; D215-K219 PolarHBondContact OD1-N 2.93Å
216	Y	87.9	Confident	87.8	Confident	193 Å²	193	54 Å²	54	76%	0.757	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-19	178.2	56.8	-93.3	0	0	0	114.3
217	G	88.7	Confident	89.1	Confident	38 Å²	38	56.1 Å²	56.1	39%	0.392	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-5.1	175	0	0	0	0	0	113.7	D215	D215-G217 PolarHBondContact O-N 2.61Å; D215-G217 VanDerWaalsContact OD1-CA 3.28Å; D215-G217 WeakPolarHBondContact OD1-CA 3.46Å; D215-G217 PolarHBondContact OD1-N 2.88Å
218	G	90.9	Very high	90.5	Very high	6 Å²	6	52.9 Å²	52.9	6%	0.062	25%	0.245	C	C	.	.	S	Bend	trans	74.5	35.3	-171.9	0	0	0	0	0	112.9	Q157 D215	Q157-G218 PolarHBondContact NE2-O 2.75Å; D215-G218 PolarHBondContact O-N 2.99Å; D215-G218 VanDerWaalsContact O-N 3.1Å; D215-G218 PolarHBondContact OD1-N 3.11Å
219	K	94.1	Very high	91.8	Very high	99 Å²	99	48.3 Å²	48.3	43%	0.43	22%	0.224	S	C	.	.			trans	-116.1	149.6	173.2	-67.8	-58.2	-170	175.2	0	110.7	C214 D215	C214-K219 WeakPolarHBondContact CA-O 3.39Å; D215-K219 VanDerWaalsContact CG-O 3.26Å; D215-K219 PolarHBondContact N-O 3.03Å; D215-K219 PolarHBondContact OD1-N 2.93Å
220	W	94.9	Very high	93	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	130.9	179.1	-58.8	-6.5	0	0	0	110.8	I151 I171 L173 W188 L194 Q196 P197 F198 W199 G200 V212 C213	I151-W220 HydrophobicContact CB-CZ2 3.81Å; I151-W220 HydrophobicContact CD1-CZ2 4.23Å; I151-W220 HydrophobicContact CG2-CZ2 3.98Å; I171-W220 HydrophobicContact CD1-CD2 3.91Å; I171-W220 HydrophobicContact CD1-CG 4.08Å; I171-W220 HydrophobicContact CD1-CZ2 4.28Å; L173-W220 HydrophobicContact CD2-CE3 3.69Å; L173-W220 HydrophobicContact CD2-CH2 4.35Å; L173-W220 HydrophobicContact CD2-CZ3 3.48Å; L173-W220 VanDerWaalsContact CD2-CZ3 3.48Å; W188-W220 AromaticContact CH2-CH2 3.7Å; W188-W220 HydrophobicContact CH2-CH2 3.7Å; W188-W220 AromaticContact CH2-CZ2 3.92Å; W188-W220 HydrophobicContact CH2-CZ2 3.92Å; W188-W220 HydrophobicContact CH2-CZ3 4.37Å; W188-W220 AromaticContact CZ2-CH2 3.64Å; W188-W220 HydrophobicContact CZ2-CH2 3.64Å; W188-W220 HydrophobicContact CZ2-CZ2 4.27Å; W188-W220 HydrophobicContact CZ2-CZ3 4.31Å; L194-W220 HydrophobicContact CD1-CH2 3.99Å; L194-W220 HydrophobicContact CD1-CZ3 3.69Å; L194-W220 HydrophobicContact CD2-CZ3 4.47Å; Q196-W220 WeakPolarHBondContact O-CH2 3.32Å; P197-W220 HydrophobicContact CB-CZ3 4.47Å; F198-W220 HydrophobicContact CB-CD2 4.06Å; F198-W220 HydrophobicContact CB-CG 4.39Å; F198-W220 HydrophobicContact CB-CZ2 4.03Å; F198-W220 AromaticContact CD2-CH2 3.76Å; F198-W220 HydrophobicContact CD2-CH2 3.76Å; F198-W220 AromaticContact CD2-CZ2 3.43Å; F198-W220 HydrophobicContact CD2-CZ2 3.43Å; F198-W220 VanDerWaalsContact CD2-CZ2 3.43Å; F198-W220 HydrophobicContact CE2-CZ2 4.34Å; F198-W220 HydrophobicContact CG-CZ2 4.19Å; F198-W220 PolarHBondContact O-N 2.79Å; W199-W220 HydrophobicContact CD2-CB 4.48Å; W199-W220 HydrophobicContact CD2-CE3 4.32Å; W199-W220 HydrophobicContact CE3-CB 3.64Å; W199-W220 HydrophobicContact CE3-CE3 4.23Å; W199-W220 HydrophobicContact CH2-CE3 4.4Å; W199-W220 HydrophobicContact CZ2-CE3 4.5Å; W199-W220 HydrophobicContact CZ3-CB 3.99Å; W199-W220 HydrophobicContact CZ3-CE3 4.27Å; G200-W220 PolarHBondContact N-O 3.15Å; V212-W220 HydrophobicContact CG1-CB 3.74Å; V212-W220 HydrophobicContact CG1-CG 4.17Å; C213-W220 WeakPolarHBondContact O-CA 3.45Å
221	K	92.6	Very high	93.6	Very high	52 Å²	52	46.4 Å²	46.4	23%	0.226	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.3	169.1	74.5	166.7	-151.2	178.9	0	111	E168 L203 V212 C213 D223	E168-K221 VanDerWaalsContact OE1-CE 3.29Å; E168-K221 WeakPolarHBondContact OE1-CE 3.38Å; E168-K221 IonicContact OE1-NZ 2.72Å; E168-K221 PolarHBondContact OE1-NZ 2.94Å; E168-K221 WeakPolarHBondContact OE2-CE 3.3Å; E168-K221 IonicContact OE2-NZ 3.98Å; E168-K221 PolarHBondContact OE2-NZ 3.43Å; L203-K221 HydrophobicContact CD1-CB 3.88Å; V212-K221 WeakPolarHBondContact CA-O 3.16Å; V212-K221 WeakPolarHBondContact CG1-O 3Å; C213-K221 PolarHBondContact N-O 3.39Å; C213-K221 PolarHBondContact O-N 3.15Å; C213-K221 WeakPolarHBondContact SG-CE 3.46Å; C213-K221 WeakPolarHBondContact SG-CG 3.19Å; K221-D223 IonicContact NZ-OD2 3.18Å; K221-D223 PolarHBondContact NZ-OD2 2.82Å
222	Q	92.1	Very high	93.9	Very high	19 Å²	19	46.4 Å²	46.4	9%	0.089	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	144.1	168.9	-63.9	168.4	-71.2	0	0	109.4	W186 W199 N205 Y210 A211	W186-Q222 HydrophobicContact CH2-CG 3.81Å; W186-Q222 HydrophobicContact CZ2-CG 4.31Å; W199-Q222 HydrophobicContact CZ3-CG 4.29Å; N205-Q222 PolarHBondContact ND2-OE1 3.21Å; N205-Q222 PolarHBondContact O-NE2 3.27Å; N205-Q222 PolarHBondContact O-OE1 2.99Å; Y210-Q222 HydrophobicContact CD1-CB 4.47Å; Y210-Q222 HydrophobicContact CD2-CB 4.23Å; Y210-Q222 HydrophobicContact CG-CB 4.03Å; A211-Q222 WeakPolarHBondContact O-CA 3.1Å
223	D	91.6	Very high	94	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.059	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	160.2	175.6	-160.7	-3.1	0	0	0	109.4	W170 A211 K221 Y227 N229	W170-D223 HydrophobicContact CH2-CB 3.56Å; W170-D223 HydrophobicContact CZ3-CB 3.78Å; A211-D223 PolarHBondContact N-O 3.12Å; A211-D223 PolarHBondContact O-N 2.76Å; A211-D223 VanDerWaalsContact O-O 3.11Å; K221-D223 IonicContact NZ-OD2 3.18Å; K221-D223 PolarHBondContact NZ-OD2 2.82Å; D223-Y227 WeakPolarHBondContact OD1-CD1 3.49Å; D223-Y227 VanDerWaalsContact OD1-CG 3.31Å; D223-N229 PolarHBondContact OD2-ND2 2.92Å
224	Y	92	Very high	94.1	Very high	99 Å²	99	48.1 Å²	48.1	39%	0.388	22%	0.219	S	C	.	.			trans	-74.2	146.6	-173.8	-66.1	-95.1	0	0	0	111.4	W170 Q208 Y210 D226 Y227	W170-Y224 WeakPolarHBondContact CH2-O 3.41Å; W170-Y224 WeakPolarHBondContact CZ2-O 3.04Å; Q208-Y224 PolarHBondContact OE1-OH 3.06Å; Y210-Y224 HydrophobicContact CD1-CD1 4.42Å; Y210-Y224 HydrophobicContact CD1-CG 4.5Å; Y210-Y224 AromaticContact CE1-CD1 3.99Å; Y210-Y224 HydrophobicContact CE1-CD1 3.99Å; Y210-Y224 HydrophobicContact CE1-CD2 4.22Å; Y210-Y224 AromaticContact CE1-CE1 3.78Å; Y210-Y224 HydrophobicContact CE1-CE1 3.78Å; Y210-Y224 AromaticContact CE1-CE2 4Å; Y210-Y224 HydrophobicContact CE1-CE2 4Å; Y210-Y224 HydrophobicContact CE1-CG 4.2Å; Y210-Y224 AromaticContact CE1-CZ 3.77Å; Y224-D226 WeakPolarHBondContact CB-OD1 3.24Å; Y224-D226 PolarHBondContact O-N 2.63Å; Y224-D226 VanDerWaalsContact O-N 3.15Å; Y224-Y227 HydrophobicContact CD2-CD2 4.32Å; Y224-Y227 HydrophobicContact CD2-CE2 4.27Å; Y224-Y227 WeakPolarHBondContact O-CB 3.39Å; Y224-Y227 PolarHBondContact O-N 2.97Å
225	Y	93.4	Very high	94.1	Very high	26 Å²	26	53.5 Å²	53.5	10%	0.102	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.8	-177.2	-77	-88.1	0	0	0	114.2	T133 W134 Y135 Q174 A211	T133-Y225 WeakPolarHBondContact CB-O 3.34Å; W134-Y225 HydrophobicContact CB-CD1 4.09Å; W134-Y225 HydrophobicContact CD2-CD1 4.17Å; W134-Y225 HydrophobicContact CD2-CE1 4.11Å; W134-Y225 AromaticContact CE3-CD1 3.88Å; W134-Y225 HydrophobicContact CE3-CD1 3.88Å; W134-Y225 AromaticContact CE3-CE1 3.74Å; W134-Y225 HydrophobicContact CE3-CE1 3.74Å; W134-Y225 HydrophobicContact CG-CD1 4.3Å; W134-Y225 HydrophobicContact CZ3-CE1 4.12Å; W134-Y225 PolarHBondContact N-O 3.41Å; W134-Y225 VanDerWaalsContact N-O 3.15Å; Y135-Y225 HydrophobicContact CD2-CD1 4.1Å; Y135-Y225 HydrophobicContact CE1-CD1 4.1Å; Y135-Y225 HydrophobicContact CE1-CE1 4.09Å; Y135-Y225 AromaticContact CE2-CD1 3.42Å; Y135-Y225 HydrophobicContact CE2-CD1 3.42Å; Y135-Y225 VanDerWaalsContact CE2-CD1 3.42Å; Y135-Y225 HydrophobicContact CE2-CE1 4.13Å; Y135-Y225 AromaticContact CE2-CG 3.76Å; Y135-Y225 HydrophobicContact CE2-CG 3.76Å; Y135-Y225 AromaticContact CZ-CD1 3.41Å; Y135-Y225 VanDerWaalsContact CZ-CD1 3.41Å; Y135-Y225 AromaticContact CZ-CE1 3.62Å; Y135-Y225 WeakPolarHBondContact OH-CE1 3.16Å; Q174-Y225 HydrophobicContact CB-CE1 4.41Å; Q174-Y225 WeakPolarHBondContact CB-OH 3.22Å; Q174-Y225 PolarHBondContact OE1-OH 2.91Å; Q174-Y225 VanDerWaalsContact OE1-OH 3.11Å; A211-Y225 HydrophobicContact CB-CD1 3.97Å; A211-Y225 HydrophobicContact CB-CE1 4.12Å; A211-Y225 HydrophobicContact CB-CG 4.31Å
226	D	93.6	Very high	94.2	Very high	111 Å²	111	54.8 Å²	54.8	59%	0.594	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.6	179	64	-20.8	0	0	0	113.8	Y224 Y228	Y224-D226 WeakPolarHBondContact CB-OD1 3.24Å; Y224-D226 PolarHBondContact O-N 2.63Å; Y224-D226 VanDerWaalsContact O-N 3.15Å; D226-Y228 WeakPolarHBondContact O-CE2 3.41Å
227	Y	94.6	Very high	94.5	Very high	127 Å²	127	47.5 Å²	47.5	50%	0.498	22%	0.22	S	C	.	.	S	Bend	trans	-68.2	149.2	171.9	-100.8	-120.4	0	0	0	111.5	T133 W170 D223 Y224	T133-Y227 WeakPolarHBondContact CA-O 3.43Å; W170-Y227 WeakPolarHBondContact CZ2-O 3.46Å; D223-Y227 WeakPolarHBondContact OD1-CD1 3.49Å; D223-Y227 VanDerWaalsContact OD1-CG 3.31Å; Y224-Y227 HydrophobicContact CD2-CD2 4.32Å; Y224-Y227 HydrophobicContact CD2-CE2 4.27Å; Y224-Y227 WeakPolarHBondContact O-CB 3.39Å; Y224-Y227 PolarHBondContact O-N 2.97Å
228	Y	95.8	Very high	94.8	Very high	139 Å²	139	48.1 Å²	48.1	55%	0.545	21%	0.211	S	C	.	.			trans	-99.8	111.5	-177.9	-70.2	-97.3	0	0	0	109.4	R131 K132 T133 D226	R131-Y228 PolarHBondContact NE-O 3.06Å; R131-Y228 PolarHBondContact NH2-O 3.36Å; K132-Y228 WeakPolarHBondContact O-CA 3.39Å; T133-Y228 HydrophobicContact CG2-CE1 4.2Å; D226-Y228 WeakPolarHBondContact O-CE2 3.41Å
229	N	96.4	Very high	95.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-128.5	166.3	173.6	-67.3	-40.9	0	0	0	110.2	R131 K132 E168 W170 D223	R131-N229 CarbonylContact C-O 3.53Å; R131-N229 VanDerWaalsContact CA-O 3.25Å; R131-N229 WeakPolarHBondContact CA-O 3.37Å; R131-N229 PolarHBondContact NH2-OD1 3.38Å; K132-N229 PolarHBondContact N-O 3.39Å; K132-N229 PolarHBondContact O-N 2.77Å; E168-N229 PolarHBondContact OE1-OD1 2.98Å; E168-N229 VanDerWaalsContact OE1-OD1 3.08Å; W170-N229 HydrophobicContact CD2-CB 4.15Å; W170-N229 HydrophobicContact CG-CB 4.24Å; W170-N229 HydrophobicContact CZ2-CB 4.3Å; W170-N229 VanDerWaalsContact CZ2-ND2 3.34Å; W170-N229 WeakPolarHBondContact CZ2-ND2 3.46Å; D223-N229 PolarHBondContact OD2-ND2 2.92Å
230	N	97.1	Very high	95.1	Very high	26 Å²	26	47.5 Å²	47.5	14%	0.139	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	178.3	165.1	-65.6	93.4	0	0	0	108.5	G128 E129 E130 E168 S169 W170	G128-N230 PolarHBondContact O-ND2 2.92Å; E129-N230 VanDerWaalsContact C-ND2 3.3Å; E129-N230 PolarHBondContact O-ND2 3.37Å; E130-N230 PolarHBondContact O-ND2 3.01Å; E130-N230 VanDerWaalsContact O-ND2 3.14Å; E168-N230 WeakPolarHBondContact O-CB 3.29Å; E168-N230 PolarHBondContact O-N 3.02Å; S169-N230 CarbonylContact C-O 3.51Å; S169-N230 VanDerWaalsContact CA-O 3.25Å; S169-N230 WeakPolarHBondContact CA-O 3.06Å; S169-N230 WeakPolarHBondContact OG-CB 3.47Å; W170-N230 PolarHBondContact N-O 3.05Å
231	W	97.9	Very high	95.1	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	158.3	176.3	71.2	95.2	0	0	0	111.3	F126 K127 G128 E130 K132 Y140 C141 L148 W170 C233	F126-W231 HydrophobicContact CE1-CZ2 4.27Å; K127-W231 CarbonylContact C-O 3.55Å; K127-W231 VanDerWaalsContact CA-O 3.3Å; K127-W231 WeakPolarHBondContact CA-O 3.46Å; G128-W231 PolarHBondContact N-O 3.28Å; E130-W231 HydrophobicContact CG-CH2 3.57Å; E130-W231 HydrophobicContact CG-CZ3 3.64Å; E130-W231 VanDerWaalsContact O-CZ3 3.22Å; E130-W231 WeakPolarHBondContact O-CZ3 3.38Å; K132-W231 HydrophobicContact CB-CE3 4.19Å; K132-W231 HydrophobicContact CB-CZ3 4.16Å; K132-W231 HydrophobicContact CD-CE3 4.28Å; K132-W231 HydrophobicContact CD-CH2 3.86Å; K132-W231 HydrophobicContact CD-CZ3 3.7Å; K132-W231 VanDerWaalsContact CE-CH2 3.46Å; K132-W231 HydrophobicContact CG-CE3 4.25Å; K132-W231 HydrophobicContact CG-CH2 4.33Å; K132-W231 HydrophobicContact CG-CZ3 3.72Å; Y140-W231 AromaticContact CD1-CE2 3.82Å; Y140-W231 AromaticContact CD1-CZ2 3.61Å; Y140-W231 HydrophobicContact CD1-CZ2 3.61Å; Y140-W231 AromaticContact CD1-NE1 3.48Å; Y140-W231 HydrophobicContact CD2-CH2 4.47Å; Y140-W231 AromaticContact CD2-CZ2 3.81Å; Y140-W231 HydrophobicContact CD2-CZ2 3.81Å; Y140-W231 AromaticContact CE1-CZ2 3.9Å; Y140-W231 HydrophobicContact CE1-CZ2 3.9Å; Y140-W231 HydrophobicContact CE2-CZ2 4.05Å; Y140-W231 AromaticContact CG-CZ2 3.59Å; Y140-W231 HydrophobicContact CG-CZ2 3.59Å; C141-W231 VanDerWaalsContact SG-CD1 3.54Å; L148-W231 HydrophobicContact CD2-CB 3.84Å; L148-W231 HydrophobicContact CD2-CG 4.32Å; W170-W231 HydrophobicContact CB-CB 3.97Å; W231-C233 PolarHBondContact NE1-SG 2.68Å; W231-C233 VanDerWaalsContact NE1-SG 3.35Å
232	I	98.3	Very high	95.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.6	173.5	-61.1	163.7	0	0	0	109	Y125 F126 K127 L148 V149 I160 F163 N164 W170	Y125-I232 HydrophobicContact CD1-CG2 4.43Å; F126-I232 CarbonylContact O-C 3.14Å; F126-I232 VanDerWaalsContact O-CA 3.29Å; F126-I232 WeakPolarHBondContact O-CA 3.44Å; K127-I232 HydrophobicContact CB-CG1 4.26Å; K127-I232 HydrophobicContact CG-CG1 4.28Å; L148-I232 WeakPolarHBondContact CA-O 3.45Å; V149-I232 HydrophobicContact CB-CB 4.4Å; V149-I232 HydrophobicContact CB-CG2 3.96Å; V149-I232 HydrophobicContact CG1-CB 3.75Å; V149-I232 HydrophobicContact CG1-CG2 3.8Å; V149-I232 PolarHBondContact N-O 3.15Å; I160-I232 HydrophobicContact CD1-CD1 4.38Å; I160-I232 HydrophobicContact CD1-CG2 4.06Å; I160-I232 HydrophobicContact CG2-CD1 3.93Å; F163-I232 HydrophobicContact CD1-CD1 4.14Å; F163-I232 HydrophobicContact CD1-CG1 4.34Å; F163-I232 HydrophobicContact CD1-CG2 4.21Å; F163-I232 HydrophobicContact CE1-CG1 4.3Å; F163-I232 HydrophobicContact CE1-CG2 3.93Å; N164-I232 HydrophobicContact CB-CD1 4.07Å; W170-I232 PolarHBondContact O-N 3.01Å; W170-I232 VanDerWaalsContact O-N 3.15Å
233	C	98.5	Very high	95.6	Very high	0 Å²	0	53 Å²	53	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	155.1	170.3	-54.4	0	0	0	0	111.3	W117 Y125 F126 C141 A146 D147 W231	W117-C233 HydrophobicContact CH2-CB 3.63Å; W117-C233 HydrophobicContact CZ3-CB 3.91Å; Y125-C233 VanDerWaalsContact CA-O 3.25Å; Y125-C233 WeakPolarHBondContact CA-O 3.29Å; F126-C233 HydrophobicContact CB-CB 4.39Å; F126-C233 PolarHBondContact N-O 2.95Å; F126-C233 VanDerWaalsContact N-O 3.11Å; F126-C233 PolarHBondContact O-N 2.82Å; C141-C233 WeakPolarHBondContact CA-SG 3.42Å; C141-C233 HydrophobicContact CB-CB 3.71Å; C141-C233 WeakPolarHBondContact CB-SG 3.3Å; C141-C233 WeakPolarHBondContact SG-CA 3.35Å; C141-C233 WeakPolarHBondContact SG-CB 3.38Å; C141-C233 CovalentContact SG-SG 2.04Å; C141-C233 PolarHBondContact SG-SG 3.43Å; A146-C233 HydrophobicContact CB-CB 4.12Å; D147-C233 CarbonylContact O-C 3.49Å; D147-C233 WeakPolarHBondContact O-CA 3.35Å; W231-C233 PolarHBondContact NE1-SG 2.68Å; W231-C233 VanDerWaalsContact NE1-SG 3.35Å
234	E	98.4	Very high	95.9	Very high	35 Å²	35	56.5 Å²	56.5	16%	0.164	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.3	171.1	-172.6	-173.2	177.6	0	0	111.2	S123 C124 Y125 A146 D147 V149 I150	S123-E234 VanDerWaalsContact CB-OE1 3.22Å; S123-E234 WeakPolarHBondContact CB-OE1 3.44Å; S123-E234 PolarHBondContact OG-OE1 3.13Å; C124-E234 WeakPolarHBondContact O-CA 3.44Å; Y125-E234 HydrophobicContact CD1-CB 4.09Å; Y125-E234 HydrophobicContact CD1-CG 4Å; Y125-E234 HydrophobicContact CE1-CB 4.13Å; Y125-E234 HydrophobicContact CE1-CG 3.65Å; A146-E234 VanDerWaalsContact CA-O 3.32Å; A146-E234 WeakPolarHBondContact CA-O 3.37Å; A146-E234 VanDerWaalsContact CB-O 3.23Å; A146-E234 WeakPolarHBondContact CB-O 3.38Å; D147-E234 PolarHBondContact N-O 2.98Å; D147-E234 PolarHBondContact O-N 2.94Å; V149-E234 HydrophobicContact CB-CB 4.1Å; V149-E234 HydrophobicContact CG2-CB 4.2Å; I150-E234 PolarHBondContact N-OE2 3.05Å; I150-E234 VanDerWaalsContact N-OE2 3.11Å
235	K	94.9	Very high	96.3	Very high	113 Å²	113	52.6 Å²	52.6	49%	0.491	23%	0.231	S	C	.	.			trans	-150.1	0	173.9	66.2	177.9	-64.8	98.3	0	112.8	P114 W117 S123 C124 K144 G145 A146	P114-K235 HydrophobicContact CG-CD 4.3Å; W117-K235 HydrophobicContact CD2-CD 4.31Å; W117-K235 HydrophobicContact CE3-CD 3.99Å; W117-K235 HydrophobicContact CE3-CG 3.99Å; W117-K235 HydrophobicContact CH2-CD 4.06Å; W117-K235 HydrophobicContact CH2-CG 4.33Å; W117-K235 HydrophobicContact CZ2-CD 4.35Å; W117-K235 HydrophobicContact CZ3-CB 4.46Å; W117-K235 HydrophobicContact CZ3-CD 3.86Å; W117-K235 HydrophobicContact CZ3-CG 3.74Å; S123-K235 CarbonylContact C-O 3.57Å; S123-K235 WeakPolarHBondContact CA-O 3.27Å; C124-K235 HydrophobicContact CB-CD 4.45Å; C124-K235 HydrophobicContact CB-CG 3.82Å; C124-K235 PolarHBondContact N-O 3.31Å; C124-K235 PolarHBondContact O-N 3.16Å; K144-K235 PolarHBondContact O-NZ 3.14Å; G145-K235 PolarHBondContact O-NZ 2.95Å; A146-K235 HydrophobicContact CB-CB 3.81Å

Retrieved 235 of 235 residues in 645.8 ms (Link to these results)

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