A0A077Z2E4_TRITR Loading...

CS domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z2E4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 236 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	37	Very low	30.7	Very low	249 Å²	249	155.7 Å²	155.7	100%	1.227	83%	0.833	S	S	*	*				0	141.3	0	-81.3	171.4	167.6	0	0	108.5
2	R	34.4	Very low	30.5	Very low	244 Å²	244	152.8 Å²	152.8	92%	0.921	83%	0.831	S	S	*	*			trans	-54.3	131.6	-168.8	-70.9	171.4	178.8	179.3	-1.8	113.8
3	S	29.8	Very low	30	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	83%	0.83	S	S	*	*				87.1	134.3	99.9	-146.3	0	0	0	0	112.1
4	C	32.3	Very low	29.9	Very low	119 Å²	119	150.8 Å²	150.8	80%	0.804	83%	0.826	S	S	*	*			cis	-153	154.2	10.5	-94.3	0	0	0	0	109.7
5	A	29.2	Very low	29.8	Very low	86 Å²	86	153.8 Å²	153.8	71%	0.711	83%	0.828	S	S	*	*			trans	-76.3	158	159.4	0	0	0	0	0	111.7
6	W	31.1	Very low	29.8	Very low	261 Å²	261	149.5 Å²	149.5	99%	0.989	81%	0.813	S	S	*	*			trans	-155.3	134.1	148.6	-116.6	67.3	0	0	0	109.7
7	N	31.5	Very low	29.8	Very low	132 Å²	132	147 Å²	147	71%	0.706	82%	0.817	S	S	*	*			trans	-95.4	162.4	-169.9	-91.1	-4.1	0	0	0	113.8
8	E	27.3	Very low	29.6	Very low	178 Å²	178	148.9 Å²	148.9	83%	0.832	82%	0.819	S	S	*	*			trans	29.9	124.2	142.9	-65.9	173	139.7	0	0	121.3
9	A	29	Very low	29.5	Very low	87 Å²	87	147.1 Å²	147.1	72%	0.719	82%	0.818	S	S	*	*				173.4	140.1	118.8	0	0	0	0	0	113.4
10	N	30.4	Very low	29.9	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	82%	0.815	S	S	*	*			trans	72.9	101.2	153.5	-62.5	-8.2	0	0	0	118.8
11	S	25.9	Very low	30.4	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	81%	0.809	S	S	*	*				70.3	110.3	83.7	79.6	0	0	0	0	114.5
12	C	28.5	Very low	30.6	Very low	120 Å²	120	135.3 Å²	135.3	81%	0.811	78%	0.78	S	S	*	*				159.6	90.4	122.2	-86.4	0	0	0	0	110.3
13	D	24	Very low	30.9	Very low	152 Å²	152	127.4 Å²	127.4	81%	0.813	76%	0.763	S	S	*	*			trans	-62.7	148.2	146.9	-73.6	-55	0	0	0	110
14	T	28.6	Very low	31.3	Very low	126 Å²	126	125.4 Å²	125.4	77%	0.773	75%	0.752	S	S	*	*			trans	69	99.1	155.7	-34.2	0	0	0	0	117.9
15	F	28.1	Very low	32	Very low	196 Å²	196	124.5 Å²	124.5	86%	0.86	74%	0.744	S	S	*	*			trans	-138.7	101.5	151.8	-110	-93.2	0	0	0	111.8
16	S	30.6	Very low	32.7	Very low	85 Å²	85	128.4 Å²	128.4	59%	0.594	74%	0.741	S	S	*	*				67.2	87	121.7	-43.9	0	0	0	0	119.5	Q18	S16-Q18 PolarHBondContact O-N 3.21Å
17	A	28.4	Very low	33.3	Very low	107 Å²	107	120.8 Å²	120.8	88%	0.884	72%	0.719	S	S	*	*	S	Bend	trans	-71	90.4	145.1	0	0	0	0	0	109.4
18	Q	27.3	Very low	34	Very low	181 Å²	181	122.8 Å²	122.8	85%	0.846	72%	0.717	S	S	*	*			trans	-172.6	79.9	167.3	-110.4	172.1	12.2	0	0	111.1	S16	S16-Q18 PolarHBondContact O-N 3.21Å
19	S	27.6	Very low	35.3	Very low	114 Å²	114	115.8 Å²	115.8	80%	0.797	69%	0.693	S	S	*	*			trans	-179.7	66.6	160.3	49.6	0	0	0	0	113
20	S	37.5	Very low	36.3	Very low	109 Å²	109	115 Å²	115	76%	0.762	68%	0.676	S	S	*	*	S	Bend	trans	-148.8	-0.9	166.7	59.5	0	0	0	0	116.4
21	S	39.8	Very low	37.2	Very low	97 Å²	97	110.1 Å²	110.1	68%	0.678	65%	0.651	S	S	*	*	S	Bend	trans	-94.8	-13.8	-178	60.2	0	0	0	0	115.4	T25	S21-T25 PolarHBondContact O-OG1 3.13Å
22	S	41.4	Very low	38.5	Very low	90 Å²	90	111 Å²	111	63%	0.629	64%	0.644	S	S	*	*	H	α-helix	trans	-86.4	-31.9	-175.3	43.5	0	0	0	0	114.1	Y26	S22-Y26 PolarHBondContact O-N 3.46Å
23	S	40.3	Very low	39.7	Very low	79 Å²	79	114.1 Å²	114.1	55%	0.552	64%	0.639	S	S	*	*	H	α-helix	trans	-77.1	-36.3	-177	-161.9	0	0	0	0	113.2	T25 Y26 L27	S23-T25 PolarHBondContact O-N 3.43Å; S23-Y26 PolarHBondContact O-N 3.14Å; S23-L27 WeakPolarHBondContact O-CG 3.45Å; S23-L27 PolarHBondContact O-N 3.01Å; S23-L27 VanDerWaalsContact O-N 3.1Å
24	A	38.9	Very low	40.8	Very low	67 Å²	67	111.4 Å²	111.4	55%	0.554	62%	0.624	S	S	*	*	H	α-helix	trans	-68	-34	178	0	0	0	0	0	112.9	R28	A24-R28 WeakPolarHBondContact O-CB 3.47Å; A24-R28 PolarHBondContact O-N 3.39Å; A24-R28 VanDerWaalsContact O-N 3.14Å
25	T	46.9	Very low	42.2	Very low	101 Å²	101	109.5 Å²	109.5	62%	0.62	61%	0.612	S	S	*	*	H	α-helix	trans	-74.5	-36	178.4	-44.5	0	0	0	0	111.6	S21 S23 G29	S21-T25 PolarHBondContact O-OG1 3.13Å; S23-T25 PolarHBondContact O-N 3.43Å; T25-G29 PolarHBondContact O-N 3.34Å; T25-G29 VanDerWaalsContact O-N 3.13Å
26	Y	43.7	Very low	43.6	Very low	167 Å²	167	107 Å²	107	66%	0.655	60%	0.601	S	S	*	*	H	α-helix	trans	-66	-45.5	175.2	-174.4	-102.1	0	0	0	112.1	S22 S23 R28 G29 L30	S22-Y26 PolarHBondContact O-N 3.46Å; S23-Y26 PolarHBondContact O-N 3.14Å; Y26-R28 VanDerWaalsContact C-N 3.34Å; Y26-R28 PolarHBondContact O-N 3.24Å; Y26-G29 PolarHBondContact O-N 3.42Å; Y26-L30 HydrophobicContact CD1-CD1 4.04Å; Y26-L30 HydrophobicContact CE1-CD1 3.42Å; Y26-L30 VanDerWaalsContact CE1-CD1 3.42Å; Y26-L30 PolarHBondContact O-N 3.28Å; Y26-L30 VanDerWaalsContact O-N 3.09Å
27	L	42.9	Very low	44.7	Very low	101 Å²	101	107.5 Å²	107.5	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-63.8	-39.8	177.1	-71.2	171.4	0	0	0	111.7	S23 G29 L30 V31	S23-L27 WeakPolarHBondContact O-CG 3.45Å; S23-L27 PolarHBondContact O-N 3.01Å; S23-L27 VanDerWaalsContact O-N 3.1Å; L27-G29 PolarHBondContact O-N 3.08Å; L27-L30 PolarHBondContact O-N 3.1Å; L27-V31 VanDerWaalsContact O-CG2 3.27Å; L27-V31 WeakPolarHBondContact O-CG2 3.42Å; L27-V31 PolarHBondContact O-N 3.45Å; L27-V31 VanDerWaalsContact O-N 3.08Å
28	R	47.2	Very low	45.8	Very low	174 Å²	174	105.8 Å²	105.8	66%	0.657	58%	0.578	S	S	*	*	H	α-helix	trans	-60.9	-43	175.1	-170.8	176.4	176.4	-178.8	4.1	112.4	A24 Y26 L30 V31 E32	A24-R28 WeakPolarHBondContact O-CB 3.47Å; A24-R28 PolarHBondContact O-N 3.39Å; A24-R28 VanDerWaalsContact O-N 3.14Å; Y26-R28 VanDerWaalsContact C-N 3.34Å; Y26-R28 PolarHBondContact O-N 3.24Å; R28-L30 VanDerWaalsContact C-N 3.34Å; R28-L30 PolarHBondContact O-N 2.69Å; R28-V31 PolarHBondContact O-N 3.46Å; R28-E32 IonicContact NE-OE1 3.39Å; R28-E32 PolarHBondContact NE-OE1 3.07Å; R28-E32 WeakPolarHBondContact O-CG 3.3Å; R28-E32 PolarHBondContact O-N 3.21Å
29	G	54.4	Low	46.9	Very low	32 Å²	32	102 Å²	102	33%	0.33	56%	0.563	S	S	.	*	H	α-helix	trans	-65.9	-33.2	177.1	0	0	0	0	0	113.9	T25 Y26 L27 R33	T25-G29 PolarHBondContact O-N 3.34Å; T25-G29 VanDerWaalsContact O-N 3.13Å; Y26-G29 PolarHBondContact O-N 3.42Å; L27-G29 PolarHBondContact O-N 3.08Å; G29-R33 WeakPolarHBondContact O-CG 3.45Å; G29-R33 PolarHBondContact O-N 3.09Å
30	L	49.4	Very low	48.1	Very low	71 Å²	71	100.6 Å²	100.6	37%	0.372	55%	0.547	S	S	.	.	H	α-helix	trans	-71	-39.9	176.7	-112.3	160.2	0	0	0	112.3	Y26 L27 R28 R33 L34	Y26-L30 HydrophobicContact CD1-CD1 4.04Å; Y26-L30 HydrophobicContact CE1-CD1 3.42Å; Y26-L30 VanDerWaalsContact CE1-CD1 3.42Å; Y26-L30 PolarHBondContact O-N 3.28Å; Y26-L30 VanDerWaalsContact O-N 3.09Å; L27-L30 PolarHBondContact O-N 3.1Å; R28-L30 VanDerWaalsContact C-N 3.34Å; R28-L30 PolarHBondContact O-N 2.69Å; L30-R33 PolarHBondContact O-N 3.03Å; L30-L34 HydrophobicContact CD2-CD1 4.4Å; L30-L34 PolarHBondContact O-N 3.14Å
31	V	50.3	Low	48.7	Very low	45 Å²	45	100.2 Å²	100.2	27%	0.273	54%	0.536	S	S	.	.	H	α-helix	trans	-68.1	-42.8	177.4	176.7	0	0	0	0	111.2	L27 R28 R33 L34 V35 I91	L27-V31 VanDerWaalsContact O-CG2 3.27Å; L27-V31 WeakPolarHBondContact O-CG2 3.42Å; L27-V31 PolarHBondContact O-N 3.45Å; L27-V31 VanDerWaalsContact O-N 3.08Å; R28-V31 PolarHBondContact O-N 3.46Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 3.46Å; V31-L34 PolarHBondContact O-N 3.27Å; V31-V35 HydrophobicContact CG1-CG2 4.32Å; V31-V35 WeakPolarHBondContact O-CG2 3.41Å; V31-V35 PolarHBondContact O-N 3.21Å; V31-I91 HydrophobicContact CB-CD1 4.28Å; V31-I91 HydrophobicContact CG1-CD1 4Å; V31-I91 HydrophobicContact CG1-CG1 4.41Å; V31-I91 HydrophobicContact CG2-CD1 3.24Å; V31-I91 HydrophobicContact CG2-CG1 4.08Å
32	E	52.6	Low	48.9	Very low	116 Å²	116	100.5 Å²	100.5	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-62	-35.6	176	-76	176.4	-173.2	0	0	112	R28 K36	R28-E32 IonicContact NE-OE1 3.39Å; R28-E32 PolarHBondContact NE-OE1 3.07Å; R28-E32 WeakPolarHBondContact O-CG 3.3Å; R28-E32 PolarHBondContact O-N 3.21Å; E32-K36 VanDerWaalsContact O-CB 3.3Å; E32-K36 WeakPolarHBondContact O-CB 3.27Å; E32-K36 PolarHBondContact O-N 3.39Å
33	R	53.5	Low	49.1	Very low	186 Å²	186	100.4 Å²	100.4	70%	0.702	52%	0.522	S	S	*	.	H	α-helix	trans	-68.6	-47.1	173	-76	-178.7	-177.7	178.7	1.1	112.6	G29 L30 V31 V35 K36 D37	G29-R33 WeakPolarHBondContact O-CG 3.45Å; G29-R33 PolarHBondContact O-N 3.09Å; L30-R33 PolarHBondContact O-N 3.03Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 3.46Å; R33-V35 PolarHBondContact O-N 2.99Å; R33-K36 PolarHBondContact O-N 3.37Å; R33-D37 PolarHBondContact O-N 3.24Å
34	L	47.4	Very low	49.5	Very low	95 Å²	95	99.8 Å²	99.8	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-39	-179.3	-82.1	162	0	0	0	113.1	L30 V31 S38	L30-L34 HydrophobicContact CD2-CD1 4.4Å; L30-L34 PolarHBondContact O-N 3.14Å; V31-L34 PolarHBondContact O-N 3.27Å; L34-S38 PolarHBondContact O-N 2.9Å
35	V	57.5	Low	49.7	Very low	87 Å²	87	103.6 Å²	103.6	53%	0.527	52%	0.524	S	S	.	.	H	α-helix	trans	-66.4	-42.1	175	173	0	0	0	0	110.4	V31 R33 D37 S38 L39	V31-V35 HydrophobicContact CG1-CG2 4.32Å; V31-V35 WeakPolarHBondContact O-CG2 3.41Å; V31-V35 PolarHBondContact O-N 3.21Å; R33-V35 PolarHBondContact O-N 2.99Å; V35-D37 PolarHBondContact O-N 3.5Å; V35-S38 PolarHBondContact O-N 2.82Å; V35-L39 WeakPolarHBondContact O-CB 3.33Å; V35-L39 PolarHBondContact O-N 3.29Å
36	K	58.9	Low	49.3	Very low	144 Å²	144	105.4 Å²	105.4	63%	0.626	53%	0.529	S	S	*	.	H	α-helix	trans	-66	-38.3	179.4	-160.8	170.2	-174.8	177.9	0	112.1	E32 R33 L39 N40	E32-K36 VanDerWaalsContact O-CB 3.3Å; E32-K36 WeakPolarHBondContact O-CB 3.27Å; E32-K36 PolarHBondContact O-N 3.39Å; R33-K36 PolarHBondContact O-N 3.37Å; K36-L39 PolarHBondContact O-N 2.96Å; K36-N40 WeakPolarHBondContact O-CB 3.3Å; K36-N40 PolarHBondContact O-N 2.97Å; K36-N40 PolarHBondContact O-ND2 3.46Å
37	D	53	Low	49.1	Very low	95 Å²	95	102.9 Å²	102.9	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-72.9	-35.7	178.2	-69.1	-20.6	0	0	0	112.7	R33 V35 N41	R33-D37 PolarHBondContact O-N 3.24Å; V35-D37 PolarHBondContact O-N 3.5Å; D37-N41 PolarHBondContact O-N 3.45Å; D37-N41 VanDerWaalsContact O-N 3.09Å
38	S	51.8	Low	48.7	Very low	70 Å²	70	108.8 Å²	108.8	49%	0.49	55%	0.546	S	S	.	.	H	α-helix	trans	-67.5	-40.4	171.2	-88.1	0	0	0	0	112.5	L34 V35 N41 L42	L34-S38 PolarHBondContact O-N 2.9Å; V35-S38 PolarHBondContact O-N 2.82Å; S38-N41 PolarHBondContact O-N 2.92Å; S38-L42 PolarHBondContact O-N 2.95Å
39	L	50.3	Low	48	Very low	101 Å²	101	105.7 Å²	105.7	53%	0.529	55%	0.548	S	S	.	.	H	α-helix	trans	-66.4	-40	178	-147.9	97.7	0	0	0	111.3	V35 K36 N41 L42 L43	V35-L39 WeakPolarHBondContact O-CB 3.33Å; V35-L39 PolarHBondContact O-N 3.29Å; K36-L39 PolarHBondContact O-N 2.96Å; L39-N41 VanDerWaalsContact C-N 3.33Å; L39-N41 PolarHBondContact O-N 3.18Å; L39-L42 PolarHBondContact O-N 3.42Å; L39-L43 HydrophobicContact CD2-CD1 4.1Å; L39-L43 HydrophobicContact CG-CD1 4.49Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 WeakPolarHBondContact O-CG 3.37Å; L39-L43 PolarHBondContact O-N 3.15Å
40	N	53.3	Low	46.8	Very low	86 Å²	86	111.7 Å²	111.7	46%	0.46	57%	0.573	S	S	.	*	H	α-helix	trans	-65.8	-34.1	175.8	-74.6	-22	0	0	0	112.4	K36 S44	K36-N40 WeakPolarHBondContact O-CB 3.3Å; K36-N40 PolarHBondContact O-N 2.97Å; K36-N40 PolarHBondContact O-ND2 3.46Å; N40-S44 WeakPolarHBondContact O-CB 3.49Å; N40-S44 PolarHBondContact O-N 3.27Å; N40-S44 PolarHBondContact O-OG 3.45Å
41	N	49.8	Very low	45.9	Very low	100 Å²	100	112.8 Å²	112.8	54%	0.535	59%	0.592	S	S	.	*	H	α-helix	trans	-72.6	-32.7	173.8	-97.3	-36.9	0	0	0	113.5	D37 S38 L39 S44 Q45	D37-N41 PolarHBondContact O-N 3.45Å; D37-N41 VanDerWaalsContact O-N 3.09Å; S38-N41 PolarHBondContact O-N 2.92Å; L39-N41 VanDerWaalsContact C-N 3.33Å; L39-N41 PolarHBondContact O-N 3.18Å; N41-S44 WeakPolarHBondContact CA-OG 3.33Å; N41-S44 PolarHBondContact O-OG 2.87Å; N41-Q45 WeakPolarHBondContact O-CG 3.38Å; N41-Q45 PolarHBondContact O-N 2.94Å
42	L	42.8	Very low	45	Very low	104 Å²	104	116.2 Å²	116.2	55%	0.545	62%	0.618	S	S	.	*	H	α-helix	trans	-70.7	-40.3	172	-89.1	158.5	0	0	0	111.4	S38 L39 Q45 L46	S38-L42 PolarHBondContact O-N 2.95Å; L39-L42 PolarHBondContact O-N 3.42Å; L42-Q45 PolarHBondContact O-N 3.06Å; L42-L46 PolarHBondContact O-N 3Å; L42-L46 VanDerWaalsContact O-N 3.14Å
43	L	45.4	Very low	44	Very low	88 Å²	88	115.8 Å²	115.8	46%	0.461	63%	0.634	S	S	.	*	H	α-helix	trans	-69.4	-35.7	176.5	-73	168.7	0	0	0	112.2	L39 Q45 L46 V47	L39-L43 HydrophobicContact CD2-CD1 4.1Å; L39-L43 HydrophobicContact CG-CD1 4.49Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 WeakPolarHBondContact O-CG 3.37Å; L39-L43 PolarHBondContact O-N 3.15Å; L43-Q45 VanDerWaalsContact C-N 3.27Å; L43-Q45 PolarHBondContact O-N 3.36Å; L43-L46 PolarHBondContact O-N 3.48Å; L43-V47 WeakPolarHBondContact O-CG2 3.17Å; L43-V47 PolarHBondContact O-N 3.45Å
44	S	49.4	Very low	42.9	Very low	65 Å²	65	113.2 Å²	113.2	46%	0.455	64%	0.639	S	S	.	*	H	α-helix	trans	-69.8	-23.3	175	67.5	0	0	0	0	113.3	N40 N41	N40-S44 WeakPolarHBondContact O-CB 3.49Å; N40-S44 PolarHBondContact O-N 3.27Å; N40-S44 PolarHBondContact O-OG 3.45Å; N41-S44 WeakPolarHBondContact CA-OG 3.33Å; N41-S44 PolarHBondContact O-OG 2.87Å
45	Q	42.9	Very low	42.2	Very low	147 Å²	147	112.2 Å²	112.2	69%	0.687	64%	0.64	S	S	*	*	H	α-helix	trans	-79.2	-29.2	170.6	-72.1	179.4	17.8	0	0	112.8	N41 L42 L43	N41-Q45 WeakPolarHBondContact O-CG 3.38Å; N41-Q45 PolarHBondContact O-N 2.94Å; L42-Q45 PolarHBondContact O-N 3.06Å; L43-Q45 VanDerWaalsContact C-N 3.27Å; L43-Q45 PolarHBondContact O-N 3.36Å
46	L	39.1	Very low	40.9	Very low	139 Å²	139	115.7 Å²	115.7	73%	0.728	65%	0.654	S	S	*	*	H	α-helix	trans	-80	-16.6	175.7	-76.4	162.1	0	0	0	113.3	L42 L43	L42-L46 PolarHBondContact O-N 3Å; L42-L46 VanDerWaalsContact O-N 3.14Å; L43-L46 PolarHBondContact O-N 3.48Å
47	V	39.8	Very low	39.7	Very low	115 Å²	115	117.9 Å²	117.9	70%	0.697	67%	0.667	S	S	*	*			trans	-105	67.7	174.3	-171.5	0	0	0	0	109.7	L43	L43-V47 WeakPolarHBondContact O-CG2 3.17Å; L43-V47 PolarHBondContact O-N 3.45Å
48	R	34.4	Very low	38.8	Very low	224 Å²	224	120.8 Å²	120.8	85%	0.845	68%	0.677	S	S	*	*			trans	-112.3	123.2	152.4	-82.3	-171.5	177	-170.3	-0.3	108.5
49	P	31.3	Very low	37.9	Very low	109 Å²	109	120.7 Å²	120.7	71%	0.708	68%	0.676	S	S	*	*			trans	-80.5	146	-177.9	33.3	-31.6	0	0	0	110.3
50	N	30.3	Very low	37.1	Very low	159 Å²	159	126.9 Å²	126.9	85%	0.85	69%	0.693	S	S	*	*			trans	78.5	100.1	164.1	-54.2	-21.5	0	0	0	117.4
51	A	30.2	Very low	36.2	Very low	94 Å²	94	126.8 Å²	126.8	78%	0.777	70%	0.704	S	S	*	*	S	Bend		-177.8	134.9	98.1	0	0	0	0	0	111.4
52	S	31.5	Very low	35.5	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	71%	0.708	S	S	*	*			trans	91.7	80	166.3	-42.1	0	0	0	0	116.4	V54	S52-V54 PolarHBondContact O-N 2.91Å
53	A	31.5	Very low	35.1	Very low	106 Å²	106	127.3 Å²	127.3	88%	0.876	71%	0.71	S	S	*	*			trans	-67.4	98.7	159.4	0	0	0	0	0	110.4
54	V	31	Very low	34.6	Very low	132 Å²	132	127.4 Å²	127.4	80%	0.8	72%	0.718	S	S	*	*			trans	-144.1	116.1	157.2	-177.6	0	0	0	0	108.3	S52	S52-V54 PolarHBondContact O-N 2.91Å
55	S	31.5	Very low	34	Very low	75 Å²	75	127.3 Å²	127.3	52%	0.524	72%	0.721	S	S	.	*			trans	64.1	70.4	167.8	-157.1	0	0	0	0	118.5
56	I	31.9	Very low	33.8	Very low	160 Å²	160	124.1 Å²	124.1	82%	0.821	71%	0.712	S	S	*	*			trans	-119.5	59.5	158.3	-49.7	177.4	0	0	0	108.4
57	Q	33.7	Very low	33.6	Very low	190 Å²	190	122.5 Å²	122.5	89%	0.888	70%	0.704	S	S	*	*	S	Bend	trans	-136	-3.4	162.4	-84.6	-161.2	-33	0	0	113.8
58	Q	33.5	Very low	33.4	Very low	155 Å²	155	123.1 Å²	123.1	72%	0.724	70%	0.7	S	S	*	*	S	Bend	trans	-101.1	-9.7	176	-94.4	169.7	-26.9	0	0	114.9	T62	Q58-T62 PolarHBondContact O-OG1 3.22Å
59	S	33.5	Very low	33.5	Very low	68 Å²	68	117.8 Å²	117.8	48%	0.476	69%	0.687	S	S	.	*	S	Bend	trans	-95.1	1.2	-175.4	-28.1	0	0	0	0	114.4
60	R	32.7	Very low	33.8	Very low	232 Å²	232	116.9 Å²	116.9	88%	0.875	68%	0.679	S	S	*	*	S	Bend	trans	-99.7	-14.4	-176.8	-129.9	174.8	-176.2	166.1	0.2	114
61	A	34	Very low	34	Very low	83 Å²	83	116.5 Å²	116.5	69%	0.686	67%	0.671	S	S	*	*	S	Bend	trans	-97.4	-19.6	178.9	0	0	0	0	0	113.6
62	T	35.6	Very low	34.3	Very low	103 Å²	103	121.1 Å²	121.1	63%	0.632	67%	0.668	S	S	*	*	S	Bend	trans	-95.5	-15	-177.8	6.5	0	0	0	0	114.3	Q58 T66	Q58-T62 PolarHBondContact O-OG1 3.22Å; T62-T66 PolarHBondContact O-OG1 2.92Å
63	L	33.8	Very low	34.4	Very low	113 Å²	113	125.5 Å²	125.5	59%	0.592	67%	0.666	S	S	*	*	S	Bend	trans	-88.1	-17	174.8	-96.5	137.4	0	0	0	113.5
64	S	34.5	Very low	34.6	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-18.7	179.4	-177	0	0	0	0	114
65	A	37.8	Very low	34.6	Very low	63 Å²	63	127.2 Å²	127.2	52%	0.521	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	-23.4	-175.3	0	0	0	0	0	113.3
66	T	38	Very low	34.5	Very low	81 Å²	81	130.7 Å²	130.7	50%	0.497	67%	0.668	S	S	.	*	H	α-helix	trans	-81.5	-25.9	177.2	35.9	0	0	0	0	113.2	T62 V70	T62-T66 PolarHBondContact O-OG1 2.92Å; T66-V70 WeakPolarHBondContact O-CG2 3.33Å; T66-V70 PolarHBondContact O-N 3.48Å
67	D	35.1	Very low	34.4	Very low	104 Å²	104	132.2 Å²	132.2	56%	0.556	67%	0.669	S	S	*	*	H	α-helix	trans	-77.7	-30.3	178.5	-77.7	-17.9	0	0	0	113.1	F71	D67-F71 PolarHBondContact O-N 3.39Å
68	E	35.7	Very low	34.2	Very low	129 Å²	129	132.4 Å²	132.4	60%	0.603	67%	0.67	S	S	*	*	H	α-helix	trans	-74.9	-31.1	176	-96.8	-158.9	144.2	0	0	113.7	R72	E68-R72 WeakPolarHBondContact O-CB 3.4Å; E68-R72 PolarHBondContact O-N 3.42Å
69	L	37	Very low	33.9	Very low	111 Å²	111	134 Å²	134	58%	0.581	68%	0.678	S	S	*	*	H	α-helix	trans	-78.9	-29.2	-179.7	-98.7	157.9	0	0	0	113.1	R73	L69-R73 PolarHBondContact O-N 3.42Å
70	V	38	Very low	33.6	Very low	90 Å²	90	141.5 Å²	141.5	55%	0.545	70%	0.695	S	S	.	*	H	α-helix	trans	-75.4	-36.4	173	176.5	0	0	0	0	110.7	T66 L74	T66-V70 WeakPolarHBondContact O-CG2 3.33Å; T66-V70 PolarHBondContact O-N 3.48Å; V70-L74 HydrophobicContact CG1-CD1 4.31Å; V70-L74 WeakPolarHBondContact O-CG 3.4Å; V70-L74 PolarHBondContact O-N 2.89Å
71	F	34.2	Very low	33.4	Very low	152 Å²	152	138.3 Å²	138.3	67%	0.667	69%	0.69	S	S	*	*	H	α-helix	trans	-72.3	-34.6	174.2	-97.7	-85.1	0	0	0	113.8	D67	D67-F71 PolarHBondContact O-N 3.39Å
72	R	34.8	Very low	33.2	Very low	190 Å²	190	143.5 Å²	143.5	72%	0.717	70%	0.7	S	S	*	*	H	α-helix	trans	-74.5	-22	177	-85.7	-173.8	171.4	172.5	0.9	114.5	E68	E68-R72 WeakPolarHBondContact O-CB 3.4Å; E68-R72 PolarHBondContact O-N 3.42Å
73	R	35.1	Very low	32.8	Very low	209 Å²	209	146.8 Å²	146.8	79%	0.789	71%	0.708	S	S	*	*	H	α-helix	trans	-84.2	-20.7	174.2	-80	-171.3	-176.5	172.6	3.2	114.3	L69	L69-R73 PolarHBondContact O-N 3.42Å
74	L	34.6	Very low	32.5	Very low	131 Å²	131	150.1 Å²	150.1	69%	0.686	72%	0.718	S	S	*	*	H	α-helix	trans	-83.4	-10.8	177.3	-72.1	168.9	0	0	0	113.8	V70	V70-L74 HydrophobicContact CG1-CD1 4.31Å; V70-L74 WeakPolarHBondContact O-CG 3.4Å; V70-L74 PolarHBondContact O-N 2.89Å
75	N	32.4	Very low	32.5	Very low	144 Å²	144	154.5 Å²	154.5	77%	0.77	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	8	-177.3	-113.3	2.5	0	0	0	115
76	N	29	Very low	32.2	Very low	147 Å²	147	160.1 Å²	160.1	79%	0.786	74%	0.739	S	S	*	*	S	Bend	trans	-127.6	20.8	-173.7	-109	-3.4	0	0	0	115.8
77	K	30	Very low	31.9	Very low	193 Å²	193	161.7 Å²	161.7	84%	0.839	75%	0.749	S	S	*	*	S	Bend	trans	-140.5	89.6	164.2	-98.3	-178.1	176.3	178.9	0	110	E79	K77-E79 PolarHBondContact O-N 3.29Å; K77-E79 VanDerWaalsContact O-N 3.14Å
78	E	27.8	Very low	31.8	Very low	193 Å²	193	162.6 Å²	162.6	90%	0.902	75%	0.754	S	S	*	*			trans	12.3	88.8	130.7	-160	166.3	-148.8	0	0	115.4
79	E	29.2	Very low	31.7	Very low	190 Å²	190	162.3 Å²	162.3	89%	0.888	75%	0.747	S	S	*	*			trans	-164.3	104.1	136.3	-107.4	176.9	-170.5	0	0	108.4	K77	K77-E79 PolarHBondContact O-N 3.29Å; K77-E79 VanDerWaalsContact O-N 3.14Å
80	R	26	Very low	31.5	Very low	224 Å²	224	162.9 Å²	162.9	85%	0.845	75%	0.75	S	S	*	*			trans	-70.5	159.8	176.3	-62.7	179.9	-163.1	164.1	6.1	109.4
81	H	27.8	Very low	31.4	Very low	166 Å²	166	161.8 Å²	161.8	77%	0.769	74%	0.74	S	S	*	*			trans	86.2	86.1	174.3	-50.6	-82.6	0	0	0	114.4
82	H	31.2	Very low	31.5	Very low	192 Å²	192	160.7 Å²	160.7	89%	0.889	74%	0.74	S	S	*	*			trans	172.5	57.1	130.9	-83.4	-57.7	0	0	0	110.1
83	Q	27.5	Very low	31.4	Very low	171 Å²	171	158.1 Å²	158.1	80%	0.799	73%	0.734	S	S	*	*			trans	-106.2	155.8	155.1	-86	-179.5	-16.2	0	0	107.7
84	F	27.4	Very low	31.2	Very low	183 Å²	183	152.3 Å²	152.3	80%	0.803	73%	0.726	S	S	*	*			trans	82.3	90.8	-169.6	-56.2	-79.1	0	0	0	114.3
85	F	33.6	Very low	31.1	Very low	181 Å²	181	153.1 Å²	153.1	79%	0.794	73%	0.73	S	S	*	*			trans	177	49.2	137.8	-82.8	-61.3	0	0	0	108.7
86	F	31.9	Very low	31	Very low	182 Å²	182	151.3 Å²	151.3	80%	0.798	73%	0.729	S	S	*	*			trans	-94.8	-6.6	-171.9	-105	-84.8	0	0	0	114.6
87	T	32.7	Very low	31	Very low	113 Å²	113	153.6 Å²	153.6	69%	0.693	73%	0.732	S	S	*	*	S	Bend	trans	-95.4	-22.3	-167.7	43	0	0	0	0	115.6
88	D	31.3	Very low	30.8	Very low	124 Å²	124	154 Å²	154	66%	0.663	73%	0.734	S	S	*	*	S	Bend	trans	-95.2	-1.9	-172.5	-62.6	-19.7	0	0	0	114.5
89	W	33.8	Very low	30.8	Very low	122 Å²	122	150.1 Å²	150.1	46%	0.462	73%	0.728	S	S	.	*	S	Bend	trans	-103.3	-16.1	-171.1	-117.6	48.7	0	0	0	115.5	I91 F93 V171	W89-I91 VanDerWaalsContact C-N 3.28Å; W89-I91 PolarHBondContact O-N 3.47Å; W89-F93 HydrophobicContact CZ3-CE2 4.39Å; W89-V171 HydrophobicContact CH2-CB 4.43Å; W89-V171 HydrophobicContact CH2-CG2 3.95Å
90	L	33.6	Very low	30.6	Very low	124 Å²	124	147.6 Å²	147.6	65%	0.649	73%	0.726	S	S	*	*	H	α-helix	trans	-71.2	-21.4	179.6	-96.6	154.1	0	0	0	113.4	S94	L90-S94 PolarHBondContact O-OG 3Å
91	I	36	Very low	30.9	Very low	66 Å²	66	142.8 Å²	142.8	34%	0.338	72%	0.721	S	S	.	*	H	α-helix	trans	-77.1	-26.2	-173.4	-61	147.8	0	0	0	112.3	V31 W89	V31-I91 HydrophobicContact CB-CD1 4.28Å; V31-I91 HydrophobicContact CG1-CD1 4Å; V31-I91 HydrophobicContact CG1-CG1 4.41Å; V31-I91 HydrophobicContact CG2-CD1 3.24Å; V31-I91 HydrophobicContact CG2-CG1 4.08Å; W89-I91 VanDerWaalsContact C-N 3.28Å; W89-I91 PolarHBondContact O-N 3.47Å
92	I	35.6	Very low	30.9	Very low	129 Å²	129	139.8 Å²	139.8	66%	0.662	72%	0.716	S	S	*	*	H	α-helix	trans	-85.4	-24.6	179.6	-62	178.9	0	0	0	111.7
93	F	33.6	Very low	30.7	Very low	136 Å²	136	135.8 Å²	135.8	60%	0.596	71%	0.71	S	S	*	*	H	α-helix	trans	-83.8	-21.2	-178.5	-105.6	-89.8	0	0	0	114.4	W89 L95	W89-F93 HydrophobicContact CZ3-CE2 4.39Å; F93-L95 VanDerWaalsContact C-N 3.29Å; F93-L95 PolarHBondContact O-N 3.32Å
94	S	31.3	Very low	30.8	Very low	87 Å²	87	136.1 Å²	136.1	61%	0.608	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-2	-179.8	-61.9	0	0	0	0	114.9	L90	L90-S94 PolarHBondContact O-OG 3Å
95	L	31.3	Very low	30.6	Very low	149 Å²	149	134.5 Å²	134.5	78%	0.78	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	0.6	-177.2	-79.1	160.5	0	0	0	115.1	F93	F93-L95 VanDerWaalsContact C-N 3.29Å; F93-L95 PolarHBondContact O-N 3.32Å
96	S	31	Very low	30.3	Very low	106 Å²	106	133.7 Å²	133.7	74%	0.741	72%	0.719	S	S	*	*	S	Bend	trans	-110.5	9.7	179.3	-68.7	0	0	0	0	116
97	F	28.7	Very low	30.2	Very low	195 Å²	195	130.4 Å²	130.4	86%	0.855	72%	0.716	S	S	*	*			trans	-122.1	81.4	173.7	-93	-89.3	0	0	0	111.2
98	K	25.6	Very low	30.1	Very low	201 Å²	201	132.6 Å²	132.6	87%	0.874	72%	0.722	S	S	*	*			trans	-171.3	86.7	152.9	-106.4	170.6	-171.7	-177.4	0	109.4
99	S	27.1	Very low	29.7	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	73%	0.73	S	S	*	*			trans	-152.6	85	149.9	-168.3	0	0	0	0	108.2
100	T	26.4	Very low	29.5	Very low	137 Å²	137	136.5 Å²	136.5	84%	0.84	75%	0.75	S	S	*	*			trans	-92.4	106	166.3	-20.5	0	0	0	0	105.8
101	V	32.1	Very low	29.2	Very low	123 Å²	123	135.8 Å²	135.8	75%	0.745	75%	0.753	S	S	*	*			trans	-115.8	117	163.8	-176.6	0	0	0	0	107.1
102	P	28.3	Very low	28.6	Very low	103 Å²	103	138.1 Å²	138.1	67%	0.669	77%	0.774	S	S	*	*			trans	-85.4	150.3	171.2	33.9	-28.6	0	0	0	110.5
103	S	26.8	Very low	28	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	78%	0.779	S	S	*	*			trans	63	110.8	159.6	61.2	0	0	0	0	118.6
104	L	28.7	Very low	27.6	Very low	178 Å²	178	138.3 Å²	138.3	93%	0.932	79%	0.79	S	S	*	*			trans	-154.9	121.9	135.4	-102	159.1	0	0	0	109.4
105	N	24.3	Very low	27.4	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	80%	0.803	S	S	*	*			trans	-68.2	135.5	171.1	-70.2	-57.8	0	0	0	110.5
106	L	26.7	Very low	27.2	Very low	165 Å²	165	146.4 Å²	146.4	86%	0.864	81%	0.811	S	S	*	*				-177.5	151.4	121.5	-119.1	81.7	0	0	0	111.1
107	P	29.5	Very low	26.9	Very low	113 Å²	113	150.6 Å²	150.6	73%	0.734	82%	0.816	S	S	*	*			trans	-98.9	136.7	-167.4	36.8	-28.8	0	0	0	112.7
108	I	29.7	Very low	26.7	Very low	158 Å²	158	148.7 Å²	148.7	81%	0.81	81%	0.814	S	S	*	*			trans	-142	102.5	165.7	-56.6	-179.5	0	0	0	109.8
109	L	24.2	Very low	26.7	Very low	160 Å²	160	147.2 Å²	147.2	84%	0.838	82%	0.815	S	S	*	*			trans	31.4	109	138.5	-65.6	158.9	0	0	0	118.8
110	L	30.2	Very low	26.8	Very low	168 Å²	168	146.8 Å²	146.8	88%	0.88	80%	0.804	S	S	*	*			trans	-62.6	146.6	146.1	-80.3	153.5	0	0	0	109.4
111	P	26.4	Very low	26.8	Very low	109 Å²	109	146.3 Å²	146.3	71%	0.708	80%	0.796	S	S	*	*				-146.8	156.3	107.9	34.6	-16.8	0	0	0	116
112	C	23.8	Very low	26.6	Very low	116 Å²	116	148.2 Å²	148.2	78%	0.784	80%	0.801	S	S	*	*			trans	79.2	102.8	147.3	-66.5	0	0	0	0	120.7
113	C	23.4	Very low	26.9	Very low	115 Å²	115	150.8 Å²	150.8	78%	0.777	80%	0.804	S	S	*	*				26.8	130.8	120.5	-65.6	0	0	0	0	120
114	N	23.9	Very low	27.6	Very low	154 Å²	154	149.8 Å²	149.8	82%	0.824	79%	0.787	S	S	*	*			trans	73.3	66.4	148.5	-59.8	-16.6	0	0	0	117.9
115	Q	27.5	Very low	28.8	Very low	187 Å²	187	143.5 Å²	143.5	87%	0.874	75%	0.751	S	S	*	*			trans	-160.9	42.7	155.9	-123.6	164.9	8.4	0	0	116.1	K117	Q115-K117 PolarHBondContact O-N 2.89Å
116	F	27.6	Very low	30.7	Very low	218 Å²	218	139 Å²	139	96%	0.956	73%	0.732	S	S	*	*			trans	-96.3	69.3	165.4	-84.4	-83.4	0	0	0	110.5
117	K	24	Very low	32.9	Very low	194 Å²	194	132.9 Å²	132.9	84%	0.843	70%	0.701	S	S	*	*			trans	-149.1	61.3	173.3	-159	-179.8	-166.1	176.9	0	108.7	Q115	Q115-K117 PolarHBondContact O-N 2.89Å
118	L	24.4	Very low	35.4	Very low	155 Å²	155	133.1 Å²	133.1	81%	0.812	69%	0.691	S	S	*	*			trans	177.7	78.9	169.9	-100.8	155.5	0	0	0	109.5
119	L	26.2	Very low	37.9	Very low	170 Å²	170	127.8 Å²	127.8	89%	0.89	67%	0.665	S	S	*	*			trans	-160.8	43.7	159.9	-113	166.2	0	0	0	110.9
120	N	28.2	Very low	40.9	Very low	103 Å²	103	123 Å²	123	55%	0.551	64%	0.64	S	S	*	*			trans	-121.6	-17.6	-170.1	-132.3	17.1	0	0	0	109.1	L122 H124	N120-L122 PolarHBondContact O-N 3.2Å; N120-L122 VanDerWaalsContact O-N 3.11Å; N120-H124 VanDerWaalsContact C-NE2 3.28Å; N120-H124 WeakPolarHBondContact CA-NE2 3.33Å; N120-H124 WeakPolarHBondContact CB-NE2 3.4Å; N120-H124 PolarHBondContact ND2-NE2 2.98Å; N120-H124 VanDerWaalsContact ND2-NE2 3.18Å; N120-H124 PolarHBondContact O-CD2 3.4Å; N120-H124 PolarHBondContact O-CE1 3.09Å; N120-H124 PolarHBondContact O-ND1 3.22Å; N120-H124 PolarHBondContact O-NE2 3.49Å; N120-H124 PolarHBondContact OD1-CD2 3.06Å
121	D	26.6	Very low	43.6	Very low	127 Å²	127	116.4 Å²	116.4	68%	0.679	61%	0.606	S	S	*	*			trans	-83.6	29.4	-175.3	-76.4	-37.7	0	0	0	118.3	H124	D121-H124 IonicContact OD1-CE1 2.69Å; D121-H124 PolarHBondContact OD1-CE1 2.83Å; D121-H124 IonicContact OD1-ND1 3.07Å; D121-H124 PolarHBondContact OD1-ND1 3.02Å
122	L	27.9	Very low	46.5	Very low	162 Å²	162	115.8 Å²	115.8	85%	0.848	60%	0.597	S	S	*	*	S	Bend	trans	-126.1	100.6	162.6	-92.3	105.3	0	0	0	109.6	N120	N120-L122 PolarHBondContact O-N 3.2Å; N120-L122 VanDerWaalsContact O-N 3.11Å
123	H	35.8	Very low	49.5	Very low	158 Å²	158	115.8 Å²	115.8	73%	0.731	59%	0.585	S	S	*	*	S	Bend	trans	51.3	65.2	-176.8	-66.1	-74.9	0	0	0	113.1	Y125	H123-Y125 HydrophobicContact CB-CE2 4.07Å; H123-Y125 WeakPolarHBondContact O-CD2 3.4Å; H123-Y125 WeakPolarHBondContact O-CE2 3.22Å; H123-Y125 PolarHBondContact O-N 3.47Å
124	H	40	Very low	52.8	Low	87 Å²	87	113.8 Å²	113.8	40%	0.403	57%	0.565	S	S	.	*			trans	-48.3	88.9	178.4	-97	118.3	0	0	0	113.6	N120 D121 S126	N120-H124 VanDerWaalsContact C-NE2 3.28Å; N120-H124 WeakPolarHBondContact CA-NE2 3.33Å; N120-H124 WeakPolarHBondContact CB-NE2 3.4Å; N120-H124 PolarHBondContact ND2-NE2 2.98Å; N120-H124 VanDerWaalsContact ND2-NE2 3.18Å; N120-H124 PolarHBondContact O-CD2 3.4Å; N120-H124 PolarHBondContact O-CE1 3.09Å; N120-H124 PolarHBondContact O-ND1 3.22Å; N120-H124 PolarHBondContact O-NE2 3.49Å; N120-H124 PolarHBondContact OD1-CD2 3.06Å; D121-H124 IonicContact OD1-CE1 2.69Å; D121-H124 PolarHBondContact OD1-CE1 2.83Å; D121-H124 IonicContact OD1-ND1 3.07Å; D121-H124 PolarHBondContact OD1-ND1 3.02Å; H124-S126 VanDerWaalsContact C-N 3.29Å; H124-S126 PolarHBondContact O-N 2.84Å; H124-S126 VanDerWaalsContact O-N 3.16Å
125	Y	54.4	Low	56.1	Low	45 Å²	45	108.1 Å²	108.1	18%	0.176	54%	0.536	C	S	.	.			trans	-79.4	88	157.8	-57.2	-82	0	0	0	106.4	H123 V141 P143 Y183 L229 T231	H123-Y125 HydrophobicContact CB-CE2 4.07Å; H123-Y125 WeakPolarHBondContact O-CD2 3.4Å; H123-Y125 WeakPolarHBondContact O-CE2 3.22Å; H123-Y125 PolarHBondContact O-N 3.47Å; Y125-V141 WeakPolarHBondContact CD1-O 3.41Å; Y125-P143 HydrophobicContact CD1-CG 4.42Å; Y125-P143 HydrophobicContact CE1-CG 4.02Å; Y125-Y183 HydrophobicContact CD1-CD1 4.48Å; Y125-Y183 HydrophobicContact CD1-CE1 4Å; Y125-Y183 HydrophobicContact CE1-CD1 4.14Å; Y125-Y183 AromaticContact CE1-CE1 3.26Å; Y125-Y183 HydrophobicContact CE1-CE1 3.26Å; Y125-Y183 AromaticContact CE1-CZ 3.82Å; Y125-Y183 HydrophobicContact CE2-CE1 4.32Å; Y125-Y183 AromaticContact CZ-CE1 3.47Å; Y125-Y183 VanDerWaalsContact CZ-CE1 3.47Å; Y125-Y183 PolarHBondContact OH-OH 3.04Å; Y125-L229 HydrophobicContact CD2-CD2 4.48Å; Y125-L229 HydrophobicContact CG-CD2 4.03Å; Y125-T231 HydrophobicContact CD2-CG2 3.62Å; Y125-T231 HydrophobicContact CE2-CG2 3.42Å; Y125-T231 VanDerWaalsContact CE2-CG2 3.42Å; Y125-T231 HydrophobicContact CG-CG2 4.37Å
126	S	64.4	Low	59.2	Low	55 Å²	55	99.2 Å²	99.2	39%	0.385	49%	0.494	S	S	.	.			trans	-72.9	132.5	178.4	56	0	0	0	0	110	H124 V141	H124-S126 VanDerWaalsContact C-N 3.29Å; H124-S126 PolarHBondContact O-N 2.84Å; H124-S126 VanDerWaalsContact O-N 3.16Å; S126-V141 PolarHBondContact O-N 3.14Å; S126-V141 VanDerWaalsContact O-N 3.15Å; S126-V141 WeakPolarHBondContact OG-CG2 3.37Å
127	V	73.2	Confident	62.2	Low	36 Å²	36	91.6 Å²	91.6	22%	0.218	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.5	166.8	-176.9	0	0	0	0	106.6	V129 L138 T139 L140 Y185 L229	V127-V129 HydrophobicContact CG1-CG2 4.37Å; V127-L138 HydrophobicContact CG1-CB 4.46Å; V127-T139 CarbonylContact C-O 3.54Å; V127-T139 WeakPolarHBondContact CA-O 3.46Å; V127-L140 HydrophobicContact CG2-CG 4.37Å; V127-Y185 HydrophobicContact CG2-CE2 3.98Å; V127-L229 HydrophobicContact CG2-CB 3.81Å; V127-L229 HydrophobicContact CG2-CD1 4.01Å
128	K	80.8	Confident	65.3	Low	119 Å²	119	82.4 Å²	82.4	52%	0.517	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.8	170.3	-174.9	-177.9	-177.9	-118.6	0	108.7	D130 L138 T139	K128-D130 WeakPolarHBondContact CE-OD1 3.2Å; K128-D130 IonicContact NZ-OD1 3.1Å; K128-D130 PolarHBondContact NZ-OD1 2.99Å; K128-D130 IonicContact NZ-OD2 3.8Å; K128-D130 PolarHBondContact NZ-OD2 3.38Å; K128-L138 CarbonylContact O-C 3.46Å; K128-L138 WeakPolarHBondContact O-CA 3.39Å; K128-T139 PolarHBondContact N-O 3.03Å; K128-T139 PolarHBondContact O-N 3.5Å
129	V	83.8	Confident	68.4	Low	45 Å²	45	75.5 Å²	75.5	27%	0.273	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.5	176.3	-174.3	0	0	0	0	108.1	V127 V136 Q137 L138 L224	V127-V129 HydrophobicContact CG1-CG2 4.37Å; V129-V136 HydrophobicContact CG1-CG1 3.76Å; V129-Q137 CarbonylContact C-O 3.5Å; V129-Q137 WeakPolarHBondContact CA-O 3.4Å; V129-L138 HydrophobicContact CB-CD2 4.31Å; V129-L138 HydrophobicContact CG1-CD2 4.01Å; V129-L138 HydrophobicContact CG2-CD2 3.69Å; V129-L224 HydrophobicContact CG1-CB 4.07Å; V129-L224 HydrophobicContact CG1-CD1 3.79Å; V129-L224 HydrophobicContact CG2-CB 4.34Å
130	D	85.4	Confident	71.3	Confident	59 Å²	59	67.5 Å²	67.5	32%	0.316	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.1	170.3	-65.6	-59.5	0	0	0	107.7	K128 Q137	K128-D130 WeakPolarHBondContact CE-OD1 3.2Å; K128-D130 IonicContact NZ-OD1 3.1Å; K128-D130 PolarHBondContact NZ-OD1 2.99Å; K128-D130 IonicContact NZ-OD2 3.8Å; K128-D130 PolarHBondContact NZ-OD2 3.38Å; D130-Q137 HydrophobicContact CB-CB 4.27Å; D130-Q137 PolarHBondContact N-O 3.3Å; D130-Q137 PolarHBondContact O-N 2.81Å
131	D	87.4	Confident	74.1	Confident	30 Å²	30	64.9 Å²	64.9	16%	0.16	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.8	-174.4	-173	46.4	0	0	0	110.9	V136 K214 S219 W220 Q221	D131-V136 VanDerWaalsContact OD1-CG2 3.27Å; D131-V136 WeakPolarHBondContact OD1-CG2 3.39Å; D131-K214 WeakPolarHBondContact OD1-CE 3.47Å; D131-K214 IonicContact OD1-NZ 2.79Å; D131-K214 PolarHBondContact OD1-NZ 2.71Å; D131-K214 IonicContact OD2-NZ 3.35Å; D131-S219 WeakPolarHBondContact OD2-CA 3.44Å; D131-S219 PolarHBondContact OD2-OG 3.28Å; D131-W220 PolarHBondContact OD2-N 2.84Å; D131-Q221 HydrophobicContact CB-CG 3.78Å; D131-Q221 PolarHBondContact OD2-N 2.81Å
132	D	87.7	Confident	76.9	Confident	97 Å²	97	58.9 Å²	58.9	52%	0.519	30%	0.299	S	S	.	.			trans	-124	164.4	171.7	-180	31.9	0	0	0	109.4	H134 T135 K214	D132-H134 PolarHBondContact O-N 3.36Å; D132-T135 PolarHBondContact N-O 2.78Å; D132-T135 PolarHBondContact O-N 2.89Å; D132-T135 VanDerWaalsContact O-O 3.07Å; D132-K214 PolarHBondContact O-NZ 3.18Å
133	E	87.7	Confident	79.3	Confident	116 Å²	116	54.6 Å²	54.6	54%	0.542	28%	0.281	S	S	.	.	S	Bend	trans	-51.4	-37.8	-174.5	-169.6	174	-174.6	0	0	112.7	P217 E218	E133-P217 HydrophobicContact CG-CB 3.58Å; E133-P217 VanDerWaalsContact O-CA 3.3Å; E133-P217 WeakPolarHBondContact O-CA 2.82Å; E133-E218 PolarHBondContact O-N 2.8Å
134	H	92.4	Very high	81.5	Confident	73 Å²	73	49.7 Å²	49.7	34%	0.338	27%	0.274	S	S	.	.	S	Bend	trans	-109.7	-13.8	-177.6	-62.6	-57	0	0	0	115.7	D132 K214	D132-H134 PolarHBondContact O-N 3.36Å; H134-K214 PolarHBondContact O-N 2.89Å
135	T	93.4	Very high	83.6	Confident	35 Å²	35	45.7 Å²	45.7	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145.9	-171.8	52.7	0	0	0	0	111.8	D132 T211 L212	D132-T135 PolarHBondContact N-O 2.78Å; D132-T135 PolarHBondContact O-N 2.89Å; D132-T135 VanDerWaalsContact O-O 3.07Å; T135-T211 HydrophobicContact CG2-CG2 4.41Å; T135-L212 CarbonylContact C-O 3.5Å; T135-L212 VanDerWaalsContact CA-O 3.29Å; T135-L212 WeakPolarHBondContact CA-O 3.27Å
136	V	91	Very high	85	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.4	166.7	178.3	0	0	0	0	108.7	V129 D131 L138 T211 L212 K214 W220 L224	V129-V136 HydrophobicContact CG1-CG1 3.76Å; D131-V136 VanDerWaalsContact OD1-CG2 3.27Å; D131-V136 WeakPolarHBondContact OD1-CG2 3.39Å; V136-L138 HydrophobicContact CG1-CD2 4.03Å; V136-L138 HydrophobicContact CG1-CG 4.43Å; V136-T211 WeakPolarHBondContact O-CA 3.32Å; V136-L212 HydrophobicContact CB-CB 4.39Å; V136-L212 PolarHBondContact N-O 2.63Å; V136-L212 PolarHBondContact O-N 2.69Å; V136-K214 HydrophobicContact CG2-CD 4.47Å; V136-W220 HydrophobicContact CB-CE3 4.1Å; V136-W220 HydrophobicContact CB-CZ3 4.34Å; V136-W220 HydrophobicContact CG1-CE3 4.44Å; V136-W220 HydrophobicContact CG2-CB 4.31Å; V136-W220 HydrophobicContact CG2-CD2 3.73Å; V136-W220 HydrophobicContact CG2-CE3 3.22Å; V136-W220 HydrophobicContact CG2-CG 4.21Å; V136-W220 HydrophobicContact CG2-CZ3 3.8Å; V136-L224 HydrophobicContact CB-CD1 4.47Å; V136-L224 HydrophobicContact CG1-CD1 3.51Å; V136-L224 HydrophobicContact CG2-CD1 4.37Å
137	Q	91.1	Very high	85.9	Confident	58 Å²	58	53.2 Å²	53.2	27%	0.271	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119	173.3	-173.5	172.5	14.3	0	0	110.1	V129 D130 V210	V129-Q137 CarbonylContact C-O 3.5Å; V129-Q137 WeakPolarHBondContact CA-O 3.4Å; D130-Q137 HydrophobicContact CB-CB 4.27Å; D130-Q137 PolarHBondContact N-O 3.3Å; D130-Q137 PolarHBondContact O-N 2.81Å; Q137-V210 CarbonylContact C-O 3.54Å; Q137-V210 WeakPolarHBondContact CA-O 3.43Å
138	L	88.7	Confident	86	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.3	171.6	-52.5	173.2	0	0	0	108.2	V127 K128 V129 V136 L140 L168 Y185 I187 R209 V210 L212 L224	V127-L138 HydrophobicContact CG1-CB 4.46Å; K128-L138 CarbonylContact O-C 3.46Å; K128-L138 WeakPolarHBondContact O-CA 3.39Å; V129-L138 HydrophobicContact CB-CD2 4.31Å; V129-L138 HydrophobicContact CG1-CD2 4.01Å; V129-L138 HydrophobicContact CG2-CD2 3.69Å; V136-L138 HydrophobicContact CG1-CD2 4.03Å; V136-L138 HydrophobicContact CG1-CG 4.43Å; L138-L140 HydrophobicContact CB-CD1 4.14Å; L138-L168 HydrophobicContact CD1-CD2 3.52Å; L138-Y185 HydrophobicContact CD1-CE1 4.06Å; L138-I187 HydrophobicContact CD1-CD1 4.07Å; L138-R209 CarbonylContact O-C 3.59Å; L138-R209 WeakPolarHBondContact O-CA 3.16Å; L138-V210 HydrophobicContact CB-CB 4.29Å; L138-V210 PolarHBondContact N-O 3.27Å; L138-V210 PolarHBondContact O-N 3.3Å; L138-L212 HydrophobicContact CD1-CD1 4.12Å; L138-L224 HydrophobicContact CD2-CD1 4.34Å
139	T	89.6	Confident	85.4	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	109.5	174.8	-56.2	0	0	0	0	108.6	V127 K128 L207 R209	V127-T139 CarbonylContact C-O 3.54Å; V127-T139 WeakPolarHBondContact CA-O 3.46Å; K128-T139 PolarHBondContact N-O 3.03Å; K128-T139 PolarHBondContact O-N 3.5Å; T139-L207 HydrophobicContact CG2-CD2 4.09Å; T139-R209 HydrophobicContact CG2-CG 4.23Å
140	L	87.7	Confident	84.3	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124	178.4	-63.3	75.6	0	0	0	108.9	V127 L138 L142 L170 Y185 L207 L208 V210 L229	V127-L140 HydrophobicContact CG2-CG 4.37Å; L138-L140 HydrophobicContact CB-CD1 4.14Å; L140-L142 HydrophobicContact CB-CG 4.3Å; L140-L142 PolarHBondContact O-N 3.38Å; L140-L170 HydrophobicContact CD1-CD1 4.35Å; L140-L170 HydrophobicContact CD2-CD1 4.19Å; L140-Y185 HydrophobicContact CD2-CD1 4.29Å; L140-Y185 HydrophobicContact CD2-CG 3.97Å; L140-L207 WeakPolarHBondContact O-CA 3.16Å; L140-L208 HydrophobicContact CB-CB 4.34Å; L140-L208 PolarHBondContact N-O 3.04Å; L140-L208 PolarHBondContact O-N 3.11Å; L140-V210 HydrophobicContact CD1-CG2 4.14Å; L140-L229 HydrophobicContact CB-CD1 4.29Å; L140-L229 HydrophobicContact CD2-CD1 3.28Å; L140-L229 HydrophobicContact CG-CD1 3.84Å
141	V	86.2	Confident	83.1	Confident	48 Å²	48	67.4 Å²	67.4	29%	0.291	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	117.6	170.9	-176.7	0	0	0	0	109.4	Y125 S126 P143 L207	Y125-V141 WeakPolarHBondContact CD1-O 3.41Å; S126-V141 PolarHBondContact O-N 3.14Å; S126-V141 VanDerWaalsContact O-N 3.15Å; S126-V141 WeakPolarHBondContact OG-CG2 3.37Å; V141-P143 WeakPolarHBondContact O-CD 3.37Å; V141-L207 HydrophobicContact CB-CD2 4.36Å; V141-L207 HydrophobicContact CG2-CD2 3.86Å
142	L	85.2	Confident	81.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.38	C	S	.	.			trans	-124.8	87	-176.3	-63.6	177.1	0	0	0	110.3	L140 G144 A145 V172 Y183 G206 L208	L140-L142 HydrophobicContact CB-CG 4.3Å; L140-L142 PolarHBondContact O-N 3.38Å; L142-G144 PolarHBondContact O-N 3.34Å; L142-A145 HydrophobicContact CB-CB 3.81Å; L142-A145 WeakPolarHBondContact O-CB 3.46Å; L142-A145 PolarHBondContact O-N 3.31Å; L142-V172 HydrophobicContact CD1-CB 4.09Å; L142-V172 HydrophobicContact CD1-CG1 3.83Å; L142-V172 HydrophobicContact CD1-CG2 3.87Å; L142-Y183 HydrophobicContact CD2-CD1 4.18Å; L142-Y183 HydrophobicContact CD2-CD2 4.11Å; L142-Y183 HydrophobicContact CD2-CG 3.87Å; L142-G206 CarbonylContact C-O 3.55Å; L142-G206 PolarHBondContact N-O 3.04Å; L142-G206 CarbonylContact O-C 3.54Å; L142-G206 WeakPolarHBondContact O-CA 3.21Å; L142-L208 HydrophobicContact CD1-CB 3.58Å; L142-L208 HydrophobicContact CD1-CD2 4.19Å; L142-L208 HydrophobicContact CG-CB 4.49Å
143	P	80.3	Confident	79.7	Confident	72 Å²	72	72.9 Å²	72.9	47%	0.468	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	126.5	178.3	-26.3	32.6	0	0	0	112.8	Y125 V141 A145	Y125-P143 HydrophobicContact CD1-CG 4.42Å; Y125-P143 HydrophobicContact CE1-CG 4.02Å; V141-P143 WeakPolarHBondContact O-CD 3.37Å; P143-A145 VanDerWaalsContact C-N 3.25Å; P143-A145 PolarHBondContact O-N 3.32Å
144	G	81.3	Confident	78.2	Confident	56 Å²	56	77.3 Å²	77.3	58%	0.577	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-0.1	178.6	0	0	0	0	0	115	L142 K146 V174	L142-G144 PolarHBondContact O-N 3.34Å; G144-K146 PolarHBondContact O-N 3.39Å; G144-V174 VanDerWaalsContact O-CG1 3.27Å; G144-V174 WeakPolarHBondContact O-CG1 3.33Å
145	A	84.7	Confident	76.7	Confident	3 Å²	3	78.7 Å²	78.7	3%	0.025	41%	0.414	C	S	.	.			trans	-63.9	134.1	170.1	0	0	0	0	0	110.4	L142 P143 T157 V174 L203 G206	L142-A145 HydrophobicContact CB-CB 3.81Å; L142-A145 WeakPolarHBondContact O-CB 3.46Å; L142-A145 PolarHBondContact O-N 3.31Å; P143-A145 VanDerWaalsContact C-N 3.25Å; P143-A145 PolarHBondContact O-N 3.32Å; A145-T157 WeakPolarHBondContact CA-OG1 3.39Å; A145-T157 HydrophobicContact CB-CG2 4.21Å; A145-V174 HydrophobicContact CB-CG2 4.07Å; A145-L203 HydrophobicContact CB-CD1 4.31Å; A145-G206 PolarHBondContact O-N 2.86Å
146	K	83.6	Confident	75.8	Confident	129 Å²	129	78.8 Å²	78.8	56%	0.561	42%	0.416	S	S	*	.			trans	-126.7	136.2	176.8	-65.4	-162.8	176.5	-160.5	0	110.6	G144 T157 D205	G144-K146 PolarHBondContact O-N 3.39Å; K146-T157 PolarHBondContact N-OG1 2.85Å; K146-T157 PolarHBondContact O-N 2.92Å; K146-T157 PolarHBondContact O-OG1 3.26Å; K146-D205 WeakPolarHBondContact CA-OD1 3.27Å
147	K	82.9	Confident	75.5	Confident	128 Å²	128	79 Å²	79	56%	0.557	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-60.6	132.8	172.7	-172.3	176.9	179.1	178.8	0	109.2	T149 D205	K147-T149 PolarHBondContact O-N 3.22Å; K147-T149 VanDerWaalsContact O-N 3.15Å; K147-D205 PolarHBondContact N-OD1 2.81Å
148	P	75	Confident	75.4	Confident	71 Å²	71	82.5 Å²	82.5	46%	0.461	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-58	122.3	172.3	18.3	-26.5	0	0	0	109.2
149	T	68.6	Low	75.4	Confident	94 Å²	94	83.5 Å²	83.5	58%	0.577	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-87.2	143.5	174.2	31.6	0	0	0	0	109.1	K147 F151	K147-T149 PolarHBondContact O-N 3.22Å; K147-T149 VanDerWaalsContact O-N 3.15Å; T149-F151 PolarHBondContact O-N 3.15Å
150	F	61.2	Low	75.5	Confident	206 Å²	206	88.2 Å²	88.2	90%	0.904	46%	0.457	S	S	*	.	S	Bend	trans	-56.9	-22.5	-176.4	-79.4	-87.6	0	0	0	114	G152	F150-G152 PolarHBondContact O-N 2.85Å
151	F	59.2	Low	75.7	Confident	186 Å²	186	89.6 Å²	89.6	82%	0.816	47%	0.468	S	S	*	.	S	Bend	trans	-94.6	64.7	178.3	-66.4	-82.2	0	0	0	112.1	T149 L153	T149-F151 PolarHBondContact O-N 3.15Å; F151-L153 VanDerWaalsContact C-N 3.25Å; F151-L153 PolarHBondContact O-N 2.98Å
152	G	49.8	Very low	76	Confident	76 Å²	76	91.6 Å²	91.6	78%	0.784	48%	0.478	S	S	*	.	S	Bend	trans	38.2	-4.3	146.4	0	0	0	0	0	124.6	F150	F150-G152 PolarHBondContact O-N 2.85Å
153	L	53.2	Low	76.4	Confident	167 Å²	167	93.1 Å²	93.1	87%	0.874	48%	0.484	S	S	*	.			trans	-129.5	1.8	-161	-86.4	151.7	0	0	0	115.5	F151	F151-L153 VanDerWaalsContact C-N 3.25Å; F151-L153 PolarHBondContact O-N 2.98Å
154	R	57.1	Low	77	Confident	209 Å²	209	90.1 Å²	90.1	79%	0.789	47%	0.466	S	S	*	.	S	Bend	trans	-122.6	119.2	-179.8	-79.7	-178.4	176.6	179.4	0.3	112.2	S156	R154-S156 PolarHBondContact O-N 2.77Å
155	K	60.3	Low	77.5	Confident	102 Å²	102	92 Å²	92	44%	0.443	46%	0.463	S	S	.	.			trans	10.1	78.9	149.5	-75.8	178.5	-173.2	-74.1	0	113.2	N175 S176 K177	K155-N175 VanDerWaalsContact CB-O 3.3Å; K155-N175 WeakPolarHBondContact CB-O 3.22Å; K155-S176 PolarHBondContact NZ-O 2.88Å; K155-K177 HydrophobicContact CD-CB 4.43Å; K155-K177 HydrophobicContact CD-CD 4.37Å; K155-K177 HydrophobicContact CD-CG 3.72Å; K155-K177 VanDerWaalsContact CE-CA 3.45Å; K155-K177 VanDerWaalsContact CE-CG 3.46Å
156	S	74.5	Confident	77.7	Confident	36 Å²	36	94.3 Å²	94.3	25%	0.252	48%	0.479	S	S	.	.			trans	-91.3	141.1	-178.8	109.8	0	0	0	0	109.6	R154 N175	R154-S156 PolarHBondContact O-N 2.77Å; S156-N175 PolarHBondContact O-ND2 3.35Å
157	T	86.1	Confident	77.9	Confident	6 Å²	6	91.1 Å²	91.1	4%	0.037	47%	0.465	C	S	.	.			trans	-67.9	136.4	161.4	-62.5	0	0	0	0	108.5	A145 K146 V159 V172 R173 V174 L203	A145-T157 WeakPolarHBondContact CA-OG1 3.39Å; A145-T157 HydrophobicContact CB-CG2 4.21Å; K146-T157 PolarHBondContact N-OG1 2.85Å; K146-T157 PolarHBondContact O-N 2.92Å; K146-T157 PolarHBondContact O-OG1 3.26Å; T157-V159 HydrophobicContact CG2-CG2 4.18Å; T157-V172 HydrophobicContact CG2-CG1 3.33Å; T157-R173 CarbonylContact C-O 3.54Å; T157-R173 WeakPolarHBondContact CA-O 3.46Å; T157-V174 HydrophobicContact CG2-CG2 4.06Å; T157-L203 HydrophobicContact CG2-CD1 4.08Å; T157-L203 HydrophobicContact CG2-CD2 3.91Å
158	K	87.6	Confident	78.2	Confident	131 Å²	131	85 Å²	85	57%	0.57	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	128	172.1	-64.9	-174.6	178.1	-175.8	0	108.3	V172 R173	K158-V172 CarbonylContact O-C 3.58Å; K158-V172 WeakPolarHBondContact O-CA 3.47Å; K158-R173 HydrophobicContact CB-CB 4.47Å; K158-R173 PolarHBondContact N-O 3.12Å; K158-R173 PolarHBondContact O-N 2.81Å
159	V	89.6	Confident	78.9	Confident	20 Å²	20	83.7 Å²	83.7	12%	0.121	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.4	177.1	-179.4	0	0	0	0	107.9	T157 V172 Y201 L203 L208	T157-V159 HydrophobicContact CG2-CG2 4.18Å; V159-V172 HydrophobicContact CG1-CG2 4.27Å; V159-V172 HydrophobicContact CG2-CG1 3.93Å; V159-V172 HydrophobicContact CG2-CG2 4.21Å; V159-Y201 HydrophobicContact CB-CD2 4.22Å; V159-Y201 HydrophobicContact CB-CE2 3.76Å; V159-Y201 HydrophobicContact CG1-CD2 3.77Å; V159-Y201 HydrophobicContact CG1-CE2 3.72Å; V159-Y201 HydrophobicContact CG1-CG 4.32Å; V159-L203 HydrophobicContact CG2-CD1 4.09Å; V159-L203 HydrophobicContact CG2-CD2 4.34Å; V159-L208 HydrophobicContact CG1-CD1 4.14Å; V159-L208 HydrophobicContact CG1-CD2 3.93Å; V159-L208 HydrophobicContact CG2-CD1 4.18Å; V159-L208 HydrophobicContact CG2-CD2 4.41Å
160	K	90.6	Very high	79.9	Confident	111 Å²	111	79.3 Å²	79.3	48%	0.483	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.7	165.4	-71.9	-173	175.6	-174.3	0	107.7	L170 V171	K160-L170 WeakPolarHBondContact O-CA 3.49Å; K160-V171 PolarHBondContact N-O 2.9Å; K160-V171 PolarHBondContact O-N 2.81Å
161	A	92.3	Very high	81.2	Confident	30 Å²	30	71 Å²	71	25%	0.248	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.7	176	0	0	0	0	0	109.3	F163 H169 L170 Y201	A161-F163 HydrophobicContact CB-CE2 3.74Å; A161-F163 HydrophobicContact CB-CZ 3.75Å; A161-H169 WeakPolarHBondContact CA-O 3.5Å; A161-L170 HydrophobicContact CB-CD2 3.42Å; A161-L170 VanDerWaalsContact CB-CD2 3.42Å; A161-Y201 HydrophobicContact CB-CD1 3.52Å; A161-Y201 HydrophobicContact CB-CE1 3.85Å; A161-Y201 HydrophobicContact CB-CG 4.31Å
162	N	93.4	Very high	82.6	Confident	91 Å²	91	62.3 Å²	62.3	49%	0.487	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.2	170.7	-174.7	21	0	0	0	108.3	H169	N162-H169 HydrophobicContact CB-CB 4.32Å; N162-H169 PolarHBondContact N-O 3.27Å; N162-H169 PolarHBondContact O-N 2.76Å
163	F	93.3	Very high	84.4	Confident	32 Å²	32	64.2 Å²	64.2	14%	0.14	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122	178.7	-55	-75.9	0	0	0	107.6	A161 L168 I194 P196 C199 V210 L212	A161-F163 HydrophobicContact CB-CE2 3.74Å; A161-F163 HydrophobicContact CB-CZ 3.75Å; F163-L168 HydrophobicContact CD1-CD1 3.48Å; F163-L168 VanDerWaalsContact CD1-CD1 3.48Å; F163-L168 HydrophobicContact CE1-CD1 3.4Å; F163-L168 VanDerWaalsContact CE1-CD1 3.4Å; F163-L168 HydrophobicContact CZ-CD1 4.46Å; F163-I194 HydrophobicContact CB-CD1 4.43Å; F163-P196 HydrophobicContact CB-CB 3.83Å; F163-P196 WeakPolarHBondContact O-CB 3.16Å; F163-C199 HydrophobicContact CB-CB 4.16Å; F163-C199 HydrophobicContact CD1-CB 3.57Å; F163-C199 HydrophobicContact CD2-CB 3.75Å; F163-C199 HydrophobicContact CE1-CB 3.8Å; F163-C199 HydrophobicContact CE2-CB 3.97Å; F163-C199 HydrophobicContact CG-CB 3.55Å; F163-C199 HydrophobicContact CZ-CB 3.99Å; F163-V210 HydrophobicContact CE1-CG1 3.74Å; F163-V210 HydrophobicContact CZ-CG1 4.17Å; F163-L212 HydrophobicContact CD1-CD2 3.71Å; F163-L212 HydrophobicContact CE1-CD2 3.68Å
164	G	92.3	Very high	86	Confident	8 Å²	8	56.5 Å²	56.5	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	168.3	167.1	0	0	0	0	0	110.3	S166 F167 I194	G164-S166 PolarHBondContact O-N 2.95Å; G164-F167 PolarHBondContact N-O 3.37Å; G164-F167 PolarHBondContact O-N 3.2Å; G164-I194 WeakPolarHBondContact O-CD1 3.29Å; G164-I194 WeakPolarHBondContact O-CG1 3.33Å
165	D	91.9	Very high	87.1	Confident	95 Å²	95	48.3 Å²	48.3	51%	0.508	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.9	-178.8	-67	-9.7	0	0	0	112.7	K193 I194 P196	D165-K193 CarbonylContact O-C 3.53Å; D165-K193 WeakPolarHBondContact O-CA 3.22Å; D165-I194 WeakPolarHBondContact O-CG1 3Å; D165-I194 PolarHBondContact O-N 2.79Å; D165-P196 WeakPolarHBondContact OD1-CD 3.29Å; D165-P196 WeakPolarHBondContact OD1-CG 3.41Å
166	S	89	Confident	87.8	Confident	53 Å²	53	46.3 Å²	46.3	37%	0.371	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	15.4	-178	66.9	0	0	0	0	113.7	G164 K189 L190	G164-S166 PolarHBondContact O-N 2.95Å; S166-K189 CarbonylContact O-C 3.55Å; S166-K189 VanDerWaalsContact O-CA 3.32Å; S166-K189 WeakPolarHBondContact O-CA 3.37Å; S166-L190 PolarHBondContact O-N 2.8Å
167	F	88.2	Confident	87.7	Confident	61 Å²	61	53.1 Å²	53.1	27%	0.268	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	159.2	-178.9	70.1	-104.1	0	0	0	112.1	G164 H169 I187	G164-F167 PolarHBondContact N-O 3.37Å; G164-F167 PolarHBondContact O-N 3.2Å; F167-H169 AromaticContact CD2-CD2 3.24Å; F167-H169 WeakPolarHBondContact CD2-CD2 3.31Å; F167-H169 AromaticContact CD2-NE2 3.58Å; F167-H169 AromaticContact CE2-CD2 3.47Å; F167-H169 VanDerWaalsContact CE2-CD2 3.47Å; F167-H169 WeakPolarHBondContact CE2-CD2 3.09Å; F167-H169 AromaticContact CE2-NE2 4Å; F167-I187 CarbonylContact C-O 3.6Å; F167-I187 WeakPolarHBondContact CA-O 3.47Å; F167-I187 VanDerWaalsContact CB-O 3.29Å; F167-I187 WeakPolarHBondContact CB-O 3.49Å
168	L	89.4	Confident	87.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	130.5	172.8	171.3	63.7	0	0	0	109.1	L138 F163 L170 Y185 T186 I187 V210 L212	L138-L168 HydrophobicContact CD1-CD2 3.52Å; F163-L168 HydrophobicContact CD1-CD1 3.48Å; F163-L168 VanDerWaalsContact CD1-CD1 3.48Å; F163-L168 HydrophobicContact CE1-CD1 3.4Å; F163-L168 VanDerWaalsContact CE1-CD1 3.4Å; F163-L168 HydrophobicContact CZ-CD1 4.46Å; L168-L170 HydrophobicContact CD1-CD1 4.19Å; L168-L170 HydrophobicContact CD1-CD2 4.31Å; L168-L170 HydrophobicContact CD1-CG 3.87Å; L168-L170 HydrophobicContact CD2-CD1 3.97Å; L168-L170 HydrophobicContact CD2-CG 4.46Å; L168-L170 HydrophobicContact CG-CD1 4.22Å; L168-L170 HydrophobicContact CG-CG 4.17Å; L168-Y185 HydrophobicContact CD2-CD1 4.16Å; L168-Y185 HydrophobicContact CD2-CE1 4.1Å; L168-T186 CarbonylContact O-C 3.46Å; L168-T186 VanDerWaalsContact O-CA 3.3Å; L168-T186 WeakPolarHBondContact O-CA 3.24Å; L168-I187 HydrophobicContact CB-CB 4.22Å; L168-I187 HydrophobicContact CB-CG1 4.38Å; L168-I187 HydrophobicContact CD2-CD1 4.16Å; L168-I187 HydrophobicContact CD2-CG1 4.48Å; L168-I187 PolarHBondContact N-O 3.07Å; L168-I187 PolarHBondContact O-N 2.92Å; L168-V210 HydrophobicContact CD1-CG1 4.36Å; L168-V210 HydrophobicContact CD2-CG1 4.28Å; L168-L212 HydrophobicContact CD1-CD2 4.37Å; L168-L212 HydrophobicContact CD2-CD1 4.45Å; L168-L212 HydrophobicContact CD2-CD2 4.41Å
169	H	89	Confident	86.5	Confident	44 Å²	44	62.8 Å²	62.8	20%	0.204	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.3	166.2	-62.5	-80.3	0	0	0	110.2	A161 N162 F167 T186	A161-H169 WeakPolarHBondContact CA-O 3.5Å; N162-H169 HydrophobicContact CB-CB 4.32Å; N162-H169 PolarHBondContact N-O 3.27Å; N162-H169 PolarHBondContact O-N 2.76Å; F167-H169 AromaticContact CD2-CD2 3.24Å; F167-H169 WeakPolarHBondContact CD2-CD2 3.31Å; F167-H169 AromaticContact CD2-NE2 3.58Å; F167-H169 AromaticContact CE2-CD2 3.47Å; F167-H169 VanDerWaalsContact CE2-CD2 3.47Å; F167-H169 WeakPolarHBondContact CE2-CD2 3.09Å; F167-H169 AromaticContact CE2-NE2 4Å; H169-T186 WeakPolarHBondContact CE1-CG2 3.36Å; H169-T186 WeakPolarHBondContact ND1-CG2 3.49Å; H169-T186 PolarHBondContact ND1-OG1 3.32Å
170	L	89.7	Confident	86.2	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.2	174.9	-67.6	164.2	0	0	0	108.7	L140 K160 A161 L168 A184 Y185 L208 V210	L140-L170 HydrophobicContact CD1-CD1 4.35Å; L140-L170 HydrophobicContact CD2-CD1 4.19Å; K160-L170 WeakPolarHBondContact O-CA 3.49Å; A161-L170 HydrophobicContact CB-CD2 3.42Å; A161-L170 VanDerWaalsContact CB-CD2 3.42Å; L168-L170 HydrophobicContact CD1-CD1 4.19Å; L168-L170 HydrophobicContact CD1-CD2 4.31Å; L168-L170 HydrophobicContact CD1-CG 3.87Å; L168-L170 HydrophobicContact CD2-CD1 3.97Å; L168-L170 HydrophobicContact CD2-CG 4.46Å; L168-L170 HydrophobicContact CG-CD1 4.22Å; L168-L170 HydrophobicContact CG-CG 4.17Å; L170-A184 CarbonylContact O-C 3.56Å; L170-A184 WeakPolarHBondContact O-CA 3.42Å; L170-Y185 HydrophobicContact CD1-CD1 4.01Å; L170-Y185 PolarHBondContact N-O 3.19Å; L170-Y185 PolarHBondContact O-N 2.78Å; L170-L208 HydrophobicContact CD2-CD2 4.46Å; L170-V210 HydrophobicContact CD1-CB 4.38Å; L170-V210 HydrophobicContact CD1-CG1 4.39Å; L170-V210 HydrophobicContact CD1-CG2 3.46Å; L170-V210 VanDerWaalsContact CD1-CG2 3.46Å; L170-V210 HydrophobicContact CD2-CG2 4.02Å; L170-V210 HydrophobicContact CG-CG2 4.4Å
171	V	87.8	Confident	85.9	Confident	32 Å²	32	64.6 Å²	64.6	19%	0.194	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.5	168.6	178.6	0	0	0	0	108.3	W89 K160 M182 Y183	W89-V171 HydrophobicContact CH2-CB 4.43Å; W89-V171 HydrophobicContact CH2-CG2 3.95Å; K160-V171 PolarHBondContact N-O 2.9Å; K160-V171 PolarHBondContact O-N 2.81Å; V171-M182 HydrophobicContact CG1-CG 4.03Å; V171-M182 HydrophobicContact CG1-SD 3.98Å; V171-Y183 CarbonylContact C-O 3.56Å; V171-Y183 WeakPolarHBondContact CA-O 3.33Å
172	V	88.8	Confident	85.5	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.8	-179	-170.1	0	0	0	0	109.5	L142 T157 K158 V159 V174 M182 Y183 L208	L142-V172 HydrophobicContact CD1-CB 4.09Å; L142-V172 HydrophobicContact CD1-CG1 3.83Å; L142-V172 HydrophobicContact CD1-CG2 3.87Å; T157-V172 HydrophobicContact CG2-CG1 3.33Å; K158-V172 CarbonylContact O-C 3.58Å; K158-V172 WeakPolarHBondContact O-CA 3.47Å; V159-V172 HydrophobicContact CG1-CG2 4.27Å; V159-V172 HydrophobicContact CG2-CG1 3.93Å; V159-V172 HydrophobicContact CG2-CG2 4.21Å; V172-V174 HydrophobicContact CG1-CG2 4.22Å; V172-M182 CarbonylContact O-C 3.58Å; V172-M182 WeakPolarHBondContact O-CA 3.33Å; V172-Y183 PolarHBondContact N-O 2.79Å; V172-Y183 PolarHBondContact O-N 2.78Å; V172-L208 HydrophobicContact CG2-CD2 3.56Å
173	R	87.5	Confident	85.1	Confident	116 Å²	116	63.1 Å²	63.1	44%	0.438	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.8	173.3	-178.4	177	172.1	163.6	6	109.1	T157 K158 N175 K181	T157-R173 CarbonylContact C-O 3.54Å; T157-R173 WeakPolarHBondContact CA-O 3.46Å; K158-R173 HydrophobicContact CB-CB 4.47Å; K158-R173 PolarHBondContact N-O 3.12Å; K158-R173 PolarHBondContact O-N 2.81Å; R173-N175 PolarHBondContact NE-OD1 3.15Å; R173-K181 CarbonylContact C-O 3.53Å; R173-K181 WeakPolarHBondContact CA-O 3.48Å
174	V	87.2	Confident	84.7	Confident	6 Å²	6	63 Å²	63	4%	0.036	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	106.3	174.7	179.6	0	0	0	0	108.3	G144 A145 T157 V172 S176 P180 K181 Y183	G144-V174 VanDerWaalsContact O-CG1 3.27Å; G144-V174 WeakPolarHBondContact O-CG1 3.33Å; A145-V174 HydrophobicContact CB-CG2 4.07Å; T157-V174 HydrophobicContact CG2-CG2 4.06Å; V172-V174 HydrophobicContact CG1-CG2 4.22Å; V174-S176 PolarHBondContact O-N 3.48Å; V174-P180 WeakPolarHBondContact O-CA 3.37Å; V174-K181 PolarHBondContact N-O 2.84Å; V174-K181 PolarHBondContact O-N 2.84Å; V174-Y183 HydrophobicContact CB-CE2 4.19Å; V174-Y183 HydrophobicContact CG2-CD2 3.94Å; V174-Y183 HydrophobicContact CG2-CE2 3.68Å
175	N	81.2	Confident	84.3	Confident	36 Å²	36	62.8 Å²	62.8	19%	0.193	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	94.9	-179.9	-66.2	-52.2	0	0	0	110.5	K155 S156 R173	K155-N175 VanDerWaalsContact CB-O 3.3Å; K155-N175 WeakPolarHBondContact CB-O 3.22Å; S156-N175 PolarHBondContact O-ND2 3.35Å; R173-N175 PolarHBondContact NE-OD1 3.15Å
176	S	75.2	Confident	83.9	Confident	61 Å²	61	60.5 Å²	60.5	43%	0.427	30%	0.3	S	S	.	.			trans	-82.8	171.1	175.5	-165.5	0	0	0	0	113.1	K155 V174 E179	K155-S176 PolarHBondContact NZ-O 2.88Å; V174-S176 PolarHBondContact O-N 3.48Å; S176-E179 WeakPolarHBondContact CB-O 3.4Å
177	K	71	Confident	83.7	Confident	179 Å²	179	58.1 Å²	58.1	78%	0.778	28%	0.283	S	S	*	.	S	Bend	trans	-63.9	-44.2	169.8	-64	-119.7	-176.8	157.6	0	112	K155	K155-K177 HydrophobicContact CD-CB 4.43Å; K155-K177 HydrophobicContact CD-CD 4.37Å; K155-K177 HydrophobicContact CD-CG 3.72Å; K155-K177 VanDerWaalsContact CE-CA 3.45Å; K155-K177 VanDerWaalsContact CE-CG 3.46Å
178	K	73.9	Confident	83.4	Confident	198 Å²	198	62.2 Å²	62.2	86%	0.861	30%	0.302	S	S	*	.	S	Bend	trans	-81.3	-64	-174.6	-62	-174.9	177.1	-173.9	0	109.8
179	E	75.2	Confident	83.1	Confident	141 Å²	141	70.9 Å²	70.9	66%	0.659	34%	0.34	S	S	*	.			trans	-143.7	136.2	-177.4	-70.9	173.9	169.3	0	0	111.4	S176 K181	S176-E179 WeakPolarHBondContact CB-O 3.4Å; E179-K181 PolarHBondContact O-N 3.43Å
180	P	82.2	Confident	83	Confident	58 Å²	58	69 Å²	69	38%	0.377	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	128.1	172	29.2	-31.4	0	0	0	110.1	V174	V174-P180 WeakPolarHBondContact O-CA 3.37Å
181	K	84.6	Confident	82.7	Confident	112 Å²	112	71.1 Å²	71.1	49%	0.487	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.9	173.7	-64.5	-169.7	176.2	-166.5	0	110.2	R173 V174 E179 Y183	R173-K181 CarbonylContact C-O 3.53Å; R173-K181 WeakPolarHBondContact CA-O 3.48Å; V174-K181 PolarHBondContact N-O 2.84Å; V174-K181 PolarHBondContact O-N 2.84Å; E179-K181 PolarHBondContact O-N 3.43Å; K181-Y183 HydrophobicContact CB-CE2 3.81Å; K181-Y183 WeakPolarHBondContact CD-OH 3.21Å
182	M	85.1	Confident	82.7	Confident	83 Å²	83	71 Å²	71	41%	0.409	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.1	173.1	-167.3	178	-67.7	0	0	109.5	V171 V172	V171-M182 HydrophobicContact CG1-CG 4.03Å; V171-M182 HydrophobicContact CG1-SD 3.98Å; V172-M182 CarbonylContact O-C 3.58Å; V172-M182 WeakPolarHBondContact O-CA 3.33Å
183	Y	84.5	Confident	82.8	Confident	7 Å²	7	77.4 Å²	77.4	3%	0.027	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.8	176.5	-59.9	-81.3	0	0	0	107.9	Y125 L142 V171 V172 V174 K181 T231	Y125-Y183 HydrophobicContact CD1-CD1 4.48Å; Y125-Y183 HydrophobicContact CD1-CE1 4Å; Y125-Y183 HydrophobicContact CE1-CD1 4.14Å; Y125-Y183 AromaticContact CE1-CE1 3.26Å; Y125-Y183 HydrophobicContact CE1-CE1 3.26Å; Y125-Y183 AromaticContact CE1-CZ 3.82Å; Y125-Y183 HydrophobicContact CE2-CE1 4.32Å; Y125-Y183 AromaticContact CZ-CE1 3.47Å; Y125-Y183 VanDerWaalsContact CZ-CE1 3.47Å; Y125-Y183 PolarHBondContact OH-OH 3.04Å; L142-Y183 HydrophobicContact CD2-CD1 4.18Å; L142-Y183 HydrophobicContact CD2-CD2 4.11Å; L142-Y183 HydrophobicContact CD2-CG 3.87Å; V171-Y183 CarbonylContact C-O 3.56Å; V171-Y183 WeakPolarHBondContact CA-O 3.33Å; V172-Y183 PolarHBondContact N-O 2.79Å; V172-Y183 PolarHBondContact O-N 2.78Å; V174-Y183 HydrophobicContact CB-CE2 4.19Å; V174-Y183 HydrophobicContact CG2-CD2 3.94Å; V174-Y183 HydrophobicContact CG2-CE2 3.68Å; K181-Y183 HydrophobicContact CB-CE2 3.81Å; K181-Y183 WeakPolarHBondContact CD-OH 3.21Å; Y183-T231 HydrophobicContact CD1-CG2 3.79Å; Y183-T231 HydrophobicContact CE1-CG2 4Å
184	A	85	Confident	83.2	Confident	28 Å²	28	72 Å²	72	23%	0.231	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.4	171.5	0	0	0	0	0	108.2	L170	L170-A184 CarbonylContact O-C 3.56Å; L170-A184 WeakPolarHBondContact O-CA 3.42Å
185	Y	83.9	Confident	83.6	Confident	4 Å²	4	75 Å²	75	2%	0.016	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	117.8	171.3	-177	-101.8	0	0	0	108.2	V127 L138 L140 L168 L170 I187 V227 G228 L229	V127-Y185 HydrophobicContact CG2-CE2 3.98Å; L138-Y185 HydrophobicContact CD1-CE1 4.06Å; L140-Y185 HydrophobicContact CD2-CD1 4.29Å; L140-Y185 HydrophobicContact CD2-CG 3.97Å; L168-Y185 HydrophobicContact CD2-CD1 4.16Å; L168-Y185 HydrophobicContact CD2-CE1 4.1Å; L170-Y185 HydrophobicContact CD1-CD1 4.01Å; L170-Y185 PolarHBondContact N-O 3.19Å; L170-Y185 PolarHBondContact O-N 2.78Å; Y185-I187 HydrophobicContact CD1-CG1 4.43Å; Y185-I187 HydrophobicContact CE1-CD1 3.74Å; Y185-I187 HydrophobicContact CE1-CG1 3.67Å; Y185-V227 PolarHBondContact OH-O 2.94Å; Y185-G228 WeakPolarHBondContact CE2-O 3.42Å; Y185-L229 HydrophobicContact CD2-CB 3.71Å; Y185-L229 HydrophobicContact CD2-CD1 3.42Å; Y185-L229 VanDerWaalsContact CD2-CD1 3.42Å; Y185-L229 HydrophobicContact CD2-CG 3.64Å; Y185-L229 HydrophobicContact CE2-CB 4.03Å; Y185-L229 HydrophobicContact CE2-CD1 4.23Å; Y185-L229 HydrophobicContact CE2-CG 4.43Å; Y185-L229 HydrophobicContact CG-CD1 3.85Å; Y185-L229 HydrophobicContact CG-CG 4.39Å
186	T	83.8	Confident	84.2	Confident	48 Å²	48	74.8 Å²	74.8	29%	0.294	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.5	-174.8	-70.4	0	0	0	0	109.8	L168 H169 H188	L168-T186 CarbonylContact O-C 3.46Å; L168-T186 VanDerWaalsContact O-CA 3.3Å; L168-T186 WeakPolarHBondContact O-CA 3.24Å; H169-T186 WeakPolarHBondContact CE1-CG2 3.36Å; H169-T186 WeakPolarHBondContact ND1-CG2 3.49Å; H169-T186 PolarHBondContact ND1-OG1 3.32Å; T186-H188 VanDerWaalsContact CG2-CE1 3.41Å; T186-H188 WeakPolarHBondContact CG2-CE1 3.48Å; T186-H188 WeakPolarHBondContact CG2-NE2 3.16Å
187	I	84	Confident	85.1	Confident	3 Å²	3	77.2 Å²	77.2	2%	0.015	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	108.3	166	-49.7	-178.5	0	0	0	107	L138 F167 L168 Y185 L190 L224 V227	L138-I187 HydrophobicContact CD1-CD1 4.07Å; F167-I187 CarbonylContact C-O 3.6Å; F167-I187 WeakPolarHBondContact CA-O 3.47Å; F167-I187 VanDerWaalsContact CB-O 3.29Å; F167-I187 WeakPolarHBondContact CB-O 3.49Å; L168-I187 HydrophobicContact CB-CB 4.22Å; L168-I187 HydrophobicContact CB-CG1 4.38Å; L168-I187 HydrophobicContact CD2-CD1 4.16Å; L168-I187 HydrophobicContact CD2-CG1 4.48Å; L168-I187 PolarHBondContact N-O 3.07Å; L168-I187 PolarHBondContact O-N 2.92Å; Y185-I187 HydrophobicContact CD1-CG1 4.43Å; Y185-I187 HydrophobicContact CE1-CD1 3.74Å; Y185-I187 HydrophobicContact CE1-CG1 3.67Å; I187-L190 HydrophobicContact CB-CD2 4.31Å; I187-L190 HydrophobicContact CD1-CD2 4.06Å; I187-L190 HydrophobicContact CG2-CD2 3.85Å; I187-L190 HydrophobicContact CG2-CG 4.32Å; I187-L224 HydrophobicContact CD1-CD2 4.4Å; I187-V227 HydrophobicContact CG1-CG1 3.98Å; I187-V227 HydrophobicContact CG2-CG1 4.4Å
188	H	81.3	Confident	86.3	Confident	147 Å²	147	73.4 Å²	73.4	68%	0.681	38%	0.376	S	S	*	.	S	Bend	trans	-73.4	-31	-177	-69.8	-72.2	0	0	0	113.6	T186	T186-H188 VanDerWaalsContact CG2-CE1 3.41Å; T186-H188 WeakPolarHBondContact CG2-CE1 3.48Å; T186-H188 WeakPolarHBondContact CG2-NE2 3.16Å
189	K	83.6	Confident	87.3	Confident	181 Å²	181	64.5 Å²	64.5	79%	0.787	34%	0.338	S	S	*	.	S	Bend	trans	-142.3	106.4	-178.5	-170.2	177.5	-179.8	-176.7	0	110.2	S166	S166-K189 CarbonylContact O-C 3.55Å; S166-K189 VanDerWaalsContact O-CA 3.32Å; S166-K189 WeakPolarHBondContact O-CA 3.37Å
190	L	86.4	Confident	88.3	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.031	33%	0.328	C	S	.	.			trans	-71.6	154.5	171.8	-68.5	168.7	0	0	0	110.4	S166 I187 A192 I194 L212 W220	S166-L190 PolarHBondContact O-N 2.8Å; I187-L190 HydrophobicContact CB-CD2 4.31Å; I187-L190 HydrophobicContact CD1-CD2 4.06Å; I187-L190 HydrophobicContact CG2-CD2 3.85Å; I187-L190 HydrophobicContact CG2-CG 4.32Å; L190-A192 WeakPolarHBondContact CB-O 3.3Å; L190-A192 PolarHBondContact O-N 2.92Å; L190-I194 HydrophobicContact CD1-CB 4.49Å; L190-I194 HydrophobicContact CD1-CD1 3.62Å; L190-I194 HydrophobicContact CD1-CG1 3.84Å; L190-I194 HydrophobicContact CD1-CG2 3.83Å; L190-L212 HydrophobicContact CD1-CD1 4.46Å; L190-L212 HydrophobicContact CD2-CD1 4.05Å; L190-W220 HydrophobicContact CB-CH2 4.2Å; L190-W220 HydrophobicContact CD1-CH2 4.47Å; L190-W220 HydrophobicContact CD2-CH2 4.37Å; L190-W220 HydrophobicContact CD2-CZ3 4.02Å
191	P	85.1	Confident	88.9	Confident	44 Å²	44	63.4 Å²	63.4	29%	0.286	33%	0.329	S	S	.	.	S	Bend	trans	-56.1	-39.2	179.7	-24.5	34	0	0	0	113	W220 I223 L224	P191-W220 HydrophobicContact CB-CD2 4.18Å; P191-W220 HydrophobicContact CB-CG 4.2Å; P191-W220 HydrophobicContact CG-CB 4.42Å; P191-W220 HydrophobicContact CG-CD2 3.86Å; P191-W220 HydrophobicContact CG-CE3 4.08Å; P191-W220 HydrophobicContact CG-CG 4.03Å; P191-I223 HydrophobicContact CB-CB 4.3Å; P191-I223 HydrophobicContact CB-CD1 3.7Å; P191-I223 HydrophobicContact CB-CG2 4.09Å; P191-I223 HydrophobicContact CG-CB 3.85Å; P191-I223 HydrophobicContact CG-CD1 4.22Å; P191-I223 HydrophobicContact CG-CG2 3.61Å; P191-L224 HydrophobicContact CG-CD2 4.29Å; P191-L224 HydrophobicContact CG-CG 4.39Å
192	A	87.2	Confident	89.2	Confident	30 Å²	30	66.8 Å²	66.8	25%	0.248	34%	0.339	C	S	.	.	S	Bend	trans	-148.9	-169	164.9	0	0	0	0	0	111.8	L190 E218	L190-A192 WeakPolarHBondContact CB-O 3.3Å; L190-A192 PolarHBondContact O-N 2.92Å; A192-E218 WeakPolarHBondContact CB-OE1 2.87Å
193	K	91.8	Very high	89.5	Confident	137 Å²	137	63.8 Å²	63.8	60%	0.596	33%	0.325	S	S	*	.			trans	-71.7	141.9	-174.1	-66.5	-174.5	179.4	-175.2	0	112.1	D165 A215	D165-K193 CarbonylContact O-C 3.53Å; D165-K193 WeakPolarHBondContact O-CA 3.22Å; K193-A215 HydrophobicContact CB-CB 3.93Å; K193-A215 VanDerWaalsContact O-CB 3.27Å; K193-A215 WeakPolarHBondContact O-CB 3.43Å; K193-A215 PolarHBondContact O-N 2.98Å
194	I	94	Very high	89.7	Confident	3 Å²	3	67 Å²	67	2%	0.015	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-107.3	171.8	168.5	56.7	169.2	0	0	0	110.5	F163 G164 D165 L190 P196 L212 R213 W220	F163-I194 HydrophobicContact CB-CD1 4.43Å; G164-I194 WeakPolarHBondContact O-CD1 3.29Å; G164-I194 WeakPolarHBondContact O-CG1 3.33Å; D165-I194 WeakPolarHBondContact O-CG1 3Å; D165-I194 PolarHBondContact O-N 2.79Å; L190-I194 HydrophobicContact CD1-CB 4.49Å; L190-I194 HydrophobicContact CD1-CD1 3.62Å; L190-I194 HydrophobicContact CD1-CG1 3.84Å; L190-I194 HydrophobicContact CD1-CG2 3.83Å; I194-P196 WeakPolarHBondContact O-CD 3.44Å; I194-L212 HydrophobicContact CD1-CD2 4.15Å; I194-L212 HydrophobicContact CG2-CB 4.26Å; I194-R213 CarbonylContact C-O 3.49Å; I194-R213 WeakPolarHBondContact CA-O 3.35Å; I194-R213 WeakPolarHBondContact CB-O 3.3Å; I194-W220 HydrophobicContact CG2-CH2 3.48Å; I194-W220 VanDerWaalsContact CG2-CH2 3.48Å; I194-W220 HydrophobicContact CG2-CZ2 4.25Å; I194-W220 HydrophobicContact CG2-CZ3 4.35Å
195	L	95.7	Very high	89.8	Confident	68 Å²	68	71 Å²	71	36%	0.356	36%	0.358	S	S	.	.			trans	-105.7	91.5	170.3	-63.2	174.2	0	0	0	108.3	S197 L198 C199 R213 A215	L195-S197 PolarHBondContact O-N 3.44Å; L195-S197 VanDerWaalsContact O-N 3.12Å; L195-L198 HydrophobicContact CB-CB 4.27Å; L195-L198 HydrophobicContact CB-CD1 4.16Å; L195-L198 HydrophobicContact CB-CG 4.28Å; L195-L198 HydrophobicContact CD1-CD1 3.8Å; L195-L198 PolarHBondContact O-N 2.92Å; L195-C199 PolarHBondContact O-N 2.8Å; L195-C199 PolarHBondContact O-SG 2.76Å; L195-C199 VanDerWaalsContact O-SG 3.35Å; L195-R213 HydrophobicContact CB-CB 4.47Å; L195-R213 HydrophobicContact CB-CG 4.41Å; L195-R213 HydrophobicContact CD1-CG 4.24Å; L195-R213 PolarHBondContact N-O 2.92Å; L195-A215 HydrophobicContact CD2-CB 4.18Å; L195-A215 HydrophobicContact CG-CB 4.24Å
196	P	94.7	Very high	89.9	Confident	32 Å²	32	71.9 Å²	71.9	21%	0.208	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-54.3	-36.1	-172	-31.4	38.6	0	0	0	114.8	F163 D165 I194 L198 C199	F163-P196 HydrophobicContact CB-CB 3.83Å; F163-P196 WeakPolarHBondContact O-CB 3.16Å; D165-P196 WeakPolarHBondContact OD1-CD 3.29Å; D165-P196 WeakPolarHBondContact OD1-CG 3.41Å; I194-P196 WeakPolarHBondContact O-CD 3.44Å; P196-L198 PolarHBondContact O-N 2.85Å; P196-C199 WeakPolarHBondContact O-CB 3.42Å; P196-C199 PolarHBondContact O-N 2.88Å
197	S	94.8	Very high	90.2	Very high	112 Å²	112	71.8 Å²	71.8	78%	0.783	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-66.6	-18.2	178.8	55.3	0	0	0	0	114	L195	L195-S197 PolarHBondContact O-N 3.44Å; L195-S197 VanDerWaalsContact O-N 3.12Å
198	L	95.3	Very high	90.5	Very high	100 Å²	100	71.7 Å²	71.7	52%	0.524	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-105.7	-2.9	177.9	-57.6	-177.5	0	0	0	112.4	L195 P196 R213	L195-L198 HydrophobicContact CB-CB 4.27Å; L195-L198 HydrophobicContact CB-CD1 4.16Å; L195-L198 HydrophobicContact CB-CG 4.28Å; L195-L198 HydrophobicContact CD1-CD1 3.8Å; L195-L198 PolarHBondContact O-N 2.92Å; P196-L198 PolarHBondContact O-N 2.85Å; L198-R213 HydrophobicContact CB-CB 3.83Å; L198-R213 HydrophobicContact CB-CG 3.96Å; L198-R213 HydrophobicContact CD1-CG 4.07Å
199	C	95.2	Very high	91.1	Very high	11 Å²	11	68.3 Å²	68.3	7%	0.074	35%	0.345	C	S	.	.			trans	-77.8	143.4	174.4	-64.8	0	0	0	0	110.5	F163 L195 P196 T211 L212 R213	F163-C199 HydrophobicContact CB-CB 4.16Å; F163-C199 HydrophobicContact CD1-CB 3.57Å; F163-C199 HydrophobicContact CD2-CB 3.75Å; F163-C199 HydrophobicContact CE1-CB 3.8Å; F163-C199 HydrophobicContact CE2-CB 3.97Å; F163-C199 HydrophobicContact CG-CB 3.55Å; F163-C199 HydrophobicContact CZ-CB 3.99Å; L195-C199 PolarHBondContact O-N 2.8Å; L195-C199 PolarHBondContact O-SG 2.76Å; L195-C199 VanDerWaalsContact O-SG 3.35Å; P196-C199 WeakPolarHBondContact O-CB 3.42Å; P196-C199 PolarHBondContact O-N 2.88Å; C199-T211 VanDerWaalsContact CA-O 3.31Å; C199-T211 WeakPolarHBondContact CA-O 3.41Å; C199-L212 HydrophobicContact CB-CD2 4.43Å; C199-R213 PolarHBondContact SG-N 2.64Å; C199-R213 VanDerWaalsContact SG-N 3.44Å
200	T	95.9	Very high	91.5	Very high	72 Å²	72	59.7 Å²	59.7	44%	0.442	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	164.1	-177.9	62.9	0	0	0	0	111.4	T211	T200-T211 PolarHBondContact N-O 2.89Å; T200-T211 PolarHBondContact O-N 2.84Å
201	Y	94.3	Very high	91.9	Very high	103 Å²	103	61.3 Å²	61.3	40%	0.404	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.2	167.6	70.4	-88.9	0	0	0	110.2	V159 A161 L208 R209	V159-Y201 HydrophobicContact CB-CD2 4.22Å; V159-Y201 HydrophobicContact CB-CE2 3.76Å; V159-Y201 HydrophobicContact CG1-CD2 3.77Å; V159-Y201 HydrophobicContact CG1-CE2 3.72Å; V159-Y201 HydrophobicContact CG1-CG 4.32Å; A161-Y201 HydrophobicContact CB-CD1 3.52Å; A161-Y201 HydrophobicContact CB-CE1 3.85Å; A161-Y201 HydrophobicContact CB-CG 4.31Å; Y201-L208 HydrophobicContact CD2-CD1 3.93Å; Y201-L208 HydrophobicContact CG-CD1 4.47Å; Y201-R209 CarbonylContact C-O 3.57Å; Y201-R209 WeakPolarHBondContact CA-O 3.36Å
202	R	92.2	Very high	92.3	Very high	183 Å²	183	59.2 Å²	59.2	69%	0.691	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	125.6	174.8	-70.7	-173.5	177.6	-177.4	0.7	109.3	R209	R202-R209 PolarHBondContact N-O 2.69Å; R202-R209 PolarHBondContact O-N 3.16Å
203	L	90.3	Very high	92.7	Very high	21 Å²	21	62.1 Å²	62.1	11%	0.11	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.1	175.4	-176.8	72.3	0	0	0	109.8	A145 T157 V159 L208	A145-L203 HydrophobicContact CB-CD1 4.31Å; T157-L203 HydrophobicContact CG2-CD1 4.08Å; T157-L203 HydrophobicContact CG2-CD2 3.91Å; V159-L203 HydrophobicContact CG2-CD1 4.09Å; V159-L203 HydrophobicContact CG2-CD2 4.34Å; L203-L208 HydrophobicContact CB-CD1 4.46Å; L203-L208 HydrophobicContact CD1-CB 4.42Å; L203-L208 HydrophobicContact CD1-CD1 4.36Å
204	E	88.7	Confident	92.7	Very high	73 Å²	73	55.8 Å²	55.8	34%	0.341	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	166.9	172.1	-73	168.5	-166.3	0	0	108.8	G206 L207 R209	E204-G206 PolarHBondContact O-N 2.81Å; E204-G206 VanDerWaalsContact O-N 3.15Å; E204-L207 CarbonylContact C-O 3.6Å; E204-L207 HydrophobicContact CB-CB 4.11Å; E204-L207 PolarHBondContact N-O 2.75Å; E204-L207 PolarHBondContact O-N 3.35Å; E204-R209 WeakPolarHBondContact OE1-CD 3.37Å; E204-R209 IonicContact OE1-NE 2.63Å; E204-R209 PolarHBondContact OE1-NE 3.5Å; E204-R209 IonicContact OE2-CZ 3.32Å; E204-R209 IonicContact OE2-NE 3.89Å; E204-R209 PolarHBondContact OE2-NE 3.31Å; E204-R209 IonicContact OE2-NH2 3.95Å
205	D	87.6	Confident	92.7	Very high	114 Å²	114	58.2 Å²	58.2	61%	0.61	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	118.2	176.3	-75.8	-10.9	0	0	0	109.4	K146 K147 L207	K146-D205 WeakPolarHBondContact CA-OD1 3.27Å; K147-D205 PolarHBondContact N-OD1 2.81Å; D205-L207 VanDerWaalsContact C-N 3.27Å; D205-L207 PolarHBondContact O-N 3.06Å
206	G	86.3	Confident	92.5	Very high	21 Å²	21	57.2 Å²	57.2	22%	0.216	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-1.5	-177.2	0	0	0	0	0	115.9	L142 A145 E204	L142-G206 CarbonylContact C-O 3.55Å; L142-G206 PolarHBondContact N-O 3.04Å; L142-G206 CarbonylContact O-C 3.54Å; L142-G206 WeakPolarHBondContact O-CA 3.21Å; A145-G206 PolarHBondContact O-N 2.86Å; E204-G206 PolarHBondContact O-N 2.81Å; E204-G206 VanDerWaalsContact O-N 3.15Å
207	L	90.2	Very high	92.3	Very high	47 Å²	47	59.3 Å²	59.3	25%	0.246	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.5	-170.8	-65.6	171	0	0	0	112	T139 L140 V141 E204 D205	T139-L207 HydrophobicContact CG2-CD2 4.09Å; L140-L207 WeakPolarHBondContact O-CA 3.16Å; V141-L207 HydrophobicContact CB-CD2 4.36Å; V141-L207 HydrophobicContact CG2-CD2 3.86Å; E204-L207 CarbonylContact C-O 3.6Å; E204-L207 HydrophobicContact CB-CB 4.11Å; E204-L207 PolarHBondContact N-O 2.75Å; E204-L207 PolarHBondContact O-N 3.35Å; D205-L207 VanDerWaalsContact C-N 3.27Å; D205-L207 PolarHBondContact O-N 3.06Å
208	L	90.6	Very high	91.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.2	166.8	175.3	64.4	0	0	0	109.1	L140 L142 V159 L170 V172 Y201 L203 V210	L140-L208 HydrophobicContact CB-CB 4.34Å; L140-L208 PolarHBondContact N-O 3.04Å; L140-L208 PolarHBondContact O-N 3.11Å; L142-L208 HydrophobicContact CD1-CB 3.58Å; L142-L208 HydrophobicContact CD1-CD2 4.19Å; L142-L208 HydrophobicContact CG-CB 4.49Å; V159-L208 HydrophobicContact CG1-CD1 4.14Å; V159-L208 HydrophobicContact CG1-CD2 3.93Å; V159-L208 HydrophobicContact CG2-CD1 4.18Å; V159-L208 HydrophobicContact CG2-CD2 4.41Å; L170-L208 HydrophobicContact CD2-CD2 4.46Å; V172-L208 HydrophobicContact CG2-CD2 3.56Å; Y201-L208 HydrophobicContact CD2-CD1 3.93Å; Y201-L208 HydrophobicContact CG-CD1 4.47Å; L203-L208 HydrophobicContact CB-CD1 4.46Å; L203-L208 HydrophobicContact CD1-CB 4.42Å; L203-L208 HydrophobicContact CD1-CD1 4.36Å; L208-V210 HydrophobicContact CD2-CG2 4.29Å; L208-V210 HydrophobicContact CG-CG2 4.04Å
209	R	92.7	Very high	91.2	Very high	76 Å²	76	56.3 Å²	56.3	29%	0.287	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.4	173.3	-68.3	174.9	-178.2	-89.8	2	109.2	L138 T139 Y201 R202 E204	L138-R209 CarbonylContact O-C 3.59Å; L138-R209 WeakPolarHBondContact O-CA 3.16Å; T139-R209 HydrophobicContact CG2-CG 4.23Å; Y201-R209 CarbonylContact C-O 3.57Å; Y201-R209 WeakPolarHBondContact CA-O 3.36Å; R202-R209 PolarHBondContact N-O 2.69Å; R202-R209 PolarHBondContact O-N 3.16Å; E204-R209 WeakPolarHBondContact OE1-CD 3.37Å; E204-R209 IonicContact OE1-NE 2.63Å; E204-R209 PolarHBondContact OE1-NE 3.5Å; E204-R209 IonicContact OE2-CZ 3.32Å; E204-R209 IonicContact OE2-NE 3.89Å; E204-R209 PolarHBondContact OE2-NE 3.31Å; E204-R209 IonicContact OE2-NH2 3.95Å
210	V	93.6	Very high	90.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.8	178.2	176.4	0	0	0	0	107.1	Q137 L138 L140 F163 L168 L170 L208 L212	Q137-V210 CarbonylContact C-O 3.54Å; Q137-V210 WeakPolarHBondContact CA-O 3.43Å; L138-V210 HydrophobicContact CB-CB 4.29Å; L138-V210 PolarHBondContact N-O 3.27Å; L138-V210 PolarHBondContact O-N 3.3Å; L140-V210 HydrophobicContact CD1-CG2 4.14Å; F163-V210 HydrophobicContact CE1-CG1 3.74Å; F163-V210 HydrophobicContact CZ-CG1 4.17Å; L168-V210 HydrophobicContact CD1-CG1 4.36Å; L168-V210 HydrophobicContact CD2-CG1 4.28Å; L170-V210 HydrophobicContact CD1-CB 4.38Å; L170-V210 HydrophobicContact CD1-CG1 4.39Å; L170-V210 HydrophobicContact CD1-CG2 3.46Å; L170-V210 VanDerWaalsContact CD1-CG2 3.46Å; L170-V210 HydrophobicContact CD2-CG2 4.02Å; L170-V210 HydrophobicContact CG-CG2 4.4Å; L208-V210 HydrophobicContact CD2-CG2 4.29Å; L208-V210 HydrophobicContact CG-CG2 4.04Å; V210-L212 HydrophobicContact CG1-CD2 4.01Å
211	T	94.1	Very high	89.2	Confident	41 Å²	41	58.1 Å²	58.1	25%	0.252	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116	179.7	-59.2	0	0	0	0	108.3	T135 V136 C199 T200	T135-T211 HydrophobicContact CG2-CG2 4.41Å; V136-T211 WeakPolarHBondContact O-CA 3.32Å; C199-T211 VanDerWaalsContact CA-O 3.31Å; C199-T211 WeakPolarHBondContact CA-O 3.41Å; T200-T211 PolarHBondContact N-O 2.89Å; T200-T211 PolarHBondContact O-N 2.84Å
212	L	93.8	Very high	87.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.3	174.1	-55.2	-178.4	0	0	0	109.1	T135 V136 L138 F163 L168 L190 I194 C199 V210 W220	T135-L212 CarbonylContact C-O 3.5Å; T135-L212 VanDerWaalsContact CA-O 3.29Å; T135-L212 WeakPolarHBondContact CA-O 3.27Å; V136-L212 HydrophobicContact CB-CB 4.39Å; V136-L212 PolarHBondContact N-O 2.63Å; V136-L212 PolarHBondContact O-N 2.69Å; L138-L212 HydrophobicContact CD1-CD1 4.12Å; F163-L212 HydrophobicContact CD1-CD2 3.71Å; F163-L212 HydrophobicContact CE1-CD2 3.68Å; L168-L212 HydrophobicContact CD1-CD2 4.37Å; L168-L212 HydrophobicContact CD2-CD1 4.45Å; L168-L212 HydrophobicContact CD2-CD2 4.41Å; L190-L212 HydrophobicContact CD1-CD1 4.46Å; L190-L212 HydrophobicContact CD2-CD1 4.05Å; I194-L212 HydrophobicContact CD1-CD2 4.15Å; I194-L212 HydrophobicContact CG2-CB 4.26Å; C199-L212 HydrophobicContact CB-CD2 4.43Å; V210-L212 HydrophobicContact CG1-CD2 4.01Å; L212-W220 HydrophobicContact CD1-CZ3 4.32Å
213	R	94.2	Very high	85.9	Confident	90 Å²	90	55.9 Å²	55.9	34%	0.34	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.8	173.7	-175.1	67.2	177.2	-177	2.7	109	I194 L195 L198 C199	I194-R213 CarbonylContact C-O 3.49Å; I194-R213 WeakPolarHBondContact CA-O 3.35Å; I194-R213 WeakPolarHBondContact CB-O 3.3Å; L195-R213 HydrophobicContact CB-CB 4.47Å; L195-R213 HydrophobicContact CB-CG 4.41Å; L195-R213 HydrophobicContact CD1-CG 4.24Å; L195-R213 PolarHBondContact N-O 2.92Å; L198-R213 HydrophobicContact CB-CB 3.83Å; L198-R213 HydrophobicContact CB-CG 3.96Å; L198-R213 HydrophobicContact CD1-CG 4.07Å; C199-R213 PolarHBondContact SG-N 2.64Å; C199-R213 VanDerWaalsContact SG-N 3.44Å
214	K	92.9	Very high	84.6	Confident	5 Å²	5	55.2 Å²	55.2	2%	0.022	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-69.6	146.6	177.2	-57.9	175.3	-176.9	168.2	0	110.2	D131 D132 H134 V136 A216 E218 W220	D131-K214 WeakPolarHBondContact OD1-CE 3.47Å; D131-K214 IonicContact OD1-NZ 2.79Å; D131-K214 PolarHBondContact OD1-NZ 2.71Å; D131-K214 IonicContact OD2-NZ 3.35Å; D132-K214 PolarHBondContact O-NZ 3.18Å; H134-K214 PolarHBondContact O-N 2.89Å; V136-K214 HydrophobicContact CG2-CD 4.47Å; K214-A216 VanDerWaalsContact CB-O 3.23Å; K214-A216 WeakPolarHBondContact CB-O 3.27Å; K214-E218 HydrophobicContact CD-CG 4.33Å; K214-E218 WeakPolarHBondContact CD-O 3.23Å; K214-E218 WeakPolarHBondContact CE-O 3.41Å; K214-E218 PolarHBondContact NZ-O 3.19Å; K214-W220 HydrophobicContact CD-CD2 4.49Å; K214-W220 HydrophobicContact CD-CZ2 4.43Å; K214-W220 HydrophobicContact CG-CH2 4.38Å; K214-W220 HydrophobicContact CG-CZ2 3.93Å
215	A	93.5	Very high	82.9	Confident	54 Å²	54	59.9 Å²	59.9	45%	0.446	33%	0.325	S	S	.	.	S	Bend	trans	-76.7	-27.6	174.1	0	0	0	0	0	112.4	K193 L195	K193-A215 HydrophobicContact CB-CB 3.93Å; K193-A215 VanDerWaalsContact O-CB 3.27Å; K193-A215 WeakPolarHBondContact O-CB 3.43Å; K193-A215 PolarHBondContact O-N 2.98Å; L195-A215 HydrophobicContact CD2-CB 4.18Å; L195-A215 HydrophobicContact CG-CB 4.24Å
216	A	92.2	Very high	81.1	Confident	46 Å²	46	60 Å²	60	38%	0.38	33%	0.331	S	S	.	.	S	Bend	trans	-131	151.3	175.7	0	0	0	0	0	110.2	K214 E218	K214-A216 VanDerWaalsContact CB-O 3.23Å; K214-A216 WeakPolarHBondContact CB-O 3.27Å; A216-E218 PolarHBondContact O-N 3.1Å
217	P	89.8	Confident	79.6	Confident	76 Å²	76	61.3 Å²	61.3	49%	0.494	33%	0.334	S	S	.	.			trans	-69.4	114.6	171	27.5	-30.6	0	0	0	110.8	E133	E133-P217 HydrophobicContact CG-CB 3.58Å; E133-P217 VanDerWaalsContact O-CA 3.3Å; E133-P217 WeakPolarHBondContact O-CA 2.82Å
218	E	84.7	Confident	77.6	Confident	71 Å²	71	61.8 Å²	61.8	33%	0.332	35%	0.35	S	S	.	.			trans	-162.7	153.7	179.5	60.1	-178.6	-172.4	0	0	109.4	E133 A192 K214 A216 W220	E133-E218 PolarHBondContact O-N 2.8Å; A192-E218 WeakPolarHBondContact CB-OE1 2.87Å; K214-E218 HydrophobicContact CD-CG 4.33Å; K214-E218 WeakPolarHBondContact CD-O 3.23Å; K214-E218 WeakPolarHBondContact CE-O 3.41Å; K214-E218 PolarHBondContact NZ-O 3.19Å; A216-E218 PolarHBondContact O-N 3.1Å; E218-W220 PolarHBondContact OE1-NE1 3.49Å
219	S	81.7	Confident	75.8	Confident	78 Å²	78	63.1 Å²	63.1	55%	0.545	36%	0.357	S	S	.	.			trans	-93	139.2	177.6	178.1	0	0	0	0	112.2	D131 Q221	D131-S219 WeakPolarHBondContact OD2-CA 3.44Å; D131-S219 PolarHBondContact OD2-OG 3.28Å; S219-Q221 PolarHBondContact OG-N 2.8Å
220	W	81.6	Confident	73.7	Confident	3 Å²	3	66.8 Å²	66.8	1%	0.011	38%	0.378	C	S	.	.			trans	-112.4	2.3	-180	-66.7	4.1	0	0	0	113.4	D131 V136 L190 P191 I194 L212 K214 E218 N222 I223 L224	D131-W220 PolarHBondContact OD2-N 2.84Å; V136-W220 HydrophobicContact CB-CE3 4.1Å; V136-W220 HydrophobicContact CB-CZ3 4.34Å; V136-W220 HydrophobicContact CG1-CE3 4.44Å; V136-W220 HydrophobicContact CG2-CB 4.31Å; V136-W220 HydrophobicContact CG2-CD2 3.73Å; V136-W220 HydrophobicContact CG2-CE3 3.22Å; V136-W220 HydrophobicContact CG2-CG 4.21Å; V136-W220 HydrophobicContact CG2-CZ3 3.8Å; L190-W220 HydrophobicContact CB-CH2 4.2Å; L190-W220 HydrophobicContact CD1-CH2 4.47Å; L190-W220 HydrophobicContact CD2-CH2 4.37Å; L190-W220 HydrophobicContact CD2-CZ3 4.02Å; P191-W220 HydrophobicContact CB-CD2 4.18Å; P191-W220 HydrophobicContact CB-CG 4.2Å; P191-W220 HydrophobicContact CG-CB 4.42Å; P191-W220 HydrophobicContact CG-CD2 3.86Å; P191-W220 HydrophobicContact CG-CE3 4.08Å; P191-W220 HydrophobicContact CG-CG 4.03Å; I194-W220 HydrophobicContact CG2-CH2 3.48Å; I194-W220 VanDerWaalsContact CG2-CH2 3.48Å; I194-W220 HydrophobicContact CG2-CZ2 4.25Å; I194-W220 HydrophobicContact CG2-CZ3 4.35Å; L212-W220 HydrophobicContact CD1-CZ3 4.32Å; K214-W220 HydrophobicContact CD-CD2 4.49Å; K214-W220 HydrophobicContact CD-CZ2 4.43Å; K214-W220 HydrophobicContact CG-CH2 4.38Å; K214-W220 HydrophobicContact CG-CZ2 3.93Å; E218-W220 PolarHBondContact OE1-NE1 3.49Å; W220-N222 VanDerWaalsContact C-N 3.25Å; W220-N222 PolarHBondContact O-N 3.27Å; W220-N222 VanDerWaalsContact O-N 3.09Å; W220-I223 PolarHBondContact O-N 3.02Å; W220-L224 HydrophobicContact CB-CD1 4.26Å; W220-L224 HydrophobicContact CB-CG 4.4Å; W220-L224 HydrophobicContact CE3-CD1 3.62Å; W220-L224 HydrophobicContact CE3-CG 4.24Å; W220-L224 HydrophobicContact CZ3-CD1 4.37Å; W220-L224 PolarHBondContact O-N 2.87Å
221	Q	67.3	Low	71.2	Confident	119 Å²	119	69.8 Å²	69.8	56%	0.556	40%	0.396	S	S	*	.	H	α-helix	trans	-46.8	-44.2	-173.2	-79.1	-180	-6.4	0	0	113.4	D131 S219 I223	D131-Q221 HydrophobicContact CB-CG 3.78Å; D131-Q221 PolarHBondContact OD2-N 2.81Å; S219-Q221 PolarHBondContact OG-N 2.8Å; Q221-I223 PolarHBondContact O-N 3.26Å
222	N	59.3	Low	69	Low	151 Å²	151	75.4 Å²	75.4	81%	0.807	42%	0.417	S	S	*	.	H	α-helix	trans	-77.8	-16.8	-176.6	-68.1	-27.7	0	0	0	114.7	W220	W220-N222 VanDerWaalsContact C-N 3.25Å; W220-N222 PolarHBondContact O-N 3.27Å; W220-N222 VanDerWaalsContact O-N 3.09Å
223	I	59.5	Low	66.4	Low	87 Å²	87	84.1 Å²	84.1	45%	0.446	46%	0.457	S	S	.	.	H	α-helix	trans	-100.7	-37.6	-166.6	-53.9	171	0	0	0	111	P191 W220 Q221 T226	P191-I223 HydrophobicContact CB-CB 4.3Å; P191-I223 HydrophobicContact CB-CD1 3.7Å; P191-I223 HydrophobicContact CB-CG2 4.09Å; P191-I223 HydrophobicContact CG-CB 3.85Å; P191-I223 HydrophobicContact CG-CD1 4.22Å; P191-I223 HydrophobicContact CG-CG2 3.61Å; W220-I223 PolarHBondContact O-N 3.02Å; Q221-I223 PolarHBondContact O-N 3.26Å; I223-T226 PolarHBondContact O-OG1 3.35Å
224	L	61.5	Low	63.8	Low	8 Å²	8	85 Å²	85	4%	0.042	47%	0.469	C	S	.	.	H	α-helix	trans	-82.4	-16.7	-173.6	-73.8	-178.3	0	0	0	115.4	V129 V136 L138 I187 P191 W220 T226 V227	V129-L224 HydrophobicContact CG1-CB 4.07Å; V129-L224 HydrophobicContact CG1-CD1 3.79Å; V129-L224 HydrophobicContact CG2-CB 4.34Å; V136-L224 HydrophobicContact CB-CD1 4.47Å; V136-L224 HydrophobicContact CG1-CD1 3.51Å; V136-L224 HydrophobicContact CG2-CD1 4.37Å; L138-L224 HydrophobicContact CD2-CD1 4.34Å; I187-L224 HydrophobicContact CD1-CD2 4.4Å; P191-L224 HydrophobicContact CG-CD2 4.29Å; P191-L224 HydrophobicContact CG-CG 4.39Å; W220-L224 HydrophobicContact CB-CD1 4.26Å; W220-L224 HydrophobicContact CB-CG 4.4Å; W220-L224 HydrophobicContact CE3-CD1 3.62Å; W220-L224 HydrophobicContact CE3-CG 4.24Å; W220-L224 HydrophobicContact CZ3-CD1 4.37Å; W220-L224 PolarHBondContact O-N 2.87Å; L224-T226 PolarHBondContact O-N 2.77Å; L224-V227 PolarHBondContact O-N 2.94Å
225	E	53.7	Low	60.8	Low	170 Å²	170	94 Å²	94	79%	0.794	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-15	174.8	-69.2	-174	168	0	0	113
226	T	50.1	Low	57.6	Low	118 Å²	118	104 Å²	104	72%	0.724	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-10.4	-178.5	56.2	0	0	0	0	115.6	I223 L224	I223-T226 PolarHBondContact O-OG1 3.35Å; L224-T226 PolarHBondContact O-N 2.77Å
227	V	53.6	Low	55.9	Low	47 Å²	47	106.9 Å²	106.9	29%	0.285	56%	0.557	S	S	.	*			trans	-106	92.9	-172	-169	0	0	0	0	111.9	Y185 I187 L224	Y185-V227 PolarHBondContact OH-O 2.94Å; I187-V227 HydrophobicContact CG1-CG1 3.98Å; I187-V227 HydrophobicContact CG2-CG1 4.4Å; L224-V227 PolarHBondContact O-N 2.94Å
228	G	49.4	Very low	54.1	Low	57 Å²	57	108.5 Å²	108.5	59%	0.588	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-78.1	170.1	-178.6	0	0	0	0	0	115.4	Y185	Y185-G228 WeakPolarHBondContact CE2-O 3.42Å
229	L	52	Low	52.4	Low	28 Å²	28	110.6 Å²	110.6	15%	0.147	57%	0.573	C	S	.	*	P	Polyproline II helix	trans	-95.5	116.7	-177.8	-169	130.3	0	0	0	112.3	Y125 V127 L140 Y185 T231	Y125-L229 HydrophobicContact CD2-CD2 4.48Å; Y125-L229 HydrophobicContact CG-CD2 4.03Å; V127-L229 HydrophobicContact CG2-CB 3.81Å; V127-L229 HydrophobicContact CG2-CD1 4.01Å; L140-L229 HydrophobicContact CB-CD1 4.29Å; L140-L229 HydrophobicContact CD2-CD1 3.28Å; L140-L229 HydrophobicContact CG-CD1 3.84Å; Y185-L229 HydrophobicContact CD2-CB 3.71Å; Y185-L229 HydrophobicContact CD2-CD1 3.42Å; Y185-L229 VanDerWaalsContact CD2-CD1 3.42Å; Y185-L229 HydrophobicContact CD2-CG 3.64Å; Y185-L229 HydrophobicContact CE2-CB 4.03Å; Y185-L229 HydrophobicContact CE2-CD1 4.23Å; Y185-L229 HydrophobicContact CE2-CG 4.43Å; Y185-L229 HydrophobicContact CG-CD1 3.85Å; Y185-L229 HydrophobicContact CG-CG 4.39Å; L229-T231 HydrophobicContact CD2-CG2 4.2Å
230	E	49.7	Very low	50.7	Low	154 Å²	154	112.5 Å²	112.5	72%	0.72	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-90	117.9	179.6	-65.6	-176.4	175.7	0	0	111.7
231	T	41.3	Very low	48.8	Very low	63 Å²	63	119.4 Å²	119.4	39%	0.387	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-89	122	170.2	50.6	0	0	0	0	111	Y125 Y183 L229	Y125-T231 HydrophobicContact CD2-CG2 3.62Å; Y125-T231 HydrophobicContact CE2-CG2 3.42Å; Y125-T231 VanDerWaalsContact CE2-CG2 3.42Å; Y125-T231 HydrophobicContact CG-CG2 4.37Å; Y183-T231 HydrophobicContact CD1-CG2 3.79Å; Y183-T231 HydrophobicContact CE1-CG2 4Å; L229-T231 HydrophobicContact CD2-CG2 4.2Å
232	K	47	Very low	47.5	Very low	159 Å²	159	119.4 Å²	119.4	69%	0.691	61%	0.614	S	S	*	*			trans	-85.7	107.1	161.5	-70	-168.1	175.9	-170.2	0	108.3	N234	K232-N234 PolarHBondContact O-N 3.09Å
233	E	40	Very low	46.7	Very low	182 Å²	182	117.1 Å²	117.1	85%	0.85	60%	0.6	S	S	*	*			trans	-65.1	131.3	161.1	-77.2	-172.5	151.2	0	0	107.7	E235	E233-E235 PolarHBondContact O-N 3.43Å
234	N	38.3	Very low	45.7	Very low	109 Å²	109	119.5 Å²	119.5	58%	0.583	61%	0.612	S	S	*	*			trans	-54.9	113.5	178.1	-82	-30.6	0	0	0	109.1	K232 Q236	K232-N234 PolarHBondContact O-N 3.09Å; N234-Q236 PolarHBondContact O-N 3.36Å
235	E	29.9	Very low	44.4	Very low	193 Å²	193	128.8 Å²	128.8	90%	0.902	66%	0.659	S	S	*	*			trans	-66.1	124.2	152.1	-75.2	-178.3	149.7	0	0	107	E233	E233-E235 PolarHBondContact O-N 3.43Å
236	Q	28.2	Very low	43.6	Very low	265 Å²	265	125 Å²	125	100%	1.238	65%	0.647	S	S	*	*			trans	-59.9	0	-179.6	-79.1	175.2	-31.7	0	0	112.8	N234	N234-Q236 PolarHBondContact O-N 3.36Å

Retrieved 236 of 236 residues in 387.1 ms (Link to these results)

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