A0A087Y8B9_POEFO Loading...

ATP synthase subunit C lysine N-methyltransferase

AlphaFold DB , UniProt , Accession A0A087Y8B9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 223 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	43.4	Very low	250 Å²	250	139.5 Å²	139.5	100%	1.232	79%	0.785	S	S	*	*				0	143	0	-81.7	165.1	71.3	0	0	108.3
2	S	45.3	Very low	43.7	Very low	97 Å²	97	144 Å²	144	68%	0.678	80%	0.795	S	S	*	*			trans	-54	148.3	-164.8	-175	0	0	0	0	117.7
3	Q	45	Very low	44	Very low	161 Å²	161	137.1 Å²	137.1	75%	0.752	78%	0.777	S	S	*	*				150.9	121.9	114.6	-76.9	-70.5	-20.7	0	0	110.2
4	H	40.1	Very low	44.5	Very low	163 Å²	163	138.1 Å²	138.1	76%	0.755	78%	0.779	S	S	*	*				179.5	126.1	124.6	-106.2	-81	0	0	0	112.3
5	E	47.6	Very low	44.9	Very low	151 Å²	151	132.1 Å²	132.1	71%	0.706	76%	0.761	S	S	*	*			trans	15.4	137.6	149.7	-69.6	174.6	93.6	0	0	122.1
6	L	39.3	Very low	45.4	Very low	156 Å²	156	128.9 Å²	128.9	82%	0.817	75%	0.754	S	S	*	*				-158.3	118.2	108.6	-129.2	83.1	0	0	0	111	L8	L6-L8 HydrophobicContact CD2-CD1 4.16Å
7	A	52.3	Low	46	Very low	92 Å²	92	127.6 Å²	127.6	76%	0.76	75%	0.749	S	S	*	*			trans	-70.5	135.9	162.5	0	0	0	0	0	109.8
8	L	37.3	Very low	46.4	Very low	151 Å²	151	124.5 Å²	124.5	79%	0.791	74%	0.735	S	S	*	*			trans	176.6	137.4	164.4	-93.3	156.9	0	0	0	104.2	L6	L6-L8 HydrophobicContact CD2-CD1 4.16Å
9	D	38.3	Very low	46.9	Very low	120 Å²	120	125.5 Å²	125.5	64%	0.642	73%	0.731	S	S	*	*			cis	-162.8	131.8	10.1	-178.2	22.6	0	0	0	107.1
10	T	43.6	Very low	47.4	Very low	117 Å²	117	121 Å²	121	72%	0.718	71%	0.713	S	S	*	*			trans	-5.3	127.4	146.6	-8.7	0	0	0	0	118.9
11	G	51.8	Low	48	Very low	76 Å²	76	125.1 Å²	125.1	78%	0.784	72%	0.716	S	S	*	*			trans	42.9	81.3	130.3	0	0	0	0	0	120
12	Q	47.3	Very low	49	Very low	194 Å²	194	121 Å²	121	91%	0.907	69%	0.687	S	S	*	*			trans	-140.2	80.8	158.6	-73.3	-169	-11.6	0	0	110.8
13	G	48	Very low	49.7	Very low	54 Å²	54	120.2 Å²	120.2	56%	0.557	68%	0.681	S	S	*	*	S	Bend	trans	-143.9	-22.8	176.2	0	0	0	0	0	115.7
14	N	50.1	Low	50.6	Low	151 Å²	151	122.3 Å²	122.3	81%	0.807	68%	0.682	S	S	*	*	S	Bend	trans	-99.7	-10.9	-172.5	-85.3	-0.8	0	0	0	115.5	S18	N14-S18 WeakPolarHBondContact O-CB 3.38Å
15	G	50.6	Low	52	Low	49 Å²	49	118.7 Å²	118.7	51%	0.505	68%	0.675	S	S	.	*	H	α-helix	trans	-74.7	-51.9	-178.2	0	0	0	0	0	113.5	V17 S18 E19	G15-V17 PolarHBondContact O-N 2.88Å; G15-S18 PolarHBondContact O-N 3.01Å; G15-E19 PolarHBondContact O-N 3.41Å; G15-E19 VanDerWaalsContact O-N 3.08Å
16	A	53.3	Low	53.3	Low	80 Å²	80	119.5 Å²	119.5	66%	0.661	67%	0.672	S	S	*	*	H	α-helix	trans	-69.1	-35	-171.9	0	0	0	0	0	113.6	G20	A16-G20 PolarHBondContact O-N 2.81Å
17	V	54.8	Low	55.4	Low	108 Å²	108	117.2 Å²	117.2	66%	0.655	66%	0.66	S	S	*	*	H	α-helix	trans	-71.6	-35.8	178.4	-175.9	0	0	0	0	111.3	G15 R21	G15-V17 PolarHBondContact O-N 2.88Å; V17-R21 PolarHBondContact O-N 3.48Å
18	S	54.1	Low	56.7	Low	71 Å²	71	114.5 Å²	114.5	50%	0.497	64%	0.641	S	S	.	*	H	α-helix	trans	-70.8	-41.5	177.6	-175.3	0	0	0	0	112.1	N14 G15 R21 R22	N14-S18 WeakPolarHBondContact O-CB 3.38Å; G15-S18 PolarHBondContact O-N 3.01Å; S18-R21 PolarHBondContact O-N 3.09Å; S18-R22 PolarHBondContact O-N 3.1Å
19	E	55.8	Low	58.9	Low	144 Å²	144	113.8 Å²	113.8	67%	0.673	64%	0.637	S	S	*	*	H	α-helix	trans	-65.4	-43.6	176.9	-75.2	-171.5	149.8	0	0	112.8	G15 R21 R22 S23	G15-E19 PolarHBondContact O-N 3.41Å; G15-E19 VanDerWaalsContact O-N 3.08Å; E19-R21 VanDerWaalsContact C-N 3.31Å; E19-R21 PolarHBondContact O-N 3.06Å; E19-R22 PolarHBondContact O-N 2.76Å; E19-S23 WeakPolarHBondContact O-CB 3.27Å; E19-S23 PolarHBondContact O-N 3.15Å
20	G	57.8	Low	61.2	Low	35 Å²	35	112.4 Å²	112.4	36%	0.361	63%	0.633	S	S	.	*	H	α-helix	trans	-63	-34.8	177.1	0	0	0	0	0	113.5	A16 R24	A16-G20 PolarHBondContact O-N 2.81Å; G20-R24 WeakPolarHBondContact O-CG 3.44Å; G20-R24 PolarHBondContact O-N 3.42Å
21	R	58.6	Low	63.4	Low	207 Å²	207	110.5 Å²	110.5	78%	0.781	62%	0.621	S	S	*	*	H	α-helix	trans	-75.5	-37.9	178.1	-150.4	173.7	-170.6	-179.4	2.1	112.1	V17 S18 E19 S25	V17-R21 PolarHBondContact O-N 3.48Å; S18-R21 PolarHBondContact O-N 3.09Å; E19-R21 VanDerWaalsContact C-N 3.31Å; E19-R21 PolarHBondContact O-N 3.06Å; R21-S25 WeakPolarHBondContact O-CB 3.49Å; R21-S25 PolarHBondContact O-N 3.38Å; R21-S25 VanDerWaalsContact O-N 3.08Å
22	R	57.7	Low	65.2	Low	165 Å²	165	111.8 Å²	111.8	62%	0.623	61%	0.614	S	S	*	*	H	α-helix	trans	-65.4	-41.9	172.9	-105	-179.7	176.1	-177	1	112.6	S18 E19 S25 R26	S18-R22 PolarHBondContact O-N 3.1Å; E19-R22 PolarHBondContact O-N 2.76Å; R22-S25 PolarHBondContact O-N 2.97Å; R22-R26 WeakPolarHBondContact O-CG 3.22Å; R22-R26 PolarHBondContact O-N 3.31Å
23	S	59.9	Low	67.2	Low	79 Å²	79	104.8 Å²	104.8	55%	0.552	59%	0.594	S	S	*	*	H	α-helix	trans	-63.9	-46	178	-179.3	0	0	0	0	111.8	E19 S25 R26 L27	E19-S23 WeakPolarHBondContact O-CB 3.27Å; E19-S23 PolarHBondContact O-N 3.15Å; S23-S25 PolarHBondContact O-N 2.98Å; S23-R26 PolarHBondContact O-N 3.03Å; S23-L27 WeakPolarHBondContact O-CB 3.25Å; S23-L27 PolarHBondContact O-N 3.03Å
24	R	65.1	Low	69.4	Low	205 Å²	205	106.5 Å²	106.5	77%	0.774	59%	0.593	S	S	*	*	H	α-helix	trans	-63.8	-36.8	175.6	-75	177.2	170.8	171.6	-1.8	113.4	G20 G28	G20-R24 WeakPolarHBondContact O-CG 3.44Å; G20-R24 PolarHBondContact O-N 3.42Å; R24-G28 PolarHBondContact O-N 3.41Å
25	S	68.6	Low	71.5	Confident	88 Å²	88	103.1 Å²	103.1	62%	0.615	58%	0.578	S	S	*	*	H	α-helix	trans	-69.2	-40.7	176.7	172.1	0	0	0	0	112.8	R21 R22 S23 G28 L29	R21-S25 WeakPolarHBondContact O-CB 3.49Å; R21-S25 PolarHBondContact O-N 3.38Å; R21-S25 VanDerWaalsContact O-N 3.08Å; R22-S25 PolarHBondContact O-N 2.97Å; S23-S25 PolarHBondContact O-N 2.98Å; S25-G28 PolarHBondContact O-N 3.13Å; S25-L29 PolarHBondContact O-N 3.49Å
26	R	75.8	Confident	73.5	Confident	167 Å²	167	102.3 Å²	102.3	63%	0.63	57%	0.569	S	S	*	*	H	α-helix	trans	-67.6	-39	175.2	-72.2	175.6	177.9	-175.8	-2.2	111.8	R22 S23 L29 V30	R22-R26 WeakPolarHBondContact O-CG 3.22Å; R22-R26 PolarHBondContact O-N 3.31Å; S23-R26 PolarHBondContact O-N 3.03Å; R26-L29 PolarHBondContact O-N 2.94Å; R26-V30 VanDerWaalsContact O-CG2 3.32Å; R26-V30 WeakPolarHBondContact O-CG2 3.34Å; R26-V30 PolarHBondContact O-N 3.04Å
27	L	81.9	Confident	75.4	Confident	109 Å²	109	100.4 Å²	100.4	57%	0.571	56%	0.558	S	S	*	*	H	α-helix	trans	-62.2	-44.3	174.3	-175.4	65.4	0	0	0	111.4	S23 L29 V30 V31	S23-L27 WeakPolarHBondContact O-CB 3.25Å; S23-L27 PolarHBondContact O-N 3.03Å; L27-L29 VanDerWaalsContact C-N 3.32Å; L27-L29 PolarHBondContact O-N 3.1Å; L27-V30 PolarHBondContact O-N 3.5Å; L27-V31 HydrophobicContact CD1-CG2 4.38Å; L27-V31 HydrophobicContact CG-CG2 4.42Å; L27-V31 WeakPolarHBondContact O-CB 3.39Å; L27-V31 VanDerWaalsContact O-CG2 3.26Å; L27-V31 WeakPolarHBondContact O-CG2 3.4Å; L27-V31 PolarHBondContact O-N 3.39Å
28	G	81.3	Confident	77.3	Confident	35 Å²	35	98.6 Å²	98.6	36%	0.361	55%	0.55	S	S	.	.	H	α-helix	trans	-57.5	-44.5	174	0	0	0	0	0	112.3	R24 S25 V30 V31 T32	R24-G28 PolarHBondContact O-N 3.41Å; S25-G28 PolarHBondContact O-N 3.13Å; G28-V30 PolarHBondContact O-N 3.36Å; G28-V31 PolarHBondContact O-N 3.09Å; G28-T32 WeakPolarHBondContact O-CB 3.37Å; G28-T32 PolarHBondContact O-N 3.3Å; G28-T32 PolarHBondContact O-OG1 2.86Å
29	L	83.3	Confident	79.2	Confident	136 Å²	136	100.4 Å²	100.4	71%	0.712	55%	0.553	S	S	*	*	H	α-helix	trans	-63.6	-41.9	177.8	-160.3	79.4	0	0	0	112.5	S25 R26 L27 G33	S25-L29 PolarHBondContact O-N 3.49Å; R26-L29 PolarHBondContact O-N 2.94Å; L27-L29 VanDerWaalsContact C-N 3.32Å; L27-L29 PolarHBondContact O-N 3.1Å; L29-G33 PolarHBondContact O-N 2.86Å
30	V	86.7	Confident	81	Confident	90 Å²	90	98.1 Å²	98.1	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-45.9	176.9	171.9	0	0	0	0	110.6	R26 L27 G28 G33 V34	R26-V30 VanDerWaalsContact O-CG2 3.32Å; R26-V30 WeakPolarHBondContact O-CG2 3.34Å; R26-V30 PolarHBondContact O-N 3.04Å; L27-V30 PolarHBondContact O-N 3.5Å; G28-V30 PolarHBondContact O-N 3.36Å; V30-G33 PolarHBondContact O-N 3.34Å; V30-V34 HydrophobicContact CG1-CG2 4.33Å; V30-V34 VanDerWaalsContact O-CG2 3.3Å; V30-V34 WeakPolarHBondContact O-CG2 3.22Å; V30-V34 PolarHBondContact O-N 3.02Å
31	V	89.7	Confident	82.7	Confident	78 Å²	78	99 Å²	99	47%	0.473	55%	0.553	S	S	.	*	H	α-helix	trans	-61.6	-46.6	178	171.3	0	0	0	0	110.7	L27 G28 G33 V34 V35	L27-V31 HydrophobicContact CD1-CG2 4.38Å; L27-V31 HydrophobicContact CG-CG2 4.42Å; L27-V31 WeakPolarHBondContact O-CB 3.39Å; L27-V31 VanDerWaalsContact O-CG2 3.26Å; L27-V31 WeakPolarHBondContact O-CG2 3.4Å; L27-V31 PolarHBondContact O-N 3.39Å; G28-V31 PolarHBondContact O-N 3.09Å; V31-G33 VanDerWaalsContact C-N 3.32Å; V31-G33 PolarHBondContact O-N 2.95Å; V31-V34 PolarHBondContact O-N 3.25Å; V31-V35 HydrophobicContact CG1-CG2 4.35Å; V31-V35 WeakPolarHBondContact O-CB 3.45Å; V31-V35 VanDerWaalsContact O-CG2 3.29Å; V31-V35 WeakPolarHBondContact O-CG2 3.48Å; V31-V35 PolarHBondContact O-N 2.99Å
32	T	88.1	Confident	84.4	Confident	102 Å²	102	94.5 Å²	94.5	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-62.1	-39.7	175.5	-57.5	0	0	0	0	111.8	G28 G36	G28-T32 WeakPolarHBondContact O-CB 3.37Å; G28-T32 PolarHBondContact O-N 3.3Å; G28-T32 PolarHBondContact O-OG1 2.86Å; T32-G36 PolarHBondContact O-N 2.96Å
33	G	91	Very high	86	Confident	48 Å²	48	94.9 Å²	94.9	50%	0.495	55%	0.546	S	S	.	.	H	α-helix	trans	-63.3	-43.8	175.5	0	0	0	0	0	113	L29 V30 V31 G37	L29-G33 PolarHBondContact O-N 2.86Å; V30-G33 PolarHBondContact O-N 3.34Å; V31-G33 VanDerWaalsContact C-N 3.32Å; V31-G33 PolarHBondContact O-N 2.95Å; G33-G37 WeakPolarHBondContact O-CA 3.37Å; G33-G37 PolarHBondContact O-N 3.17Å
34	V	93	Very high	87.5	Confident	89 Å²	89	95.7 Å²	95.7	54%	0.539	55%	0.548	S	S	.	.	H	α-helix	trans	-67	-47	178	171.3	0	0	0	0	110.9	V30 V31 S38	V30-V34 HydrophobicContact CG1-CG2 4.33Å; V30-V34 VanDerWaalsContact O-CG2 3.3Å; V30-V34 WeakPolarHBondContact O-CG2 3.22Å; V30-V34 PolarHBondContact O-N 3.02Å; V31-V34 PolarHBondContact O-N 3.25Å; V34-S38 VanDerWaalsContact O-CB 3.24Å; V34-S38 WeakPolarHBondContact O-CB 3.33Å; V34-S38 PolarHBondContact O-N 3.38Å; V34-S38 PolarHBondContact O-OG 3.5Å
35	V	94.4	Very high	88.8	Confident	81 Å²	81	90.2 Å²	90.2	49%	0.491	54%	0.537	S	S	.	.	H	α-helix	trans	-65.5	-48.7	179.4	173.9	0	0	0	0	110.6	V31 S38 L39	V31-V35 HydrophobicContact CG1-CG2 4.35Å; V31-V35 WeakPolarHBondContact O-CB 3.45Å; V31-V35 VanDerWaalsContact O-CG2 3.29Å; V31-V35 WeakPolarHBondContact O-CG2 3.48Å; V31-V35 PolarHBondContact O-N 2.99Å; V35-S38 PolarHBondContact O-N 3.3Å; V35-L39 HydrophobicContact CG1-CD1 4.09Å; V35-L39 WeakPolarHBondContact O-CG 3.38Å; V35-L39 PolarHBondContact O-N 3.17Å
36	G	92.9	Very high	89.6	Confident	31 Å²	31	87.8 Å²	87.8	32%	0.32	52%	0.522	S	S	.	.	H	α-helix	trans	-61.1	-46.4	177.5	0	0	0	0	0	112.3	T32 S38 L39 V40	T32-G36 PolarHBondContact O-N 2.96Å; G36-S38 PolarHBondContact O-N 3.33Å; G36-L39 PolarHBondContact O-N 3.3Å; G36-V40 WeakPolarHBondContact O-CG2 3.14Å; G36-V40 PolarHBondContact O-N 2.95Å
37	G	93.4	Very high	89.9	Confident	41 Å²	41	81.3 Å²	81.3	42%	0.423	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-41.6	176.6	0	0	0	0	0	112.8	G33 V40 A41	G33-G37 WeakPolarHBondContact O-CA 3.37Å; G33-G37 PolarHBondContact O-N 3.17Å; G37-V40 PolarHBondContact O-N 3.21Å; G37-A41 WeakPolarHBondContact O-CB 3.49Å; G37-A41 PolarHBondContact O-N 3.31Å
38	S	93.8	Very high	89.8	Confident	69 Å²	69	80 Å²	80	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-40.6	177.4	-58	0	0	0	0	112.2	V34 V35 G36 A41 L42	V34-S38 VanDerWaalsContact O-CB 3.24Å; V34-S38 WeakPolarHBondContact O-CB 3.33Å; V34-S38 PolarHBondContact O-N 3.38Å; V34-S38 PolarHBondContact O-OG 3.5Å; V35-S38 PolarHBondContact O-N 3.3Å; G36-S38 PolarHBondContact O-N 3.33Å; S38-A41 PolarHBondContact O-N 2.93Å; S38-L42 VanDerWaalsContact O-CB 3.29Å; S38-L42 WeakPolarHBondContact O-CB 3.34Å; S38-L42 PolarHBondContact O-N 2.94Å
39	L	94.2	Very high	89.7	Confident	110 Å²	110	86 Å²	86	58%	0.576	52%	0.519	S	S	*	.	H	α-helix	trans	-65.3	-42.6	175.7	-72.5	171.9	0	0	0	111.9	V35 G36 L42 Y43	V35-L39 HydrophobicContact CG1-CD1 4.09Å; V35-L39 WeakPolarHBondContact O-CG 3.38Å; V35-L39 PolarHBondContact O-N 3.17Å; G36-L39 PolarHBondContact O-N 3.3Å; L39-L42 PolarHBondContact O-N 2.88Å; L39-Y43 WeakPolarHBondContact O-CB 3.46Å; L39-Y43 PolarHBondContact O-N 2.89Å
40	V	94.4	Very high	89.2	Confident	96 Å²	96	83.3 Å²	83.3	58%	0.582	51%	0.507	S	S	*	.	H	α-helix	trans	-63.5	-45.8	175.7	171.8	0	0	0	0	110.5	G36 G37 L42 Y43 V44	G36-V40 WeakPolarHBondContact O-CG2 3.14Å; G36-V40 PolarHBondContact O-N 2.95Å; G37-V40 PolarHBondContact O-N 3.21Å; V40-L42 PolarHBondContact O-N 3.31Å; V40-Y43 PolarHBondContact O-N 2.91Å; V40-V44 HydrophobicContact CG1-CG2 4.39Å; V40-V44 VanDerWaalsContact O-CG2 3.3Å; V40-V44 WeakPolarHBondContact O-CG2 3.43Å; V40-V44 PolarHBondContact O-N 2.88Å
41	A	93.3	Very high	88.3	Confident	53 Å²	53	81.4 Å²	81.4	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-45.9	177.1	0	0	0	0	0	111.6	G37 S38 Y43 V44 V45	G37-A41 WeakPolarHBondContact O-CB 3.49Å; G37-A41 PolarHBondContact O-N 3.31Å; S38-A41 PolarHBondContact O-N 2.93Å; A41-Y43 VanDerWaalsContact C-N 3.34Å; A41-Y43 PolarHBondContact O-N 2.79Å; A41-V44 PolarHBondContact O-N 2.77Å; A41-V45 VanDerWaalsContact O-CG2 3.3Å; A41-V45 WeakPolarHBondContact O-CG2 3.24Å; A41-V45 PolarHBondContact O-N 2.97Å
42	L	94.6	Very high	87.1	Confident	112 Å²	112	80.5 Å²	80.5	59%	0.586	50%	0.497	S	S	*	.	H	α-helix	trans	-60.7	-42.9	175.8	-179.6	62.8	0	0	0	111.6	S38 L39 V40 V45 A46	S38-L42 VanDerWaalsContact O-CB 3.29Å; S38-L42 WeakPolarHBondContact O-CB 3.34Å; S38-L42 PolarHBondContact O-N 2.94Å; L39-L42 PolarHBondContact O-N 2.88Å; V40-L42 PolarHBondContact O-N 3.31Å; L42-V45 PolarHBondContact O-N 3.04Å; L42-A46 WeakPolarHBondContact O-CB 3.28Å; L42-A46 PolarHBondContact O-N 2.9Å
43	Y	90.3	Very high	85.9	Confident	173 Å²	173	79.6 Å²	79.6	68%	0.678	50%	0.5	S	S	*	.	H	α-helix	trans	-62.7	-46.7	176.5	-179.1	-94.6	0	0	0	111.7	L39 V40 A41 V45 A46 A47	L39-Y43 WeakPolarHBondContact O-CB 3.46Å; L39-Y43 PolarHBondContact O-N 2.89Å; V40-Y43 PolarHBondContact O-N 2.91Å; A41-Y43 VanDerWaalsContact C-N 3.34Å; A41-Y43 PolarHBondContact O-N 2.79Å; Y43-V45 VanDerWaalsContact C-N 3.29Å; Y43-V45 PolarHBondContact O-N 3.25Å; Y43-A46 PolarHBondContact O-N 3.08Å; Y43-A47 HydrophobicContact CE1-CB 4.3Å; Y43-A47 WeakPolarHBondContact O-CB 3.41Å; Y43-A47 PolarHBondContact O-N 2.91Å
44	V	92.2	Very high	84.4	Confident	96 Å²	96	83.8 Å²	83.8	58%	0.582	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-39.1	178	170.3	0	0	0	0	111.4	V40 A41 P48	V40-V44 HydrophobicContact CG1-CG2 4.39Å; V40-V44 VanDerWaalsContact O-CG2 3.3Å; V40-V44 WeakPolarHBondContact O-CG2 3.43Å; V40-V44 PolarHBondContact O-N 2.88Å; A41-V44 PolarHBondContact O-N 2.77Å; V44-P48 WeakPolarHBondContact O-CD 3.41Å
45	V	91.3	Very high	83	Confident	91 Å²	91	85.3 Å²	85.3	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-71.9	-43.2	177	173.7	0	0	0	0	111.5	A41 L42 Y43 P48 F49	A41-V45 VanDerWaalsContact O-CG2 3.3Å; A41-V45 WeakPolarHBondContact O-CG2 3.24Å; A41-V45 PolarHBondContact O-N 2.97Å; L42-V45 PolarHBondContact O-N 3.04Å; Y43-V45 VanDerWaalsContact C-N 3.29Å; Y43-V45 PolarHBondContact O-N 3.25Å; V45-P48 WeakPolarHBondContact O-CD 3.24Å; V45-P48 WeakPolarHBondContact O-CG 3.37Å; V45-F49 WeakPolarHBondContact O-CD2 3.4Å; V45-F49 WeakPolarHBondContact O-CE2 3.22Å
46	A	86.8	Confident	81.3	Confident	37 Å²	37	93.5 Å²	93.5	31%	0.306	53%	0.528	S	S	.	.	H	α-helix	trans	-80	-34.3	-174.3	0	0	0	0	0	113.8	L42 Y43 F49 V50	L42-A46 WeakPolarHBondContact O-CB 3.28Å; L42-A46 PolarHBondContact O-N 2.9Å; Y43-A46 PolarHBondContact O-N 3.08Å; A46-F49 PolarHBondContact O-N 3.03Å; A46-V50 PolarHBondContact O-N 2.86Å
47	A	82.1	Confident	79.5	Confident	30 Å²	30	94.5 Å²	94.5	25%	0.248	53%	0.528	C	S	.	.	H	α-helix	trans	-50.3	-46.1	-178.2	0	0	0	0	0	114.3	Y43 F49 V50 A51	Y43-A47 HydrophobicContact CE1-CB 4.3Å; Y43-A47 WeakPolarHBondContact O-CB 3.41Å; Y43-A47 PolarHBondContact O-N 2.91Å; A47-F49 VanDerWaalsContact C-N 3.25Å; A47-F49 PolarHBondContact O-N 2.71Å; A47-V50 PolarHBondContact O-N 3.11Å; A47-A51 WeakPolarHBondContact O-CB 3.31Å; A47-A51 PolarHBondContact O-N 2.83Å
48	P	78.2	Confident	77.8	Confident	81 Å²	81	97.1 Å²	97.1	53%	0.526	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-22.8	177.8	24.5	-34.2	0	0	0	114.1	V44 V45 P52	V44-P48 WeakPolarHBondContact O-CD 3.41Å; V45-P48 WeakPolarHBondContact O-CD 3.24Å; V45-P48 WeakPolarHBondContact O-CG 3.37Å; P48-P52 WeakPolarHBondContact O-CD 3.28Å; P48-P52 WeakPolarHBondContact O-CG 3.23Å
49	F	79.4	Confident	76.2	Confident	163 Å²	163	97.2 Å²	97.2	72%	0.715	53%	0.534	S	S	*	.	H	α-helix	trans	-84.4	-30.7	175.8	-60.3	-83	0	0	0	112.4	V45 A46 A47	V45-F49 WeakPolarHBondContact O-CD2 3.4Å; V45-F49 WeakPolarHBondContact O-CE2 3.22Å; A46-F49 PolarHBondContact O-N 3.03Å; A47-F49 VanDerWaalsContact C-N 3.25Å; A47-F49 PolarHBondContact O-N 2.71Å
50	V	73.8	Confident	74.9	Confident	78 Å²	78	96.8 Å²	96.8	47%	0.473	54%	0.537	S	S	.	.	H	α-helix	trans	-88.4	-34	179.7	-178.5	0	0	0	0	112.2	A46 A47 P52 A53 L54	A46-V50 PolarHBondContact O-N 2.86Å; A47-V50 PolarHBondContact O-N 3.11Å; V50-P52 VanDerWaalsContact C-CD 3.46Å; V50-A53 WeakPolarHBondContact O-CB 3.31Å; V50-A53 PolarHBondContact O-N 3.14Å; V50-L54 HydrophobicContact CG1-CD1 4.1Å; V50-L54 HydrophobicContact CG1-CG 4.28Å; V50-L54 PolarHBondContact O-N 2.92Å
51	A	68.1	Low	73.7	Confident	50 Å²	50	97 Å²	97	41%	0.413	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-37.3	-176.2	0	0	0	0	0	114.8	A47 A53 L54	A47-A51 WeakPolarHBondContact O-CB 3.31Å; A47-A51 PolarHBondContact O-N 2.83Å; A51-A53 VanDerWaalsContact C-N 3.31Å; A51-A53 PolarHBondContact O-N 2.65Å; A51-L54 PolarHBondContact O-N 2.91Å
52	P	64.5	Low	72.9	Confident	59 Å²	59	98.3 Å²	98.3	38%	0.383	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-34.8	173.6	-23	34.5	0	0	0	113.1	P48 V50 L54 R55	P48-P52 WeakPolarHBondContact O-CD 3.28Å; P48-P52 WeakPolarHBondContact O-CG 3.23Å; V50-P52 VanDerWaalsContact C-CD 3.46Å; P52-L54 VanDerWaalsContact C-N 3.29Å; P52-L54 PolarHBondContact O-N 2.81Å; P52-R55 WeakPolarHBondContact O-CB 3.19Å; P52-R55 PolarHBondContact O-N 3.46Å
53	A	61.3	Low	72.1	Confident	83 Å²	83	95.9 Å²	95.9	69%	0.686	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.6	-179.5	0	0	0	0	0	113.3	V50 A51 R55	V50-A53 WeakPolarHBondContact O-CB 3.31Å; V50-A53 PolarHBondContact O-N 3.14Å; A51-A53 VanDerWaalsContact C-N 3.31Å; A51-A53 PolarHBondContact O-N 2.65Å; A53-R55 VanDerWaalsContact C-N 3.34Å
54	L	61.1	Low	71.6	Confident	137 Å²	137	88 Å²	88	72%	0.717	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	1.7	175.4	-64.5	174.6	0	0	0	113.3	V50 A51 P52 R56	V50-L54 HydrophobicContact CG1-CD1 4.1Å; V50-L54 HydrophobicContact CG1-CG 4.28Å; V50-L54 PolarHBondContact O-N 2.92Å; A51-L54 PolarHBondContact O-N 2.91Å; P52-L54 VanDerWaalsContact C-N 3.29Å; P52-L54 PolarHBondContact O-N 2.81Å; L54-R56 PolarHBondContact O-N 3.27Å
55	R	64.1	Low	71.4	Confident	121 Å²	121	85.9 Å²	85.9	46%	0.457	48%	0.482	S	S	.	.			trans	-75.4	119.6	173.8	-64	-175.4	-176.8	168.7	0.2	108.7	P52 A53 V57	P52-R55 WeakPolarHBondContact O-CB 3.19Å; P52-R55 PolarHBondContact O-N 3.46Å; A53-R55 VanDerWaalsContact C-N 3.34Å; R55-V57 PolarHBondContact O-N 2.99Å
56	R	57.1	Low	71.3	Confident	252 Å²	252	86.4 Å²	86.4	95%	0.951	49%	0.486	S	S	*	.	S	Bend	trans	-56.3	-22.1	-176.2	-79.9	-175.3	-178.2	157.5	-0.4	114.8	L54	L54-R56 PolarHBondContact O-N 3.27Å
57	V	56.7	Low	71.4	Confident	53 Å²	53	86.7 Å²	86.7	32%	0.321	49%	0.488	S	S	.	.			trans	-135.6	107.2	-178.8	-175	0	0	0	0	108.8	R55 L59	R55-V57 PolarHBondContact O-N 2.99Å; V57-L59 HydrophobicContact CG1-CD2 3.63Å; V57-L59 HydrophobicContact CG1-CG 4.11Å
58	C	55.9	Low	71.9	Confident	96 Å²	96	85.4 Å²	85.4	65%	0.649	48%	0.477	S	S	*	.			trans	-103.2	106.2	167.9	-74.1	0	0	0	0	107.9
59	L	60.7	Low	72.6	Confident	70 Å²	70	82.5 Å²	82.5	37%	0.366	46%	0.458	S	S	.	.			trans	-79.4	121.2	175.2	-57.5	-179.8	0	0	0	108.6	V57 F61 V153 M156	V57-L59 HydrophobicContact CG1-CD2 3.63Å; V57-L59 HydrophobicContact CG1-CG 4.11Å; L59-F61 PolarHBondContact O-N 3.02Å; L59-V153 HydrophobicContact CD2-CB 3.98Å; L59-V153 HydrophobicContact CD2-CG1 3.55Å; L59-V153 HydrophobicContact CD2-CG2 3.24Å; L59-M156 HydrophobicContact CD1-CE 4.17Å
60	P	67.3	Low	73.4	Confident	101 Å²	101	79.8 Å²	79.8	66%	0.656	45%	0.447	S	S	*	.			trans	-63.3	133.2	170.5	26.8	-32	0	0	0	108.8	V62	P60-V62 PolarHBondContact O-N 3.27Å; P60-V62 VanDerWaalsContact O-N 3.07Å
61	F	69.4	Low	74.4	Confident	100 Å²	100	76.7 Å²	76.7	44%	0.439	43%	0.428	S	S	.	.			trans	-66.9	111	175.1	172.4	-108.5	0	0	0	109.3	L59 P63 D90 L113	L59-F61 PolarHBondContact O-N 3.02Å; F61-P63 HydrophobicContact CE1-CB 4.38Å; F61-P63 HydrophobicContact CE1-CG 4.47Å; F61-P63 HydrophobicContact CZ-CB 4Å; F61-D90 HydrophobicContact CE2-CB 4.37Å; F61-D90 HydrophobicContact CZ-CB 3.93Å; F61-L113 HydrophobicContact CB-CD1 4.16Å; F61-L113 HydrophobicContact CD2-CD1 3.8Å; F61-L113 HydrophobicContact CE2-CD1 4.41Å; F61-L113 HydrophobicContact CG-CD1 3.93Å
62	V	75.6	Confident	75.8	Confident	82 Å²	82	74.3 Å²	74.3	50%	0.497	41%	0.408	S	S	.	.			trans	-120.7	112.8	172.3	-178.4	0	0	0	0	107.3	P60 A64	P60-V62 PolarHBondContact O-N 3.27Å; P60-V62 VanDerWaalsContact O-N 3.07Å; V62-A64 PolarHBondContact O-N 2.99Å
63	P	78.8	Confident	77.3	Confident	60 Å²	60	73.2 Å²	73.2	39%	0.39	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-65.6	133.5	-178.2	24.2	-31.3	0	0	0	111	F61 R92	F61-P63 HydrophobicContact CE1-CB 4.38Å; F61-P63 HydrophobicContact CE1-CG 4.47Å; F61-P63 HydrophobicContact CZ-CB 4Å; P63-R92 VanDerWaalsContact CB-CZ 3.46Å
64	A	80.6	Confident	78.9	Confident	8 Å²	8	73.9 Å²	73.9	7%	0.066	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-61.4	136.5	173.5	0	0	0	0	0	110.8	V62 Q68 V69 R92 F151	V62-A64 PolarHBondContact O-N 2.99Å; A64-Q68 HydrophobicContact CB-CB 4.33Å; A64-Q68 HydrophobicContact CB-CG 4.29Å; A64-V69 HydrophobicContact CB-CG2 4.44Å; A64-R92 WeakPolarHBondContact O-CD 3.26Å; A64-R92 PolarHBondContact O-NH1 2.81Å; A64-F151 HydrophobicContact CB-CD2 4.12Å; A64-F151 HydrophobicContact CB-CE2 3.66Å
65	T	86.3	Confident	80.6	Confident	52 Å²	52	68.4 Å²	68.4	32%	0.319	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-64.9	162.2	179.5	71.6	0	0	0	0	111	A67 Q68 V69 D195	T65-A67 PolarHBondContact O-N 2.95Å; T65-Q68 PolarHBondContact O-N 3.47Å; T65-Q68 WeakPolarHBondContact OG1-CB 3.48Å; T65-Q68 PolarHBondContact OG1-N 3.09Å; T65-V69 WeakPolarHBondContact O-CG2 3.24Å; T65-V69 PolarHBondContact O-N 3.27Å; T65-D195 WeakPolarHBondContact CG2-OD1 3.23Å; T65-D195 VanDerWaalsContact OG1-CG 3.32Å; T65-D195 PolarHBondContact OG1-OD1 3.1Å
66	T	88.9	Confident	82.1	Confident	102 Å²	102	62.8 Å²	62.8	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-58.9	-40.6	173.9	-50	0	0	0	0	111.3	Q68 V69 E70	T66-Q68 VanDerWaalsContact C-N 3.31Å; T66-Q68 PolarHBondContact O-N 3.46Å; T66-V69 PolarHBondContact O-N 2.64Å; T66-E70 WeakPolarHBondContact O-CG 3.49Å; T66-E70 PolarHBondContact O-N 3.16Å
67	A	90.8	Very high	83.9	Confident	42 Å²	42	60.3 Å²	60.3	35%	0.347	33%	0.326	S	S	.	.	H	α-helix	trans	-59.6	-41.9	176	0	0	0	0	0	111.8	T65 E70 N71	T65-A67 PolarHBondContact O-N 2.95Å; A67-E70 PolarHBondContact O-N 3.48Å; A67-N71 WeakPolarHBondContact O-CB 3.28Å; A67-N71 PolarHBondContact O-N 3.15Å; A67-N71 PolarHBondContact O-ND2 3.43Å
68	Q	91.4	Very high	85.7	Confident	3 Å²	3	63.1 Å²	63.1	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-41.6	177.5	-169.5	148.2	45.7	0	0	112.6	A64 T65 T66 E70 N71 V72 F151 I194 D195	A64-Q68 HydrophobicContact CB-CB 4.33Å; A64-Q68 HydrophobicContact CB-CG 4.29Å; T65-Q68 PolarHBondContact O-N 3.47Å; T65-Q68 WeakPolarHBondContact OG1-CB 3.48Å; T65-Q68 PolarHBondContact OG1-N 3.09Å; T66-Q68 VanDerWaalsContact C-N 3.31Å; T66-Q68 PolarHBondContact O-N 3.46Å; Q68-E70 VanDerWaalsContact C-N 3.32Å; Q68-E70 PolarHBondContact O-N 2.89Å; Q68-N71 PolarHBondContact O-N 3.17Å; Q68-V72 WeakPolarHBondContact O-CG2 3.35Å; Q68-V72 PolarHBondContact O-N 3.33Å; Q68-F151 VanDerWaalsContact CD-CE2 3.43Å; Q68-F151 HydrophobicContact CG-CE2 4.29Å; Q68-I194 PolarHBondContact NE2-O 3.37Å; Q68-D195 HydrophobicContact CB-CB 4.4Å
69	V	94.1	Very high	87.6	Confident	21 Å²	21	61.9 Å²	61.9	13%	0.127	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-46.1	173.3	175.8	0	0	0	0	110.1	A64 T65 T66 N71 V72 L73 R92 I93 A96	A64-V69 HydrophobicContact CB-CG2 4.44Å; T65-V69 WeakPolarHBondContact O-CG2 3.24Å; T65-V69 PolarHBondContact O-N 3.27Å; T66-V69 PolarHBondContact O-N 2.64Å; V69-N71 PolarHBondContact O-N 3.14Å; V69-V72 PolarHBondContact O-N 3.17Å; V69-L73 HydrophobicContact CG1-CD1 4.17Å; V69-L73 HydrophobicContact CG1-CG 4.4Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.43Å; V69-L73 PolarHBondContact O-N 2.66Å; V69-R92 HydrophobicContact CG2-CG 4.03Å; V69-I93 HydrophobicContact CB-CD1 4.09Å; V69-I93 HydrophobicContact CG1-CD1 4.16Å; V69-I93 HydrophobicContact CG2-CD1 3.7Å; V69-A96 HydrophobicContact CG1-CB 4.03Å
70	E	94.9	Very high	89.3	Confident	105 Å²	105	63.8 Å²	63.8	49%	0.491	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-41.1	178.5	-73.7	175.7	-170	0	0	112.9	T66 A67 Q68 L73 R74	T66-E70 WeakPolarHBondContact O-CG 3.49Å; T66-E70 PolarHBondContact O-N 3.16Å; A67-E70 PolarHBondContact O-N 3.48Å; Q68-E70 VanDerWaalsContact C-N 3.32Å; Q68-E70 PolarHBondContact O-N 2.89Å; E70-L73 PolarHBondContact O-N 3.48Å; E70-R74 WeakPolarHBondContact O-CB 3.3Å; E70-R74 PolarHBondContact O-N 3.49Å
71	N	95.9	Very high	90.7	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.07	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-45.2	176.2	-68.2	-21.3	0	0	0	111.1	A67 Q68 V69 L73 R74 V75 E190 G191 D195 V197	A67-N71 WeakPolarHBondContact O-CB 3.28Å; A67-N71 PolarHBondContact O-N 3.15Å; A67-N71 PolarHBondContact O-ND2 3.43Å; Q68-N71 PolarHBondContact O-N 3.17Å; V69-N71 PolarHBondContact O-N 3.14Å; N71-L73 PolarHBondContact O-N 3.41Å; N71-R74 WeakPolarHBondContact O-CB 3.46Å; N71-R74 PolarHBondContact O-N 2.69Å; N71-R74 PolarHBondContact OD1-NH1 3.36Å; N71-V75 PolarHBondContact O-N 3.35Å; N71-V75 VanDerWaalsContact O-N 3.1Å; N71-E190 HydrophobicContact CB-CB 4.46Å; N71-G191 WeakPolarHBondContact ND2-CA 3.34Å; N71-D195 PolarHBondContact ND2-O 3.08Å; N71-V197 HydrophobicContact CB-CB 4.48Å; N71-V197 HydrophobicContact CB-CG2 3.77Å
72	V	96.1	Very high	92.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-46.9	174.3	169.8	0	0	0	0	110.9	Q68 V69 R74 V75 L76 I93 V149 V175 V197	Q68-V72 WeakPolarHBondContact O-CG2 3.35Å; Q68-V72 PolarHBondContact O-N 3.33Å; V69-V72 PolarHBondContact O-N 3.17Å; V72-R74 VanDerWaalsContact C-N 3.3Å; V72-R74 PolarHBondContact O-N 3.42Å; V72-V75 WeakPolarHBondContact O-CG2 3.39Å; V72-V75 PolarHBondContact O-N 3.08Å; V72-L76 HydrophobicContact CG1-CD1 3.68Å; V72-L76 HydrophobicContact CG1-CG 4.44Å; V72-L76 WeakPolarHBondContact O-CB 3.48Å; V72-L76 VanDerWaalsContact O-CG 3.26Å; V72-L76 WeakPolarHBondContact O-CG 3.37Å; V72-L76 PolarHBondContact O-N 2.95Å; V72-L76 VanDerWaalsContact O-N 3.09Å; V72-I93 HydrophobicContact CB-CD1 4.22Å; V72-I93 HydrophobicContact CG1-CD1 4.24Å; V72-I93 HydrophobicContact CG1-CG2 4.23Å; V72-I93 HydrophobicContact CG2-CD1 4.32Å; V72-V149 HydrophobicContact CG1-CG1 4.15Å; V72-V149 HydrophobicContact CG1-CG2 3.99Å; V72-V149 HydrophobicContact CG2-CG1 4.45Å; V72-V175 HydrophobicContact CG1-CG1 4.44Å; V72-V175 HydrophobicContact CG2-CG1 4.24Å; V72-V197 HydrophobicContact CG2-CG1 4.23Å; V72-V197 HydrophobicContact CG2-CG2 3.83Å
73	L	96.1	Very high	93.2	Very high	36 Å²	36	54.4 Å²	54.4	19%	0.188	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-38	177.7	-67.4	178	0	0	0	111.6	V69 E70 N71 L76 R77 A96	V69-L73 HydrophobicContact CG1-CD1 4.17Å; V69-L73 HydrophobicContact CG1-CG 4.4Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.43Å; V69-L73 PolarHBondContact O-N 2.66Å; E70-L73 PolarHBondContact O-N 3.48Å; N71-L73 PolarHBondContact O-N 3.41Å; L73-L76 CarbonylContact O-C 3.59Å; L73-L76 PolarHBondContact O-N 2.97Å; L73-R77 VanDerWaalsContact O-CG 3.28Å; L73-R77 WeakPolarHBondContact O-CG 3.41Å; L73-R77 PolarHBondContact O-N 2.98Å; L73-A96 HydrophobicContact CD1-CB 4Å; L73-A96 HydrophobicContact CD2-CB 4.06Å; L73-A96 HydrophobicContact CG-CB 4.42Å
74	R	96.2	Very high	94.1	Very high	98 Å²	98	51.5 Å²	51.5	37%	0.37	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-47.5	178.8	-167.3	-178.4	-58.1	117.9	10.1	111.4	E70 N71 V72 L76 R77 E190	E70-R74 WeakPolarHBondContact O-CB 3.3Å; E70-R74 PolarHBondContact O-N 3.49Å; N71-R74 WeakPolarHBondContact O-CB 3.46Å; N71-R74 PolarHBondContact O-N 2.69Å; N71-R74 PolarHBondContact OD1-NH1 3.36Å; V72-R74 VanDerWaalsContact C-N 3.3Å; V72-R74 PolarHBondContact O-N 3.42Å; R74-L76 VanDerWaalsContact C-N 3.27Å; R74-L76 PolarHBondContact O-N 3.43Å; R74-R77 WeakPolarHBondContact O-CB 3.44Å; R74-R77 PolarHBondContact O-N 3.45Å; R74-E190 WeakPolarHBondContact CD-OE2 3.48Å; R74-E190 IonicContact NH1-OE2 2.74Å; R74-E190 PolarHBondContact NH1-OE2 2.97Å
75	V	96.3	Very high	94.9	Very high	22 Å²	22	51.4 Å²	51.4	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-69.2	-26.2	177.4	-59.7	0	0	0	0	112.9	N71 V72 P78 V175 E190 V197 V199	N71-V75 PolarHBondContact O-N 3.35Å; N71-V75 VanDerWaalsContact O-N 3.1Å; V72-V75 WeakPolarHBondContact O-CG2 3.39Å; V72-V75 PolarHBondContact O-N 3.08Å; V75-P78 WeakPolarHBondContact O-CD 3.47Å; V75-V175 HydrophobicContact CG2-CG1 3.84Å; V75-V175 HydrophobicContact CG2-CG2 3.97Å; V75-E190 HydrophobicContact CG1-CB 3.84Å; V75-E190 HydrophobicContact CG1-CG 3.33Å; V75-V197 HydrophobicContact CG2-CG1 4.16Å; V75-V199 HydrophobicContact CB-CG2 3.69Å; V75-V199 HydrophobicContact CG1-CG2 3.58Å; V75-V199 HydrophobicContact CG2-CG2 4.05Å
76	L	95.6	Very high	95.4	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-86.4	-13	177.2	-68.9	173.8	0	0	0	113.8	V72 L73 R74 P78 R79 L83 F102 N147 V149 V175	V72-L76 HydrophobicContact CG1-CD1 3.68Å; V72-L76 HydrophobicContact CG1-CG 4.44Å; V72-L76 WeakPolarHBondContact O-CB 3.48Å; V72-L76 VanDerWaalsContact O-CG 3.26Å; V72-L76 WeakPolarHBondContact O-CG 3.37Å; V72-L76 PolarHBondContact O-N 2.95Å; V72-L76 VanDerWaalsContact O-N 3.09Å; L73-L76 CarbonylContact O-C 3.59Å; L73-L76 PolarHBondContact O-N 2.97Å; R74-L76 VanDerWaalsContact C-N 3.27Å; R74-L76 PolarHBondContact O-N 3.43Å; L76-P78 VanDerWaalsContact C-N 3.34Å; L76-R79 WeakPolarHBondContact O-CA 3.44Å; L76-R79 VanDerWaalsContact O-CB 3.28Å; L76-R79 WeakPolarHBondContact O-CB 3.45Å; L76-R79 PolarHBondContact O-N 3.08Å; L76-L83 HydrophobicContact CD1-CD1 3.48Å; L76-L83 VanDerWaalsContact CD1-CD1 3.48Å; L76-L83 HydrophobicContact CD2-CD1 4.26Å; L76-F102 HydrophobicContact CB-CE2 4.44Å; L76-F102 HydrophobicContact CB-CZ 4.15Å; L76-F102 WeakPolarHBondContact O-CZ 3.48Å; L76-N147 HydrophobicContact CD2-CB 4.27Å; L76-V149 HydrophobicContact CD1-CG2 4.05Å; L76-V175 HydrophobicContact CD2-CG2 4.01Å; L76-V175 HydrophobicContact CG-CG2 4.47Å
77	R	94.3	Very high	95.5	Very high	201 Å²	201	45.5 Å²	45.5	76%	0.758	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-42.5	179.4	-75.1	-173.9	-175.5	-171.5	0.3	115.2	L73 R74 R79	L73-R77 VanDerWaalsContact O-CG 3.28Å; L73-R77 WeakPolarHBondContact O-CG 3.41Å; L73-R77 PolarHBondContact O-N 2.98Å; R74-R77 WeakPolarHBondContact O-CB 3.44Å; R74-R77 PolarHBondContact O-N 3.45Å; R77-R79 PolarHBondContact O-N 3.37Å
78	P	94.6	Very high	95.7	Very high	112 Å²	112	43.8 Å²	43.8	73%	0.727	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	2.1	179.9	32.5	-35.6	0	0	0	113.4	V75 L76	V75-P78 WeakPolarHBondContact O-CD 3.47Å; L76-P78 VanDerWaalsContact C-N 3.34Å
79	R	95.8	Very high	95.7	Very high	69 Å²	69	43.8 Å²	43.8	26%	0.26	23%	0.233	S	C	.	.			trans	-106.2	159.8	-174.4	-60.9	-66.7	-60.3	152.5	-3.2	111.2	L76 R77 F102 S146 N147 S171	L76-R79 WeakPolarHBondContact O-CA 3.44Å; L76-R79 VanDerWaalsContact O-CB 3.28Å; L76-R79 WeakPolarHBondContact O-CB 3.45Å; L76-R79 PolarHBondContact O-N 3.08Å; R77-R79 PolarHBondContact O-N 3.37Å; R79-F102 HydrophobicContact CB-CE1 4.03Å; R79-F102 HydrophobicContact CB-CZ 3.9Å; R79-F102 WeakPolarHBondContact O-CZ 3.35Å; R79-S146 PolarHBondContact NH2-O 3.29Å; R79-S146 VanDerWaalsContact NH2-O 3.15Å; R79-N147 PolarHBondContact NE-OD1 3.33Å; R79-N147 PolarHBondContact NH2-OD1 3.36Å; R79-S171 PolarHBondContact NH2-O 3.09Å
80	T	96.5	Very high	95.7	Very high	111 Å²	111	43.3 Å²	43.3	68%	0.681	23%	0.23	S	C	*	.			trans	-144.2	177.7	173.1	59	0	0	0	0	109.3	S146 N147	T80-S146 PolarHBondContact O-OG 3.48Å; T80-N147 PolarHBondContact O-ND2 2.92Å
81	G	96.8	Very high	95.7	Very high	35 Å²	35	38.3 Å²	38.3	36%	0.361	21%	0.206	S	C	.	.	S	Bend	trans	100.3	-149.4	171.8	0	0	0	0	0	113.8	Q103	G81-Q103 PolarHBondContact O-N 3.03Å; G81-Q103 VanDerWaalsContact O-N 3.09Å
82	T	98.2	Very high	95.8	Very high	50 Å²	50	41.2 Å²	41.2	31%	0.307	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	137.6	-179.2	53	0	0	0	0	110.4	Q103 Q144 Y145 S146 N147	T82-Q103 WeakPolarHBondContact CA-O 3.47Å; T82-Q103 HydrophobicContact CG2-CB 4.38Å; T82-Q144 PolarHBondContact OG1-O 3.32Å; T82-Y145 WeakPolarHBondContact OG1-CA 3.36Å; T82-S146 PolarHBondContact N-OG 2.87Å; T82-S146 PolarHBondContact O-N 3.16Å; T82-S146 PolarHBondContact O-OG 3.39Å; T82-S146 PolarHBondContact OG1-N 3.32Å; T82-S146 VanDerWaalsContact OG1-N 3.1Å; T82-S146 PolarHBondContact OG1-OG 2.99Å; T82-N147 PolarHBondContact O-N 3.48Å; T82-N147 PolarHBondContact O-ND2 3Å; T82-N147 VanDerWaalsContact O-ND2 3.08Å
83	L	98.5	Very high	95.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139.8	177.6	-178	145.8	0	0	0	110.2	L76 A97 F102 Q103 A104 S105 N147 V149	L76-L83 HydrophobicContact CD1-CD1 3.48Å; L76-L83 VanDerWaalsContact CD1-CD1 3.48Å; L76-L83 HydrophobicContact CD2-CD1 4.26Å; L83-A97 HydrophobicContact CD1-CB 4.06Å; L83-A97 HydrophobicContact CD2-CB 4.24Å; L83-F102 HydrophobicContact CB-CB 4.27Å; L83-F102 HydrophobicContact CB-CD1 4.07Å; L83-F102 HydrophobicContact CB-CG 4.44Å; L83-F102 HydrophobicContact CD1-CD1 4.3Å; L83-Q103 PolarHBondContact N-O 3.09Å; L83-A104 HydrophobicContact CB-CB 4.46Å; L83-A104 HydrophobicContact CD2-CB 4.2Å; L83-A104 CarbonylContact O-C 3.56Å; L83-A104 WeakPolarHBondContact O-CA 3.34Å; L83-S105 PolarHBondContact O-N 2.76Å; L83-N147 CarbonylContact C-O 3.49Å; L83-N147 VanDerWaalsContact CA-O 3.28Å; L83-N147 WeakPolarHBondContact CA-O 3.12Å; L83-N147 HydrophobicContact CB-CB 4.23Å; L83-N147 HydrophobicContact CD1-CB 4.11Å; L83-N147 HydrophobicContact CG-CB 4.21Å; L83-V149 HydrophobicContact CD1-CG2 4.07Å; L83-V149 HydrophobicContact CD2-CG2 4.39Å; L83-V149 HydrophobicContact CG-CG2 4.43Å
84	V	98.4	Very high	95.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.8	167.7	64.4	0	0	0	0	110.9	S105 L107 F142 Y145 N147 V148 V149	V84-S105 CarbonylContact C-O 3.49Å; V84-S105 VanDerWaalsContact CA-O 3.23Å; V84-S105 WeakPolarHBondContact CA-O 3.16Å; V84-L107 HydrophobicContact CG2-CD1 4.03Å; V84-L107 HydrophobicContact CG2-CG 3.82Å; V84-F142 HydrophobicContact CG1-CD1 4.06Å; V84-F142 HydrophobicContact CG1-CE1 4.35Å; V84-F142 HydrophobicContact CG2-CE1 4.43Å; V84-Y145 HydrophobicContact CB-CD1 3.66Å; V84-Y145 HydrophobicContact CB-CD2 3.65Å; V84-Y145 HydrophobicContact CB-CE1 3.68Å; V84-Y145 HydrophobicContact CB-CE2 3.64Å; V84-Y145 HydrophobicContact CB-CG 3.65Å; V84-Y145 HydrophobicContact CG1-CD1 4.09Å; V84-Y145 HydrophobicContact CG1-CD2 3.5Å; V84-Y145 VanDerWaalsContact CG1-CD2 3.5Å; V84-Y145 HydrophobicContact CG1-CE2 3.94Å; V84-Y145 HydrophobicContact CG1-CG 3.57Å; V84-Y145 HydrophobicContact CG2-CD2 4.28Å; V84-Y145 HydrophobicContact CG2-CE1 4.34Å; V84-Y145 HydrophobicContact CG2-CE2 3.83Å; V84-N147 PolarHBondContact N-O 3.21Å; V84-V148 HydrophobicContact CG1-CB 4.2Å; V84-V148 HydrophobicContact CG1-CG1 4.1Å; V84-V148 HydrophobicContact CG1-CG2 3.79Å; V84-V148 CarbonylContact O-C 3.46Å; V84-V148 WeakPolarHBondContact O-CA 3.47Å; V84-V149 PolarHBondContact O-N 3.37Å
85	D	97.7	Very high	96	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.3	172.5	-174.7	23.1	0	0	0	109.1	S88 I93 V94 S105 L107 V149	D85-S88 VanDerWaalsContact OD2-CA 3.28Å; D85-S88 WeakPolarHBondContact OD2-CA 3.45Å; D85-S88 WeakPolarHBondContact OD2-CB 3.41Å; D85-I93 HydrophobicContact CB-CG2 4.48Å; D85-I93 WeakPolarHBondContact OD2-CB 3.16Å; D85-V94 HydrophobicContact CB-CG2 3.49Å; D85-V94 VanDerWaalsContact CB-CG2 3.49Å; D85-S105 PolarHBondContact N-O 2.82Å; D85-L107 PolarHBondContact O-N 2.94Å; D85-V149 WeakPolarHBondContact CA-O 3.43Å
86	I	95.6	Very high	96.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.7	-178.2	-55.5	174	0	0	0	108.3	L137 F142 V148 V149 I150 F151 L160 L164	I86-L137 HydrophobicContact CG2-CB 3.79Å; I86-L137 HydrophobicContact CG2-CD2 3.73Å; I86-L137 HydrophobicContact CG2-CG 4.27Å; I86-F142 HydrophobicContact CD1-CE1 3.71Å; I86-F142 HydrophobicContact CD1-CE2 4.37Å; I86-F142 HydrophobicContact CD1-CZ 3.62Å; I86-F142 HydrophobicContact CG1-CE1 3.88Å; I86-F142 HydrophobicContact CG1-CZ 4.08Å; I86-V148 HydrophobicContact CD1-CG1 3.66Å; I86-V148 HydrophobicContact CG1-CG1 4.21Å; I86-V149 PolarHBondContact N-O 2.85Å; I86-I150 HydrophobicContact CB-CB 4.42Å; I86-I150 HydrophobicContact CB-CD1 3.58Å; I86-I150 HydrophobicContact CG2-CD1 3.54Å; I86-F151 PolarHBondContact O-N 3.13Å; I86-L160 HydrophobicContact CD1-CD1 4.18Å; I86-L160 HydrophobicContact CD1-CD2 4.47Å; I86-L164 HydrophobicContact CD1-CD2 4.42Å
87	G	92.2	Very high	96.2	Very high	31 Å²	31	35.3 Å²	35.3	32%	0.32	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	45.1	-171.1	0	0	0	0	0	111.5	G89 L107	G87-G89 PolarHBondContact O-N 2.98Å; G87-L107 WeakPolarHBondContact CA-O 3.24Å; G87-L107 PolarHBondContact N-O 2.78Å
88	S	93.8	Very high	96.4	Very high	6 Å²	6	26.1 Å²	26.1	4%	0.042	16%	0.161	C	C	.	.			trans	-63.4	-17.6	-169.4	63.7	0	0	0	0	115.1	D85 D90 G91 G106 L107	D85-S88 VanDerWaalsContact OD2-CA 3.28Å; D85-S88 WeakPolarHBondContact OD2-CA 3.45Å; D85-S88 WeakPolarHBondContact OD2-CB 3.41Å; S88-D90 PolarHBondContact O-N 3.28Å; S88-D90 VanDerWaalsContact O-N 3.15Å; S88-G91 WeakPolarHBondContact O-CA 3.28Å; S88-G91 PolarHBondContact O-N 2.86Å; S88-G106 WeakPolarHBondContact OG-CA 3.44Å; S88-L107 PolarHBondContact N-O 3.36Å; S88-L107 PolarHBondContact OG-O 2.67Å
89	G	92.6	Very high	96.5	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	-119.4	175.1	0	0	0	0	0	112.5	G87 G91 E108 L113	G87-G89 PolarHBondContact O-N 2.98Å; G89-G91 PolarHBondContact O-N 2.96Å; G89-E108 WeakPolarHBondContact CA-OE2 3.43Å; G89-E108 PolarHBondContact N-OE2 3.24Å; G89-L113 WeakPolarHBondContact O-CB 3.26Å
90	D	93.7	Very high	96.5	Very high	11 Å²	11	27 Å²	27	6%	0.059	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	0.1	177.7	74.3	-12.8	0	0	0	114.2	F61 S88 R92 Y116 S117 R120	F61-D90 HydrophobicContact CE2-CB 4.37Å; F61-D90 HydrophobicContact CZ-CB 3.93Å; S88-D90 PolarHBondContact O-N 3.28Å; S88-D90 VanDerWaalsContact O-N 3.15Å; D90-R92 WeakPolarHBondContact OD1-CG 3.42Å; D90-R92 IonicContact OD1-CZ 3.77Å; D90-R92 PolarHBondContact OD1-N 3.25Å; D90-R92 IonicContact OD1-NE 2.91Å; D90-R92 PolarHBondContact OD1-NE 3.04Å; D90-R92 IonicContact OD1-NH2 3.75Å; D90-R92 IonicContact OD2-CZ 3.36Å; D90-R92 IonicContact OD2-NE 3.23Å; D90-R92 PolarHBondContact OD2-NE 3.38Å; D90-R92 IonicContact OD2-NH2 2.69Å; D90-R92 PolarHBondContact OD2-NH2 3.3Å; D90-Y116 HydrophobicContact CB-CD1 3.97Å; D90-Y116 HydrophobicContact CB-CE1 3.89Å; D90-S117 WeakPolarHBondContact O-CB 3.39Å; D90-R120 VanDerWaalsContact C-NH2 3.31Å; D90-R120 VanDerWaalsContact O-CZ 3.27Å; D90-R120 PolarHBondContact O-NE 2.88Å; D90-R120 PolarHBondContact O-NH2 3.47Å; D90-R120 IonicContact OD1-NH2 3.52Å; D90-R120 PolarHBondContact OD1-NH2 2.84Å; D90-R120 IonicContact OD2-CZ 2.83Å; D90-R120 VanDerWaalsContact OD2-CZ 3.22Å; D90-R120 IonicContact OD2-NH1 3.18Å; D90-R120 PolarHBondContact OD2-NH1 3.15Å; D90-R120 IonicContact OD2-NH2 2.67Å; D90-R120 PolarHBondContact OD2-NH2 3.34Å
91	G	96	Very high	96.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.162	C	C	.	.			trans	79.4	14.7	175	0	0	0	0	0	114.8	S88 G89 I93 V94 I95	S88-G91 WeakPolarHBondContact O-CA 3.28Å; S88-G91 PolarHBondContact O-N 2.86Å; G89-G91 PolarHBondContact O-N 2.96Å; G91-I93 VanDerWaalsContact C-N 3.35Å; G91-I93 PolarHBondContact O-N 3.31Å; G91-V94 PolarHBondContact O-N 3.44Å; G91-I95 WeakPolarHBondContact O-CB 3.31Å; G91-I95 VanDerWaalsContact O-CG1 3.26Å; G91-I95 WeakPolarHBondContact O-CG1 3.26Å; G91-I95 PolarHBondContact O-N 3.06Å
92	R	96.8	Very high	96.6	Very high	74 Å²	74	23.3 Å²	23.3	28%	0.279	15%	0.146	S	C	.	.	H	α-helix	trans	-60	-40.1	-175.3	66.3	-175.9	63.5	-160.1	-6.6	113.6	P63 A64 V69 D90 A96	P63-R92 VanDerWaalsContact CB-CZ 3.46Å; A64-R92 WeakPolarHBondContact O-CD 3.26Å; A64-R92 PolarHBondContact O-NH1 2.81Å; V69-R92 HydrophobicContact CG2-CG 4.03Å; D90-R92 WeakPolarHBondContact OD1-CG 3.42Å; D90-R92 IonicContact OD1-CZ 3.77Å; D90-R92 PolarHBondContact OD1-N 3.25Å; D90-R92 IonicContact OD1-NE 2.91Å; D90-R92 PolarHBondContact OD1-NE 3.04Å; D90-R92 IonicContact OD1-NH2 3.75Å; D90-R92 IonicContact OD2-CZ 3.36Å; D90-R92 IonicContact OD2-NE 3.23Å; D90-R92 PolarHBondContact OD2-NE 3.38Å; D90-R92 IonicContact OD2-NH2 2.69Å; D90-R92 PolarHBondContact OD2-NH2 3.3Å; R92-A96 WeakPolarHBondContact O-CB 3.47Å; R92-A96 PolarHBondContact O-N 2.9Å
93	I	96.9	Very high	96.6	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-69	-47	178.1	-62.8	-68.9	0	0	0	110	V69 V72 D85 G91 I95 A96 A97 V149	V69-I93 HydrophobicContact CB-CD1 4.09Å; V69-I93 HydrophobicContact CG1-CD1 4.16Å; V69-I93 HydrophobicContact CG2-CD1 3.7Å; V72-I93 HydrophobicContact CB-CD1 4.22Å; V72-I93 HydrophobicContact CG1-CD1 4.24Å; V72-I93 HydrophobicContact CG1-CG2 4.23Å; V72-I93 HydrophobicContact CG2-CD1 4.32Å; D85-I93 HydrophobicContact CB-CG2 4.48Å; D85-I93 WeakPolarHBondContact OD2-CB 3.16Å; G91-I93 VanDerWaalsContact C-N 3.35Å; G91-I93 PolarHBondContact O-N 3.31Å; I93-I95 VanDerWaalsContact C-N 3.35Å; I93-I95 PolarHBondContact O-N 3.41Å; I93-A96 PolarHBondContact O-N 3.31Å; I93-A97 VanDerWaalsContact O-CB 3.31Å; I93-A97 WeakPolarHBondContact O-CB 3.24Å; I93-A97 PolarHBondContact O-N 3.2Å; I93-V149 HydrophobicContact CG2-CB 4.33Å; I93-V149 HydrophobicContact CG2-CG1 4.13Å; I93-V149 HydrophobicContact CG2-CG2 4.25Å
94	V	98.1	Very high	96.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.4	-47.6	176.9	-179.4	0	0	0	0	111.5	D85 G91 A98 A104 T130 F132	D85-V94 HydrophobicContact CB-CG2 3.49Å; D85-V94 VanDerWaalsContact CB-CG2 3.49Å; G91-V94 PolarHBondContact O-N 3.44Å; V94-A98 WeakPolarHBondContact O-CB 3.45Å; V94-A98 PolarHBondContact O-N 3.09Å; V94-A104 HydrophobicContact CB-CB 4.45Å; V94-A104 HydrophobicContact CG1-CB 3.68Å; V94-A104 WeakPolarHBondContact O-CB 3.18Å; V94-T130 HydrophobicContact CG1-CG2 3.92Å; V94-F132 HydrophobicContact CB-CE1 3.69Å; V94-F132 HydrophobicContact CB-CZ 3.86Å; V94-F132 HydrophobicContact CG1-CE1 3.67Å; V94-F132 HydrophobicContact CG1-CE2 4.39Å; V94-F132 HydrophobicContact CG1-CZ 3.59Å; V94-F132 HydrophobicContact CG2-CE1 3.88Å
95	I	98.3	Very high	96.6	Very high	12 Å²	12	26.4 Å²	26.4	6%	0.062	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-45.9	178.7	-70.3	166.5	0	0	0	110.5	G91 I93 A98 K99 R120 A121 E124 V126 F132	G91-I95 WeakPolarHBondContact O-CB 3.31Å; G91-I95 VanDerWaalsContact O-CG1 3.26Å; G91-I95 WeakPolarHBondContact O-CG1 3.26Å; G91-I95 PolarHBondContact O-N 3.06Å; I93-I95 VanDerWaalsContact C-N 3.35Å; I93-I95 PolarHBondContact O-N 3.41Å; I95-A98 PolarHBondContact O-N 3.42Å; I95-K99 WeakPolarHBondContact O-CG 3.45Å; I95-K99 PolarHBondContact O-N 3.33Å; I95-R120 HydrophobicContact CD1-CB 3.69Å; I95-A121 HydrophobicContact CD1-CB 4.28Å; I95-A121 HydrophobicContact CG1-CB 4.03Å; I95-E124 HydrophobicContact CG2-CB 4.22Å; I95-E124 HydrophobicContact CG2-CG 4.16Å; I95-V126 HydrophobicContact CB-CG2 4.42Å; I95-V126 HydrophobicContact CG1-CG2 4.34Å; I95-V126 HydrophobicContact CG2-CG2 3.98Å; I95-F132 HydrophobicContact CG1-CZ 4.25Å
96	A	97.6	Very high	96.6	Very high	16 Å²	16	26.2 Å²	26.2	13%	0.132	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-42.5	-179.8	0	0	0	0	0	112.1	V69 L73 R92 I93 A98 K99 C100	V69-A96 HydrophobicContact CG1-CB 4.03Å; L73-A96 HydrophobicContact CD1-CB 4Å; L73-A96 HydrophobicContact CD2-CB 4.06Å; L73-A96 HydrophobicContact CG-CB 4.42Å; R92-A96 WeakPolarHBondContact O-CB 3.47Å; R92-A96 PolarHBondContact O-N 2.9Å; I93-A96 PolarHBondContact O-N 3.31Å; A96-A98 PolarHBondContact O-N 2.91Å; A96-K99 WeakPolarHBondContact O-CB 3.41Å; A96-K99 PolarHBondContact O-N 3.1Å; A96-C100 PolarHBondContact O-N 2.94Å
97	A	97.8	Very high	96.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-42.6	174	0	0	0	0	0	111.6	L83 I93 K99 C100 G101 F102 A104	L83-A97 HydrophobicContact CD1-CB 4.06Å; L83-A97 HydrophobicContact CD2-CB 4.24Å; I93-A97 VanDerWaalsContact O-CB 3.31Å; I93-A97 WeakPolarHBondContact O-CB 3.24Å; I93-A97 PolarHBondContact O-N 3.2Å; A97-K99 VanDerWaalsContact C-N 3.3Å; A97-K99 PolarHBondContact O-N 2.8Å; A97-C100 CarbonylContact O-C 3.58Å; A97-C100 WeakPolarHBondContact O-CA 3.47Å; A97-C100 WeakPolarHBondContact O-CB 3.23Å; A97-C100 PolarHBondContact O-N 2.83Å; A97-G101 PolarHBondContact O-N 2.8Å; A97-F102 HydrophobicContact CB-CB 4.21Å; A97-F102 HydrophobicContact CB-CD2 4.26Å; A97-F102 HydrophobicContact CB-CG 4.42Å; A97-F102 WeakPolarHBondContact O-CD2 3.42Å; A97-F102 PolarHBondContact O-N 3.05Å; A97-A104 HydrophobicContact CB-CB 4.25Å
98	A	98.1	Very high	96.8	Very high	9 Å²	9	26.5 Å²	26.5	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-62.5	-36.4	176.1	0	0	0	0	0	112.6	V94 I95 A96 C100 G101 F102 A104 V126 T130	V94-A98 WeakPolarHBondContact O-CB 3.45Å; V94-A98 PolarHBondContact O-N 3.09Å; I95-A98 PolarHBondContact O-N 3.42Å; A96-A98 PolarHBondContact O-N 2.91Å; A98-C100 PolarHBondContact O-N 3.41Å; A98-G101 PolarHBondContact O-N 3.43Å; A98-F102 WeakPolarHBondContact CA-O 3.11Å; A98-A104 HydrophobicContact CB-CB 4.42Å; A98-V126 HydrophobicContact CB-CB 4.02Å; A98-V126 HydrophobicContact CB-CG1 4.47Å; A98-V126 HydrophobicContact CB-CG2 4.33Å; A98-T130 HydrophobicContact CB-CG2 3.39Å
99	K	97.2	Very high	96.6	Very high	120 Å²	120	29 Å²	29	52%	0.522	16%	0.164	S	C	.	.	H	α-helix	trans	-62.9	-25.7	171.2	-70.3	-178.9	177.5	-173.8	0	113	I95 A96 A97 G101 E124 V126	I95-K99 WeakPolarHBondContact O-CG 3.45Å; I95-K99 PolarHBondContact O-N 3.33Å; A96-K99 WeakPolarHBondContact O-CB 3.41Å; A96-K99 PolarHBondContact O-N 3.1Å; A97-K99 VanDerWaalsContact C-N 3.3Å; A97-K99 PolarHBondContact O-N 2.8Å; K99-G101 VanDerWaalsContact C-N 3.31Å; K99-E124 WeakPolarHBondContact CE-OE2 3.36Å; K99-E124 IonicContact NZ-OE2 3.51Å; K99-E124 PolarHBondContact NZ-OE2 2.89Å; K99-V126 HydrophobicContact CG-CG1 3.71Å
100	C	96.8	Very high	96.5	Very high	79 Å²	79	31.9 Å²	31.9	53%	0.534	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	6.8	172.8	-63.7	0	0	0	0	113.7	A96 A97 A98 F102	A96-C100 PolarHBondContact O-N 2.94Å; A97-C100 CarbonylContact O-C 3.58Å; A97-C100 WeakPolarHBondContact O-CA 3.47Å; A97-C100 WeakPolarHBondContact O-CB 3.23Å; A97-C100 PolarHBondContact O-N 2.83Å; A98-C100 PolarHBondContact O-N 3.41Å; C100-F102 HydrophobicContact CB-CD2 4.11Å; C100-F102 HydrophobicContact CB-CE2 4.24Å
101	G	97	Very high	96.5	Very high	61 Å²	61	34 Å²	34	63%	0.629	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.1	8.9	174.9	0	0	0	0	0	115.6	A97 A98 K99	A97-G101 PolarHBondContact O-N 2.8Å; A98-G101 PolarHBondContact O-N 3.43Å; K99-G101 VanDerWaalsContact C-N 3.31Å
102	F	98.2	Very high	96.3	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.031	23%	0.231	C	C	.	.			trans	-78.3	148.4	174.2	-70	-94.5	0	0	0	112	L76 R79 L83 A97 A98 C100 A104	L76-F102 HydrophobicContact CB-CE2 4.44Å; L76-F102 HydrophobicContact CB-CZ 4.15Å; L76-F102 WeakPolarHBondContact O-CZ 3.48Å; R79-F102 HydrophobicContact CB-CE1 4.03Å; R79-F102 HydrophobicContact CB-CZ 3.9Å; R79-F102 WeakPolarHBondContact O-CZ 3.35Å; L83-F102 HydrophobicContact CB-CB 4.27Å; L83-F102 HydrophobicContact CB-CD1 4.07Å; L83-F102 HydrophobicContact CB-CG 4.44Å; L83-F102 HydrophobicContact CD1-CD1 4.3Å; A97-F102 HydrophobicContact CB-CB 4.21Å; A97-F102 HydrophobicContact CB-CD2 4.26Å; A97-F102 HydrophobicContact CB-CG 4.42Å; A97-F102 WeakPolarHBondContact O-CD2 3.42Å; A97-F102 PolarHBondContact O-N 3.05Å; A98-F102 WeakPolarHBondContact CA-O 3.11Å; C100-F102 HydrophobicContact CB-CD2 4.11Å; C100-F102 HydrophobicContact CB-CE2 4.24Å; F102-A104 PolarHBondContact O-N 2.87Å
103	Q	98.4	Very high	96.2	Very high	100 Å²	100	41.5 Å²	41.5	47%	0.467	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	93.4	162.9	-66.1	-66.4	82.9	0	0	108.1	G81 T82 L83 S129	G81-Q103 PolarHBondContact O-N 3.03Å; G81-Q103 VanDerWaalsContact O-N 3.09Å; T82-Q103 WeakPolarHBondContact CA-O 3.47Å; T82-Q103 HydrophobicContact CG2-CB 4.38Å; L83-Q103 PolarHBondContact N-O 3.09Å; Q103-S129 VanDerWaalsContact OE1-CA 3.3Å; Q103-S129 PolarHBondContact OE1-OG 2.97Å
104	A	98.4	Very high	96.1	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.1	-165.5	0	0	0	0	0	112.3	L83 V94 A97 A98 F102 S129 T130 S131	L83-A104 HydrophobicContact CB-CB 4.46Å; L83-A104 HydrophobicContact CD2-CB 4.2Å; L83-A104 CarbonylContact O-C 3.56Å; L83-A104 WeakPolarHBondContact O-CA 3.34Å; V94-A104 HydrophobicContact CB-CB 4.45Å; V94-A104 HydrophobicContact CG1-CB 3.68Å; V94-A104 WeakPolarHBondContact O-CB 3.18Å; A97-A104 HydrophobicContact CB-CB 4.25Å; A98-A104 HydrophobicContact CB-CB 4.42Å; F102-A104 PolarHBondContact O-N 2.87Å; A104-S129 PolarHBondContact N-O 3.19Å; A104-T130 CarbonylContact O-C 3.55Å; A104-T130 VanDerWaalsContact O-CA 3.22Å; A104-T130 WeakPolarHBondContact O-CA 3.43Å; A104-S131 PolarHBondContact O-N 3.29Å
105	S	98.4	Very high	96.1	Very high	15 Å²	15	48.5 Å²	48.5	11%	0.105	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.6	179.6	-58.1	0	0	0	0	110.7	L83 V84 D85 S131 Y145	L83-S105 PolarHBondContact O-N 2.76Å; V84-S105 CarbonylContact C-O 3.49Å; V84-S105 VanDerWaalsContact CA-O 3.23Å; V84-S105 WeakPolarHBondContact CA-O 3.16Å; D85-S105 PolarHBondContact N-O 2.82Å; S105-S131 CarbonylContact C-O 3.44Å; S105-S131 VanDerWaalsContact CA-O 3.24Å; S105-S131 WeakPolarHBondContact CA-O 3.13Å; S105-S131 WeakPolarHBondContact CB-OG 3.29Å; S105-S131 PolarHBondContact OG-OG 3.2Å; S105-Y145 WeakPolarHBondContact CB-OH 3.37Å
106	G	97.9	Very high	96	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128	174.7	0	0	0	0	0	111.8	S88 S131 F132 H133	S88-G106 WeakPolarHBondContact OG-CA 3.44Å; G106-S131 PolarHBondContact N-O 3.16Å; G106-F132 WeakPolarHBondContact O-CA 3.38Å; G106-H133 PolarHBondContact O-N 3.02Å
107	L	96.5	Very high	96	Very high	9 Å²	9	52.1 Å²	52.1	5%	0.047	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.3	168.6	-56.8	-174.2	0	0	0	109	V84 D85 G87 S88 H133 A140 F142	V84-L107 HydrophobicContact CG2-CD1 4.03Å; V84-L107 HydrophobicContact CG2-CG 3.82Å; D85-L107 PolarHBondContact O-N 2.94Å; G87-L107 WeakPolarHBondContact CA-O 3.24Å; G87-L107 PolarHBondContact N-O 2.78Å; S88-L107 PolarHBondContact N-O 3.36Å; S88-L107 PolarHBondContact OG-O 2.67Å; L107-H133 HydrophobicContact CD2-CB 3.89Å; L107-A140 HydrophobicContact CD1-CB 3.66Å; L107-F142 HydrophobicContact CD1-CE1 3.73Å; L107-F142 HydrophobicContact CD1-CZ 4.17Å
108	E	94	Very high	96	Very high	28 Å²	28	56.6 Å²	56.6	13%	0.131	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143.5	-179.7	172.7	53.8	-115.7	0	0	109.8	G89 N110 L113 V114 H133 I134 S135	G89-E108 WeakPolarHBondContact CA-OE2 3.43Å; G89-E108 PolarHBondContact N-OE2 3.24Å; E108-N110 HydrophobicContact CG-CB 4.33Å; E108-N110 WeakPolarHBondContact OE1-CB 3.21Å; E108-N110 PolarHBondContact OE1-N 3.04Å; E108-L113 HydrophobicContact CG-CB 3.93Å; E108-V114 HydrophobicContact CB-CG2 3.65Å; E108-V114 HydrophobicContact CG-CG2 3.91Å; E108-H133 PolarHBondContact N-O 3.07Å; E108-H133 VanDerWaalsContact N-O 3.09Å; E108-H133 VanDerWaalsContact O-O 3.1Å; E108-I134 CarbonylContact O-C 3.59Å; E108-I134 VanDerWaalsContact O-CA 3.23Å; E108-I134 WeakPolarHBondContact O-CA 3.49Å; E108-S135 PolarHBondContact O-N 2.96Å
109	L	90.7	Very high	96	Very high	58 Å²	58	62.1 Å²	62.1	30%	0.304	30%	0.296	S	S	.	.	S	Bend	trans	-87	-28.3	-179.3	-78.5	174	0	0	0	112.5	P111 D136	L109-P111 VanDerWaalsContact O-CD 3.29Å; L109-P111 WeakPolarHBondContact O-CD 3.3Å; L109-D136 HydrophobicContact CD2-CB 4Å
110	N	90.2	Very high	96	Very high	63 Å²	63	58 Å²	58	34%	0.337	28%	0.278	S	S	.	.			trans	-82.4	112.4	-179.1	-174.3	-21.9	0	0	0	111.2	E108 W112 L113 V114	E108-N110 HydrophobicContact CG-CB 4.33Å; E108-N110 WeakPolarHBondContact OE1-CB 3.21Å; E108-N110 PolarHBondContact OE1-N 3.04Å; N110-W112 VanDerWaalsContact C-N 3.25Å; N110-W112 PolarHBondContact O-N 3.41Å; N110-W112 WeakPolarHBondContact OD1-CB 3.37Å; N110-W112 PolarHBondContact OD1-N 2.89Å; N110-L113 HydrophobicContact CB-CB 4.14Å; N110-L113 HydrophobicContact CB-CD1 3.97Å; N110-L113 HydrophobicContact CB-CG 4.08Å; N110-L113 PolarHBondContact O-N 3.39Å; N110-V114 PolarHBondContact O-N 3.24Å; N110-V114 VanDerWaalsContact O-N 3.16Å
111	P	92.6	Very high	96.1	Very high	57 Å²	57	54.3 Å²	54.3	37%	0.37	25%	0.253	S	S	.	.	H	α-helix	trans	-56.5	-36.9	179.6	-26.2	36.8	0	0	0	113.7	L109 V114 W115 I134	L109-P111 VanDerWaalsContact O-CD 3.29Å; L109-P111 WeakPolarHBondContact O-CD 3.3Å; P111-V114 PolarHBondContact O-N 3.15Å; P111-W115 PolarHBondContact O-N 3.19Å; P111-I134 HydrophobicContact CB-CD1 3.7Å; P111-I134 HydrophobicContact CB-CG1 4.42Å; P111-I134 HydrophobicContact CG-CD1 4.15Å; P111-I134 HydrophobicContact CG-CG2 4.13Å
112	W	92.3	Very high	96.2	Very high	206 Å²	206	59.3 Å²	59.3	78%	0.78	25%	0.253	S	S	*	.	H	α-helix	trans	-66.7	-40.5	-178.1	-59.7	113.6	0	0	0	112.1	N110 V114 W115 Y116	N110-W112 VanDerWaalsContact C-N 3.25Å; N110-W112 PolarHBondContact O-N 3.41Å; N110-W112 WeakPolarHBondContact OD1-CB 3.37Å; N110-W112 PolarHBondContact OD1-N 2.89Å; W112-V114 VanDerWaalsContact C-N 3.34Å; W112-W115 PolarHBondContact O-N 3.08Å; W112-Y116 WeakPolarHBondContact O-CB 3.47Å; W112-Y116 PolarHBondContact O-N 3.44Å
113	L	94.1	Very high	96.1	Very high	25 Å²	25	65.5 Å²	65.5	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-38.6	175.4	-70.9	-179.8	0	0	0	111.2	F61 G89 E108 N110 Y116 S117	F61-L113 HydrophobicContact CB-CD1 4.16Å; F61-L113 HydrophobicContact CD2-CD1 3.8Å; F61-L113 HydrophobicContact CE2-CD1 4.41Å; F61-L113 HydrophobicContact CG-CD1 3.93Å; G89-L113 WeakPolarHBondContact O-CB 3.26Å; E108-L113 HydrophobicContact CG-CB 3.93Å; N110-L113 HydrophobicContact CB-CB 4.14Å; N110-L113 HydrophobicContact CB-CD1 3.97Å; N110-L113 HydrophobicContact CB-CG 4.08Å; N110-L113 PolarHBondContact O-N 3.39Å; L113-Y116 PolarHBondContact O-N 3.43Å; L113-S117 WeakPolarHBondContact O-CB 3.36Å; L113-S117 PolarHBondContact O-N 3.47Å; L113-S117 PolarHBondContact O-OG 2.83Å
114	V	96.5	Very high	96.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-43.6	173.6	172.3	0	0	0	0	112.2	E108 N110 P111 W112 S117 R118 F132 I134	E108-V114 HydrophobicContact CB-CG2 3.65Å; E108-V114 HydrophobicContact CG-CG2 3.91Å; N110-V114 PolarHBondContact O-N 3.24Å; N110-V114 VanDerWaalsContact O-N 3.16Å; P111-V114 PolarHBondContact O-N 3.15Å; W112-V114 VanDerWaalsContact C-N 3.34Å; V114-S117 WeakPolarHBondContact CA-OG 3.37Å; V114-S117 PolarHBondContact O-N 3.48Å; V114-S117 PolarHBondContact O-OG 3.18Å; V114-R118 VanDerWaalsContact O-CG 3.26Å; V114-R118 WeakPolarHBondContact O-CG 3.5Å; V114-R118 PolarHBondContact O-N 2.69Å; V114-F132 HydrophobicContact CG1-CB 3.91Å; V114-I134 HydrophobicContact CB-CG1 3.83Å; V114-I134 HydrophobicContact CG1-CG1 3.81Å; V114-I134 HydrophobicContact CG2-CG1 3.79Å
115	W	96.8	Very high	96.1	Very high	152 Å²	152	67 Å²	67	58%	0.576	30%	0.297	S	S	*	.	H	α-helix	trans	-65.2	-41.8	176.1	-74.5	115.9	0	0	0	111.8	P111 W112 R118 Y119	P111-W115 PolarHBondContact O-N 3.19Å; W112-W115 PolarHBondContact O-N 3.08Å; W115-R118 PolarHBondContact O-N 3.28Å; W115-Y119 PolarHBondContact O-N 3.47Å
116	Y	96.5	Very high	96.1	Very high	105 Å²	105	67.2 Å²	67.2	41%	0.412	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-43.8	176.4	-179.7	-118.7	0	0	0	112.2	D90 W112 L113 Y119 R120	D90-Y116 HydrophobicContact CB-CD1 3.97Å; D90-Y116 HydrophobicContact CB-CE1 3.89Å; W112-Y116 WeakPolarHBondContact O-CB 3.47Å; W112-Y116 PolarHBondContact O-N 3.44Å; L113-Y116 PolarHBondContact O-N 3.43Å; Y116-Y119 PolarHBondContact O-N 3.29Å; Y116-R120 HydrophobicContact CD2-CG 4.42Å; Y116-R120 HydrophobicContact CE1-CG 4.22Å; Y116-R120 HydrophobicContact CE2-CG 4.02Å; Y116-R120 WeakPolarHBondContact O-CG 3.41Å; Y116-R120 PolarHBondContact O-N 2.93Å
117	S	97.4	Very high	96	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-39.3	179.2	63.1	0	0	0	0	112.3	D90 L113 V114 R120 A121 F132	D90-S117 WeakPolarHBondContact O-CB 3.39Å; L113-S117 WeakPolarHBondContact O-CB 3.36Å; L113-S117 PolarHBondContact O-N 3.47Å; L113-S117 PolarHBondContact O-OG 2.83Å; V114-S117 WeakPolarHBondContact CA-OG 3.37Å; V114-S117 PolarHBondContact O-N 3.48Å; V114-S117 PolarHBondContact O-OG 3.18Å; S117-R120 PolarHBondContact O-N 2.74Å; S117-A121 WeakPolarHBondContact O-CB 3.45Å; S117-A121 PolarHBondContact O-N 2.91Å; S117-F132 WeakPolarHBondContact OG-CD1 3.33Å; S117-F132 VanDerWaalsContact OG-CG 3.24Å; S117-F132 WeakPolarHBondContact OG-CG 3.46Å
118	R	98.3	Very high	96.1	Very high	94 Å²	94	81 Å²	81	36%	0.355	35%	0.353	S	S	.	.	H	α-helix	trans	-58.6	-47.1	170.9	-72.2	170.8	179.1	-178.8	-1.7	112	V114 W115 A121 W122 F132	V114-R118 VanDerWaalsContact O-CG 3.26Å; V114-R118 WeakPolarHBondContact O-CG 3.5Å; V114-R118 PolarHBondContact O-N 2.69Å; W115-R118 PolarHBondContact O-N 3.28Å; R118-A121 PolarHBondContact O-N 2.83Å; R118-W122 PolarHBondContact O-N 2.8Å; R118-F132 HydrophobicContact CG-CB 4.01Å; R118-F132 HydrophobicContact CG-CD2 3.89Å; R118-F132 HydrophobicContact CG-CG 4.34Å; R118-F132 PolarHBondContact NE-O 3.34Å; R118-F132 PolarHBondContact NH2-O 2.94Å
119	Y	98.1	Very high	96.2	Very high	124 Å²	124	81.7 Å²	81.7	49%	0.486	36%	0.36	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.5	169.1	-107.1	0	0	0	111.7	W115 Y116 W122 R123	W115-Y119 PolarHBondContact O-N 3.47Å; Y116-Y119 PolarHBondContact O-N 3.29Å; Y119-W122 HydrophobicContact CD2-CE3 4.29Å; Y119-W122 HydrophobicContact CE2-CE3 4.23Å; Y119-W122 HydrophobicContact CE2-CZ3 4.23Å; Y119-W122 PolarHBondContact O-N 3.37Å; Y119-R123 WeakPolarHBondContact O-CB 3.44Å; Y119-R123 PolarHBondContact O-N 3.21Å
120	R	97.9	Very high	96.6	Very high	35 Å²	35	79.7 Å²	79.7	13%	0.132	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-45.4	176.8	-69.7	-146.8	-56.8	-165.8	9.5	112	D90 I95 Y116 S117 W122 R123 E124	D90-R120 VanDerWaalsContact C-NH2 3.31Å; D90-R120 VanDerWaalsContact O-CZ 3.27Å; D90-R120 PolarHBondContact O-NE 2.88Å; D90-R120 PolarHBondContact O-NH2 3.47Å; D90-R120 IonicContact OD1-NH2 3.52Å; D90-R120 PolarHBondContact OD1-NH2 2.84Å; D90-R120 IonicContact OD2-CZ 2.83Å; D90-R120 VanDerWaalsContact OD2-CZ 3.22Å; D90-R120 IonicContact OD2-NH1 3.18Å; D90-R120 PolarHBondContact OD2-NH1 3.15Å; D90-R120 IonicContact OD2-NH2 2.67Å; D90-R120 PolarHBondContact OD2-NH2 3.34Å; I95-R120 HydrophobicContact CD1-CB 3.69Å; Y116-R120 HydrophobicContact CD2-CG 4.42Å; Y116-R120 HydrophobicContact CE1-CG 4.22Å; Y116-R120 HydrophobicContact CE2-CG 4.02Å; Y116-R120 WeakPolarHBondContact O-CG 3.41Å; Y116-R120 PolarHBondContact O-N 2.93Å; S117-R120 PolarHBondContact O-N 2.74Å; R120-W122 VanDerWaalsContact C-N 3.27Å; R120-W122 PolarHBondContact O-N 2.93Å; R120-R123 PolarHBondContact O-N 2.9Å; R120-R123 VanDerWaalsContact O-N 3.16Å; R120-E124 WeakPolarHBondContact O-CB 3.36Å; R120-E124 WeakPolarHBondContact O-CG 3.47Å; R120-E124 PolarHBondContact O-N 3.48Å
121	A	98.2	Very high	97	Very high	1 Å²	1	78.7 Å²	78.7	1%	0.008	35%	0.348	C	S	.	.	H	α-helix	trans	-62.7	-35.3	178.4	0	0	0	0	0	112.7	I95 S117 R118 G125 V126 H127 T130 F132	I95-A121 HydrophobicContact CD1-CB 4.28Å; I95-A121 HydrophobicContact CG1-CB 4.03Å; S117-A121 WeakPolarHBondContact O-CB 3.45Å; S117-A121 PolarHBondContact O-N 2.91Å; R118-A121 PolarHBondContact O-N 2.83Å; A121-G125 PolarHBondContact O-N 3.35Å; A121-V126 HydrophobicContact CB-CG2 4.17Å; A121-V126 PolarHBondContact O-N 2.97Å; A121-H127 PolarHBondContact O-N 3.28Å; A121-H127 VanDerWaalsContact O-N 3.13Å; A121-T130 HydrophobicContact CB-CG2 4.37Å; A121-T130 WeakPolarHBondContact CB-OG1 3.28Å; A121-F132 HydrophobicContact CB-CE2 3.71Å; A121-F132 HydrophobicContact CB-CZ 4.38Å
122	W	98.1	Very high	97.3	Very high	165 Å²	165	76.3 Å²	76.3	63%	0.625	33%	0.332	S	S	*	.	H	α-helix	trans	-64.4	-49.5	170.9	176	80.4	0	0	0	111.8	R118 Y119 R120 E124 G125 H127	R118-W122 PolarHBondContact O-N 2.8Å; Y119-W122 HydrophobicContact CD2-CE3 4.29Å; Y119-W122 HydrophobicContact CE2-CE3 4.23Å; Y119-W122 HydrophobicContact CE2-CZ3 4.23Å; Y119-W122 PolarHBondContact O-N 3.37Å; R120-W122 VanDerWaalsContact C-N 3.27Å; R120-W122 PolarHBondContact O-N 2.93Å; W122-E124 VanDerWaalsContact C-N 3.27Å; W122-E124 PolarHBondContact O-N 3.37Å; W122-G125 PolarHBondContact O-N 3.33Å; W122-H127 HydrophobicContact CB-CB 4.33Å
123	R	97.9	Very high	97.5	Very high	137 Å²	137	70.1 Å²	70.1	52%	0.517	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-35.8	178.6	-169.4	-176.1	71.5	177.2	2.5	112.9	Y119 R120 G125	Y119-R123 WeakPolarHBondContact O-CB 3.44Å; Y119-R123 PolarHBondContact O-N 3.21Å; R120-R123 PolarHBondContact O-N 2.9Å; R120-R123 VanDerWaalsContact O-N 3.16Å; R123-G125 VanDerWaalsContact C-N 3.28Å
124	E	97.5	Very high	97.5	Very high	78 Å²	78	72.9 Å²	72.9	36%	0.364	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.2	177.9	-62	-72.4	156.8	0	0	112.9	I95 K99 R120 W122 V126	I95-E124 HydrophobicContact CG2-CB 4.22Å; I95-E124 HydrophobicContact CG2-CG 4.16Å; K99-E124 WeakPolarHBondContact CE-OE2 3.36Å; K99-E124 IonicContact NZ-OE2 3.51Å; K99-E124 PolarHBondContact NZ-OE2 2.89Å; R120-E124 WeakPolarHBondContact O-CB 3.36Å; R120-E124 WeakPolarHBondContact O-CG 3.47Å; R120-E124 PolarHBondContact O-N 3.48Å; W122-E124 VanDerWaalsContact C-N 3.27Å; W122-E124 PolarHBondContact O-N 3.37Å; E124-V126 VanDerWaalsContact C-N 3.28Å; E124-V126 HydrophobicContact CB-CG2 4.29Å; E124-V126 PolarHBondContact O-N 3.49Å
125	G	97.8	Very high	97.3	Very high	54 Å²	54	74.5 Å²	74.5	56%	0.557	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	3.9	176.1	0	0	0	0	0	115.8	A121 W122 R123	A121-G125 PolarHBondContact O-N 3.35Å; W122-G125 PolarHBondContact O-N 3.33Å; R123-G125 VanDerWaalsContact C-N 3.28Å
126	V	98.2	Very high	97	Very high	20 Å²	20	69.6 Å²	69.6	12%	0.121	32%	0.323	C	S	.	.			trans	-99.9	5.2	-175.1	-62.9	0	0	0	0	114.5	I95 A98 K99 A121 E124 R128 S129 T130	I95-V126 HydrophobicContact CB-CG2 4.42Å; I95-V126 HydrophobicContact CG1-CG2 4.34Å; I95-V126 HydrophobicContact CG2-CG2 3.98Å; A98-V126 HydrophobicContact CB-CB 4.02Å; A98-V126 HydrophobicContact CB-CG1 4.47Å; A98-V126 HydrophobicContact CB-CG2 4.33Å; K99-V126 HydrophobicContact CG-CG1 3.71Å; A121-V126 HydrophobicContact CB-CG2 4.17Å; A121-V126 PolarHBondContact O-N 2.97Å; E124-V126 VanDerWaalsContact C-N 3.28Å; E124-V126 HydrophobicContact CB-CG2 4.29Å; E124-V126 PolarHBondContact O-N 3.49Å; V126-R128 PolarHBondContact O-N 2.88Å; V126-S129 PolarHBondContact O-N 2.85Å; V126-T130 HydrophobicContact CB-CG2 4.3Å; V126-T130 HydrophobicContact CG2-CG2 3.87Å; V126-T130 PolarHBondContact O-N 3.35Å; V126-T130 VanDerWaalsContact O-N 3.17Å; V126-T130 PolarHBondContact O-OG1 3.21Å
127	H	96.8	Very high	96.8	Very high	86 Å²	86	65.5 Å²	65.5	40%	0.398	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-23.3	-177.4	65	-80.7	0	0	0	115.6	A121 W122 T130	A121-H127 PolarHBondContact O-N 3.28Å; A121-H127 VanDerWaalsContact O-N 3.13Å; W122-H127 HydrophobicContact CB-CB 4.33Å; H127-T130 WeakPolarHBondContact CA-OG1 3.5Å; H127-T130 VanDerWaalsContact O-O 3.07Å
128	R	97.4	Very high	96.5	Very high	214 Å²	214	69.3 Å²	69.3	81%	0.808	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-22.8	176.7	-62.5	-173.6	178.3	-175.5	-2	113.7	V126	V126-R128 PolarHBondContact O-N 2.88Å
129	S	97.9	Very high	96.2	Very high	41 Å²	41	73.1 Å²	73.1	29%	0.287	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-0.2	179.4	-66.6	0	0	0	0	112.7	Q103 A104 V126	Q103-S129 VanDerWaalsContact OE1-CA 3.3Å; Q103-S129 PolarHBondContact OE1-OG 2.97Å; A104-S129 PolarHBondContact N-O 3.19Å; V126-S129 PolarHBondContact O-N 2.85Å
130	T	98.4	Very high	96	Very high	17 Å²	17	68 Å²	68	10%	0.104	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.5	177.4	62.1	0	0	0	0	111.7	V94 A98 A104 A121 V126 H127	V94-T130 HydrophobicContact CG1-CG2 3.92Å; A98-T130 HydrophobicContact CB-CG2 3.39Å; A104-T130 CarbonylContact O-C 3.55Å; A104-T130 VanDerWaalsContact O-CA 3.22Å; A104-T130 WeakPolarHBondContact O-CA 3.43Å; A121-T130 HydrophobicContact CB-CG2 4.37Å; A121-T130 WeakPolarHBondContact CB-OG1 3.28Å; V126-T130 HydrophobicContact CB-CG2 4.3Å; V126-T130 HydrophobicContact CG2-CG2 3.87Å; V126-T130 PolarHBondContact O-N 3.35Å; V126-T130 VanDerWaalsContact O-N 3.17Å; V126-T130 PolarHBondContact O-OG1 3.21Å; H127-T130 WeakPolarHBondContact CA-OG1 3.5Å; H127-T130 VanDerWaalsContact O-O 3.07Å
131	S	98.1	Very high	95.9	Very high	41 Å²	41	70 Å²	70	29%	0.287	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	146.8	164.6	74.5	0	0	0	0	110.6	A104 S105 G106 H133	A104-S131 PolarHBondContact O-N 3.29Å; S105-S131 CarbonylContact C-O 3.44Å; S105-S131 VanDerWaalsContact CA-O 3.24Å; S105-S131 WeakPolarHBondContact CA-O 3.13Å; S105-S131 WeakPolarHBondContact CB-OG 3.29Å; S105-S131 PolarHBondContact OG-OG 3.2Å; G106-S131 PolarHBondContact N-O 3.16Å; S131-H133 PolarHBondContact OG-NE2 3.49Å
132	F	98.3	Very high	95.8	Very high	7 Å²	7	70 Å²	70	3%	0.031	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	129.5	178.2	-63.1	-84.3	0	0	0	110	V94 I95 G106 V114 S117 R118 A121	V94-F132 HydrophobicContact CB-CE1 3.69Å; V94-F132 HydrophobicContact CB-CZ 3.86Å; V94-F132 HydrophobicContact CG1-CE1 3.67Å; V94-F132 HydrophobicContact CG1-CE2 4.39Å; V94-F132 HydrophobicContact CG1-CZ 3.59Å; V94-F132 HydrophobicContact CG2-CE1 3.88Å; I95-F132 HydrophobicContact CG1-CZ 4.25Å; G106-F132 WeakPolarHBondContact O-CA 3.38Å; V114-F132 HydrophobicContact CG1-CB 3.91Å; S117-F132 WeakPolarHBondContact OG-CD1 3.33Å; S117-F132 VanDerWaalsContact OG-CG 3.24Å; S117-F132 WeakPolarHBondContact OG-CG 3.46Å; R118-F132 HydrophobicContact CG-CB 4.01Å; R118-F132 HydrophobicContact CG-CD2 3.89Å; R118-F132 HydrophobicContact CG-CG 4.34Å; R118-F132 PolarHBondContact NE-O 3.34Å; R118-F132 PolarHBondContact NH2-O 2.94Å; A121-F132 HydrophobicContact CB-CE2 3.71Å; A121-F132 HydrophobicContact CB-CZ 4.38Å
133	H	97	Very high	95.8	Very high	76 Å²	76	64.7 Å²	64.7	35%	0.352	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.2	-170.9	-55.9	-78.1	0	0	0	110.7	G106 L107 E108 S131 S135	G106-H133 PolarHBondContact O-N 3.02Å; L107-H133 HydrophobicContact CD2-CB 3.89Å; E108-H133 PolarHBondContact N-O 3.07Å; E108-H133 VanDerWaalsContact N-O 3.09Å; E108-H133 VanDerWaalsContact O-O 3.1Å; S131-H133 PolarHBondContact OG-NE2 3.49Å; H133-S135 VanDerWaalsContact C-N 3.31Å; H133-S135 PolarHBondContact O-N 2.9Å
134	I	95.1	Very high	95.7	Very high	84 Å²	84	62.6 Å²	62.6	43%	0.431	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	89.2	167.2	-53.6	169.8	0	0	0	106.4	E108 P111 V114	E108-I134 CarbonylContact O-C 3.59Å; E108-I134 VanDerWaalsContact O-CA 3.23Å; E108-I134 WeakPolarHBondContact O-CA 3.49Å; P111-I134 HydrophobicContact CB-CD1 3.7Å; P111-I134 HydrophobicContact CB-CG1 4.42Å; P111-I134 HydrophobicContact CG-CD1 4.15Å; P111-I134 HydrophobicContact CG-CG2 4.13Å; V114-I134 HydrophobicContact CB-CG1 3.83Å; V114-I134 HydrophobicContact CG1-CG1 3.81Å; V114-I134 HydrophobicContact CG2-CG1 3.79Å
135	S	92.1	Very high	95.7	Very high	34 Å²	34	59.8 Å²	59.8	24%	0.238	31%	0.314	C	S	.	.			trans	-142.3	141.7	-171.1	-169.4	0	0	0	0	111.8	E108 H133	E108-S135 PolarHBondContact O-N 2.96Å; H133-S135 VanDerWaalsContact C-N 3.31Å; H133-S135 PolarHBondContact O-N 2.9Å
136	D	90.9	Very high	95.7	Very high	49 Å²	49	58.3 Å²	58.3	26%	0.262	30%	0.295	S	S	.	.			trans	-74.5	124.2	164.9	-173.7	-11.7	0	0	0	109	L109 W138 K139 A140	L109-D136 HydrophobicContact CD2-CB 4Å; D136-W138 PolarHBondContact O-N 3.45Å; D136-W138 PolarHBondContact OD1-N 2.89Å; D136-K139 HydrophobicContact CB-CB 4.4Å; D136-K139 HydrophobicContact CB-CD 4.15Å; D136-K139 HydrophobicContact CB-CG 4.16Å; D136-K139 PolarHBondContact O-N 2.87Å; D136-K139 VanDerWaalsContact O-N 3.15Å; D136-A140 PolarHBondContact O-N 2.93Å; D136-A140 VanDerWaalsContact O-N 3.14Å
137	L	91.1	Very high	95.7	Very high	18 Å²	18	57.4 Å²	57.4	9%	0.094	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.4	180	71.9	92	0	0	0	111.8	I86 K139 A140 F142 M156 L160 K163	I86-L137 HydrophobicContact CG2-CB 3.79Å; I86-L137 HydrophobicContact CG2-CD2 3.73Å; I86-L137 HydrophobicContact CG2-CG 4.27Å; L137-K139 VanDerWaalsContact C-N 3.27Å; L137-K139 PolarHBondContact O-N 2.93Å; L137-A140 PolarHBondContact O-N 2.83Å; L137-F142 HydrophobicContact CB-CZ 4.45Å; L137-M156 HydrophobicContact CD1-SD 4.42Å; L137-M156 HydrophobicContact CD2-CE 4.23Å; L137-M156 HydrophobicContact CD2-SD 3.51Å; L137-M156 VanDerWaalsContact CD2-SD 3.51Å; L137-L160 HydrophobicContact CD1-CD1 4.09Å; L137-K163 WeakPolarHBondContact O-CE 3.29Å
138	W	92.1	Very high	95.8	Very high	81 Å²	81	53.3 Å²	53.3	31%	0.307	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.4	-178.7	-58.5	114.4	0	0	0	112.6	D136 M156 Q159 L160 K163	D136-W138 PolarHBondContact O-N 3.45Å; D136-W138 PolarHBondContact OD1-N 2.89Å; W138-M156 HydrophobicContact CH2-CG 3.81Å; W138-M156 HydrophobicContact CZ2-CG 3.61Å; W138-M156 HydrophobicContact CZ2-SD 4.03Å; W138-Q159 HydrophobicContact CH2-CB 3.37Å; W138-Q159 HydrophobicContact CZ2-CB 4.26Å; W138-Q159 HydrophobicContact CZ3-CB 3.71Å; W138-L160 HydrophobicContact CH2-CB 4.13Å; W138-L160 HydrophobicContact CZ3-CB 4.39Å; W138-K163 HydrophobicContact CE3-CD 3.99Å; W138-K163 HydrophobicContact CZ3-CD 4.44Å; W138-K163 PolarHBondContact O-NZ 3.43Å
139	K	91.8	Very high	95.8	Very high	174 Å²	174	43.1 Å²	43.1	76%	0.757	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-21.2	-179.8	-59.2	-178	-174.1	178.9	0	112.8	D136 L137	D136-K139 HydrophobicContact CB-CB 4.4Å; D136-K139 HydrophobicContact CB-CD 4.15Å; D136-K139 HydrophobicContact CB-CG 4.16Å; D136-K139 PolarHBondContact O-N 2.87Å; D136-K139 VanDerWaalsContact O-N 3.15Å; L137-K139 VanDerWaalsContact C-N 3.27Å; L137-K139 PolarHBondContact O-N 2.93Å
140	A	93.8	Very high	95.7	Very high	16 Å²	16	41.2 Å²	41.2	13%	0.132	22%	0.219	C	C	.	.	S	Bend	trans	-68.8	150.9	175.2	0	0	0	0	0	110.8	L107 D136 L137 K163	L107-A140 HydrophobicContact CD1-CB 3.66Å; D136-A140 PolarHBondContact O-N 2.93Å; D136-A140 VanDerWaalsContact O-N 3.14Å; L137-A140 PolarHBondContact O-N 2.83Å; A140-K163 VanDerWaalsContact O-CE 3.23Å; A140-K163 WeakPolarHBondContact O-CE 3.22Å; A140-K163 PolarHBondContact O-NZ 2.83Å
141	T	95.5	Very high	95.2	Very high	77 Å²	77	42.5 Å²	42.5	47%	0.472	22%	0.223	S	C	.	.			trans	-100.2	140.8	169.3	-179.6	0	0	0	0	110.4	Q144 E167	T141-Q144 PolarHBondContact O-NE2 2.95Å; T141-Q144 PolarHBondContact O-OE1 2.89Å; T141-E167 VanDerWaalsContact CA-OE2 3.31Å; T141-E167 WeakPolarHBondContact CA-OE2 3.3Å
142	F	96.9	Very high	94.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.			trans	-105.7	-1.1	-178.5	-61.1	-66.8	0	0	0	115.1	V84 I86 L107 L137 Q144 Y145 K163 L164 E167 L168	V84-F142 HydrophobicContact CG1-CD1 4.06Å; V84-F142 HydrophobicContact CG1-CE1 4.35Å; V84-F142 HydrophobicContact CG2-CE1 4.43Å; I86-F142 HydrophobicContact CD1-CE1 3.71Å; I86-F142 HydrophobicContact CD1-CE2 4.37Å; I86-F142 HydrophobicContact CD1-CZ 3.62Å; I86-F142 HydrophobicContact CG1-CE1 3.88Å; I86-F142 HydrophobicContact CG1-CZ 4.08Å; L107-F142 HydrophobicContact CD1-CE1 3.73Å; L107-F142 HydrophobicContact CD1-CZ 4.17Å; L137-F142 HydrophobicContact CB-CZ 4.45Å; F142-Q144 PolarHBondContact O-N 2.89Å; F142-Q144 VanDerWaalsContact O-N 3.13Å; F142-Y145 HydrophobicContact CB-CD2 4.48Å; F142-Y145 HydrophobicContact CD1-CD2 4.09Å; F142-Y145 HydrophobicContact CD1-CE2 4.31Å; F142-Y145 PolarHBondContact O-N 3.27Å; F142-K163 HydrophobicContact CD2-CD 4.4Å; F142-K163 HydrophobicContact CD2-CG 4.42Å; F142-K163 HydrophobicContact CE2-CD 3.95Å; F142-K163 HydrophobicContact CE2-CG 4.41Å; F142-L164 HydrophobicContact CB-CD2 4.22Å; F142-L164 HydrophobicContact CD1-CD2 4.48Å; F142-L164 HydrophobicContact CD2-CD2 3.59Å; F142-L164 HydrophobicContact CE2-CD2 3.98Å; F142-L164 HydrophobicContact CG-CD2 3.85Å; F142-E167 HydrophobicContact CB-CB 4.26Å; F142-E167 WeakPolarHBondContact CD2-OE2 3.49Å; F142-E167 PolarHBondContact N-OE2 3.02Å; F142-L168 HydrophobicContact CB-CD2 3.82Å
143	A	96.6	Very high	94	Very high	55 Å²	55	41.9 Å²	41.9	46%	0.455	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.3	-173	0	0	0	0	0	114.6	Y145 E167	A143-Y145 VanDerWaalsContact C-N 3.32Å; A143-Y145 PolarHBondContact O-N 3.49Å; A143-E167 WeakPolarHBondContact CA-O 3.3Å; A143-E167 WeakPolarHBondContact CB-O 3.41Å
144	Q	96.2	Very high	93.4	Very high	93 Å²	93	41.3 Å²	41.3	44%	0.435	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-6.8	178.7	69.6	-82.1	4.7	0	0	114.7	T82 T141 F142	T82-Q144 PolarHBondContact OG1-O 3.32Å; T141-Q144 PolarHBondContact O-NE2 2.95Å; T141-Q144 PolarHBondContact O-OE1 2.89Å; F142-Q144 PolarHBondContact O-N 2.89Å; F142-Q144 VanDerWaalsContact O-N 3.13Å
145	Y	97.9	Very high	93	Very high	19 Å²	19	44.1 Å²	44.1	8%	0.075	23%	0.233	C	C	.	.			trans	-99.1	127.4	-174.3	-61	-68.3	0	0	0	112.4	T82 V84 S105 F142 A143	T82-Y145 WeakPolarHBondContact OG1-CA 3.36Å; V84-Y145 HydrophobicContact CB-CD1 3.66Å; V84-Y145 HydrophobicContact CB-CD2 3.65Å; V84-Y145 HydrophobicContact CB-CE1 3.68Å; V84-Y145 HydrophobicContact CB-CE2 3.64Å; V84-Y145 HydrophobicContact CB-CG 3.65Å; V84-Y145 HydrophobicContact CG1-CD1 4.09Å; V84-Y145 HydrophobicContact CG1-CD2 3.5Å; V84-Y145 VanDerWaalsContact CG1-CD2 3.5Å; V84-Y145 HydrophobicContact CG1-CE2 3.94Å; V84-Y145 HydrophobicContact CG1-CG 3.57Å; V84-Y145 HydrophobicContact CG2-CD2 4.28Å; V84-Y145 HydrophobicContact CG2-CE1 4.34Å; V84-Y145 HydrophobicContact CG2-CE2 3.83Å; S105-Y145 WeakPolarHBondContact CB-OH 3.37Å; F142-Y145 HydrophobicContact CB-CD2 4.48Å; F142-Y145 HydrophobicContact CD1-CD2 4.09Å; F142-Y145 HydrophobicContact CD1-CE2 4.31Å; F142-Y145 PolarHBondContact O-N 3.27Å; A143-Y145 VanDerWaalsContact C-N 3.32Å; A143-Y145 PolarHBondContact O-N 3.49Å
146	S	97.7	Very high	92.8	Very high	23 Å²	23	42.7 Å²	42.7	16%	0.161	22%	0.223	C	C	.	.	S	Bend	trans	-86	-16	172.9	54.6	0	0	0	0	113.8	R79 T80 T82 A172 K173	R79-S146 PolarHBondContact NH2-O 3.29Å; R79-S146 VanDerWaalsContact NH2-O 3.15Å; T80-S146 PolarHBondContact O-OG 3.48Å; T82-S146 PolarHBondContact N-OG 2.87Å; T82-S146 PolarHBondContact O-N 3.16Å; T82-S146 PolarHBondContact O-OG 3.39Å; T82-S146 PolarHBondContact OG1-N 3.32Å; T82-S146 VanDerWaalsContact OG1-N 3.1Å; T82-S146 PolarHBondContact OG1-OG 2.99Å; S146-A172 VanDerWaalsContact O-CA 3.31Å; S146-A172 WeakPolarHBondContact O-CA 3.4Å; S146-K173 PolarHBondContact O-N 3.18Å; S146-K173 VanDerWaalsContact O-N 3.11Å
147	N	98.3	Very high	92.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	133.3	179.6	-48.3	-79.6	0	0	0	109	L76 R79 T80 T82 L83 V84 K173	L76-N147 HydrophobicContact CD2-CB 4.27Å; R79-N147 PolarHBondContact NE-OD1 3.33Å; R79-N147 PolarHBondContact NH2-OD1 3.36Å; T80-N147 PolarHBondContact O-ND2 2.92Å; T82-N147 PolarHBondContact O-N 3.48Å; T82-N147 PolarHBondContact O-ND2 3Å; T82-N147 VanDerWaalsContact O-ND2 3.08Å; L83-N147 CarbonylContact C-O 3.49Å; L83-N147 VanDerWaalsContact CA-O 3.28Å; L83-N147 WeakPolarHBondContact CA-O 3.12Å; L83-N147 HydrophobicContact CB-CB 4.23Å; L83-N147 HydrophobicContact CD1-CB 4.11Å; L83-N147 HydrophobicContact CG-CB 4.21Å; V84-N147 PolarHBondContact N-O 3.21Å; N147-K173 CarbonylContact C-O 3.49Å; N147-K173 WeakPolarHBondContact CA-O 3.32Å
148	V	98.3	Very high	93	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.5	176.8	179.4	0	0	0	0	108.6	V84 I86 L164 L168 K173 V174 V175	V84-V148 HydrophobicContact CG1-CB 4.2Å; V84-V148 HydrophobicContact CG1-CG1 4.1Å; V84-V148 HydrophobicContact CG1-CG2 3.79Å; V84-V148 CarbonylContact O-C 3.46Å; V84-V148 WeakPolarHBondContact O-CA 3.47Å; I86-V148 HydrophobicContact CD1-CG1 3.66Å; I86-V148 HydrophobicContact CG1-CG1 4.21Å; V148-L164 HydrophobicContact CG1-CD1 4.35Å; V148-L164 HydrophobicContact CG1-CD2 4.47Å; V148-L168 HydrophobicContact CG2-CD1 3.99Å; V148-L168 HydrophobicContact CG2-CD2 3.61Å; V148-L168 HydrophobicContact CG2-CG 4.44Å; V148-K173 PolarHBondContact N-O 3.36Å; V148-V174 HydrophobicContact CB-CG1 4.24Å; V148-V174 HydrophobicContact CB-CG2 4.31Å; V148-V174 HydrophobicContact CG1-CG1 4.33Å; V148-V174 CarbonylContact O-C 3.52Å; V148-V174 WeakPolarHBondContact O-CA 3.42Å; V148-V175 PolarHBondContact O-N 3.47Å
149	V	97.9	Very high	93.1	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	136.3	166.7	-175	0	0	0	0	107.9	V72 L76 L83 V84 D85 I86 I93 V175	V72-V149 HydrophobicContact CG1-CG1 4.15Å; V72-V149 HydrophobicContact CG1-CG2 3.99Å; V72-V149 HydrophobicContact CG2-CG1 4.45Å; L76-V149 HydrophobicContact CD1-CG2 4.05Å; L83-V149 HydrophobicContact CD1-CG2 4.07Å; L83-V149 HydrophobicContact CD2-CG2 4.39Å; L83-V149 HydrophobicContact CG-CG2 4.43Å; V84-V149 PolarHBondContact O-N 3.37Å; D85-V149 WeakPolarHBondContact CA-O 3.43Å; I86-V149 PolarHBondContact N-O 2.85Å; I93-V149 HydrophobicContact CG2-CB 4.33Å; I93-V149 HydrophobicContact CG2-CG1 4.13Å; I93-V149 HydrophobicContact CG2-CG2 4.25Å; V149-V175 WeakPolarHBondContact CA-O 3.05Å; V149-V175 HydrophobicContact CG2-CB 4.26Å
150	I	95.6	Very high	93.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128	177.1	172.5	65	0	0	0	110.7	I86 M156 L160 V175 A176 C177 F181	I86-I150 HydrophobicContact CB-CB 4.42Å; I86-I150 HydrophobicContact CB-CD1 3.58Å; I86-I150 HydrophobicContact CG2-CD1 3.54Å; I150-M156 HydrophobicContact CD1-CE 3.62Å; I150-M156 HydrophobicContact CG1-CE 4.49Å; I150-L160 HydrophobicContact CB-CD2 4.29Å; I150-L160 HydrophobicContact CD1-CD2 3.74Å; I150-L160 HydrophobicContact CG1-CD2 3.59Å; I150-V175 PolarHBondContact N-O 2.85Å; I150-A176 HydrophobicContact CG2-CB 3.84Å; I150-C177 WeakPolarHBondContact O-CB 3.36Å; I150-C177 PolarHBondContact O-N 2.54Å; I150-F181 HydrophobicContact CG2-CE2 4.17Å; I150-F181 HydrophobicContact CG2-CZ 4.12Å
151	F	89.1	Confident	93.3	Very high	43 Å²	43	38 Å²	38	19%	0.189	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	80.6	164.5	-148.4	-73.2	0	0	0	110	A64 Q68 I86 C177	A64-F151 HydrophobicContact CB-CD2 4.12Å; A64-F151 HydrophobicContact CB-CE2 3.66Å; Q68-F151 VanDerWaalsContact CD-CE2 3.43Å; Q68-F151 HydrophobicContact CG-CE2 4.29Å; I86-F151 PolarHBondContact O-N 3.13Å; F151-C177 HydrophobicContact CD2-CB 3.59Å; F151-C177 HydrophobicContact CE2-CB 3.91Å; F151-C177 HydrophobicContact CG-CB 4.21Å
152	G	82.8	Confident	93.2	Very high	3 Å²	3	38.4 Å²	38.4	3%	0.031	21%	0.207	C	C	.	.			trans	-90.4	-177.6	-170.7	0	0	0	0	0	114.4	F179	G152-F179 VanDerWaalsContact O-CD2 3.24Å; G152-F179 WeakPolarHBondContact O-CD2 3.45Å; G152-F179 WeakPolarHBondContact O-CE2 3.48Å
153	V	86.4	Confident	93.2	Very high	33 Å²	33	39.7 Å²	39.7	20%	0.2	21%	0.213	C	C	.	.			trans	-125.7	153.6	162.7	-67	0	0	0	0	108.5	L59 Q155 M156 M157	L59-V153 HydrophobicContact CD2-CB 3.98Å; L59-V153 HydrophobicContact CD2-CG1 3.55Å; L59-V153 HydrophobicContact CD2-CG2 3.24Å; V153-Q155 PolarHBondContact O-N 3.5Å; V153-Q155 VanDerWaalsContact O-N 3.08Å; V153-M156 HydrophobicContact CG2-CB 4.17Å; V153-M156 PolarHBondContact O-N 2.84Å; V153-M157 WeakPolarHBondContact O-CG 3.32Å; V153-M157 PolarHBondContact O-N 3.28Å
154	P	85.4	Confident	93.2	Very high	63 Å²	63	37.1 Å²	37.1	41%	0.409	19%	0.191	S	C	.	.	H	α-helix	trans	-49.9	-41.6	-174.5	-29.9	36.1	0	0	0	114.2	M156 M157 F179	P154-M156 PolarHBondContact O-N 2.95Å; P154-M156 VanDerWaalsContact O-N 3.1Å; P154-M157 PolarHBondContact O-N 3.28Å; P154-F179 HydrophobicContact CG-CD1 3.61Å; P154-F179 HydrophobicContact CG-CD2 4.5Å; P154-F179 HydrophobicContact CG-CE1 3.58Å; P154-F179 HydrophobicContact CG-CE2 4.47Å; P154-F179 HydrophobicContact CG-CG 4.07Å; P154-F179 HydrophobicContact CG-CZ 4.03Å
155	Q	86.2	Confident	93.1	Very high	144 Å²	144	33.2 Å²	33.2	67%	0.673	18%	0.175	S	C	*	.	H	α-helix	trans	-64.5	-18.3	-176.5	-57.4	84	-5.7	0	0	113.9	V153	V153-Q155 PolarHBondContact O-N 3.5Å; V153-Q155 VanDerWaalsContact O-N 3.08Å
156	M	89.3	Confident	93	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.02	20%	0.2	C	C	.	.	H	α-helix	trans	-97.9	-22.9	-179.4	177.6	168.1	78	0	0	112.7	L59 L137 W138 I150 V153 P154 D158 Q159 L160	L59-M156 HydrophobicContact CD1-CE 4.17Å; L137-M156 HydrophobicContact CD1-SD 4.42Å; L137-M156 HydrophobicContact CD2-CE 4.23Å; L137-M156 HydrophobicContact CD2-SD 3.51Å; L137-M156 VanDerWaalsContact CD2-SD 3.51Å; W138-M156 HydrophobicContact CH2-CG 3.81Å; W138-M156 HydrophobicContact CZ2-CG 3.61Å; W138-M156 HydrophobicContact CZ2-SD 4.03Å; I150-M156 HydrophobicContact CD1-CE 3.62Å; I150-M156 HydrophobicContact CG1-CE 4.49Å; V153-M156 HydrophobicContact CG2-CB 4.17Å; V153-M156 PolarHBondContact O-N 2.84Å; P154-M156 PolarHBondContact O-N 2.95Å; P154-M156 VanDerWaalsContact O-N 3.1Å; M156-D158 PolarHBondContact O-N 3.49Å; M156-Q159 PolarHBondContact O-N 2.88Å; M156-L160 HydrophobicContact CE-CD2 4.36Å; M156-L160 HydrophobicContact CG-CB 4.31Å; M156-L160 WeakPolarHBondContact O-CB 3.41Å; M156-L160 PolarHBondContact O-N 3.21Å
157	M	92.9	Very high	92.9	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-40.4	-168.2	-62	-58.6	-71	0	0	112.1	V153 P154 Q159 L160 E161 A176 F179 F181	V153-M157 WeakPolarHBondContact O-CG 3.32Å; V153-M157 PolarHBondContact O-N 3.28Å; P154-M157 PolarHBondContact O-N 3.28Å; M157-Q159 PolarHBondContact O-N 3.43Å; M157-L160 PolarHBondContact O-N 2.95Å; M157-E161 WeakPolarHBondContact O-CB 3.33Å; M157-E161 PolarHBondContact O-N 3.03Å; M157-A176 HydrophobicContact CE-CB 4.12Å; M157-F179 VanDerWaalsContact CE-O 3.29Å; M157-F179 WeakPolarHBondContact CE-O 3.35Å; M157-F179 HydrophobicContact CG-CB 4.32Å; M157-F181 HydrophobicContact CB-CD1 4.44Å; M157-F181 HydrophobicContact CE-CD1 3.7Å; M157-F181 HydrophobicContact CE-CD2 4.01Å; M157-F181 HydrophobicContact CE-CE1 3.69Å; M157-F181 HydrophobicContact CE-CE2 3.98Å; M157-F181 HydrophobicContact CE-CG 3.87Å; M157-F181 HydrophobicContact CE-CZ 3.83Å; M157-F181 HydrophobicContact SD-CE1 4.49Å
158	D	92.9	Very high	92.9	Very high	94 Å²	94	39.4 Å²	39.4	50%	0.503	21%	0.206	S	C	.	.	H	α-helix	trans	-57.4	-50.6	177.6	-66.3	-59.1	0	0	0	112.5	M156 E161 V162 P182	M156-D158 PolarHBondContact O-N 3.49Å; D158-E161 WeakPolarHBondContact O-CB 3.41Å; D158-E161 PolarHBondContact O-N 3.43Å; D158-V162 PolarHBondContact O-N 3.08Å; D158-P182 HydrophobicContact CB-CG 4.45Å; D158-P182 WeakPolarHBondContact OD1-CB 3.13Å; D158-P182 WeakPolarHBondContact OD1-CG 3.49Å
159	Q	92.8	Very high	92.7	Very high	125 Å²	125	41.6 Å²	41.6	58%	0.584	22%	0.22	S	C	*	.	H	α-helix	trans	-71.2	-36.7	-177.7	-70.6	-177.3	-9.1	0	0	111.7	W138 M156 M157 E161 V162 K163	W138-Q159 HydrophobicContact CH2-CB 3.37Å; W138-Q159 HydrophobicContact CZ2-CB 4.26Å; W138-Q159 HydrophobicContact CZ3-CB 3.71Å; M156-Q159 PolarHBondContact O-N 2.88Å; M157-Q159 PolarHBondContact O-N 3.43Å; Q159-E161 VanDerWaalsContact C-N 3.34Å; Q159-V162 PolarHBondContact O-N 3.08Å; Q159-K163 PolarHBondContact O-N 3.36Å
160	L	94.7	Very high	92.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-37	178.6	-177.8	61.3	0	0	0	111.2	I86 L137 W138 I150 M156 M157 V162 K163 L164 F181	I86-L160 HydrophobicContact CD1-CD1 4.18Å; I86-L160 HydrophobicContact CD1-CD2 4.47Å; L137-L160 HydrophobicContact CD1-CD1 4.09Å; W138-L160 HydrophobicContact CH2-CB 4.13Å; W138-L160 HydrophobicContact CZ3-CB 4.39Å; I150-L160 HydrophobicContact CB-CD2 4.29Å; I150-L160 HydrophobicContact CD1-CD2 3.74Å; I150-L160 HydrophobicContact CG1-CD2 3.59Å; M156-L160 HydrophobicContact CE-CD2 4.36Å; M156-L160 HydrophobicContact CG-CB 4.31Å; M156-L160 WeakPolarHBondContact O-CB 3.41Å; M156-L160 PolarHBondContact O-N 3.21Å; M157-L160 PolarHBondContact O-N 2.95Å; L160-V162 VanDerWaalsContact C-N 3.33Å; L160-V162 PolarHBondContact O-N 3.33Å; L160-K163 PolarHBondContact O-N 3.06Å; L160-L164 HydrophobicContact CD1-CD1 4.08Å; L160-L164 HydrophobicContact CD1-CD2 4.29Å; L160-L164 HydrophobicContact CD1-CG 3.85Å; L160-L164 HydrophobicContact CD2-CD1 4.39Å; L160-L164 HydrophobicContact CG-CD1 3.88Å; L160-L164 HydrophobicContact CG-CG 4.09Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 WeakPolarHBondContact O-CG 3.41Å; L160-L164 PolarHBondContact O-N 2.9Å; L160-F181 HydrophobicContact CB-CE1 4.16Å; L160-F181 HydrophobicContact CD2-CE1 4.2Å; L160-F181 HydrophobicContact CD2-CZ 4.08Å; L160-F181 HydrophobicContact CG-CE1 4.05Å; L160-F181 HydrophobicContact CG-CZ 4.19Å
161	E	95.1	Very high	92.5	Very high	15 Å²	15	49 Å²	49	7%	0.07	27%	0.272	C	S	.	.	H	α-helix	trans	-53	-52.2	174.7	-163	-176.5	94.5	0	0	110.7	M157 D158 Q159 K163 L164 A165 F181 P182 T183 W184	M157-E161 WeakPolarHBondContact O-CB 3.33Å; M157-E161 PolarHBondContact O-N 3.03Å; D158-E161 WeakPolarHBondContact O-CB 3.41Å; D158-E161 PolarHBondContact O-N 3.43Å; Q159-E161 VanDerWaalsContact C-N 3.34Å; E161-K163 PolarHBondContact O-N 3.38Å; E161-L164 PolarHBondContact O-N 3.38Å; E161-A165 WeakPolarHBondContact O-CB 3.49Å; E161-A165 PolarHBondContact O-N 3.4Å; E161-F181 HydrophobicContact CB-CD1 3.65Å; E161-F181 HydrophobicContact CB-CE1 4.11Å; E161-F181 HydrophobicContact CG-CB 4.36Å; E161-F181 HydrophobicContact CG-CD1 3.89Å; E161-F181 HydrophobicContact CG-CG 4.35Å; E161-F181 WeakPolarHBondContact OE2-CB 3.06Å; E161-P182 WeakPolarHBondContact OE2-CD 3.46Å; E161-P182 WeakPolarHBondContact OE2-CG 3.47Å; E161-T183 WeakPolarHBondContact OE1-CB 3.45Å; E161-T183 PolarHBondContact OE1-OG1 3.39Å; E161-T183 PolarHBondContact OE2-N 3.41Å; E161-T183 PolarHBondContact OE2-OG1 3.07Å; E161-W184 VanDerWaalsContact CD-CD1 3.44Å; E161-W184 HydrophobicContact CG-CD2 3.67Å; E161-W184 HydrophobicContact CG-CE3 4.37Å; E161-W184 HydrophobicContact CG-CG 3.95Å; E161-W184 HydrophobicContact CG-CH2 4.34Å; E161-W184 HydrophobicContact CG-CZ2 3.61Å; E161-W184 VanDerWaalsContact O-CZ2 3.24Å; E161-W184 WeakPolarHBondContact O-CZ2 3.41Å; E161-W184 PolarHBondContact OE2-N 3.45Å
162	V	94.9	Very high	92.9	Very high	85 Å²	85	47 Å²	47	52%	0.515	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-43.3	179.9	178	0	0	0	0	111.4	D158 Q159 L160 A165 N166	D158-V162 PolarHBondContact O-N 3.08Å; Q159-V162 PolarHBondContact O-N 3.08Å; L160-V162 VanDerWaalsContact C-N 3.33Å; L160-V162 PolarHBondContact O-N 3.33Å; V162-A165 PolarHBondContact O-N 3.25Å; V162-N166 VanDerWaalsContact O-CG 3.3Å; V162-N166 PolarHBondContact O-N 2.69Å; V162-N166 VanDerWaalsContact O-N 3.16Å; V162-N166 PolarHBondContact O-ND2 3.43Å; V162-N166 VanDerWaalsContact O-ND2 3.08Å
163	K	95.9	Very high	93.6	Very high	28 Å²	28	48.3 Å²	48.3	12%	0.122	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-46.7	180	-176.5	175.2	168.7	76.5	0	111.7	L137 W138 A140 F142 Q159 L160 E161 N166 E167	L137-K163 WeakPolarHBondContact O-CE 3.29Å; W138-K163 HydrophobicContact CE3-CD 3.99Å; W138-K163 HydrophobicContact CZ3-CD 4.44Å; W138-K163 PolarHBondContact O-NZ 3.43Å; A140-K163 VanDerWaalsContact O-CE 3.23Å; A140-K163 WeakPolarHBondContact O-CE 3.22Å; A140-K163 PolarHBondContact O-NZ 2.83Å; F142-K163 HydrophobicContact CD2-CD 4.4Å; F142-K163 HydrophobicContact CD2-CG 4.42Å; F142-K163 HydrophobicContact CE2-CD 3.95Å; F142-K163 HydrophobicContact CE2-CG 4.41Å; Q159-K163 PolarHBondContact O-N 3.36Å; L160-K163 PolarHBondContact O-N 3.06Å; E161-K163 PolarHBondContact O-N 3.38Å; K163-N166 PolarHBondContact O-N 3.23Å; K163-E167 WeakPolarHBondContact CE-OE1 3.38Å; K163-E167 WeakPolarHBondContact CG-OE1 3.42Å; K163-E167 IonicContact NZ-OE1 2.9Å; K163-E167 PolarHBondContact NZ-OE1 3.44Å; K163-E167 IonicContact NZ-OE2 3.22Å; K163-E167 WeakPolarHBondContact O-CB 3.34Å; K163-E167 WeakPolarHBondContact O-CG 3.38Å; K163-E167 PolarHBondContact O-N 3.15Å; K163-E167 VanDerWaalsContact O-N 3.09Å
164	L	96.6	Very high	94.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-37.3	179.3	-68.3	-177.8	0	0	0	111.7	I86 F142 V148 L160 E161 N166 E167 L168 V174 F181 W184	I86-L164 HydrophobicContact CD1-CD2 4.42Å; F142-L164 HydrophobicContact CB-CD2 4.22Å; F142-L164 HydrophobicContact CD1-CD2 4.48Å; F142-L164 HydrophobicContact CD2-CD2 3.59Å; F142-L164 HydrophobicContact CE2-CD2 3.98Å; F142-L164 HydrophobicContact CG-CD2 3.85Å; V148-L164 HydrophobicContact CG1-CD1 4.35Å; V148-L164 HydrophobicContact CG1-CD2 4.47Å; L160-L164 HydrophobicContact CD1-CD1 4.08Å; L160-L164 HydrophobicContact CD1-CD2 4.29Å; L160-L164 HydrophobicContact CD1-CG 3.85Å; L160-L164 HydrophobicContact CD2-CD1 4.39Å; L160-L164 HydrophobicContact CG-CD1 3.88Å; L160-L164 HydrophobicContact CG-CG 4.09Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 WeakPolarHBondContact O-CG 3.41Å; L160-L164 PolarHBondContact O-N 2.9Å; E161-L164 PolarHBondContact O-N 3.38Å; L164-N166 VanDerWaalsContact C-N 3.27Å; L164-N166 PolarHBondContact O-N 2.91Å; L164-E167 PolarHBondContact O-N 2.65Å; L164-L168 HydrophobicContact CB-CD1 3.84Å; L164-L168 HydrophobicContact CB-CG 4.28Å; L164-L168 HydrophobicContact CD2-CD1 4.03Å; L164-L168 HydrophobicContact CD2-CG 4.16Å; L164-L168 HydrophobicContact CG-CD1 4.34Å; L164-L168 VanDerWaalsContact O-CB 3.24Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 WeakPolarHBondContact O-CG 3.44Å; L164-L168 PolarHBondContact O-N 3.18Å; L164-V174 HydrophobicContact CD1-CG1 4.02Å; L164-F181 HydrophobicContact CD1-CE1 4.48Å; L164-F181 HydrophobicContact CD1-CE2 4.48Å; L164-F181 HydrophobicContact CD1-CZ 3.76Å; L164-W184 HydrophobicContact CB-CH2 3.78Å
165	A	95.3	Very high	94.7	Very high	11 Å²	11	43.8 Å²	43.8	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-56.1	-43.2	172.3	0	0	0	0	0	111.7	E161 V162 W184 F205 H206	E161-A165 WeakPolarHBondContact O-CB 3.49Å; E161-A165 PolarHBondContact O-N 3.4Å; V162-A165 PolarHBondContact O-N 3.25Å; A165-W184 HydrophobicContact CB-CZ2 3.97Å; A165-F205 HydrophobicContact CB-CD2 4.45Å; A165-H206 PolarHBondContact O-CE1 2.84Å; A165-H206 PolarHBondContact O-NE2 3.41Å
166	N	94.6	Very high	95.2	Very high	113 Å²	113	37 Å²	37	60%	0.604	21%	0.208	S	C	*	.	H	α-helix	trans	-78.6	-29.6	-175.4	-69.6	-31.9	0	0	0	113.7	V162 K163 L164	V162-N166 VanDerWaalsContact O-CG 3.3Å; V162-N166 PolarHBondContact O-N 2.69Å; V162-N166 VanDerWaalsContact O-N 3.16Å; V162-N166 PolarHBondContact O-ND2 3.43Å; V162-N166 VanDerWaalsContact O-ND2 3.08Å; K163-N166 PolarHBondContact O-N 3.23Å; L164-N166 VanDerWaalsContact C-N 3.27Å; L164-N166 PolarHBondContact O-N 2.91Å
167	E	96.3	Very high	95.4	Very high	53 Å²	53	36.9 Å²	36.9	25%	0.248	21%	0.207	C	C	.	.	H	α-helix	trans	-104.2	-27.3	-169.9	-67.7	-177.6	-159.3	0	0	114.2	T141 F142 A143 K163 L164	T141-E167 VanDerWaalsContact CA-OE2 3.31Å; T141-E167 WeakPolarHBondContact CA-OE2 3.3Å; F142-E167 HydrophobicContact CB-CB 4.26Å; F142-E167 WeakPolarHBondContact CD2-OE2 3.49Å; F142-E167 PolarHBondContact N-OE2 3.02Å; A143-E167 WeakPolarHBondContact CA-O 3.3Å; A143-E167 WeakPolarHBondContact CB-O 3.41Å; K163-E167 WeakPolarHBondContact CE-OE1 3.38Å; K163-E167 WeakPolarHBondContact CG-OE1 3.42Å; K163-E167 IonicContact NZ-OE1 2.9Å; K163-E167 PolarHBondContact NZ-OE1 3.44Å; K163-E167 IonicContact NZ-OE2 3.22Å; K163-E167 WeakPolarHBondContact O-CB 3.34Å; K163-E167 WeakPolarHBondContact O-CG 3.38Å; K163-E167 PolarHBondContact O-N 3.15Å; K163-E167 VanDerWaalsContact O-N 3.09Å; L164-E167 PolarHBondContact O-N 2.65Å
168	L	97.3	Very high	95.3	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.031	22%	0.223	C	C	.	.	S	Bend	trans	-77.7	140.8	-174.4	-71	177.7	0	0	0	112.5	F142 V148 L164 A172 V174 F205 H206	F142-L168 HydrophobicContact CB-CD2 3.82Å; V148-L168 HydrophobicContact CG2-CD1 3.99Å; V148-L168 HydrophobicContact CG2-CD2 3.61Å; V148-L168 HydrophobicContact CG2-CG 4.44Å; L164-L168 HydrophobicContact CB-CD1 3.84Å; L164-L168 HydrophobicContact CB-CG 4.28Å; L164-L168 HydrophobicContact CD2-CD1 4.03Å; L164-L168 HydrophobicContact CD2-CG 4.16Å; L164-L168 HydrophobicContact CG-CD1 4.34Å; L164-L168 VanDerWaalsContact O-CB 3.24Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 WeakPolarHBondContact O-CG 3.44Å; L164-L168 PolarHBondContact O-N 3.18Å; L168-A172 HydrophobicContact CB-CB 4.07Å; L168-A172 HydrophobicContact CD1-CB 4.33Å; L168-A172 HydrophobicContact CD2-CB 4.27Å; L168-A172 HydrophobicContact CG-CB 4.48Å; L168-V174 HydrophobicContact CD1-CG2 3.34Å; L168-F205 HydrophobicContact CD1-CZ 4.32Å; L168-H206 PolarHBondContact O-NE2 3.01Å
169	P	95.4	Very high	95.2	Very high	46 Å²	46	39.5 Å²	39.5	30%	0.299	21%	0.212	S	C	.	.			trans	-63.8	150.6	170.1	27.9	-32.2	0	0	0	110.1	S171 A172 A202	P169-S171 PolarHBondContact O-N 3.04Å; P169-A172 HydrophobicContact CG-CB 4.06Å; P169-A172 VanDerWaalsContact O-CB 3.22Å; P169-A172 WeakPolarHBondContact O-CB 3.49Å; P169-A172 PolarHBondContact O-N 2.86Å; P169-A202 VanDerWaalsContact O-CB 3.27Å; P169-A202 WeakPolarHBondContact O-CB 3.39Å
170	S	93.7	Very high	95.3	Very high	77 Å²	77	36.2 Å²	36.2	54%	0.538	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.7	-178.8	56.5	0	0	0	0	114.6	K203	S170-K203 PolarHBondContact O-N 3.31Å; S170-K203 VanDerWaalsContact O-N 3.1Å
171	S	94.2	Very high	95.3	Very high	81 Å²	81	36.5 Å²	36.5	57%	0.566	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	0.4	174.6	60.8	0	0	0	0	114	R79 P169	R79-S171 PolarHBondContact NH2-O 3.09Å; P169-S171 PolarHBondContact O-N 3.04Å
172	A	97.3	Very high	95.2	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.			trans	-73.4	150.3	-179.9	0	0	0	0	0	112.3	S146 L168 P169 A202	S146-A172 VanDerWaalsContact O-CA 3.31Å; S146-A172 WeakPolarHBondContact O-CA 3.4Å; L168-A172 HydrophobicContact CB-CB 4.07Å; L168-A172 HydrophobicContact CD1-CB 4.33Å; L168-A172 HydrophobicContact CD2-CB 4.27Å; L168-A172 HydrophobicContact CG-CB 4.48Å; P169-A172 HydrophobicContact CG-CB 4.06Å; P169-A172 VanDerWaalsContact O-CB 3.22Å; P169-A172 WeakPolarHBondContact O-CB 3.49Å; P169-A172 PolarHBondContact O-N 2.86Å; A172-A202 HydrophobicContact CB-CB 4.07Å; A172-A202 VanDerWaalsContact O-CB 3.24Å; A172-A202 WeakPolarHBondContact O-CB 3.24Å; A172-A202 PolarHBondContact O-N 3.28Å
173	K	97.4	Very high	95.1	Very high	31 Å²	31	39 Å²	39	14%	0.135	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.4	166.2	-68.9	-65.3	-165.3	-179.1	0	109.8	S146 N147 V148 E187 Y200 D201	S146-K173 PolarHBondContact O-N 3.18Å; S146-K173 VanDerWaalsContact O-N 3.11Å; N147-K173 CarbonylContact C-O 3.49Å; N147-K173 WeakPolarHBondContact CA-O 3.32Å; V148-K173 PolarHBondContact N-O 3.36Å; K173-E187 IonicContact NZ-OE1 2.65Å; K173-E187 PolarHBondContact NZ-OE1 2.8Å; K173-E187 IonicContact NZ-OE2 2.71Å; K173-E187 PolarHBondContact NZ-OE2 2.77Å; K173-Y200 WeakPolarHBondContact CA-O 3.3Å; K173-D201 HydrophobicContact CD-CB 4.25Å; K173-D201 VanDerWaalsContact NZ-CG 3.3Å; K173-D201 IonicContact NZ-OD2 3.19Å; K173-D201 PolarHBondContact NZ-OD2 3.3Å
174	V	98.1	Very high	95	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133	175.1	-173.5	0	0	0	0	109	V148 L164 L168 F181 W184 V199 Y200 F205	V148-V174 HydrophobicContact CB-CG1 4.24Å; V148-V174 HydrophobicContact CB-CG2 4.31Å; V148-V174 HydrophobicContact CG1-CG1 4.33Å; V148-V174 CarbonylContact O-C 3.52Å; V148-V174 WeakPolarHBondContact O-CA 3.42Å; L164-V174 HydrophobicContact CD1-CG1 4.02Å; L168-V174 HydrophobicContact CD1-CG2 3.34Å; V174-F181 HydrophobicContact CG1-CE2 3.64Å; V174-F181 HydrophobicContact CG1-CZ 4.27Å; V174-W184 HydrophobicContact CB-CZ3 4.41Å; V174-W184 HydrophobicContact CG1-CZ3 4.47Å; V174-W184 HydrophobicContact CG2-CZ3 4.24Å; V174-V199 CarbonylContact O-C 3.47Å; V174-V199 WeakPolarHBondContact O-CA 3.18Å; V174-Y200 PolarHBondContact N-O 3.3Å; V174-Y200 PolarHBondContact O-N 2.97Å; V174-F205 HydrophobicContact CG2-CE1 4.26Å; V174-F205 HydrophobicContact CG2-CZ 4.33Å
175	V	97.9	Very high	94.9	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	106.9	-178	-179.3	0	0	0	0	108.1	V72 V75 L76 V148 V149 I150 V197 W198	V72-V175 HydrophobicContact CG1-CG1 4.44Å; V72-V175 HydrophobicContact CG2-CG1 4.24Å; V75-V175 HydrophobicContact CG2-CG1 3.84Å; V75-V175 HydrophobicContact CG2-CG2 3.97Å; L76-V175 HydrophobicContact CD2-CG2 4.01Å; L76-V175 HydrophobicContact CG-CG2 4.47Å; V148-V175 PolarHBondContact O-N 3.47Å; V149-V175 WeakPolarHBondContact CA-O 3.05Å; V149-V175 HydrophobicContact CG2-CB 4.26Å; I150-V175 PolarHBondContact N-O 2.85Å; V175-V197 HydrophobicContact CG1-CG1 3.15Å; V175-W198 CarbonylContact C-O 3.5Å; V175-W198 WeakPolarHBondContact CA-O 3.35Å
176	A	96.6	Very high	94.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.6	179	0	0	0	0	0	111.2	I150 M157 F179 F181 V197 W198 Y200	I150-A176 HydrophobicContact CG2-CB 3.84Å; M157-A176 HydrophobicContact CE-CB 4.12Å; A176-F179 WeakPolarHBondContact CB-O 3.14Å; A176-F181 HydrophobicContact CB-CD2 4.19Å; A176-F181 HydrophobicContact CB-CE2 4.02Å; A176-V197 CarbonylContact O-C 3.54Å; A176-V197 WeakPolarHBondContact O-CA 3.1Å; A176-W198 HydrophobicContact CB-CB 4.39Å; A176-W198 PolarHBondContact N-O 2.88Å; A176-W198 PolarHBondContact O-N 3.44Å; A176-Y200 HydrophobicContact CB-CE2 3.95Å
177	C	93.6	Very high	94.9	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.014	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	135.5	177.7	-60.7	0	0	0	0	110.1	I150 F151 F179	I150-C177 WeakPolarHBondContact O-CB 3.36Å; I150-C177 PolarHBondContact O-N 2.54Å; F151-C177 HydrophobicContact CD2-CB 3.59Å; F151-C177 HydrophobicContact CE2-CB 3.91Å; F151-C177 HydrophobicContact CG-CB 4.21Å; C177-F179 PolarHBondContact O-N 3.32Å
178	R	90.3	Very high	94.9	Very high	95 Å²	95	45.2 Å²	45.2	36%	0.358	26%	0.26	S	S	.	.	S	Bend	trans	65.8	-44.6	172.6	-170.2	176.2	-174.1	140.2	1.2	116.2	T196	R178-T196 PolarHBondContact N-O 3.39Å
179	F	91.4	Very high	94.8	Very high	59 Å²	59	47.9 Å²	47.9	26%	0.259	28%	0.279	S	S	.	.	S	Bend	trans	-116	123.3	-178.4	-57.1	-70.8	0	0	0	109.7	G152 P154 M157 A176 C177	G152-F179 VanDerWaalsContact O-CD2 3.24Å; G152-F179 WeakPolarHBondContact O-CD2 3.45Å; G152-F179 WeakPolarHBondContact O-CE2 3.48Å; P154-F179 HydrophobicContact CG-CD1 3.61Å; P154-F179 HydrophobicContact CG-CD2 4.5Å; P154-F179 HydrophobicContact CG-CE1 3.58Å; P154-F179 HydrophobicContact CG-CE2 4.47Å; P154-F179 HydrophobicContact CG-CG 4.07Å; P154-F179 HydrophobicContact CG-CZ 4.03Å; M157-F179 VanDerWaalsContact CE-O 3.29Å; M157-F179 WeakPolarHBondContact CE-O 3.35Å; M157-F179 HydrophobicContact CG-CB 4.32Å; A176-F179 WeakPolarHBondContact CB-O 3.14Å; C177-F179 PolarHBondContact O-N 3.32Å
180	P	94.4	Very high	94.7	Very high	57 Å²	57	48.9 Å²	48.9	37%	0.37	28%	0.28	S	S	.	.			trans	-72.1	160.2	174.1	29.9	-33.1	0	0	0	111.1	W198 Y200	P180-W198 HydrophobicContact CB-CD2 3.86Å; P180-W198 HydrophobicContact CB-CE3 4.4Å; P180-W198 HydrophobicContact CB-CG 3.98Å; P180-W198 HydrophobicContact CB-CZ2 4.42Å; P180-W198 HydrophobicContact CG-CZ2 4.28Å; P180-Y200 VanDerWaalsContact CA-OH 3.3Å; P180-Y200 WeakPolarHBondContact CA-OH 3.24Å; P180-Y200 VanDerWaalsContact CB-OH 3.22Å; P180-Y200 WeakPolarHBondContact CB-OH 3.33Å
181	F	95.4	Very high	94.7	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.026	27%	0.271	C	S	.	.			trans	-67.6	139.5	164.4	-78.1	-72.9	0	0	0	110.4	I150 M157 L160 E161 L164 V174 A176 T183 W184 Y200	I150-F181 HydrophobicContact CG2-CE2 4.17Å; I150-F181 HydrophobicContact CG2-CZ 4.12Å; M157-F181 HydrophobicContact CB-CD1 4.44Å; M157-F181 HydrophobicContact CE-CD1 3.7Å; M157-F181 HydrophobicContact CE-CD2 4.01Å; M157-F181 HydrophobicContact CE-CE1 3.69Å; M157-F181 HydrophobicContact CE-CE2 3.98Å; M157-F181 HydrophobicContact CE-CG 3.87Å; M157-F181 HydrophobicContact CE-CZ 3.83Å; M157-F181 HydrophobicContact SD-CE1 4.49Å; L160-F181 HydrophobicContact CB-CE1 4.16Å; L160-F181 HydrophobicContact CD2-CE1 4.2Å; L160-F181 HydrophobicContact CD2-CZ 4.08Å; L160-F181 HydrophobicContact CG-CE1 4.05Å; L160-F181 HydrophobicContact CG-CZ 4.19Å; E161-F181 HydrophobicContact CB-CD1 3.65Å; E161-F181 HydrophobicContact CB-CE1 4.11Å; E161-F181 HydrophobicContact CG-CB 4.36Å; E161-F181 HydrophobicContact CG-CD1 3.89Å; E161-F181 HydrophobicContact CG-CG 4.35Å; E161-F181 WeakPolarHBondContact OE2-CB 3.06Å; L164-F181 HydrophobicContact CD1-CE1 4.48Å; L164-F181 HydrophobicContact CD1-CE2 4.48Å; L164-F181 HydrophobicContact CD1-CZ 3.76Å; V174-F181 HydrophobicContact CG1-CE2 3.64Å; V174-F181 HydrophobicContact CG1-CZ 4.27Å; A176-F181 HydrophobicContact CB-CD2 4.19Å; A176-F181 HydrophobicContact CB-CE2 4.02Å; F181-T183 PolarHBondContact O-N 3.49Å; F181-W184 HydrophobicContact CB-CB 4.04Å; F181-W184 HydrophobicContact CB-CD2 4.26Å; F181-W184 HydrophobicContact CB-CE3 4.06Å; F181-W184 HydrophobicContact CB-CG 4.28Å; F181-W184 HydrophobicContact CD1-CE3 4.49Å; F181-W184 AromaticContact CD2-CE3 3.64Å; F181-W184 HydrophobicContact CD2-CE3 3.64Å; F181-W184 AromaticContact CD2-CZ3 3.85Å; F181-W184 HydrophobicContact CD2-CZ3 3.85Å; F181-W184 HydrophobicContact CE2-CE3 4.23Å; F181-W184 AromaticContact CE2-CZ3 3.96Å; F181-W184 HydrophobicContact CE2-CZ3 3.96Å; F181-W184 HydrophobicContact CG-CD2 4.36Å; F181-W184 AromaticContact CG-CE3 3.8Å; F181-W184 HydrophobicContact CG-CE3 3.8Å; F181-W184 HydrophobicContact CG-CZ3 4.19Å; F181-W184 HydrophobicContact CZ-CZ3 4.36Å; F181-Y200 HydrophobicContact CB-CE1 4.32Å; F181-Y200 AromaticContact CD2-CD2 3.9Å; F181-Y200 HydrophobicContact CD2-CD2 3.9Å; F181-Y200 AromaticContact CD2-CE2 3.62Å; F181-Y200 HydrophobicContact CD2-CE2 3.62Å; F181-Y200 HydrophobicContact CE2-CD2 4.46Å; F181-Y200 HydrophobicContact CE2-CE2 4.4Å; F181-Y200 PolarHBondContact N-OH 3.08Å
182	P	92.4	Very high	94.4	Very high	68 Å²	68	51.1 Å²	51.1	44%	0.442	28%	0.282	S	S	.	.	S	Bend	trans	-68.7	-35.1	-168	22.9	-32.4	0	0	0	114	D158 E161	D158-P182 HydrophobicContact CB-CG 4.45Å; D158-P182 WeakPolarHBondContact OD1-CB 3.13Å; D158-P182 WeakPolarHBondContact OD1-CG 3.49Å; E161-P182 WeakPolarHBondContact OE2-CD 3.46Å; E161-P182 WeakPolarHBondContact OE2-CG 3.47Å
183	T	92.7	Very high	94.1	Very high	83 Å²	83	54 Å²	54	51%	0.509	31%	0.312	S	S	.	.	S	Bend	trans	-113.4	-21	-176.2	90.4	0	0	0	0	114.1	E161 F181	E161-T183 WeakPolarHBondContact OE1-CB 3.45Å; E161-T183 PolarHBondContact OE1-OG1 3.39Å; E161-T183 PolarHBondContact OE2-N 3.41Å; E161-T183 PolarHBondContact OE2-OG1 3.07Å; F181-T183 PolarHBondContact O-N 3.49Å
184	W	94.7	Very high	93.6	Very high	24 Å²	24	56.7 Å²	56.7	9%	0.091	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-73.9	138.4	178.2	-66.1	-3.2	0	0	0	112.4	E161 L164 A165 V174 F181 Y200 F205	E161-W184 VanDerWaalsContact CD-CD1 3.44Å; E161-W184 HydrophobicContact CG-CD2 3.67Å; E161-W184 HydrophobicContact CG-CE3 4.37Å; E161-W184 HydrophobicContact CG-CG 3.95Å; E161-W184 HydrophobicContact CG-CH2 4.34Å; E161-W184 HydrophobicContact CG-CZ2 3.61Å; E161-W184 VanDerWaalsContact O-CZ2 3.24Å; E161-W184 WeakPolarHBondContact O-CZ2 3.41Å; E161-W184 PolarHBondContact OE2-N 3.45Å; L164-W184 HydrophobicContact CB-CH2 3.78Å; A165-W184 HydrophobicContact CB-CZ2 3.97Å; V174-W184 HydrophobicContact CB-CZ3 4.41Å; V174-W184 HydrophobicContact CG1-CZ3 4.47Å; V174-W184 HydrophobicContact CG2-CZ3 4.24Å; F181-W184 HydrophobicContact CB-CB 4.04Å; F181-W184 HydrophobicContact CB-CD2 4.26Å; F181-W184 HydrophobicContact CB-CE3 4.06Å; F181-W184 HydrophobicContact CB-CG 4.28Å; F181-W184 HydrophobicContact CD1-CE3 4.49Å; F181-W184 AromaticContact CD2-CE3 3.64Å; F181-W184 HydrophobicContact CD2-CE3 3.64Å; F181-W184 AromaticContact CD2-CZ3 3.85Å; F181-W184 HydrophobicContact CD2-CZ3 3.85Å; F181-W184 HydrophobicContact CE2-CE3 4.23Å; F181-W184 AromaticContact CE2-CZ3 3.96Å; F181-W184 HydrophobicContact CE2-CZ3 3.96Å; F181-W184 HydrophobicContact CG-CD2 4.36Å; F181-W184 AromaticContact CG-CE3 3.8Å; F181-W184 HydrophobicContact CG-CE3 3.8Å; F181-W184 HydrophobicContact CG-CZ3 4.19Å; F181-W184 HydrophobicContact CZ-CZ3 4.36Å; W184-Y200 HydrophobicContact CB-CD1 3.64Å; W184-Y200 HydrophobicContact CB-CE1 3.68Å; W184-Y200 HydrophobicContact CE3-CD1 4.09Å; W184-Y200 AromaticContact CE3-CG 3.99Å; W184-Y200 HydrophobicContact CE3-CG 3.99Å; W184-F205 HydrophobicContact CD2-CB 3.97Å; W184-F205 AromaticContact CD2-CD1 3.62Å; W184-F205 HydrophobicContact CD2-CD1 3.62Å; W184-F205 HydrophobicContact CD2-CE1 4.18Å; W184-F205 AromaticContact CD2-CG 3.92Å; W184-F205 HydrophobicContact CD2-CG 3.92Å; W184-F205 AromaticContact CE2-CD1 3.71Å; W184-F205 AromaticContact CE2-CG 3.57Å; W184-F205 AromaticContact CE3-CD1 3.63Å; W184-F205 HydrophobicContact CE3-CD1 3.63Å; W184-F205 AromaticContact CE3-CE1 3.77Å; W184-F205 HydrophobicContact CE3-CE1 3.77Å; W184-F205 HydrophobicContact CE3-CG 4.36Å; W184-F205 HydrophobicContact CG-CB 3.99Å; W184-F205 HydrophobicContact CG-CD1 4.32Å; W184-F205 HydrophobicContact CG-CG 4.46Å; W184-F205 AromaticContact CH2-CD1 3.82Å; W184-F205 HydrophobicContact CH2-CD1 3.82Å; W184-F205 HydrophobicContact CH2-CD2 4.21Å; W184-F205 AromaticContact CH2-CE1 3.46Å; W184-F205 HydrophobicContact CH2-CE1 3.46Å; W184-F205 VanDerWaalsContact CH2-CE1 3.46Å; W184-F205 AromaticContact CH2-CE2 3.93Å; W184-F205 HydrophobicContact CH2-CE2 3.93Å; W184-F205 HydrophobicContact CH2-CG 4.16Å; W184-F205 AromaticContact CH2-CZ 3.5Å; W184-F205 HydrophobicContact CH2-CZ 3.5Å; W184-F205 VanDerWaalsContact CH2-CZ 3.5Å; W184-F205 HydrophobicContact CZ2-CB 4.26Å; W184-F205 AromaticContact CZ2-CD1 3.83Å; W184-F205 HydrophobicContact CZ2-CD1 3.83Å; W184-F205 AromaticContact CZ2-CD2 3.76Å; W184-F205 HydrophobicContact CZ2-CD2 3.76Å; W184-F205 AromaticContact CZ2-CE1 3.91Å; W184-F205 HydrophobicContact CZ2-CE1 3.91Å; W184-F205 AromaticContact CZ2-CE2 3.89Å; W184-F205 HydrophobicContact CZ2-CE2 3.89Å; W184-F205 AromaticContact CZ2-CG 3.72Å; W184-F205 HydrophobicContact CZ2-CG 3.72Å; W184-F205 AromaticContact CZ2-CZ 3.92Å; W184-F205 HydrophobicContact CZ2-CZ 3.92Å; W184-F205 AromaticContact CZ3-CD1 3.74Å; W184-F205 HydrophobicContact CZ3-CD1 3.74Å; W184-F205 AromaticContact CZ3-CE1 3.39Å; W184-F205 HydrophobicContact CZ3-CE1 3.39Å; W184-F205 HydrophobicContact CZ3-CG 4.47Å; W184-F205 AromaticContact CZ3-CZ 3.91Å; W184-F205 HydrophobicContact CZ3-CZ 3.91Å; W184-F205 AromaticContact NE1-CG 3.95Å
185	V	93.7	Very high	93.3	Very high	100 Å²	100	58.2 Å²	58.2	61%	0.606	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-84.3	121.8	172.2	-176.9	0	0	0	0	108.9
186	P	95.4	Very high	93.1	Very high	47 Å²	47	59 Å²	59	31%	0.305	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-68.3	138.7	176.2	28.2	-33.1	0	0	0	110.6	W198 V199 Y200	P186-W198 HydrophobicContact CB-CE3 4.01Å; P186-W198 HydrophobicContact CG-CE3 3.8Å; P186-W198 HydrophobicContact CG-CZ3 4.13Å; P186-V199 CarbonylContact C-O 3.57Å; P186-V199 WeakPolarHBondContact CA-O 3.3Å; P186-Y200 HydrophobicContact CB-CD1 4.28Å; P186-Y200 HydrophobicContact CB-CE1 3.79Å; P186-Y200 HydrophobicContact CG-CE1 4.47Å
187	E	95.2	Very high	93.1	Very high	112 Å²	112	59 Å²	59	52%	0.523	34%	0.34	S	S	.	.	S	Bend	trans	-69.4	-39.7	171.5	178.3	-176	-137.8	0	0	110.8	K173 V199	K173-E187 IonicContact NZ-OE1 2.65Å; K173-E187 PolarHBondContact NZ-OE1 2.8Å; K173-E187 IonicContact NZ-OE2 2.71Å; K173-E187 PolarHBondContact NZ-OE2 2.77Å; E187-V199 PolarHBondContact N-O 3.45Å
188	S	95.1	Very high	93.3	Very high	53 Å²	53	62.1 Å²	62.1	37%	0.371	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	168.5	177.5	64.1	0	0	0	0	111.1	V199	S188-V199 PolarHBondContact O-N 2.83Å
189	S	95.6	Very high	93.6	Very high	62 Å²	62	58 Å²	58	43%	0.434	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	147.1	172.3	59.1	0	0	0	0	110.6	V197	S189-V197 CarbonylContact C-O 3.59Å; S189-V197 WeakPolarHBondContact CA-O 3.12Å; S189-V197 WeakPolarHBondContact CB-O 3.49Å
190	E	94.3	Very high	93.9	Very high	68 Å²	68	55.2 Å²	55.2	32%	0.318	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.4	178.8	-75.7	-70.5	148.8	0	0	110.9	N71 R74 V75 T196 V197	N71-E190 HydrophobicContact CB-CB 4.46Å; R74-E190 WeakPolarHBondContact CD-OE2 3.48Å; R74-E190 IonicContact NH1-OE2 2.74Å; R74-E190 PolarHBondContact NH1-OE2 2.97Å; V75-E190 HydrophobicContact CG1-CB 3.84Å; V75-E190 HydrophobicContact CG1-CG 3.33Å; E190-T196 CarbonylContact O-C 3.55Å; E190-T196 WeakPolarHBondContact O-CA 3.29Å; E190-V197 PolarHBondContact N-O 3.45Å; E190-V197 PolarHBondContact O-N 3.32Å
191	G	92	Very high	94	Very high	35 Å²	35	54.1 Å²	54.1	36%	0.361	32%	0.316	S	S	.	.	S	Bend	trans	87.9	-176.1	-179.3	0	0	0	0	0	114.3	N71	N71-G191 WeakPolarHBondContact ND2-CA 3.34Å
192	E	89.3	Confident	93.9	Very high	170 Å²	170	53.8 Å²	53.8	79%	0.794	31%	0.314	S	S	*	.	S	Bend	trans	-134.9	151.2	-177.1	-64.6	-172.5	178.2	0	0	111.6	I194 D195 T196	E192-I194 PolarHBondContact O-N 2.97Å; E192-D195 PolarHBondContact O-N 3.45Å; E192-D195 VanDerWaalsContact O-N 3.15Å; E192-T196 VanDerWaalsContact C-OG1 3.26Å
193	G	90.9	Very high	93.9	Very high	61 Å²	61	57.7 Å²	57.7	63%	0.629	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	56	-128.5	175.1	0	0	0	0	0	113.3	D195 T196	G193-D195 PolarHBondContact O-N 2.89Å; G193-T196 PolarHBondContact N-OG1 2.96Å; G193-T196 WeakPolarHBondContact O-CB 3.19Å; G193-T196 PolarHBondContact O-N 2.87Å; G193-T196 PolarHBondContact O-OG1 3.38Å
194	I	87.6	Confident	93.8	Very high	87 Å²	87	56.6 Å²	56.6	45%	0.446	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-68.6	-18.2	-177.5	63.4	170.7	0	0	0	113.9	Q68 E192	Q68-I194 PolarHBondContact NE2-O 3.37Å; E192-I194 PolarHBondContact O-N 2.97Å
195	D	90.8	Very high	93.4	Very high	32 Å²	32	56 Å²	56	17%	0.171	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-96.9	7.1	-179	-61.4	-48.9	0	0	0	112.4	T65 Q68 N71 E192 G193	T65-D195 WeakPolarHBondContact CG2-OD1 3.23Å; T65-D195 VanDerWaalsContact OG1-CG 3.32Å; T65-D195 PolarHBondContact OG1-OD1 3.1Å; Q68-D195 HydrophobicContact CB-CB 4.4Å; N71-D195 PolarHBondContact ND2-O 3.08Å; E192-D195 PolarHBondContact O-N 3.45Å; E192-D195 VanDerWaalsContact O-N 3.15Å; G193-D195 PolarHBondContact O-N 2.89Å
196	T	93.9	Very high	93.1	Very high	19 Å²	19	53 Å²	53	12%	0.117	30%	0.295	C	S	.	.			trans	-63.7	137	175.7	-51	0	0	0	0	110.4	R178 E190 E192 G193 W198	R178-T196 PolarHBondContact N-O 3.39Å; E190-T196 CarbonylContact O-C 3.55Å; E190-T196 WeakPolarHBondContact O-CA 3.29Å; E192-T196 VanDerWaalsContact C-OG1 3.26Å; G193-T196 PolarHBondContact N-OG1 2.96Å; G193-T196 WeakPolarHBondContact O-CB 3.19Å; G193-T196 PolarHBondContact O-N 2.87Å; G193-T196 PolarHBondContact O-OG1 3.38Å; T196-W198 HydrophobicContact CG2-CD2 4.4Å; T196-W198 HydrophobicContact CG2-CZ2 3.95Å
197	V	96.3	Very high	92.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.5	177.6	177.8	0	0	0	0	108.6	N71 V72 V75 V175 A176 S189 E190	N71-V197 HydrophobicContact CB-CB 4.48Å; N71-V197 HydrophobicContact CB-CG2 3.77Å; V72-V197 HydrophobicContact CG2-CG1 4.23Å; V72-V197 HydrophobicContact CG2-CG2 3.83Å; V75-V197 HydrophobicContact CG2-CG1 4.16Å; V175-V197 HydrophobicContact CG1-CG1 3.15Å; A176-V197 CarbonylContact O-C 3.54Å; A176-V197 WeakPolarHBondContact O-CA 3.1Å; S189-V197 CarbonylContact C-O 3.59Å; S189-V197 WeakPolarHBondContact CA-O 3.12Å; S189-V197 WeakPolarHBondContact CB-O 3.49Å; E190-V197 PolarHBondContact N-O 3.45Å; E190-V197 PolarHBondContact O-N 3.32Å
198	W	97.1	Very high	91.4	Very high	66 Å²	66	50.2 Å²	50.2	25%	0.25	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.5	-178.2	-53.3	90	0	0	0	109.9	V175 A176 P180 P186 T196 Y200	V175-W198 CarbonylContact C-O 3.5Å; V175-W198 WeakPolarHBondContact CA-O 3.35Å; A176-W198 HydrophobicContact CB-CB 4.39Å; A176-W198 PolarHBondContact N-O 2.88Å; A176-W198 PolarHBondContact O-N 3.44Å; P180-W198 HydrophobicContact CB-CD2 3.86Å; P180-W198 HydrophobicContact CB-CE3 4.4Å; P180-W198 HydrophobicContact CB-CG 3.98Å; P180-W198 HydrophobicContact CB-CZ2 4.42Å; P180-W198 HydrophobicContact CG-CZ2 4.28Å; P186-W198 HydrophobicContact CB-CE3 4.01Å; P186-W198 HydrophobicContact CG-CE3 3.8Å; P186-W198 HydrophobicContact CG-CZ3 4.13Å; T196-W198 HydrophobicContact CG2-CD2 4.4Å; T196-W198 HydrophobicContact CG2-CZ2 3.95Å; W198-Y200 HydrophobicContact CB-CE2 3.56Å
199	V	97.6	Very high	90.3	Very high	9 Å²	9	51.3 Å²	51.3	6%	0.055	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.8	-177.2	-173.2	0	0	0	0	109.7	V75 V174 P186 E187 S188	V75-V199 HydrophobicContact CB-CG2 3.69Å; V75-V199 HydrophobicContact CG1-CG2 3.58Å; V75-V199 HydrophobicContact CG2-CG2 4.05Å; V174-V199 CarbonylContact O-C 3.47Å; V174-V199 WeakPolarHBondContact O-CA 3.18Å; P186-V199 CarbonylContact C-O 3.57Å; P186-V199 WeakPolarHBondContact CA-O 3.3Å; E187-V199 PolarHBondContact N-O 3.45Å; S188-V199 PolarHBondContact O-N 2.83Å
200	Y	97.4	Very high	89	Confident	1 Å²	1	54.7 Å²	54.7	0%	0.004	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.2	179.8	-54.7	-90.5	0	0	0	110.7	K173 V174 A176 P180 F181 W184 P186 W198	K173-Y200 WeakPolarHBondContact CA-O 3.3Å; V174-Y200 PolarHBondContact N-O 3.3Å; V174-Y200 PolarHBondContact O-N 2.97Å; A176-Y200 HydrophobicContact CB-CE2 3.95Å; P180-Y200 VanDerWaalsContact CA-OH 3.3Å; P180-Y200 WeakPolarHBondContact CA-OH 3.24Å; P180-Y200 VanDerWaalsContact CB-OH 3.22Å; P180-Y200 WeakPolarHBondContact CB-OH 3.33Å; F181-Y200 HydrophobicContact CB-CE1 4.32Å; F181-Y200 AromaticContact CD2-CD2 3.9Å; F181-Y200 HydrophobicContact CD2-CD2 3.9Å; F181-Y200 AromaticContact CD2-CE2 3.62Å; F181-Y200 HydrophobicContact CD2-CE2 3.62Å; F181-Y200 HydrophobicContact CE2-CD2 4.46Å; F181-Y200 HydrophobicContact CE2-CE2 4.4Å; F181-Y200 PolarHBondContact N-OH 3.08Å; W184-Y200 HydrophobicContact CB-CD1 3.64Å; W184-Y200 HydrophobicContact CB-CE1 3.68Å; W184-Y200 HydrophobicContact CE3-CD1 4.09Å; W184-Y200 AromaticContact CE3-CG 3.99Å; W184-Y200 HydrophobicContact CE3-CG 3.99Å; P186-Y200 HydrophobicContact CB-CD1 4.28Å; P186-Y200 HydrophobicContact CB-CE1 3.79Å; P186-Y200 HydrophobicContact CG-CE1 4.47Å; W198-Y200 HydrophobicContact CB-CE2 3.56Å
201	D	96.1	Very high	87.9	Confident	33 Å²	33	58.6 Å²	58.6	18%	0.176	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.7	172	-165.1	-39.1	0	0	0	110.4	K173 K203 T204 F205	K173-D201 HydrophobicContact CD-CB 4.25Å; K173-D201 VanDerWaalsContact NZ-CG 3.3Å; K173-D201 IonicContact NZ-OD2 3.19Å; K173-D201 PolarHBondContact NZ-OD2 3.3Å; D201-K203 PolarHBondContact O-N 3.46Å; D201-K203 WeakPolarHBondContact OD1-CB 3.46Å; D201-K203 PolarHBondContact OD1-N 3.06Å; D201-T204 WeakPolarHBondContact O-CB 3.35Å; D201-T204 PolarHBondContact O-N 3.39Å; D201-F205 VanDerWaalsContact O-CD1 3.28Å; D201-F205 WeakPolarHBondContact O-CD1 3.26Å; D201-F205 PolarHBondContact O-N 2.81Å
202	A	93.9	Very high	86.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59	-33.2	177.1	0	0	0	0	0	113.7	P169 A172 T204 F205 H206	P169-A202 VanDerWaalsContact O-CB 3.27Å; P169-A202 WeakPolarHBondContact O-CB 3.39Å; A172-A202 HydrophobicContact CB-CB 4.07Å; A172-A202 VanDerWaalsContact O-CB 3.24Å; A172-A202 WeakPolarHBondContact O-CB 3.24Å; A172-A202 PolarHBondContact O-N 3.28Å; A202-T204 PolarHBondContact O-N 3.03Å; A202-F205 HydrophobicContact CB-CE1 3.95Å; A202-F205 HydrophobicContact CB-CE2 3.74Å; A202-F205 HydrophobicContact CB-CZ 3.39Å; A202-F205 WeakPolarHBondContact O-CD2 3.45Å; A202-F205 PolarHBondContact O-N 2.82Å; A202-H206 VanDerWaalsContact O-CB 3.3Å; A202-H206 WeakPolarHBondContact O-CB 3.29Å; A202-H206 PolarHBondContact O-CD2 3.38Å; A202-H206 PolarHBondContact O-N 3.3Å
203	K	92.6	Very high	85.5	Confident	149 Å²	149	58.1 Å²	58.1	65%	0.648	30%	0.3	S	S	*	.	H	α-helix	trans	-57.5	-38.8	174.6	-171.2	-178.7	177.7	-175	0	111.9	S170 D201 S207	S170-K203 PolarHBondContact O-N 3.31Å; S170-K203 VanDerWaalsContact O-N 3.1Å; D201-K203 PolarHBondContact O-N 3.46Å; D201-K203 WeakPolarHBondContact OD1-CB 3.46Å; D201-K203 PolarHBondContact OD1-N 3.06Å; K203-S207 WeakPolarHBondContact O-CB 3.42Å; K203-S207 PolarHBondContact O-N 2.99Å; K203-S207 VanDerWaalsContact O-N 3.14Å
204	T	90.1	Very high	83.8	Confident	61 Å²	61	57.3 Å²	57.3	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-67.9	-53.9	-177.6	-54.9	0	0	0	0	110.7	D201 A202 H206 S207 D208	D201-T204 WeakPolarHBondContact O-CB 3.35Å; D201-T204 PolarHBondContact O-N 3.39Å; A202-T204 PolarHBondContact O-N 3.03Å; T204-H206 PolarHBondContact O-N 2.67Å; T204-S207 PolarHBondContact O-N 3.35Å; T204-S207 PolarHBondContact O-OG 3.1Å; T204-D208 PolarHBondContact O-N 2.97Å; T204-D208 VanDerWaalsContact O-N 3.15Å
205	F	87.1	Confident	82.1	Confident	10 Å²	10	59.9 Å²	59.9	4%	0.044	30%	0.302	C	S	.	.	H	α-helix	trans	-72.8	-25.9	-177.2	56.4	-113.6	0	0	0	113.9	A165 L168 V174 W184 D201 A202 D208 L209	A165-F205 HydrophobicContact CB-CD2 4.45Å; L168-F205 HydrophobicContact CD1-CZ 4.32Å; V174-F205 HydrophobicContact CG2-CE1 4.26Å; V174-F205 HydrophobicContact CG2-CZ 4.33Å; W184-F205 HydrophobicContact CD2-CB 3.97Å; W184-F205 AromaticContact CD2-CD1 3.62Å; W184-F205 HydrophobicContact CD2-CD1 3.62Å; W184-F205 HydrophobicContact CD2-CE1 4.18Å; W184-F205 AromaticContact CD2-CG 3.92Å; W184-F205 HydrophobicContact CD2-CG 3.92Å; W184-F205 AromaticContact CE2-CD1 3.71Å; W184-F205 AromaticContact CE2-CG 3.57Å; W184-F205 AromaticContact CE3-CD1 3.63Å; W184-F205 HydrophobicContact CE3-CD1 3.63Å; W184-F205 AromaticContact CE3-CE1 3.77Å; W184-F205 HydrophobicContact CE3-CE1 3.77Å; W184-F205 HydrophobicContact CE3-CG 4.36Å; W184-F205 HydrophobicContact CG-CB 3.99Å; W184-F205 HydrophobicContact CG-CD1 4.32Å; W184-F205 HydrophobicContact CG-CG 4.46Å; W184-F205 AromaticContact CH2-CD1 3.82Å; W184-F205 HydrophobicContact CH2-CD1 3.82Å; W184-F205 HydrophobicContact CH2-CD2 4.21Å; W184-F205 AromaticContact CH2-CE1 3.46Å; W184-F205 HydrophobicContact CH2-CE1 3.46Å; W184-F205 VanDerWaalsContact CH2-CE1 3.46Å; W184-F205 AromaticContact CH2-CE2 3.93Å; W184-F205 HydrophobicContact CH2-CE2 3.93Å; W184-F205 HydrophobicContact CH2-CG 4.16Å; W184-F205 AromaticContact CH2-CZ 3.5Å; W184-F205 HydrophobicContact CH2-CZ 3.5Å; W184-F205 VanDerWaalsContact CH2-CZ 3.5Å; W184-F205 HydrophobicContact CZ2-CB 4.26Å; W184-F205 AromaticContact CZ2-CD1 3.83Å; W184-F205 HydrophobicContact CZ2-CD1 3.83Å; W184-F205 AromaticContact CZ2-CD2 3.76Å; W184-F205 HydrophobicContact CZ2-CD2 3.76Å; W184-F205 AromaticContact CZ2-CE1 3.91Å; W184-F205 HydrophobicContact CZ2-CE1 3.91Å; W184-F205 AromaticContact CZ2-CE2 3.89Å; W184-F205 HydrophobicContact CZ2-CE2 3.89Å; W184-F205 AromaticContact CZ2-CG 3.72Å; W184-F205 HydrophobicContact CZ2-CG 3.72Å; W184-F205 AromaticContact CZ2-CZ 3.92Å; W184-F205 HydrophobicContact CZ2-CZ 3.92Å; W184-F205 AromaticContact CZ3-CD1 3.74Å; W184-F205 HydrophobicContact CZ3-CD1 3.74Å; W184-F205 AromaticContact CZ3-CE1 3.39Å; W184-F205 HydrophobicContact CZ3-CE1 3.39Å; W184-F205 HydrophobicContact CZ3-CG 4.47Å; W184-F205 AromaticContact CZ3-CZ 3.91Å; W184-F205 HydrophobicContact CZ3-CZ 3.91Å; W184-F205 AromaticContact NE1-CG 3.95Å; D201-F205 VanDerWaalsContact O-CD1 3.28Å; D201-F205 WeakPolarHBondContact O-CD1 3.26Å; D201-F205 PolarHBondContact O-N 2.81Å; A202-F205 HydrophobicContact CB-CE1 3.95Å; A202-F205 HydrophobicContact CB-CE2 3.74Å; A202-F205 HydrophobicContact CB-CZ 3.39Å; A202-F205 WeakPolarHBondContact O-CD2 3.45Å; A202-F205 PolarHBondContact O-N 2.82Å; F205-D208 PolarHBondContact O-N 3.47Å; F205-L209 PolarHBondContact O-N 3.18Å; F205-L209 VanDerWaalsContact O-N 3.08Å
206	H	86.1	Confident	80.3	Confident	37 Å²	37	63.8 Å²	63.8	17%	0.171	33%	0.326	C	S	.	.	H	α-helix	trans	-66.1	-39.8	169.2	-84.7	-65.8	0	0	0	111.9	A165 L168 A202 T204 D208 L209 H210	A165-H206 PolarHBondContact O-CE1 2.84Å; A165-H206 PolarHBondContact O-NE2 3.41Å; L168-H206 PolarHBondContact O-NE2 3.01Å; A202-H206 VanDerWaalsContact O-CB 3.3Å; A202-H206 WeakPolarHBondContact O-CB 3.29Å; A202-H206 PolarHBondContact O-CD2 3.38Å; A202-H206 PolarHBondContact O-N 3.3Å; T204-H206 PolarHBondContact O-N 2.67Å; H206-D208 VanDerWaalsContact C-N 3.33Å; H206-D208 PolarHBondContact O-N 3.34Å; H206-L209 PolarHBondContact O-N 2.91Å; H206-H210 PolarHBondContact O-CD2 3.32Å; H206-H210 PolarHBondContact O-N 2.9Å; H206-H210 VanDerWaalsContact O-N 3.08Å
207	S	79.8	Confident	78.3	Confident	65 Å²	65	71.3 Å²	71.3	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-65.2	-37.9	177	76.1	0	0	0	0	112.3	K203 T204 H210 R211	K203-S207 WeakPolarHBondContact O-CB 3.42Å; K203-S207 PolarHBondContact O-N 2.99Å; K203-S207 VanDerWaalsContact O-N 3.14Å; T204-S207 PolarHBondContact O-N 3.35Å; T204-S207 PolarHBondContact O-OG 3.1Å; S207-H210 PolarHBondContact O-N 3.19Å; S207-R211 WeakPolarHBondContact O-CB 3.39Å; S207-R211 PolarHBondContact O-N 3.03Å
208	D	75.7	Confident	76.1	Confident	37 Å²	37	77.9 Å²	77.9	20%	0.198	39%	0.392	C	S	.	.	H	α-helix	trans	-67.4	-38.3	175.5	-79.7	-38.1	0	0	0	112.6	T204 F205 H206 R211 K212	T204-D208 PolarHBondContact O-N 2.97Å; T204-D208 VanDerWaalsContact O-N 3.15Å; F205-D208 PolarHBondContact O-N 3.47Å; H206-D208 VanDerWaalsContact C-N 3.33Å; H206-D208 PolarHBondContact O-N 3.34Å; D208-R211 PolarHBondContact O-N 2.88Å; D208-R211 IonicContact OD1-CZ 2.64Å; D208-R211 IonicContact OD1-NE 2.91Å; D208-R211 IonicContact OD1-NH2 3.6Å; D208-R211 PolarHBondContact OD1-NH2 2.96Å; D208-K212 WeakPolarHBondContact O-CG 3.41Å; D208-K212 PolarHBondContact O-N 3.39Å
209	L	71.6	Confident	73.6	Confident	76 Å²	76	81.9 Å²	81.9	40%	0.398	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-46.4	175.1	-171.9	67.8	0	0	0	111.1	F205 H206 K212 T213	F205-L209 PolarHBondContact O-N 3.18Å; F205-L209 VanDerWaalsContact O-N 3.08Å; H206-L209 PolarHBondContact O-N 2.91Å; L209-K212 PolarHBondContact O-N 3.42Å; L209-T213 PolarHBondContact O-N 2.84Å; L209-T213 PolarHBondContact O-OG1 2.89Å
210	H	69.3	Low	71.1	Confident	133 Å²	133	87 Å²	87	62%	0.616	45%	0.451	S	S	*	.	H	α-helix	trans	-63.3	-39.4	176	-76.4	-55.8	0	0	0	112.9	H206 S207 T213 G214	H206-H210 PolarHBondContact O-CD2 3.32Å; H206-H210 PolarHBondContact O-N 2.9Å; H206-H210 VanDerWaalsContact O-N 3.08Å; S207-H210 PolarHBondContact O-N 3.19Å; H210-T213 WeakPolarHBondContact CA-OG1 3.43Å; H210-T213 PolarHBondContact O-OG1 2.59Å; H210-G214 PolarHBondContact O-N 3.4Å
211	R	70.7	Confident	68.8	Low	149 Å²	149	93.1 Å²	93.1	56%	0.562	49%	0.488	S	S	*	.	H	α-helix	trans	-63.6	-43.8	175.8	-177.2	173.2	59.8	150.7	-3.3	111.8	S207 D208 G214 Q215	S207-R211 WeakPolarHBondContact O-CB 3.39Å; S207-R211 PolarHBondContact O-N 3.03Å; D208-R211 PolarHBondContact O-N 2.88Å; D208-R211 IonicContact OD1-CZ 2.64Å; D208-R211 IonicContact OD1-NE 2.91Å; D208-R211 IonicContact OD1-NH2 3.6Å; D208-R211 PolarHBondContact OD1-NH2 2.96Å; R211-G214 PolarHBondContact O-N 3.07Å; R211-Q215 WeakPolarHBondContact O-CG 3.37Å; R211-Q215 PolarHBondContact O-N 3.29Å; R211-Q215 VanDerWaalsContact O-N 3.08Å
212	K	65.3	Low	66.7	Low	123 Å²	123	96.4 Å²	96.4	54%	0.535	52%	0.52	S	S	.	.	H	α-helix	trans	-65.4	-44.1	178	-75	178	179.7	176.5	0	112.1	D208 L209 T216	D208-K212 WeakPolarHBondContact O-CG 3.41Å; D208-K212 PolarHBondContact O-N 3.39Å; L209-K212 PolarHBondContact O-N 3.42Å; K212-T216 PolarHBondContact O-N 2.98Å; K212-T216 PolarHBondContact O-OG1 3.18Å
213	T	66.4	Low	65.1	Low	73 Å²	73	105.5 Å²	105.5	45%	0.448	58%	0.584	S	S	.	*	H	α-helix	trans	-68.2	-39.5	176.6	29.1	0	0	0	0	112.2	L209 H210 Q215 T216 F217	L209-T213 PolarHBondContact O-N 2.84Å; L209-T213 PolarHBondContact O-OG1 2.89Å; H210-T213 WeakPolarHBondContact CA-OG1 3.43Å; H210-T213 PolarHBondContact O-OG1 2.59Å; T213-Q215 PolarHBondContact O-N 3.15Å; T213-T216 PolarHBondContact O-N 3.32Å; T213-F217 VanDerWaalsContact O-CD2 3.25Å; T213-F217 WeakPolarHBondContact O-CD2 3.42Å
214	G	54.5	Low	63.7	Low	44 Å²	44	103.3 Å²	103.3	45%	0.454	58%	0.58	S	S	.	*	H	α-helix	trans	-65.6	-32.5	177	0	0	0	0	0	114.4	H210 R211	H210-G214 PolarHBondContact O-N 3.4Å; R211-G214 PolarHBondContact O-N 3.07Å
215	Q	52.7	Low	62.3	Low	141 Å²	141	105.5 Å²	105.5	66%	0.659	59%	0.591	S	S	*	*	H	α-helix	trans	-75.3	-22	175.9	-76.9	-176.4	-7.8	0	0	113.9	R211 T213 F217	R211-Q215 WeakPolarHBondContact O-CG 3.37Å; R211-Q215 PolarHBondContact O-N 3.29Å; R211-Q215 VanDerWaalsContact O-N 3.08Å; T213-Q215 PolarHBondContact O-N 3.15Å; Q215-F217 VanDerWaalsContact C-N 3.25Å; Q215-F217 PolarHBondContact O-N 3.35Å
216	T	53	Low	60.9	Low	113 Å²	113	110.8 Å²	110.8	69%	0.693	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-14.8	-179.6	-51.4	0	0	0	0	112.6	K212 T213	K212-T216 PolarHBondContact O-N 2.98Å; K212-T216 PolarHBondContact O-OG1 3.18Å; T213-T216 PolarHBondContact O-N 3.32Å
217	F	51.6	Low	59.5	Low	177 Å²	177	115.2 Å²	115.2	78%	0.776	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-0.8	-179	-74.1	-78.2	0	0	0	115.5	T213 Q215 L219	T213-F217 VanDerWaalsContact O-CD2 3.25Å; T213-F217 WeakPolarHBondContact O-CD2 3.42Å; Q215-F217 VanDerWaalsContact C-N 3.25Å; Q215-F217 PolarHBondContact O-N 3.35Å; F217-L219 PolarHBondContact O-N 2.73Å
218	I	50.4	Low	58.2	Low	139 Å²	139	118.3 Å²	118.3	71%	0.713	66%	0.66	S	S	*	*			trans	-96.5	83.1	174.4	-51.3	-179.4	0	0	0	108.2
219	L	43.9	Very low	57	Low	149 Å²	149	123.7 Å²	123.7	78%	0.78	69%	0.691	S	S	*	*			trans	-62.3	135.2	162.2	-72.9	171.2	0	0	0	108.1	F217 T221	F217-L219 PolarHBondContact O-N 2.73Å; L219-T221 PolarHBondContact O-N 3.2Å; L219-T221 VanDerWaalsContact O-N 3.09Å
220	P	43.9	Very low	56	Low	118 Å²	118	127.1 Å²	127.1	77%	0.766	71%	0.712	S	S	*	*			trans	-66.3	114.7	171.4	27	-28.7	0	0	0	107.6	A222	P220-A222 PolarHBondContact O-N 3.34Å; P220-A222 VanDerWaalsContact O-N 3.09Å
221	T	49.6	Very low	54.9	Low	128 Å²	128	126.7 Å²	126.7	79%	0.785	72%	0.719	S	S	*	*			trans	-61.2	111.2	161.2	44.3	0	0	0	0	106.9	L219 S223	L219-T221 PolarHBondContact O-N 3.2Å; L219-T221 VanDerWaalsContact O-N 3.09Å; T221-S223 PolarHBondContact O-N 2.99Å
222	A	53.3	Low	53.6	Low	103 Å²	103	124.8 Å²	124.8	85%	0.851	73%	0.732	S	S	*	*			trans	-62.3	124.5	172.3	0	0	0	0	0	108.9	P220	P220-A222 PolarHBondContact O-N 3.34Å; P220-A222 VanDerWaalsContact O-N 3.09Å
223	S	59	Low	52.6	Low	190 Å²	190	125 Å²	125	100%	1.329	75%	0.75	S	S	*	*			trans	-98.9	0	167.7	-58.7	0	0	0	0	109.7	T221	T221-S223 PolarHBondContact O-N 2.99Å

Retrieved 223 of 223 residues in 326.1 ms (Link to these results)

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