A0A096NQ75_PAPAN Loading...

Hedgehog protein

The dually lipidated hedgehog protein N-product is a morphogen which is essential for a variety of patterning events during development. The C-terminal part of the hedgehog protein precursor displays an autoproteolysis activity that results in the cleavage of the full-length protein into two parts (N-product and C-product). In addition, the C-terminal part displays a cholesterol transferase activity that results by the covalent attachment of a cholesterol moiety to the C-terminal of the newly generated N-product.

AlphaFold DB (A0A2K5KQ34), UniProt , Accession A0A096NQ75, Species PAPAN (Papio anubis, Olive baboon), Gene IHH, Length 411 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	46	Very low	51.6	Low	243 Å²	243	149.8 Å²	149.8	100%	1.197	75%	0.751	S	S	*	*				0	120.8	0	-70.5	159.6	79.8	0	0	107.7
2	S	41.5	Very low	52.2	Low	104 Å²	104	149.5 Å²	149.5	73%	0.727	74%	0.742	S	S	*	*			trans	-70.6	135.3	-160	-173.5	0	0	0	0	114	A4	S2-A4 PolarHBondContact O-N 2.76Å
3	P	51	Low	52.8	Low	128 Å²	128	144.3 Å²	144.3	83%	0.831	73%	0.727	S	S	*	*	S	Bend	trans	-82	26.3	-172.2	35.4	-36	0	0	0	114.3
4	A	53.6	Low	53.5	Low	80 Å²	80	140.9 Å²	140.9	66%	0.661	71%	0.711	S	S	*	*			trans	-105.6	10.3	-168.9	0	0	0	0	0	115.7	S2	S2-A4 PolarHBondContact O-N 2.76Å
5	R	52.4	Low	54.1	Low	223 Å²	223	139.4 Å²	139.4	84%	0.842	71%	0.705	S	S	*	*	S	Bend	trans	-120.7	16.5	-179.2	-64	-167.4	-161.5	-153.1	4.9	115.8
6	L	50.4	Low	54.5	Low	137 Å²	137	136.6 Å²	136.6	72%	0.717	69%	0.692	S	S	*	*	S	Bend	trans	-104.1	-17	-179.6	-124.6	80.2	0	0	0	114.9	L10	L6-L10 PolarHBondContact O-N 2.86Å
7	R	54.9	Low	54.9	Low	206 Å²	206	135 Å²	135	78%	0.777	69%	0.685	S	S	*	*	H	α-helix	trans	-70.9	-39.2	-175.1	-74	-174.6	172.8	-173.5	-2.7	116.3	R9 L10 H11	R7-R9 PolarHBondContact O-N 3.36Å; R7-L10 PolarHBondContact O-N 2.71Å; R7-H11 PolarHBondContact O-CD2 2.94Å; R7-H11 VanDerWaalsContact O-CD2 3.3Å; R7-H11 PolarHBondContact O-N 3.44Å
8	P	49.7	Very low	55	Low	92 Å²	92	134.4 Å²	134.4	60%	0.597	68%	0.683	S	S	*	*	H	α-helix	trans	-74.9	-25.3	-177.1	26.7	-31.4	0	0	0	113.3	F12	P8-F12 PolarHBondContact O-N 3.21Å
9	R	52.8	Low	55.1	Low	200 Å²	200	133.9 Å²	133.9	76%	0.755	68%	0.682	S	S	*	*	H	α-helix	trans	-76.1	-32.7	175.2	-70.1	-174.5	174.3	-179.2	-2.3	112.4	R7 C13	R7-R9 PolarHBondContact O-N 3.36Å; R9-C13 WeakPolarHBondContact O-CB 3.34Å; R9-C13 PolarHBondContact O-N 2.76Å; R9-C13 PolarHBondContact O-SG 3.29Å; R9-C13 VanDerWaalsContact O-SG 3.33Å
10	L	55.7	Low	55.1	Low	107 Å²	107	133.8 Å²	133.8	56%	0.56	68%	0.682	S	S	*	*	H	α-helix	trans	-68.8	-39.8	176.9	-150.9	82.8	0	0	0	111.6	L6 R7 L14	L6-L10 PolarHBondContact O-N 2.86Å; R7-L10 PolarHBondContact O-N 2.71Å; L10-L14 HydrophobicContact CG-CD1 4.48Å; L10-L14 WeakPolarHBondContact O-CB 3.47Å; L10-L14 PolarHBondContact O-N 2.9Å
11	H	59.2	Low	55	Low	128 Å²	128	132.4 Å²	132.4	59%	0.593	68%	0.68	S	S	*	*	H	α-helix	trans	-69.9	-36.6	176	-67.3	-41.2	0	0	0	113	R7 L14 L15	R7-H11 PolarHBondContact O-CD2 2.94Å; R7-H11 VanDerWaalsContact O-CD2 3.3Å; R7-H11 PolarHBondContact O-N 3.44Å; H11-L14 PolarHBondContact O-N 3.19Å; H11-L15 WeakPolarHBondContact O-CB 3.49Å; H11-L15 PolarHBondContact O-N 2.8Å
12	F	59	Low	55.4	Low	146 Å²	146	125.7 Å²	125.7	64%	0.64	65%	0.652	S	S	*	*	H	α-helix	trans	-67	-42.5	174.3	-162.1	-94.7	0	0	0	111.7	P8 L15 L16	P8-F12 PolarHBondContact O-N 3.21Å; F12-L15 PolarHBondContact O-N 3.39Å; F12-L16 HydrophobicContact CE1-CD1 4.34Å; F12-L16 WeakPolarHBondContact O-CB 3.39Å; F12-L16 PolarHBondContact O-N 3.17Å
13	C	59.8	Low	55.6	Low	82 Å²	82	125.7 Å²	125.7	55%	0.554	65%	0.65	S	S	*	*	H	α-helix	trans	-66.1	-37.4	174.3	-71.5	0	0	0	0	112.6	R9 L16 L17	R9-C13 WeakPolarHBondContact O-CB 3.34Å; R9-C13 PolarHBondContact O-N 2.76Å; R9-C13 PolarHBondContact O-SG 3.29Å; R9-C13 VanDerWaalsContact O-SG 3.33Å; C13-L16 PolarHBondContact O-N 3.48Å; C13-L17 VanDerWaalsContact O-CB 3.27Å; C13-L17 WeakPolarHBondContact O-CB 3.4Å; C13-L17 PolarHBondContact O-N 2.83Å
14	L	62.3	Low	55.6	Low	96 Å²	96	123.6 Å²	123.6	50%	0.503	64%	0.643	S	S	.	*	H	α-helix	trans	-67.3	-37.1	175.3	-113.7	121.9	0	0	0	112.5	L10 H11 L17 L18	L10-L14 HydrophobicContact CG-CD1 4.48Å; L10-L14 WeakPolarHBondContact O-CB 3.47Å; L10-L14 PolarHBondContact O-N 2.9Å; H11-L14 PolarHBondContact O-N 3.19Å; L14-L17 PolarHBondContact O-N 3.28Å; L14-L18 WeakPolarHBondContact O-CB 3.35Å; L14-L18 PolarHBondContact O-N 2.63Å
15	L	63.5	Low	55.5	Low	119 Å²	119	124.1 Å²	124.1	62%	0.623	65%	0.647	S	S	*	*	H	α-helix	trans	-68.7	-40	175.8	-148.4	97.2	0	0	0	111.4	H11 F12 L18 L19	H11-L15 WeakPolarHBondContact O-CB 3.49Å; H11-L15 PolarHBondContact O-N 2.8Å; F12-L15 PolarHBondContact O-N 3.39Å; L15-L18 PolarHBondContact O-N 2.92Å; L15-L19 PolarHBondContact O-N 2.94Å; L15-L19 VanDerWaalsContact O-N 3.09Å
16	L	60.2	Low	55.3	Low	94 Å²	94	125.4 Å²	125.4	49%	0.492	65%	0.652	S	S	.	*	H	α-helix	trans	-67.1	-37.2	175.1	-147.1	91.3	0	0	0	111.7	F12 C13 L19 L20	F12-L16 HydrophobicContact CE1-CD1 4.34Å; F12-L16 WeakPolarHBondContact O-CB 3.39Å; F12-L16 PolarHBondContact O-N 3.17Å; C13-L16 PolarHBondContact O-N 3.48Å; L16-L19 PolarHBondContact O-N 2.72Å; L16-L20 WeakPolarHBondContact O-CD1 3.13Å; L16-L20 WeakPolarHBondContact O-CG 3.3Å; L16-L20 PolarHBondContact O-N 3.41Å
17	L	60.5	Low	55	Low	110 Å²	110	121.8 Å²	121.8	58%	0.576	65%	0.648	S	S	*	*	H	α-helix	trans	-69.7	-36.5	174.8	-153.9	85.1	0	0	0	111.4	C13 L14 L19 L20 V21	C13-L17 VanDerWaalsContact O-CB 3.27Å; C13-L17 WeakPolarHBondContact O-CB 3.4Å; C13-L17 PolarHBondContact O-N 2.83Å; L14-L17 PolarHBondContact O-N 3.28Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.96Å; L17-L20 PolarHBondContact O-N 3.32Å; L17-V21 WeakPolarHBondContact O-CB 3.37Å; L17-V21 WeakPolarHBondContact O-CG2 3.38Å; L17-V21 PolarHBondContact O-N 3.31Å
18	L	57.7	Low	55.3	Low	125 Å²	125	118 Å²	118	65%	0.654	65%	0.652	S	S	*	*	H	α-helix	trans	-65.1	-35	173.7	-119.2	104.9	0	0	0	112.4	L14 L15 L20 V22	L14-L18 WeakPolarHBondContact O-CB 3.35Å; L14-L18 PolarHBondContact O-N 2.63Å; L15-L18 PolarHBondContact O-N 2.92Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-V22 PolarHBondContact O-N 3.22Å
19	L	56.7	Low	55.6	Low	125 Å²	125	116.4 Å²	116.4	65%	0.654	65%	0.652	S	S	*	*	H	α-helix	trans	-71	-25	173.9	-81	158.2	0	0	0	113	L15 L16 L17	L15-L19 PolarHBondContact O-N 2.94Å; L15-L19 VanDerWaalsContact O-N 3.09Å; L16-L19 PolarHBondContact O-N 2.72Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.96Å
20	L	55.3	Low	56	Low	131 Å²	131	112.9 Å²	112.9	69%	0.686	66%	0.655	S	S	*	*	H	α-helix	trans	-89.3	-15.3	177.3	-75	163.3	0	0	0	113.7	L16 L17 L18	L16-L20 WeakPolarHBondContact O-CD1 3.13Å; L16-L20 WeakPolarHBondContact O-CG 3.3Å; L16-L20 PolarHBondContact O-N 3.41Å; L17-L20 PolarHBondContact O-N 3.32Å; L18-L20 VanDerWaalsContact C-N 3.31Å
21	V	52.4	Low	55.8	Low	105 Å²	105	110.6 Å²	110.6	64%	0.636	66%	0.657	S	S	*	*			trans	-103.7	1.9	-178.5	179	0	0	0	0	112.3	L17 P23	L17-V21 WeakPolarHBondContact O-CB 3.37Å; L17-V21 WeakPolarHBondContact O-CG2 3.38Å; L17-V21 PolarHBondContact O-N 3.31Å; V21-P23 WeakPolarHBondContact O-CD 3.44Å
22	V	54.2	Low	55.4	Low	102 Å²	102	116.3 Å²	116.3	62%	0.618	67%	0.673	S	S	*	*	S	Bend	trans	-58.7	114.5	159.4	-176.6	0	0	0	0	105.6	L18 A24	L18-V22 PolarHBondContact O-N 3.22Å; V22-A24 PolarHBondContact O-N 3.47Å; V22-A24 VanDerWaalsContact O-N 3.12Å
23	P	46.5	Very low	54.8	Low	104 Å²	104	115 Å²	115	68%	0.675	68%	0.677	S	S	*	*			trans	-55.4	130.5	176.3	-15.6	28.2	0	0	0	105.5	V21 A25	V21-P23 WeakPolarHBondContact O-CD 3.44Å; P23-A25 PolarHBondContact O-N 2.92Å
24	A	50.9	Low	54.4	Low	84 Å²	84	117.7 Å²	117.7	69%	0.694	69%	0.691	S	S	*	*			trans	-51	100	153.1	0	0	0	0	0	104.1	V22 W26	V22-A24 PolarHBondContact O-N 3.47Å; V22-A24 VanDerWaalsContact O-N 3.12Å; A24-W26 PolarHBondContact O-N 2.8Å
25	A	52.3	Low	53.7	Low	90 Å²	90	115.7 Å²	115.7	74%	0.744	69%	0.693	S	S	*	*			trans	-55.9	115.6	170.5	0	0	0	0	0	102.7	P23 G27	P23-A25 PolarHBondContact O-N 2.92Å; A25-G27 PolarHBondContact O-N 2.74Å
26	W	47.8	Very low	52.8	Low	251 Å²	251	115.1 Å²	115.1	95%	0.951	70%	0.699	S	S	*	*			trans	-65	75.2	166.5	-78	35.5	0	0	0	105.5	A24 C28	A24-W26 PolarHBondContact O-N 2.8Å; W26-C28 PolarHBondContact O-N 2.9Å; W26-C28 VanDerWaalsContact O-N 3.13Å
27	G	42.8	Very low	52.2	Low	61 Å²	61	121.8 Å²	121.8	63%	0.629	72%	0.718	S	S	*	*			trans	-56	119.7	161.2	0	0	0	0	0	104.4	A25 G29	A25-G27 PolarHBondContact O-N 2.74Å; G27-G29 PolarHBondContact O-N 2.87Å
28	C	62.7	Low	51.7	Low	126 Å²	126	128 Å²	128	85%	0.851	73%	0.734	S	S	*	*			trans	-44.1	122.3	165.5	-65.1	0	0	0	0	106.5	W26	W26-C28 PolarHBondContact O-N 2.9Å; W26-C28 VanDerWaalsContact O-N 3.13Å
29	G	55.5	Low	51.4	Low	58 Å²	58	133.2 Å²	133.2	60%	0.598	74%	0.744	S	S	*	*			trans	-46.9	146.2	175.8	0	0	0	0	0	109	G27 G31	G27-G29 PolarHBondContact O-N 2.87Å; G29-G31 PolarHBondContact O-N 2.82Å
30	P	60.6	Low	51.3	Low	127 Å²	127	132.5 Å²	132.5	83%	0.825	75%	0.747	S	S	*	*			trans	-49	105.7	-165.7	20.9	-32.6	0	0	0	108.7
31	G	51.1	Low	51.5	Low	58 Å²	58	132.1 Å²	132.1	60%	0.598	75%	0.753	S	S	*	*			trans	-54.2	152.8	175.9	0	0	0	0	0	107.5	G29 V33	G29-G31 PolarHBondContact O-N 2.82Å; G31-V33 PolarHBondContact O-N 2.95Å
32	R	50.7	Low	52.2	Low	248 Å²	248	136.5 Å²	136.5	94%	0.936	76%	0.758	S	S	*	*			trans	-35.1	111.1	175.7	-97.4	-178.6	175.9	177.1	-0.6	108.7	V34	R32-V34 PolarHBondContact O-N 2.89Å
33	V	47.4	Very low	53.3	Low	120 Å²	120	140.6 Å²	140.6	73%	0.727	77%	0.767	S	S	*	*			trans	-57.4	101.4	170.8	-179.7	0	0	0	0	103.7	G31 G35	G31-V33 PolarHBondContact O-N 2.95Å; V33-G35 PolarHBondContact O-N 2.84Å
34	V	52.3	Low	55.3	Low	138 Å²	138	138.4 Å²	138.4	84%	0.836	75%	0.75	S	S	*	*			trans	-57.7	100.6	161.3	172.5	0	0	0	0	101.8	R32 S36	R32-V34 PolarHBondContact O-N 2.89Å; V34-S36 PolarHBondContact O-N 2.87Å
35	G	47.3	Very low	57.4	Low	53 Å²	53	138.3 Å²	138.3	55%	0.546	74%	0.74	S	S	.	*			trans	-43.8	117.1	-167.5	0	0	0	0	0	107.5	V33 R37	V33-G35 PolarHBondContact O-N 2.84Å; G35-R37 PolarHBondContact O-N 2.83Å
36	S	44.7	Very low	59.5	Low	108 Å²	108	137.2 Å²	137.2	76%	0.755	73%	0.726	S	S	*	*			trans	-40.5	113.7	162.1	174.4	0	0	0	0	104.5	V34 R38	V34-S36 PolarHBondContact O-N 2.87Å; S36-R38 PolarHBondContact O-N 2.74Å
37	R	47.4	Very low	61.8	Low	233 Å²	233	125.5 Å²	125.5	88%	0.879	68%	0.682	S	S	*	*			trans	-44.2	112.5	-174.9	-78.3	179	-177.2	173.7	0.8	104.7	G35 R39	G35-R37 PolarHBondContact O-N 2.83Å; R37-R39 PolarHBondContact O-N 3.21Å
38	R	49.6	Very low	64.4	Low	241 Å²	241	125.4 Å²	125.4	91%	0.909	68%	0.675	S	S	*	*			trans	-47.5	111.8	176.5	-82.3	-177.2	176.8	178.8	-1.2	103.8	S36 P40	S36-R38 PolarHBondContact O-N 2.74Å; R38-P40 WeakPolarHBondContact O-CD 3.31Å
39	R	51.2	Low	66.1	Low	234 Å²	234	124.9 Å²	124.9	88%	0.883	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-52.4	121.1	177.3	-83.2	-176.7	177.9	178.6	-0.8	103.7	R37	R37-R39 PolarHBondContact O-N 3.21Å
40	P	53.7	Low	68.1	Low	110 Å²	110	126.9 Å²	126.9	71%	0.714	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-53.7	134.5	179.6	21.2	-30.3	0	0	0	106.2	R38 R42	R38-P40 WeakPolarHBondContact O-CD 3.31Å; P40-R42 PolarHBondContact O-N 2.81Å
41	P	60.9	Low	69.8	Low	123 Å²	123	124.7 Å²	124.7	80%	0.799	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-50.5	133.2	178.9	20.4	-31	0	0	0	107.9	K43	P41-K43 PolarHBondContact O-N 2.94Å
42	R	66.4	Low	71.9	Confident	197 Å²	197	124.8 Å²	124.8	74%	0.743	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-50.5	120.1	176.9	-95.4	-177.3	168.4	164.2	-1.8	107.1	P40 L44	P40-R42 PolarHBondContact O-N 2.81Å; R42-L44 PolarHBondContact O-N 2.89Å
43	K	78.4	Confident	73.9	Confident	188 Å²	188	114.3 Å²	114.3	82%	0.817	58%	0.576	S	S	*	*			trans	-66.7	109.7	-177.2	-173.8	178.5	-179.7	-178.8	0	108	P41 V45	P41-K43 PolarHBondContact O-N 2.94Å; K43-V45 HydrophobicContact CG-CG2 4.44Å; K43-V45 PolarHBondContact O-N 3.14Å; K43-V45 VanDerWaalsContact O-N 3.14Å
44	L	88.6	Confident	76	Confident	59 Å²	59	110.9 Å²	110.9	31%	0.309	56%	0.556	S	S	.	*			trans	-70.9	106.3	174.6	-61.2	178.1	0	0	0	108.5	R42 P46 L165 R168 L169 E172	R42-L44 PolarHBondContact O-N 2.89Å; L44-P46 WeakPolarHBondContact O-CD 3.44Å; L44-L165 HydrophobicContact CB-CD1 3.93Å; L44-L165 HydrophobicContact CD1-CD1 4.41Å; L44-R168 HydrophobicContact CB-CG 3.92Å; L44-R168 HydrophobicContact CD2-CG 3.99Å; L44-L169 HydrophobicContact CD1-CD2 3.82Å; L44-E172 HydrophobicContact CD2-CG 3.7Å
45	V	93.6	Very high	77.9	Confident	81 Å²	81	110.8 Å²	110.8	49%	0.491	55%	0.551	S	S	.	*			trans	-93.1	114.8	175.6	-179.3	0	0	0	0	108.4	K43 R168	K43-V45 HydrophobicContact CG-CG2 4.44Å; K43-V45 PolarHBondContact O-N 3.14Å; K43-V45 VanDerWaalsContact O-N 3.14Å; V45-R168 PolarHBondContact O-NE 3.14Å; V45-R168 PolarHBondContact O-NH2 3.22Å
46	P	96.4	Very high	79.8	Confident	68 Å²	68	110.9 Å²	110.9	44%	0.442	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-52.1	142.8	176.3	-27.9	36.5	0	0	0	112	L44 G164 L165	L44-P46 WeakPolarHBondContact O-CD 3.44Å; P46-G164 CarbonylContact C-O 3.59Å; P46-G164 VanDerWaalsContact CA-O 3.3Å; P46-G164 WeakPolarHBondContact CA-O 3.39Å; P46-L165 HydrophobicContact CG-CB 4.34Å; P46-L165 HydrophobicContact CG-CD1 4.44Å
47	L	96.9	Very high	82.1	Confident	5 Å²	5	110 Å²	110	3%	0.026	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-71	138.2	170	-87.2	65.9	0	0	0	109.3	Q51 G164 A167 R168 V171 V178	L47-Q51 HydrophobicContact CB-CB 4.4Å; L47-Q51 HydrophobicContact CG-CG 4.39Å; L47-G164 PolarHBondContact N-O 2.93Å; L47-G164 WeakPolarHBondContact O-CA 3.18Å; L47-A167 HydrophobicContact CB-CB 3.95Å; L47-A167 HydrophobicContact CD1-CB 4.44Å; L47-A167 HydrophobicContact CD2-CB 4.05Å; L47-A167 HydrophobicContact CG-CB 4.36Å; L47-R168 HydrophobicContact CD1-CB 4.06Å; L47-V171 HydrophobicContact CD1-CG2 4.37Å; L47-V178 HydrophobicContact CD2-CG1 4.26Å
48	A	97.4	Very high	84.3	Confident	58 Å²	58	100.5 Å²	100.5	48%	0.479	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-71.9	157.2	171.6	0	0	0	0	0	110.7	K50 Q51 Y180	A48-K50 PolarHBondContact O-N 2.78Å; A48-Q51 HydrophobicContact CB-CB 4.23Å; A48-Q51 WeakPolarHBondContact O-CB 3.33Å; A48-Q51 PolarHBondContact O-N 2.74Å; A48-Y180 WeakPolarHBondContact O-CD2 3.29Å
49	Y	97.4	Very high	86.2	Confident	116 Å²	116	92.4 Å²	92.4	46%	0.455	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	135.2	173.4	178.4	-123	0	0	0	110.5	Q51 Y180 K183	Y49-Q51 PolarHBondContact O-N 2.97Å; Y49-Y180 VanDerWaalsContact CA-CD2 3.49Å; Y49-K183 HydrophobicContact CD2-CG 4.41Å; Y49-K183 HydrophobicContact CE2-CG 4.03Å
50	K	97.3	Very high	87.3	Confident	100 Å²	100	83.6 Å²	83.6	44%	0.435	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	8.7	-173.3	-60.5	-64.1	-166.6	-180	0	115.9	A48 Y179 Y180 E181	A48-K50 PolarHBondContact O-N 2.78Å; K50-Y179 HydrophobicContact CB-CE2 4.49Å; K50-Y179 HydrophobicContact CD-CE2 4.19Å; K50-Y179 VanDerWaalsContact CD-OH 3.29Å; K50-Y179 WeakPolarHBondContact CD-OH 3.49Å; K50-Y179 PolarHBondContact NZ-OH 3.48Å; K50-Y180 WeakPolarHBondContact CA-O 3.44Å; K50-Y180 PolarHBondContact N-O 3.08Å; K50-E181 WeakPolarHBondContact CD-O 3.41Å; K50-E181 VanDerWaalsContact CE-O 3.29Å; K50-E181 WeakPolarHBondContact CE-O 3.43Å; K50-E181 PolarHBondContact NZ-O 2.92Å
51	Q	97.1	Very high	88.2	Confident	81 Å²	81	84.3 Å²	84.3	38%	0.379	44%	0.438	S	S	.	.			trans	-82.4	141.3	171.4	-170.7	177.7	6.2	0	0	110.9	L47 A48 Y49 Y180	L47-Q51 HydrophobicContact CB-CB 4.4Å; L47-Q51 HydrophobicContact CG-CG 4.39Å; A48-Q51 HydrophobicContact CB-CB 4.23Å; A48-Q51 WeakPolarHBondContact O-CB 3.33Å; A48-Q51 PolarHBondContact O-N 2.74Å; Y49-Q51 PolarHBondContact O-N 2.97Å; Q51-Y180 PolarHBondContact O-N 2.83Å
52	F	95.8	Very high	88.5	Confident	59 Å²	59	81.1 Å²	81.1	26%	0.259	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153.4	169.7	50.5	-87.7	0	0	0	112	P54 N55 V56 W177 V178 Y179	F52-P54 WeakPolarHBondContact CD2-O 3.48Å; F52-N55 VanDerWaalsContact CE2-OD1 3.29Å; F52-N55 WeakPolarHBondContact CE2-OD1 3.37Å; F52-V56 WeakPolarHBondContact CD2-O 3.46Å; F52-V56 WeakPolarHBondContact CE2-O 3.29Å; F52-W177 HydrophobicContact CB-CH2 4.19Å; F52-W177 HydrophobicContact CB-CZ2 3.42Å; F52-W177 VanDerWaalsContact CB-CZ2 3.42Å; F52-W177 HydrophobicContact CD1-CZ2 4.27Å; F52-W177 AromaticContact CD2-CZ2 3.93Å; F52-W177 HydrophobicContact CD2-CZ2 3.93Å; F52-W177 AromaticContact CD2-NE1 3.68Å; F52-W177 AromaticContact CG-CZ2 3.62Å; F52-W177 HydrophobicContact CG-CZ2 3.62Å; F52-V178 CarbonylContact C-O 3.54Å; F52-V178 WeakPolarHBondContact CA-O 3.37Å; F52-V178 WeakPolarHBondContact CB-O 3.41Å; F52-Y179 HydrophobicContact CB-CD2 3.84Å; F52-Y179 HydrophobicContact CB-CG 4.19Å; F52-Y179 HydrophobicContact CD1-CD2 4.1Å; F52-Y179 HydrophobicContact CD1-CE2 4.29Å; F52-Y179 HydrophobicContact CG-CD2 4.46Å
53	S	91.8	Very high	89.5	Confident	29 Å²	29	71.7 Å²	71.7	20%	0.203	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128.8	-179.4	-179.9	0	0	0	0	109.9	W177 V178	S53-W177 WeakPolarHBondContact O-CA 3.12Å; S53-V178 PolarHBondContact N-O 2.65Å; S53-V178 PolarHBondContact O-N 2.9Å
54	P	90.9	Very high	90	Very high	48 Å²	48	62.8 Å²	62.8	31%	0.312	35%	0.353	S	S	.	.	S	Bend	cis	-63.1	158.7	-6.1	26.9	-34.1	0	0	0	112.2	F52 V56 G62 A63 D176	F52-P54 WeakPolarHBondContact CD2-O 3.48Å; P54-V56 HydrophobicContact CB-CG2 4.17Å; P54-V56 HydrophobicContact CG-CG2 3.85Å; P54-V56 PolarHBondContact O-N 3.23Å; P54-G62 WeakPolarHBondContact CG-O 3.42Å; P54-A63 HydrophobicContact CG-CB 4.18Å; P54-D176 WeakPolarHBondContact CD-O 3.27Å
55	N	93.4	Very high	89.8	Confident	136 Å²	136	60.2 Å²	60.2	73%	0.727	34%	0.341	S	S	*	.	S	Bend	trans	-76.3	56.8	-177.8	-170.2	27.4	0	0	0	112.4	F52	F52-N55 VanDerWaalsContact CE2-OD1 3.29Å; F52-N55 WeakPolarHBondContact CE2-OD1 3.37Å
56	V	86.8	Confident	89.4	Confident	55 Å²	55	65.3 Å²	65.3	33%	0.333	35%	0.352	S	S	.	.	S	Bend	trans	-138.8	158.8	173.5	-65.3	0	0	0	0	108.6	F52 P54 T60 A63 W177	F52-V56 WeakPolarHBondContact CD2-O 3.46Å; F52-V56 WeakPolarHBondContact CE2-O 3.29Å; P54-V56 HydrophobicContact CB-CG2 4.17Å; P54-V56 HydrophobicContact CG-CG2 3.85Å; P54-V56 PolarHBondContact O-N 3.23Å; V56-T60 WeakPolarHBondContact CG2-OG1 3.48Å; V56-A63 HydrophobicContact CG2-CB 3.87Å; V56-W177 PolarHBondContact O-NE1 2.87Å
57	P	93.1	Very high	89	Confident	89 Å²	89	65.1 Å²	65.1	58%	0.578	34%	0.343	S	S	*	.			trans	-60.6	144.3	177.4	-19.7	29.2	0	0	0	112.1	K59 T60	P57-K59 VanDerWaalsContact C-N 3.3Å; P57-K59 PolarHBondContact O-N 3.12Å; P57-T60 HydrophobicContact CB-CG2 3.97Å; P57-T60 HydrophobicContact CG-CG2 4.07Å; P57-T60 WeakPolarHBondContact O-CB 3.46Å; P57-T60 WeakPolarHBondContact O-CG2 3.39Å; P57-T60 PolarHBondContact O-N 3.42Å; P57-T60 PolarHBondContact O-OG1 3.2Å
58	E	93.4	Very high	88.4	Confident	33 Å²	33	68.7 Å²	68.7	15%	0.154	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-47.7	-174.4	-178	-176.4	-161.4	0	0	113.4	T60 A63 S64 G65 L144 W177 H187 S189	E58-T60 PolarHBondContact O-N 2.87Å; E58-A63 WeakPolarHBondContact O-CB 3.43Å; E58-S64 WeakPolarHBondContact O-CA 3.3Å; E58-S64 PolarHBondContact O-N 3.13Å; E58-G65 PolarHBondContact O-N 3.41Å; E58-L144 HydrophobicContact CG-CD1 4.11Å; E58-L144 WeakPolarHBondContact OE1-CD1 3.3Å; E58-W177 HydrophobicContact CB-CD2 3.66Å; E58-W177 HydrophobicContact CB-CE3 3.73Å; E58-W177 HydrophobicContact CB-CG 4.2Å; E58-W177 HydrophobicContact CB-CH2 4.04Å; E58-W177 HydrophobicContact CB-CZ2 4.01Å; E58-W177 HydrophobicContact CB-CZ3 3.9Å; E58-W177 HydrophobicContact CG-CB 4.39Å; E58-W177 HydrophobicContact CG-CD2 3.81Å; E58-W177 HydrophobicContact CG-CE3 3.59Å; E58-W177 HydrophobicContact CG-CG 4.18Å; E58-W177 HydrophobicContact CG-CZ3 4.04Å; E58-H187 IonicContact OE1-NE2 2.74Å; E58-H187 PolarHBondContact OE1-NE2 3.42Å; E58-H187 VanDerWaalsContact OE1-NE2 3.11Å; E58-S189 WeakPolarHBondContact OE1-CB 3.37Å; E58-S189 PolarHBondContact OE1-OG 3.49Å
59	K	90.3	Very high	88	Confident	72 Å²	72	66.9 Å²	66.9	31%	0.313	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	8	-173.1	-67	177.5	-73.4	-171.7	0	114.3	P57 G65 R66 E142	P57-K59 VanDerWaalsContact C-N 3.3Å; P57-K59 PolarHBondContact O-N 3.12Å; K59-G65 WeakPolarHBondContact CA-O 3.37Å; K59-G65 CarbonylContact O-C 3.58Å; K59-G65 VanDerWaalsContact O-C 3.32Å; K59-R66 PolarHBondContact O-N 2.69Å; K59-E142 HydrophobicContact CD-CB 4.37Å; K59-E142 VanDerWaalsContact NZ-CB 3.26Å; K59-E142 IonicContact NZ-OE2 3.81Å; K59-E142 PolarHBondContact NZ-OE2 2.79Å
60	T	74.7	Confident	87.8	Confident	48 Å²	48	65.7 Å²	65.7	29%	0.294	34%	0.343	S	S	.	.	S	Bend	trans	-79.6	157.5	174.5	63.8	0	0	0	0	112	V56 P57 E58 G62 A63 G65	V56-T60 WeakPolarHBondContact CG2-OG1 3.48Å; P57-T60 HydrophobicContact CB-CG2 3.97Å; P57-T60 HydrophobicContact CG-CG2 4.07Å; P57-T60 WeakPolarHBondContact O-CB 3.46Å; P57-T60 WeakPolarHBondContact O-CG2 3.39Å; P57-T60 PolarHBondContact O-N 3.42Å; P57-T60 PolarHBondContact O-OG1 3.2Å; E58-T60 PolarHBondContact O-N 2.87Å; T60-G62 PolarHBondContact O-N 2.85Å; T60-A63 CarbonylContact O-C 3.55Å; T60-A63 PolarHBondContact O-N 2.85Å; T60-G65 VanDerWaalsContact O-CA 3.25Å; T60-G65 WeakPolarHBondContact O-CA 3.47Å; T60-G65 PolarHBondContact O-N 3.22Å
61	L	70.7	Confident	87.6	Confident	126 Å²	126	61 Å²	61	66%	0.66	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.4	178.4	-65.6	174.6	0	0	0	113.3	A63 K191	L61-A63 VanDerWaalsContact C-N 3.3Å; L61-K191 PolarHBondContact O-NZ 3.17Å
62	G	69.1	Low	87.4	Confident	55 Å²	55	59.1 Å²	59.1	57%	0.567	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.9	175.6	0	0	0	0	0	114.7	P54 T60	P54-G62 WeakPolarHBondContact CG-O 3.42Å; T60-G62 PolarHBondContact O-N 2.85Å
63	A	86.7	Confident	87.2	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-131.7	-178.2	0	0	0	0	0	110.2	P54 V56 E58 T60 L61 G65 D176 W177 K191	P54-A63 HydrophobicContact CG-CB 4.18Å; V56-A63 HydrophobicContact CG2-CB 3.87Å; E58-A63 WeakPolarHBondContact O-CB 3.43Å; T60-A63 CarbonylContact O-C 3.55Å; T60-A63 PolarHBondContact O-N 2.85Å; L61-A63 VanDerWaalsContact C-N 3.3Å; A63-G65 VanDerWaalsContact C-N 3.28Å; A63-G65 PolarHBondContact O-N 3.08Å; A63-D176 WeakPolarHBondContact CA-O 3.1Å; A63-W177 HydrophobicContact CB-CB 4.07Å; A63-W177 VanDerWaalsContact CB-CD1 3.47Å; A63-W177 HydrophobicContact CB-CG 4.02Å; A63-K191 WeakPolarHBondContact O-CE 3.19Å; A63-K191 WeakPolarHBondContact O-CG 3.36Å; A63-K191 PolarHBondContact O-NZ 3.01Å
64	S	88.8	Confident	87.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.3	-179.3	-62.1	0	0	0	0	113.4	E58 L144 R149 W177 S189 K191	E58-S64 WeakPolarHBondContact O-CA 3.3Å; E58-S64 PolarHBondContact O-N 3.13Å; S64-L144 VanDerWaalsContact CB-CD1 3.45Å; S64-R149 PolarHBondContact O-NH2 2.62Å; S64-W177 VanDerWaalsContact OG-CB 3.25Å; S64-W177 WeakPolarHBondContact OG-CB 3.21Å; S64-S189 WeakPolarHBondContact CB-OG 3.21Å; S64-S189 VanDerWaalsContact OG-C 3.23Å; S64-S189 PolarHBondContact OG-O 3.09Å; S64-S189 PolarHBondContact OG-OG 2.87Å; S64-K191 VanDerWaalsContact O-CA 3.24Å; S64-K191 WeakPolarHBondContact O-CA 3.27Å
65	G	83.5	Confident	87	Confident	6 Å²	6	65 Å²	65	6%	0.062	35%	0.354	C	S	.	.			trans	74.7	176.1	177.7	0	0	0	0	0	113.3	E58 K59 T60 A63	E58-G65 PolarHBondContact O-N 3.41Å; K59-G65 WeakPolarHBondContact CA-O 3.37Å; K59-G65 CarbonylContact O-C 3.58Å; K59-G65 VanDerWaalsContact O-C 3.32Å; T60-G65 VanDerWaalsContact O-CA 3.25Å; T60-G65 WeakPolarHBondContact O-CA 3.47Å; T60-G65 PolarHBondContact O-N 3.22Å; A63-G65 VanDerWaalsContact C-N 3.28Å; A63-G65 PolarHBondContact O-N 3.08Å
66	R	85.6	Confident	86.6	Confident	188 Å²	188	65.1 Å²	65.1	71%	0.709	35%	0.35	S	S	*	.			trans	-62.9	152.6	-167	-64.3	-175.6	-179.1	178.6	0.2	112.8	K59 R149	K59-R66 PolarHBondContact O-N 2.69Å; R66-R149 PolarHBondContact O-NH1 3.13Å
67	Y	87.9	Confident	86.4	Confident	64 Å²	64	65.2 Å²	65.2	25%	0.251	35%	0.345	S	S	.	.			trans	-67.1	133.6	162.7	175.1	-98	0	0	0	109	G69 K70 E142 S143 L144 Y146 E147	Y67-G69 VanDerWaalsContact CE1-CA 3.41Å; Y67-G69 VanDerWaalsContact CZ-CA 3.44Å; Y67-K70 WeakPolarHBondContact OH-CB 3.44Å; Y67-K70 PolarHBondContact OH-N 3.38Å; Y67-E142 HydrophobicContact CD1-CB 4.23Å; Y67-E142 HydrophobicContact CD1-CG 4.16Å; Y67-E142 HydrophobicContact CD2-CB 4.34Å; Y67-E142 HydrophobicContact CG-CB 4.02Å; Y67-E142 HydrophobicContact CG-CG 4.43Å; Y67-S143 WeakPolarHBondContact CE2-O 3.13Å; Y67-L144 HydrophobicContact CD2-CD2 4.46Å; Y67-Y146 HydrophobicContact CE2-CD2 4.43Å; Y67-E147 WeakPolarHBondContact CA-OE1 3.31Å; Y67-E147 HydrophobicContact CD2-CG 4.46Å; Y67-E147 WeakPolarHBondContact CD2-OE1 3.5Å; Y67-E147 HydrophobicContact CE2-CG 4.36Å; Y67-E147 WeakPolarHBondContact CE2-OE1 3.47Å
68	E	85.6	Confident	86.3	Confident	80 Å²	80	63.3 Å²	63.3	37%	0.374	33%	0.328	S	S	.	.			trans	-107.3	-13.6	-178	-64.5	-177.7	173.4	0	0	112.6	R77 E147 S192 H194	E68-R77 PolarHBondContact O-NH1 3.09Å; E68-R77 IonicContact OE2-NH2 2.67Å; E68-E147 WeakPolarHBondContact CA-OE1 3.48Å; E68-E147 PolarHBondContact N-OE1 3.4Å; E68-S192 VanDerWaalsContact CD-CB 3.45Å; E68-S192 WeakPolarHBondContact OE1-CB 3.3Å; E68-S192 PolarHBondContact OE1-OG 2.98Å; E68-S192 WeakPolarHBondContact OE2-CB 3.47Å; E68-S192 PolarHBondContact OE2-OG 2.96Å; E68-H194 IonicContact OE2-CD2 3.36Å; E68-H194 IonicContact OE2-CG 2.78Å
69	G	88.3	Confident	86	Confident	20 Å²	20	69 Å²	69	21%	0.206	35%	0.352	C	S	.	.			trans	124.9	145	177.2	0	0	0	0	0	112.7	Y67 I71 R77 E147	Y67-G69 VanDerWaalsContact CE1-CA 3.41Å; Y67-G69 VanDerWaalsContact CZ-CA 3.44Å; G69-I71 PolarHBondContact O-N 3.06Å; G69-R77 PolarHBondContact O-NH1 2.96Å; G69-E147 PolarHBondContact N-OE1 2.82Å; G69-E147 VanDerWaalsContact O-CG 3.27Å; G69-E147 WeakPolarHBondContact O-CG 3.2Å
70	K	93.7	Very high	85.7	Confident	91 Å²	91	68.6 Å²	68.6	40%	0.396	35%	0.351	S	S	.	.			trans	-57.8	129.6	-179.4	176.6	165.1	-175.4	174.7	0	110.7	Y67 E135 Y146	Y67-K70 WeakPolarHBondContact OH-CB 3.44Å; Y67-K70 PolarHBondContact OH-N 3.38Å; K70-E135 PolarHBondContact NZ-O 2.81Å; K70-Y146 HydrophobicContact CD-CD1 4.2Å; K70-Y146 HydrophobicContact CD-CG 4.21Å; K70-Y146 HydrophobicContact CG-CG 4.3Å
71	I	93.1	Very high	86.5	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	34%	0.34	C	S	.	.			trans	-89.5	115.4	172	-60.3	-179.7	0	0	0	106.9	G69 R77 F78 L81 W133 Y146 E147	G69-I71 PolarHBondContact O-N 3.06Å; I71-R77 HydrophobicContact CD1-CB 4.16Å; I71-R77 HydrophobicContact CG1-CB 3.98Å; I71-R77 HydrophobicContact CG2-CB 4.3Å; I71-F78 HydrophobicContact CG2-CB 4.07Å; I71-F78 HydrophobicContact CG2-CD2 4.18Å; I71-L81 HydrophobicContact CD1-CD2 4.15Å; I71-L81 HydrophobicContact CD1-CG 4.34Å; I71-L81 HydrophobicContact CG2-CD1 4.11Å; I71-W133 VanDerWaalsContact O-CZ2 3.23Å; I71-W133 WeakPolarHBondContact O-CZ2 3.25Å; I71-W133 PolarHBondContact O-NE1 2.9Å; I71-W133 VanDerWaalsContact O-NE1 3.1Å; I71-Y146 PolarHBondContact N-O 2.64Å; I71-E147 HydrophobicContact CD1-CB 4.36Å
72	A	92.8	Very high	87.4	Confident	41 Å²	41	62.7 Å²	62.7	34%	0.339	32%	0.32	S	S	.	.			trans	-94.9	155.8	171.4	0	0	0	0	0	110.3	S74 S75	A72-S74 PolarHBondContact O-N 2.95Å; A72-S74 VanDerWaalsContact O-N 3.1Å; A72-S75 PolarHBondContact N-OG 2.84Å; A72-S75 VanDerWaalsContact O-CB 3.31Å; A72-S75 WeakPolarHBondContact O-CB 3.49Å; A72-S75 PolarHBondContact O-N 2.94Å; A72-S75 PolarHBondContact O-OG 2.83Å
73	R	91.2	Very high	88.8	Confident	107 Å²	107	62.3 Å²	62.3	40%	0.404	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-32.9	176.8	-67.1	-168.7	173	-101.2	-0.2	113.6	F78 T97 W133 E135	R73-F78 HydrophobicContact CG-CE2 4.2Å; R73-F78 HydrophobicContact CG-CZ 4.47Å; R73-T97 PolarHBondContact NH2-O 2.92Å; R73-W133 HydrophobicContact CG-CH2 3.46Å; R73-W133 VanDerWaalsContact CG-CH2 3.46Å; R73-W133 HydrophobicContact CG-CZ2 4.38Å; R73-W133 HydrophobicContact CG-CZ3 4.22Å; R73-E135 IonicContact CZ-OE1 2.72Å; R73-E135 IonicContact CZ-OE2 3.91Å; R73-E135 VanDerWaalsContact NE-CD 3.34Å; R73-E135 IonicContact NE-OE1 2.68Å; R73-E135 PolarHBondContact NE-OE1 3.22Å; R73-E135 IonicContact NE-OE2 3.77Å; R73-E135 PolarHBondContact NE-OE2 3.41Å; R73-E135 IonicContact NH2-OE1 2.56Å; R73-E135 PolarHBondContact NH2-OE1 3.27Å; R73-E135 IonicContact NH2-OE2 3.29Å
74	S	90.4	Very high	89.2	Confident	117 Å²	117	62.5 Å²	62.5	82%	0.818	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7	179.1	54.9	0	0	0	0	114.1	A72	A72-S74 PolarHBondContact O-N 2.95Å; A72-S74 VanDerWaalsContact O-N 3.1Å
75	S	88.8	Confident	89.6	Confident	36 Å²	36	70.4 Å²	70.4	25%	0.252	34%	0.339	S	S	.	.	S	Bend	trans	-81.9	148.6	-176.2	73.9	0	0	0	0	112	A72 R77 F78	A72-S75 PolarHBondContact N-OG 2.84Å; A72-S75 VanDerWaalsContact O-CB 3.31Å; A72-S75 WeakPolarHBondContact O-CB 3.49Å; A72-S75 PolarHBondContact O-N 2.94Å; A72-S75 PolarHBondContact O-OG 2.83Å; S75-R77 PolarHBondContact O-N 2.78Å; S75-F78 WeakPolarHBondContact O-CB 3.43Å; S75-F78 PolarHBondContact O-N 2.85Å; S75-F78 PolarHBondContact OG-N 2.71Å
76	E	85.1	Confident	90.2	Very high	138 Å²	138	71.6 Å²	71.6	65%	0.645	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-58.8	-33.8	175.1	-75.1	-63.2	138.5	0	0	112.6	F78 K79	E76-F78 PolarHBondContact O-N 2.78Å; E76-K79 WeakPolarHBondContact O-CB 3.41Å; E76-K79 PolarHBondContact O-N 2.99Å; E76-K79 IonicContact OE1-NZ 3.63Å; E76-K79 PolarHBondContact OE1-NZ 2.92Å; E76-K79 IonicContact OE2-NZ 3.63Å; E76-K79 PolarHBondContact OE2-NZ 3.21Å
77	R	82.8	Confident	90.7	Very high	57 Å²	57	67.3 Å²	67.3	22%	0.215	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-65.8	-15.3	176.4	-68.2	-175.3	62.4	-154	-5.6	113.5	E68 G69 I71 S75 K79 E80 E147	E68-R77 PolarHBondContact O-NH1 3.09Å; E68-R77 IonicContact OE2-NH2 2.67Å; G69-R77 PolarHBondContact O-NH1 2.96Å; I71-R77 HydrophobicContact CD1-CB 4.16Å; I71-R77 HydrophobicContact CG1-CB 3.98Å; I71-R77 HydrophobicContact CG2-CB 4.3Å; S75-R77 PolarHBondContact O-N 2.78Å; R77-K79 PolarHBondContact O-N 2.94Å; R77-E80 IonicContact NE-OE2 2.63Å; R77-E80 PolarHBondContact NE-OE2 3Å; R77-E80 WeakPolarHBondContact O-CB 3.47Å; R77-E80 WeakPolarHBondContact O-CG 3.25Å; R77-E80 PolarHBondContact O-N 2.8Å; R77-E147 IonicContact NH2-OE2 3.8Å
78	F	90.5	Very high	91.1	Very high	50 Å²	50	66.7 Å²	66.7	22%	0.219	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-60.9	-29.2	174.3	-170.8	-105	0	0	0	112.3	I71 R73 S75 E76 E80 L81 L102 W133	I71-F78 HydrophobicContact CG2-CB 4.07Å; I71-F78 HydrophobicContact CG2-CD2 4.18Å; R73-F78 HydrophobicContact CG-CE2 4.2Å; R73-F78 HydrophobicContact CG-CZ 4.47Å; S75-F78 WeakPolarHBondContact O-CB 3.43Å; S75-F78 PolarHBondContact O-N 2.85Å; S75-F78 PolarHBondContact OG-N 2.71Å; E76-F78 PolarHBondContact O-N 2.78Å; F78-E80 PolarHBondContact O-N 3.42Å; F78-L81 HydrophobicContact CD2-CD1 4.16Å; F78-L81 HydrophobicContact CE2-CD1 4.34Å; F78-L81 PolarHBondContact O-N 2.86Å; F78-L81 VanDerWaalsContact O-N 3.09Å; F78-L102 HydrophobicContact CE2-CD1 3.72Å; F78-L102 HydrophobicContact CZ-CD1 3.57Å; F78-W133 HydrophobicContact CD2-CH2 4.17Å; F78-W133 HydrophobicContact CD2-CZ2 4.11Å; F78-W133 HydrophobicContact CE2-CE3 4.26Å; F78-W133 AromaticContact CE2-CH2 3.6Å; F78-W133 HydrophobicContact CE2-CH2 3.6Å; F78-W133 AromaticContact CE2-CZ2 3.96Å; F78-W133 HydrophobicContact CE2-CZ2 3.96Å; F78-W133 AromaticContact CE2-CZ3 3.74Å; F78-W133 HydrophobicContact CE2-CZ3 3.74Å
79	K	86.3	Confident	91.7	Very high	151 Å²	151	63.3 Å²	63.3	66%	0.657	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-65.2	-16.1	175.2	-61.8	171.3	-174.5	164.5	0	113.1	E76 R77 L81	E76-K79 WeakPolarHBondContact O-CB 3.41Å; E76-K79 PolarHBondContact O-N 2.99Å; E76-K79 IonicContact OE1-NZ 3.63Å; E76-K79 PolarHBondContact OE1-NZ 2.92Å; E76-K79 IonicContact OE2-NZ 3.63Å; E76-K79 PolarHBondContact OE2-NZ 3.21Å; R77-K79 PolarHBondContact O-N 2.94Å; K79-L81 VanDerWaalsContact C-N 3.33Å
80	E	83.5	Confident	92.2	Very high	65 Å²	65	65.8 Å²	65.8	30%	0.304	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-78.1	-21	176.2	-56.2	170.4	173.4	0	0	111.8	R77 F78 H194	R77-E80 IonicContact NE-OE2 2.63Å; R77-E80 PolarHBondContact NE-OE2 3Å; R77-E80 WeakPolarHBondContact O-CB 3.47Å; R77-E80 WeakPolarHBondContact O-CG 3.25Å; R77-E80 PolarHBondContact O-N 2.8Å; F78-E80 PolarHBondContact O-N 3.42Å; E80-H194 IonicContact OE1-CE1 3.84Å; E80-H194 PolarHBondContact OE1-CE1 3.32Å; E80-H194 IonicContact OE1-NE2 3.88Å; E80-H194 PolarHBondContact OE1-NE2 3.09Å; E80-H194 IonicContact OE2-NE2 3.72Å; E80-H194 PolarHBondContact OE2-NE2 2.86Å
81	L	92.5	Very high	92.4	Very high	12 Å²	12	62.2 Å²	62.2	6%	0.063	32%	0.319	C	S	.	.			trans	-83.4	136	177.7	-56.8	-175.4	0	0	0	110.2	I71 F78 K79 L102 T104 W133 E147	I71-L81 HydrophobicContact CD1-CD2 4.15Å; I71-L81 HydrophobicContact CD1-CG 4.34Å; I71-L81 HydrophobicContact CG2-CD1 4.11Å; F78-L81 HydrophobicContact CD2-CD1 4.16Å; F78-L81 HydrophobicContact CE2-CD1 4.34Å; F78-L81 PolarHBondContact O-N 2.86Å; F78-L81 VanDerWaalsContact O-N 3.09Å; K79-L81 VanDerWaalsContact C-N 3.33Å; L81-L102 HydrophobicContact CB-CB 4.37Å; L81-L102 HydrophobicContact CD1-CB 4.31Å; L81-T104 HydrophobicContact CD2-CG2 4.07Å; L81-W133 HydrophobicContact CD1-CB 4.44Å; L81-W133 HydrophobicContact CD1-CD2 3.84Å; L81-W133 HydrophobicContact CD1-CG 3.75Å; L81-E147 WeakPolarHBondContact CD2-O 3.25Å
82	T	90.4	Very high	92.6	Very high	38 Å²	38	66.6 Å²	66.6	23%	0.233	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.4	175.1	67.7	0	0	0	0	109.7	M103	T82-M103 PolarHBondContact N-O 3.44Å; T82-M103 PolarHBondContact O-N 2.79Å
83	P	96.7	Very high	92.7	Very high	47 Å²	47	66.3 Å²	66.3	31%	0.305	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	142.1	175.6	28.1	-33.6	0	0	0	110.8	Y85 R101 L102 K108	P83-Y85 HydrophobicContact CB-CD2 4.2Å; P83-Y85 HydrophobicContact CB-CE2 3.54Å; P83-Y85 HydrophobicContact CG-CD2 4.38Å; P83-Y85 HydrophobicContact CG-CE2 3.65Å; P83-R101 CarbonylContact C-O 3.57Å; P83-R101 WeakPolarHBondContact CA-O 3.33Å; P83-L102 HydrophobicContact CB-CD2 4.08Å; P83-K108 PolarHBondContact O-NZ 2.95Å
84	N	96.9	Very high	92.7	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.016	33%	0.327	C	S	.	.			trans	-104	113.6	171.8	-165.5	-6.1	0	0	0	111	N86 F91 R101 M103 K108 N112	N84-N86 VanDerWaalsContact OD1-CB 3.25Å; N84-N86 WeakPolarHBondContact OD1-CB 3.4Å; N84-N86 PolarHBondContact OD1-N 2.9Å; N84-F91 HydrophobicContact CB-CZ 4.04Å; N84-F91 WeakPolarHBondContact O-CE2 3.5Å; N84-R101 PolarHBondContact N-O 3.37Å; N84-R101 PolarHBondContact O-NH1 2.83Å; N84-M103 HydrophobicContact CB-CE 3.81Å; N84-M103 HydrophobicContact CB-SD 3.95Å; N84-K108 HydrophobicContact CB-CD 4.39Å; N84-K108 HydrophobicContact CB-CG 4.29Å; N84-N112 PolarHBondContact ND2-OD1 2.83Å; N84-N112 PolarHBondContact OD1-OD1 2.89Å
85	Y	97.1	Very high	92.8	Very high	167 Å²	167	61.2 Å²	61.2	66%	0.655	30%	0.298	S	S	*	.			trans	-110.1	25.2	177.9	-65	-68.5	0	0	0	112.5	P83 P87	P83-Y85 HydrophobicContact CB-CD2 4.2Å; P83-Y85 HydrophobicContact CB-CE2 3.54Å; P83-Y85 HydrophobicContact CG-CD2 4.38Å; P83-Y85 HydrophobicContact CG-CE2 3.65Å; Y85-P87 WeakPolarHBondContact O-CD 3.39Å
86	N	94.3	Very high	93	Very high	30 Å²	30	66.3 Å²	66.3	16%	0.16	32%	0.323	C	S	.	.			trans	-58	120.2	176.7	-175.5	-16	0	0	0	110.3	N84 D88 I89 N112	N84-N86 VanDerWaalsContact OD1-CB 3.25Å; N84-N86 WeakPolarHBondContact OD1-CB 3.4Å; N84-N86 PolarHBondContact OD1-N 2.9Å; N86-D88 PolarHBondContact O-N 2.67Å; N86-D88 VanDerWaalsContact O-N 3.15Å; N86-D88 WeakPolarHBondContact OD1-CB 3.48Å; N86-D88 PolarHBondContact OD1-N 2.81Å; N86-I89 HydrophobicContact CB-CD1 3.92Å; N86-I89 HydrophobicContact CB-CG1 4.14Å; N86-I89 PolarHBondContact O-N 3.46Å; N86-N112 WeakPolarHBondContact CB-OD1 3.44Å; N86-N112 PolarHBondContact ND2-OD1 2.74Å
87	P	96.4	Very high	93.4	Very high	99 Å²	99	62.8 Å²	62.8	64%	0.643	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.8	-178	29.7	-37.2	0	0	0	113.4	Y85 I89 K126	Y85-P87 WeakPolarHBondContact O-CD 3.39Å; P87-I89 VanDerWaalsContact C-N 3.34Å; P87-K126 PolarHBondContact O-NZ 2.74Å
88	D	96.5	Very high	94	Very high	51 Å²	51	61 Å²	61	27%	0.273	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	3.9	179.5	-61.6	-35.6	0	0	0	113.6	N86 M119 K126	N86-D88 PolarHBondContact O-N 2.67Å; N86-D88 VanDerWaalsContact O-N 3.15Å; N86-D88 WeakPolarHBondContact OD1-CB 3.48Å; N86-D88 PolarHBondContact OD1-N 2.81Å; D88-M119 HydrophobicContact CB-CE 3.65Å; D88-M119 HydrophobicContact CB-SD 3.73Å; D88-K126 IonicContact OD1-NZ 3.91Å; D88-K126 PolarHBondContact OD1-NZ 2.66Å
89	I	98.5	Very high	94.3	Very high	8 Å²	8	58.8 Å²	58.8	4%	0.041	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.3	175.7	-55.4	175	0	0	0	109.2	N86 P87 F91 L111 A115 L127 V129	N86-I89 HydrophobicContact CB-CD1 3.92Å; N86-I89 HydrophobicContact CB-CG1 4.14Å; N86-I89 PolarHBondContact O-N 3.46Å; P87-I89 VanDerWaalsContact C-N 3.34Å; I89-F91 HydrophobicContact CB-CD2 4.43Å; I89-F91 HydrophobicContact CB-CE2 3.77Å; I89-F91 HydrophobicContact CB-CZ 4.18Å; I89-F91 HydrophobicContact CG2-CD2 4.03Å; I89-F91 HydrophobicContact CG2-CE1 4.2Å; I89-F91 HydrophobicContact CG2-CE2 3.54Å; I89-F91 HydrophobicContact CG2-CZ 3.64Å; I89-L111 HydrophobicContact CD1-CD2 3.79Å; I89-L111 HydrophobicContact CD1-CG 3.75Å; I89-A115 HydrophobicContact CD1-CB 4.11Å; I89-A115 HydrophobicContact CG1-CB 3.68Å; I89-L127 WeakPolarHBondContact CA-O 3.35Å; I89-L127 HydrophobicContact CD1-CD2 4.46Å; I89-L127 HydrophobicContact CG1-CD2 4.37Å; I89-V129 HydrophobicContact CG2-CG2 3.84Å
90	I	98.4	Very high	94.8	Very high	72 Å²	72	51.6 Å²	51.6	37%	0.369	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.6	170.9	-53.8	-57.6	0	0	0	108.3	K126 L127 R128 V129	I90-K126 HydrophobicContact CD1-CD 4.3Å; I90-K126 HydrophobicContact CG1-CB 4.25Å; I90-L127 PolarHBondContact N-O 2.89Å; I90-R128 HydrophobicContact CB-CB 4.13Å; I90-R128 HydrophobicContact CB-CG 4.08Å; I90-R128 HydrophobicContact CG2-CG 4.17Å; I90-R128 CarbonylContact O-C 3.44Å; I90-R128 WeakPolarHBondContact O-CA 3.46Å; I90-V129 PolarHBondContact O-N 2.69Å
91	F	98.4	Very high	95.5	Very high	17 Å²	17	51.6 Å²	51.6	8%	0.075	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.8	172.1	-66.9	-90.1	0	0	0	108.8	N84 I89 D100 R101 M103 L111 V129	N84-F91 HydrophobicContact CB-CZ 4.04Å; N84-F91 WeakPolarHBondContact O-CE2 3.5Å; I89-F91 HydrophobicContact CB-CD2 4.43Å; I89-F91 HydrophobicContact CB-CE2 3.77Å; I89-F91 HydrophobicContact CB-CZ 4.18Å; I89-F91 HydrophobicContact CG2-CD2 4.03Å; I89-F91 HydrophobicContact CG2-CE1 4.2Å; I89-F91 HydrophobicContact CG2-CE2 3.54Å; I89-F91 HydrophobicContact CG2-CZ 3.64Å; F91-D100 HydrophobicContact CB-CB 4.49Å; F91-D100 HydrophobicContact CD1-CB 4.1Å; F91-D100 WeakPolarHBondContact CD1-O 3.46Å; F91-D100 VanDerWaalsContact CE1-O 3.27Å; F91-D100 WeakPolarHBondContact CE1-O 3.4Å; F91-R101 HydrophobicContact CB-CG 4.35Å; F91-R101 HydrophobicContact CD1-CG 3.95Å; F91-R101 HydrophobicContact CD2-CG 4.16Å; F91-R101 VanDerWaalsContact CD2-NH1 3.26Å; F91-R101 HydrophobicContact CE1-CG 4.26Å; F91-R101 HydrophobicContact CE2-CG 4.46Å; F91-R101 HydrophobicContact CG-CG 3.88Å; F91-M103 HydrophobicContact CE1-CE 3.97Å; F91-M103 HydrophobicContact CZ-CE 4.27Å; F91-L111 HydrophobicContact CZ-CD2 4.41Å; F91-V129 HydrophobicContact CD1-CB 3.76Å; F91-V129 HydrophobicContact CD1-CG1 4.11Å; F91-V129 HydrophobicContact CD1-CG2 4.13Å; F91-V129 HydrophobicContact CE1-CB 3.99Å; F91-V129 HydrophobicContact CE1-CG1 4.3Å; F91-V129 HydrophobicContact CE1-CG2 3.84Å
92	K	97.4	Very high	95.8	Very high	93 Å²	93	51.9 Å²	51.9	40%	0.404	27%	0.268	S	S	.	.			trans	-74.3	-47.1	-179.4	-174.4	-175	160.6	-148.3	0	110.2	E94 D100 R128 V129 T130	K92-E94 VanDerWaalsContact C-N 3.27Å; K92-E94 WeakPolarHBondContact CD-OE2 3.45Å; K92-E94 VanDerWaalsContact CE-CD 3.46Å; K92-E94 WeakPolarHBondContact CE-OE1 3.15Å; K92-E94 WeakPolarHBondContact CE-OE2 3.41Å; K92-E94 WeakPolarHBondContact CG-OE2 3.2Å; K92-E94 IonicContact NZ-OE1 3.74Å; K92-E94 PolarHBondContact NZ-OE1 2.8Å; K92-E94 IonicContact NZ-OE2 3.59Å; K92-E94 PolarHBondContact NZ-OE2 2.93Å; K92-E94 VanDerWaalsContact NZ-OE2 3.15Å; K92-E94 PolarHBondContact O-N 3.21Å; K92-D100 PolarHBondContact N-OD2 3.45Å; K92-R128 VanDerWaalsContact CD-NH2 3.35Å; K92-R128 VanDerWaalsContact CG-NH2 3.26Å; K92-V129 WeakPolarHBondContact CB-O 3.43Å; K92-V129 PolarHBondContact N-O 3.02Å; K92-T130 HydrophobicContact CD-CG2 4.17Å
93	D	94.5	Very high	96.1	Very high	34 Å²	34	50.1 Å²	50.1	18%	0.182	26%	0.257	C	S	.	.			trans	47.1	48.9	173	-167.9	19.7	0	0	0	112	E95 N96 T97 G98 D100	D93-E95 PolarHBondContact O-N 3.41Å; D93-N96 PolarHBondContact O-N 3.28Å; D93-N96 VanDerWaalsContact O-N 3.12Å; D93-N96 PolarHBondContact OD1-N 3.49Å; D93-T97 PolarHBondContact OD1-N 3.44Å; D93-G98 WeakPolarHBondContact OD1-CA 3.19Å; D93-G98 PolarHBondContact OD1-N 2.72Å; D93-D100 PolarHBondContact N-OD2 3.09Å
94	E	91.9	Very high	96	Very high	73 Å²	73	48.2 Å²	48.2	34%	0.341	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.7	179.8	64.2	-88.6	-133.7	0	0	113	K92 N96	K92-E94 VanDerWaalsContact C-N 3.27Å; K92-E94 WeakPolarHBondContact CD-OE2 3.45Å; K92-E94 VanDerWaalsContact CE-CD 3.46Å; K92-E94 WeakPolarHBondContact CE-OE1 3.15Å; K92-E94 WeakPolarHBondContact CE-OE2 3.41Å; K92-E94 WeakPolarHBondContact CG-OE2 3.2Å; K92-E94 IonicContact NZ-OE1 3.74Å; K92-E94 PolarHBondContact NZ-OE1 2.8Å; K92-E94 IonicContact NZ-OE2 3.59Å; K92-E94 PolarHBondContact NZ-OE2 2.93Å; K92-E94 VanDerWaalsContact NZ-OE2 3.15Å; K92-E94 PolarHBondContact O-N 3.21Å; E94-N96 PolarHBondContact O-N 3.31Å; E94-N96 PolarHBondContact O-ND2 2.91Å; E94-N96 VanDerWaalsContact O-ND2 3.17Å
95	E	91.3	Very high	95.4	Very high	45 Å²	45	51.9 Å²	51.9	21%	0.21	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.1	176	-60.6	69.6	-147.3	0	0	111.5	D93 T97	D93-E95 PolarHBondContact O-N 3.41Å; E95-T97 HydrophobicContact CB-CG2 4Å; E95-T97 PolarHBondContact O-N 3.39Å
96	N	93.6	Very high	94.9	Very high	143 Å²	143	44.6 Å²	44.6	77%	0.765	23%	0.233	S	C	*	.	S	Bend	trans	55.6	29.3	-172	-57.4	-84.1	0	0	0	113.5	D93 E94	D93-N96 PolarHBondContact O-N 3.28Å; D93-N96 VanDerWaalsContact O-N 3.12Å; D93-N96 PolarHBondContact OD1-N 3.49Å; E94-N96 PolarHBondContact O-N 3.31Å; E94-N96 PolarHBondContact O-ND2 2.91Å; E94-N96 VanDerWaalsContact O-ND2 3.17Å
97	T	93.4	Very high	95	Very high	64 Å²	64	43.2 Å²	43.2	39%	0.393	23%	0.225	S	C	.	.	S	Bend	trans	-108.5	-9	179.9	64	0	0	0	0	112.5	R73 D93 E95 A99	R73-T97 PolarHBondContact NH2-O 2.92Å; D93-T97 PolarHBondContact OD1-N 3.44Å; E95-T97 HydrophobicContact CB-CG2 4Å; E95-T97 PolarHBondContact O-N 3.39Å; T97-A99 PolarHBondContact O-N 2.89Å; T97-A99 VanDerWaalsContact OG1-CB 3.26Å; T97-A99 WeakPolarHBondContact OG1-CB 3.35Å; T97-A99 PolarHBondContact OG1-N 3.33Å
98	G	94.9	Very high	94.9	Very high	18 Å²	18	40.7 Å²	40.7	19%	0.186	21%	0.205	C	C	.	.	S	Bend	trans	70.2	12.7	-171.4	0	0	0	0	0	113.8	D93 D100 R101	D93-G98 WeakPolarHBondContact OD1-CA 3.19Å; D93-G98 PolarHBondContact OD1-N 2.72Å; G98-D100 VanDerWaalsContact C-N 3.31Å; G98-D100 PolarHBondContact O-N 2.67Å; G98-R101 WeakPolarHBondContact O-CB 3.33Å; G98-R101 PolarHBondContact O-N 2.83Å
99	A	96.3	Very high	94.3	Very high	4 Å²	4	41 Å²	41	3%	0.033	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-59.4	-41	-176.8	0	0	0	0	0	112.3	T97 R101 L102 W133	T97-A99 PolarHBondContact O-N 2.89Å; T97-A99 VanDerWaalsContact OG1-CB 3.26Å; T97-A99 WeakPolarHBondContact OG1-CB 3.35Å; T97-A99 PolarHBondContact OG1-N 3.33Å; A99-R101 PolarHBondContact O-N 2.78Å; A99-L102 WeakPolarHBondContact O-CB 3.29Å; A99-L102 PolarHBondContact O-N 3.17Å; A99-W133 HydrophobicContact CB-CE3 3.98Å; A99-W133 HydrophobicContact CB-CZ3 4.2Å; A99-W133 WeakPolarHBondContact CB-O 3.21Å
100	D	97.8	Very high	94.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-50.3	-25.5	172	-99.5	0.9	0	0	0	115.1	F91 K92 D93 G98 E131 G132	F91-D100 HydrophobicContact CB-CB 4.49Å; F91-D100 HydrophobicContact CD1-CB 4.1Å; F91-D100 WeakPolarHBondContact CD1-O 3.46Å; F91-D100 VanDerWaalsContact CE1-O 3.27Å; F91-D100 WeakPolarHBondContact CE1-O 3.4Å; K92-D100 PolarHBondContact N-OD2 3.45Å; D93-D100 PolarHBondContact N-OD2 3.09Å; G98-D100 VanDerWaalsContact C-N 3.31Å; G98-D100 PolarHBondContact O-N 2.67Å; D100-E131 VanDerWaalsContact OD1-C 3.32Å; D100-E131 WeakPolarHBondContact OD1-CA 3.36Å; D100-G132 PolarHBondContact OD1-N 2.9Å
101	R	98.3	Very high	94	Very high	65 Å²	65	38.5 Å²	38.5	25%	0.245	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-88.3	-19	-178.8	-58.7	175.6	176.8	-81.6	-1.5	112.4	P83 N84 F91 G98 A99	P83-R101 CarbonylContact C-O 3.57Å; P83-R101 WeakPolarHBondContact CA-O 3.33Å; N84-R101 PolarHBondContact N-O 3.37Å; N84-R101 PolarHBondContact O-NH1 2.83Å; F91-R101 HydrophobicContact CB-CG 4.35Å; F91-R101 HydrophobicContact CD1-CG 3.95Å; F91-R101 HydrophobicContact CD2-CG 4.16Å; F91-R101 VanDerWaalsContact CD2-NH1 3.26Å; F91-R101 HydrophobicContact CE1-CG 4.26Å; F91-R101 HydrophobicContact CE2-CG 4.46Å; F91-R101 HydrophobicContact CG-CG 3.88Å; G98-R101 WeakPolarHBondContact O-CB 3.33Å; G98-R101 PolarHBondContact O-N 2.83Å; A99-R101 PolarHBondContact O-N 2.78Å
102	L	98	Very high	93.6	Very high	19 Å²	19	39.5 Å²	39.5	10%	0.099	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	122.5	-176.1	-66.5	171.5	0	0	0	109.7	F78 L81 P83 A99 W133	F78-L102 HydrophobicContact CE2-CD1 3.72Å; F78-L102 HydrophobicContact CZ-CD1 3.57Å; L81-L102 HydrophobicContact CB-CB 4.37Å; L81-L102 HydrophobicContact CD1-CB 4.31Å; P83-L102 HydrophobicContact CB-CD2 4.08Å; A99-L102 WeakPolarHBondContact O-CB 3.29Å; A99-L102 PolarHBondContact O-N 3.17Å; L102-W133 HydrophobicContact CB-CB 4.23Å; L102-W133 HydrophobicContact CB-CE3 4.05Å; L102-W133 HydrophobicContact CD1-CE3 3.57Å; L102-W133 HydrophobicContact CD1-CZ3 3.71Å; L102-W133 HydrophobicContact CG-CE3 4.43Å; L102-W133 WeakPolarHBondContact O-CB 3.49Å
103	M	97.7	Very high	93.1	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	161.9	-179	63.1	-168.1	67.8	0	0	110.8	T82 N84 F91 C107 K108 L111 G148	T82-M103 PolarHBondContact N-O 3.44Å; T82-M103 PolarHBondContact O-N 2.79Å; N84-M103 HydrophobicContact CB-CE 3.81Å; N84-M103 HydrophobicContact CB-SD 3.95Å; F91-M103 HydrophobicContact CE1-CE 3.97Å; F91-M103 HydrophobicContact CZ-CE 4.27Å; M103-C107 HydrophobicContact CB-CB 3.93Å; M103-C107 HydrophobicContact CG-CB 4.25Å; M103-C107 HydrophobicContact SD-CB 4.47Å; M103-K108 HydrophobicContact CG-CB 3.93Å; M103-K108 VanDerWaalsContact SD-CA 3.55Å; M103-K108 HydrophobicContact SD-CB 3.94Å; M103-L111 HydrophobicContact CE-CD2 3.64Å; M103-L111 HydrophobicContact SD-CB 4.47Å; M103-L111 HydrophobicContact SD-CD2 3.74Å; M103-G148 CarbonylContact C-O 3.54Å; M103-G148 VanDerWaalsContact CA-O 3.29Å; M103-G148 WeakPolarHBondContact CA-O 3.28Å
104	T	94.6	Very high	93.2	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.043	19%	0.186	C	C	.	.			trans	-63.3	157.4	172.4	62.2	0	0	0	0	111	L81 R106 C107 K108 G148 R149	L81-T104 HydrophobicContact CD2-CG2 4.07Å; T104-R106 VanDerWaalsContact C-N 3.29Å; T104-R106 PolarHBondContact O-N 3.31Å; T104-C107 WeakPolarHBondContact O-CB 3.45Å; T104-C107 PolarHBondContact O-N 3.18Å; T104-C107 VanDerWaalsContact O-N 3.1Å; T104-C107 WeakPolarHBondContact OG1-CB 3.17Å; T104-C107 PolarHBondContact OG1-N 3.03Å; T104-K108 PolarHBondContact O-N 2.97Å; T104-G148 PolarHBondContact N-O 3.27Å; T104-R149 HydrophobicContact CG2-CG 3.62Å
105	Q	85.1	Confident	93.3	Very high	80 Å²	80	32.4 Å²	32.4	37%	0.374	17%	0.17	S	C	.	.	H	α-helix	trans	-57.3	-43.7	179.6	-175	59.3	50.6	0	0	111.7	C107 K108 D109	Q105-C107 PolarHBondContact O-N 2.86Å; Q105-K108 WeakPolarHBondContact O-CB 3.25Å; Q105-K108 PolarHBondContact O-N 3.37Å; Q105-D109 PolarHBondContact NE2-OD1 2.99Å; Q105-D109 PolarHBondContact O-N 3.01Å
106	R	86.3	Confident	93.1	Very high	14 Å²	14	34.7 Å²	34.7	5%	0.053	18%	0.183	C	C	.	.	H	α-helix	trans	-58.5	-45.2	174.7	-179.3	-177.9	-171.1	77	8.6	112.4	T104 K108 D109 R110 D176 V190 K191 E193 S407	T104-R106 VanDerWaalsContact C-N 3.29Å; T104-R106 PolarHBondContact O-N 3.31Å; R106-K108 VanDerWaalsContact C-N 3.3Å; R106-K108 PolarHBondContact O-N 3.2Å; R106-D109 PolarHBondContact O-N 3.06Å; R106-R110 WeakPolarHBondContact O-CG 3.49Å; R106-R110 PolarHBondContact O-N 3.08Å; R106-D176 IonicContact CZ-OD1 3.37Å; R106-D176 IonicContact CZ-OD2 3.15Å; R106-D176 IonicContact NE-OD1 2.73Å; R106-D176 IonicContact NE-OD2 3.96Å; R106-D176 PolarHBondContact NE-OD2 3.03Å; R106-D176 IonicContact NH2-OD1 3.16Å; R106-D176 PolarHBondContact NH2-OD1 3.07Å; R106-D176 IonicContact NH2-OD2 2.94Å; R106-D176 PolarHBondContact NH2-OD2 3.21Å; R106-D176 VanDerWaalsContact NH2-OD2 3.16Å; R106-V190 HydrophobicContact CB-CG2 4.42Å; R106-V190 HydrophobicContact CG-CB 4.02Å; R106-V190 HydrophobicContact CG-CG1 4.29Å; R106-V190 HydrophobicContact CG-CG2 4.23Å; R106-K191 VanDerWaalsContact CD-O 3.27Å; R106-K191 WeakPolarHBondContact CD-O 3.24Å; R106-E193 WeakPolarHBondContact CB-OE1 3.36Å; R106-E193 PolarHBondContact N-OE1 2.9Å; R106-S407 PolarHBondContact NH1-O 3Å; R106-S407 PolarHBondContact NH2-O 3.42Å
107	C	95.8	Very high	93.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-43.8	178	-170.9	0	0	0	0	110.6	M103 T104 Q105 D109 R110 L111 V190	M103-C107 HydrophobicContact CB-CB 3.93Å; M103-C107 HydrophobicContact CG-CB 4.25Å; M103-C107 HydrophobicContact SD-CB 4.47Å; T104-C107 WeakPolarHBondContact O-CB 3.45Å; T104-C107 PolarHBondContact O-N 3.18Å; T104-C107 VanDerWaalsContact O-N 3.1Å; T104-C107 WeakPolarHBondContact OG1-CB 3.17Å; T104-C107 PolarHBondContact OG1-N 3.03Å; Q105-C107 PolarHBondContact O-N 2.86Å; C107-D109 PolarHBondContact O-N 3.25Å; C107-R110 PolarHBondContact O-N 3.08Å; C107-L111 WeakPolarHBondContact O-CB 3.39Å; C107-L111 PolarHBondContact O-N 3.36Å; C107-V190 HydrophobicContact CB-CG1 4.46Å; C107-V190 HydrophobicContact CB-CG2 3.71Å
108	K	94.5	Very high	93.2	Very high	47 Å²	47	26.5 Å²	26.5	20%	0.204	14%	0.14	C	C	.	.	H	α-helix	trans	-57.6	-45.7	175.2	-179.7	171.3	177.5	171.6	0	112.5	P83 N84 M103 T104 Q105 R106 L111 N112	P83-K108 PolarHBondContact O-NZ 2.95Å; N84-K108 HydrophobicContact CB-CD 4.39Å; N84-K108 HydrophobicContact CB-CG 4.29Å; M103-K108 HydrophobicContact CG-CB 3.93Å; M103-K108 VanDerWaalsContact SD-CA 3.55Å; M103-K108 HydrophobicContact SD-CB 3.94Å; T104-K108 PolarHBondContact O-N 2.97Å; Q105-K108 WeakPolarHBondContact O-CB 3.25Å; Q105-K108 PolarHBondContact O-N 3.37Å; R106-K108 VanDerWaalsContact C-N 3.3Å; R106-K108 PolarHBondContact O-N 3.2Å; K108-L111 PolarHBondContact O-N 3.33Å; K108-N112 VanDerWaalsContact O-CB 3.31Å; K108-N112 WeakPolarHBondContact O-CB 3.46Å; K108-N112 PolarHBondContact O-N 2.83Å; K108-N112 PolarHBondContact O-ND2 2.8Å
109	D	83.8	Confident	93.3	Very high	56 Å²	56	28 Å²	28	30%	0.299	14%	0.142	S	C	.	.	H	α-helix	trans	-63.2	-46.2	179.4	-61.8	-16.3	0	0	0	111.7	Q105 R106 C107 N112 S113	Q105-D109 PolarHBondContact NE2-OD1 2.99Å; Q105-D109 PolarHBondContact O-N 3.01Å; R106-D109 PolarHBondContact O-N 3.06Å; C107-D109 PolarHBondContact O-N 3.25Å; D109-N112 PolarHBondContact O-N 3.35Å; D109-S113 WeakPolarHBondContact O-CB 3.45Å; D109-S113 PolarHBondContact O-N 3.28Å
110	R	93.7	Very high	93.1	Very high	29 Å²	29	33.9 Å²	33.9	11%	0.109	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-42	177.8	-60.5	-48.6	176.8	-151.1	-3.9	112.2	R106 C107 S113 L114 A173 G174 F175 V190 S407	R106-R110 WeakPolarHBondContact O-CG 3.49Å; R106-R110 PolarHBondContact O-N 3.08Å; C107-R110 PolarHBondContact O-N 3.08Å; R110-S113 PolarHBondContact O-N 3.29Å; R110-L114 WeakPolarHBondContact O-CB 3.37Å; R110-L114 PolarHBondContact O-N 2.99Å; R110-A173 WeakPolarHBondContact CD-O 3.38Å; R110-G174 WeakPolarHBondContact CD-O 3.4Å; R110-G174 PolarHBondContact NE-O 3.09Å; R110-F175 HydrophobicContact CB-CD1 4.13Å; R110-F175 HydrophobicContact CB-CD2 3.91Å; R110-F175 HydrophobicContact CB-CE1 3.98Å; R110-F175 HydrophobicContact CB-CE2 3.74Å; R110-F175 HydrophobicContact CB-CG 4.12Å; R110-F175 HydrophobicContact CB-CZ 3.78Å; R110-V190 HydrophobicContact CB-CG1 4.44Å; R110-V190 HydrophobicContact CG-CG1 4.03Å; R110-S407 PolarHBondContact NH2-O 3.48Å
111	L	97.7	Very high	93.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.9	-40.8	178.9	-166.6	72.8	0	0	0	112	I89 F91 M103 C107 K108 L114 A115 L127 V129 V151 I153 F175	I89-L111 HydrophobicContact CD1-CD2 3.79Å; I89-L111 HydrophobicContact CD1-CG 3.75Å; F91-L111 HydrophobicContact CZ-CD2 4.41Å; M103-L111 HydrophobicContact CE-CD2 3.64Å; M103-L111 HydrophobicContact SD-CB 4.47Å; M103-L111 HydrophobicContact SD-CD2 3.74Å; C107-L111 WeakPolarHBondContact O-CB 3.39Å; C107-L111 PolarHBondContact O-N 3.36Å; K108-L111 PolarHBondContact O-N 3.33Å; L111-L114 PolarHBondContact O-N 3.41Å; L111-A115 PolarHBondContact O-N 3.26Å; L111-L127 HydrophobicContact CD1-CD2 3.59Å; L111-L127 HydrophobicContact CG-CD2 3.97Å; L111-V129 HydrophobicContact CD1-CG2 4.11Å; L111-V129 HydrophobicContact CD2-CG2 3.85Å; L111-V151 HydrophobicContact CD1-CG2 4.09Å; L111-I153 HydrophobicContact CD1-CG2 4.15Å; L111-F175 HydrophobicContact CB-CZ 4.17Å; L111-F175 HydrophobicContact CD1-CZ 4.04Å
112	N	89	Confident	93	Very high	38 Å²	38	36.1 Å²	36.1	20%	0.203	19%	0.185	C	C	.	.	H	α-helix	trans	-66.3	-41.1	176.1	-71	-20.1	0	0	0	111.9	N84 N86 K108 D109 L114 A115 I116	N84-N112 PolarHBondContact ND2-OD1 2.83Å; N84-N112 PolarHBondContact OD1-OD1 2.89Å; N86-N112 WeakPolarHBondContact CB-OD1 3.44Å; N86-N112 PolarHBondContact ND2-OD1 2.74Å; K108-N112 VanDerWaalsContact O-CB 3.31Å; K108-N112 WeakPolarHBondContact O-CB 3.46Å; K108-N112 PolarHBondContact O-N 2.83Å; K108-N112 PolarHBondContact O-ND2 2.8Å; D109-N112 PolarHBondContact O-N 3.35Å; N112-L114 VanDerWaalsContact C-N 3.34Å; N112-A115 PolarHBondContact O-N 3.21Å; N112-I116 PolarHBondContact O-N 3.45Å
113	S	87.8	Confident	93	Very high	50 Å²	50	40.8 Å²	40.8	35%	0.35	22%	0.216	S	C	.	.	H	α-helix	trans	-60.9	-44.4	173.6	-173.6	0	0	0	0	111.4	D109 R110 A115 I116 S117	D109-S113 WeakPolarHBondContact O-CB 3.45Å; D109-S113 PolarHBondContact O-N 3.28Å; R110-S113 PolarHBondContact O-N 3.29Å; S113-A115 VanDerWaalsContact C-N 3.35Å; S113-A115 PolarHBondContact O-N 2.91Å; S113-I116 PolarHBondContact O-N 3.33Å; S113-S117 PolarHBondContact O-N 3.13Å; S113-S117 VanDerWaalsContact O-N 3.15Å; S113-S117 PolarHBondContact O-OG 3.11Å
114	L	96.8	Very high	92.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.9	-40.8	176.2	179.9	57.1	0	0	0	112.3	R110 L111 N112 I116 S117 V118 L127 I153 L166 L169 A170 A173 F175	R110-L114 WeakPolarHBondContact O-CB 3.37Å; R110-L114 PolarHBondContact O-N 2.99Å; L111-L114 PolarHBondContact O-N 3.41Å; N112-L114 VanDerWaalsContact C-N 3.34Å; L114-I116 VanDerWaalsContact C-N 3.27Å; L114-I116 PolarHBondContact O-N 3.35Å; L114-S117 WeakPolarHBondContact O-CB 3.38Å; L114-S117 PolarHBondContact O-N 3.26Å; L114-S117 VanDerWaalsContact O-N 3.08Å; L114-V118 HydrophobicContact CD1-CG2 4.02Å; L114-V118 HydrophobicContact CG-CG2 4.2Å; L114-V118 WeakPolarHBondContact O-CG2 3.43Å; L114-V118 PolarHBondContact O-N 3.18Å; L114-L127 HydrophobicContact CB-CD2 4.21Å; L114-L127 HydrophobicContact CD2-CD1 4.02Å; L114-L127 HydrophobicContact CD2-CD2 4.07Å; L114-L127 HydrophobicContact CG-CD1 4.25Å; L114-L127 HydrophobicContact CG-CD2 3.98Å; L114-I153 HydrophobicContact CD2-CD1 3.41Å; L114-I153 VanDerWaalsContact CD2-CD1 3.41Å; L114-L166 HydrophobicContact CD1-CD1 4.47Å; L114-L169 HydrophobicContact CD1-CB 3.6Å; L114-A170 HydrophobicContact CD1-CB 4.31Å; L114-A170 HydrophobicContact CD2-CB 3.8Å; L114-A173 HydrophobicContact CB-CB 3.78Å; L114-A173 HydrophobicContact CD1-CB 4.28Å; L114-F175 HydrophobicContact CB-CE2 4.18Å; L114-F175 HydrophobicContact CD2-CE2 3.86Å
115	A	94.1	Very high	93	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-42.5	178.3	0	0	0	0	0	111.8	I89 L111 N112 S113 V118 M119 L127	I89-A115 HydrophobicContact CD1-CB 4.11Å; I89-A115 HydrophobicContact CG1-CB 3.68Å; L111-A115 PolarHBondContact O-N 3.26Å; N112-A115 PolarHBondContact O-N 3.21Å; S113-A115 VanDerWaalsContact C-N 3.35Å; S113-A115 PolarHBondContact O-N 2.91Å; A115-V118 PolarHBondContact O-N 3.18Å; A115-M119 WeakPolarHBondContact O-CG 3.43Å; A115-M119 PolarHBondContact O-N 3.13Å; A115-M119 VanDerWaalsContact O-N 3.12Å; A115-L127 HydrophobicContact CB-CB 4.17Å; A115-L127 HydrophobicContact CB-CD2 4.11Å
116	I	86.8	Confident	93.7	Very high	94 Å²	94	44.3 Å²	44.3	48%	0.482	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-47	174.4	-62.2	165.9	0	0	0	110.5	N112 S113 L114 V118 M119 N120	N112-I116 PolarHBondContact O-N 3.45Å; S113-I116 PolarHBondContact O-N 3.33Å; L114-I116 VanDerWaalsContact C-N 3.27Å; L114-I116 PolarHBondContact O-N 3.35Å; I116-V118 VanDerWaalsContact C-N 3.33Å; I116-V118 PolarHBondContact O-N 2.89Å; I116-M119 PolarHBondContact O-N 2.67Å; I116-N120 WeakPolarHBondContact O-CB 3.39Å; I116-N120 VanDerWaalsContact O-CG 3.28Å; I116-N120 PolarHBondContact O-N 3.44Å; I116-N120 PolarHBondContact O-ND2 2.68Å
117	S	91.9	Very high	94.3	Very high	35 Å²	35	43.7 Å²	43.7	25%	0.245	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-39	178.3	-62.6	0	0	0	0	113	S113 L114 N120 Q121	S113-S117 PolarHBondContact O-N 3.13Å; S113-S117 VanDerWaalsContact O-N 3.15Å; S113-S117 PolarHBondContact O-OG 3.11Å; L114-S117 WeakPolarHBondContact O-CB 3.38Å; L114-S117 PolarHBondContact O-N 3.26Å; L114-S117 VanDerWaalsContact O-N 3.08Å; S117-N120 PolarHBondContact O-N 2.96Å; S117-Q121 VanDerWaalsContact O-CB 3.27Å; S117-Q121 WeakPolarHBondContact O-CB 3.44Å; S117-Q121 PolarHBondContact O-N 3.39Å
118	V	97.3	Very high	94.4	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-48	177.8	169.6	0	0	0	0	111	L114 A115 I116 N120 Q121 W122 V125 L127 L166 L169	L114-V118 HydrophobicContact CD1-CG2 4.02Å; L114-V118 HydrophobicContact CG-CG2 4.2Å; L114-V118 WeakPolarHBondContact O-CG2 3.43Å; L114-V118 PolarHBondContact O-N 3.18Å; A115-V118 PolarHBondContact O-N 3.18Å; I116-V118 VanDerWaalsContact C-N 3.33Å; I116-V118 PolarHBondContact O-N 2.89Å; V118-N120 VanDerWaalsContact C-N 3.3Å; V118-N120 PolarHBondContact O-N 3.42Å; V118-Q121 PolarHBondContact O-N 2.89Å; V118-W122 HydrophobicContact CG1-CE3 3.97Å; V118-W122 HydrophobicContact CG1-CZ3 4.24Å; V118-W122 HydrophobicContact CG2-CZ3 4.33Å; V118-W122 PolarHBondContact O-N 3.33Å; V118-V125 HydrophobicContact CG1-CG1 4.45Å; V118-L127 HydrophobicContact CB-CB 4.46Å; V118-L127 HydrophobicContact CG2-CB 4.36Å; V118-L127 HydrophobicContact CG2-CD1 4.25Å; V118-L166 HydrophobicContact CG2-CD1 3.51Å; V118-L169 HydrophobicContact CG2-CD1 4.34Å
119	M	95.7	Very high	94.6	Very high	50 Å²	50	42.7 Å²	42.7	25%	0.246	25%	0.248	C	C	.	.	H	α-helix	trans	-64.2	-35.8	178.7	-68	-172.8	-64.3	0	0	112.4	D88 A115 I116 W122	D88-M119 HydrophobicContact CB-CE 3.65Å; D88-M119 HydrophobicContact CB-SD 3.73Å; A115-M119 WeakPolarHBondContact O-CG 3.43Å; A115-M119 PolarHBondContact O-N 3.13Å; A115-M119 VanDerWaalsContact O-N 3.12Å; I116-M119 PolarHBondContact O-N 2.67Å; M119-W122 CarbonylContact O-C 3.43Å
120	N	93.3	Very high	95.3	Very high	126 Å²	126	41 Å²	41	67%	0.674	24%	0.239	S	C	*	.	H	α-helix	trans	-70.5	-36.4	175.3	-73	-23.5	0	0	0	112.4	I116 S117 V118	I116-N120 WeakPolarHBondContact O-CB 3.39Å; I116-N120 VanDerWaalsContact O-CG 3.28Å; I116-N120 PolarHBondContact O-N 3.44Å; I116-N120 PolarHBondContact O-ND2 2.68Å; S117-N120 PolarHBondContact O-N 2.96Å; V118-N120 VanDerWaalsContact C-N 3.3Å; V118-N120 PolarHBondContact O-N 3.42Å
121	Q	96.4	Very high	95.5	Very high	75 Å²	75	40.7 Å²	40.7	35%	0.35	24%	0.239	S	C	.	.	H	α-helix	trans	-74.3	-36.2	180	-177.2	59	74.4	0	0	112.1	S117 V118 L165 L169	S117-Q121 VanDerWaalsContact O-CB 3.27Å; S117-Q121 WeakPolarHBondContact O-CB 3.44Å; S117-Q121 PolarHBondContact O-N 3.39Å; V118-Q121 PolarHBondContact O-N 2.89Å; Q121-L165 HydrophobicContact CG-CD2 3.99Å; Q121-L169 HydrophobicContact CB-CD1 3.82Å; Q121-L169 HydrophobicContact CG-CD1 4Å
122	W	97.9	Very high	95.5	Very high	37 Å²	37	40.7 Å²	40.7	14%	0.14	24%	0.239	C	C	.	.	S	Bend	trans	-135.8	94.2	-177.9	-58.3	-67.7	0	0	0	110.4	V118 M119 G124 V125 T155 K162 L165 L166 L169	V118-W122 HydrophobicContact CG1-CE3 3.97Å; V118-W122 HydrophobicContact CG1-CZ3 4.24Å; V118-W122 HydrophobicContact CG2-CZ3 4.33Å; V118-W122 PolarHBondContact O-N 3.33Å; M119-W122 CarbonylContact O-C 3.43Å; W122-G124 PolarHBondContact O-N 3.4Å; W122-V125 HydrophobicContact CB-CB 3.76Å; W122-V125 HydrophobicContact CB-CG2 3.86Å; W122-V125 PolarHBondContact O-N 2.72Å; W122-T155 HydrophobicContact CE3-CG2 4.33Å; W122-T155 HydrophobicContact CZ3-CG2 4.05Å; W122-K162 HydrophobicContact CD2-CD 3.95Å; W122-K162 HydrophobicContact CG-CD 4.16Å; W122-K162 HydrophobicContact CH2-CB 3.98Å; W122-K162 HydrophobicContact CZ2-CB 3.67Å; W122-K162 HydrophobicContact CZ2-CD 4.15Å; W122-K162 HydrophobicContact CZ2-CG 3.93Å; W122-L165 HydrophobicContact CH2-CB 4.17Å; W122-L165 HydrophobicContact CH2-CD2 4.39Å; W122-L165 HydrophobicContact CH2-CG 4.17Å; W122-L165 HydrophobicContact CZ2-CB 3.96Å; W122-L165 HydrophobicContact CZ2-CD2 3.7Å; W122-L165 HydrophobicContact CZ2-CG 3.94Å; W122-L166 HydrophobicContact CH2-CB 4.2Å; W122-L169 HydrophobicContact CH2-CD1 4.04Å; W122-L169 HydrophobicContact CZ3-CD1 3.78Å
123	P	96.7	Very high	95.9	Very high	118 Å²	118	38.9 Å²	38.9	77%	0.766	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	127.8	177.6	-27.5	35.5	0	0	0	112	V125	P123-V125 VanDerWaalsContact C-N 3.34Å
124	G	95	Very high	96.2	Very high	84 Å²	84	36.7 Å²	36.7	87%	0.866	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	-4.6	-178.3	0	0	0	0	0	115.4	W122	W122-G124 PolarHBondContact O-N 3.4Å
125	V	98.4	Very high	96	Very high	15 Å²	15	39.5 Å²	39.5	9%	0.091	23%	0.227	C	C	.	.			trans	-102.9	132.9	174.5	-178.9	0	0	0	0	109.5	V118 W122 P123 T155	V118-V125 HydrophobicContact CG1-CG1 4.45Å; W122-V125 HydrophobicContact CB-CB 3.76Å; W122-V125 HydrophobicContact CB-CG2 3.86Å; W122-V125 PolarHBondContact O-N 2.72Å; P123-V125 VanDerWaalsContact C-N 3.34Å; V125-T155 HydrophobicContact CG1-CG2 4.09Å
126	K	98.6	Very high	95.7	Very high	63 Å²	63	44 Å²	44	27%	0.274	25%	0.251	S	S	.	.			trans	-104.5	159.7	176.3	-72.4	-173	169.7	-166.5	0	111.3	P87 D88 I90 S156	P87-K126 PolarHBondContact O-NZ 2.74Å; D88-K126 IonicContact OD1-NZ 3.91Å; D88-K126 PolarHBondContact OD1-NZ 2.66Å; I90-K126 HydrophobicContact CD1-CD 4.3Å; I90-K126 HydrophobicContact CG1-CB 4.25Å; K126-S156 PolarHBondContact N-OG 3.38Å; K126-S156 WeakPolarHBondContact O-CB 3.35Å; K126-S156 PolarHBondContact O-N 3.11Å; K126-S156 PolarHBondContact O-OG 3.06Å
127	L	98.8	Very high	95.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	142.6	167.1	-180	63.6	0	0	0	109	I89 I90 L111 L114 A115 V118 I153 L166	I89-L127 WeakPolarHBondContact CA-O 3.35Å; I89-L127 HydrophobicContact CD1-CD2 4.46Å; I89-L127 HydrophobicContact CG1-CD2 4.37Å; I90-L127 PolarHBondContact N-O 2.89Å; L111-L127 HydrophobicContact CD1-CD2 3.59Å; L111-L127 HydrophobicContact CG-CD2 3.97Å; L114-L127 HydrophobicContact CB-CD2 4.21Å; L114-L127 HydrophobicContact CD2-CD1 4.02Å; L114-L127 HydrophobicContact CD2-CD2 4.07Å; L114-L127 HydrophobicContact CG-CD1 4.25Å; L114-L127 HydrophobicContact CG-CD2 3.98Å; A115-L127 HydrophobicContact CB-CB 4.17Å; A115-L127 HydrophobicContact CB-CD2 4.11Å; V118-L127 HydrophobicContact CB-CB 4.46Å; V118-L127 HydrophobicContact CG2-CB 4.36Å; V118-L127 HydrophobicContact CG2-CD1 4.25Å; L127-I153 HydrophobicContact CD1-CB 4.04Å; L127-I153 HydrophobicContact CD1-CD1 4.09Å; L127-I153 HydrophobicContact CD1-CG2 4.3Å; L127-L166 HydrophobicContact CD1-CD1 4.03Å
128	R	98.8	Very high	95.5	Very high	27 Å²	27	45.7 Å²	45.7	10%	0.102	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119.9	177.9	177.2	175.5	175	-79.6	-9.7	111.3	I90 K92 I153 T154	I90-R128 HydrophobicContact CB-CB 4.13Å; I90-R128 HydrophobicContact CB-CG 4.08Å; I90-R128 HydrophobicContact CG2-CG 4.17Å; I90-R128 CarbonylContact O-C 3.44Å; I90-R128 WeakPolarHBondContact O-CA 3.46Å; K92-R128 VanDerWaalsContact CD-NH2 3.35Å; K92-R128 VanDerWaalsContact CG-NH2 3.26Å; R128-I153 CarbonylContact O-C 3.6Å; R128-I153 WeakPolarHBondContact O-CA 3.27Å; R128-T154 WeakPolarHBondContact CB-OG1 3.44Å; R128-T154 WeakPolarHBondContact CG-OG1 3.1Å; R128-T154 PolarHBondContact N-O 3.21Å; R128-T154 PolarHBondContact NH1-OG1 2.82Å; R128-T154 PolarHBondContact O-N 2.91Å; R128-T154 PolarHBondContact O-OG1 3.26Å
129	V	98.8	Very high	95.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	132.4	172.1	179	0	0	0	0	108.7	I89 I90 F91 K92 L111 E131 V151 D152 I153	I89-V129 HydrophobicContact CG2-CG2 3.84Å; I90-V129 PolarHBondContact O-N 2.69Å; F91-V129 HydrophobicContact CD1-CB 3.76Å; F91-V129 HydrophobicContact CD1-CG1 4.11Å; F91-V129 HydrophobicContact CD1-CG2 4.13Å; F91-V129 HydrophobicContact CE1-CB 3.99Å; F91-V129 HydrophobicContact CE1-CG1 4.3Å; F91-V129 HydrophobicContact CE1-CG2 3.84Å; K92-V129 WeakPolarHBondContact CB-O 3.43Å; K92-V129 PolarHBondContact N-O 3.02Å; L111-V129 HydrophobicContact CD1-CG2 4.11Å; L111-V129 HydrophobicContact CD2-CG2 3.85Å; V129-E131 WeakPolarHBondContact CG1-O 3.34Å; V129-V151 HydrophobicContact CG1-CB 4.49Å; V129-V151 HydrophobicContact CG1-CG1 4.47Å; V129-D152 WeakPolarHBondContact CA-O 3.48Å; V129-I153 HydrophobicContact CG2-CG2 4.22Å
130	T	97.7	Very high	95	Very high	20 Å²	20	49.6 Å²	49.6	12%	0.123	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-23.9	174.6	43.7	0	0	0	0	114.3	K92 D152 T154	K92-T130 HydrophobicContact CD-CG2 4.17Å; T130-D152 PolarHBondContact N-O 3.47Å; T130-D152 WeakPolarHBondContact OG1-CB 3.48Å; T130-D152 PolarHBondContact OG1-O 3.2Å; T130-D152 VanDerWaalsContact OG1-O 3.04Å; T130-T154 HydrophobicContact CG2-CG2 4.11Å
131	E	98.1	Very high	94.8	Very high	22 Å²	22	51.9 Å²	51.9	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	134.6	-179.6	-170.1	65	-126.3	0	0	107.4	D100 V129 H139 V151 D152	D100-E131 VanDerWaalsContact OD1-C 3.32Å; D100-E131 WeakPolarHBondContact OD1-CA 3.36Å; V129-E131 WeakPolarHBondContact CG1-O 3.34Å; E131-H139 WeakPolarHBondContact CG-NE2 3.44Å; E131-V151 CarbonylContact O-C 3.53Å; E131-V151 VanDerWaalsContact O-CA 3.27Å; E131-V151 WeakPolarHBondContact O-CA 2.94Å; E131-D152 HydrophobicContact CB-CB 3.88Å; E131-D152 PolarHBondContact O-N 3.41Å
132	G	96.9	Very high	94.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.01	30%	0.302	C	S	.	.			trans	-125.7	-114.4	178.8	0	0	0	0	0	111.9	D100 H145	D100-G132 PolarHBondContact OD1-N 2.9Å; G132-H145 PolarHBondContact O-ND1 3.34Å
133	W	97.9	Very high	94.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.299	C	S	.	.	S	Bend	trans	-81.2	117.5	172.3	170.9	65.5	0	0	0	110.1	I71 R73 F78 L81 A99 L102 E135 H145 Y146	I71-W133 VanDerWaalsContact O-CZ2 3.23Å; I71-W133 WeakPolarHBondContact O-CZ2 3.25Å; I71-W133 PolarHBondContact O-NE1 2.9Å; I71-W133 VanDerWaalsContact O-NE1 3.1Å; R73-W133 HydrophobicContact CG-CH2 3.46Å; R73-W133 VanDerWaalsContact CG-CH2 3.46Å; R73-W133 HydrophobicContact CG-CZ2 4.38Å; R73-W133 HydrophobicContact CG-CZ3 4.22Å; F78-W133 HydrophobicContact CD2-CH2 4.17Å; F78-W133 HydrophobicContact CD2-CZ2 4.11Å; F78-W133 HydrophobicContact CE2-CE3 4.26Å; F78-W133 AromaticContact CE2-CH2 3.6Å; F78-W133 HydrophobicContact CE2-CH2 3.6Å; F78-W133 AromaticContact CE2-CZ2 3.96Å; F78-W133 HydrophobicContact CE2-CZ2 3.96Å; F78-W133 AromaticContact CE2-CZ3 3.74Å; F78-W133 HydrophobicContact CE2-CZ3 3.74Å; L81-W133 HydrophobicContact CD1-CB 4.44Å; L81-W133 HydrophobicContact CD1-CD2 3.84Å; L81-W133 HydrophobicContact CD1-CG 3.75Å; A99-W133 HydrophobicContact CB-CE3 3.98Å; A99-W133 HydrophobicContact CB-CZ3 4.2Å; A99-W133 WeakPolarHBondContact CB-O 3.21Å; L102-W133 HydrophobicContact CB-CB 4.23Å; L102-W133 HydrophobicContact CB-CE3 4.05Å; L102-W133 HydrophobicContact CD1-CE3 3.57Å; L102-W133 HydrophobicContact CD1-CZ3 3.71Å; L102-W133 HydrophobicContact CG-CE3 4.43Å; L102-W133 WeakPolarHBondContact O-CB 3.49Å; W133-E135 HydrophobicContact CH2-CB 3.96Å; W133-E135 HydrophobicContact CZ2-CB 4.28Å; W133-E135 HydrophobicContact CZ3-CB 4.42Å; W133-E135 VanDerWaalsContact CZ3-OE1 3.31Å; W133-E135 WeakPolarHBondContact CZ3-OE1 3.47Å; W133-H145 WeakPolarHBondContact CA-O 3.35Å; W133-Y146 PolarHBondContact NE1-O 3.17Å
134	D	95.3	Very high	94.5	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	26%	0.262	C	S	.	.			trans	-95.8	128	-176.6	177.8	17.3	0	0	0	111.3	D136 G137 H138 H139 H145 Y146	D134-D136 PolarHBondContact OD1-N 3.5Å; D134-G137 PolarHBondContact OD1-N 2.86Å; D134-G137 PolarHBondContact OD2-N 2.83Å; D134-H138 IonicContact OD1-ND1 3.64Å; D134-H138 PolarHBondContact OD2-N 3.35Å; D134-H139 IonicContact OD2-CD2 3.37Å; D134-H139 PolarHBondContact OD2-CD2 2.85Å; D134-H139 IonicContact OD2-NE2 3.6Å; D134-H145 HydrophobicContact CB-CB 4.15Å; D134-H145 PolarHBondContact N-O 2.82Å; D134-Y146 HydrophobicContact CB-CD1 4.18Å; D134-Y146 HydrophobicContact CB-CE1 4.16Å; D134-Y146 WeakPolarHBondContact O-CD1 3.49Å; D134-Y146 VanDerWaalsContact OD2-CE1 3.25Å; D134-Y146 WeakPolarHBondContact OD2-CE1 3.24Å
135	E	90.8	Very high	94.7	Very high	58 Å²	58	42.2 Å²	42.2	27%	0.271	22%	0.221	S	C	.	.	S	Bend	trans	-101.7	-21.5	173.4	61.7	-167.3	86.1	0	0	113.7	K70 R73 W133	K70-E135 PolarHBondContact NZ-O 2.81Å; R73-E135 IonicContact CZ-OE1 2.72Å; R73-E135 IonicContact CZ-OE2 3.91Å; R73-E135 VanDerWaalsContact NE-CD 3.34Å; R73-E135 IonicContact NE-OE1 2.68Å; R73-E135 PolarHBondContact NE-OE1 3.22Å; R73-E135 IonicContact NE-OE2 3.77Å; R73-E135 PolarHBondContact NE-OE2 3.41Å; R73-E135 IonicContact NH2-OE1 2.56Å; R73-E135 PolarHBondContact NH2-OE1 3.27Å; R73-E135 IonicContact NH2-OE2 3.29Å; W133-E135 HydrophobicContact CH2-CB 3.96Å; W133-E135 HydrophobicContact CZ2-CB 4.28Å; W133-E135 HydrophobicContact CZ3-CB 4.42Å; W133-E135 VanDerWaalsContact CZ3-OE1 3.31Å; W133-E135 WeakPolarHBondContact CZ3-OE1 3.47Å
136	D	88.1	Confident	94.6	Very high	95 Å²	95	42.1 Å²	42.1	51%	0.508	22%	0.219	S	C	.	.	S	Bend	trans	-89.3	-18.8	-166.9	-67.9	-33.3	0	0	0	113.8	D134 H138	D134-D136 PolarHBondContact OD1-N 3.5Å; D136-H138 WeakPolarHBondContact CB-CE1 3.36Å; D136-H138 IonicContact OD2-CE1 2.67Å
137	G	88	Confident	94.5	Very high	37 Å²	37	39.1 Å²	39.1	38%	0.381	21%	0.206	S	C	.	.			trans	92.9	31.4	172.4	0	0	0	0	0	114.2	D134 H139 Y146	D134-G137 PolarHBondContact OD1-N 2.86Å; D134-G137 PolarHBondContact OD2-N 2.83Å; G137-H139 VanDerWaalsContact C-N 3.26Å; G137-H139 PolarHBondContact O-N 2.99Å; G137-Y146 WeakPolarHBondContact CA-OH 3.15Å; G137-Y146 PolarHBondContact O-OH 2.86Å
138	H	87.7	Confident	94.4	Very high	128 Å²	128	39.1 Å²	39.1	59%	0.593	21%	0.206	S	C	*	.			trans	-77.8	-10.1	-176.6	-64.2	128	0	0	0	113.6	D134 D136	D134-H138 IonicContact OD1-ND1 3.64Å; D134-H138 PolarHBondContact OD2-N 3.35Å; D136-H138 WeakPolarHBondContact CB-CE1 3.36Å; D136-H138 IonicContact OD2-CE1 2.67Å
139	H	92.1	Very high	94.4	Very high	46 Å²	46	38 Å²	38	21%	0.213	20%	0.202	C	C	.	.	S	Bend	trans	-107.5	169.7	-178.3	-56.8	-82.6	0	0	0	113.6	E131 D134 G137 S143 H145 Y146	E131-H139 WeakPolarHBondContact CG-NE2 3.44Å; D134-H139 IonicContact OD2-CD2 3.37Å; D134-H139 PolarHBondContact OD2-CD2 2.85Å; D134-H139 IonicContact OD2-NE2 3.6Å; G137-H139 VanDerWaalsContact C-N 3.26Å; G137-H139 PolarHBondContact O-N 2.99Å; H139-S143 VanDerWaalsContact CB-OG 3.31Å; H139-S143 WeakPolarHBondContact CB-OG 3.17Å; H139-H145 VanDerWaalsContact CD2-CB 3.5Å; H139-H145 WeakPolarHBondContact CD2-CB 3.35Å; H139-H145 AromaticContact CD2-CG 3.74Å; H139-H145 AromaticContact CE1-CD2 3.41Å; H139-H145 PolarHBondContact CE1-CD2 3.28Å; H139-H145 VanDerWaalsContact CE1-CD2 3.41Å; H139-H145 AromaticContact CE1-CE1 3.9Å; H139-H145 AromaticContact CE1-CG 3.63Å; H139-H145 AromaticContact CE1-ND1 3.94Å; H139-H145 AromaticContact CE1-NE2 3.65Å; H139-H145 AromaticContact ND1-CD2 3.69Å; H139-H145 AromaticContact NE2-CD2 3.6Å; H139-H145 AromaticContact NE2-CG 3.31Å; H139-H145 VanDerWaalsContact NE2-CG 3.31Å; H139-H145 AromaticContact NE2-ND1 3.63Å; H139-Y146 HydrophobicContact CB-CE2 4.45Å; H139-Y146 PolarHBondContact N-OH 3.12Å; H139-Y146 VanDerWaalsContact N-OH 3.13Å; H139-Y146 PolarHBondContact O-OH 3.26Å
140	S	90.7	Very high	94.4	Very high	85 Å²	85	38 Å²	38	59%	0.594	20%	0.202	S	C	*	.			trans	-56.1	151.4	172.4	62.1	0	0	0	0	112.3	E142 S143 Y146	S140-E142 PolarHBondContact O-N 3.43Å; S140-S143 WeakPolarHBondContact O-CB 3.36Å; S140-S143 PolarHBondContact O-N 2.89Å; S140-Y146 VanDerWaalsContact O-CE2 3.25Å; S140-Y146 WeakPolarHBondContact O-CE2 3.46Å
141	E	87.9	Confident	94.4	Very high	175 Å²	175	37 Å²	37	82%	0.818	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.9	-39.9	-172.2	-64.2	-175.2	163.2	0	0	115.4
142	E	91.9	Very high	94.4	Very high	101 Å²	101	36.4 Å²	36.4	47%	0.472	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	34.9	-178.9	-63.9	-176.9	168.1	0	0	112.8	K59 Y67 S140	K59-E142 HydrophobicContact CD-CB 4.37Å; K59-E142 VanDerWaalsContact NZ-CB 3.26Å; K59-E142 IonicContact NZ-OE2 3.81Å; K59-E142 PolarHBondContact NZ-OE2 2.79Å; Y67-E142 HydrophobicContact CD1-CB 4.23Å; Y67-E142 HydrophobicContact CD1-CG 4.16Å; Y67-E142 HydrophobicContact CD2-CB 4.34Å; Y67-E142 HydrophobicContact CG-CB 4.02Å; Y67-E142 HydrophobicContact CG-CG 4.43Å; S140-E142 PolarHBondContact O-N 3.43Å
143	S	96.6	Very high	94.5	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.063	19%	0.193	C	C	.	.			trans	-69.6	139.3	178.2	-179.1	0	0	0	0	111.8	Y67 H139 S140 H145 Y146	Y67-S143 WeakPolarHBondContact CE2-O 3.13Å; H139-S143 VanDerWaalsContact CB-OG 3.31Å; H139-S143 WeakPolarHBondContact CB-OG 3.17Å; S140-S143 WeakPolarHBondContact O-CB 3.36Å; S140-S143 PolarHBondContact O-N 2.89Å; S143-H145 PolarHBondContact O-N 3.36Å; S143-H145 WeakPolarHBondContact OG-CB 3.48Å; S143-H145 PolarHBondContact OG-CD2 2.72Å; S143-H145 PolarHBondContact OG-N 2.88Å; S143-Y146 WeakPolarHBondContact O-CB 3.07Å; S143-Y146 PolarHBondContact O-N 3.01Å
144	L	97.4	Very high	94.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-74.7	-11.1	174.8	-63.3	-168.9	0	0	0	113.3	E58 S64 Y67 Y146 E147 R149 A150	E58-L144 HydrophobicContact CG-CD1 4.11Å; E58-L144 WeakPolarHBondContact OE1-CD1 3.3Å; S64-L144 VanDerWaalsContact CB-CD1 3.45Å; Y67-L144 HydrophobicContact CD2-CD2 4.46Å; L144-Y146 PolarHBondContact O-N 2.72Å; L144-E147 PolarHBondContact O-N 3.25Å; L144-R149 HydrophobicContact CB-CB 4.21Å; L144-R149 PolarHBondContact O-N 3.48Å; L144-R149 VanDerWaalsContact O-N 3.14Å; L144-A150 HydrophobicContact CB-CB 3.93Å; L144-A150 PolarHBondContact O-N 2.69Å
145	H	98.2	Very high	94.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-60.5	-37.1	168.7	-75.4	-88.5	0	0	0	111.1	G132 W133 D134 H139 S143 E147 G148 D152 H187	G132-H145 PolarHBondContact O-ND1 3.34Å; W133-H145 WeakPolarHBondContact CA-O 3.35Å; D134-H145 HydrophobicContact CB-CB 4.15Å; D134-H145 PolarHBondContact N-O 2.82Å; H139-H145 VanDerWaalsContact CD2-CB 3.5Å; H139-H145 WeakPolarHBondContact CD2-CB 3.35Å; H139-H145 AromaticContact CD2-CG 3.74Å; H139-H145 AromaticContact CE1-CD2 3.41Å; H139-H145 PolarHBondContact CE1-CD2 3.28Å; H139-H145 VanDerWaalsContact CE1-CD2 3.41Å; H139-H145 AromaticContact CE1-CE1 3.9Å; H139-H145 AromaticContact CE1-CG 3.63Å; H139-H145 AromaticContact CE1-ND1 3.94Å; H139-H145 AromaticContact CE1-NE2 3.65Å; H139-H145 AromaticContact ND1-CD2 3.69Å; H139-H145 AromaticContact NE2-CD2 3.6Å; H139-H145 AromaticContact NE2-CG 3.31Å; H139-H145 VanDerWaalsContact NE2-CG 3.31Å; H139-H145 AromaticContact NE2-ND1 3.63Å; S143-H145 PolarHBondContact O-N 3.36Å; S143-H145 WeakPolarHBondContact OG-CB 3.48Å; S143-H145 PolarHBondContact OG-CD2 2.72Å; S143-H145 PolarHBondContact OG-N 2.88Å; H145-E147 PolarHBondContact O-N 2.9Å; H145-G148 PolarHBondContact O-N 2.98Å; H145-G148 VanDerWaalsContact O-N 3.09Å; H145-D152 IonicContact CE1-OD1 3.18Å; H145-D152 IonicContact CE1-OD2 2.66Å; H145-D152 IonicContact NE2-OD1 3.37Å; H145-D152 IonicContact NE2-OD2 2.71Å; H145-H187 AromaticContact CD2-CE1 3.66Å; H145-H187 AromaticContact NE2-CE1 3.19Å; H145-H187 PolarHBondContact NE2-CE1 3.03Å; H145-H187 AromaticContact NE2-ND1 3.22Å; H145-H187 PolarHBondContact NE2-ND1 3.41Å
146	Y	97.3	Very high	95.1	Very high	13 Å²	13	35.6 Å²	35.6	5%	0.051	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-64.5	-9.6	177.1	-61.8	-38	0	0	0	114.7	Y67 K70 I71 W133 D134 G137 H139 S140 S143 L144	Y67-Y146 HydrophobicContact CE2-CD2 4.43Å; K70-Y146 HydrophobicContact CD-CD1 4.2Å; K70-Y146 HydrophobicContact CD-CG 4.21Å; K70-Y146 HydrophobicContact CG-CG 4.3Å; I71-Y146 PolarHBondContact N-O 2.64Å; W133-Y146 PolarHBondContact NE1-O 3.17Å; D134-Y146 HydrophobicContact CB-CD1 4.18Å; D134-Y146 HydrophobicContact CB-CE1 4.16Å; D134-Y146 WeakPolarHBondContact O-CD1 3.49Å; D134-Y146 VanDerWaalsContact OD2-CE1 3.25Å; D134-Y146 WeakPolarHBondContact OD2-CE1 3.24Å; G137-Y146 WeakPolarHBondContact CA-OH 3.15Å; G137-Y146 PolarHBondContact O-OH 2.86Å; H139-Y146 HydrophobicContact CB-CE2 4.45Å; H139-Y146 PolarHBondContact N-OH 3.12Å; H139-Y146 VanDerWaalsContact N-OH 3.13Å; H139-Y146 PolarHBondContact O-OH 3.26Å; S140-Y146 VanDerWaalsContact O-CE2 3.25Å; S140-Y146 WeakPolarHBondContact O-CE2 3.46Å; S143-Y146 WeakPolarHBondContact O-CB 3.07Å; S143-Y146 PolarHBondContact O-N 3.01Å; L144-Y146 PolarHBondContact O-N 2.72Å
147	E	96.1	Very high	95.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-115.1	5.7	179.7	-67.1	-179.4	-154.9	0	0	113	Y67 E68 G69 I71 R77 L81 L144 H145 R149	Y67-E147 WeakPolarHBondContact CA-OE1 3.31Å; Y67-E147 HydrophobicContact CD2-CG 4.46Å; Y67-E147 WeakPolarHBondContact CD2-OE1 3.5Å; Y67-E147 HydrophobicContact CE2-CG 4.36Å; Y67-E147 WeakPolarHBondContact CE2-OE1 3.47Å; E68-E147 WeakPolarHBondContact CA-OE1 3.48Å; E68-E147 PolarHBondContact N-OE1 3.4Å; G69-E147 PolarHBondContact N-OE1 2.82Å; G69-E147 VanDerWaalsContact O-CG 3.27Å; G69-E147 WeakPolarHBondContact O-CG 3.2Å; I71-E147 HydrophobicContact CD1-CB 4.36Å; R77-E147 IonicContact NH2-OE2 3.8Å; L81-E147 WeakPolarHBondContact CD2-O 3.25Å; L144-E147 PolarHBondContact O-N 3.25Å; H145-E147 PolarHBondContact O-N 2.9Å; E147-R149 HydrophobicContact CB-CB 4.33Å; E147-R149 HydrophobicContact CB-CG 4.05Å; E147-R149 PolarHBondContact O-N 2.68Å; E147-R149 VanDerWaalsContact OE2-CD 3.28Å; E147-R149 WeakPolarHBondContact OE2-CD 3.37Å; E147-R149 IonicContact OE2-CZ 2.65Å; E147-R149 IonicContact OE2-NE 3.82Å; E147-R149 IonicContact OE2-NH1 2.91Å; E147-R149 PolarHBondContact OE2-NH1 2.9Å
148	G	97.2	Very high	96	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	27.7	-174.5	0	0	0	0	0	112.5	M103 T104 H145	M103-G148 CarbonylContact C-O 3.54Å; M103-G148 VanDerWaalsContact CA-O 3.29Å; M103-G148 WeakPolarHBondContact CA-O 3.28Å; T104-G148 PolarHBondContact N-O 3.27Å; H145-G148 PolarHBondContact O-N 2.98Å; H145-G148 VanDerWaalsContact O-N 3.09Å
149	R	97.5	Very high	96.5	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.008	18%	0.184	C	C	.	.			trans	-107.7	-1.8	-178.5	-74.7	170.6	56.4	-162.3	-5	112.7	S64 R66 T104 L144 E147 S189 V190	S64-R149 PolarHBondContact O-NH2 2.62Å; R66-R149 PolarHBondContact O-NH1 3.13Å; T104-R149 HydrophobicContact CG2-CG 3.62Å; L144-R149 HydrophobicContact CB-CB 4.21Å; L144-R149 PolarHBondContact O-N 3.48Å; L144-R149 VanDerWaalsContact O-N 3.14Å; E147-R149 HydrophobicContact CB-CB 4.33Å; E147-R149 HydrophobicContact CB-CG 4.05Å; E147-R149 PolarHBondContact O-N 2.68Å; E147-R149 VanDerWaalsContact OE2-CD 3.28Å; E147-R149 WeakPolarHBondContact OE2-CD 3.37Å; E147-R149 IonicContact OE2-CZ 2.65Å; E147-R149 IonicContact OE2-NE 3.82Å; E147-R149 IonicContact OE2-NH1 2.91Å; E147-R149 PolarHBondContact OE2-NH1 2.9Å; R149-S189 CarbonylContact O-C 3.5Å; R149-S189 WeakPolarHBondContact O-CA 3.32Å; R149-S189 WeakPolarHBondContact O-CB 3.5Å; R149-V190 HydrophobicContact CB-CG2 4.22Å; R149-V190 HydrophobicContact CG-CG2 4.42Å; R149-V190 PolarHBondContact NE-O 2.93Å; R149-V190 VanDerWaalsContact NE-O 3.08Å; R149-V190 PolarHBondContact NH2-O 2.81Å; R149-V190 WeakPolarHBondContact O-CG2 3.38Å; R149-V190 PolarHBondContact O-N 2.97Å
150	A	98.4	Very high	96.8	Very high	1 Å²	1	42 Å²	42	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	156.3	176.9	0	0	0	0	0	111.1	L144 C188	L144-A150 HydrophobicContact CB-CB 3.93Å; L144-A150 PolarHBondContact O-N 2.69Å; A150-C188 CarbonylContact C-O 3.59Å; A150-C188 VanDerWaalsContact CA-O 3.25Å; A150-C188 WeakPolarHBondContact CA-O 3.43Å
151	V	98.7	Very high	97.1	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	140.6	176.9	-70	0	0	0	0	109.3	L111 V129 E131 I153 F175 C188	L111-V151 HydrophobicContact CD1-CG2 4.09Å; V129-V151 HydrophobicContact CG1-CB 4.49Å; V129-V151 HydrophobicContact CG1-CG1 4.47Å; E131-V151 CarbonylContact O-C 3.53Å; E131-V151 VanDerWaalsContact O-CA 3.27Å; E131-V151 WeakPolarHBondContact O-CA 2.94Å; V151-I153 HydrophobicContact CB-CG2 4.17Å; V151-I153 HydrophobicContact CG2-CG2 3.88Å; V151-F175 HydrophobicContact CG2-CE1 3.99Å; V151-F175 HydrophobicContact CG2-CZ 4.18Å; V151-C188 HydrophobicContact CG2-CB 3.95Å; V151-C188 PolarHBondContact N-O 2.82Å; V151-C188 PolarHBondContact O-N 2.93Å
152	D	98.6	Very high	97.6	Very high	9 Å²	9	38.4 Å²	38.4	5%	0.048	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.3	166.4	-69.7	-23.3	0	0	0	109.1	V129 T130 E131 H145 H185 V186 H187	V129-D152 WeakPolarHBondContact CA-O 3.48Å; T130-D152 PolarHBondContact N-O 3.47Å; T130-D152 WeakPolarHBondContact OG1-CB 3.48Å; T130-D152 PolarHBondContact OG1-O 3.2Å; T130-D152 VanDerWaalsContact OG1-O 3.04Å; E131-D152 HydrophobicContact CB-CB 3.88Å; E131-D152 PolarHBondContact O-N 3.41Å; H145-D152 IonicContact CE1-OD1 3.18Å; H145-D152 IonicContact CE1-OD2 2.66Å; H145-D152 IonicContact NE2-OD1 3.37Å; H145-D152 IonicContact NE2-OD2 2.71Å; D152-H185 HydrophobicContact CB-CB 4.18Å; D152-H185 VanDerWaalsContact CB-CD2 3.42Å; D152-H185 WeakPolarHBondContact CB-CD2 3.35Å; D152-H185 VanDerWaalsContact CG-NE2 3.26Å; D152-H185 IonicContact OD1-CD2 3.03Å; D152-H185 PolarHBondContact OD1-CD2 3.22Å; D152-H185 VanDerWaalsContact OD1-CD2 3.29Å; D152-H185 IonicContact OD1-NE2 3.2Å; D152-H185 PolarHBondContact OD1-NE2 3.26Å; D152-H185 IonicContact OD2-CD2 3.35Å; D152-H185 PolarHBondContact OD2-CD2 2.98Å; D152-H185 IonicContact OD2-CE1 3.74Å; D152-H185 IonicContact OD2-NE2 3.64Å; D152-H185 PolarHBondContact OD2-NE2 2.67Å; D152-H185 VanDerWaalsContact OD2-NE2 3.1Å; D152-V186 WeakPolarHBondContact CA-O 3.42Å; D152-H187 WeakPolarHBondContact OD1-CA 3.34Å; D152-H187 WeakPolarHBondContact OD1-CB 3.14Å; D152-H187 IonicContact OD1-CG 3.84Å; D152-H187 IonicContact OD1-ND1 2.72Å; D152-H187 PolarHBondContact OD1-ND1 3.02Å
153	I	98.8	Very high	97.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.2	-169.1	62.6	166.7	0	0	0	113.3	L111 L114 L127 R128 V129 V151 L166 A170 H185 V186	L111-I153 HydrophobicContact CD1-CG2 4.15Å; L114-I153 HydrophobicContact CD2-CD1 3.41Å; L114-I153 VanDerWaalsContact CD2-CD1 3.41Å; L127-I153 HydrophobicContact CD1-CB 4.04Å; L127-I153 HydrophobicContact CD1-CD1 4.09Å; L127-I153 HydrophobicContact CD1-CG2 4.3Å; R128-I153 CarbonylContact O-C 3.6Å; R128-I153 WeakPolarHBondContact O-CA 3.27Å; V129-I153 HydrophobicContact CG2-CG2 4.22Å; V151-I153 HydrophobicContact CB-CG2 4.17Å; V151-I153 HydrophobicContact CG2-CG2 3.88Å; I153-L166 HydrophobicContact CD1-CD1 4.22Å; I153-L166 HydrophobicContact CD1-CD2 4.18Å; I153-L166 HydrophobicContact CD1-CG 4.03Å; I153-L166 HydrophobicContact CG1-CD2 4.2Å; I153-A170 HydrophobicContact CD1-CB 4.37Å; I153-H185 WeakPolarHBondContact O-CA 3.5Å; I153-V186 HydrophobicContact CG1-CB 3.96Å; I153-V186 VanDerWaalsContact CG1-O 3.28Å; I153-V186 WeakPolarHBondContact CG1-O 3.38Å; I153-V186 PolarHBondContact N-O 3.39Å; I153-V186 PolarHBondContact O-N 3.36Å
154	T	98.8	Very high	98	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	171.5	177.9	57.4	0	0	0	0	109.7	R128 T130 Y163 A184 H185	R128-T154 WeakPolarHBondContact CB-OG1 3.44Å; R128-T154 WeakPolarHBondContact CG-OG1 3.1Å; R128-T154 PolarHBondContact N-O 3.21Å; R128-T154 PolarHBondContact NH1-OG1 2.82Å; R128-T154 PolarHBondContact O-N 2.91Å; R128-T154 PolarHBondContact O-OG1 3.26Å; T130-T154 HydrophobicContact CG2-CG2 4.11Å; T154-Y163 HydrophobicContact CG2-CE1 4.4Å; T154-Y163 HydrophobicContact CG2-CE2 4.15Å; T154-Y163 WeakPolarHBondContact CG2-OH 3.5Å; T154-A184 WeakPolarHBondContact CG2-O 3.38Å; T154-H185 HydrophobicContact CG2-CB 4.09Å
155	T	98.7	Very high	98	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	151	162.9	54.3	0	0	0	0	110.3	W122 V125 D157 R158 D159 K162 L166	W122-T155 HydrophobicContact CE3-CG2 4.33Å; W122-T155 HydrophobicContact CZ3-CG2 4.05Å; V125-T155 HydrophobicContact CG1-CG2 4.09Å; T155-D157 WeakPolarHBondContact CB-OD1 3.35Å; T155-D157 PolarHBondContact O-N 3.45Å; T155-D157 PolarHBondContact OG1-OD1 2.85Å; T155-R158 WeakPolarHBondContact O-CA 3.38Å; T155-R158 PolarHBondContact O-N 3.36Å; T155-D159 PolarHBondContact OG1-N 3.22Å; T155-K162 HydrophobicContact CG2-CB 3.96Å; T155-K162 HydrophobicContact CG2-CD 4.07Å; T155-L166 HydrophobicContact CG2-CD2 4.31Å
156	S	98.4	Very high	98	Very high	42 Å²	42	35.5 Å²	35.5	29%	0.294	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.1	-178.1	62.6	0	0	0	0	113.7	K126 R158	K126-S156 PolarHBondContact N-OG 3.38Å; K126-S156 WeakPolarHBondContact O-CB 3.35Å; K126-S156 PolarHBondContact O-N 3.11Å; K126-S156 PolarHBondContact O-OG 3.06Å; S156-R158 VanDerWaalsContact C-N 3.26Å
157	D	98	Very high	98.1	Very high	71 Å²	71	34.9 Å²	34.9	38%	0.38	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.6	174.9	65.8	-4.1	0	0	0	113.5	T155 D159 K162	T155-D157 WeakPolarHBondContact CB-OD1 3.35Å; T155-D157 PolarHBondContact O-N 3.45Å; T155-D157 PolarHBondContact OG1-OD1 2.85Å; D157-D159 PolarHBondContact O-N 3.03Å; D157-D159 PolarHBondContact OD1-N 2.74Å; D157-K162 WeakPolarHBondContact OD2-CE 3.36Å; D157-K162 IonicContact OD2-NZ 3.57Å; D157-K162 PolarHBondContact OD2-NZ 2.7Å
158	R	97.9	Very high	98.1	Very high	166 Å²	166	37.1 Å²	37.1	63%	0.626	17%	0.174	S	C	*	.			trans	57	26.5	-179.9	-52.4	173.4	73.7	-178.7	4.3	113.6	T155 S156 R160	T155-R158 WeakPolarHBondContact O-CA 3.38Å; T155-R158 PolarHBondContact O-N 3.36Å; S156-R158 VanDerWaalsContact C-N 3.26Å; R158-R160 PolarHBondContact O-N 3.11Å
159	D	97.9	Very high	98.1	Very high	51 Å²	51	37.6 Å²	37.6	27%	0.273	18%	0.177	S	C	.	.			trans	-76	105.5	175.4	-179.7	6.3	0	0	0	111.3	T155 D157 N161 K162 Y163	T155-D159 PolarHBondContact OG1-N 3.22Å; D157-D159 PolarHBondContact O-N 3.03Å; D157-D159 PolarHBondContact OD1-N 2.74Å; D159-N161 PolarHBondContact O-N 2.61Å; D159-N161 WeakPolarHBondContact OD1-CB 3.43Å; D159-N161 PolarHBondContact OD1-N 3.19Å; D159-N161 PolarHBondContact OD1-ND2 3.08Å; D159-N161 VanDerWaalsContact OD1-ND2 3.08Å; D159-K162 HydrophobicContact CB-CD 4.14Å; D159-K162 HydrophobicContact CB-CG 4.15Å; D159-K162 WeakPolarHBondContact O-CB 3.49Å; D159-K162 PolarHBondContact O-N 3.25Å; D159-K162 IonicContact OD2-NZ 2.74Å; D159-K162 PolarHBondContact OD2-NZ 2.95Å; D159-Y163 WeakPolarHBondContact O-CD1 3.4Å; D159-Y163 WeakPolarHBondContact O-CE1 3.36Å
160	R	97	Very high	98.1	Very high	154 Å²	154	37.5 Å²	37.5	58%	0.581	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-62.8	-23.7	-177.6	-60.9	178.5	-177.3	174.9	-0.3	113.4	R158 K162 Y163 K183	R158-R160 PolarHBondContact O-N 3.11Å; R160-K162 PolarHBondContact O-N 2.77Å; R160-Y163 HydrophobicContact CB-CD2 4.41Å; R160-Y163 HydrophobicContact CB-CE2 4.31Å; R160-Y163 HydrophobicContact CG-CD2 4.47Å; R160-Y163 HydrophobicContact CG-CE2 3.92Å; R160-Y163 PolarHBondContact O-N 2.77Å; R160-K183 WeakPolarHBondContact CD-O 3.33Å
161	N	97.3	Very high	97.9	Very high	147 Å²	147	38.9 Å²	38.9	79%	0.786	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-66.5	-21.2	177.3	-59.6	-50.6	0	0	0	111.8	D159	D159-N161 PolarHBondContact O-N 2.61Å; D159-N161 WeakPolarHBondContact OD1-CB 3.43Å; D159-N161 PolarHBondContact OD1-N 3.19Å; D159-N161 PolarHBondContact OD1-ND2 3.08Å; D159-N161 VanDerWaalsContact OD1-ND2 3.08Å
162	K	98.3	Very high	97.4	Very high	37 Å²	37	43.3 Å²	43.3	16%	0.161	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-80.9	-17.1	177.5	-62.3	-175.1	176.2	84	0	113	W122 T155 D157 D159 R160 G164 L165 L166	W122-K162 HydrophobicContact CD2-CD 3.95Å; W122-K162 HydrophobicContact CG-CD 4.16Å; W122-K162 HydrophobicContact CH2-CB 3.98Å; W122-K162 HydrophobicContact CZ2-CB 3.67Å; W122-K162 HydrophobicContact CZ2-CD 4.15Å; W122-K162 HydrophobicContact CZ2-CG 3.93Å; T155-K162 HydrophobicContact CG2-CB 3.96Å; T155-K162 HydrophobicContact CG2-CD 4.07Å; D157-K162 WeakPolarHBondContact OD2-CE 3.36Å; D157-K162 IonicContact OD2-NZ 3.57Å; D157-K162 PolarHBondContact OD2-NZ 2.7Å; D159-K162 HydrophobicContact CB-CD 4.14Å; D159-K162 HydrophobicContact CB-CG 4.15Å; D159-K162 WeakPolarHBondContact O-CB 3.49Å; D159-K162 PolarHBondContact O-N 3.25Å; D159-K162 IonicContact OD2-NZ 2.74Å; D159-K162 PolarHBondContact OD2-NZ 2.95Å; R160-K162 PolarHBondContact O-N 2.77Å; K162-G164 PolarHBondContact O-N 3.1Å; K162-L165 CarbonylContact O-C 3.59Å; K162-L165 PolarHBondContact O-N 2.96Å; K162-L165 VanDerWaalsContact O-N 3.09Å; K162-L166 WeakPolarHBondContact O-CB 3.19Å; K162-L166 PolarHBondContact O-N 3.38Å
163	Y	98.5	Very high	96.8	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.02	21%	0.205	C	C	.	.	H	α-helix	trans	-68.6	-34.9	-165.9	-68.9	3.2	0	0	0	113.7	T154 D159 R160 L165 L166 A167 Y180 A184 V186	T154-Y163 HydrophobicContact CG2-CE1 4.4Å; T154-Y163 HydrophobicContact CG2-CE2 4.15Å; T154-Y163 WeakPolarHBondContact CG2-OH 3.5Å; D159-Y163 WeakPolarHBondContact O-CD1 3.4Å; D159-Y163 WeakPolarHBondContact O-CE1 3.36Å; R160-Y163 HydrophobicContact CB-CD2 4.41Å; R160-Y163 HydrophobicContact CB-CE2 4.31Å; R160-Y163 HydrophobicContact CG-CD2 4.47Å; R160-Y163 HydrophobicContact CG-CE2 3.92Å; R160-Y163 PolarHBondContact O-N 2.77Å; Y163-L165 VanDerWaalsContact C-N 3.29Å; Y163-L165 PolarHBondContact O-N 2.65Å; Y163-L166 HydrophobicContact CD1-CD2 4.34Å; Y163-L166 WeakPolarHBondContact O-CB 3.43Å; Y163-L166 PolarHBondContact O-N 2.79Å; Y163-A167 WeakPolarHBondContact O-CB 3.25Å; Y163-A167 PolarHBondContact O-N 3.48Å; Y163-Y180 WeakPolarHBondContact CB-OH 3.17Å; Y163-Y180 HydrophobicContact CD2-CE1 4.1Å; Y163-Y180 HydrophobicContact CG-CE1 4.38Å; Y163-A184 VanDerWaalsContact CE2-O 3.27Å; Y163-A184 WeakPolarHBondContact CE2-O 3.25Å; Y163-V186 WeakPolarHBondContact O-CG2 3.39Å
164	G	98.1	Very high	96.1	Very high	10 Å²	10	44.3 Å²	44.3	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-40.4	173	0	0	0	0	0	112	P46 L47 K162 R168	P46-G164 CarbonylContact C-O 3.59Å; P46-G164 VanDerWaalsContact CA-O 3.3Å; P46-G164 WeakPolarHBondContact CA-O 3.39Å; L47-G164 PolarHBondContact N-O 2.93Å; L47-G164 WeakPolarHBondContact O-CA 3.18Å; K162-G164 PolarHBondContact O-N 3.1Å; G164-R168 PolarHBondContact O-N 3.5Å
165	L	98.1	Very high	95.9	Very high	34 Å²	34	44.8 Å²	44.8	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-75.9	-36.1	176.6	-175.3	58.1	0	0	0	111.6	L44 P46 Q121 W122 K162 Y163 A167 R168 L169	L44-L165 HydrophobicContact CB-CD1 3.93Å; L44-L165 HydrophobicContact CD1-CD1 4.41Å; P46-L165 HydrophobicContact CG-CB 4.34Å; P46-L165 HydrophobicContact CG-CD1 4.44Å; Q121-L165 HydrophobicContact CG-CD2 3.99Å; W122-L165 HydrophobicContact CH2-CB 4.17Å; W122-L165 HydrophobicContact CH2-CD2 4.39Å; W122-L165 HydrophobicContact CH2-CG 4.17Å; W122-L165 HydrophobicContact CZ2-CB 3.96Å; W122-L165 HydrophobicContact CZ2-CD2 3.7Å; W122-L165 HydrophobicContact CZ2-CG 3.94Å; K162-L165 CarbonylContact O-C 3.59Å; K162-L165 PolarHBondContact O-N 2.96Å; K162-L165 VanDerWaalsContact O-N 3.09Å; Y163-L165 VanDerWaalsContact C-N 3.29Å; Y163-L165 PolarHBondContact O-N 2.65Å; L165-A167 VanDerWaalsContact C-N 3.3Å; L165-A167 PolarHBondContact O-N 3.41Å; L165-R168 HydrophobicContact CD1-CB 4.38Å; L165-R168 WeakPolarHBondContact O-CB 3.29Å; L165-R168 PolarHBondContact O-N 3.44Å; L165-R168 VanDerWaalsContact O-N 3.1Å; L165-L169 WeakPolarHBondContact O-CG 3.48Å; L165-L169 PolarHBondContact O-N 3.19Å
166	L	98.6	Very high	95.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-45.1	172.8	176.3	64	0	0	0	110.8	L114 V118 W122 L127 I153 T155 K162 Y163 R168 L169 A170 V186	L114-L166 HydrophobicContact CD1-CD1 4.47Å; V118-L166 HydrophobicContact CG2-CD1 3.51Å; W122-L166 HydrophobicContact CH2-CB 4.2Å; L127-L166 HydrophobicContact CD1-CD1 4.03Å; I153-L166 HydrophobicContact CD1-CD1 4.22Å; I153-L166 HydrophobicContact CD1-CD2 4.18Å; I153-L166 HydrophobicContact CD1-CG 4.03Å; I153-L166 HydrophobicContact CG1-CD2 4.2Å; T155-L166 HydrophobicContact CG2-CD2 4.31Å; K162-L166 WeakPolarHBondContact O-CB 3.19Å; K162-L166 PolarHBondContact O-N 3.38Å; Y163-L166 HydrophobicContact CD1-CD2 4.34Å; Y163-L166 WeakPolarHBondContact O-CB 3.43Å; Y163-L166 PolarHBondContact O-N 2.79Å; L166-R168 VanDerWaalsContact C-N 3.32Å; L166-R168 PolarHBondContact O-N 3.46Å; L166-L169 WeakPolarHBondContact O-CB 3.29Å; L166-L169 PolarHBondContact O-N 2.99Å; L166-L169 VanDerWaalsContact O-N 3.16Å; L166-A170 PolarHBondContact O-N 3.42Å; L166-V186 HydrophobicContact CD2-CG2 4.48Å
167	A	98.4	Very high	95.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-40.6	175.5	0	0	0	0	0	111.7	L47 Y163 L165 A170 V171 V178 V186	L47-A167 HydrophobicContact CB-CB 3.95Å; L47-A167 HydrophobicContact CD1-CB 4.44Å; L47-A167 HydrophobicContact CD2-CB 4.05Å; L47-A167 HydrophobicContact CG-CB 4.36Å; Y163-A167 WeakPolarHBondContact O-CB 3.25Å; Y163-A167 PolarHBondContact O-N 3.48Å; L165-A167 VanDerWaalsContact C-N 3.3Å; L165-A167 PolarHBondContact O-N 3.41Å; A167-A170 WeakPolarHBondContact O-CB 3.26Å; A167-A170 PolarHBondContact O-N 3.24Å; A167-V171 WeakPolarHBondContact O-CG2 3.31Å; A167-V171 PolarHBondContact O-N 3.2Å; A167-V171 VanDerWaalsContact O-N 3.08Å; A167-V178 HydrophobicContact CB-CG1 3.97Å; A167-V186 HydrophobicContact CB-CB 4.41Å; A167-V186 HydrophobicContact CB-CG1 3.58Å; A167-V186 HydrophobicContact CB-CG2 3.92Å
168	R	97.8	Very high	95.6	Very high	47 Å²	47	41.2 Å²	41.2	18%	0.177	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-42.8	173.5	173	56.3	62.7	-168.9	-3	111.6	L44 V45 L47 G164 L165 L166 A170 V171 E172	L44-R168 HydrophobicContact CB-CG 3.92Å; L44-R168 HydrophobicContact CD2-CG 3.99Å; V45-R168 PolarHBondContact O-NE 3.14Å; V45-R168 PolarHBondContact O-NH2 3.22Å; L47-R168 HydrophobicContact CD1-CB 4.06Å; G164-R168 PolarHBondContact O-N 3.5Å; L165-R168 HydrophobicContact CD1-CB 4.38Å; L165-R168 WeakPolarHBondContact O-CB 3.29Å; L165-R168 PolarHBondContact O-N 3.44Å; L165-R168 VanDerWaalsContact O-N 3.1Å; L166-R168 VanDerWaalsContact C-N 3.32Å; L166-R168 PolarHBondContact O-N 3.46Å; R168-A170 VanDerWaalsContact C-N 3.27Å; R168-A170 PolarHBondContact O-N 3.18Å; R168-V171 WeakPolarHBondContact O-CB 3.29Å; R168-V171 PolarHBondContact O-N 2.74Å; R168-E172 IonicContact NH1-OE1 3.37Å; R168-E172 WeakPolarHBondContact O-CG 3.46Å; R168-E172 PolarHBondContact O-N 3.3Å
169	L	96.9	Very high	95.6	Very high	10 Å²	10	35.4 Å²	35.4	5%	0.052	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-37.2	175.4	-66.6	177.3	0	0	0	111.7	L44 L114 V118 Q121 W122 L165 L166 V171 E172 A173	L44-L169 HydrophobicContact CD1-CD2 3.82Å; L114-L169 HydrophobicContact CD1-CB 3.6Å; V118-L169 HydrophobicContact CG2-CD1 4.34Å; Q121-L169 HydrophobicContact CB-CD1 3.82Å; Q121-L169 HydrophobicContact CG-CD1 4Å; W122-L169 HydrophobicContact CH2-CD1 4.04Å; W122-L169 HydrophobicContact CZ3-CD1 3.78Å; L165-L169 WeakPolarHBondContact O-CG 3.48Å; L165-L169 PolarHBondContact O-N 3.19Å; L166-L169 WeakPolarHBondContact O-CB 3.29Å; L166-L169 PolarHBondContact O-N 2.99Å; L166-L169 VanDerWaalsContact O-N 3.16Å; L169-V171 VanDerWaalsContact C-N 3.33Å; L169-V171 PolarHBondContact O-N 2.83Å; L169-E172 CarbonylContact O-C 3.57Å; L169-E172 PolarHBondContact O-N 2.99Å; L169-A173 VanDerWaalsContact O-CB 3.32Å; L169-A173 WeakPolarHBondContact O-CB 3.29Å; L169-A173 PolarHBondContact O-N 2.95Å
170	A	97	Very high	95.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.3	-38.8	175.4	0	0	0	0	0	112.1	L114 I153 L166 A167 R168 A173 G174 F175 V178 C188	L114-A170 HydrophobicContact CD1-CB 4.31Å; L114-A170 HydrophobicContact CD2-CB 3.8Å; I153-A170 HydrophobicContact CD1-CB 4.37Å; L166-A170 PolarHBondContact O-N 3.42Å; A167-A170 WeakPolarHBondContact O-CB 3.26Å; A167-A170 PolarHBondContact O-N 3.24Å; R168-A170 VanDerWaalsContact C-N 3.27Å; R168-A170 PolarHBondContact O-N 3.18Å; A170-A173 PolarHBondContact O-N 3.15Å; A170-G174 PolarHBondContact O-N 3.13Å; A170-F175 HydrophobicContact CB-CD2 3.98Å; A170-F175 WeakPolarHBondContact O-CD2 3.44Å; A170-F175 PolarHBondContact O-N 3.1Å; A170-V178 HydrophobicContact CB-CG1 4.14Å; A170-V178 HydrophobicContact CB-CG2 3.84Å; A170-C188 VanDerWaalsContact CB-SG 3.59Å
171	V	94.1	Very high	95.5	Very high	30 Å²	30	29.9 Å²	29.9	18%	0.182	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-47.2	172.4	174.4	0	0	0	0	110.7	L47 A167 R168 L169 A173 G174 V178	L47-V171 HydrophobicContact CD1-CG2 4.37Å; A167-V171 WeakPolarHBondContact O-CG2 3.31Å; A167-V171 PolarHBondContact O-N 3.2Å; A167-V171 VanDerWaalsContact O-N 3.08Å; R168-V171 WeakPolarHBondContact O-CB 3.29Å; R168-V171 PolarHBondContact O-N 2.74Å; L169-V171 VanDerWaalsContact C-N 3.33Å; L169-V171 PolarHBondContact O-N 2.83Å; V171-A173 VanDerWaalsContact C-N 3.31Å; V171-A173 PolarHBondContact O-N 2.8Å; V171-G174 PolarHBondContact O-N 2.76Å; V171-G174 VanDerWaalsContact O-N 3.1Å; V171-V178 HydrophobicContact CG2-CB 3.78Å; V171-V178 HydrophobicContact CG2-CG1 4.29Å; V171-V178 HydrophobicContact CG2-CG2 3.76Å
172	E	88.3	Confident	95.5	Very high	93 Å²	93	24.1 Å²	24.1	44%	0.435	12%	0.124	S	C	.	.	H	α-helix	trans	-69.2	-28	178.9	-60	-58.9	133.8	0	0	113	L44 R168 L169 G174	L44-E172 HydrophobicContact CD2-CG 3.7Å; R168-E172 IonicContact NH1-OE1 3.37Å; R168-E172 WeakPolarHBondContact O-CG 3.46Å; R168-E172 PolarHBondContact O-N 3.3Å; L169-E172 CarbonylContact O-C 3.57Å; L169-E172 PolarHBondContact O-N 2.99Å; E172-G174 PolarHBondContact O-N 3.45Å
173	A	85.9	Confident	95.3	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.041	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-11.1	173.1	0	0	0	0	0	112.6	R110 L114 L169 A170 V171 F175	R110-A173 WeakPolarHBondContact CD-O 3.38Å; L114-A173 HydrophobicContact CB-CB 3.78Å; L114-A173 HydrophobicContact CD1-CB 4.28Å; L169-A173 VanDerWaalsContact O-CB 3.32Å; L169-A173 WeakPolarHBondContact O-CB 3.29Å; L169-A173 PolarHBondContact O-N 2.95Å; A170-A173 PolarHBondContact O-N 3.15Å; V171-A173 VanDerWaalsContact C-N 3.31Å; V171-A173 PolarHBondContact O-N 2.8Å; A173-F175 HydrophobicContact CB-CD2 4.47Å
174	G	84.2	Confident	95.2	Very high	26 Å²	26	31 Å²	31	27%	0.268	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	25	172.7	0	0	0	0	0	114.6	R110 A170 V171 E172	R110-G174 WeakPolarHBondContact CD-O 3.4Å; R110-G174 PolarHBondContact NE-O 3.09Å; A170-G174 PolarHBondContact O-N 3.13Å; V171-G174 PolarHBondContact O-N 2.76Å; V171-G174 VanDerWaalsContact O-N 3.1Å; E172-G174 PolarHBondContact O-N 3.45Å
175	F	94.9	Very high	95.2	Very high	12 Å²	12	32 Å²	32	5%	0.053	17%	0.165	C	C	.	.			trans	-59.6	138.4	163.6	-80.6	-86.6	0	0	0	109.8	R110 L111 L114 V151 A170 A173 W177 V178 C188 V190	R110-F175 HydrophobicContact CB-CD1 4.13Å; R110-F175 HydrophobicContact CB-CD2 3.91Å; R110-F175 HydrophobicContact CB-CE1 3.98Å; R110-F175 HydrophobicContact CB-CE2 3.74Å; R110-F175 HydrophobicContact CB-CG 4.12Å; R110-F175 HydrophobicContact CB-CZ 3.78Å; L111-F175 HydrophobicContact CB-CZ 4.17Å; L111-F175 HydrophobicContact CD1-CZ 4.04Å; L114-F175 HydrophobicContact CB-CE2 4.18Å; L114-F175 HydrophobicContact CD2-CE2 3.86Å; V151-F175 HydrophobicContact CG2-CE1 3.99Å; V151-F175 HydrophobicContact CG2-CZ 4.18Å; A170-F175 HydrophobicContact CB-CD2 3.98Å; A170-F175 WeakPolarHBondContact O-CD2 3.44Å; A170-F175 PolarHBondContact O-N 3.1Å; A173-F175 HydrophobicContact CB-CD2 4.47Å; F175-W177 VanDerWaalsContact C-N 3.3Å; F175-W177 PolarHBondContact O-N 3.32Å; F175-V178 HydrophobicContact CB-CG2 3.65Å; F175-C188 HydrophobicContact CB-CB 4.47Å; F175-C188 HydrophobicContact CD1-CB 3.54Å; F175-C188 HydrophobicContact CD2-CB 4.32Å; F175-C188 HydrophobicContact CE1-CB 3.7Å; F175-C188 HydrophobicContact CE2-CB 4.47Å; F175-C188 HydrophobicContact CG-CB 3.86Å; F175-C188 HydrophobicContact CZ-CB 4.17Å; F175-V190 HydrophobicContact CD1-CG1 3.7Å; F175-V190 HydrophobicContact CE1-CG1 4.09Å
176	D	91.6	Very high	95.2	Very high	21 Å²	21	30.4 Å²	30.4	11%	0.112	16%	0.157	C	C	.	.	S	Bend	trans	-76.2	-23.9	-174	-61.1	-75.1	0	0	0	112	P54 A63 R106 S189 V190 K191	P54-D176 WeakPolarHBondContact CD-O 3.27Å; A63-D176 WeakPolarHBondContact CA-O 3.1Å; R106-D176 IonicContact CZ-OD1 3.37Å; R106-D176 IonicContact CZ-OD2 3.15Å; R106-D176 IonicContact NE-OD1 2.73Å; R106-D176 IonicContact NE-OD2 3.96Å; R106-D176 PolarHBondContact NE-OD2 3.03Å; R106-D176 IonicContact NH2-OD1 3.16Å; R106-D176 PolarHBondContact NH2-OD1 3.07Å; R106-D176 IonicContact NH2-OD2 2.94Å; R106-D176 PolarHBondContact NH2-OD2 3.21Å; R106-D176 VanDerWaalsContact NH2-OD2 3.16Å; D176-S189 PolarHBondContact N-O 3.42Å; D176-S189 VanDerWaalsContact N-O 3.07Å; D176-V190 VanDerWaalsContact OD2-CA 3.23Å; D176-V190 WeakPolarHBondContact OD2-CA 3.4Å; D176-V190 WeakPolarHBondContact OD2-CB 3.39Å; D176-K191 HydrophobicContact CB-CG 3.95Å; D176-K191 WeakPolarHBondContact OD1-CE 3.05Å; D176-K191 PolarHBondContact OD2-N 2.89Å
177	W	97.9	Very high	95.2	Very high	17 Å²	17	30.9 Å²	30.9	6%	0.064	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	135.4	169.9	-163.6	77.8	0	0	0	110.7	F52 S53 V56 E58 A63 S64 F175 Y179 H187 C188 S189	F52-W177 HydrophobicContact CB-CH2 4.19Å; F52-W177 HydrophobicContact CB-CZ2 3.42Å; F52-W177 VanDerWaalsContact CB-CZ2 3.42Å; F52-W177 HydrophobicContact CD1-CZ2 4.27Å; F52-W177 AromaticContact CD2-CZ2 3.93Å; F52-W177 HydrophobicContact CD2-CZ2 3.93Å; F52-W177 AromaticContact CD2-NE1 3.68Å; F52-W177 AromaticContact CG-CZ2 3.62Å; F52-W177 HydrophobicContact CG-CZ2 3.62Å; S53-W177 WeakPolarHBondContact O-CA 3.12Å; V56-W177 PolarHBondContact O-NE1 2.87Å; E58-W177 HydrophobicContact CB-CD2 3.66Å; E58-W177 HydrophobicContact CB-CE3 3.73Å; E58-W177 HydrophobicContact CB-CG 4.2Å; E58-W177 HydrophobicContact CB-CH2 4.04Å; E58-W177 HydrophobicContact CB-CZ2 4.01Å; E58-W177 HydrophobicContact CB-CZ3 3.9Å; E58-W177 HydrophobicContact CG-CB 4.39Å; E58-W177 HydrophobicContact CG-CD2 3.81Å; E58-W177 HydrophobicContact CG-CE3 3.59Å; E58-W177 HydrophobicContact CG-CG 4.18Å; E58-W177 HydrophobicContact CG-CZ3 4.04Å; A63-W177 HydrophobicContact CB-CB 4.07Å; A63-W177 VanDerWaalsContact CB-CD1 3.47Å; A63-W177 HydrophobicContact CB-CG 4.02Å; S64-W177 VanDerWaalsContact OG-CB 3.25Å; S64-W177 WeakPolarHBondContact OG-CB 3.21Å; F175-W177 VanDerWaalsContact C-N 3.3Å; F175-W177 PolarHBondContact O-N 3.32Å; W177-Y179 AromaticContact CH2-CD1 3.56Å; W177-Y179 HydrophobicContact CH2-CD1 3.56Å; W177-Y179 HydrophobicContact CH2-CD2 4.38Å; W177-Y179 HydrophobicContact CH2-CE1 4.44Å; W177-Y179 AromaticContact CH2-CG 3.52Å; W177-Y179 HydrophobicContact CH2-CG 3.52Å; W177-Y179 HydrophobicContact CZ2-CG 4.27Å; W177-Y179 AromaticContact CZ3-CD1 3.89Å; W177-Y179 HydrophobicContact CZ3-CD1 3.89Å; W177-Y179 AromaticContact CZ3-CG 3.91Å; W177-Y179 HydrophobicContact CZ3-CG 3.91Å; W177-H187 AromaticContact CE3-CD2 3.81Å; W177-H187 AromaticContact CZ3-CD2 3.58Å; W177-C188 WeakPolarHBondContact O-CA 3.26Å; W177-S189 PolarHBondContact N-O 3.38Å; W177-S189 VanDerWaalsContact N-O 3.15Å; W177-S189 PolarHBondContact O-N 3.06Å
178	V	98.6	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132	177.8	179.5	0	0	0	0	108.8	L47 F52 S53 A167 A170 V171 F175 V186 H187	L47-V178 HydrophobicContact CD2-CG1 4.26Å; F52-V178 CarbonylContact C-O 3.54Å; F52-V178 WeakPolarHBondContact CA-O 3.37Å; F52-V178 WeakPolarHBondContact CB-O 3.41Å; S53-V178 PolarHBondContact N-O 2.65Å; S53-V178 PolarHBondContact O-N 2.9Å; A167-V178 HydrophobicContact CB-CG1 3.97Å; A170-V178 HydrophobicContact CB-CG1 4.14Å; A170-V178 HydrophobicContact CB-CG2 3.84Å; V171-V178 HydrophobicContact CG2-CB 3.78Å; V171-V178 HydrophobicContact CG2-CG1 4.29Å; V171-V178 HydrophobicContact CG2-CG2 3.76Å; F175-V178 HydrophobicContact CB-CG2 3.65Å; V178-V186 HydrophobicContact CG1-CG1 3.72Å; V178-H187 WeakPolarHBondContact CA-O 3.27Å
179	Y	98.5	Very high	95.2	Very high	45 Å²	45	28.6 Å²	28.6	18%	0.176	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.3	-178.5	173.2	-141.8	0	0	0	110.7	K50 F52 W177 E181 H187	K50-Y179 HydrophobicContact CB-CE2 4.49Å; K50-Y179 HydrophobicContact CD-CE2 4.19Å; K50-Y179 VanDerWaalsContact CD-OH 3.29Å; K50-Y179 WeakPolarHBondContact CD-OH 3.49Å; K50-Y179 PolarHBondContact NZ-OH 3.48Å; F52-Y179 HydrophobicContact CB-CD2 3.84Å; F52-Y179 HydrophobicContact CB-CG 4.19Å; F52-Y179 HydrophobicContact CD1-CD2 4.1Å; F52-Y179 HydrophobicContact CD1-CE2 4.29Å; F52-Y179 HydrophobicContact CG-CD2 4.46Å; W177-Y179 AromaticContact CH2-CD1 3.56Å; W177-Y179 HydrophobicContact CH2-CD1 3.56Å; W177-Y179 HydrophobicContact CH2-CD2 4.38Å; W177-Y179 HydrophobicContact CH2-CE1 4.44Å; W177-Y179 AromaticContact CH2-CG 3.52Å; W177-Y179 HydrophobicContact CH2-CG 3.52Å; W177-Y179 HydrophobicContact CZ2-CG 4.27Å; W177-Y179 AromaticContact CZ3-CD1 3.89Å; W177-Y179 HydrophobicContact CZ3-CD1 3.89Å; W177-Y179 AromaticContact CZ3-CG 3.91Å; W177-Y179 HydrophobicContact CZ3-CG 3.91Å; Y179-E181 HydrophobicContact CD1-CB 3.47Å; Y179-E181 VanDerWaalsContact CD1-CB 3.47Å; Y179-E181 HydrophobicContact CD1-CG 3.93Å; Y179-E181 VanDerWaalsContact CE1-CA 3.49Å; Y179-E181 HydrophobicContact CE1-CB 3.49Å; Y179-E181 VanDerWaalsContact CE1-CB 3.49Å; Y179-E181 HydrophobicContact CE1-CG 3.51Å; Y179-E181 HydrophobicContact CG-CB 4.13Å; Y179-E181 PolarHBondContact O-N 3.27Å; Y179-H187 HydrophobicContact CD1-CB 4.49Å; Y179-H187 PolarHBondContact N-O 3.49Å; Y179-H187 PolarHBondContact O-N 3.11Å
180	Y	98.2	Very high	95.1	Very high	24 Å²	24	28.1 Å²	28.1	9%	0.094	15%	0.148	C	C	.	.			trans	-78.1	73.2	170.7	-166.4	12.7	0	0	0	109.8	A48 Y49 K50 Q51 Y163 S182 V186	A48-Y180 WeakPolarHBondContact O-CD2 3.29Å; Y49-Y180 VanDerWaalsContact CA-CD2 3.49Å; K50-Y180 WeakPolarHBondContact CA-O 3.44Å; K50-Y180 PolarHBondContact N-O 3.08Å; Q51-Y180 PolarHBondContact O-N 2.83Å; Y163-Y180 WeakPolarHBondContact CB-OH 3.17Å; Y163-Y180 HydrophobicContact CD2-CE1 4.1Å; Y163-Y180 HydrophobicContact CG-CE1 4.38Å; Y180-S182 WeakPolarHBondContact CD1-O 3.45Å; Y180-S182 WeakPolarHBondContact CE1-O 3.46Å; Y180-V186 HydrophobicContact CD1-CG2 3.82Å; Y180-V186 HydrophobicContact CE1-CG2 4.22Å
181	E	94.9	Very high	94.7	Very high	65 Å²	65	28.8 Å²	28.8	30%	0.304	15%	0.151	S	C	.	.			trans	-64.9	-48.8	-166.5	178.1	170.4	-137.3	0	0	112.9	K50 Y179 H185 H187	K50-E181 WeakPolarHBondContact CD-O 3.41Å; K50-E181 VanDerWaalsContact CE-O 3.29Å; K50-E181 WeakPolarHBondContact CE-O 3.43Å; K50-E181 PolarHBondContact NZ-O 2.92Å; Y179-E181 HydrophobicContact CD1-CB 3.47Å; Y179-E181 VanDerWaalsContact CD1-CB 3.47Å; Y179-E181 HydrophobicContact CD1-CG 3.93Å; Y179-E181 VanDerWaalsContact CE1-CA 3.49Å; Y179-E181 HydrophobicContact CE1-CB 3.49Å; Y179-E181 VanDerWaalsContact CE1-CB 3.49Å; Y179-E181 HydrophobicContact CE1-CG 3.51Å; Y179-E181 HydrophobicContact CG-CB 4.13Å; Y179-E181 PolarHBondContact O-N 3.27Å; E181-H185 IonicContact OE2-CD2 3.69Å; E181-H185 IonicContact OE2-CE1 3.43Å; E181-H185 IonicContact OE2-NE2 3.1Å; E181-H185 PolarHBondContact OE2-NE2 2.81Å; E181-H187 HydrophobicContact CB-CB 4.05Å
182	S	96	Very high	94.1	Very high	25 Å²	25	27.5 Å²	27.5	18%	0.175	14%	0.143	C	C	.	.			trans	-134.3	166.9	-171.4	93	0	0	0	0	110.2	Y180 A184 H185	Y180-S182 WeakPolarHBondContact CD1-O 3.45Å; Y180-S182 WeakPolarHBondContact CE1-O 3.46Å; S182-A184 PolarHBondContact O-N 2.88Å; S182-A184 WeakPolarHBondContact OG-CA 3.28Å; S182-A184 WeakPolarHBondContact OG-CB 3.41Å; S182-A184 PolarHBondContact OG-N 3.1Å; S182-H185 PolarHBondContact N-O 3.22Å; S182-H185 PolarHBondContact OG-CE1 3.2Å; S182-H185 PolarHBondContact OG-N 2.91Å; S182-H185 VanDerWaalsContact OG-N 3.09Å; S182-H185 PolarHBondContact OG-ND1 3Å
183	K	94.8	Very high	92.9	Very high	136 Å²	136	25.3 Å²	25.3	59%	0.591	13%	0.133	S	C	*	.	S	Bend	trans	-72.3	-9.3	170.8	-68.2	-175.1	178.7	179.3	0	112.2	Y49 R160	Y49-K183 HydrophobicContact CD2-CG 4.41Å; Y49-K183 HydrophobicContact CE2-CG 4.03Å; R160-K183 WeakPolarHBondContact CD-O 3.33Å
184	A	96.2	Very high	91.5	Very high	52 Å²	52	27 Å²	27	43%	0.43	14%	0.14	S	C	.	.	S	Bend	trans	-98.5	-22.9	-175.6	0	0	0	0	0	113.1	T154 Y163 S182	T154-A184 WeakPolarHBondContact CG2-O 3.38Å; Y163-A184 VanDerWaalsContact CE2-O 3.27Å; Y163-A184 WeakPolarHBondContact CE2-O 3.25Å; S182-A184 PolarHBondContact O-N 2.88Å; S182-A184 WeakPolarHBondContact OG-CA 3.28Å; S182-A184 WeakPolarHBondContact OG-CB 3.41Å; S182-A184 PolarHBondContact OG-N 3.1Å
185	H	98.1	Very high	89.8	Confident	30 Å²	30	27 Å²	27	14%	0.139	14%	0.136	C	C	.	.			trans	-161.1	166.5	-177.2	65.3	-87.7	0	0	0	112.7	D152 I153 T154 E181 S182	D152-H185 HydrophobicContact CB-CB 4.18Å; D152-H185 VanDerWaalsContact CB-CD2 3.42Å; D152-H185 WeakPolarHBondContact CB-CD2 3.35Å; D152-H185 VanDerWaalsContact CG-NE2 3.26Å; D152-H185 IonicContact OD1-CD2 3.03Å; D152-H185 PolarHBondContact OD1-CD2 3.22Å; D152-H185 VanDerWaalsContact OD1-CD2 3.29Å; D152-H185 IonicContact OD1-NE2 3.2Å; D152-H185 PolarHBondContact OD1-NE2 3.26Å; D152-H185 IonicContact OD2-CD2 3.35Å; D152-H185 PolarHBondContact OD2-CD2 2.98Å; D152-H185 IonicContact OD2-CE1 3.74Å; D152-H185 IonicContact OD2-NE2 3.64Å; D152-H185 PolarHBondContact OD2-NE2 2.67Å; D152-H185 VanDerWaalsContact OD2-NE2 3.1Å; I153-H185 WeakPolarHBondContact O-CA 3.5Å; T154-H185 HydrophobicContact CG2-CB 4.09Å; E181-H185 IonicContact OE2-CD2 3.69Å; E181-H185 IonicContact OE2-CE1 3.43Å; E181-H185 IonicContact OE2-NE2 3.1Å; E181-H185 PolarHBondContact OE2-NE2 2.81Å; S182-H185 PolarHBondContact N-O 3.22Å; S182-H185 PolarHBondContact OG-CE1 3.2Å; S182-H185 PolarHBondContact OG-N 2.91Å; S182-H185 VanDerWaalsContact OG-N 3.09Å; S182-H185 PolarHBondContact OG-ND1 3Å
186	V	98.6	Very high	87.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	129.8	168	179.3	0	0	0	0	107.7	D152 I153 Y163 L166 A167 V178 Y180	D152-V186 WeakPolarHBondContact CA-O 3.42Å; I153-V186 HydrophobicContact CG1-CB 3.96Å; I153-V186 VanDerWaalsContact CG1-O 3.28Å; I153-V186 WeakPolarHBondContact CG1-O 3.38Å; I153-V186 PolarHBondContact N-O 3.39Å; I153-V186 PolarHBondContact O-N 3.36Å; Y163-V186 WeakPolarHBondContact O-CG2 3.39Å; L166-V186 HydrophobicContact CD2-CG2 4.48Å; A167-V186 HydrophobicContact CB-CB 4.41Å; A167-V186 HydrophobicContact CB-CG1 3.58Å; A167-V186 HydrophobicContact CB-CG2 3.92Å; V178-V186 HydrophobicContact CG1-CG1 3.72Å; Y180-V186 HydrophobicContact CD1-CG2 3.82Å; Y180-V186 HydrophobicContact CE1-CG2 4.22Å
187	H	98.7	Very high	84.7	Confident	10 Å²	10	26.6 Å²	26.6	5%	0.046	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133	174.5	179.2	89.9	0	0	0	109.9	E58 H145 D152 W177 V178 Y179 E181	E58-H187 IonicContact OE1-NE2 2.74Å; E58-H187 PolarHBondContact OE1-NE2 3.42Å; E58-H187 VanDerWaalsContact OE1-NE2 3.11Å; H145-H187 AromaticContact CD2-CE1 3.66Å; H145-H187 AromaticContact NE2-CE1 3.19Å; H145-H187 PolarHBondContact NE2-CE1 3.03Å; H145-H187 AromaticContact NE2-ND1 3.22Å; H145-H187 PolarHBondContact NE2-ND1 3.41Å; D152-H187 WeakPolarHBondContact OD1-CA 3.34Å; D152-H187 WeakPolarHBondContact OD1-CB 3.14Å; D152-H187 IonicContact OD1-CG 3.84Å; D152-H187 IonicContact OD1-ND1 2.72Å; D152-H187 PolarHBondContact OD1-ND1 3.02Å; W177-H187 AromaticContact CE3-CD2 3.81Å; W177-H187 AromaticContact CZ3-CD2 3.58Å; V178-H187 WeakPolarHBondContact CA-O 3.27Å; Y179-H187 HydrophobicContact CD1-CB 4.49Å; Y179-H187 PolarHBondContact N-O 3.49Å; Y179-H187 PolarHBondContact O-N 3.11Å; E181-H187 HydrophobicContact CB-CB 4.05Å
188	C	98.7	Very high	81.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134	178.1	-62.3	0	0	0	0	109.6	A150 V151 A170 F175 W177	A150-C188 CarbonylContact C-O 3.59Å; A150-C188 VanDerWaalsContact CA-O 3.25Å; A150-C188 WeakPolarHBondContact CA-O 3.43Å; V151-C188 HydrophobicContact CG2-CB 3.95Å; V151-C188 PolarHBondContact N-O 2.82Å; V151-C188 PolarHBondContact O-N 2.93Å; A170-C188 VanDerWaalsContact CB-SG 3.59Å; F175-C188 HydrophobicContact CB-CB 4.47Å; F175-C188 HydrophobicContact CD1-CB 3.54Å; F175-C188 HydrophobicContact CD2-CB 4.32Å; F175-C188 HydrophobicContact CE1-CB 3.7Å; F175-C188 HydrophobicContact CE2-CB 4.47Å; F175-C188 HydrophobicContact CG-CB 3.86Å; F175-C188 HydrophobicContact CZ-CB 4.17Å; W177-C188 WeakPolarHBondContact O-CA 3.26Å
189	S	98.3	Very high	79.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	162.6	178.3	65.4	0	0	0	0	113.3	E58 S64 R149 D176 W177	E58-S189 WeakPolarHBondContact OE1-CB 3.37Å; E58-S189 PolarHBondContact OE1-OG 3.49Å; S64-S189 WeakPolarHBondContact CB-OG 3.21Å; S64-S189 VanDerWaalsContact OG-C 3.23Å; S64-S189 PolarHBondContact OG-O 3.09Å; S64-S189 PolarHBondContact OG-OG 2.87Å; R149-S189 CarbonylContact O-C 3.5Å; R149-S189 WeakPolarHBondContact O-CA 3.32Å; R149-S189 WeakPolarHBondContact O-CB 3.5Å; D176-S189 PolarHBondContact N-O 3.42Å; D176-S189 VanDerWaalsContact N-O 3.07Å; W177-S189 PolarHBondContact N-O 3.38Å; W177-S189 VanDerWaalsContact N-O 3.15Å; W177-S189 PolarHBondContact O-N 3.06Å
190	V	94.6	Very high	76.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.			trans	-127.6	157.6	-176.9	-59.5	0	0	0	0	112.3	R106 C107 R110 R149 F175 D176	R106-V190 HydrophobicContact CB-CG2 4.42Å; R106-V190 HydrophobicContact CG-CB 4.02Å; R106-V190 HydrophobicContact CG-CG1 4.29Å; R106-V190 HydrophobicContact CG-CG2 4.23Å; C107-V190 HydrophobicContact CB-CG1 4.46Å; C107-V190 HydrophobicContact CB-CG2 3.71Å; R110-V190 HydrophobicContact CB-CG1 4.44Å; R110-V190 HydrophobicContact CG-CG1 4.03Å; R149-V190 HydrophobicContact CB-CG2 4.22Å; R149-V190 HydrophobicContact CG-CG2 4.42Å; R149-V190 PolarHBondContact NE-O 2.93Å; R149-V190 VanDerWaalsContact NE-O 3.08Å; R149-V190 PolarHBondContact NH2-O 2.81Å; R149-V190 WeakPolarHBondContact O-CG2 3.38Å; R149-V190 PolarHBondContact O-N 2.97Å; F175-V190 HydrophobicContact CD1-CG1 3.7Å; F175-V190 HydrophobicContact CE1-CG1 4.09Å; D176-V190 VanDerWaalsContact OD2-CA 3.23Å; D176-V190 WeakPolarHBondContact OD2-CA 3.4Å; D176-V190 WeakPolarHBondContact OD2-CB 3.39Å
191	K	87.1	Confident	75	Confident	14 Å²	14	28.9 Å²	28.9	6%	0.061	16%	0.162	C	C	.	.			trans	-60.9	148.5	168.3	-65.9	176.6	-163	-69	0	111.5	L61 A63 S64 R106 D176 S195 A197	L61-K191 PolarHBondContact O-NZ 3.17Å; A63-K191 WeakPolarHBondContact O-CE 3.19Å; A63-K191 WeakPolarHBondContact O-CG 3.36Å; A63-K191 PolarHBondContact O-NZ 3.01Å; S64-K191 VanDerWaalsContact O-CA 3.24Å; S64-K191 WeakPolarHBondContact O-CA 3.27Å; R106-K191 VanDerWaalsContact CD-O 3.27Å; R106-K191 WeakPolarHBondContact CD-O 3.24Å; D176-K191 HydrophobicContact CB-CG 3.95Å; D176-K191 WeakPolarHBondContact OD1-CE 3.05Å; D176-K191 PolarHBondContact OD2-N 2.89Å; K191-S195 WeakPolarHBondContact CB-OG 3.43Å; K191-A197 HydrophobicContact CD-CB 3.62Å
192	S	81.3	Confident	74.1	Confident	3 Å²	3	25.9 Å²	25.9	2%	0.021	15%	0.149	C	C	.	.			trans	-60.9	148.1	170.9	175.9	0	0	0	0	110.5	E68 H194 S195	E68-S192 VanDerWaalsContact CD-CB 3.45Å; E68-S192 WeakPolarHBondContact OE1-CB 3.3Å; E68-S192 PolarHBondContact OE1-OG 2.98Å; E68-S192 WeakPolarHBondContact OE2-CB 3.47Å; E68-S192 PolarHBondContact OE2-OG 2.96Å; S192-H194 PolarHBondContact O-N 3.28Å; S192-H194 VanDerWaalsContact O-N 3.15Å; S192-H194 WeakPolarHBondContact OG-CB 3.22Å; S192-H194 PolarHBondContact OG-CD2 3.26Å; S192-H194 PolarHBondContact OG-N 2.86Å; S192-S195 WeakPolarHBondContact O-CB 3.49Å; S192-S195 PolarHBondContact O-N 3.33Å; S192-S195 PolarHBondContact O-OG 2.82Å
193	E	64.6	Low	73.8	Confident	47 Å²	47	24.7 Å²	24.7	22%	0.22	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.3	165.9	-62.6	-60.3	156.6	0	0	112.3	R106	R106-E193 WeakPolarHBondContact CB-OE1 3.36Å; R106-E193 PolarHBondContact N-OE1 2.9Å
194	H	56	Low	73.8	Confident	41 Å²	41	18.3 Å²	18.3	19%	0.19	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-13.5	177.9	-54.8	-114.1	0	0	0	111.9	E68 E80 S192 A196 R253	E68-H194 IonicContact OE2-CD2 3.36Å; E68-H194 IonicContact OE2-CG 2.78Å; E80-H194 IonicContact OE1-CE1 3.84Å; E80-H194 PolarHBondContact OE1-CE1 3.32Å; E80-H194 IonicContact OE1-NE2 3.88Å; E80-H194 PolarHBondContact OE1-NE2 3.09Å; E80-H194 IonicContact OE2-NE2 3.72Å; E80-H194 PolarHBondContact OE2-NE2 2.86Å; S192-H194 PolarHBondContact O-N 3.28Å; S192-H194 VanDerWaalsContact O-N 3.15Å; S192-H194 WeakPolarHBondContact OG-CB 3.22Å; S192-H194 PolarHBondContact OG-CD2 3.26Å; S192-H194 PolarHBondContact OG-N 2.86Å; H194-A196 PolarHBondContact O-N 2.82Å; H194-R253 PolarHBondContact CD2-NH2 3.38Å; H194-R253 PolarHBondContact CE1-NH2 3.29Å; H194-R253 PolarHBondContact ND1-NE 3.47Å; H194-R253 VanDerWaalsContact ND1-NE 3.12Å; H194-R253 PolarHBondContact ND1-NH2 2.91Å; H194-R253 PolarHBondContact NE2-NH2 3.4Å
195	S	48.3	Very low	73.8	Confident	25 Å²	25	16.4 Å²	16.4	18%	0.175	10%	0.096	C	C	.	.	S	Bend	trans	-59.4	134.7	174.4	72.6	0	0	0	0	108.3	K191 S192 A197 A198	K191-S195 WeakPolarHBondContact CB-OG 3.43Å; S192-S195 WeakPolarHBondContact O-CB 3.49Å; S192-S195 PolarHBondContact O-N 3.33Å; S192-S195 PolarHBondContact O-OG 2.82Å; S195-A197 PolarHBondContact O-N 2.84Å; S195-A198 PolarHBondContact O-N 2.84Å
196	A	41.8	Very low	73.6	Confident	22 Å²	22	15.7 Å²	15.7	18%	0.182	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-12.4	177.3	0	0	0	0	0	113.3	H194 T200 P273	H194-A196 PolarHBondContact O-N 2.82Å; A196-T200 WeakPolarHBondContact O-CG2 3.4Å; A196-P273 HydrophobicContact CB-CG 4.48Å
197	A	37.7	Very low	73.5	Confident	2 Å²	2	18.3 Å²	18.3	2%	0.017	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-30.1	175.4	0	0	0	0	0	116.3	K191 S195 L404	K191-A197 HydrophobicContact CD-CB 3.62Å; S195-A197 PolarHBondContact O-N 2.84Å; A197-L404 CarbonylContact C-O 3.5Å; A197-L404 WeakPolarHBondContact CA-O 3.47Å; A197-L404 HydrophobicContact CB-CB 3.67Å; A197-L404 HydrophobicContact CB-CD2 3.92Å; A197-L404 HydrophobicContact CB-CG 4.33Å; A197-L404 WeakPolarHBondContact CB-O 3.27Å
198	A	38.8	Very low	73.4	Confident	24 Å²	24	18 Å²	18	20%	0.198	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-21.4	-177.8	0	0	0	0	0	112.5	S195	S195-A198 PolarHBondContact O-N 2.84Å
199	K	45.5	Very low	73.3	Confident	60 Å²	60	21.8 Å²	21.8	26%	0.261	14%	0.139	S	C	.	.	S	Bend	trans	-130.7	51.5	-174.4	-67.6	-174.9	173.3	-135.1	0	112.1	G201 E250	K199-G201 PolarHBondContact O-N 2.82Å; K199-E250 WeakPolarHBondContact CD-OE1 3.5Å; K199-E250 IonicContact NZ-OE1 3.45Å; K199-E250 PolarHBondContact NZ-OE1 3.34Å
200	T	44.8	Very low	73.3	Confident	31 Å²	31	22 Å²	22	19%	0.19	14%	0.14	C	C	.	.			trans	-71.9	71.6	-173.9	40.9	0	0	0	0	113.9	A196 A274 L404 G405	A196-T200 WeakPolarHBondContact O-CG2 3.4Å; T200-A274 HydrophobicContact CG2-CB 4.02Å; T200-L404 HydrophobicContact CG2-CB 4.34Å; T200-G405 WeakPolarHBondContact OG1-CA 3.46Å
201	G	59.5	Low	73.4	Confident	19 Å²	19	26.2 Å²	26.2	20%	0.196	16%	0.156	C	C	.	.	S	Bend	trans	-94.5	144.7	142.6	0	0	0	0	0	109.4	K199 C203 T272	K199-G201 PolarHBondContact O-N 2.82Å; G201-C203 PolarHBondContact O-N 3.5Å; G201-C203 PolarHBondContact O-SG 2.88Å; G201-T272 PolarHBondContact O-OG1 3.24Å
202	G	75.8	Confident	73.8	Confident	3 Å²	3	26.9 Å²	26.9	3%	0.031	16%	0.16	C	C	.	.			trans	-68.7	116.1	169.2	0	0	0	0	0	107.6	T272 H275 A330	G202-T272 WeakPolarHBondContact CA-OG1 3.48Å; G202-H275 WeakPolarHBondContact CA-ND1 3.5Å; G202-H275 PolarHBondContact O-CE1 3.01Å; G202-H275 VanDerWaalsContact O-CE1 3.26Å; G202-A330 WeakPolarHBondContact O-CB 3.46Å
203	C	90.8	Very high	74.5	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.			trans	-121.9	156	-177.6	-61.2	0	0	0	0	111.1	G201 L271 T272 H275 A328 Y329	G201-C203 PolarHBondContact O-N 3.5Å; G201-C203 PolarHBondContact O-SG 2.88Å; C203-L271 WeakPolarHBondContact O-CA 3.29Å; C203-T272 HydrophobicContact CB-CG2 3.84Å; C203-T272 PolarHBondContact N-OG1 2.92Å; C203-T272 PolarHBondContact O-N 3.09Å; C203-H275 PolarHBondContact N-ND1 3.15Å; C203-H275 VanDerWaalsContact N-ND1 3.18Å; C203-H275 PolarHBondContact O-ND1 3.07Å; C203-A328 HydrophobicContact CB-CB 3.92Å; C203-Y329 WeakPolarHBondContact CA-O 3.42Å
204	F	94.8	Very high	75.9	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-113.4	157.1	166.2	-55.8	-77.9	0	0	0	109.6	A208 L220 L269 L271 H275 Y329 L338 V340 A345	F204-A208 HydrophobicContact CB-CB 4.12Å; F204-L220 HydrophobicContact CB-CD2 3.53Å; F204-L220 HydrophobicContact CD2-CD2 3.88Å; F204-L220 HydrophobicContact CG-CD2 4.09Å; F204-L269 HydrophobicContact CD1-CD1 4.19Å; F204-L269 HydrophobicContact CE1-CD1 4.03Å; F204-L271 HydrophobicContact CD1-CB 3.88Å; F204-L271 HydrophobicContact CE1-CB 3.86Å; F204-L271 HydrophobicContact CE1-CD1 4.44Å; F204-H275 AromaticContact CD2-CE1 3.72Å; F204-H275 AromaticContact CE1-CE1 3.79Å; F204-H275 AromaticContact CE2-CE1 3.13Å; F204-H275 WeakPolarHBondContact CE2-CE1 3.24Å; F204-H275 AromaticContact CE2-NE2 3.64Å; F204-H275 AromaticContact CZ-CE1 3.15Å; F204-H275 WeakPolarHBondContact CZ-CE1 3.49Å; F204-H275 AromaticContact CZ-ND1 3.83Å; F204-H275 AromaticContact CZ-NE2 3.45Å; F204-H275 WeakPolarHBondContact CZ-NE2 3.49Å; F204-Y329 PolarHBondContact N-O 2.82Å; F204-Y329 PolarHBondContact O-N 2.78Å; F204-L338 HydrophobicContact CE2-CD2 4.32Å; F204-V340 HydrophobicContact CD1-CB 4.26Å; F204-V340 HydrophobicContact CD1-CG1 3.98Å; F204-V340 HydrophobicContact CD1-CG2 4.13Å; F204-V340 HydrophobicContact CD2-CG2 4.14Å; F204-V340 HydrophobicContact CE1-CB 4.12Å; F204-V340 HydrophobicContact CE1-CG1 4.35Å; F204-V340 HydrophobicContact CE1-CG2 3.89Å; F204-V340 HydrophobicContact CE2-CG2 3.86Å; F204-V340 HydrophobicContact CG-CG1 4.31Å; F204-V340 HydrophobicContact CG-CG2 4.26Å; F204-V340 HydrophobicContact CZ-CB 4.46Å; F204-V340 HydrophobicContact CZ-CG2 3.75Å; F204-A345 HydrophobicContact CE1-CB 4.12Å; F204-A345 HydrophobicContact CZ-CB 3.65Å
205	P	95.2	Very high	77.7	Confident	13 Å²	13	34.1 Å²	34.1	8%	0.084	22%	0.218	C	C	.	.			trans	-69.6	158.1	175.5	28	-32.8	0	0	0	112.1	G207 A208 F257 A270 A325 G327	P205-G207 PolarHBondContact O-N 3.29Å; P205-A208 HydrophobicContact CG-CB 4.05Å; P205-A208 VanDerWaalsContact O-CB 3.3Å; P205-A208 WeakPolarHBondContact O-CB 3.32Å; P205-A208 PolarHBondContact O-N 3.24Å; P205-A208 VanDerWaalsContact O-N 3.08Å; P205-F257 HydrophobicContact CB-CD2 4.29Å; P205-F257 HydrophobicContact CB-CE1 4.38Å; P205-F257 HydrophobicContact CB-CE2 3.88Å; P205-F257 HydrophobicContact CB-CZ 3.93Å; P205-A270 WeakPolarHBondContact CD-O 3.17Å; P205-A270 HydrophobicContact CG-CB 4.02Å; P205-A325 HydrophobicContact CB-CB 3.66Å; P205-A325 HydrophobicContact CG-CB 4.45Å; P205-G327 WeakPolarHBondContact CA-O 3.36Å
206	A	94.9	Very high	79.9	Confident	15 Å²	15	35 Å²	35	12%	0.124	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-40.7	-178.9	0	0	0	0	0	113.3	A208 L220 S221 L326 Y329	A206-A208 VanDerWaalsContact C-N 3.31Å; A206-A208 PolarHBondContact O-N 3.38Å; A206-L220 PolarHBondContact O-N 2.48Å; A206-S221 PolarHBondContact O-N 2.86Å; A206-S221 VanDerWaalsContact O-N 3.09Å; A206-S221 PolarHBondContact O-OG 2.9Å; A206-L326 VanDerWaalsContact CB-O 3.25Å; A206-L326 WeakPolarHBondContact CB-O 3.33Å; A206-L326 PolarHBondContact N-O 2.89Å; A206-Y329 HydrophobicContact CB-CD2 4.3Å; A206-Y329 HydrophobicContact CB-CE2 3.71Å
207	G	95.3	Very high	82.5	Confident	54 Å²	54	40.2 Å²	40.2	56%	0.557	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-2	-177	0	0	0	0	0	115	P205	P205-G207 PolarHBondContact O-N 3.29Å
208	A	96.6	Very high	85.4	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.041	25%	0.251	C	S	.	.			trans	-61.2	137.4	177.9	0	0	0	0	0	110.5	F204 P205 A206 A219 L220 V340	F204-A208 HydrophobicContact CB-CB 4.12Å; P205-A208 HydrophobicContact CG-CB 4.05Å; P205-A208 VanDerWaalsContact O-CB 3.3Å; P205-A208 WeakPolarHBondContact O-CB 3.32Å; P205-A208 PolarHBondContact O-N 3.24Å; P205-A208 VanDerWaalsContact O-N 3.08Å; A206-A208 VanDerWaalsContact C-N 3.31Å; A206-A208 PolarHBondContact O-N 3.38Å; A208-A219 CarbonylContact O-C 3.56Å; A208-A219 WeakPolarHBondContact O-CA 3.49Å; A208-L220 HydrophobicContact CB-CB 4.46Å; A208-L220 WeakPolarHBondContact O-CB 3.19Å; A208-L220 PolarHBondContact O-N 2.74Å; A208-V340 HydrophobicContact CB-CG1 3.66Å
209	Q	97.7	Very high	88.1	Confident	78 Å²	78	42.2 Å²	42.2	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.2	-175.7	-60.6	-170.5	17.3	0	0	112.5	V218 V340 E341	Q209-V218 WeakPolarHBondContact CA-O 3.33Å; Q209-V340 WeakPolarHBondContact O-CA 3.49Å; Q209-E341 PolarHBondContact N-OE1 3.17Å; Q209-E341 PolarHBondContact O-N 3.01Å
210	V	97.3	Very high	90.5	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.024	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.1	169.5	-61.3	0	0	0	0	110.4	R217 V218 L220 V223 V229 L338 V340	V210-R217 WeakPolarHBondContact O-CA 3.4Å; V210-V218 HydrophobicContact CG2-CG2 3.78Å; V210-V218 PolarHBondContact N-O 2.87Å; V210-V218 PolarHBondContact O-N 3Å; V210-L220 HydrophobicContact CG1-CD1 3.87Å; V210-L220 HydrophobicContact CG2-CD1 4.48Å; V210-V223 HydrophobicContact CG2-CG2 3.44Å; V210-V223 VanDerWaalsContact CG2-CG2 3.44Å; V210-V229 HydrophobicContact CG2-CG1 4.08Å; V210-L338 HydrophobicContact CG1-CD1 4.23Å; V210-L338 HydrophobicContact CG1-CD2 4.16Å; V210-L338 HydrophobicContact CG1-CG 4.35Å; V210-V340 HydrophobicContact CG1-CG2 4.01Å
211	R	97	Very high	92.9	Very high	90 Å²	90	40.2 Å²	40.2	34%	0.34	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.3	176.7	-167.7	170	73.5	-173.8	2.4	110.5	A216 V229 L230	R211-A216 WeakPolarHBondContact CA-O 3.23Å; R211-V229 CarbonylContact O-C 3.58Å; R211-V229 WeakPolarHBondContact O-CA 3.15Å; R211-L230 HydrophobicContact CB-CB 4.19Å; R211-L230 VanDerWaalsContact NH2-CD2 3.34Å; R211-L230 PolarHBondContact O-N 3.4Å
212	L	96.9	Very high	94.6	Very high	28 Å²	28	42.1 Å²	42.1	15%	0.147	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-79.8	162.2	173.1	-63.5	179	0	0	0	111.4	S214 G215 A216 V218 D227 R228 V229 F240	L212-S214 PolarHBondContact O-N 3.43Å; L212-G215 WeakPolarHBondContact O-CA 3.47Å; L212-G215 PolarHBondContact O-N 3.45Å; L212-A216 HydrophobicContact CD1-CB 4.48Å; L212-A216 PolarHBondContact N-O 3.1Å; L212-V218 HydrophobicContact CD1-CG1 3.72Å; L212-V218 HydrophobicContact CD1-CG2 3.99Å; L212-V218 HydrophobicContact CD2-CG2 4.09Å; L212-V218 HydrophobicContact CG-CG1 4.28Å; L212-V218 HydrophobicContact CG-CG2 3.83Å; L212-D227 HydrophobicContact CD2-CB 4.06Å; L212-R228 CarbonylContact C-O 3.56Å; L212-R228 WeakPolarHBondContact CA-O 3.42Å; L212-V229 HydrophobicContact CD2-CG1 3.87Å; L212-F240 VanDerWaalsContact C-CE1 3.48Å; L212-F240 WeakPolarHBondContact O-CE1 3.38Å
213	E	95.7	Very high	95.5	Very high	95 Å²	95	42 Å²	42	44%	0.444	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.8	173.2	-175.6	170.2	-141.5	0	0	112.9	G215 R228 F240	E213-G215 PolarHBondContact O-N 3.29Å; E213-G215 VanDerWaalsContact O-N 3.13Å; E213-R228 HydrophobicContact CB-CB 4Å; E213-R228 PolarHBondContact N-O 2.82Å; E213-R228 IonicContact OE1-CZ 3.38Å; E213-R228 IonicContact OE1-NH1 3.06Å; E213-R228 PolarHBondContact OE1-NH1 2.87Å; E213-R228 IonicContact OE1-NH2 3.82Å; E213-R228 WeakPolarHBondContact OE2-CD 3.4Å; E213-R228 IonicContact OE2-CZ 3.87Å; E213-R228 IonicContact OE2-NE 3.32Å; E213-R228 IonicContact OE2-NH1 3.42Å; E213-R228 PolarHBondContact OE2-NH1 2.85Å; E213-F240 HydrophobicContact CB-CB 4.3Å; E213-F240 HydrophobicContact CB-CD1 3.79Å; E213-F240 HydrophobicContact CB-CD2 4.29Å; E213-F240 HydrophobicContact CB-CE1 4.18Å; E213-F240 HydrophobicContact CB-CG 3.86Å; E213-F240 HydrophobicContact CG-CB 4.38Å; E213-F240 HydrophobicContact CG-CD1 4.4Å; E213-F240 HydrophobicContact CG-CD2 4Å; E213-F240 HydrophobicContact CG-CE2 4.38Å; E213-F240 HydrophobicContact CG-CG 4.01Å
214	S	94.1	Very high	95.6	Very high	100 Å²	100	50.8 Å²	50.8	70%	0.699	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-8.7	172.6	62.9	0	0	0	0	114.2	L212 A216	L212-S214 PolarHBondContact O-N 3.43Å; S214-A216 VanDerWaalsContact C-N 3.26Å; S214-A216 PolarHBondContact O-N 2.88Å; S214-A216 WeakPolarHBondContact OG-CB 3.12Å; S214-A216 PolarHBondContact OG-N 2.83Å
215	G	92.2	Very high	95.4	Very high	48 Å²	48	53.6 Å²	53.6	50%	0.495	31%	0.313	S	S	.	.	S	Bend	trans	85.4	-9.6	-172.2	0	0	0	0	0	114	L212 E213	L212-G215 WeakPolarHBondContact O-CA 3.47Å; L212-G215 PolarHBondContact O-N 3.45Å; E213-G215 PolarHBondContact O-N 3.29Å; E213-G215 VanDerWaalsContact O-N 3.13Å
216	A	95.4	Very high	95.1	Very high	43 Å²	43	55.6 Å²	55.6	36%	0.355	34%	0.336	S	S	.	.			trans	-65.9	142	177.5	0	0	0	0	0	111.7	R211 L212 S214	R211-A216 WeakPolarHBondContact CA-O 3.23Å; L212-A216 HydrophobicContact CD1-CB 4.48Å; L212-A216 PolarHBondContact N-O 3.1Å; S214-A216 VanDerWaalsContact C-N 3.26Å; S214-A216 PolarHBondContact O-N 2.88Å; S214-A216 WeakPolarHBondContact OG-CB 3.12Å; S214-A216 PolarHBondContact OG-N 2.83Å
217	R	96.7	Very high	95.1	Very high	131 Å²	131	57.2 Å²	57.2	49%	0.494	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.3	168	-76.2	-177.7	152	-173	-4.5	109.5	V210 D342	V210-R217 WeakPolarHBondContact O-CA 3.4Å; R217-D342 IonicContact CZ-OD1 3.13Å; R217-D342 IonicContact CZ-OD2 3.11Å; R217-D342 IonicContact NH2-OD1 3.2Å; R217-D342 PolarHBondContact NH2-OD1 3.18Å; R217-D342 IonicContact NH2-OD2 3.99Å; R217-D342 PolarHBondContact NH2-OD2 2.8Å
218	V	97.4	Very high	95.2	Very high	35 Å²	35	59 Å²	59	21%	0.212	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	148.4	-178.2	-60.2	0	0	0	0	110.4	Q209 V210 L212 V223	Q209-V218 WeakPolarHBondContact CA-O 3.33Å; V210-V218 HydrophobicContact CG2-CG2 3.78Å; V210-V218 PolarHBondContact N-O 2.87Å; V210-V218 PolarHBondContact O-N 3Å; L212-V218 HydrophobicContact CD1-CG1 3.72Å; L212-V218 HydrophobicContact CD1-CG2 3.99Å; L212-V218 HydrophobicContact CD2-CG2 4.09Å; L212-V218 HydrophobicContact CG-CG1 4.28Å; L212-V218 HydrophobicContact CG-CG2 3.83Å; V218-V223 HydrophobicContact CG2-CG2 3.8Å
219	A	97.3	Very high	95.2	Very high	34 Å²	34	58.8 Å²	58.8	28%	0.281	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	145.3	170.5	0	0	0	0	0	110.1	A208 S221 A222 V223	A208-A219 CarbonylContact O-C 3.56Å; A208-A219 WeakPolarHBondContact O-CA 3.49Å; A219-S221 PolarHBondContact O-N 2.68Å; A219-A222 WeakPolarHBondContact O-CB 3.49Å; A219-A222 PolarHBondContact O-N 3.16Å; A219-V223 PolarHBondContact O-N 2.95Å
220	L	95.2	Very high	95.2	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-62.6	-29.3	-177.9	-165.8	60.4	0	0	0	112.1	F204 A206 A208 V210 A222 V223 Y329 P331 L338	F204-L220 HydrophobicContact CB-CD2 3.53Å; F204-L220 HydrophobicContact CD2-CD2 3.88Å; F204-L220 HydrophobicContact CG-CD2 4.09Å; A206-L220 PolarHBondContact O-N 2.48Å; A208-L220 HydrophobicContact CB-CB 4.46Å; A208-L220 WeakPolarHBondContact O-CB 3.19Å; A208-L220 PolarHBondContact O-N 2.74Å; V210-L220 HydrophobicContact CG1-CD1 3.87Å; V210-L220 HydrophobicContact CG2-CD1 4.48Å; L220-A222 PolarHBondContact O-N 2.73Å; L220-V223 HydrophobicContact CD1-CB 4.42Å; L220-V223 HydrophobicContact CD1-CG2 4.06Å; L220-V223 WeakPolarHBondContact O-CB 3.44Å; L220-V223 PolarHBondContact O-N 3.06Å; L220-Y329 HydrophobicContact CG-CG 4.48Å; L220-P331 HydrophobicContact CD1-CG 4.16Å; L220-P331 HydrophobicContact CD2-CG 4.45Å; L220-L338 HydrophobicContact CD1-CD2 4.48Å
221	S	94.8	Very high	95.1	Very high	47 Å²	47	55 Å²	55	33%	0.329	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-62.8	-24.2	172.5	62.5	0	0	0	0	114.3	A206 A219 Y329	A206-S221 PolarHBondContact O-N 2.86Å; A206-S221 VanDerWaalsContact O-N 3.09Å; A206-S221 PolarHBondContact O-OG 2.9Å; A219-S221 PolarHBondContact O-N 2.68Å; S221-Y329 WeakPolarHBondContact CB-OH 3.39Å
222	A	95.5	Very high	94.9	Very high	59 Å²	59	51.5 Å²	51.5	49%	0.488	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-91.4	-13.5	179.6	0	0	0	0	0	113.3	A219 L220	A219-A222 WeakPolarHBondContact O-CB 3.49Å; A219-A222 PolarHBondContact O-N 3.16Å; L220-A222 PolarHBondContact O-N 2.73Å
223	V	94.6	Very high	94.6	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.012	30%	0.299	C	S	.	.			trans	-68.4	136.2	179.7	176.8	0	0	0	0	110.4	V210 V218 A219 L220 D227 V229 V243 F246	V210-V223 HydrophobicContact CG2-CG2 3.44Å; V210-V223 VanDerWaalsContact CG2-CG2 3.44Å; V218-V223 HydrophobicContact CG2-CG2 3.8Å; A219-V223 PolarHBondContact O-N 2.95Å; L220-V223 HydrophobicContact CD1-CB 4.42Å; L220-V223 HydrophobicContact CD1-CG2 4.06Å; L220-V223 WeakPolarHBondContact O-CB 3.44Å; L220-V223 PolarHBondContact O-N 3.06Å; V223-D227 HydrophobicContact CG1-CB 4.35Å; V223-V229 HydrophobicContact CG1-CG1 4.37Å; V223-V243 HydrophobicContact CG1-CB 4.44Å; V223-V243 HydrophobicContact CG1-CG1 4.29Å; V223-V243 HydrophobicContact CG1-CG2 3.85Å; V223-F246 HydrophobicContact CB-CZ 4.23Å; V223-F246 HydrophobicContact CG1-CZ 4.26Å; V223-F246 WeakPolarHBondContact O-CZ 3.44Å
224	R	92	Very high	94	Very high	183 Å²	183	54.4 Å²	54.4	69%	0.691	32%	0.316	S	S	*	.			trans	-116.4	148.2	-179.9	-60.5	-178.1	-178.7	-157.1	-0.9	110.9	G226 D227	R224-G226 PolarHBondContact O-N 3.39Å; R224-D227 PolarHBondContact N-OD2 3.31Å; R224-D227 VanDerWaalsContact O-CB 3.26Å; R224-D227 WeakPolarHBondContact O-CB 3.44Å; R224-D227 PolarHBondContact O-N 3.26Å
225	P	90.9	Very high	93.5	Very high	60 Å²	60	55.1 Å²	55.1	39%	0.39	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	133	164.1	-26.9	36.8	0	0	0	110.9	V243 T376	P225-V243 CarbonylContact C-O 3.58Å; P225-V243 WeakPolarHBondContact CA-O 3.43Å; P225-T376 HydrophobicContact CG-CG2 4.1Å
226	G	89.7	Confident	93.1	Very high	55 Å²	55	53.4 Å²	53.4	57%	0.567	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.1	-18.3	-172.4	0	0	0	0	0	114.5	R224 V243	R224-G226 PolarHBondContact O-N 3.39Å; G226-V243 PolarHBondContact N-O 3.37Å
227	D	94.6	Very high	92.8	Very high	50 Å²	50	53.4 Å²	53.4	27%	0.267	29%	0.292	S	S	.	.			trans	-65.8	144.4	172.9	-70.2	-18	0	0	0	110.6	L212 V223 R224 V243	L212-D227 HydrophobicContact CD2-CB 4.06Å; V223-D227 HydrophobicContact CG1-CB 4.35Å; R224-D227 PolarHBondContact N-OD2 3.31Å; R224-D227 VanDerWaalsContact O-CB 3.26Å; R224-D227 WeakPolarHBondContact O-CB 3.44Å; R224-D227 PolarHBondContact O-N 3.26Å; D227-V243 WeakPolarHBondContact O-CG2 3.46Å; D227-V243 PolarHBondContact O-N 3.09Å
228	R	97.1	Very high	92.6	Very high	91 Å²	91	50 Å²	50	34%	0.343	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.1	174.9	-66.6	-170.8	68.3	-148	-1.8	110.4	L212 E213 F240 S241 D242	L212-R228 CarbonylContact C-O 3.56Å; L212-R228 WeakPolarHBondContact CA-O 3.42Å; E213-R228 HydrophobicContact CB-CB 4Å; E213-R228 PolarHBondContact N-O 2.82Å; E213-R228 IonicContact OE1-CZ 3.38Å; E213-R228 IonicContact OE1-NH1 3.06Å; E213-R228 PolarHBondContact OE1-NH1 2.87Å; E213-R228 IonicContact OE1-NH2 3.82Å; E213-R228 WeakPolarHBondContact OE2-CD 3.4Å; E213-R228 IonicContact OE2-CZ 3.87Å; E213-R228 IonicContact OE2-NE 3.32Å; E213-R228 IonicContact OE2-NH1 3.42Å; E213-R228 PolarHBondContact OE2-NH1 2.85Å; R228-F240 HydrophobicContact CB-CB 4.48Å; R228-F240 PolarHBondContact NH2-O 2.94Å; R228-S241 WeakPolarHBondContact CA-O 3.45Å; R228-D242 WeakPolarHBondContact CD-OD1 3.38Å; R228-D242 WeakPolarHBondContact CG-OD1 3.43Å; R228-D242 IonicContact NE-OD1 3.81Å
229	V	97.4	Very high	92.5	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	151.7	-174	-67.7	0	0	0	0	111.2	V210 R211 L212 V223 A231 F240 S241 V243 T333 L338	V210-V229 HydrophobicContact CG2-CG1 4.08Å; R211-V229 CarbonylContact O-C 3.58Å; R211-V229 WeakPolarHBondContact O-CA 3.15Å; L212-V229 HydrophobicContact CD2-CG1 3.87Å; V223-V229 HydrophobicContact CG1-CG1 4.37Å; V229-A231 PolarHBondContact O-N 2.78Å; V229-F240 WeakPolarHBondContact O-CA 3.13Å; V229-S241 WeakPolarHBondContact CG2-O 3.46Å; V229-S241 PolarHBondContact N-O 2.9Å; V229-S241 PolarHBondContact O-N 2.87Å; V229-V243 HydrophobicContact CB-CG2 4.29Å; V229-V243 HydrophobicContact CG1-CG2 3.76Å; V229-V243 HydrophobicContact CG2-CG2 3.51Å; V229-T333 HydrophobicContact CG2-CG2 3.8Å; V229-L338 HydrophobicContact CB-CD1 3.75Å; V229-L338 HydrophobicContact CG2-CD1 3.31Å
230	L	96.9	Very high	92.4	Very high	3 Å²	3	51 Å²	51	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	131	176.6	-173.8	69.7	0	0	0	110.5	R211 P238 F240 A307 V339	R211-L230 HydrophobicContact CB-CB 4.19Å; R211-L230 VanDerWaalsContact NH2-CD2 3.34Å; R211-L230 PolarHBondContact O-N 3.4Å; L230-P238 HydrophobicContact CD1-CB 4.34Å; L230-F240 HydrophobicContact CB-CD1 4.39Å; L230-F240 HydrophobicContact CB-CE1 3.99Å; L230-F240 HydrophobicContact CD1-CE1 4.16Å; L230-F240 HydrophobicContact CD1-CZ 4.19Å; L230-A307 HydrophobicContact CD2-CB 3.95Å; L230-V339 HydrophobicContact CB-CB 4.15Å; L230-V339 HydrophobicContact CB-CG2 4.39Å; L230-V339 HydrophobicContact CD2-CB 3.84Å; L230-V339 HydrophobicContact CD2-CG1 3.89Å; L230-V339 HydrophobicContact CD2-CG2 3.95Å; L230-V339 HydrophobicContact CG-CB 3.95Å; L230-V339 HydrophobicContact CG-CG2 3.79Å; L230-V339 PolarHBondContact O-N 3.08Å
231	A	95.8	Very high	92.4	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	178.8	-176.8	0	0	0	0	0	110.2	V229 T239 T337	V229-A231 PolarHBondContact O-N 2.78Å; A231-T239 HydrophobicContact CB-CG2 4.39Å; A231-T239 PolarHBondContact N-O 2.66Å; A231-T239 PolarHBondContact O-N 3.21Å; A231-T239 VanDerWaalsContact O-O 3.14Å; A231-T337 WeakPolarHBondContact CB-O 2.94Å
232	M	93.8	Very high	92.4	Very high	15 Å²	15	51.1 Å²	51.1	7%	0.074	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127	174	-178.2	175.7	72.1	0	0	109.9	S237 F278 L305 L312 T337 V344	M232-S237 WeakPolarHBondContact CA-O 3.33Å; M232-F278 HydrophobicContact CE-CD1 4.19Å; M232-F278 HydrophobicContact CE-CD2 3.87Å; M232-F278 HydrophobicContact CE-CE1 4.09Å; M232-F278 HydrophobicContact CE-CE2 3.77Å; M232-F278 HydrophobicContact CE-CG 4.07Å; M232-F278 HydrophobicContact CE-CZ 3.88Å; M232-L305 HydrophobicContact CE-CD1 4.37Å; M232-L305 HydrophobicContact SD-CD1 3.66Å; M232-L312 HydrophobicContact CB-CD1 3.91Å; M232-L312 HydrophobicContact CG-CD1 3.55Å; M232-L312 HydrophobicContact SD-CD1 3.69Å; M232-T337 HydrophobicContact CE-CG2 4.43Å; M232-T337 PolarHBondContact N-OG1 3.34Å; M232-T337 PolarHBondContact O-OG1 3.01Å; M232-V344 HydrophobicContact CB-CG1 3.8Å; M232-V344 HydrophobicContact CE-CG1 4.1Å; M232-V344 HydrophobicContact SD-CG1 4.06Å
233	G	89.2	Confident	92.3	Very high	10 Å²	10	48.4 Å²	48.4	10%	0.103	26%	0.26	C	S	.	.			trans	-71.6	171.6	174	0	0	0	0	0	112.8	D235 G236 S237	G233-D235 PolarHBondContact O-N 2.83Å; G233-G236 PolarHBondContact O-N 3.3Å; G233-S237 PolarHBondContact N-O 2.9Å
234	E	83.3	Confident	92.1	Very high	174 Å²	174	49.5 Å²	49.5	81%	0.813	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-27	179.1	-64.7	-176.9	173.8	0	0	113	G236	E234-G236 PolarHBondContact O-N 3.41Å
235	D	83.1	Confident	91.9	Very high	116 Å²	116	40.8 Å²	40.8	62%	0.62	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.7	175.3	65.1	-14.3	0	0	0	113.3	G233 S237	G233-D235 PolarHBondContact O-N 2.83Å; D235-S237 VanDerWaalsContact C-N 3.29Å; D235-S237 VanDerWaalsContact OD1-CB 3.25Å; D235-S237 WeakPolarHBondContact OD1-CB 3.47Å; D235-S237 PolarHBondContact OD1-N 2.99Å; D235-S237 PolarHBondContact OD1-OG 2.97Å; D235-S237 WeakPolarHBondContact OD2-CB 3.5Å; D235-S237 PolarHBondContact OD2-OG 2.86Å; D235-S237 VanDerWaalsContact OD2-OG 3.06Å
236	G	84.9	Confident	91.7	Very high	11 Å²	11	38.6 Å²	38.6	11%	0.113	22%	0.217	C	C	.	.	S	Bend	trans	77.2	12.3	-175	0	0	0	0	0	113.8	G233 E234	G233-G236 PolarHBondContact O-N 3.3Å; E234-G236 PolarHBondContact O-N 3.41Å
237	S	89.1	Confident	91.5	Very high	43 Å²	43	36.6 Å²	36.6	30%	0.301	19%	0.193	S	C	.	.			trans	-85	151	175.1	72.7	0	0	0	0	111.9	M232 G233 D235	M232-S237 WeakPolarHBondContact CA-O 3.33Å; G233-S237 PolarHBondContact N-O 2.9Å; D235-S237 VanDerWaalsContact C-N 3.29Å; D235-S237 VanDerWaalsContact OD1-CB 3.25Å; D235-S237 WeakPolarHBondContact OD1-CB 3.47Å; D235-S237 PolarHBondContact OD1-N 2.99Å; D235-S237 PolarHBondContact OD1-OG 2.97Å; D235-S237 WeakPolarHBondContact OD2-CB 3.5Å; D235-S237 PolarHBondContact OD2-OG 2.86Å; D235-S237 VanDerWaalsContact OD2-OG 3.06Å
238	P	92.6	Very high	90.9	Very high	59 Å²	59	34.2 Å²	34.2	38%	0.383	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	131.9	171.9	29	-33.5	0	0	0	110.7	L230 L312	L230-P238 HydrophobicContact CD1-CB 4.34Å; P238-L312 HydrophobicContact CB-CD2 4.49Å; P238-L312 HydrophobicContact CB-CG 4.3Å
239	T	94.8	Very high	90.4	Very high	41 Å²	41	33.4 Å²	33.4	25%	0.252	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	167.6	179.7	-170.4	0	0	0	0	111.5	A231	A231-T239 HydrophobicContact CB-CG2 4.39Å; A231-T239 PolarHBondContact N-O 2.66Å; A231-T239 PolarHBondContact O-N 3.21Å; A231-T239 VanDerWaalsContact O-O 3.14Å
240	F	96.1	Very high	89.9	Confident	49 Å²	49	34.3 Å²	34.3	22%	0.215	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.5	172	-73.5	-75.9	0	0	0	110.6	L212 E213 R228 V229 L230	L212-F240 VanDerWaalsContact C-CE1 3.48Å; L212-F240 WeakPolarHBondContact O-CE1 3.38Å; E213-F240 HydrophobicContact CB-CB 4.3Å; E213-F240 HydrophobicContact CB-CD1 3.79Å; E213-F240 HydrophobicContact CB-CD2 4.29Å; E213-F240 HydrophobicContact CB-CE1 4.18Å; E213-F240 HydrophobicContact CB-CG 3.86Å; E213-F240 HydrophobicContact CG-CB 4.38Å; E213-F240 HydrophobicContact CG-CD1 4.4Å; E213-F240 HydrophobicContact CG-CD2 4Å; E213-F240 HydrophobicContact CG-CE2 4.38Å; E213-F240 HydrophobicContact CG-CG 4.01Å; R228-F240 HydrophobicContact CB-CB 4.48Å; R228-F240 PolarHBondContact NH2-O 2.94Å; V229-F240 WeakPolarHBondContact O-CA 3.13Å; L230-F240 HydrophobicContact CB-CD1 4.39Å; L230-F240 HydrophobicContact CB-CE1 3.99Å; L230-F240 HydrophobicContact CD1-CE1 4.16Å; L230-F240 HydrophobicContact CD1-CZ 4.19Å
241	S	95.3	Very high	89.4	Confident	1 Å²	1	35 Å²	35	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140	-175.6	-170.4	0	0	0	0	111.5	R228 V229 V243 T333 R334 H335	R228-S241 WeakPolarHBondContact CA-O 3.45Å; V229-S241 WeakPolarHBondContact CG2-O 3.46Å; V229-S241 PolarHBondContact N-O 2.9Å; V229-S241 PolarHBondContact O-N 2.87Å; S241-V243 PolarHBondContact O-N 3.19Å; S241-T333 WeakPolarHBondContact OG-CB 3.36Å; S241-R334 WeakPolarHBondContact OG-CB 3.37Å; S241-R334 PolarHBondContact OG-N 3.29Å; S241-H335 WeakPolarHBondContact CB-ND1 3.01Å; S241-H335 PolarHBondContact OG-N 3.5Å; S241-H335 VanDerWaalsContact OG-N 3.11Å; S241-H335 PolarHBondContact OG-ND1 3.41Å
242	D	94	Very high	88.8	Confident	50 Å²	50	42.5 Å²	42.5	27%	0.267	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	133.9	172.1	-51	-65.5	0	0	0	110.4	R228 L244 T333 R334	R228-D242 WeakPolarHBondContact CD-OD1 3.38Å; R228-D242 WeakPolarHBondContact CG-OD1 3.43Å; R228-D242 IonicContact NE-OD1 3.81Å; D242-L244 HydrophobicContact CB-CD2 4.31Å; D242-T333 CarbonylContact O-C 3.57Å; D242-T333 WeakPolarHBondContact O-CA 3.42Å; D242-R334 PolarHBondContact O-N 3.32Å
243	V	93.4	Very high	87.8	Confident	2 Å²	2	44 Å²	44	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.9	165.2	179.7	0	0	0	0	107.7	V223 P225 G226 D227 V229 S241 T333	V223-V243 HydrophobicContact CG1-CB 4.44Å; V223-V243 HydrophobicContact CG1-CG1 4.29Å; V223-V243 HydrophobicContact CG1-CG2 3.85Å; P225-V243 CarbonylContact C-O 3.58Å; P225-V243 WeakPolarHBondContact CA-O 3.43Å; G226-V243 PolarHBondContact N-O 3.37Å; D227-V243 WeakPolarHBondContact O-CG2 3.46Å; D227-V243 PolarHBondContact O-N 3.09Å; V229-V243 HydrophobicContact CB-CG2 4.29Å; V229-V243 HydrophobicContact CG1-CG2 3.76Å; V229-V243 HydrophobicContact CG2-CG2 3.51Å; S241-V243 PolarHBondContact O-N 3.19Å; V243-T333 HydrophobicContact CG2-CG2 4.49Å
244	L	89.7	Confident	87.4	Confident	25 Å²	25	48.9 Å²	48.9	13%	0.131	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-53.5	-175.5	-57.4	179.6	0	0	0	111.1	D242 L332 R334 R365	D242-L244 HydrophobicContact CB-CD2 4.31Å; L244-L332 WeakPolarHBondContact CB-O 3.37Å; L244-L332 PolarHBondContact N-O 3.12Å; L244-R334 HydrophobicContact CD2-CB 4.49Å; L244-R365 HydrophobicContact CD1-CB 4.15Å; L244-R365 HydrophobicContact CD1-CG 3.77Å
245	I	88.3	Confident	87.1	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	174	-177.2	60.5	172.9	0	0	0	110.2	L247 L332 L364 H368 T376	I245-L247 HydrophobicContact CD1-CD2 3.81Å; I245-L247 HydrophobicContact CG1-CD2 4.2Å; I245-L332 HydrophobicContact CD1-CD2 4.3Å; I245-L332 HydrophobicContact CG1-CB 3.98Å; I245-L332 HydrophobicContact CG1-CD2 4.1Å; I245-L332 PolarHBondContact O-N 3.44Å; I245-L364 HydrophobicContact CD1-CD2 3.59Å; I245-L364 HydrophobicContact CD1-CG 4.23Å; I245-H368 WeakPolarHBondContact CG2-CE1 3.35Å; I245-H368 WeakPolarHBondContact CG2-NE2 3.44Å; I245-T376 HydrophobicContact CB-CG2 4.25Å; I245-T376 HydrophobicContact CG2-CG2 3.76Å
246	F	87.7	Confident	86.9	Confident	14 Å²	14	38 Å²	38	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.8	162.2	-70.1	-94.4	0	0	0	109.3	V223 D248 R249 Y329 A330 P331	V223-F246 HydrophobicContact CB-CZ 4.23Å; V223-F246 HydrophobicContact CG1-CZ 4.26Å; V223-F246 WeakPolarHBondContact O-CZ 3.44Å; F246-D248 VanDerWaalsContact C-N 3.32Å; F246-R249 HydrophobicContact CB-CB 4.25Å; F246-Y329 AromaticContact CD1-CD1 3.95Å; F246-Y329 HydrophobicContact CD1-CD1 3.95Å; F246-Y329 AromaticContact CE1-CD1 3.7Å; F246-Y329 HydrophobicContact CE1-CD1 3.7Å; F246-Y329 HydrophobicContact CE1-CG 4.42Å; F246-Y329 HydrophobicContact CZ-CD1 4.42Å; F246-A330 CarbonylContact C-O 3.52Å; F246-A330 WeakPolarHBondContact CA-O 3.25Å; F246-P331 HydrophobicContact CD1-CB 4.16Å; F246-P331 HydrophobicContact CE1-CB 3.93Å
247	L	84.9	Confident	87	Confident	13 Å²	13	37.5 Å²	37.5	7%	0.068	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-27.3	175	-59.3	-176.6	0	0	0	112.2	I245 A330 L332 F361 L364 V381 H382 P385	I245-L247 HydrophobicContact CD1-CD2 3.81Å; I245-L247 HydrophobicContact CG1-CD2 4.2Å; L247-A330 HydrophobicContact CB-CB 4.1Å; L247-A330 PolarHBondContact N-O 3.17Å; L247-L332 HydrophobicContact CD1-CB 4.32Å; L247-L332 HydrophobicContact CD2-CB 4.06Å; L247-L332 HydrophobicContact CD2-CD2 4.06Å; L247-L332 HydrophobicContact CG-CB 3.97Å; L247-F361 HydrophobicContact CD1-CE1 3.9Å; L247-F361 HydrophobicContact CD1-CZ 4.11Å; L247-F361 HydrophobicContact CD2-CD1 4.44Å; L247-F361 HydrophobicContact CD2-CE1 3.78Å; L247-L364 HydrophobicContact CD2-CD2 4.4Å; L247-V381 CarbonylContact O-C 3.32Å; L247-V381 WeakPolarHBondContact O-CA 3.41Å; L247-H382 PolarHBondContact O-N 2.78Å; L247-P385 HydrophobicContact CB-CG 4.1Å; L247-P385 HydrophobicContact CD2-CG 3.85Å; L247-P385 HydrophobicContact CG-CG 4.38Å
248	D	82.7	Confident	87	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	140.1	173.2	-167.2	8.3	0	0	0	108.7	F246 A330 G380 V381	F246-D248 VanDerWaalsContact C-N 3.32Å; D248-A330 HydrophobicContact CB-CB 3.85Å; D248-A330 PolarHBondContact O-N 3.05Å; D248-G380 WeakPolarHBondContact CA-O 3.28Å; D248-V381 HydrophobicContact CB-CG2 4.21Å; D248-V381 WeakPolarHBondContact OD1-CG2 3.43Å
249	R	85.9	Confident	87.1	Confident	73 Å²	73	33.8 Å²	33.8	28%	0.275	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	101.4	-179.5	-177.7	172.2	173	140.3	2.6	110.3	F246 A328 Y329 G378 E379 G380	F246-R249 HydrophobicContact CB-CB 4.25Å; R249-A328 CarbonylContact C-O 3.51Å; R249-A328 WeakPolarHBondContact CA-O 3.48Å; R249-Y329 HydrophobicContact CG-CD1 4.12Å; R249-Y329 HydrophobicContact CG-CE1 3.84Å; R249-G378 WeakPolarHBondContact CD-O 3.47Å; R249-E379 CarbonylContact O-C 3.6Å; R249-E379 WeakPolarHBondContact O-CA 3.49Å; R249-G380 PolarHBondContact N-O 3.15Å; R249-G380 PolarHBondContact O-N 2.78Å
250	E	85.8	Confident	87.2	Confident	20 Å²	20	31.9 Å²	31.9	9%	0.093	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	86.2	176.3	-61.1	-174.4	135.2	0	0	109.4	K199 H252 R253 R255 G327 A328	K199-E250 WeakPolarHBondContact CD-OE1 3.5Å; K199-E250 IonicContact NZ-OE1 3.45Å; K199-E250 PolarHBondContact NZ-OE1 3.34Å; E250-H252 PolarHBondContact O-N 2.89Å; E250-R253 HydrophobicContact CB-CB 4.2Å; E250-R253 IonicContact OE1-NH1 3.77Å; E250-R253 PolarHBondContact OE1-NH1 3.25Å; E250-R253 WeakPolarHBondContact OE2-CD 3.13Å; E250-R253 IonicContact OE2-NH1 2.72Å; E250-R255 IonicContact OE2-CZ 3.73Å; E250-R255 IonicContact OE2-NE 3.89Å; E250-R255 PolarHBondContact OE2-NE 3.44Å; E250-R255 IonicContact OE2-NH2 3.73Å; E250-R255 PolarHBondContact OE2-NH2 3.1Å; E250-R255 VanDerWaalsContact OE2-NH2 3.13Å; E250-G327 CarbonylContact O-C 3.5Å; E250-G327 WeakPolarHBondContact O-CA 3.35Å; E250-A328 HydrophobicContact CB-CB 4.13Å; E250-A328 PolarHBondContact N-O 3.4Å; E250-A328 PolarHBondContact O-N 3.5Å
251	P	86.4	Confident	87.3	Confident	19 Å²	19	32.9 Å²	32.9	12%	0.123	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-31.3	-170	24.1	-32.3	0	0	0	114.4	Y329 E379	P251-Y329 WeakPolarHBondContact CB-OH 3.48Å; P251-E379 HydrophobicContact CG-CG 4.36Å; P251-E379 VanDerWaalsContact CG-OE1 3.29Å; P251-E379 WeakPolarHBondContact CG-OE1 3.47Å
252	H	83.1	Confident	87.4	Confident	156 Å²	156	33.3 Å²	33.3	72%	0.722	17%	0.167	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	7.5	-169.4	-59.2	-56.4	0	0	0	114.3	E250	E250-H252 PolarHBondContact O-N 2.89Å
253	R	74.5	Confident	87.4	Confident	47 Å²	47	34.3 Å²	34.3	18%	0.177	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.5	-172.9	-158.4	176	-169.9	160.1	3	112.1	H194 E250 G327	H194-R253 PolarHBondContact CD2-NH2 3.38Å; H194-R253 PolarHBondContact CE1-NH2 3.29Å; H194-R253 PolarHBondContact ND1-NE 3.47Å; H194-R253 VanDerWaalsContact ND1-NE 3.12Å; H194-R253 PolarHBondContact ND1-NH2 2.91Å; H194-R253 PolarHBondContact NE2-NH2 3.4Å; E250-R253 HydrophobicContact CB-CB 4.2Å; E250-R253 IonicContact OE1-NH1 3.77Å; E250-R253 PolarHBondContact OE1-NH1 3.25Å; E250-R253 WeakPolarHBondContact OE2-CD 3.13Å; E250-R253 IonicContact OE2-NH1 2.72Å; R253-G327 PolarHBondContact O-N 2.75Å
254	L	79.5	Confident	87.2	Confident	113 Å²	113	40 Å²	40	59%	0.592	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	133.2	168	-68.6	172.3	0	0	0	109.8	V324 L326	L254-V324 HydrophobicContact CB-CG1 4.2Å; L254-V324 HydrophobicContact CD2-CG1 4.43Å; L254-L326 HydrophobicContact CD2-CB 4.11Å; L254-L326 HydrophobicContact CD2-CD1 3.96Å; L254-L326 HydrophobicContact CG-CD1 4.28Å
255	R	76.8	Confident	87.4	Confident	8 Å²	8	39.9 Å²	39.9	3%	0.03	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150	176.3	-94.9	-177.4	-175.2	-118.7	20.2	111.6	E250 F257 V324 A325	E250-R255 IonicContact OE2-CZ 3.73Å; E250-R255 IonicContact OE2-NE 3.89Å; E250-R255 PolarHBondContact OE2-NE 3.44Å; E250-R255 IonicContact OE2-NH2 3.73Å; E250-R255 PolarHBondContact OE2-NH2 3.1Å; E250-R255 VanDerWaalsContact OE2-NH2 3.13Å; R255-F257 HydrophobicContact CB-CD2 4.42Å; R255-F257 HydrophobicContact CB-CE2 3.7Å; R255-F257 HydrophobicContact CB-CZ 3.94Å; R255-F257 WeakPolarHBondContact O-CD2 3.47Å; R255-F257 WeakPolarHBondContact O-CE2 3.47Å; R255-V324 CarbonylContact O-C 3.55Å; R255-V324 VanDerWaalsContact O-CA 3.3Å; R255-V324 WeakPolarHBondContact O-CA 3.3Å; R255-A325 PolarHBondContact N-O 2.87Å; R255-A325 PolarHBondContact O-N 3.27Å
256	A	78.4	Confident	87.7	Confident	53 Å²	53	44.5 Å²	44.5	44%	0.438	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	127.1	168.7	0	0	0	0	0	110.2	T322 V324	A256-T322 HydrophobicContact CB-CG2 4.24Å; A256-V324 HydrophobicContact CB-CG2 4.38Å
257	F	87.8	Confident	88.1	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.8	175.6	-64.9	-87.9	0	0	0	109.4	P205 R255 A270 L271 T272 T322 H323 A325 G327	P205-F257 HydrophobicContact CB-CD2 4.29Å; P205-F257 HydrophobicContact CB-CE1 4.38Å; P205-F257 HydrophobicContact CB-CE2 3.88Å; P205-F257 HydrophobicContact CB-CZ 3.93Å; R255-F257 HydrophobicContact CB-CD2 4.42Å; R255-F257 HydrophobicContact CB-CE2 3.7Å; R255-F257 HydrophobicContact CB-CZ 3.94Å; R255-F257 WeakPolarHBondContact O-CD2 3.47Å; R255-F257 WeakPolarHBondContact O-CE2 3.47Å; F257-A270 HydrophobicContact CB-CB 4.15Å; F257-L271 CarbonylContact C-O 3.47Å; F257-T272 HydrophobicContact CD1-CG2 4.07Å; F257-T272 HydrophobicContact CE1-CG2 3.88Å; F257-T322 CarbonylContact O-C 3.52Å; F257-T322 VanDerWaalsContact O-CA 3.27Å; F257-T322 WeakPolarHBondContact O-CA 3.45Å; F257-T322 WeakPolarHBondContact O-CG2 3.43Å; F257-H323 WeakPolarHBondContact CB-O 3.29Å; F257-H323 PolarHBondContact N-O 3.25Å; F257-H323 PolarHBondContact O-N 3.35Å; F257-A325 HydrophobicContact CD2-CB 3.8Å; F257-A325 HydrophobicContact CE2-CB 3.89Å; F257-G327 VanDerWaalsContact CZ-O 3.29Å; F257-G327 WeakPolarHBondContact CZ-O 3.42Å
258	Q	88.6	Confident	88.7	Confident	23 Å²	23	52.1 Å²	52.1	11%	0.107	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136.2	164.7	-167.5	166.7	14.1	0	0	108.5	A270 L271 A295 V320 S321	Q258-A270 WeakPolarHBondContact O-CA 3.37Å; Q258-L271 PolarHBondContact N-O 3.08Å; Q258-L271 PolarHBondContact O-N 3.42Å; Q258-A295 PolarHBondContact NE2-O 3.06Å; Q258-A295 VanDerWaalsContact NE2-O 3.08Å; Q258-A295 PolarHBondContact OE1-O 3.37Å; Q258-V320 HydrophobicContact CG-CG1 3.78Å; Q258-S321 CarbonylContact C-O 3.5Å; Q258-S321 WeakPolarHBondContact CA-O 3.22Å
259	V	96.1	Very high	89.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.4	-179.7	-177.9	0	0	0	0	108.4	E261 R268 L269 A270 V320 S321 H323	V259-E261 HydrophobicContact CG1-CG 4.08Å; V259-R268 HydrophobicContact CG1-CG 3.65Å; V259-L269 CarbonylContact C-O 3.54Å; V259-L269 VanDerWaalsContact CA-O 3.29Å; V259-L269 WeakPolarHBondContact CA-O 3.43Å; V259-A270 HydrophobicContact CG2-CB 4.15Å; V259-V320 CarbonylContact O-C 3.39Å; V259-V320 WeakPolarHBondContact O-CA 3.2Å; V259-S321 PolarHBondContact N-O 2.62Å; V259-S321 PolarHBondContact O-N 3.46Å; V259-H323 HydrophobicContact CG2-CB 3.4Å; V259-H323 VanDerWaalsContact CG2-CB 3.4Å
260	I	96.9	Very high	89.9	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.8	176.8	-64.8	167.5	0	0	0	107.3	R268 L269 L271 L277 V298 V317	I260-R268 WeakPolarHBondContact O-CA 3.25Å; I260-L269 PolarHBondContact N-O 3.23Å; I260-L269 PolarHBondContact O-N 3.44Å; I260-L271 HydrophobicContact CD1-CD2 3.93Å; I260-L271 HydrophobicContact CG1-CD2 4.45Å; I260-L277 HydrophobicContact CD1-CD1 3.06Å; I260-V298 HydrophobicContact CD1-CB 4.08Å; I260-V298 HydrophobicContact CD1-CG1 4.07Å; I260-V298 HydrophobicContact CD1-CG2 4.02Å; I260-V298 HydrophobicContact CG1-CG1 4.48Å; I260-V317 HydrophobicContact CG2-CG1 3.99Å; I260-V317 HydrophobicContact CG2-CG2 4.03Å
261	E	97.6	Very high	90.3	Very high	69 Å²	69	48.2 Å²	48.2	32%	0.322	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.3	178.3	-66.2	179.7	158.6	0	0	108.7	V259 R267 R268 A318 A319	V259-E261 HydrophobicContact CG1-CG 4.08Å; E261-R267 WeakPolarHBondContact CA-O 3.27Å; E261-R268 HydrophobicContact CG-CB 4.45Å; E261-R268 HydrophobicContact CG-CG 4.06Å; E261-R268 IonicContact OE1-NE 3.56Å; E261-R268 PolarHBondContact OE1-NE 3.1Å; E261-A318 PolarHBondContact O-N 3.16Å; E261-A319 HydrophobicContact CB-CB 4.34Å; E261-A319 PolarHBondContact N-O 3.2Å; E261-A319 PolarHBondContact O-N 3.19Å
262	T	97.2	Very high	90.5	Very high	10 Å²	10	47.5 Å²	47.5	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	159.3	178.1	66.3	0	0	0	0	111	P265 P266 R267 V304 A315 R316	T262-P265 PolarHBondContact OG1-O 3.48Å; T262-P266 WeakPolarHBondContact O-CA 3.23Å; T262-R267 PolarHBondContact N-O 3.16Å; T262-R267 VanDerWaalsContact OG1-CB 3.3Å; T262-R267 WeakPolarHBondContact OG1-CB 3.48Å; T262-R267 PolarHBondContact OG1-N 3.31Å; T262-V304 HydrophobicContact CG2-CG2 3.38Å; T262-A315 HydrophobicContact CG2-CB 4.05Å; T262-R316 CarbonylContact C-O 3.46Å; T262-R316 WeakPolarHBondContact CA-O 3.27Å; T262-R316 WeakPolarHBondContact CB-O 3.11Å
263	Q	94.5	Very high	90.6	Very high	72 Å²	72	41.3 Å²	41.3	34%	0.336	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.2	163.2	60.1	177	85.1	0	0	108.5	P265 R316 A318	Q263-P265 CarbonylContact C-O 3.46Å; Q263-R316 HydrophobicContact CG-CB 3.81Å; Q263-R316 HydrophobicContact CG-CG 4.24Å; Q263-R316 PolarHBondContact N-O 3.18Å; Q263-R316 PolarHBondContact O-N 3.34Å; Q263-A318 HydrophobicContact CB-CB 4.12Å; Q263-A318 HydrophobicContact CG-CB 4.16Å
264	D	89.3	Confident	91.1	Very high	120 Å²	120	39.2 Å²	39.2	64%	0.642	21%	0.207	S	C	*	.	S	Bend	trans	53.4	66.5	172.1	-49.4	-48.5	0	0	0	114.3
265	P	93.1	Very high	91.6	Very high	23 Å²	23	33.9 Å²	33.9	15%	0.149	18%	0.179	C	C	.	.	S	Bend	cis	-88.7	160.1	0.9	35.2	-37.7	0	0	0	113.9	T262 Q263 R267 V306	T262-P265 PolarHBondContact OG1-O 3.48Å; Q263-P265 CarbonylContact C-O 3.46Å; P265-R267 PolarHBondContact O-N 3.4Å; P265-V306 HydrophobicContact CG-CG2 3.65Å
266	P	95.4	Very high	92.3	Very high	98 Å²	98	33.5 Å²	33.5	64%	0.636	18%	0.178	S	C	*	.			trans	-71.3	121.5	175.7	28.6	-33.4	0	0	0	111.5	T262	T262-P266 WeakPolarHBondContact O-CA 3.23Å
267	R	96.5	Very high	93.1	Very high	70 Å²	70	31 Å²	31	26%	0.264	16%	0.157	S	C	.	.			trans	-138.7	158.7	173.9	-59.7	-63.6	-176.2	-104.6	4.2	109.7	E261 T262 P265 V306 D342 V343	E261-R267 WeakPolarHBondContact CA-O 3.27Å; T262-R267 PolarHBondContact N-O 3.16Å; T262-R267 VanDerWaalsContact OG1-CB 3.3Å; T262-R267 WeakPolarHBondContact OG1-CB 3.48Å; T262-R267 PolarHBondContact OG1-N 3.31Å; P265-R267 PolarHBondContact O-N 3.4Å; R267-V306 HydrophobicContact CG-CB 4.33Å; R267-V306 HydrophobicContact CG-CG1 4.05Å; R267-D342 IonicContact CZ-OD2 3.39Å; R267-D342 IonicContact NE-OD2 3.63Å; R267-D342 PolarHBondContact NE-OD2 2.85Å; R267-D342 VanDerWaalsContact NE-OD2 3.17Å; R267-D342 IonicContact NH2-OD2 3.17Å; R267-V343 HydrophobicContact CB-CG2 3.81Å; R267-V343 HydrophobicContact CG-CG2 4.4Å
268	R	97.2	Very high	93.4	Very high	116 Å²	116	31.5 Å²	31.5	44%	0.438	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	104.9	-178.8	-177.2	172.2	-179.1	-87.9	0.9	110	V259 I260 E261 E341	V259-R268 HydrophobicContact CG1-CG 3.65Å; I260-R268 WeakPolarHBondContact O-CA 3.25Å; E261-R268 HydrophobicContact CG-CB 4.45Å; E261-R268 HydrophobicContact CG-CG 4.06Å; E261-R268 IonicContact OE1-NE 3.56Å; E261-R268 PolarHBondContact OE1-NE 3.1Å; R268-E341 VanDerWaalsContact O-CB 3.31Å; R268-E341 WeakPolarHBondContact O-CB 3.2Å; R268-E341 WeakPolarHBondContact O-CG 3.44Å
269	L	97.8	Very high	93.7	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.2	179	177.6	68	0	0	0	110.5	F204 V259 I260 L271 L277 V340 E341 V343	F204-L269 HydrophobicContact CD1-CD1 4.19Å; F204-L269 HydrophobicContact CE1-CD1 4.03Å; V259-L269 CarbonylContact C-O 3.54Å; V259-L269 VanDerWaalsContact CA-O 3.29Å; V259-L269 WeakPolarHBondContact CA-O 3.43Å; I260-L269 PolarHBondContact N-O 3.23Å; I260-L269 PolarHBondContact O-N 3.44Å; L269-L271 HydrophobicContact CD2-CD1 4.01Å; L269-L271 HydrophobicContact CD2-CD2 4.09Å; L269-L271 HydrophobicContact CG-CD2 4.14Å; L269-L277 HydrophobicContact CD2-CD1 4.34Å; L269-L277 HydrophobicContact CD2-CD2 3.58Å; L269-V340 HydrophobicContact CD1-CB 3.76Å; L269-V340 HydrophobicContact CD1-CG1 3.8Å; L269-V340 WeakPolarHBondContact CD1-O 3.37Å; L269-E341 HydrophobicContact CD1-CB 4.42Å; L269-V343 HydrophobicContact CB-CB 4.1Å; L269-V343 HydrophobicContact CB-CG1 4.49Å; L269-V343 HydrophobicContact CB-CG2 3.93Å; L269-V343 HydrophobicContact CD2-CB 3.93Å; L269-V343 HydrophobicContact CD2-CG1 3.81Å; L269-V343 HydrophobicContact CG-CB 4.42Å
270	A	96.2	Very high	93.6	Very high	12 Å²	12	31.2 Å²	31.2	10%	0.099	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.7	171.8	0	0	0	0	0	110.8	P205 F257 Q258 V259	P205-A270 WeakPolarHBondContact CD-O 3.17Å; P205-A270 HydrophobicContact CG-CB 4.02Å; F257-A270 HydrophobicContact CB-CB 4.15Å; Q258-A270 WeakPolarHBondContact O-CA 3.37Å; V259-A270 HydrophobicContact CG2-CB 4.15Å
271	L	94.3	Very high	93.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	160.6	-178	73.7	176.5	0	0	0	112.1	C203 F204 F257 Q258 I260 L269 H275 L277 A295	C203-L271 WeakPolarHBondContact O-CA 3.29Å; F204-L271 HydrophobicContact CD1-CB 3.88Å; F204-L271 HydrophobicContact CE1-CB 3.86Å; F204-L271 HydrophobicContact CE1-CD1 4.44Å; F257-L271 CarbonylContact C-O 3.47Å; Q258-L271 PolarHBondContact N-O 3.08Å; Q258-L271 PolarHBondContact O-N 3.42Å; I260-L271 HydrophobicContact CD1-CD2 3.93Å; I260-L271 HydrophobicContact CG1-CD2 4.45Å; L269-L271 HydrophobicContact CD2-CD1 4.01Å; L269-L271 HydrophobicContact CD2-CD2 4.09Å; L269-L271 HydrophobicContact CG-CD2 4.14Å; L271-H275 HydrophobicContact CB-CB 4.19Å; L271-H275 HydrophobicContact CD1-CB 3.69Å; L271-H275 HydrophobicContact CG-CB 4.01Å; L271-L277 HydrophobicContact CD1-CD1 3.63Å; L271-L277 HydrophobicContact CD1-CD2 3.94Å; L271-L277 HydrophobicContact CD1-CG 3.65Å; L271-L277 HydrophobicContact CD2-CD1 4.18Å; L271-A295 HydrophobicContact CD1-CB 4.01Å; L271-A295 HydrophobicContact CD2-CB 3.97Å; L271-A295 HydrophobicContact CG-CB 3.82Å
272	T	89.7	Confident	92.8	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	19%	0.194	C	C	.	.			trans	-68.7	151.1	179	56	0	0	0	0	111.6	G201 G202 C203 F257 A274 H275	G201-T272 PolarHBondContact O-OG1 3.24Å; G202-T272 WeakPolarHBondContact CA-OG1 3.48Å; C203-T272 HydrophobicContact CB-CG2 3.84Å; C203-T272 PolarHBondContact N-OG1 2.92Å; C203-T272 PolarHBondContact O-N 3.09Å; F257-T272 HydrophobicContact CD1-CG2 4.07Å; F257-T272 HydrophobicContact CE1-CG2 3.88Å; T272-A274 PolarHBondContact O-N 3.27Å; T272-A274 VanDerWaalsContact O-N 3.08Å; T272-H275 WeakPolarHBondContact O-CB 3.46Å; T272-H275 PolarHBondContact O-N 3.33Å
273	P	85.1	Confident	92.3	Very high	27 Å²	27	41.7 Å²	41.7	18%	0.175	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.8	-174.1	-25	33.3	0	0	0	115.2	A196 A295 S296 L404	A196-P273 HydrophobicContact CB-CG 4.48Å; P273-A295 PolarHBondContact O-N 3.46Å; P273-S296 WeakPolarHBondContact O-CB 3.45Å; P273-S296 PolarHBondContact O-N 2.91Å; P273-S296 PolarHBondContact O-OG 2.92Å; P273-L404 HydrophobicContact CB-CD1 3.89Å; P273-L404 HydrophobicContact CG-CD1 4.29Å
274	A	84.7	Confident	91.8	Very high	2 Å²	2	42.6 Å²	42.6	2%	0.017	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	0.5	179.1	0	0	0	0	0	113.9	T200 T272 F294 A349 A350 H402	T200-A274 HydrophobicContact CG2-CB 4.02Å; T272-A274 PolarHBondContact O-N 3.27Å; T272-A274 VanDerWaalsContact O-N 3.08Å; A274-F294 VanDerWaalsContact O-CD1 3.28Å; A274-F294 WeakPolarHBondContact O-CD1 3.3Å; A274-A349 WeakPolarHBondContact O-CA 3.4Å; A274-A349 VanDerWaalsContact O-CB 3.26Å; A274-A349 WeakPolarHBondContact O-CB 3.04Å; A274-A350 PolarHBondContact O-N 3.34Å; A274-H402 HydrophobicContact CB-CB 4.09Å
275	H	90.8	Very high	91.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	138	179.4	-151.8	139.3	0	0	0	110	G202 C203 F204 L271 T272 F294 A295 S346	G202-H275 WeakPolarHBondContact CA-ND1 3.5Å; G202-H275 PolarHBondContact O-CE1 3.01Å; G202-H275 VanDerWaalsContact O-CE1 3.26Å; C203-H275 PolarHBondContact N-ND1 3.15Å; C203-H275 VanDerWaalsContact N-ND1 3.18Å; C203-H275 PolarHBondContact O-ND1 3.07Å; F204-H275 AromaticContact CD2-CE1 3.72Å; F204-H275 AromaticContact CE1-CE1 3.79Å; F204-H275 AromaticContact CE2-CE1 3.13Å; F204-H275 WeakPolarHBondContact CE2-CE1 3.24Å; F204-H275 AromaticContact CE2-NE2 3.64Å; F204-H275 AromaticContact CZ-CE1 3.15Å; F204-H275 WeakPolarHBondContact CZ-CE1 3.49Å; F204-H275 AromaticContact CZ-ND1 3.83Å; F204-H275 AromaticContact CZ-NE2 3.45Å; F204-H275 WeakPolarHBondContact CZ-NE2 3.49Å; L271-H275 HydrophobicContact CB-CB 4.19Å; L271-H275 HydrophobicContact CD1-CB 3.69Å; L271-H275 HydrophobicContact CG-CB 4.01Å; T272-H275 WeakPolarHBondContact O-CB 3.46Å; T272-H275 PolarHBondContact O-N 3.33Å; H275-F294 CarbonylContact O-C 3.52Å; H275-A295 PolarHBondContact O-N 3.49Å; H275-S346 PolarHBondContact CD2-O 3.32Å; H275-S346 PolarHBondContact NE2-O 3.35Å
276	L	91.9	Very high	91	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.7	178.9	-68.3	175.1	0	0	0	113	A292 T293 F294 S346 F348 V351	L276-A292 HydrophobicContact CD1-CB 4.24Å; L276-A292 HydrophobicContact CD2-CB 4.32Å; L276-T293 WeakPolarHBondContact CA-O 3.26Å; L276-F294 HydrophobicContact CD2-CD1 3.54Å; L276-F294 HydrophobicContact CD2-CE1 3.64Å; L276-F294 HydrophobicContact CD2-CG 4.18Å; L276-F294 HydrophobicContact CD2-CZ 4.38Å; L276-F294 HydrophobicContact CG-CD1 4.32Å; L276-F294 HydrophobicContact CG-CE1 4.3Å; L276-S346 PolarHBondContact O-N 3.03Å; L276-S346 VanDerWaalsContact O-N 3.08Å; L276-F348 HydrophobicContact CD1-CB 4.49Å; L276-F348 PolarHBondContact N-O 2.76Å; L276-V351 WeakPolarHBondContact CD1-O 3.35Å
277	L	93.9	Very high	90.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.8	169	-74.9	166.4	0	0	0	111	I260 L269 L271 T279 A292 T293 A295 V298 V343 V344 A345	I260-L277 HydrophobicContact CD1-CD1 3.06Å; L269-L277 HydrophobicContact CD2-CD1 4.34Å; L269-L277 HydrophobicContact CD2-CD2 3.58Å; L271-L277 HydrophobicContact CD1-CD1 3.63Å; L271-L277 HydrophobicContact CD1-CD2 3.94Å; L271-L277 HydrophobicContact CD1-CG 3.65Å; L271-L277 HydrophobicContact CD2-CD1 4.18Å; L277-T279 HydrophobicContact CB-CG2 4.45Å; L277-A292 CarbonylContact O-C 3.56Å; L277-A292 WeakPolarHBondContact O-CA 3.31Å; L277-T293 PolarHBondContact N-O 3.3Å; L277-T293 PolarHBondContact O-N 3.35Å; L277-A295 HydrophobicContact CD1-CB 4.45Å; L277-V298 HydrophobicContact CD1-CG2 4.2Å; L277-V343 HydrophobicContact CD2-CG1 4.35Å; L277-V344 WeakPolarHBondContact CD2-O 3.38Å; L277-A345 HydrophobicContact CD2-CB 3.8Å
278	F	94.1	Very high	89.4	Confident	13 Å²	13	38.8 Å²	38.8	6%	0.057	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	114.3	172.2	-61.7	-76.8	0	0	0	108.4	M232 F290 R291 L305 T337 V344 H354	M232-F278 HydrophobicContact CE-CD1 4.19Å; M232-F278 HydrophobicContact CE-CD2 3.87Å; M232-F278 HydrophobicContact CE-CE1 4.09Å; M232-F278 HydrophobicContact CE-CE2 3.77Å; M232-F278 HydrophobicContact CE-CG 4.07Å; M232-F278 HydrophobicContact CE-CZ 3.88Å; F278-F290 HydrophobicContact CB-CB 3.8Å; F278-F290 HydrophobicContact CB-CD1 4.37Å; F278-F290 WeakPolarHBondContact O-CD1 3.45Å; F278-R291 WeakPolarHBondContact CA-O 3.31Å; F278-L305 HydrophobicContact CB-CD1 4.08Å; F278-T337 HydrophobicContact CE2-CG2 3.83Å; F278-T337 HydrophobicContact CZ-CG2 3.78Å; F278-V344 HydrophobicContact CD2-CB 4.42Å; F278-V344 HydrophobicContact CD2-CG1 3.74Å; F278-V344 HydrophobicContact CE2-CG1 3.99Å; F278-H354 AromaticContact CZ-CE1 3.94Å; F278-H354 AromaticContact CZ-ND1 3.9Å
279	T	94.7	Very high	88.7	Confident	6 Å²	6	41.7 Å²	41.7	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149.9	-178.8	61.1	0	0	0	0	112.7	L277 F290 R291 T293 V298 Y303 V304	L277-T279 HydrophobicContact CB-CG2 4.45Å; T279-F290 VanDerWaalsContact C-CD1 3.45Å; T279-R291 PolarHBondContact N-O 3.06Å; T279-R291 PolarHBondContact O-N 3.17Å; T279-R291 PolarHBondContact OG1-O 3.4Å; T279-T293 VanDerWaalsContact OG1-CB 3.3Å; T279-T293 WeakPolarHBondContact OG1-CB 3.45Å; T279-T293 PolarHBondContact OG1-OG1 3.46Å; T279-V298 HydrophobicContact CG2-CG2 3.91Å; T279-Y303 CarbonylContact C-O 3.56Å; T279-Y303 WeakPolarHBondContact CA-O 3.48Å; T279-V304 HydrophobicContact CG2-CG1 4.17Å
280	A	93.8	Very high	88.4	Confident	10 Å²	10	42.3 Å²	42.3	8%	0.083	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154.1	168.4	0	0	0	0	0	110.9	N282 E285 F290 Y303	A280-N282 VanDerWaalsContact C-N 3.33Å; A280-E285 HydrophobicContact CB-CB 4.14Å; A280-E285 HydrophobicContact CB-CG 4.39Å; A280-F290 HydrophobicContact CB-CD1 3.82Å; A280-F290 HydrophobicContact CB-CD2 3.96Å; A280-F290 HydrophobicContact CB-CE1 3.63Å; A280-F290 HydrophobicContact CB-CE2 3.76Å; A280-F290 HydrophobicContact CB-CG 3.98Å; A280-F290 HydrophobicContact CB-CZ 3.58Å; A280-Y303 PolarHBondContact N-O 2.56Å; A280-Y303 PolarHBondContact O-N 3.15Å
281	D	90.9	Very high	88.1	Confident	131 Å²	131	51 Å²	51	70%	0.701	26%	0.261	S	S	*	.	S	Bend	trans	-84.6	-13	175	-58.5	-45.2	0	0	0	112.3	Q302	D281-Q302 PolarHBondContact OD1-NE2 2.78Å; D281-Q302 VanDerWaalsContact OD1-NE2 3.12Å
282	N	88.4	Confident	88	Confident	65 Å²	65	52.4 Å²	52.4	35%	0.348	27%	0.272	S	S	.	.	S	Bend	trans	-133.9	135.2	-178.3	-172.5	7.8	0	0	0	111.6	A280 T284 E285	A280-N282 VanDerWaalsContact C-N 3.33Å; N282-T284 VanDerWaalsContact C-N 3.26Å; N282-T284 PolarHBondContact ND2-OG1 2.89Å; N282-T284 PolarHBondContact O-N 3.37Å; N282-T284 PolarHBondContact OD1-N 3.2Å; N282-E285 HydrophobicContact CB-CG 4.3Å; N282-E285 PolarHBondContact O-N 3.39Å
283	H	85.4	Confident	88	Confident	105 Å²	105	53.6 Å²	53.6	49%	0.486	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.6	178.6	73.2	-65.6	0	0	0	115	E285 Y303 P314	H283-E285 VanDerWaalsContact C-N 3.33Å; H283-Y303 HydrophobicContact CB-CD1 3.86Å; H283-Y303 HydrophobicContact CB-CE1 3.5Å; H283-Y303 HydrophobicContact CB-CE2 4.22Å; H283-Y303 HydrophobicContact CB-CG 4.36Å; H283-P314 WeakPolarHBondContact O-CG 3.48Å
284	T	84.6	Confident	88.2	Confident	92 Å²	92	52.7 Å²	52.7	56%	0.564	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.2	179.7	60.2	0	0	0	0	113.4	N282	N282-T284 VanDerWaalsContact C-N 3.26Å; N282-T284 PolarHBondContact ND2-OG1 2.89Å; N282-T284 PolarHBondContact O-N 3.37Å; N282-T284 PolarHBondContact OD1-N 3.2Å
285	E	83.8	Confident	88.4	Confident	71 Å²	71	52.6 Å²	52.6	33%	0.332	27%	0.272	S	S	.	.	S	Bend	trans	-64.1	134.6	177.4	-74.1	-64.6	154.7	0	0	110.1	A280 N282 H283 R289 F290	A280-E285 HydrophobicContact CB-CB 4.14Å; A280-E285 HydrophobicContact CB-CG 4.39Å; N282-E285 HydrophobicContact CB-CG 4.3Å; N282-E285 PolarHBondContact O-N 3.39Å; H283-E285 VanDerWaalsContact C-N 3.33Å; E285-R289 WeakPolarHBondContact OE2-CD 3.4Å; E285-F290 HydrophobicContact CB-CE2 4.13Å; E285-F290 WeakPolarHBondContact O-CE2 3.19Å
286	P	82.1	Confident	88.2	Confident	68 Å²	68	54.5 Å²	54.5	44%	0.442	29%	0.286	S	S	.	.			trans	-60.3	145.6	171.8	-20.9	31.4	0	0	0	111	A288 R289 F290	P286-A288 PolarHBondContact O-N 3.04Å; P286-A288 VanDerWaalsContact O-N 3.09Å; P286-R289 PolarHBondContact O-N 2.76Å; P286-F290 WeakPolarHBondContact O-CD2 3.44Å
287	A	80.2	Confident	88	Confident	22 Å²	22	59.1 Å²	59.1	18%	0.182	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-51.2	-38.4	179.1	0	0	0	0	0	113.3	R289 F290 L305	A287-R289 PolarHBondContact O-N 2.82Å; A287-R289 VanDerWaalsContact O-N 3.17Å; A287-F290 WeakPolarHBondContact O-CB 3.2Å; A287-F290 PolarHBondContact O-N 2.86Å; A287-L305 HydrophobicContact CB-CD1 3.87Å; A287-L305 HydrophobicContact CB-CD2 3.89Å
288	A	77.3	Confident	87.9	Confident	70 Å²	70	59.4 Å²	59.4	58%	0.579	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-64.8	-14.7	177.4	0	0	0	0	0	114.9	P286	P286-A288 PolarHBondContact O-N 3.04Å; P286-A288 VanDerWaalsContact O-N 3.09Å
289	R	84	Confident	87.8	Confident	176 Å²	176	64.9 Å²	64.9	66%	0.664	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-100.4	-1.6	178	-69.1	-167.1	177	162.9	-0.1	113.9	E285 P286 A287 R291	E285-R289 WeakPolarHBondContact OE2-CD 3.4Å; P286-R289 PolarHBondContact O-N 2.76Å; A287-R289 PolarHBondContact O-N 2.82Å; A287-R289 VanDerWaalsContact O-N 3.17Å; R289-R291 PolarHBondContact O-N 3.45Å
290	F	90	Very high	87.7	Confident	14 Å²	14	68.5 Å²	68.5	6%	0.061	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-63.6	135.6	174.3	-81.7	-123.6	0	0	0	109.6	F278 T279 A280 E285 P286 A287 L305 P314	F278-F290 HydrophobicContact CB-CB 3.8Å; F278-F290 HydrophobicContact CB-CD1 4.37Å; F278-F290 WeakPolarHBondContact O-CD1 3.45Å; T279-F290 VanDerWaalsContact C-CD1 3.45Å; A280-F290 HydrophobicContact CB-CD1 3.82Å; A280-F290 HydrophobicContact CB-CD2 3.96Å; A280-F290 HydrophobicContact CB-CE1 3.63Å; A280-F290 HydrophobicContact CB-CE2 3.76Å; A280-F290 HydrophobicContact CB-CG 3.98Å; A280-F290 HydrophobicContact CB-CZ 3.58Å; E285-F290 HydrophobicContact CB-CE2 4.13Å; E285-F290 WeakPolarHBondContact O-CE2 3.19Å; P286-F290 WeakPolarHBondContact O-CD2 3.44Å; A287-F290 WeakPolarHBondContact O-CB 3.2Å; A287-F290 PolarHBondContact O-N 2.86Å; F290-L305 HydrophobicContact CB-CD1 4.22Å; F290-L305 HydrophobicContact CD1-CD1 4.07Å; F290-L305 HydrophobicContact CD1-CD2 4.07Å; F290-L305 HydrophobicContact CD1-CG 3.6Å; F290-L305 HydrophobicContact CD2-CD1 4.32Å; F290-L305 HydrophobicContact CD2-CD2 4.1Å; F290-L305 HydrophobicContact CD2-CG 4.28Å; F290-L305 HydrophobicContact CE1-CD2 3.76Å; F290-L305 HydrophobicContact CE1-CG 3.69Å; F290-L305 HydrophobicContact CE2-CD2 3.79Å; F290-L305 HydrophobicContact CE2-CG 4.36Å; F290-L305 HydrophobicContact CG-CD1 3.94Å; F290-L305 HydrophobicContact CG-CD2 4.24Å; F290-L305 HydrophobicContact CG-CG 3.93Å; F290-L305 HydrophobicContact CZ-CD2 3.62Å; F290-L305 HydrophobicContact CZ-CG 4.09Å; F290-P314 HydrophobicContact CE2-CG 4.32Å; F290-P314 HydrophobicContact CZ-CB 3.97Å; F290-P314 HydrophobicContact CZ-CG 3.81Å
291	R	90.7	Very high	87.7	Confident	196 Å²	196	69.3 Å²	69.3	74%	0.74	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	140.5	-177.4	-62.8	-178.3	-179	-162.4	0.6	109.7	F278 T279 R289 T293	F278-R291 WeakPolarHBondContact CA-O 3.31Å; T279-R291 PolarHBondContact N-O 3.06Å; T279-R291 PolarHBondContact O-N 3.17Å; T279-R291 PolarHBondContact OG1-O 3.4Å; R289-R291 PolarHBondContact O-N 3.45Å; R291-T293 PolarHBondContact O-N 3.07Å
292	A	91.1	Very high	87.9	Confident	28 Å²	28	64.6 Å²	64.6	23%	0.231	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	118.6	169.8	0	0	0	0	0	109.3	L276 L277 H354	L276-A292 HydrophobicContact CD1-CB 4.24Å; L276-A292 HydrophobicContact CD2-CB 4.32Å; L277-A292 CarbonylContact O-C 3.56Å; L277-A292 WeakPolarHBondContact O-CA 3.31Å; A292-H354 HydrophobicContact CB-CB 3.86Å
293	T	90.1	Very high	88.3	Confident	28 Å²	28	63.7 Å²	63.7	17%	0.172	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.9	-177	-59.4	0	0	0	0	108.8	L276 L277 T279 R291 H297 V298	L276-T293 WeakPolarHBondContact CA-O 3.26Å; L277-T293 PolarHBondContact N-O 3.3Å; L277-T293 PolarHBondContact O-N 3.35Å; T279-T293 VanDerWaalsContact OG1-CB 3.3Å; T279-T293 WeakPolarHBondContact OG1-CB 3.45Å; T279-T293 PolarHBondContact OG1-OG1 3.46Å; R291-T293 PolarHBondContact O-N 3.07Å; T293-H297 HydrophobicContact CG2-CB 3.75Å; T293-V298 HydrophobicContact CG2-CG2 4.49Å
294	F	89	Confident	88.8	Confident	9 Å²	9	58.7 Å²	58.7	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	141.1	173.7	-64.3	-61.6	0	0	0	110.8	A274 H275 L276 S296 H297 V298 A352 H402	A274-F294 VanDerWaalsContact O-CD1 3.28Å; A274-F294 WeakPolarHBondContact O-CD1 3.3Å; H275-F294 CarbonylContact O-C 3.52Å; L276-F294 HydrophobicContact CD2-CD1 3.54Å; L276-F294 HydrophobicContact CD2-CE1 3.64Å; L276-F294 HydrophobicContact CD2-CG 4.18Å; L276-F294 HydrophobicContact CD2-CZ 4.38Å; L276-F294 HydrophobicContact CG-CD1 4.32Å; L276-F294 HydrophobicContact CG-CE1 4.3Å; F294-S296 PolarHBondContact O-N 3.44Å; F294-S296 VanDerWaalsContact O-N 3.09Å; F294-H297 PolarHBondContact O-N 3.16Å; F294-V298 PolarHBondContact O-N 3.25Å; F294-A352 HydrophobicContact CE2-CB 3.72Å; F294-A352 HydrophobicContact CZ-CB 3.83Å; F294-H402 HydrophobicContact CD1-CB 4.03Å; F294-H402 AromaticContact CD1-CD2 3.84Å; F294-H402 HydrophobicContact CD2-CB 4.2Å; F294-H402 AromaticContact CD2-CD2 3.46Å; F294-H402 VanDerWaalsContact CD2-CD2 3.46Å; F294-H402 WeakPolarHBondContact CD2-CD2 3.43Å; F294-H402 HydrophobicContact CE1-CB 3.71Å; F294-H402 HydrophobicContact CE2-CB 3.84Å; F294-H402 AromaticContact CE2-CD2 3.99Å; F294-H402 HydrophobicContact CG-CB 4.26Å; F294-H402 AromaticContact CG-CD2 3.35Å; F294-H402 WeakPolarHBondContact CG-CD2 3.33Å; F294-H402 HydrophobicContact CZ-CB 3.58Å
295	A	90.3	Very high	89.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-51	-37.8	177.4	0	0	0	0	0	112.1	Q258 L271 P273 H275 L277 H297 V298	Q258-A295 PolarHBondContact NE2-O 3.06Å; Q258-A295 VanDerWaalsContact NE2-O 3.08Å; Q258-A295 PolarHBondContact OE1-O 3.37Å; L271-A295 HydrophobicContact CD1-CB 4.01Å; L271-A295 HydrophobicContact CD2-CB 3.97Å; L271-A295 HydrophobicContact CG-CB 3.82Å; P273-A295 PolarHBondContact O-N 3.46Å; H275-A295 PolarHBondContact O-N 3.49Å; L277-A295 HydrophobicContact CD1-CB 4.45Å; A295-H297 PolarHBondContact O-N 3Å; A295-V298 WeakPolarHBondContact O-CB 3.46Å; A295-V298 PolarHBondContact O-N 3.17Å; A295-V298 VanDerWaalsContact O-N 3.13Å
296	S	86.6	Confident	89.8	Confident	40 Å²	40	51 Å²	51	28%	0.28	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-61.1	-26.1	177.9	64.4	0	0	0	0	114.2	P273 F294 H402	P273-S296 WeakPolarHBondContact O-CB 3.45Å; P273-S296 PolarHBondContact O-N 2.91Å; P273-S296 PolarHBondContact O-OG 2.92Å; F294-S296 PolarHBondContact O-N 3.44Å; F294-S296 VanDerWaalsContact O-N 3.09Å; S296-H402 WeakPolarHBondContact CB-NE2 3.43Å; S296-H402 PolarHBondContact OG-NE2 2.9Å
297	H	87	Confident	90.3	Very high	98 Å²	98	48.1 Å²	48.1	45%	0.454	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-97	-5.7	-178.6	-64.4	174.9	0	0	0	112.5	T293 F294 A295 Q299	T293-H297 HydrophobicContact CG2-CB 3.75Å; F294-H297 PolarHBondContact O-N 3.16Å; A295-H297 PolarHBondContact O-N 3Å; H297-Q299 PolarHBondContact O-N 3.46Å
298	V	91.9	Very high	90.4	Very high	6 Å²	6	48.3 Å²	48.3	4%	0.036	25%	0.254	C	S	.	.			trans	-68.4	130.2	175.5	-179	0	0	0	0	109.4	I260 L277 T279 T293 F294 A295 V317	I260-V298 HydrophobicContact CD1-CB 4.08Å; I260-V298 HydrophobicContact CD1-CG1 4.07Å; I260-V298 HydrophobicContact CD1-CG2 4.02Å; I260-V298 HydrophobicContact CG1-CG1 4.48Å; L277-V298 HydrophobicContact CD1-CG2 4.2Å; T279-V298 HydrophobicContact CG2-CG2 3.91Å; T293-V298 HydrophobicContact CG2-CG2 4.49Å; F294-V298 PolarHBondContact O-N 3.25Å; A295-V298 WeakPolarHBondContact O-CB 3.46Å; A295-V298 PolarHBondContact O-N 3.17Å; A295-V298 VanDerWaalsContact O-N 3.13Å; V298-V317 HydrophobicContact CG1-CG1 4.27Å; V298-V317 HydrophobicContact CG1-CG2 3.94Å
299	Q	91.1	Very high	90.3	Very high	128 Å²	128	51.6 Å²	51.6	60%	0.598	27%	0.267	S	S	*	.			trans	-118.5	147.3	-179.2	-63.7	-178.2	3.2	0	0	111.6	H297 G301 Q302	H297-Q299 PolarHBondContact O-N 3.46Å; Q299-G301 PolarHBondContact O-N 3.17Å; Q299-Q302 HydrophobicContact CB-CG 4.48Å; Q299-Q302 WeakPolarHBondContact O-CB 3.07Å; Q299-Q302 PolarHBondContact O-N 2.89Å
300	P	94	Very high	89.5	Confident	81 Å²	81	50 Å²	50	53%	0.526	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	137.6	167	-25.6	35.3	0	0	0	111.6	V317 V320	P300-V317 WeakPolarHBondContact CA-O 3.43Å; P300-V320 HydrophobicContact CG-CG2 4.3Å
301	G	93.2	Very high	89.3	Confident	28 Å²	28	50.2 Å²	50.2	29%	0.289	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	-23.9	-175.3	0	0	0	0	0	114.8	Q299 V317	Q299-G301 PolarHBondContact O-N 3.17Å; G301-V317 PolarHBondContact N-O 3.22Å
302	Q	94.9	Very high	89.3	Confident	31 Å²	31	42.3 Å²	42.3	15%	0.145	26%	0.257	C	S	.	.			trans	-72.2	169.8	172.1	-62.9	-171.9	-60.3	0	0	111.4	D281 Q299 R316 V317	D281-Q302 PolarHBondContact OD1-NE2 2.78Å; D281-Q302 VanDerWaalsContact OD1-NE2 3.12Å; Q299-Q302 HydrophobicContact CB-CG 4.48Å; Q299-Q302 WeakPolarHBondContact O-CB 3.07Å; Q299-Q302 PolarHBondContact O-N 2.89Å; Q302-R316 CarbonylContact O-C 3.25Å; Q302-R316 WeakPolarHBondContact O-CA 3.43Å; Q302-V317 WeakPolarHBondContact O-CB 3.5Å; Q302-V317 WeakPolarHBondContact O-CG2 3.49Å; Q302-V317 PolarHBondContact O-N 2.92Å
303	Y	96.1	Very high	89.4	Confident	47 Å²	47	44.7 Å²	44.7	18%	0.184	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.4	178.2	-66.3	-94.1	0	0	0	110.9	T279 A280 H283 P314 A315 R316	T279-Y303 CarbonylContact C-O 3.56Å; T279-Y303 WeakPolarHBondContact CA-O 3.48Å; A280-Y303 PolarHBondContact N-O 2.56Å; A280-Y303 PolarHBondContact O-N 3.15Å; H283-Y303 HydrophobicContact CB-CD1 3.86Å; H283-Y303 HydrophobicContact CB-CE1 3.5Å; H283-Y303 HydrophobicContact CB-CE2 4.22Å; H283-Y303 HydrophobicContact CB-CG 4.36Å; Y303-P314 HydrophobicContact CD1-CB 4.07Å; Y303-P314 HydrophobicContact CG-CB 4.49Å; Y303-A315 CarbonylContact C-O 3.47Å; Y303-A315 VanDerWaalsContact CA-O 3.29Å; Y303-A315 WeakPolarHBondContact CA-O 3.38Å; Y303-R316 HydrophobicContact CD1-CB 4.02Å; Y303-R316 HydrophobicContact CE1-CB 3.65Å; Y303-R316 HydrophobicContact CE1-CG 4.23Å
304	V	96.5	Very high	89.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	158.7	170.1	-66.2	0	0	0	0	109.9	T262 T279 V306 P314 A315 V317 V343	T262-V304 HydrophobicContact CG2-CG2 3.38Å; T279-V304 HydrophobicContact CG2-CG1 4.17Å; V304-V306 HydrophobicContact CG2-CG1 4.31Å; V304-P314 CarbonylContact O-C 3.43Å; V304-P314 WeakPolarHBondContact O-CA 3.33Å; V304-A315 PolarHBondContact N-O 3.1Å; V304-A315 PolarHBondContact O-N 3.43Å; V304-V317 HydrophobicContact CG1-CG2 3.85Å; V304-V317 HydrophobicContact CG2-CG2 4.34Å; V304-V343 HydrophobicContact CB-CG1 4.39Å; V304-V343 HydrophobicContact CG2-CG1 4.22Å
305	L	94.8	Very high	89.8	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	128.7	176.4	-67.3	171.5	0	0	0	110.7	M232 F278 A287 F290 P314 V344	M232-L305 HydrophobicContact CE-CD1 4.37Å; M232-L305 HydrophobicContact SD-CD1 3.66Å; F278-L305 HydrophobicContact CB-CD1 4.08Å; A287-L305 HydrophobicContact CB-CD1 3.87Å; A287-L305 HydrophobicContact CB-CD2 3.89Å; F290-L305 HydrophobicContact CB-CD1 4.22Å; F290-L305 HydrophobicContact CD1-CD1 4.07Å; F290-L305 HydrophobicContact CD1-CD2 4.07Å; F290-L305 HydrophobicContact CD1-CG 3.6Å; F290-L305 HydrophobicContact CD2-CD1 4.32Å; F290-L305 HydrophobicContact CD2-CD2 4.1Å; F290-L305 HydrophobicContact CD2-CG 4.28Å; F290-L305 HydrophobicContact CE1-CD2 3.76Å; F290-L305 HydrophobicContact CE1-CG 3.69Å; F290-L305 HydrophobicContact CE2-CD2 3.79Å; F290-L305 HydrophobicContact CE2-CG 4.36Å; F290-L305 HydrophobicContact CG-CD1 3.94Å; F290-L305 HydrophobicContact CG-CD2 4.24Å; F290-L305 HydrophobicContact CG-CG 3.93Å; F290-L305 HydrophobicContact CZ-CD2 3.62Å; F290-L305 HydrophobicContact CZ-CG 4.09Å; L305-P314 HydrophobicContact CD2-CG 4.47Å; L305-V344 HydrophobicContact CB-CB 3.96Å; L305-V344 HydrophobicContact CB-CG2 3.71Å; L305-V344 PolarHBondContact O-N 2.9Å
306	V	95.1	Very high	90.1	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.8	175.4	-54.1	0	0	0	0	111.5	P265 R267 V304 G308 L312 Q313 A315 D342 V343	P265-V306 HydrophobicContact CG-CG2 3.65Å; R267-V306 HydrophobicContact CG-CB 4.33Å; R267-V306 HydrophobicContact CG-CG1 4.05Å; V304-V306 HydrophobicContact CG2-CG1 4.31Å; V306-G308 PolarHBondContact O-N 3.21Å; V306-L312 WeakPolarHBondContact O-CA 3.43Å; V306-Q313 HydrophobicContact CG2-CG 3.71Å; V306-Q313 WeakPolarHBondContact CG2-O 3.44Å; V306-Q313 PolarHBondContact N-O 3.03Å; V306-Q313 PolarHBondContact O-N 2.94Å; V306-A315 HydrophobicContact CB-CB 4.3Å; V306-A315 HydrophobicContact CG1-CB 3.51Å; V306-A315 HydrophobicContact CG2-CB 3.75Å; V306-D342 CarbonylContact C-O 3.57Å; V306-D342 WeakPolarHBondContact CA-O 3.2Å; V306-D342 WeakPolarHBondContact CB-O 3.48Å; V306-V343 HydrophobicContact CG1-CG2 4.1Å
307	A	92.4	Very high	90.6	Very high	8 Å²	8	48.2 Å²	48.2	7%	0.066	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	121.8	171.8	0	0	0	0	0	110.5	L230 L312 V339 D342	L230-A307 HydrophobicContact CD2-CB 3.95Å; A307-L312 HydrophobicContact CB-CD2 4.1Å; A307-V339 HydrophobicContact CB-CG1 3.99Å; A307-D342 HydrophobicContact CB-CB 4.29Å; A307-D342 PolarHBondContact N-O 3.04Å
308	G	81.8	Confident	91.1	Very high	25 Å²	25	45.7 Å²	45.7	26%	0.258	27%	0.269	S	S	.	.			trans	-137.2	-162.1	174.8	0	0	0	0	0	111.6	V306 G311	V306-G308 PolarHBondContact O-N 3.21Å; G308-G311 CarbonylContact C-O 3.41Å; G308-G311 VanDerWaalsContact C-O 3.25Å; G308-G311 WeakPolarHBondContact CA-O 3.5Å; G308-G311 PolarHBondContact N-O 2.96Å; G308-G311 PolarHBondContact O-N 3.44Å; G308-G311 VanDerWaalsContact O-O 3.04Å
309	V	75.9	Confident	91.1	Very high	140 Å²	140	47 Å²	47	85%	0.848	28%	0.28	S	S	*	.	S	Bend	trans	-117.8	125.2	175.3	-178.1	0	0	0	0	107.2
310	P	67.9	Low	91.1	Very high	142 Å²	142	43.1 Å²	43.1	92%	0.922	27%	0.265	S	S	*	.	S	Bend	cis	-97.4	29.2	10.1	38.9	-35.1	0	0	0	114.9
311	G	85.7	Confident	90.7	Very high	19 Å²	19	41.8 Å²	41.8	20%	0.196	26%	0.258	C	S	.	.	S	Bend	trans	173.1	-154.6	179.5	0	0	0	0	0	115	G308	G308-G311 CarbonylContact C-O 3.41Å; G308-G311 VanDerWaalsContact C-O 3.25Å; G308-G311 WeakPolarHBondContact CA-O 3.5Å; G308-G311 PolarHBondContact N-O 2.96Å; G308-G311 PolarHBondContact O-N 3.44Å; G308-G311 VanDerWaalsContact O-O 3.04Å
312	L	90.8	Very high	90.2	Very high	30 Å²	30	45.1 Å²	45.1	16%	0.157	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.1	171.9	-61	-178.5	0	0	0	109.5	M232 P238 V306 A307 V344	M232-L312 HydrophobicContact CB-CD1 3.91Å; M232-L312 HydrophobicContact CG-CD1 3.55Å; M232-L312 HydrophobicContact SD-CD1 3.69Å; P238-L312 HydrophobicContact CB-CD2 4.49Å; P238-L312 HydrophobicContact CB-CG 4.3Å; V306-L312 WeakPolarHBondContact O-CA 3.43Å; A307-L312 HydrophobicContact CB-CD2 4.1Å; L312-V344 HydrophobicContact CD1-CG2 3.96Å; L312-V344 HydrophobicContact CD2-CG2 3.67Å; L312-V344 HydrophobicContact CG-CG2 4.41Å
313	Q	91.7	Very high	89.7	Confident	77 Å²	77	47.6 Å²	47.6	36%	0.36	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150	178	64.2	-174.6	-17.8	0	0	110.7	V306	V306-Q313 HydrophobicContact CG2-CG 3.71Å; V306-Q313 WeakPolarHBondContact CG2-O 3.44Å; V306-Q313 PolarHBondContact N-O 3.03Å; V306-Q313 PolarHBondContact O-N 2.94Å
314	P	93.6	Very high	89.1	Confident	39 Å²	39	49.6 Å²	49.6	25%	0.253	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	134	171.8	-24.7	39.2	0	0	0	111.5	H283 F290 Y303 V304 L305	H283-P314 WeakPolarHBondContact O-CG 3.48Å; F290-P314 HydrophobicContact CE2-CG 4.32Å; F290-P314 HydrophobicContact CZ-CB 3.97Å; F290-P314 HydrophobicContact CZ-CG 3.81Å; Y303-P314 HydrophobicContact CD1-CB 4.07Å; Y303-P314 HydrophobicContact CG-CB 4.49Å; V304-P314 CarbonylContact O-C 3.43Å; V304-P314 WeakPolarHBondContact O-CA 3.33Å; L305-P314 HydrophobicContact CD2-CG 4.47Å
315	A	95.1	Very high	88.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.8	170.4	0	0	0	0	0	109.6	T262 Y303 V304 V306	T262-A315 HydrophobicContact CG2-CB 4.05Å; Y303-A315 CarbonylContact C-O 3.47Å; Y303-A315 VanDerWaalsContact CA-O 3.29Å; Y303-A315 WeakPolarHBondContact CA-O 3.38Å; V304-A315 PolarHBondContact N-O 3.1Å; V304-A315 PolarHBondContact O-N 3.43Å; V306-A315 HydrophobicContact CB-CB 4.3Å; V306-A315 HydrophobicContact CG1-CB 3.51Å; V306-A315 HydrophobicContact CG2-CB 3.75Å
316	R	96.6	Very high	88.5	Confident	111 Å²	111	54.6 Å²	54.6	42%	0.419	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	133.2	-177.4	-176.8	178.6	178.5	-176.3	1.3	109.8	T262 Q263 Q302 Y303 A318	T262-R316 CarbonylContact C-O 3.46Å; T262-R316 WeakPolarHBondContact CA-O 3.27Å; T262-R316 WeakPolarHBondContact CB-O 3.11Å; Q263-R316 HydrophobicContact CG-CB 3.81Å; Q263-R316 HydrophobicContact CG-CG 4.24Å; Q263-R316 PolarHBondContact N-O 3.18Å; Q263-R316 PolarHBondContact O-N 3.34Å; Q302-R316 CarbonylContact O-C 3.25Å; Q302-R316 WeakPolarHBondContact O-CA 3.43Å; Y303-R316 HydrophobicContact CD1-CB 4.02Å; Y303-R316 HydrophobicContact CE1-CB 3.65Å; Y303-R316 HydrophobicContact CE1-CG 4.23Å; R316-A318 PolarHBondContact O-N 3.2Å
317	V	97.5	Very high	88.2	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	116.4	172.7	-179	0	0	0	0	108.6	I260 V298 P300 G301 Q302 V304 V320	I260-V317 HydrophobicContact CG2-CG1 3.99Å; I260-V317 HydrophobicContact CG2-CG2 4.03Å; V298-V317 HydrophobicContact CG1-CG1 4.27Å; V298-V317 HydrophobicContact CG1-CG2 3.94Å; P300-V317 WeakPolarHBondContact CA-O 3.43Å; G301-V317 PolarHBondContact N-O 3.22Å; Q302-V317 WeakPolarHBondContact O-CB 3.5Å; Q302-V317 WeakPolarHBondContact O-CG2 3.49Å; Q302-V317 PolarHBondContact O-N 2.92Å; V304-V317 HydrophobicContact CG1-CG2 3.85Å; V304-V317 HydrophobicContact CG2-CG2 4.34Å; V317-V320 HydrophobicContact CG1-CG2 3.84Å
318	A	96.6	Very high	88	Confident	46 Å²	46	54.2 Å²	54.2	38%	0.38	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-44	179.1	0	0	0	0	0	111.3	E261 Q263 R316	E261-A318 PolarHBondContact O-N 3.16Å; Q263-A318 HydrophobicContact CB-CB 4.12Å; Q263-A318 HydrophobicContact CG-CB 4.16Å; R316-A318 PolarHBondContact O-N 3.2Å
319	A	92.3	Very high	88.5	Confident	33 Å²	33	53.4 Å²	53.4	27%	0.273	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	153	-177.3	0	0	0	0	0	112.1	E261	E261-A319 HydrophobicContact CB-CB 4.34Å; E261-A319 PolarHBondContact N-O 3.2Å; E261-A319 PolarHBondContact O-N 3.19Å
320	V	91.8	Very high	89.2	Confident	47 Å²	47	46.9 Å²	46.9	29%	0.285	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	121.6	174.2	-178.2	0	0	0	0	108	Q258 V259 P300 V317	Q258-V320 HydrophobicContact CG-CG1 3.78Å; V259-V320 CarbonylContact O-C 3.39Å; V259-V320 WeakPolarHBondContact O-CA 3.2Å; P300-V320 HydrophobicContact CG-CG2 4.3Å; V317-V320 HydrophobicContact CG1-CG2 3.84Å
321	S	84.9	Confident	90.4	Very high	52 Å²	52	40.2 Å²	40.2	36%	0.364	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	-174.1	-177.4	68	0	0	0	0	111.4	Q258 V259	Q258-S321 CarbonylContact C-O 3.5Å; Q258-S321 WeakPolarHBondContact CA-O 3.22Å; V259-S321 PolarHBondContact N-O 2.62Å; V259-S321 PolarHBondContact O-N 3.46Å
322	T	82.7	Confident	90.7	Very high	98 Å²	98	39.4 Å²	39.4	60%	0.601	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.5	178.3	-57.2	0	0	0	0	109.6	A256 F257	A256-T322 HydrophobicContact CB-CG2 4.24Å; F257-T322 CarbonylContact O-C 3.52Å; F257-T322 VanDerWaalsContact O-CA 3.27Å; F257-T322 WeakPolarHBondContact O-CA 3.45Å; F257-T322 WeakPolarHBondContact O-CG2 3.43Å
323	H	84.9	Confident	90.7	Very high	84 Å²	84	38 Å²	38	39%	0.389	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	133.5	-178.5	179.1	-99.3	0	0	0	110.5	F257 V259	F257-H323 WeakPolarHBondContact CB-O 3.29Å; F257-H323 PolarHBondContact N-O 3.25Å; F257-H323 PolarHBondContact O-N 3.35Å; V259-H323 HydrophobicContact CG2-CB 3.4Å; V259-H323 VanDerWaalsContact CG2-CB 3.4Å
324	V	82.4	Confident	90.7	Very high	89 Å²	89	41.3 Å²	41.3	54%	0.539	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.5	175.1	178.7	0	0	0	0	109	L254 R255 A256	L254-V324 HydrophobicContact CB-CG1 4.2Å; L254-V324 HydrophobicContact CD2-CG1 4.43Å; R255-V324 CarbonylContact O-C 3.55Å; R255-V324 VanDerWaalsContact O-CA 3.3Å; R255-V324 WeakPolarHBondContact O-CA 3.3Å; A256-V324 HydrophobicContact CB-CG2 4.38Å
325	A	88	Confident	90.6	Very high	16 Å²	16	42.2 Å²	42.2	13%	0.132	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	160.4	178.9	0	0	0	0	0	111.6	P205 R255 F257	P205-A325 HydrophobicContact CB-CB 3.66Å; P205-A325 HydrophobicContact CG-CB 4.45Å; R255-A325 PolarHBondContact N-O 2.87Å; R255-A325 PolarHBondContact O-N 3.27Å; F257-A325 HydrophobicContact CD2-CB 3.8Å; F257-A325 HydrophobicContact CE2-CB 3.89Å
326	L	90.9	Very high	90.4	Very high	89 Å²	89	42.2 Å²	42.2	47%	0.466	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	139.9	178.4	-171.4	70.8	0	0	0	111.3	A206 L254	A206-L326 VanDerWaalsContact CB-O 3.25Å; A206-L326 WeakPolarHBondContact CB-O 3.33Å; A206-L326 PolarHBondContact N-O 2.89Å; L254-L326 HydrophobicContact CD2-CB 4.11Å; L254-L326 HydrophobicContact CD2-CD1 3.96Å; L254-L326 HydrophobicContact CG-CD1 4.28Å
327	G	87.8	Confident	90.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.9	150.8	173.2	0	0	0	0	0	113.5	P205 E250 R253 F257	P205-G327 WeakPolarHBondContact CA-O 3.36Å; E250-G327 CarbonylContact O-C 3.5Å; E250-G327 WeakPolarHBondContact O-CA 3.35Å; R253-G327 PolarHBondContact O-N 2.75Å; F257-G327 VanDerWaalsContact CZ-O 3.29Å; F257-G327 WeakPolarHBondContact CZ-O 3.42Å
328	A	89.1	Confident	90.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	119.9	173.1	0	0	0	0	0	109.8	C203 R249 E250	C203-A328 HydrophobicContact CB-CB 3.92Å; R249-A328 CarbonylContact C-O 3.51Å; R249-A328 WeakPolarHBondContact CA-O 3.48Å; E250-A328 HydrophobicContact CB-CB 4.13Å; E250-A328 PolarHBondContact N-O 3.4Å; E250-A328 PolarHBondContact O-N 3.5Å
329	Y	91.7	Very high	90.2	Very high	9 Å²	9	35 Å²	35	4%	0.035	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125.6	-177	-69.9	-101.7	0	0	0	110.4	C203 F204 A206 L220 S221 F246 R249 P251 P331	C203-Y329 WeakPolarHBondContact CA-O 3.42Å; F204-Y329 PolarHBondContact N-O 2.82Å; F204-Y329 PolarHBondContact O-N 2.78Å; A206-Y329 HydrophobicContact CB-CD2 4.3Å; A206-Y329 HydrophobicContact CB-CE2 3.71Å; L220-Y329 HydrophobicContact CG-CG 4.48Å; S221-Y329 WeakPolarHBondContact CB-OH 3.39Å; F246-Y329 AromaticContact CD1-CD1 3.95Å; F246-Y329 HydrophobicContact CD1-CD1 3.95Å; F246-Y329 AromaticContact CE1-CD1 3.7Å; F246-Y329 HydrophobicContact CE1-CD1 3.7Å; F246-Y329 HydrophobicContact CE1-CG 4.42Å; F246-Y329 HydrophobicContact CZ-CD1 4.42Å; R249-Y329 HydrophobicContact CG-CD1 4.12Å; R249-Y329 HydrophobicContact CG-CE1 3.84Å; P251-Y329 WeakPolarHBondContact CB-OH 3.48Å; Y329-P331 WeakPolarHBondContact O-CD 3.35Å
330	A	91.8	Very high	90.4	Very high	3 Å²	3	33.5 Å²	33.5	3%	0.025	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	80.3	176.5	0	0	0	0	0	110.3	G202 F246 L247 D248	G202-A330 WeakPolarHBondContact O-CB 3.46Å; F246-A330 CarbonylContact C-O 3.52Å; F246-A330 WeakPolarHBondContact CA-O 3.25Å; L247-A330 HydrophobicContact CB-CB 4.1Å; L247-A330 PolarHBondContact N-O 3.17Å; D248-A330 HydrophobicContact CB-CB 3.85Å; D248-A330 PolarHBondContact O-N 3.05Å
331	P	92.4	Very high	90.7	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.013	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.3	179.3	30.9	-37.8	0	0	0	111.6	L220 F246 Y329 L338 C347	L220-P331 HydrophobicContact CD1-CG 4.16Å; L220-P331 HydrophobicContact CD2-CG 4.45Å; F246-P331 HydrophobicContact CD1-CB 4.16Å; F246-P331 HydrophobicContact CE1-CB 3.93Å; Y329-P331 WeakPolarHBondContact O-CD 3.35Å; P331-L338 HydrophobicContact CB-CD2 4.3Å; P331-L338 HydrophobicContact CG-CD2 3.35Å; P331-C347 WeakPolarHBondContact O-CB 3.34Å; P331-C347 PolarHBondContact O-SG 3.18Å
332	L	91.1	Very high	91.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.8	168.7	178.1	63.9	0	0	0	109.7	L244 I245 L247 C347 F348 F361 L364 R365	L244-L332 WeakPolarHBondContact CB-O 3.37Å; L244-L332 PolarHBondContact N-O 3.12Å; I245-L332 HydrophobicContact CD1-CD2 4.3Å; I245-L332 HydrophobicContact CG1-CB 3.98Å; I245-L332 HydrophobicContact CG1-CD2 4.1Å; I245-L332 PolarHBondContact O-N 3.44Å; L247-L332 HydrophobicContact CD1-CB 4.32Å; L247-L332 HydrophobicContact CD2-CB 4.06Å; L247-L332 HydrophobicContact CD2-CD2 4.06Å; L247-L332 HydrophobicContact CG-CB 3.97Å; L332-C347 HydrophobicContact CD1-CB 4.08Å; L332-F348 HydrophobicContact CD1-CE1 3.67Å; L332-F348 HydrophobicContact CD1-CZ 3.93Å; L332-F361 HydrophobicContact CD2-CD1 4.23Å; L332-L364 HydrophobicContact CD2-CD2 4.1Å; L332-R365 HydrophobicContact CD2-CG 4.33Å
333	T	92.7	Very high	91.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	161.8	172.5	69.7	0	0	0	0	111.4	V229 S241 D242 V243 H335 G336 T337 L338 C347	V229-T333 HydrophobicContact CG2-CG2 3.8Å; S241-T333 WeakPolarHBondContact OG-CB 3.36Å; D242-T333 CarbonylContact O-C 3.57Å; D242-T333 WeakPolarHBondContact O-CA 3.42Å; V243-T333 HydrophobicContact CG2-CG2 4.49Å; T333-H335 VanDerWaalsContact C-N 3.3Å; T333-H335 PolarHBondContact O-N 3.44Å; T333-G336 PolarHBondContact O-N 2.86Å; T333-G336 VanDerWaalsContact O-N 3.1Å; T333-G336 PolarHBondContact OG1-N 3.28Å; T333-G336 VanDerWaalsContact OG1-N 3.13Å; T333-T337 WeakPolarHBondContact CG2-O 3.07Å; T333-T337 PolarHBondContact OG1-N 2.8Å; T333-T337 PolarHBondContact OG1-O 3.14Å; T333-L338 HydrophobicContact CG2-CB 4.42Å; T333-L338 HydrophobicContact CG2-CD1 4.22Å; T333-C347 PolarHBondContact N-SG 3.18Å; T333-C347 PolarHBondContact OG1-SG 2.59Å
334	R	90.7	Very high	92.4	Very high	148 Å²	148	23.6 Å²	23.6	56%	0.558	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-42.4	173.6	-171	175.9	-175.9	177.6	0.3	113.2	S241 D242 L244 G336 R365	S241-R334 WeakPolarHBondContact OG-CB 3.37Å; S241-R334 PolarHBondContact OG-N 3.29Å; D242-R334 PolarHBondContact O-N 3.32Å; L244-R334 HydrophobicContact CD2-CB 4.49Å; R334-G336 VanDerWaalsContact C-N 3.3Å; R334-G336 PolarHBondContact O-N 3.24Å; R334-R365 WeakPolarHBondContact O-CD 3.09Å; R334-R365 PolarHBondContact O-NH1 3.39Å
335	H	90.9	Very high	93	Very high	58 Å²	58	19.4 Å²	19.4	27%	0.269	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.7	178.5	-69.4	83	0	0	0	113.7	S241 T333 T337 Q358	S241-H335 WeakPolarHBondContact CB-ND1 3.01Å; S241-H335 PolarHBondContact OG-N 3.5Å; S241-H335 VanDerWaalsContact OG-N 3.11Å; S241-H335 PolarHBondContact OG-ND1 3.41Å; T333-H335 VanDerWaalsContact C-N 3.3Å; T333-H335 PolarHBondContact O-N 3.44Å; H335-T337 PolarHBondContact O-N 3.04Å; H335-Q358 PolarHBondContact O-NE2 2.81Å
336	G	90.6	Very high	93.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	71.3	10.3	-178.2	0	0	0	0	0	114.3	T333 R334 S346 C347 H354	T333-G336 PolarHBondContact O-N 2.86Å; T333-G336 VanDerWaalsContact O-N 3.1Å; T333-G336 PolarHBondContact OG1-N 3.28Å; T333-G336 VanDerWaalsContact OG1-N 3.13Å; R334-G336 VanDerWaalsContact C-N 3.3Å; R334-G336 PolarHBondContact O-N 3.24Å; G336-S346 PolarHBondContact O-OG 3.22Å; G336-C347 VanDerWaalsContact C-SG 3.57Å; G336-C347 WeakPolarHBondContact O-CB 3.41Å; G336-C347 PolarHBondContact O-N 3.49Å; G336-H354 PolarHBondContact O-CE1 2.92Å
337	T	94.5	Very high	93.3	Very high	3 Å²	3	14.7 Å²	14.7	2%	0.018	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.9	175.8	64.3	0	0	0	0	110	A231 M232 F278 T333 H335 A345	A231-T337 WeakPolarHBondContact CB-O 2.94Å; M232-T337 HydrophobicContact CE-CG2 4.43Å; M232-T337 PolarHBondContact N-OG1 3.34Å; M232-T337 PolarHBondContact O-OG1 3.01Å; F278-T337 HydrophobicContact CE2-CG2 3.83Å; F278-T337 HydrophobicContact CZ-CG2 3.78Å; T333-T337 WeakPolarHBondContact CG2-O 3.07Å; T333-T337 PolarHBondContact OG1-N 2.8Å; T333-T337 PolarHBondContact OG1-O 3.14Å; H335-T337 PolarHBondContact O-N 3.04Å; T337-A345 CarbonylContact C-O 3.4Å; T337-A345 WeakPolarHBondContact CA-O 3.38Å
338	L	95.8	Very high	93.3	Very high	2 Å²	2	15 Å²	15	1%	0.01	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.9	179.2	179.4	65.1	0	0	0	109.8	F204 V210 L220 V229 P331 T333 V340 A345	F204-L338 HydrophobicContact CE2-CD2 4.32Å; V210-L338 HydrophobicContact CG1-CD1 4.23Å; V210-L338 HydrophobicContact CG1-CD2 4.16Å; V210-L338 HydrophobicContact CG1-CG 4.35Å; L220-L338 HydrophobicContact CD1-CD2 4.48Å; V229-L338 HydrophobicContact CB-CD1 3.75Å; V229-L338 HydrophobicContact CG2-CD1 3.31Å; P331-L338 HydrophobicContact CB-CD2 4.3Å; P331-L338 HydrophobicContact CG-CD2 3.35Å; T333-L338 HydrophobicContact CG2-CB 4.42Å; T333-L338 HydrophobicContact CG2-CD1 4.22Å; L338-V340 HydrophobicContact CD2-CG2 3.55Å; L338-V340 HydrophobicContact CG-CG2 3.69Å; L338-A345 PolarHBondContact N-O 3.29Å; L338-A345 PolarHBondContact O-N 2.79Å
339	V	97	Very high	93	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.012	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.3	170.8	-176.2	0	0	0	0	110	L230 A307 D342 V343 V344	L230-V339 HydrophobicContact CB-CB 4.15Å; L230-V339 HydrophobicContact CB-CG2 4.39Å; L230-V339 HydrophobicContact CD2-CB 3.84Å; L230-V339 HydrophobicContact CD2-CG1 3.89Å; L230-V339 HydrophobicContact CD2-CG2 3.95Å; L230-V339 HydrophobicContact CG-CB 3.95Å; L230-V339 HydrophobicContact CG-CG2 3.79Å; L230-V339 PolarHBondContact O-N 3.08Å; A307-V339 HydrophobicContact CB-CG1 3.99Å; V339-D342 VanDerWaalsContact CG1-CA 3.5Å; V339-V343 WeakPolarHBondContact CA-O 3.35Å; V339-V344 HydrophobicContact CG2-CG2 4.08Å
340	V	97.2	Very high	91.9	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.3	-179.2	-174.4	0	0	0	0	108.4	F204 A208 Q209 V210 L269 L338 D342 V343	F204-V340 HydrophobicContact CD1-CB 4.26Å; F204-V340 HydrophobicContact CD1-CG1 3.98Å; F204-V340 HydrophobicContact CD1-CG2 4.13Å; F204-V340 HydrophobicContact CD2-CG2 4.14Å; F204-V340 HydrophobicContact CE1-CB 4.12Å; F204-V340 HydrophobicContact CE1-CG1 4.35Å; F204-V340 HydrophobicContact CE1-CG2 3.89Å; F204-V340 HydrophobicContact CE2-CG2 3.86Å; F204-V340 HydrophobicContact CG-CG1 4.31Å; F204-V340 HydrophobicContact CG-CG2 4.26Å; F204-V340 HydrophobicContact CZ-CB 4.46Å; F204-V340 HydrophobicContact CZ-CG2 3.75Å; A208-V340 HydrophobicContact CB-CG1 3.66Å; Q209-V340 WeakPolarHBondContact O-CA 3.49Å; V210-V340 HydrophobicContact CG1-CG2 4.01Å; L269-V340 HydrophobicContact CD1-CB 3.76Å; L269-V340 HydrophobicContact CD1-CG1 3.8Å; L269-V340 WeakPolarHBondContact CD1-O 3.37Å; L338-V340 HydrophobicContact CD2-CG2 3.55Å; L338-V340 HydrophobicContact CG-CG2 3.69Å; V340-D342 PolarHBondContact O-N 3.24Å; V340-D342 VanDerWaalsContact O-N 3.14Å; V340-V343 PolarHBondContact N-O 2.87Å; V340-V343 PolarHBondContact O-N 3.09Å
341	E	96.7	Very high	91	Very high	51 Å²	51	16.9 Å²	16.9	24%	0.238	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	36.9	-173.9	-58.9	-62.4	161.5	0	0	112.9	Q209 R268 L269 V343	Q209-E341 PolarHBondContact N-OE1 3.17Å; Q209-E341 PolarHBondContact O-N 3.01Å; R268-E341 VanDerWaalsContact O-CB 3.31Å; R268-E341 WeakPolarHBondContact O-CB 3.2Å; R268-E341 WeakPolarHBondContact O-CG 3.44Å; L269-E341 HydrophobicContact CD1-CB 4.42Å; E341-V343 PolarHBondContact O-N 3.16Å
342	D	95.9	Very high	90	Very high	22 Å²	22	18.7 Å²	18.7	12%	0.118	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	15.2	-171.7	-50.1	-41.5	0	0	0	115.7	R217 R267 V306 A307 V339 V340	R217-D342 IonicContact CZ-OD1 3.13Å; R217-D342 IonicContact CZ-OD2 3.11Å; R217-D342 IonicContact NH2-OD1 3.2Å; R217-D342 PolarHBondContact NH2-OD1 3.18Å; R217-D342 IonicContact NH2-OD2 3.99Å; R217-D342 PolarHBondContact NH2-OD2 2.8Å; R267-D342 IonicContact CZ-OD2 3.39Å; R267-D342 IonicContact NE-OD2 3.63Å; R267-D342 PolarHBondContact NE-OD2 2.85Å; R267-D342 VanDerWaalsContact NE-OD2 3.17Å; R267-D342 IonicContact NH2-OD2 3.17Å; V306-D342 CarbonylContact C-O 3.57Å; V306-D342 WeakPolarHBondContact CA-O 3.2Å; V306-D342 WeakPolarHBondContact CB-O 3.48Å; A307-D342 HydrophobicContact CB-CB 4.29Å; A307-D342 PolarHBondContact N-O 3.04Å; V339-D342 VanDerWaalsContact CG1-CA 3.5Å; V340-D342 PolarHBondContact O-N 3.24Å; V340-D342 VanDerWaalsContact O-N 3.14Å
343	V	97.1	Very high	89.4	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.8	174.9	-174.5	0	0	0	0	109.5	R267 L269 L277 V304 V306 V339 V340 E341	R267-V343 HydrophobicContact CB-CG2 3.81Å; R267-V343 HydrophobicContact CG-CG2 4.4Å; L269-V343 HydrophobicContact CB-CB 4.1Å; L269-V343 HydrophobicContact CB-CG1 4.49Å; L269-V343 HydrophobicContact CB-CG2 3.93Å; L269-V343 HydrophobicContact CD2-CB 3.93Å; L269-V343 HydrophobicContact CD2-CG1 3.81Å; L269-V343 HydrophobicContact CG-CB 4.42Å; L277-V343 HydrophobicContact CD2-CG1 4.35Å; V304-V343 HydrophobicContact CB-CG1 4.39Å; V304-V343 HydrophobicContact CG2-CG1 4.22Å; V306-V343 HydrophobicContact CG1-CG2 4.1Å; V339-V343 WeakPolarHBondContact CA-O 3.35Å; V340-V343 PolarHBondContact N-O 2.87Å; V340-V343 PolarHBondContact O-N 3.09Å; E341-V343 PolarHBondContact O-N 3.16Å
344	V	96.3	Very high	88.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	126.5	178.6	-171.8	0	0	0	0	109.8	M232 L277 F278 L305 L312 V339	M232-V344 HydrophobicContact CB-CG1 3.8Å; M232-V344 HydrophobicContact CE-CG1 4.1Å; M232-V344 HydrophobicContact SD-CG1 4.06Å; L277-V344 WeakPolarHBondContact CD2-O 3.38Å; F278-V344 HydrophobicContact CD2-CB 4.42Å; F278-V344 HydrophobicContact CD2-CG1 3.74Å; F278-V344 HydrophobicContact CE2-CG1 3.99Å; L305-V344 HydrophobicContact CB-CB 3.96Å; L305-V344 HydrophobicContact CB-CG2 3.71Å; L305-V344 PolarHBondContact O-N 2.9Å; L312-V344 HydrophobicContact CD1-CG2 3.96Å; L312-V344 HydrophobicContact CD2-CG2 3.67Å; L312-V344 HydrophobicContact CG-CG2 4.41Å; V339-V344 HydrophobicContact CG2-CG2 4.08Å
345	A	95.8	Very high	88.6	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.6	174.3	0	0	0	0	0	111	F204 L277 T337 L338	F204-A345 HydrophobicContact CE1-CB 4.12Å; F204-A345 HydrophobicContact CZ-CB 3.65Å; L277-A345 HydrophobicContact CD2-CB 3.8Å; T337-A345 CarbonylContact C-O 3.4Å; T337-A345 WeakPolarHBondContact CA-O 3.38Å; L338-A345 PolarHBondContact N-O 3.29Å; L338-A345 PolarHBondContact O-N 2.79Å
346	S	94	Very high	88.2	Confident	1 Å²	1	23 Å²	23	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	151	169	-176.9	0	0	0	0	110	H275 L276 G336 F348 H354	H275-S346 PolarHBondContact CD2-O 3.32Å; H275-S346 PolarHBondContact NE2-O 3.35Å; L276-S346 PolarHBondContact O-N 3.03Å; L276-S346 VanDerWaalsContact O-N 3.08Å; G336-S346 PolarHBondContact O-OG 3.22Å; S346-F348 PolarHBondContact O-N 3.01Å; S346-F348 VanDerWaalsContact OG-CD2 3.32Å; S346-F348 WeakPolarHBondContact OG-CD2 3.34Å; S346-F348 PolarHBondContact OG-N 2.85Å; S346-F348 VanDerWaalsContact OG-N 3.11Å; S346-H354 PolarHBondContact OG-CE1 3.31Å; S346-H354 PolarHBondContact OG-ND1 2.89Å
347	C	91	Very high	87.8	Confident	6 Å²	6	23.4 Å²	23.4	4%	0.041	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-4.3	166.6	-66.2	0	0	0	0	113.4	P331 L332 T333 G336	P331-C347 WeakPolarHBondContact O-CB 3.34Å; P331-C347 PolarHBondContact O-SG 3.18Å; L332-C347 HydrophobicContact CD1-CB 4.08Å; T333-C347 PolarHBondContact N-SG 3.18Å; T333-C347 PolarHBondContact OG1-SG 2.59Å; G336-C347 VanDerWaalsContact C-SG 3.57Å; G336-C347 WeakPolarHBondContact O-CB 3.41Å; G336-C347 PolarHBondContact O-N 3.49Å
348	F	87.1	Confident	87.3	Confident	5 Å²	5	24.4 Å²	24.4	2%	0.022	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	159.7	-174.6	-49.4	-65.5	0	0	0	112.1	L276 L332 S346 H354 A357 Q358 F361	L276-F348 HydrophobicContact CD1-CB 4.49Å; L276-F348 PolarHBondContact N-O 2.76Å; L332-F348 HydrophobicContact CD1-CE1 3.67Å; L332-F348 HydrophobicContact CD1-CZ 3.93Å; S346-F348 PolarHBondContact O-N 3.01Å; S346-F348 VanDerWaalsContact OG-CD2 3.32Å; S346-F348 WeakPolarHBondContact OG-CD2 3.34Å; S346-F348 PolarHBondContact OG-N 2.85Å; S346-F348 VanDerWaalsContact OG-N 3.11Å; F348-H354 AromaticContact CD2-ND1 3.73Å; F348-H354 AromaticContact CE2-CE1 3.99Å; F348-A357 HydrophobicContact CB-CB 3.64Å; F348-A357 HydrophobicContact CD1-CB 3.98Å; F348-A357 HydrophobicContact CD2-CB 3.69Å; F348-A357 HydrophobicContact CE2-CB 4.39Å; F348-A357 HydrophobicContact CG-CB 3.48Å; F348-A357 VanDerWaalsContact CG-CB 3.48Å; F348-Q358 HydrophobicContact CE2-CB 4.45Å; F348-Q358 HydrophobicContact CE2-CG 3.63Å; F348-Q358 HydrophobicContact CZ-CG 4.24Å; F348-F361 AromaticContact CD1-CD2 3.74Å; F348-F361 HydrophobicContact CD1-CD2 3.74Å; F348-F361 AromaticContact CD1-CE2 3.94Å; F348-F361 HydrophobicContact CD1-CE2 3.94Å; F348-F361 HydrophobicContact CD1-CG 4.2Å; F348-F361 HydrophobicContact CE1-CB 3.74Å; F348-F361 HydrophobicContact CE1-CD1 4.24Å; F348-F361 AromaticContact CE1-CD2 3.55Å; F348-F361 HydrophobicContact CE1-CD2 3.55Å; F348-F361 HydrophobicContact CE1-CE2 4.17Å; F348-F361 AromaticContact CE1-CG 3.58Å; F348-F361 HydrophobicContact CE1-CG 3.58Å; F348-F361 HydrophobicContact CZ-CB 4.19Å; F348-F361 HydrophobicContact CZ-CG 4.49Å
349	A	82.3	Confident	86.8	Confident	20 Å²	20	30 Å²	30	17%	0.165	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	179.1	-177.9	0	0	0	0	0	110.2	A274 V351	A274-A349 WeakPolarHBondContact O-CA 3.4Å; A274-A349 VanDerWaalsContact O-CB 3.26Å; A274-A349 WeakPolarHBondContact O-CB 3.04Å; A349-V351 PolarHBondContact O-N 3.08Å
350	A	68.8	Low	86.2	Confident	6 Å²	6	31.6 Å²	31.6	5%	0.05	18%	0.177	C	C	.	.	S	Bend	trans	66.1	-31.1	176.8	0	0	0	0	0	115.7	A274 F401 H402	A274-A350 PolarHBondContact O-N 3.34Å; A350-F401 CarbonylContact O-C 3.55Å; A350-F401 WeakPolarHBondContact O-CA 3.42Å; A350-H402 PolarHBondContact O-N 3.18Å
351	V	73.1	Confident	85.6	Confident	26 Å²	26	32.6 Å²	32.6	16%	0.158	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-107.1	134.1	172	179.2	0	0	0	0	108.7	L276 A349 D353 L356 S400 F401	L276-V351 WeakPolarHBondContact CD1-O 3.35Å; A349-V351 PolarHBondContact O-N 3.08Å; V351-D353 HydrophobicContact CG1-CB 4.49Å; V351-D353 PolarHBondContact O-N 2.91Å; V351-L356 HydrophobicContact CG1-CD2 4.12Å; V351-S400 WeakPolarHBondContact CA-O 3.42Å; V351-F401 HydrophobicContact CG2-CD1 3.86Å; V351-F401 HydrophobicContact CG2-CE1 3.62Å
352	A	72.2	Confident	85.1	Confident	40 Å²	40	36.9 Å²	36.9	33%	0.331	20%	0.195	S	C	.	.	S	Bend	trans	-71	-13.4	-173.8	0	0	0	0	0	114.2	F294 S400	F294-A352 HydrophobicContact CE2-CB 3.72Å; F294-A352 HydrophobicContact CZ-CB 3.83Å; A352-S400 PolarHBondContact N-O 2.95Å
353	D	78.6	Confident	84.5	Confident	76 Å²	76	37.5 Å²	37.5	41%	0.406	20%	0.2	S	C	.	.			trans	-106.9	110	-173.9	-172.6	-28.1	0	0	0	111.5	V351 H355 L356 A357	V351-D353 HydrophobicContact CG1-CB 4.49Å; V351-D353 PolarHBondContact O-N 2.91Å; D353-H355 WeakPolarHBondContact OD1-CA 3.35Å; D353-H355 WeakPolarHBondContact OD1-CB 3.39Å; D353-H355 PolarHBondContact OD1-N 3.24Å; D353-L356 HydrophobicContact CB-CB 3.76Å; D353-L356 PolarHBondContact OD1-N 3.03Å; D353-A357 WeakPolarHBondContact O-CB 3.27Å; D353-A357 PolarHBondContact O-N 3.48Å
354	H	82.2	Confident	83.7	Confident	14 Å²	14	38.2 Å²	38.2	7%	0.065	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-39.8	176.5	175.3	80.2	0	0	0	113	F278 A292 G336 S346 F348 A357 Q358	F278-H354 AromaticContact CZ-CE1 3.94Å; F278-H354 AromaticContact CZ-ND1 3.9Å; A292-H354 HydrophobicContact CB-CB 3.86Å; G336-H354 PolarHBondContact O-CE1 2.92Å; S346-H354 PolarHBondContact OG-CE1 3.31Å; S346-H354 PolarHBondContact OG-ND1 2.89Å; F348-H354 AromaticContact CD2-ND1 3.73Å; F348-H354 AromaticContact CE2-CE1 3.99Å; H354-A357 PolarHBondContact O-N 3.25Å; H354-Q358 PolarHBondContact NE2-NE2 3.34Å; H354-Q358 WeakPolarHBondContact O-CB 3.46Å; H354-Q358 WeakPolarHBondContact O-CG 3.34Å; H354-Q358 PolarHBondContact O-N 2.87Å
355	H	83.6	Confident	82.9	Confident	146 Å²	146	40.2 Å²	40.2	68%	0.676	21%	0.212	S	C	*	.	H	α-helix	trans	-70.6	-40.6	-179	-71.5	-78	0	0	0	111.1	D353 A357 Q358 L359	D353-H355 WeakPolarHBondContact OD1-CA 3.35Å; D353-H355 WeakPolarHBondContact OD1-CB 3.39Å; D353-H355 PolarHBondContact OD1-N 3.24Å; H355-A357 VanDerWaalsContact C-N 3.34Å; H355-Q358 WeakPolarHBondContact O-CB 3.37Å; H355-Q358 PolarHBondContact O-N 2.92Å; H355-L359 PolarHBondContact O-N 3.39Å
356	L	83.4	Confident	82.1	Confident	62 Å²	62	43.5 Å²	43.5	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-62.2	-44.1	173.6	-177.2	61.7	0	0	0	111	V351 D353 L359 A360 L396	V351-L356 HydrophobicContact CG1-CD2 4.12Å; D353-L356 HydrophobicContact CB-CB 3.76Å; D353-L356 PolarHBondContact OD1-N 3.03Å; L356-L359 PolarHBondContact O-N 3.02Å; L356-A360 WeakPolarHBondContact O-CB 3.5Å; L356-A360 PolarHBondContact O-N 2.92Å; L356-L396 HydrophobicContact CD2-CD1 3.76Å; L356-L396 HydrophobicContact CD2-CD2 4Å
357	A	81.8	Confident	81.2	Confident	8 Å²	8	50.2 Å²	50.2	7%	0.066	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-42.5	175.1	0	0	0	0	0	111.4	F348 D353 H354 H355 L359 A360 F361	F348-A357 HydrophobicContact CB-CB 3.64Å; F348-A357 HydrophobicContact CD1-CB 3.98Å; F348-A357 HydrophobicContact CD2-CB 3.69Å; F348-A357 HydrophobicContact CE2-CB 4.39Å; F348-A357 HydrophobicContact CG-CB 3.48Å; F348-A357 VanDerWaalsContact CG-CB 3.48Å; D353-A357 WeakPolarHBondContact O-CB 3.27Å; D353-A357 PolarHBondContact O-N 3.48Å; H354-A357 PolarHBondContact O-N 3.25Å; H355-A357 VanDerWaalsContact C-N 3.34Å; A357-L359 VanDerWaalsContact C-N 3.32Å; A357-L359 PolarHBondContact O-N 2.83Å; A357-A360 PolarHBondContact O-N 2.98Å; A357-F361 WeakPolarHBondContact O-CB 3.43Å; A357-F361 VanDerWaalsContact O-CD2 3.29Å; A357-F361 WeakPolarHBondContact O-CD2 3.47Å; A357-F361 PolarHBondContact O-N 2.87Å
358	Q	83.6	Confident	80.1	Confident	25 Å²	25	52.6 Å²	52.6	12%	0.117	27%	0.269	C	S	.	.	H	α-helix	trans	-55.1	-47.3	172.5	-84.6	-137.3	33.6	0	0	112.2	H335 F348 H354 H355 F361 W362 R365	H335-Q358 PolarHBondContact O-NE2 2.81Å; F348-Q358 HydrophobicContact CE2-CB 4.45Å; F348-Q358 HydrophobicContact CE2-CG 3.63Å; F348-Q358 HydrophobicContact CZ-CG 4.24Å; H354-Q358 PolarHBondContact NE2-NE2 3.34Å; H354-Q358 WeakPolarHBondContact O-CB 3.46Å; H354-Q358 WeakPolarHBondContact O-CG 3.34Å; H354-Q358 PolarHBondContact O-N 2.87Å; H355-Q358 WeakPolarHBondContact O-CB 3.37Å; H355-Q358 PolarHBondContact O-N 2.92Å; Q358-F361 PolarHBondContact O-N 3.47Å; Q358-W362 PolarHBondContact O-N 3.21Å; Q358-R365 VanDerWaalsContact C-NH2 3.33Å; Q358-R365 PolarHBondContact O-NH2 3.15Å
359	L	85.8	Confident	78.8	Confident	119 Å²	119	55.8 Å²	55.8	62%	0.623	29%	0.291	S	S	*	.	H	α-helix	trans	-65.1	-43.1	178.7	-172.3	70	0	0	0	111.5	H355 L356 A357 F361 W362	H355-L359 PolarHBondContact O-N 3.39Å; L356-L359 PolarHBondContact O-N 3.02Å; A357-L359 VanDerWaalsContact C-N 3.32Å; A357-L359 PolarHBondContact O-N 2.83Å; L359-F361 VanDerWaalsContact C-N 3.29Å; L359-F361 PolarHBondContact O-N 3.06Å; L359-W362 WeakPolarHBondContact O-CB 3.43Å; L359-W362 PolarHBondContact O-N 3.21Å
360	A	84.3	Confident	77.6	Confident	36 Å²	36	60.2 Å²	60.2	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-36.3	178.5	0	0	0	0	0	112	L356 A357 P363 Y384 L388	L356-A360 WeakPolarHBondContact O-CB 3.5Å; L356-A360 PolarHBondContact O-N 2.92Å; A357-A360 PolarHBondContact O-N 2.98Å; A360-P363 VanDerWaalsContact O-CD 3.3Å; A360-P363 WeakPolarHBondContact O-CD 3.32Å; A360-Y384 PolarHBondContact O-OH 3.46Å; A360-L388 HydrophobicContact CB-CD1 3.92Å; A360-L388 HydrophobicContact CB-CD2 4.24Å
361	F	84.6	Confident	76.8	Confident	21 Å²	21	63.9 Å²	63.9	9%	0.092	34%	0.342	C	S	.	.	H	α-helix	trans	-89.2	-1.1	177.9	-79.1	-95.2	0	0	0	114.2	L247 L332 F348 A357 Q358 L359 L364 R365 Y384 P385 L388	L247-F361 HydrophobicContact CD1-CE1 3.9Å; L247-F361 HydrophobicContact CD1-CZ 4.11Å; L247-F361 HydrophobicContact CD2-CD1 4.44Å; L247-F361 HydrophobicContact CD2-CE1 3.78Å; L332-F361 HydrophobicContact CD2-CD1 4.23Å; F348-F361 AromaticContact CD1-CD2 3.74Å; F348-F361 HydrophobicContact CD1-CD2 3.74Å; F348-F361 AromaticContact CD1-CE2 3.94Å; F348-F361 HydrophobicContact CD1-CE2 3.94Å; F348-F361 HydrophobicContact CD1-CG 4.2Å; F348-F361 HydrophobicContact CE1-CB 3.74Å; F348-F361 HydrophobicContact CE1-CD1 4.24Å; F348-F361 AromaticContact CE1-CD2 3.55Å; F348-F361 HydrophobicContact CE1-CD2 3.55Å; F348-F361 HydrophobicContact CE1-CE2 4.17Å; F348-F361 AromaticContact CE1-CG 3.58Å; F348-F361 HydrophobicContact CE1-CG 3.58Å; F348-F361 HydrophobicContact CZ-CB 4.19Å; F348-F361 HydrophobicContact CZ-CG 4.49Å; A357-F361 WeakPolarHBondContact O-CB 3.43Å; A357-F361 VanDerWaalsContact O-CD2 3.29Å; A357-F361 WeakPolarHBondContact O-CD2 3.47Å; A357-F361 PolarHBondContact O-N 2.87Å; Q358-F361 PolarHBondContact O-N 3.47Å; L359-F361 VanDerWaalsContact C-N 3.29Å; L359-F361 PolarHBondContact O-N 3.06Å; F361-L364 HydrophobicContact CD1-CD2 4.01Å; F361-L364 HydrophobicContact CE1-CD2 4.32Å; F361-L364 PolarHBondContact O-N 2.94Å; F361-R365 WeakPolarHBondContact O-CG 3.42Å; F361-R365 PolarHBondContact O-N 3.38Å; F361-Y384 HydrophobicContact CD1-CD1 4Å; F361-Y384 HydrophobicContact CD1-CE1 4.07Å; F361-Y384 AromaticContact CE1-CD1 3.95Å; F361-Y384 HydrophobicContact CE1-CD1 3.95Å; F361-Y384 HydrophobicContact CE1-CE1 4.39Å; F361-Y384 HydrophobicContact CG-CE1 4.44Å; F361-P385 HydrophobicContact CE1-CG 3.95Å; F361-P385 HydrophobicContact CZ-CB 4.24Å; F361-P385 HydrophobicContact CZ-CG 3.99Å; F361-L388 HydrophobicContact CD1-CD1 4.35Å; F361-L388 HydrophobicContact CD2-CD1 3.67Å; F361-L388 HydrophobicContact CE1-CD1 4.18Å; F361-L388 HydrophobicContact CE2-CD1 3.49Å; F361-L388 VanDerWaalsContact CE2-CD1 3.49Å; F361-L388 HydrophobicContact CG-CD1 4.12Å; F361-L388 HydrophobicContact CZ-CD1 3.77Å
362	W	85.6	Confident	75.2	Confident	140 Å²	140	74.3 Å²	74.3	53%	0.53	38%	0.378	S	S	.	.	H	α-helix	trans	-54.4	-42.2	177.4	112.7	-92.9	0	0	0	113.6	Q358 L359 L364 R365 L366	Q358-W362 PolarHBondContact O-N 3.21Å; L359-W362 WeakPolarHBondContact O-CB 3.43Å; L359-W362 PolarHBondContact O-N 3.21Å; W362-L364 PolarHBondContact O-N 3.39Å; W362-R365 PolarHBondContact O-N 3.42Å; W362-L366 HydrophobicContact CE3-CB 4.19Å; W362-L366 HydrophobicContact CH2-CD2 3.57Å; W362-L366 HydrophobicContact CZ2-CD2 4.39Å; W362-L366 HydrophobicContact CZ3-CB 4.04Å; W362-L366 HydrophobicContact CZ3-CD1 4.23Å; W362-L366 HydrophobicContact CZ3-CD2 3.68Å; W362-L366 HydrophobicContact CZ3-CG 4.19Å; W362-L366 PolarHBondContact O-N 2.72Å
363	P	84.5	Confident	73.7	Confident	35 Å²	35	75.2 Å²	75.2	23%	0.227	39%	0.391	C	S	.	.	H	α-helix	trans	-64.2	-45.3	-178	-20	34.2	0	0	0	110.6	A360 R365 L366 F367 Y384	A360-P363 VanDerWaalsContact O-CD 3.3Å; A360-P363 WeakPolarHBondContact O-CD 3.32Å; P363-R365 VanDerWaalsContact C-N 3.3Å; P363-R365 PolarHBondContact O-N 3.44Å; P363-L366 PolarHBondContact O-N 2.68Å; P363-F367 HydrophobicContact CB-CD2 4.5Å; P363-F367 HydrophobicContact CB-CE2 4.47Å; P363-F367 WeakPolarHBondContact O-CD2 3.49Å; P363-F367 PolarHBondContact O-N 3.12Å; P363-Y384 WeakPolarHBondContact CD-OH 3.45Å; P363-Y384 WeakPolarHBondContact CG-OH 3.46Å
364	L	79.8	Confident	72.1	Confident	16 Å²	16	76.2 Å²	76.2	8%	0.084	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-40.3	178.6	-171.5	65.1	0	0	0	111.6	I245 L247 L332 F361 W362 H368 Y384	I245-L364 HydrophobicContact CD1-CD2 3.59Å; I245-L364 HydrophobicContact CD1-CG 4.23Å; L247-L364 HydrophobicContact CD2-CD2 4.4Å; L332-L364 HydrophobicContact CD2-CD2 4.1Å; F361-L364 HydrophobicContact CD1-CD2 4.01Å; F361-L364 HydrophobicContact CE1-CD2 4.32Å; F361-L364 PolarHBondContact O-N 2.94Å; W362-L364 PolarHBondContact O-N 3.39Å; L364-H368 PolarHBondContact O-N 3.4Å; L364-Y384 HydrophobicContact CB-CD1 4.01Å; L364-Y384 HydrophobicContact CB-CE1 3.85Å; L364-Y384 HydrophobicContact CD1-CG 4.46Å; L364-Y384 HydrophobicContact CD2-CD1 3.69Å; L364-Y384 HydrophobicContact CD2-CE1 4.33Å; L364-Y384 HydrophobicContact CD2-CG 4.12Å; L364-Y384 HydrophobicContact CG-CD1 4.35Å
365	R	80.1	Confident	70.6	Confident	43 Å²	43	86.2 Å²	86.2	16%	0.162	44%	0.442	C	S	.	.	H	α-helix	trans	-65	-39.4	175.6	-68.9	-169.7	-72.4	166.2	-3.5	112.2	L244 L332 R334 Q358 F361 W362 P363 S369	L244-R365 HydrophobicContact CD1-CB 4.15Å; L244-R365 HydrophobicContact CD1-CG 3.77Å; L332-R365 HydrophobicContact CD2-CG 4.33Å; R334-R365 WeakPolarHBondContact O-CD 3.09Å; R334-R365 PolarHBondContact O-NH1 3.39Å; Q358-R365 VanDerWaalsContact C-NH2 3.33Å; Q358-R365 PolarHBondContact O-NH2 3.15Å; F361-R365 WeakPolarHBondContact O-CG 3.42Å; F361-R365 PolarHBondContact O-N 3.38Å; W362-R365 PolarHBondContact O-N 3.42Å; P363-R365 VanDerWaalsContact C-N 3.3Å; P363-R365 PolarHBondContact O-N 3.44Å; R365-S369 PolarHBondContact O-N 3.03Å
366	L	78.2	Confident	69.1	Low	68 Å²	68	82.1 Å²	82.1	36%	0.356	43%	0.427	S	S	.	.	H	α-helix	trans	-69.1	-45.6	176.7	-175	72.3	0	0	0	111.8	W362 P363 H368 S369 L370	W362-L366 HydrophobicContact CE3-CB 4.19Å; W362-L366 HydrophobicContact CH2-CD2 3.57Å; W362-L366 HydrophobicContact CZ2-CD2 4.39Å; W362-L366 HydrophobicContact CZ3-CB 4.04Å; W362-L366 HydrophobicContact CZ3-CD1 4.23Å; W362-L366 HydrophobicContact CZ3-CD2 3.68Å; W362-L366 HydrophobicContact CZ3-CG 4.19Å; W362-L366 PolarHBondContact O-N 2.72Å; P363-L366 PolarHBondContact O-N 2.68Å; L366-H368 VanDerWaalsContact C-N 3.31Å; L366-H368 PolarHBondContact O-N 3.3Å; L366-S369 WeakPolarHBondContact O-CA 3.43Å; L366-S369 WeakPolarHBondContact O-CB 3.15Å; L366-S369 PolarHBondContact O-N 3.29Å; L366-S369 PolarHBondContact O-OG 2.85Å; L366-L370 HydrophobicContact CD1-CD1 4.33Å; L366-L370 HydrophobicContact CD2-CD1 4.31Å; L366-L370 HydrophobicContact CG-CD1 3.92Å; L366-L370 PolarHBondContact O-N 3.43Å
367	F	74.7	Confident	67.7	Low	142 Å²	142	81.7 Å²	81.7	62%	0.623	43%	0.428	S	S	*	.	H	α-helix	trans	-59.7	-40.8	180	-82.8	-67.9	0	0	0	112.2	P363 S369 L370	P363-F367 HydrophobicContact CB-CD2 4.5Å; P363-F367 HydrophobicContact CB-CE2 4.47Å; P363-F367 WeakPolarHBondContact O-CD2 3.49Å; P363-F367 PolarHBondContact O-N 3.12Å; F367-S369 VanDerWaalsContact C-N 3.28Å; F367-S369 PolarHBondContact O-N 3.44Å; F367-L370 PolarHBondContact O-N 2.93Å
368	H	69	Low	66.6	Low	57 Å²	57	84.1 Å²	84.1	26%	0.264	45%	0.454	S	S	.	.	H	α-helix	trans	-66.6	-29	174.3	-100.5	-86.8	0	0	0	113.4	I245 L364 L366 L370	I245-H368 WeakPolarHBondContact CG2-CE1 3.35Å; I245-H368 WeakPolarHBondContact CG2-NE2 3.44Å; L364-H368 PolarHBondContact O-N 3.4Å; L366-H368 VanDerWaalsContact C-N 3.31Å; L366-H368 PolarHBondContact O-N 3.3Å; H368-L370 VanDerWaalsContact C-N 3.28Å; H368-L370 PolarHBondContact O-N 3.3Å
369	S	59.9	Low	65.9	Low	71 Å²	71	88.8 Å²	88.8	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-73.2	-18.3	174.9	75.4	0	0	0	0	113.9	R365 L366 F367	R365-S369 PolarHBondContact O-N 3.03Å; L366-S369 WeakPolarHBondContact O-CA 3.43Å; L366-S369 WeakPolarHBondContact O-CB 3.15Å; L366-S369 PolarHBondContact O-N 3.29Å; L366-S369 PolarHBondContact O-OG 2.85Å; F367-S369 VanDerWaalsContact C-N 3.28Å; F367-S369 PolarHBondContact O-N 3.44Å
370	L	56	Low	64.9	Low	114 Å²	114	84.3 Å²	84.3	60%	0.597	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	3.8	-176.2	-67.7	170.5	0	0	0	114.1	L366 F367 H368	L366-L370 HydrophobicContact CD1-CD1 4.33Å; L366-L370 HydrophobicContact CD2-CD1 4.31Å; L366-L370 HydrophobicContact CG-CD1 3.92Å; L366-L370 PolarHBondContact O-N 3.43Å; F367-L370 PolarHBondContact O-N 2.93Å; H368-L370 VanDerWaalsContact C-N 3.28Å; H368-L370 PolarHBondContact O-N 3.3Å
371	A	51	Low	64.2	Low	82 Å²	82	84.8 Å²	84.8	68%	0.678	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	67.5	168.7	0	0	0	0	0	115.9
372	W	40.6	Very low	63.6	Low	245 Å²	245	84 Å²	84	93%	0.928	45%	0.454	S	S	*	.	S	Bend	trans	-122.3	100.8	154.4	-73.3	-19.3	0	0	0	109.9
373	G	40.5	Very low	62.9	Low	59 Å²	59	84.5 Å²	84.5	61%	0.608	46%	0.456	S	S	*	.			trans	68.8	101.4	162.9	0	0	0	0	0	116.1	W375	G373-W375 VanDerWaalsContact C-N 3.27Å; G373-W375 PolarHBondContact O-N 3.22Å
374	S	44.7	Very low	62.4	Low	98 Å²	98	84.1 Å²	84.1	69%	0.685	45%	0.45	S	S	*	.			trans	-64.1	80.8	168.6	55.3	0	0	0	0	111.7	T376	S374-T376 PolarHBondContact O-N 3.15Å; S374-T376 VanDerWaalsContact O-N 3.15Å
375	W	50.6	Low	62	Low	224 Å²	224	84.6 Å²	84.6	85%	0.848	45%	0.454	S	S	*	.			trans	-82.5	72.6	163.4	-83.7	60.3	0	0	0	108.8	G373 P377	G373-W375 VanDerWaalsContact C-N 3.27Å; G373-W375 PolarHBondContact O-N 3.22Å; W375-P377 WeakPolarHBondContact O-CD 3.35Å
376	T	52.6	Low	61.4	Low	59 Å²	59	86.9 Å²	86.9	36%	0.362	47%	0.467	S	S	.	.			trans	-86.9	116	163.3	50	0	0	0	0	107.7	P225 I245 S374 G378	P225-T376 HydrophobicContact CG-CG2 4.1Å; I245-T376 HydrophobicContact CB-CG2 4.25Å; I245-T376 HydrophobicContact CG2-CG2 3.76Å; S374-T376 PolarHBondContact O-N 3.15Å; S374-T376 VanDerWaalsContact O-N 3.15Å; T376-G378 PolarHBondContact O-N 2.95Å
377	P	53.3	Low	61	Low	53 Å²	53	87.1 Å²	87.1	34%	0.344	47%	0.468	S	S	.	.			trans	-53.1	135.9	168.3	-21.1	31.1	0	0	0	109.4	W375 E379	W375-P377 WeakPolarHBondContact O-CD 3.35Å; P377-E379 VanDerWaalsContact C-N 3.29Å
378	G	59.2	Low	60.9	Low	59 Å²	59	82.1 Å²	82.1	61%	0.608	45%	0.447	S	S	*	.	S	Bend	trans	-63.7	-38.4	176.4	0	0	0	0	0	111.8	R249 T376	R249-G378 WeakPolarHBondContact CD-O 3.47Å; T376-G378 PolarHBondContact O-N 2.95Å
379	E	68.9	Low	60.8	Low	123 Å²	123	81.1 Å²	81.1	58%	0.575	44%	0.442	S	S	*	.	S	Bend	trans	-148.7	153.8	179.2	-62.3	-172.4	166.4	0	0	111.1	R249 P251 P377	R249-E379 CarbonylContact O-C 3.6Å; R249-E379 WeakPolarHBondContact O-CA 3.49Å; P251-E379 HydrophobicContact CG-CG 4.36Å; P251-E379 VanDerWaalsContact CG-OE1 3.29Å; P251-E379 WeakPolarHBondContact CG-OE1 3.47Å; P377-E379 VanDerWaalsContact C-N 3.29Å
380	G	65.4	Low	61.2	Low	25 Å²	25	84.6 Å²	84.6	26%	0.258	44%	0.444	S	S	.	.	S	Bend	trans	91.6	-173.3	178.4	0	0	0	0	0	114.8	D248 R249	D248-G380 WeakPolarHBondContact CA-O 3.28Å; R249-G380 PolarHBondContact N-O 3.15Å; R249-G380 PolarHBondContact O-N 2.78Å
381	V	68.3	Low	61.8	Low	46 Å²	46	83 Å²	83	28%	0.279	44%	0.436	S	S	.	.			trans	-84.7	131.7	-175.8	-177.7	0	0	0	0	110.2	L247 D248 Q386	L247-V381 CarbonylContact O-C 3.32Å; L247-V381 WeakPolarHBondContact O-CA 3.41Å; D248-V381 HydrophobicContact CB-CG2 4.21Å; D248-V381 WeakPolarHBondContact OD1-CG2 3.43Å; V381-Q386 HydrophobicContact CG1-CG 3.91Å
382	H	72.2	Confident	62.5	Low	5 Å²	5	79.7 Å²	79.7	2%	0.023	41%	0.409	C	S	.	.			trans	-62.9	141.3	175	-169.8	-84.1	0	0	0	111.1	L247 Y384 P385	L247-H382 PolarHBondContact O-N 2.78Å; H382-Y384 VanDerWaalsContact C-N 3.25Å; H382-Y384 VanDerWaalsContact ND1-CB 3.34Å; H382-Y384 WeakPolarHBondContact ND1-CB 3.44Å; H382-Y384 PolarHBondContact ND1-N 2.84Å; H382-Y384 VanDerWaalsContact ND1-N 3.16Å; H382-Y384 PolarHBondContact O-N 2.77Å; H382-P385 HydrophobicContact CB-CG 4.26Å; H382-P385 VanDerWaalsContact O-CD 3.24Å; H382-P385 WeakPolarHBondContact O-CD 3.18Å
383	W	72	Confident	63.7	Low	151 Å²	151	72.7 Å²	72.7	57%	0.572	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-32.7	-175.6	67.8	-93.4	0	0	0	113.2	Q386 L387	W383-Q386 WeakPolarHBondContact O-CB 3.47Å; W383-Q386 PolarHBondContact O-N 2.92Å; W383-L387 HydrophobicContact CE3-CB 4.46Å; W383-L387 HydrophobicContact CE3-CD2 4.47Å; W383-L387 HydrophobicContact CZ3-CD2 3.83Å; W383-L387 PolarHBondContact O-N 2.9Å
384	Y	73.4	Confident	65	Low	27 Å²	27	76.7 Å²	76.7	11%	0.106	39%	0.39	C	S	.	.	H	α-helix	trans	-64.4	-50.5	-175.4	-170.6	-98.4	0	0	0	113.7	A360 F361 P363 L364 H382 Q386 L387 L388	A360-Y384 PolarHBondContact O-OH 3.46Å; F361-Y384 HydrophobicContact CD1-CD1 4Å; F361-Y384 HydrophobicContact CD1-CE1 4.07Å; F361-Y384 AromaticContact CE1-CD1 3.95Å; F361-Y384 HydrophobicContact CE1-CD1 3.95Å; F361-Y384 HydrophobicContact CE1-CE1 4.39Å; F361-Y384 HydrophobicContact CG-CE1 4.44Å; P363-Y384 WeakPolarHBondContact CD-OH 3.45Å; P363-Y384 WeakPolarHBondContact CG-OH 3.46Å; L364-Y384 HydrophobicContact CB-CD1 4.01Å; L364-Y384 HydrophobicContact CB-CE1 3.85Å; L364-Y384 HydrophobicContact CD1-CG 4.46Å; L364-Y384 HydrophobicContact CD2-CD1 3.69Å; L364-Y384 HydrophobicContact CD2-CE1 4.33Å; L364-Y384 HydrophobicContact CD2-CG 4.12Å; L364-Y384 HydrophobicContact CG-CD1 4.35Å; H382-Y384 VanDerWaalsContact C-N 3.25Å; H382-Y384 VanDerWaalsContact ND1-CB 3.34Å; H382-Y384 WeakPolarHBondContact ND1-CB 3.44Å; H382-Y384 PolarHBondContact ND1-N 2.84Å; H382-Y384 VanDerWaalsContact ND1-N 3.16Å; H382-Y384 PolarHBondContact O-N 2.77Å; Y384-Q386 PolarHBondContact O-N 3.21Å; Y384-L387 PolarHBondContact O-N 3Å; Y384-L387 VanDerWaalsContact O-N 3.16Å; Y384-L388 HydrophobicContact CD1-CD1 3.73Å; Y384-L388 HydrophobicContact CD1-CG 4.05Å; Y384-L388 HydrophobicContact CE1-CD1 3.33Å; Y384-L388 HydrophobicContact CE1-CD2 4.24Å; Y384-L388 HydrophobicContact CE1-CG 3.76Å; Y384-L388 PolarHBondContact O-N 3.26Å
385	P	71.5	Confident	66.2	Low	25 Å²	25	79 Å²	79	16%	0.162	39%	0.393	C	S	.	.	H	α-helix	trans	-49.2	-41	167.4	-28.9	29	0	0	0	114.4	L247 F361 H382 L388 Y389	L247-P385 HydrophobicContact CB-CG 4.1Å; L247-P385 HydrophobicContact CD2-CG 3.85Å; L247-P385 HydrophobicContact CG-CG 4.38Å; F361-P385 HydrophobicContact CE1-CG 3.95Å; F361-P385 HydrophobicContact CZ-CB 4.24Å; F361-P385 HydrophobicContact CZ-CG 3.99Å; H382-P385 HydrophobicContact CB-CG 4.26Å; H382-P385 VanDerWaalsContact O-CD 3.24Å; H382-P385 WeakPolarHBondContact O-CD 3.18Å; P385-L388 PolarHBondContact O-N 3.37Å; P385-Y389 VanDerWaalsContact O-CB 3.25Å; P385-Y389 WeakPolarHBondContact O-CB 3.5Å; P385-Y389 PolarHBondContact O-N 3.09Å
386	Q	68.4	Low	67	Low	91 Å²	91	71.1 Å²	71.1	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-42.1	-179.9	-59.3	175.1	-2.2	0	0	111.6	V381 W383 Y384 Y389 R390	V381-Q386 HydrophobicContact CG1-CG 3.91Å; W383-Q386 WeakPolarHBondContact O-CB 3.47Å; W383-Q386 PolarHBondContact O-N 2.92Å; Y384-Q386 PolarHBondContact O-N 3.21Å; Q386-Y389 PolarHBondContact O-N 3.37Å; Q386-R390 WeakPolarHBondContact O-CG 3.47Å; Q386-R390 PolarHBondContact O-N 3.44Å
387	L	69.9	Low	67.8	Low	74 Å²	74	76 Å²	76	39%	0.387	39%	0.386	S	S	.	.	H	α-helix	trans	-63.4	-48.4	174.7	176.9	64.3	0	0	0	111.4	W383 Y384 Y389 R390 L391	W383-L387 HydrophobicContact CE3-CB 4.46Å; W383-L387 HydrophobicContact CE3-CD2 4.47Å; W383-L387 HydrophobicContact CZ3-CD2 3.83Å; W383-L387 PolarHBondContact O-N 2.9Å; Y384-L387 PolarHBondContact O-N 3Å; Y384-L387 VanDerWaalsContact O-N 3.16Å; L387-Y389 VanDerWaalsContact C-N 3.27Å; L387-Y389 PolarHBondContact O-N 2.97Å; L387-R390 WeakPolarHBondContact O-CB 3.31Å; L387-R390 PolarHBondContact O-N 3.3Å; L387-L391 HydrophobicContact CD1-CD1 4.21Å; L387-L391 HydrophobicContact CD1-CG 4.28Å; L387-L391 HydrophobicContact CG-CD1 4.09Å; L387-L391 WeakPolarHBondContact O-CG 3.47Å; L387-L391 PolarHBondContact O-N 3.34Å
388	L	72.6	Confident	68	Low	36 Å²	36	80.1 Å²	80.1	19%	0.188	40%	0.401	C	S	.	.	H	α-helix	trans	-59.5	-40.9	178.6	-75.6	-175.5	0	0	0	111.8	A360 F361 Y384 P385 L391 G392	A360-L388 HydrophobicContact CB-CD1 3.92Å; A360-L388 HydrophobicContact CB-CD2 4.24Å; F361-L388 HydrophobicContact CD1-CD1 4.35Å; F361-L388 HydrophobicContact CD2-CD1 3.67Å; F361-L388 HydrophobicContact CE1-CD1 4.18Å; F361-L388 HydrophobicContact CE2-CD1 3.49Å; F361-L388 VanDerWaalsContact CE2-CD1 3.49Å; F361-L388 HydrophobicContact CG-CD1 4.12Å; F361-L388 HydrophobicContact CZ-CD1 3.77Å; Y384-L388 HydrophobicContact CD1-CD1 3.73Å; Y384-L388 HydrophobicContact CD1-CG 4.05Å; Y384-L388 HydrophobicContact CE1-CD1 3.33Å; Y384-L388 HydrophobicContact CE1-CD2 4.24Å; Y384-L388 HydrophobicContact CE1-CG 3.76Å; Y384-L388 PolarHBondContact O-N 3.26Å; P385-L388 PolarHBondContact O-N 3.37Å; L388-L391 PolarHBondContact O-N 2.93Å; L388-G392 PolarHBondContact O-N 2.78Å
389	Y	66.7	Low	67.9	Low	37 Å²	37	80.7 Å²	80.7	15%	0.145	41%	0.407	C	S	.	.	H	α-helix	trans	-62.9	-44.2	176.3	178.9	-92.7	0	0	0	111.7	P385 Q386 L387 L391 G392 R393 F401 G405 G408	P385-Y389 VanDerWaalsContact O-CB 3.25Å; P385-Y389 WeakPolarHBondContact O-CB 3.5Å; P385-Y389 PolarHBondContact O-N 3.09Å; Q386-Y389 PolarHBondContact O-N 3.37Å; L387-Y389 VanDerWaalsContact C-N 3.27Å; L387-Y389 PolarHBondContact O-N 2.97Å; Y389-L391 PolarHBondContact O-N 3.39Å; Y389-G392 PolarHBondContact O-N 3.26Å; Y389-R393 VanDerWaalsContact CE1-CD 3.5Å; Y389-R393 HydrophobicContact CE1-CG 4.26Å; Y389-R393 WeakPolarHBondContact O-CG 3.41Å; Y389-R393 PolarHBondContact O-N 2.74Å; Y389-R393 VanDerWaalsContact O-N 3.16Å; Y389-F401 HydrophobicContact CD2-CE1 4.36Å; Y389-F401 HydrophobicContact CE2-CD1 4.2Å; Y389-F401 HydrophobicContact CE2-CE1 4.37Å; Y389-G405 WeakPolarHBondContact CE2-O 3.42Å; Y389-G405 PolarHBondContact OH-O 2.91Å; Y389-G408 WeakPolarHBondContact CE1-O 3.46Å
390	R	67.9	Low	67.8	Low	143 Å²	143	76.9 Å²	76.9	54%	0.54	39%	0.394	S	S	.	.	H	α-helix	trans	-59.9	-43.9	174.5	-72.3	175.4	-177.7	-165.2	-2	112.4	Q386 L387	Q386-R390 WeakPolarHBondContact O-CG 3.47Å; Q386-R390 PolarHBondContact O-N 3.44Å; L387-R390 WeakPolarHBondContact O-CB 3.31Å; L387-R390 PolarHBondContact O-N 3.3Å
391	L	68.2	Low	67.9	Low	82 Å²	82	76 Å²	76	43%	0.429	38%	0.383	S	S	.	.	H	α-helix	trans	-69.5	-42.1	178.4	-68.5	174.8	0	0	0	112.2	L387 L388 Y389 R393 L394 L395	L387-L391 HydrophobicContact CD1-CD1 4.21Å; L387-L391 HydrophobicContact CD1-CG 4.28Å; L387-L391 HydrophobicContact CG-CD1 4.09Å; L387-L391 WeakPolarHBondContact O-CG 3.47Å; L387-L391 PolarHBondContact O-N 3.34Å; L388-L391 PolarHBondContact O-N 2.93Å; Y389-L391 PolarHBondContact O-N 3.39Å; L391-R393 VanDerWaalsContact C-N 3.26Å; L391-R393 PolarHBondContact O-N 2.83Å; L391-L394 WeakPolarHBondContact O-CB 3.42Å; L391-L394 PolarHBondContact O-N 3.04Å; L391-L395 WeakPolarHBondContact O-CG 3.27Å; L391-L395 PolarHBondContact O-N 2.67Å
392	G	65.3	Low	67.7	Low	12 Å²	12	74 Å²	74	12%	0.124	37%	0.371	C	S	.	.	H	α-helix	trans	-57.9	-39.3	178.4	0	0	0	0	0	112	L388 Y389 L394 L395 L396 F401	L388-G392 PolarHBondContact O-N 2.78Å; Y389-G392 PolarHBondContact O-N 3.26Å; G392-L394 PolarHBondContact O-N 3.44Å; G392-L395 PolarHBondContact O-N 3.46Å; G392-L395 VanDerWaalsContact O-N 3.09Å; G392-L396 WeakPolarHBondContact O-CB 3.45Å; G392-L396 PolarHBondContact O-N 3.06Å; G392-F401 VanDerWaalsContact C-CZ 3.48Å
393	R	65.6	Low	67	Low	98 Å²	98	78 Å²	78	37%	0.37	40%	0.396	S	S	.	.	H	α-helix	trans	-62.8	-23.4	176	-73.6	-177.2	69.1	-172.4	-4.8	114.4	Y389 L391 F401 G408 A409	Y389-R393 VanDerWaalsContact CE1-CD 3.5Å; Y389-R393 HydrophobicContact CE1-CG 4.26Å; Y389-R393 WeakPolarHBondContact O-CG 3.41Å; Y389-R393 PolarHBondContact O-N 2.74Å; Y389-R393 VanDerWaalsContact O-N 3.16Å; L391-R393 VanDerWaalsContact C-N 3.26Å; L391-R393 PolarHBondContact O-N 2.83Å; R393-F401 HydrophobicContact CG-CZ 4.49Å; R393-G408 PolarHBondContact NH1-O 2.73Å; R393-A409 PolarHBondContact NH1-O 3.13Å
394	L	69.3	Low	66.2	Low	143 Å²	143	72.1 Å²	72.1	75%	0.749	38%	0.376	S	S	*	.	H	α-helix	trans	-84.7	-22.5	176.4	-62.3	172.2	0	0	0	112.3	L391 G392	L391-L394 WeakPolarHBondContact O-CB 3.42Å; L391-L394 PolarHBondContact O-N 3.04Å; G392-L394 PolarHBondContact O-N 3.44Å
395	L	68.6	Low	64.7	Low	146 Å²	146	70.8 Å²	70.8	76%	0.764	37%	0.371	S	S	*	.	H	α-helix	trans	-113.9	-27.7	-166.2	-64.3	175	0	0	0	114.1	L391 G392	L391-L395 WeakPolarHBondContact O-CG 3.27Å; L391-L395 PolarHBondContact O-N 2.67Å; G392-L395 PolarHBondContact O-N 3.46Å; G392-L395 VanDerWaalsContact O-N 3.09Å
396	L	68.6	Low	63	Low	59 Å²	59	72 Å²	72	31%	0.309	38%	0.375	S	S	.	.	S	Bend	trans	-109.6	152.1	-174.6	-58.4	174.5	0	0	0	111.3	L356 G392 F401	L356-L396 HydrophobicContact CD2-CD1 3.76Å; L356-L396 HydrophobicContact CD2-CD2 4Å; G392-L396 WeakPolarHBondContact O-CB 3.45Å; G392-L396 PolarHBondContact O-N 3.06Å; L396-F401 HydrophobicContact CB-CE2 3.79Å; L396-F401 HydrophobicContact CB-CZ 4.13Å; L396-F401 HydrophobicContact CD1-CE2 4.36Å; L396-F401 HydrophobicContact CD1-CZ 3.95Å
397	E	67.9	Low	61.5	Low	162 Å²	162	68.4 Å²	68.4	76%	0.757	36%	0.36	S	S	*	.			trans	-66.3	151.5	173.9	-62.1	-172.8	169.1	0	0	111.8	G399 S400	E397-G399 PolarHBondContact O-N 3.12Å; E397-G399 VanDerWaalsContact O-N 3.11Å; E397-S400 WeakPolarHBondContact O-CB 3.38Å; E397-S400 PolarHBondContact O-N 3.04Å
398	E	59	Low	59.8	Low	138 Å²	138	65.4 Å²	65.4	65%	0.645	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-57	-29.9	-178.2	-66.1	-178.3	170.6	0	0	113	S400 F401 M406	E398-S400 VanDerWaalsContact C-N 3.29Å; E398-S400 PolarHBondContact O-N 2.91Å; E398-F401 PolarHBondContact O-N 2.69Å; E398-M406 HydrophobicContact CB-CE 3.74Å; E398-M406 HydrophobicContact CG-CE 3.66Å
399	G	57.3	Low	57.8	Low	71 Å²	71	66.1 Å²	66.1	73%	0.732	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-73.4	-13.6	178.9	0	0	0	0	0	115.1	E397 F401	E397-G399 PolarHBondContact O-N 3.12Å; E397-G399 VanDerWaalsContact O-N 3.11Å; G399-F401 PolarHBondContact O-N 3.49Å
400	S	66.1	Low	56	Low	43 Å²	43	65.7 Å²	65.7	30%	0.301	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-76	-14	177.5	-61.3	0	0	0	0	112.9	V351 A352 E397 E398	V351-S400 WeakPolarHBondContact CA-O 3.42Å; A352-S400 PolarHBondContact N-O 2.95Å; E397-S400 WeakPolarHBondContact O-CB 3.38Å; E397-S400 PolarHBondContact O-N 3.04Å; E398-S400 VanDerWaalsContact C-N 3.29Å; E398-S400 PolarHBondContact O-N 2.91Å
401	F	67.5	Low	54.1	Low	8 Å²	8	67 Å²	67	4%	0.035	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-104.7	149.9	-178.8	-63.4	-86.7	0	0	0	111.5	A350 V351 Y389 G392 R393 L396 E398 G399 M406	A350-F401 CarbonylContact O-C 3.55Å; A350-F401 WeakPolarHBondContact O-CA 3.42Å; V351-F401 HydrophobicContact CG2-CD1 3.86Å; V351-F401 HydrophobicContact CG2-CE1 3.62Å; Y389-F401 HydrophobicContact CD2-CE1 4.36Å; Y389-F401 HydrophobicContact CE2-CD1 4.2Å; Y389-F401 HydrophobicContact CE2-CE1 4.37Å; G392-F401 VanDerWaalsContact C-CZ 3.48Å; R393-F401 HydrophobicContact CG-CZ 4.49Å; L396-F401 HydrophobicContact CB-CE2 3.79Å; L396-F401 HydrophobicContact CB-CZ 4.13Å; L396-F401 HydrophobicContact CD1-CE2 4.36Å; L396-F401 HydrophobicContact CD1-CZ 3.95Å; E398-F401 PolarHBondContact O-N 2.69Å; G399-F401 PolarHBondContact O-N 3.49Å; F401-M406 HydrophobicContact CB-CG 3.52Å; F401-M406 HydrophobicContact CB-SD 3.33Å; F401-M406 WeakPolarHBondContact CB-SD 3.42Å; F401-M406 HydrophobicContact CD1-SD 4.43Å; F401-M406 HydrophobicContact CD2-CE 4.49Å; F401-M406 HydrophobicContact CD2-SD 3.47Å; F401-M406 WeakPolarHBondContact CD2-SD 3.38Å; F401-M406 HydrophobicContact CE2-SD 4.38Å; F401-M406 HydrophobicContact CG-CG 4.35Å; F401-M406 HydrophobicContact CG-SD 3.5Å; F401-M406 WeakPolarHBondContact CG-SD 3.2Å
402	H	63.6	Low	53.4	Low	4 Å²	4	66.3 Å²	66.3	2%	0.019	39%	0.394	C	S	.	.			trans	-60.3	139.6	169.4	-168.2	-107.1	0	0	0	109.6	A274 F294 S296 A350 L404 G405 M406	A274-H402 HydrophobicContact CB-CB 4.09Å; F294-H402 HydrophobicContact CD1-CB 4.03Å; F294-H402 AromaticContact CD1-CD2 3.84Å; F294-H402 HydrophobicContact CD2-CB 4.2Å; F294-H402 AromaticContact CD2-CD2 3.46Å; F294-H402 VanDerWaalsContact CD2-CD2 3.46Å; F294-H402 WeakPolarHBondContact CD2-CD2 3.43Å; F294-H402 HydrophobicContact CE1-CB 3.71Å; F294-H402 HydrophobicContact CE2-CB 3.84Å; F294-H402 AromaticContact CE2-CD2 3.99Å; F294-H402 HydrophobicContact CG-CB 4.26Å; F294-H402 AromaticContact CG-CD2 3.35Å; F294-H402 WeakPolarHBondContact CG-CD2 3.33Å; F294-H402 HydrophobicContact CZ-CB 3.58Å; S296-H402 WeakPolarHBondContact CB-NE2 3.43Å; S296-H402 PolarHBondContact OG-NE2 2.9Å; A350-H402 PolarHBondContact O-N 3.18Å; H402-L404 VanDerWaalsContact CE1-CD1 3.47Å; H402-L404 WeakPolarHBondContact CE1-CD1 3.39Å; H402-L404 WeakPolarHBondContact CE1-CG 3.46Å; H402-L404 VanDerWaalsContact ND1-CB 3.27Å; H402-L404 WeakPolarHBondContact ND1-CB 3.18Å; H402-L404 PolarHBondContact ND1-N 3.46Å; H402-L404 PolarHBondContact O-N 3.2Å; H402-L404 VanDerWaalsContact O-N 3.17Å; H402-G405 CarbonylContact O-C 3.59Å; H402-G405 WeakPolarHBondContact O-CA 3.25Å; H402-G405 PolarHBondContact O-N 3.48Å; H402-M406 PolarHBondContact O-N 3.42Å
403	P	57.3	Low	52.8	Low	87 Å²	87	69.1 Å²	69.1	57%	0.565	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-34.6	178.4	-27.5	35	0	0	0	113.2	G405 M406 S407	P403-G405 VanDerWaalsContact C-N 3.31Å; P403-M406 PolarHBondContact O-N 2.88Å; P403-S407 PolarHBondContact O-OG 3.46Å
404	L	54.9	Low	52	Low	28 Å²	28	67.5 Å²	67.5	15%	0.147	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-30.2	172.2	-54.2	177.2	0	0	0	111.4	A197 T200 P273 H402 M406 S407	A197-L404 CarbonylContact C-O 3.5Å; A197-L404 WeakPolarHBondContact CA-O 3.47Å; A197-L404 HydrophobicContact CB-CB 3.67Å; A197-L404 HydrophobicContact CB-CD2 3.92Å; A197-L404 HydrophobicContact CB-CG 4.33Å; A197-L404 WeakPolarHBondContact CB-O 3.27Å; T200-L404 HydrophobicContact CG2-CB 4.34Å; P273-L404 HydrophobicContact CB-CD1 3.89Å; P273-L404 HydrophobicContact CG-CD1 4.29Å; H402-L404 VanDerWaalsContact CE1-CD1 3.47Å; H402-L404 WeakPolarHBondContact CE1-CD1 3.39Å; H402-L404 WeakPolarHBondContact CE1-CG 3.46Å; H402-L404 VanDerWaalsContact ND1-CB 3.27Å; H402-L404 WeakPolarHBondContact ND1-CB 3.18Å; H402-L404 PolarHBondContact ND1-N 3.46Å; H402-L404 PolarHBondContact O-N 3.2Å; H402-L404 VanDerWaalsContact O-N 3.17Å; L404-M406 VanDerWaalsContact C-N 3.35Å; L404-S407 PolarHBondContact O-OG 2.99Å
405	G	41.9	Very low	51	Low	0 Å²	0	63.1 Å²	63.1	0%	0	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-69.1	-27.1	175.4	0	0	0	0	0	113.8	T200 Y389 H402 P403 S407	T200-G405 WeakPolarHBondContact OG1-CA 3.46Å; Y389-G405 WeakPolarHBondContact CE2-O 3.42Å; Y389-G405 PolarHBondContact OH-O 2.91Å; H402-G405 CarbonylContact O-C 3.59Å; H402-G405 WeakPolarHBondContact O-CA 3.25Å; H402-G405 PolarHBondContact O-N 3.48Å; P403-G405 VanDerWaalsContact C-N 3.31Å; G405-S407 PolarHBondContact O-N 3.33Å
406	M	37.1	Very low	49.9	Very low	51 Å²	51	57.9 Å²	57.9	25%	0.251	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-77.2	-3.1	-176.7	-73.7	-63.7	-77	0	0	115.3	E398 F401 H402 P403 L404	E398-M406 HydrophobicContact CB-CE 3.74Å; E398-M406 HydrophobicContact CG-CE 3.66Å; F401-M406 HydrophobicContact CB-CG 3.52Å; F401-M406 HydrophobicContact CB-SD 3.33Å; F401-M406 WeakPolarHBondContact CB-SD 3.42Å; F401-M406 HydrophobicContact CD1-SD 4.43Å; F401-M406 HydrophobicContact CD2-CE 4.49Å; F401-M406 HydrophobicContact CD2-SD 3.47Å; F401-M406 WeakPolarHBondContact CD2-SD 3.38Å; F401-M406 HydrophobicContact CE2-SD 4.38Å; F401-M406 HydrophobicContact CG-CG 4.35Å; F401-M406 HydrophobicContact CG-SD 3.5Å; F401-M406 WeakPolarHBondContact CG-SD 3.2Å; H402-M406 PolarHBondContact O-N 3.42Å; P403-M406 PolarHBondContact O-N 2.88Å; L404-M406 VanDerWaalsContact C-N 3.35Å
407	S	37.2	Very low	48.7	Very low	14 Å²	14	57.8 Å²	57.8	10%	0.098	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-93	-7.7	-167.4	-10.3	0	0	0	0	114.5	R106 R110 P403 L404 G405	R106-S407 PolarHBondContact NH1-O 3Å; R106-S407 PolarHBondContact NH2-O 3.42Å; R110-S407 PolarHBondContact NH2-O 3.48Å; P403-S407 PolarHBondContact O-OG 3.46Å; L404-S407 PolarHBondContact O-OG 2.99Å; G405-S407 PolarHBondContact O-N 3.33Å
408	G	33.3	Very low	47.3	Very low	12 Å²	12	50.4 Å²	50.4	12%	0.124	34%	0.344	C	S	.	.	S	Bend	trans	-105.8	134	-168.8	0	0	0	0	0	115.5	Y389 R393	Y389-G408 WeakPolarHBondContact CE1-O 3.46Å; R393-G408 PolarHBondContact NH1-O 2.73Å
409	A	31.6	Very low	46.4	Very low	51 Å²	51	43.6 Å²	43.6	42%	0.421	32%	0.321	S	S	.	.			trans	65.6	86.1	170.5	0	0	0	0	0	116.6	R393	R393-A409 PolarHBondContact NH1-O 3.13Å
410	G	27.3	Very low	45.5	Very low	28 Å²	28	41.3 Å²	41.3	29%	0.289	29%	0.286	S	S	.	.			trans	-87.9	117.6	150.9	0	0	0	0	0	107.7
411	S	28.6	Very low	43.7	Very low	170 Å²	170	41.2 Å²	41.2	100%	1.189	29%	0.285	S	S	*	.			trans	51	0	175.7	61.5	0	0	0	0	117.8

Retrieved 411 of 411 residues in 180.8 ms (Link to these results)

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