A0A5K4ECQ7_SCHMA Loading...

2'-phosphotransferase

Catalyzes the last step of tRNA splicing, the transfer of the splice junction 2'-phosphate from ligated tRNA to NAD to produce ADP-ribose 1''-2'' cyclic phosphate.

AlphaFold DB , UniProt , Accession A0A5K4ECQ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 346 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	41.9	Very low	36.2	Very low	242 Å²	242	139.9 Å²	139.9	100%	1.192	86%	0.861	S	S	*	*				0	136.4	0	-78.8	-179.5	158.9	0	0	107.7
2	S	38.3	Very low	36	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	86%	0.863	S	S	*	*			trans	60.9	95.7	-173	70.8	0	0	0	0	117.7
3	T	35.5	Very low	35.6	Very low	120 Å²	120	142.2 Å²	142.2	74%	0.736	85%	0.854	S	S	*	*				71.6	104.6	67.5	66.1	0	0	0	0	112.6
4	T	36.4	Very low	35.5	Very low	143 Å²	143	140.8 Å²	140.8	88%	0.877	85%	0.849	S	S	*	*				106.7	137	73	49.1	0	0	0	0	110.4
5	G	37.5	Very low	35	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	85%	0.85	S	S	*	*			trans	177.7	62.1	168.4	0	0	0	0	0	113.3
6	D	30.7	Very low	34.9	Very low	169 Å²	169	138.9 Å²	138.9	90%	0.904	85%	0.846	S	S	*	*			trans	-69.6	141.9	166.7	-109.4	-35.3	0	0	0	110.8
7	A	38.8	Very low	34.5	Very low	101 Å²	101	141.7 Å²	141.7	84%	0.835	85%	0.847	S	S	*	*			trans	-152.6	116.7	152.9	0	0	0	0	0	111
8	S	33.9	Very low	34.4	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	85%	0.851	S	S	*	*			trans	-66.1	148.5	-178.8	43.3	0	0	0	0	114.9
9	K	37	Very low	33.9	Very low	214 Å²	214	150.3 Å²	150.3	93%	0.93	85%	0.853	S	S	*	*			trans	-127	115.2	145.9	-89.5	-175.3	179.2	176.9	0	109.5
10	T	31.5	Very low	33.6	Very low	133 Å²	133	149.2 Å²	149.2	82%	0.816	85%	0.853	S	S	*	*			trans	-80.7	138.1	169.7	39.7	0	0	0	0	110.3
11	S	36.4	Very low	33.1	Very low	124 Å²	124	148.4 Å²	148.4	87%	0.867	85%	0.851	S	S	*	*			trans	-148	137	149.3	64.8	0	0	0	0	110
12	K	34.1	Very low	32.6	Very low	204 Å²	204	141.9 Å²	141.9	89%	0.887	83%	0.83	S	S	*	*			trans	-75.3	156.5	-162.2	-65.4	161.1	172.4	175.7	0	113.4
13	S	30.9	Very low	31.9	Very low	106 Å²	106	148.2 Å²	148.2	74%	0.741	84%	0.837	S	S	*	*			trans	-66.9	168.4	159.5	50.8	0	0	0	0	111.9
14	P	34.1	Very low	31.5	Very low	122 Å²	122	152 Å²	152	79%	0.792	85%	0.849	S	S	*	*				-137.5	140.7	123.4	35.5	-22.6	0	0	0	114
15	T	27.4	Very low	30.9	Very low	139 Å²	139	150.3 Å²	150.3	85%	0.853	85%	0.849	S	S	*	*			trans	-59.2	140.1	157.1	33.6	0	0	0	0	111
16	S	34.2	Very low	30.4	Very low	113 Å²	113	150.5 Å²	150.5	79%	0.79	85%	0.851	S	S	*	*			trans	-134	117.7	160.9	115.5	0	0	0	0	109.8
17	H	28.8	Very low	30.1	Very low	186 Å²	186	150.4 Å²	150.4	86%	0.861	85%	0.847	S	S	*	*			trans	-67.5	134.8	163.3	-79.9	-58.3	0	0	0	110.6
18	R	31.4	Very low	29.5	Very low	242 Å²	242	154.9 Å²	154.9	91%	0.913	85%	0.848	S	S	*	*			trans	-141.3	103.7	141.4	-80.3	-164.7	178.6	-175.6	-1	110.3
19	K	26	Very low	29.2	Very low	205 Å²	205	156.3 Å²	156.3	89%	0.891	85%	0.847	S	S	*	*			trans	-83.8	133.1	147.7	-80.1	179.6	175	178.1	0	106.8
20	C	27	Very low	28.5	Very low	128 Å²	128	155.4 Å²	155.4	87%	0.865	84%	0.843	S	S	*	*			trans	-143.7	118.8	156.2	-155	0	0	0	0	109.1
21	T	23.5	Very low	28.2	Very low	132 Å²	132	155.4 Å²	155.4	81%	0.81	85%	0.847	S	S	*	*			trans	-118.6	124.5	173.2	45.7	0	0	0	0	107.4
22	S	30.9	Very low	27.6	Very low	106 Å²	106	153.7 Å²	153.7	74%	0.741	84%	0.835	S	S	*	*			trans	-174.7	116.4	147	63.2	0	0	0	0	108.2
23	R	24.8	Very low	27.4	Very low	239 Å²	239	149.7 Å²	149.7	90%	0.902	83%	0.828	S	S	*	*				49.6	109.3	89.4	-89.2	-171.7	169.6	-165.7	-2.3	113.8
24	M	26.7	Very low	27.4	Very low	201 Å²	201	151 Å²	151	99%	0.99	84%	0.836	S	S	*	*			trans	-143.5	111.8	136.4	-92.2	-149.7	172.5	0	0	109.9
25	A	23.6	Very low	27	Very low	107 Å²	107	152.3 Å²	152.3	88%	0.884	84%	0.835	S	S	*	*			trans	-101.6	136	149	0	0	0	0	0	105.5
26	G	27.1	Very low	27.2	Very low	83 Å²	83	154.6 Å²	154.6	86%	0.856	84%	0.836	S	S	*	*			trans	-176.8	120.1	-178.7	0	0	0	0	0	111.2
27	M	23.1	Very low	26.9	Very low	167 Å²	167	155.6 Å²	155.6	82%	0.823	84%	0.837	S	S	*	*			trans	-116.7	124.1	-165.8	-177.3	162.6	96.6	0	0	107.6
28	F	27.8	Very low	27.1	Very low	196 Å²	196	152.2 Å²	152.2	86%	0.86	83%	0.834	S	S	*	*			trans	-159.4	110.6	161	-88.5	-78	0	0	0	107.7
29	L	26.2	Very low	27.1	Very low	136 Å²	136	145.8 Å²	145.8	71%	0.712	83%	0.827	S	S	*	*				67.6	112.7	91.2	-92.9	104.1	0	0	0	115.4
30	F	22.6	Very low	27.1	Very low	195 Å²	195	141.4 Å²	141.4	86%	0.855	82%	0.822	S	S	*	*			trans	23.8	122.2	142.1	-74.9	-89.9	0	0	0	119.8
31	C	25	Very low	27.4	Very low	133 Å²	133	141.1 Å²	141.1	90%	0.899	82%	0.817	S	S	*	*				-150.3	137.2	129.7	-163.8	0	0	0	0	111.1
32	S	25.3	Very low	27.7	Very low	87 Å²	87	143.1 Å²	143.1	61%	0.608	82%	0.817	S	S	*	*			trans	-81.7	168.1	-174.2	-68.1	0	0	0	0	113.5
33	T	28.3	Very low	27.6	Very low	121 Å²	121	147.1 Å²	147.1	74%	0.742	82%	0.821	S	S	*	*			trans	76.7	102.3	156.8	55.8	0	0	0	0	118.5
34	C	31.1	Very low	27.7	Very low	134 Å²	134	144.8 Å²	144.8	91%	0.905	82%	0.817	S	S	*	*				-144.7	105.2	121	-88.8	0	0	0	0	108.6
35	L	26.3	Very low	27.8	Very low	149 Å²	149	140.9 Å²	140.9	78%	0.78	80%	0.804	S	S	*	*			trans	-63.1	128.9	161.3	-77.2	131.6	0	0	0	108
36	H	32.4	Very low	28.1	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.866	80%	0.803	S	S	*	*			trans	-148.1	135.1	139.2	-97.3	78.5	0	0	0	108.6
37	T	26	Very low	28.4	Very low	133 Å²	133	148 Å²	148	82%	0.816	80%	0.8	S	S	*	*			trans	-73.6	130.5	-171.6	47.8	0	0	0	0	112.2
38	S	33.3	Very low	29.1	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	79%	0.79	S	S	*	*			trans	-153.8	116.4	155.7	56.1	0	0	0	0	111.3
39	S	32	Very low	29.5	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	78%	0.783	S	S	*	*			trans	-1.1	114.3	171.2	64.1	0	0	0	0	119	T41	S39-T41 PolarHBondContact O-N 2.95Å
40	S	26.5	Very low	29.9	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	78%	0.777	S	S	*	*			trans	-68.6	99.7	155.3	50.1	0	0	0	0	110.9	E42	S40-E42 PolarHBondContact O-N 3.42Å
41	T	33.3	Very low	30.7	Very low	123 Å²	123	132.9 Å²	132.9	76%	0.755	77%	0.766	S	S	*	*			trans	-85.5	92.9	151.5	47.4	0	0	0	0	107.6	S39 K43	S39-T41 PolarHBondContact O-N 2.95Å; T41-K43 VanDerWaalsContact C-N 3.34Å; T41-K43 PolarHBondContact O-N 3.31Å
42	E	28.4	Very low	31.6	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	76%	0.757	S	S	*	*			trans	-62.3	95.9	165.8	-74.9	-175.6	155.4	0	0	108.7	S40 K44	S40-E42 PolarHBondContact O-N 3.42Å; E42-K44 VanDerWaalsContact C-N 3.29Å; E42-K44 PolarHBondContact O-N 2.9Å
43	K	29.5	Very low	32.4	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.826	76%	0.761	S	S	*	*			trans	-68.7	94.7	159.1	-84.7	-177	175.6	178.4	0	107.2	T41 V45	T41-K43 VanDerWaalsContact C-N 3.34Å; T41-K43 PolarHBondContact O-N 3.31Å; K43-V45 VanDerWaalsContact C-N 3.27Å; K43-V45 PolarHBondContact O-N 3.43Å
44	K	27.8	Very low	33.1	Very low	190 Å²	190	134.2 Å²	134.2	83%	0.826	75%	0.748	S	S	*	*			trans	-55.5	95.4	157.4	-98.6	179.9	175.1	174.4	0	107.7	E42 Q46	E42-K44 VanDerWaalsContact C-N 3.29Å; E42-K44 PolarHBondContact O-N 2.9Å; K44-Q46 PolarHBondContact O-N 3.47Å; K44-Q46 VanDerWaalsContact O-N 3.07Å
45	V	28.6	Very low	33.5	Very low	119 Å²	119	132.7 Å²	132.7	72%	0.721	73%	0.73	S	S	*	*			trans	-69.7	100.2	163.4	176.3	0	0	0	0	105.8	K43 I47	K43-V45 VanDerWaalsContact C-N 3.27Å; K43-V45 PolarHBondContact O-N 3.43Å; V45-I47 PolarHBondContact O-N 3.08Å
46	Q	29.4	Very low	34.2	Very low	185 Å²	185	132.2 Å²	132.2	86%	0.864	72%	0.724	S	S	*	*			trans	-63.1	103.3	164.5	-83.2	175.9	-15.5	0	0	107.3	K44 A48	K44-Q46 PolarHBondContact O-N 3.47Å; K44-Q46 VanDerWaalsContact O-N 3.07Å; Q46-A48 PolarHBondContact O-N 3.37Å; Q46-A48 VanDerWaalsContact O-N 3.08Å
47	I	33.8	Very low	34.6	Very low	155 Å²	155	127.1 Å²	127.1	80%	0.795	71%	0.706	S	S	*	*			trans	-67.5	104.3	165.3	-59.4	173.4	0	0	0	105.3	V45	V45-I47 PolarHBondContact O-N 3.08Å
48	A	37.5	Very low	35.4	Very low	74 Å²	74	130.2 Å²	130.2	61%	0.612	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-54.6	140.3	171.4	0	0	0	0	0	108.9	Q46	Q46-A48 PolarHBondContact O-N 3.37Å; Q46-A48 VanDerWaalsContact O-N 3.08Å
49	P	35.6	Very low	36	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-59.1	146	174.4	27.7	-32.2	0	0	0	108.3	T51	P49-T51 PolarHBondContact O-N 3.43Å
50	P	35	Very low	37.2	Very low	89 Å²	89	129.3 Å²	129.3	58%	0.578	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-57.3	117.5	-178.3	23.2	-31.1	0	0	0	109	I54	P50-I54 HydrophobicContact CB-CB 4.35Å; P50-I54 HydrophobicContact CB-CD1 4.01Å
51	T	40	Very low	38.8	Very low	103 Å²	103	128.4 Å²	128.4	63%	0.632	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-55.5	145.7	171	-3.9	0	0	0	0	108.6	P49 E53 I54	P49-T51 PolarHBondContact O-N 3.43Å; T51-E53 PolarHBondContact O-N 3.34Å; T51-I54 PolarHBondContact O-N 2.96Å
52	N	44	Very low	41.1	Very low	132 Å²	132	126.7 Å²	126.7	71%	0.706	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.1	-14.7	-175.1	-109.2	-23.1	0	0	0	115.9	Q56	N52-Q56 PolarHBondContact O-N 3.38Å
53	E	41.7	Very low	44.1	Very low	145 Å²	145	121.3 Å²	121.3	68%	0.678	62%	0.62	S	S	*	*	H	α-helix	trans	-67.4	-32	174.9	-72.7	-177.1	145.2	0	0	114.4	T51 L55 Q56 T57	T51-E53 PolarHBondContact O-N 3.34Å; E53-L55 VanDerWaalsContact C-N 3.33Å; E53-L55 PolarHBondContact O-N 3.37Å; E53-Q56 PolarHBondContact O-N 3.02Å; E53-T57 PolarHBondContact O-N 2.7Å; E53-T57 PolarHBondContact O-OG1 3.39Å
54	I	44	Very low	47	Very low	92 Å²	92	115.2 Å²	115.2	47%	0.472	59%	0.593	S	S	.	*	H	α-helix	trans	-73.2	-29.8	179.6	-61.9	176.7	0	0	0	111.2	P50 T51 T57 R58	P50-I54 HydrophobicContact CB-CB 4.35Å; P50-I54 HydrophobicContact CB-CD1 4.01Å; T51-I54 PolarHBondContact O-N 2.96Å; I54-T57 WeakPolarHBondContact CA-OG1 3.16Å; I54-T57 PolarHBondContact O-OG1 2.95Å; I54-R58 PolarHBondContact O-N 3.37Å
55	L	38.6	Very low	49.9	Very low	101 Å²	101	111.8 Å²	111.8	53%	0.529	58%	0.579	S	S	.	*	H	α-helix	trans	-74.7	-32.2	175.1	-96	139.9	0	0	0	112.6	E53 K59	E53-L55 VanDerWaalsContact C-N 3.33Å; E53-L55 PolarHBondContact O-N 3.37Å; L55-K59 PolarHBondContact O-N 3.25Å
56	Q	41.2	Very low	52.9	Low	140 Å²	140	110.8 Å²	110.8	65%	0.654	56%	0.563	S	S	*	*	H	α-helix	trans	-70.7	-37.5	174.3	-76.5	-176.2	-11.7	0	0	112.5	N52 E53 K59 S60	N52-Q56 PolarHBondContact O-N 3.38Å; E53-Q56 PolarHBondContact O-N 3.02Å; Q56-K59 PolarHBondContact O-N 3.11Å; Q56-S60 WeakPolarHBondContact O-CB 3.41Å; Q56-S60 PolarHBondContact O-N 2.82Å
57	T	41.5	Very low	56	Low	80 Å²	80	102 Å²	102	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-69.9	-34	179.1	38.9	0	0	0	0	113.5	E53 I54 S60 L61	E53-T57 PolarHBondContact O-N 2.7Å; E53-T57 PolarHBondContact O-OG1 3.39Å; I54-T57 WeakPolarHBondContact CA-OG1 3.16Å; I54-T57 PolarHBondContact O-OG1 2.95Å; T57-S60 PolarHBondContact O-OG 3.19Å; T57-L61 PolarHBondContact O-N 2.97Å
58	R	41.6	Very low	58.9	Low	198 Å²	198	94.6 Å²	94.6	75%	0.747	48%	0.484	S	S	*	.	H	α-helix	trans	-71.5	-38.7	172.7	-80.3	-173.6	177.1	176.3	0.1	113.1	I54 S60	I54-R58 PolarHBondContact O-N 3.37Å; R58-S60 VanDerWaalsContact C-N 3.31Å
59	K	46.6	Very low	61.6	Low	160 Å²	160	93.9 Å²	93.9	70%	0.696	47%	0.47	S	S	*	.	H	α-helix	trans	-65.5	-35.2	174.1	-81.9	-174	176.1	-178.3	0	112.3	L55 Q56 R63	L55-K59 PolarHBondContact O-N 3.25Å; Q56-K59 PolarHBondContact O-N 3.11Å; K59-R63 PolarHBondContact O-N 3.23Å
60	S	55.8	Low	64.4	Low	43 Å²	43	89.7 Å²	89.7	30%	0.301	44%	0.441	S	S	.	.	H	α-helix	trans	-67	-44.3	-178.9	77.3	0	0	0	0	111.5	Q56 T57 R58 D62 R63 Y64	Q56-S60 WeakPolarHBondContact O-CB 3.41Å; Q56-S60 PolarHBondContact O-N 2.82Å; T57-S60 PolarHBondContact O-OG 3.19Å; R58-S60 VanDerWaalsContact C-N 3.31Å; S60-D62 VanDerWaalsContact C-N 3.33Å; S60-D62 PolarHBondContact O-N 3.04Å; S60-R63 PolarHBondContact O-N 2.78Å; S60-Y64 WeakPolarHBondContact O-CD2 3.25Å; S60-Y64 PolarHBondContact O-N 2.69Å; S60-Y64 VanDerWaalsContact O-N 3.09Å
61	L	60.1	Low	67.3	Low	93 Å²	93	85.5 Å²	85.5	49%	0.487	41%	0.414	S	S	.	.	H	α-helix	trans	-57.6	-43.8	178.9	-73.6	170.2	0	0	0	112.5	T57 R63 Y64 E65	T57-L61 PolarHBondContact O-N 2.97Å; L61-R63 PolarHBondContact O-N 2.9Å; L61-Y64 PolarHBondContact O-N 3.17Å; L61-E65 VanDerWaalsContact O-CB 3.31Å; L61-E65 WeakPolarHBondContact O-CB 3.45Å; L61-E65 PolarHBondContact O-N 3.18Å
62	D	83.1	Confident	69.9	Low	87 Å²	87	82.5 Å²	82.5	47%	0.465	39%	0.393	S	S	.	.	H	α-helix	trans	-65.2	-38.3	-179.7	178.6	35.9	0	0	0	112.2	S60 R66	S60-D62 VanDerWaalsContact C-N 3.33Å; S60-D62 PolarHBondContact O-N 3.04Å; D62-R66 WeakPolarHBondContact O-CB 3.27Å; D62-R66 WeakPolarHBondContact O-CG 3.13Å; D62-R66 PolarHBondContact O-N 3.1Å; D62-R66 PolarHBondContact O-NH1 3.14Å; D62-R66 IonicContact OD1-NH1 3.86Å; D62-R66 PolarHBondContact OD1-NH1 2.99Å; D62-R66 IonicContact OD2-CZ 2.62Å; D62-R66 IonicContact OD2-NH1 2.95Å; D62-R66 PolarHBondContact OD2-NH1 2.93Å
63	R	90.9	Very high	72.3	Confident	62 Å²	62	80.3 Å²	80.3	23%	0.234	38%	0.378	C	S	.	.	H	α-helix	trans	-63.4	-49.6	172.8	178.5	173.6	176.1	76.4	-1	112	K59 S60 L61 E65 R66 I67 E107 H108 E113	K59-R63 PolarHBondContact O-N 3.23Å; S60-R63 PolarHBondContact O-N 2.78Å; L61-R63 PolarHBondContact O-N 2.9Å; R63-E65 VanDerWaalsContact C-N 3.3Å; R63-E65 PolarHBondContact O-N 3.01Å; R63-R66 PolarHBondContact O-N 2.86Å; R63-I67 HydrophobicContact CG-CD1 3.94Å; R63-I67 WeakPolarHBondContact O-CG1 3.46Å; R63-I67 PolarHBondContact O-N 2.79Å; R63-E107 PolarHBondContact NH1-O 3.32Å; R63-E107 PolarHBondContact NH2-O 2.79Å; R63-H108 PolarHBondContact NH2-O 3.11Å; R63-E113 IonicContact CZ-OE1 2.72Å; R63-E113 VanDerWaalsContact CZ-OE1 3.24Å; R63-E113 IonicContact CZ-OE2 3.94Å; R63-E113 IonicContact NE-OE1 3.95Å; R63-E113 PolarHBondContact NE-OE1 2.98Å; R63-E113 IonicContact NE-OE2 2.93Å; R63-E113 VanDerWaalsContact NH2-CD 3.26Å; R63-E113 IonicContact NH2-OE1 3.98Å; R63-E113 PolarHBondContact NH2-OE1 2.87Å; R63-E113 IonicContact NH2-OE2 3.24Å; R63-E113 PolarHBondContact NH2-OE2 3.07Å
64	Y	90.1	Very high	74.9	Confident	62 Å²	62	73.7 Å²	73.7	24%	0.243	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-36.1	-179.2	-71.6	-66.8	0	0	0	111.9	S60 L61 G68 E113 D116 V117	S60-Y64 WeakPolarHBondContact O-CD2 3.25Å; S60-Y64 PolarHBondContact O-N 2.69Å; S60-Y64 VanDerWaalsContact O-N 3.09Å; L61-Y64 PolarHBondContact O-N 3.17Å; Y64-G68 PolarHBondContact O-N 3.16Å; Y64-E113 HydrophobicContact CE1-CG 4.45Å; Y64-D116 HydrophobicContact CD1-CB 4.42Å; Y64-D116 HydrophobicContact CE1-CB 3.85Å; Y64-D116 WeakPolarHBondContact CE1-OD2 3.46Å; Y64-V117 HydrophobicContact CD1-CG2 3.71Å; Y64-V117 HydrophobicContact CG-CG2 4.43Å; Y64-V117 WeakPolarHBondContact O-CG2 3.46Å
65	E	89.1	Confident	77.3	Confident	117 Å²	117	70.5 Å²	70.5	55%	0.547	33%	0.331	S	S	.	.	H	α-helix	trans	-65.7	-43.8	174.4	-172.8	169.9	-174.7	0	0	111.8	L61 R63 G68 N69	L61-E65 VanDerWaalsContact O-CB 3.31Å; L61-E65 WeakPolarHBondContact O-CB 3.45Å; L61-E65 PolarHBondContact O-N 3.18Å; R63-E65 VanDerWaalsContact C-N 3.3Å; R63-E65 PolarHBondContact O-N 3.01Å; E65-G68 PolarHBondContact O-N 3.26Å; E65-N69 WeakPolarHBondContact O-CB 3.38Å; E65-N69 VanDerWaalsContact O-CG 3.23Å; E65-N69 PolarHBondContact O-N 3.18Å; E65-N69 PolarHBondContact O-ND2 3.33Å
66	R	91.6	Very high	79.8	Confident	98 Å²	98	70.8 Å²	70.8	37%	0.37	33%	0.328	S	S	.	.	H	α-helix	trans	-58.6	-49	173.2	-78.2	-164.2	-57.3	-80.5	4.4	112.6	D62 R63 G68 N69 L70 E107	D62-R66 WeakPolarHBondContact O-CB 3.27Å; D62-R66 WeakPolarHBondContact O-CG 3.13Å; D62-R66 PolarHBondContact O-N 3.1Å; D62-R66 PolarHBondContact O-NH1 3.14Å; D62-R66 IonicContact OD1-NH1 3.86Å; D62-R66 PolarHBondContact OD1-NH1 2.99Å; D62-R66 IonicContact OD2-CZ 2.62Å; D62-R66 IonicContact OD2-NH1 2.95Å; D62-R66 PolarHBondContact OD2-NH1 2.93Å; R63-R66 PolarHBondContact O-N 2.86Å; R66-G68 VanDerWaalsContact C-N 3.3Å; R66-G68 PolarHBondContact O-N 2.83Å; R66-N69 PolarHBondContact O-N 3.31Å; R66-L70 WeakPolarHBondContact O-CB 3.48Å; R66-L70 PolarHBondContact O-N 2.84Å; R66-E107 IonicContact NE-OE2 3.29Å
67	I	94.3	Very high	82.2	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-42.2	178	-67	171	0	0	0	110.2	R63 N69 L70 L71 C109 E113 I114 V117	R63-I67 HydrophobicContact CG-CD1 3.94Å; R63-I67 WeakPolarHBondContact O-CG1 3.46Å; R63-I67 PolarHBondContact O-N 2.79Å; I67-N69 PolarHBondContact O-N 3.37Å; I67-L70 PolarHBondContact O-N 2.82Å; I67-L71 WeakPolarHBondContact O-CB 3.36Å; I67-L71 PolarHBondContact O-N 2.88Å; I67-C109 VanDerWaalsContact CG2-SG 3.56Å; I67-E113 HydrophobicContact CD1-CB 4.14Å; I67-I114 HydrophobicContact CG2-CD1 3.67Å; I67-V117 HydrophobicContact CB-CG2 3.86Å; I67-V117 HydrophobicContact CG2-CB 4.5Å; I67-V117 HydrophobicContact CG2-CG2 3.69Å
68	G	94.4	Very high	84.4	Confident	0 Å²	0	70 Å²	70	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-43.1	175.3	0	0	0	0	0	113.4	Y64 E65 R66 L70 L71 E72 V117 F126	Y64-G68 PolarHBondContact O-N 3.16Å; E65-G68 PolarHBondContact O-N 3.26Å; R66-G68 VanDerWaalsContact C-N 3.3Å; R66-G68 PolarHBondContact O-N 2.83Å; G68-L70 VanDerWaalsContact C-N 3.34Å; G68-L71 PolarHBondContact O-N 3.49Å; G68-E72 WeakPolarHBondContact O-CB 3.33Å; G68-E72 PolarHBondContact O-N 3.25Å; G68-V117 VanDerWaalsContact CA-CG1 3.41Å; G68-F126 VanDerWaalsContact O-CZ 3.31Å; G68-F126 WeakPolarHBondContact O-CZ 3.42Å
69	N	93.9	Very high	86.5	Confident	59 Å²	59	61.5 Å²	61.5	32%	0.316	30%	0.301	S	S	.	.	H	α-helix	trans	-68.5	-34.5	177.2	-68.3	-20.5	0	0	0	112.1	E65 R66 I67 Q73 R125	E65-N69 WeakPolarHBondContact O-CB 3.38Å; E65-N69 VanDerWaalsContact O-CG 3.23Å; E65-N69 PolarHBondContact O-N 3.18Å; E65-N69 PolarHBondContact O-ND2 3.33Å; R66-N69 PolarHBondContact O-N 3.31Å; I67-N69 PolarHBondContact O-N 3.37Å; N69-Q73 VanDerWaalsContact O-CG 3.27Å; N69-Q73 WeakPolarHBondContact O-CG 3.49Å; N69-Q73 PolarHBondContact O-N 2.84Å; N69-Q73 PolarHBondContact O-NE2 2.87Å; N69-Q73 VanDerWaalsContact O-NE2 3.14Å; N69-R125 PolarHBondContact OD1-NH1 2.8Å
70	L	94.8	Very high	87.6	Confident	22 Å²	22	62.6 Å²	62.6	12%	0.115	31%	0.309	C	S	.	.	H	α-helix	trans	-67.3	-44.7	173.5	-177	62.7	0	0	0	111.3	R66 I67 G68 E72 Q73 F74 L79 E103 F104 E107	R66-L70 WeakPolarHBondContact O-CB 3.48Å; R66-L70 PolarHBondContact O-N 2.84Å; I67-L70 PolarHBondContact O-N 2.82Å; G68-L70 VanDerWaalsContact C-N 3.34Å; L70-E72 VanDerWaalsContact C-N 3.34Å; L70-E72 PolarHBondContact O-N 2.88Å; L70-Q73 PolarHBondContact O-N 3.38Å; L70-F74 PolarHBondContact O-N 2.84Å; L70-L79 HydrophobicContact CD1-CD1 3.7Å; L70-L79 HydrophobicContact CD1-CD2 4.26Å; L70-L79 HydrophobicContact CG-CD1 4.46Å; L70-E103 HydrophobicContact CD1-CB 3.83Å; L70-E103 HydrophobicContact CD2-CB 4.15Å; L70-F104 HydrophobicContact CD2-CD1 3.92Å; L70-F104 HydrophobicContact CD2-CD2 4.04Å; L70-F104 HydrophobicContact CD2-CE1 4.04Å; L70-F104 HydrophobicContact CD2-CE2 4.18Å; L70-F104 HydrophobicContact CD2-CG 3.94Å; L70-F104 HydrophobicContact CD2-CZ 4.18Å; L70-F104 HydrophobicContact CG-CD1 4.41Å; L70-F104 HydrophobicContact CG-CD2 4.31Å; L70-F104 HydrophobicContact CG-CE1 4.02Å; L70-F104 HydrophobicContact CG-CE2 3.95Å; L70-F104 HydrophobicContact CG-CZ 3.79Å; L70-E107 HydrophobicContact CD2-CG 4.29Å
71	L	96.3	Very high	88.6	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-42.9	174.8	-177.4	61.8	0	0	0	111.9	I67 G68 F74 L75 I98 F104 I114 V118 F126 V133	I67-L71 WeakPolarHBondContact O-CB 3.36Å; I67-L71 PolarHBondContact O-N 2.88Å; G68-L71 PolarHBondContact O-N 3.49Å; L71-F74 PolarHBondContact O-N 3.44Å; L71-L75 HydrophobicContact CD1-CD1 3.86Å; L71-L75 HydrophobicContact CD1-CG 4.18Å; L71-L75 HydrophobicContact CG-CD1 3.8Å; L71-L75 WeakPolarHBondContact O-CB 3.39Å; L71-L75 VanDerWaalsContact O-CG 3.25Å; L71-L75 WeakPolarHBondContact O-CG 3.1Å; L71-L75 PolarHBondContact O-N 2.8Å; L71-I98 HydrophobicContact CD1-CD1 4.1Å; L71-I98 HydrophobicContact CD1-CG2 4.38Å; L71-F104 HydrophobicContact CB-CE1 4.4Å; L71-F104 HydrophobicContact CD1-CE1 4.44Å; L71-F104 HydrophobicContact CD1-CZ 4.43Å; L71-I114 HydrophobicContact CD2-CD1 4.5Å; L71-I114 HydrophobicContact CD2-CG2 4.17Å; L71-V118 HydrophobicContact CD2-CG2 3.9Å; L71-F126 HydrophobicContact CB-CE1 4.3Å; L71-F126 HydrophobicContact CB-CZ 4.29Å; L71-F126 HydrophobicContact CD2-CD1 3.95Å; L71-F126 HydrophobicContact CD2-CD2 4.26Å; L71-F126 HydrophobicContact CD2-CE1 3.99Å; L71-F126 HydrophobicContact CD2-CE2 4.3Å; L71-F126 HydrophobicContact CD2-CG 4.1Å; L71-F126 HydrophobicContact CD2-CZ 4.17Å; L71-F126 HydrophobicContact CG-CD1 4.16Å; L71-F126 HydrophobicContact CG-CE1 3.87Å; L71-F126 HydrophobicContact CG-CZ 4.25Å; L71-V133 HydrophobicContact CD1-CG1 4.33Å; L71-V133 HydrophobicContact CD2-CG2 4.3Å
72	E	95.2	Very high	89.1	Confident	41 Å²	41	68.5 Å²	68.5	19%	0.192	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-42.6	174.8	-176.4	175.3	-172	0	0	112.3	G68 L70 L75 K76 R125 F126 L135	G68-E72 WeakPolarHBondContact O-CB 3.33Å; G68-E72 PolarHBondContact O-N 3.25Å; L70-E72 VanDerWaalsContact C-N 3.34Å; L70-E72 PolarHBondContact O-N 2.88Å; E72-L75 PolarHBondContact O-N 3.45Å; E72-K76 HydrophobicContact CG-CD 3.97Å; E72-K76 HydrophobicContact CG-CG 4.44Å; E72-K76 WeakPolarHBondContact O-CB 3.46Å; E72-K76 VanDerWaalsContact O-CG 3.29Å; E72-K76 WeakPolarHBondContact O-CG 3.44Å; E72-K76 PolarHBondContact O-N 3.14Å; E72-K76 VanDerWaalsContact OE1-CE 3.24Å; E72-K76 WeakPolarHBondContact OE1-CE 3.25Å; E72-K76 IonicContact OE1-NZ 3.11Å; E72-K76 PolarHBondContact OE1-NZ 3.09Å; E72-R125 WeakPolarHBondContact OE2-CD 3.33Å; E72-R125 IonicContact OE2-CZ 3.93Å; E72-R125 IonicContact OE2-NE 2.87Å; E72-R125 IonicContact OE2-NH1 3.54Å; E72-R125 PolarHBondContact OE2-NH1 3.41Å; E72-F126 HydrophobicContact CB-CE1 4.03Å; E72-F126 HydrophobicContact CB-CZ 3.96Å; E72-L135 HydrophobicContact CG-CD1 4.2Å
73	Q	94.5	Very high	88.9	Confident	86 Å²	86	68.9 Å²	68.9	40%	0.402	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-45.2	176.6	-76.4	172.3	74.3	0	0	111.6	N69 L70 K76 G77 K78 L79	N69-Q73 VanDerWaalsContact O-CG 3.27Å; N69-Q73 WeakPolarHBondContact O-CG 3.49Å; N69-Q73 PolarHBondContact O-N 2.84Å; N69-Q73 PolarHBondContact O-NE2 2.87Å; N69-Q73 VanDerWaalsContact O-NE2 3.14Å; L70-Q73 PolarHBondContact O-N 3.38Å; Q73-K76 PolarHBondContact O-N 3.04Å; Q73-G77 PolarHBondContact O-N 2.84Å; Q73-K78 HydrophobicContact CB-CB 4.31Å; Q73-K78 HydrophobicContact CG-CD 4.5Å; Q73-K78 WeakPolarHBondContact O-CB 3.46Å; Q73-K78 PolarHBondContact O-N 2.81Å; Q73-L79 HydrophobicContact CB-CD2 4.18Å; Q73-L79 HydrophobicContact CB-CG 4.26Å
74	F	94.9	Very high	88.6	Confident	5 Å²	5	75 Å²	75	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-56.7	-54.6	174.8	172.4	-109.7	0	0	0	111.3	L70 L71 K76 G77 L79 H81 F85 F93 I98 L101 F104	L70-F74 PolarHBondContact O-N 2.84Å; L71-F74 PolarHBondContact O-N 3.44Å; F74-K76 PolarHBondContact O-N 2.88Å; F74-G77 WeakPolarHBondContact O-CA 3.32Å; F74-G77 PolarHBondContact O-N 3.24Å; F74-L79 HydrophobicContact CB-CD1 3.73Å; F74-L79 HydrophobicContact CB-CG 4.34Å; F74-L79 HydrophobicContact CD2-CD1 4.49Å; F74-H81 AromaticContact CE2-CE1 3.95Å; F74-F85 HydrophobicContact CE2-CE1 4.44Å; F74-F85 AromaticContact CE2-CE2 3.73Å; F74-F85 HydrophobicContact CE2-CE2 3.73Å; F74-F85 AromaticContact CE2-CZ 3.56Å; F74-F85 HydrophobicContact CE2-CZ 3.56Å; F74-F85 HydrophobicContact CZ-CD2 4.5Å; F74-F85 HydrophobicContact CZ-CE1 4.03Å; F74-F85 AromaticContact CZ-CE2 3.79Å; F74-F85 HydrophobicContact CZ-CE2 3.79Å; F74-F85 AromaticContact CZ-CZ 3.54Å; F74-F85 HydrophobicContact CZ-CZ 3.54Å; F74-F93 HydrophobicContact CE1-CB 4.23Å; F74-F93 AromaticContact CE1-CD1 3.99Å; F74-F93 HydrophobicContact CE1-CD1 3.99Å; F74-F93 HydrophobicContact CE1-CD2 4.23Å; F74-F93 HydrophobicContact CE1-CE1 4.42Å; F74-F93 AromaticContact CE1-CG 3.88Å; F74-F93 HydrophobicContact CE1-CG 3.88Å; F74-F93 AromaticContact CZ-CD1 3.79Å; F74-F93 HydrophobicContact CZ-CD1 3.79Å; F74-F93 AromaticContact CZ-CE1 3.98Å; F74-F93 HydrophobicContact CZ-CE1 3.98Å; F74-F93 HydrophobicContact CZ-CG 4.17Å; F74-I98 HydrophobicContact CD1-CD1 3.97Å; F74-I98 HydrophobicContact CD1-CG1 4.03Å; F74-I98 HydrophobicContact CD1-CG2 4.23Å; F74-I98 HydrophobicContact CE1-CD1 3.66Å; F74-I98 HydrophobicContact CE1-CG1 3.51Å; F74-I98 HydrophobicContact CE1-CG2 4.49Å; F74-I98 HydrophobicContact CZ-CG1 4.1Å; F74-L101 HydrophobicContact CD2-CD1 3.49Å; F74-L101 VanDerWaalsContact CD2-CD1 3.49Å; F74-L101 HydrophobicContact CE2-CD1 3.51Å; F74-L101 HydrophobicContact CG-CD1 4.27Å; F74-L101 HydrophobicContact CZ-CD1 4.31Å; F74-F104 HydrophobicContact CB-CE2 3.97Å; F74-F104 HydrophobicContact CB-CZ 3.92Å; F74-F104 HydrophobicContact CG-CE2 4.29Å; F74-F104 HydrophobicContact CG-CZ 4.42Å
75	L	94	Very high	88.6	Confident	25 Å²	25	73.6 Å²	73.6	13%	0.131	36%	0.355	C	S	.	.	H	α-helix	trans	-68.9	-17	-175.6	-64.8	167.5	0	0	0	113.4	L71 E72 G77 F93 F126 L135	L71-L75 HydrophobicContact CD1-CD1 3.86Å; L71-L75 HydrophobicContact CD1-CG 4.18Å; L71-L75 HydrophobicContact CG-CD1 3.8Å; L71-L75 WeakPolarHBondContact O-CB 3.39Å; L71-L75 VanDerWaalsContact O-CG 3.25Å; L71-L75 WeakPolarHBondContact O-CG 3.1Å; L71-L75 PolarHBondContact O-N 2.8Å; E72-L75 PolarHBondContact O-N 3.45Å; L75-G77 VanDerWaalsContact C-N 3.31Å; L75-F93 HydrophobicContact CD2-CD2 3.62Å; L75-F93 HydrophobicContact CD2-CE2 4.16Å; L75-F93 HydrophobicContact CD2-CG 4.4Å; L75-F126 HydrophobicContact CD1-CD1 3.71Å; L75-F126 HydrophobicContact CD1-CE1 3.96Å; L75-L135 HydrophobicContact CB-CB 3.9Å; L75-L135 HydrophobicContact CD1-CB 4.23Å
76	K	92.7	Very high	88.8	Confident	107 Å²	107	70.9 Å²	70.9	47%	0.465	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	0.9	169.6	-75.4	179.9	172	173.2	0	113.5	E72 Q73 F74 K78 L135	E72-K76 HydrophobicContact CG-CD 3.97Å; E72-K76 HydrophobicContact CG-CG 4.44Å; E72-K76 WeakPolarHBondContact O-CB 3.46Å; E72-K76 VanDerWaalsContact O-CG 3.29Å; E72-K76 WeakPolarHBondContact O-CG 3.44Å; E72-K76 PolarHBondContact O-N 3.14Å; E72-K76 VanDerWaalsContact OE1-CE 3.24Å; E72-K76 WeakPolarHBondContact OE1-CE 3.25Å; E72-K76 IonicContact OE1-NZ 3.11Å; E72-K76 PolarHBondContact OE1-NZ 3.09Å; Q73-K76 PolarHBondContact O-N 3.04Å; F74-K76 PolarHBondContact O-N 2.88Å; K76-K78 VanDerWaalsContact C-N 3.29Å; K76-K78 HydrophobicContact CB-CD 4.39Å; K76-K78 HydrophobicContact CB-CG 4.03Å; K76-K78 PolarHBondContact O-N 2.87Å; K76-L135 HydrophobicContact CD-CD2 4.49Å; K76-L135 HydrophobicContact CG-CD2 3.73Å
77	G	90.7	Very high	88.8	Confident	59 Å²	59	73.8 Å²	73.8	61%	0.608	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	22.6	-176.4	0	0	0	0	0	113.8	Q73 F74 L75	Q73-G77 PolarHBondContact O-N 2.84Å; F74-G77 WeakPolarHBondContact O-CA 3.32Å; F74-G77 PolarHBondContact O-N 3.24Å; L75-G77 VanDerWaalsContact C-N 3.31Å
78	K	88.1	Confident	88.6	Confident	145 Å²	145	75 Å²	75	63%	0.63	38%	0.376	S	S	*	.			trans	-87.1	-14.8	-178.1	-63.3	-172.9	173.8	-169.8	0	113.9	Q73 K76	Q73-K78 HydrophobicContact CB-CB 4.31Å; Q73-K78 HydrophobicContact CG-CD 4.5Å; Q73-K78 WeakPolarHBondContact O-CB 3.46Å; Q73-K78 PolarHBondContact O-N 2.81Å; K76-K78 VanDerWaalsContact C-N 3.29Å; K76-K78 HydrophobicContact CB-CD 4.39Å; K76-K78 HydrophobicContact CB-CG 4.03Å; K76-K78 PolarHBondContact O-N 2.87Å
79	L	85	Confident	88.3	Confident	19 Å²	19	79.4 Å²	79.4	10%	0.099	41%	0.405	C	S	.	.	S	Bend	trans	-93.7	127.8	176.2	-58.4	-175.5	0	0	0	109.7	L70 Q73 F74 H81 E103 F104	L70-L79 HydrophobicContact CD1-CD1 3.7Å; L70-L79 HydrophobicContact CD1-CD2 4.26Å; L70-L79 HydrophobicContact CG-CD1 4.46Å; Q73-L79 HydrophobicContact CB-CD2 4.18Å; Q73-L79 HydrophobicContact CB-CG 4.26Å; F74-L79 HydrophobicContact CB-CD1 3.73Å; F74-L79 HydrophobicContact CB-CG 4.34Å; F74-L79 HydrophobicContact CD2-CD1 4.49Å; L79-H81 PolarHBondContact O-N 2.83Å; L79-H81 PolarHBondContact O-ND1 3.18Å; L79-E103 HydrophobicContact CD1-CB 4.37Å; L79-E103 HydrophobicContact CD1-CG 4.32Å; L79-E103 HydrophobicContact CD2-CG 4.42Å; L79-F104 HydrophobicContact CD1-CE2 3.96Å
80	Q	70.8	Confident	88.1	Confident	183 Å²	183	81.4 Å²	81.4	86%	0.855	42%	0.415	S	S	*	.			trans	-76.1	123.6	175.2	-67.9	-172.5	-11.5	0	0	109.6
81	H	75.6	Confident	87.9	Confident	74 Å²	74	82.6 Å²	82.6	34%	0.343	43%	0.434	S	S	.	.			trans	-141	140.5	176.3	52.2	-89.6	0	0	0	109.9	F74 L79 H83 F85 L101	F74-H81 AromaticContact CE2-CE1 3.95Å; L79-H81 PolarHBondContact O-N 2.83Å; L79-H81 PolarHBondContact O-ND1 3.18Å; H81-H83 VanDerWaalsContact C-N 3.29Å; H81-F85 AromaticContact CD2-CE2 3.35Å; H81-F85 WeakPolarHBondContact CD2-CE2 3.31Å; H81-F85 AromaticContact CG-CE2 3.96Å; H81-F85 AromaticContact NE2-CD2 3.96Å; H81-F85 AromaticContact NE2-CE2 3.41Å; H81-F85 WeakPolarHBondContact NE2-CE2 3.36Å; H81-L101 HydrophobicContact CB-CD2 3.78Å
82	I	71.3	Confident	87.9	Confident	186 Å²	186	83.2 Å²	83.2	95%	0.954	44%	0.436	S	S	*	.			trans	-90.8	-3.8	172.9	-49	174.2	0	0	0	109.8
83	H	78	Confident	87.9	Confident	96 Å²	96	83.8 Å²	83.8	44%	0.444	44%	0.438	S	S	.	.			trans	-70.8	132	-175.3	-154.9	73.7	0	0	0	111.3	H81 F85 L101	H81-H83 VanDerWaalsContact C-N 3.29Å; H83-F85 HydrophobicContact CB-CE2 4.46Å; H83-F85 HydrophobicContact CB-CZ 4.39Å; H83-L101 HydrophobicContact CB-CD2 4.23Å
84	K	85	Confident	88	Confident	191 Å²	191	81.5 Å²	81.5	83%	0.83	43%	0.428	S	S	*	.			trans	-88.9	112.9	172.5	-171.8	178.7	-179.1	-178.9	0	108.5
85	F	91.4	Very high	88.1	Confident	31 Å²	31	81.3 Å²	81.3	14%	0.136	43%	0.427	C	S	.	.			trans	-82.1	159.1	178.4	-68.6	-76.5	0	0	0	112.7	F74 H81 H83 D87 F93 E97 L101	F74-F85 HydrophobicContact CE2-CE1 4.44Å; F74-F85 AromaticContact CE2-CE2 3.73Å; F74-F85 HydrophobicContact CE2-CE2 3.73Å; F74-F85 AromaticContact CE2-CZ 3.56Å; F74-F85 HydrophobicContact CE2-CZ 3.56Å; F74-F85 HydrophobicContact CZ-CD2 4.5Å; F74-F85 HydrophobicContact CZ-CE1 4.03Å; F74-F85 AromaticContact CZ-CE2 3.79Å; F74-F85 HydrophobicContact CZ-CE2 3.79Å; F74-F85 AromaticContact CZ-CZ 3.54Å; F74-F85 HydrophobicContact CZ-CZ 3.54Å; H81-F85 AromaticContact CD2-CE2 3.35Å; H81-F85 WeakPolarHBondContact CD2-CE2 3.31Å; H81-F85 AromaticContact CG-CE2 3.96Å; H81-F85 AromaticContact NE2-CD2 3.96Å; H81-F85 AromaticContact NE2-CE2 3.41Å; H81-F85 WeakPolarHBondContact NE2-CE2 3.36Å; H83-F85 HydrophobicContact CB-CE2 4.46Å; H83-F85 HydrophobicContact CB-CZ 4.39Å; F85-D87 PolarHBondContact O-N 3.17Å; F85-F93 HydrophobicContact CB-CD1 4.15Å; F85-F93 HydrophobicContact CB-CE1 4.2Å; F85-F93 HydrophobicContact CD1-CD1 4.16Å; F85-F93 HydrophobicContact CD2-CD1 4.31Å; F85-F93 HydrophobicContact CD2-CE1 4.04Å; F85-F93 AromaticContact CG-CD1 3.94Å; F85-F93 HydrophobicContact CG-CD1 3.94Å; F85-F93 HydrophobicContact CG-CE1 4.06Å; F85-E97 HydrophobicContact CD1-CB 3.67Å; F85-E97 HydrophobicContact CD1-CG 4.47Å; F85-E97 HydrophobicContact CE1-CB 3.8Å; F85-L101 HydrophobicContact CZ-CD1 4.03Å; F85-L101 HydrophobicContact CZ-CD2 3.9Å; F85-L101 HydrophobicContact CZ-CG 4.16Å
86	T	93.2	Very high	88.2	Confident	61 Å²	61	84.1 Å²	84.1	37%	0.374	44%	0.442	S	S	.	.			trans	-61.3	125.6	166.2	-63.3	0	0	0	0	109.6	L88 L94 E97	T86-L88 HydrophobicContact CG2-CD2 3.98Å; T86-L88 HydrophobicContact CG2-CG 4.08Å; T86-L88 PolarHBondContact O-N 2.83Å; T86-L94 HydrophobicContact CG2-CD1 4.33Å; T86-E97 WeakPolarHBondContact CB-OE1 3.49Å; T86-E97 PolarHBondContact N-OE1 3.28Å; T86-E97 PolarHBondContact N-OE2 2.49Å; T86-E97 VanDerWaalsContact N-OE2 3.16Å; T86-E97 PolarHBondContact OG1-OE1 3.02Å
87	D	89.8	Confident	88.3	Confident	159 Å²	159	80.5 Å²	80.5	85%	0.85	43%	0.427	S	S	*	.			trans	-71.8	111.7	176	-172.7	22.3	0	0	0	109.7	F85	F85-D87 PolarHBondContact O-N 3.17Å
88	L	91.6	Very high	88.6	Confident	26 Å²	26	77.7 Å²	77.7	14%	0.136	40%	0.398	C	S	.	.			trans	-121.9	142.8	-179.6	-67	178.4	0	0	0	109.9	T86 Y92 L94 K132	T86-L88 HydrophobicContact CG2-CD2 3.98Å; T86-L88 HydrophobicContact CG2-CG 4.08Å; T86-L88 PolarHBondContact O-N 2.83Å; L88-Y92 WeakPolarHBondContact CB-O 3.45Å; L88-L94 HydrophobicContact CD1-CD2 4.07Å; L88-L94 HydrophobicContact CD1-CG 3.99Å; L88-K132 HydrophobicContact CD1-CD 3.91Å; L88-K132 HydrophobicContact CD1-CG 3.91Å; L88-K132 HydrophobicContact CD2-CD 4.49Å
89	P	88.4	Confident	88.9	Confident	92 Å²	92	72 Å²	72	60%	0.597	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-66.3	161.5	-179.4	28.6	-35.7	0	0	0	112	G91 Y92	P89-G91 PolarHBondContact O-N 2.81Å; P89-Y92 WeakPolarHBondContact O-CD2 3.4Å; P89-Y92 PolarHBondContact O-N 3.41Å
90	D	88	Confident	89.3	Confident	101 Å²	101	75.6 Å²	75.6	54%	0.54	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	55.6	29	172.7	-46.7	-40.1	0	0	0	115.9	Y92 R134	D90-Y92 VanDerWaalsContact C-N 3.34Å; D90-Y92 HydrophobicContact CB-CD2 4.21Å; D90-Y92 HydrophobicContact CB-CE2 4.35Å; D90-Y92 PolarHBondContact O-N 3.4Å; D90-R134 VanDerWaalsContact O-CD 3.25Å; D90-R134 WeakPolarHBondContact O-CD 3.3Å; D90-R134 PolarHBondContact O-NH1 2.88Å; D90-R134 VanDerWaalsContact O-NH1 3.08Å
91	G	91.1	Very high	90.3	Very high	48 Å²	48	67.1 Å²	67.1	50%	0.495	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	71.9	23.3	175.9	0	0	0	0	0	114.6	P89 R134	P89-G91 PolarHBondContact O-N 2.81Å; G91-R134 WeakPolarHBondContact O-CB 3.26Å
92	Y	95.9	Very high	91.2	Very high	13 Å²	13	68.2 Å²	68.2	5%	0.051	37%	0.365	C	S	.	.			trans	-78	152.1	172.6	-80.6	-80.8	0	0	0	112	L88 P89 D90 S127 R129 K132 V133 R134	L88-Y92 WeakPolarHBondContact CB-O 3.45Å; P89-Y92 WeakPolarHBondContact O-CD2 3.4Å; P89-Y92 PolarHBondContact O-N 3.41Å; D90-Y92 VanDerWaalsContact C-N 3.34Å; D90-Y92 HydrophobicContact CB-CD2 4.21Å; D90-Y92 HydrophobicContact CB-CE2 4.35Å; D90-Y92 PolarHBondContact O-N 3.4Å; Y92-S127 PolarHBondContact OH-OG 3.05Å; Y92-R129 HydrophobicContact CE1-CB 4.29Å; Y92-R129 HydrophobicContact CE1-CG 4.3Å; Y92-R129 WeakPolarHBondContact OH-CD 3.34Å; Y92-R129 PolarHBondContact OH-NE 3.41Å; Y92-K132 HydrophobicContact CD1-CB 3.64Å; Y92-K132 HydrophobicContact CE1-CB 4.37Å; Y92-K132 HydrophobicContact CG-CB 4.17Å; Y92-V133 CarbonylContact C-O 3.48Å; Y92-V133 WeakPolarHBondContact CA-O 3.31Å; Y92-R134 HydrophobicContact CD1-CB 3.86Å; Y92-R134 HydrophobicContact CD1-CG 3.93Å; Y92-R134 HydrophobicContact CD2-CG 4.45Å; Y92-R134 HydrophobicContact CE1-CB 4.09Å; Y92-R134 HydrophobicContact CE1-CG 3.63Å; Y92-R134 HydrophobicContact CE2-CG 4.18Å; Y92-R134 HydrophobicContact CG-CB 4.12Å; Y92-R134 HydrophobicContact CG-CG 4.33Å; Y92-R134 PolarHBondContact OH-NE 2.77Å
93	F	96.2	Very high	92.2	Very high	53 Å²	53	61.8 Å²	61.8	23%	0.232	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	149.3	172.5	-70.7	-92.7	0	0	0	109.4	F74 L75 F85 I98 K132 V133	F74-F93 HydrophobicContact CE1-CB 4.23Å; F74-F93 AromaticContact CE1-CD1 3.99Å; F74-F93 HydrophobicContact CE1-CD1 3.99Å; F74-F93 HydrophobicContact CE1-CD2 4.23Å; F74-F93 HydrophobicContact CE1-CE1 4.42Å; F74-F93 AromaticContact CE1-CG 3.88Å; F74-F93 HydrophobicContact CE1-CG 3.88Å; F74-F93 AromaticContact CZ-CD1 3.79Å; F74-F93 HydrophobicContact CZ-CD1 3.79Å; F74-F93 AromaticContact CZ-CE1 3.98Å; F74-F93 HydrophobicContact CZ-CE1 3.98Å; F74-F93 HydrophobicContact CZ-CG 4.17Å; L75-F93 HydrophobicContact CD2-CD2 3.62Å; L75-F93 HydrophobicContact CD2-CE2 4.16Å; L75-F93 HydrophobicContact CD2-CG 4.4Å; F85-F93 HydrophobicContact CB-CD1 4.15Å; F85-F93 HydrophobicContact CB-CE1 4.2Å; F85-F93 HydrophobicContact CD1-CD1 4.16Å; F85-F93 HydrophobicContact CD2-CD1 4.31Å; F85-F93 HydrophobicContact CD2-CE1 4.04Å; F85-F93 AromaticContact CG-CD1 3.94Å; F85-F93 HydrophobicContact CG-CD1 3.94Å; F85-F93 HydrophobicContact CG-CE1 4.06Å; F93-I98 HydrophobicContact CB-CD1 3.86Å; F93-I98 HydrophobicContact CB-CG1 4.2Å; F93-K132 CarbonylContact O-C 3.55Å; F93-K132 VanDerWaalsContact O-CA 3.28Å; F93-K132 WeakPolarHBondContact O-CA 3.33Å; F93-V133 PolarHBondContact N-O 3.43Å; F93-V133 PolarHBondContact O-N 3.37Å
94	L	96.9	Very high	93	Very high	38 Å²	38	57.2 Å²	57.2	20%	0.199	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	128.9	172.7	-66.4	175.5	0	0	0	109.8	T86 L88 D96 E97 I98 K132	T86-L94 HydrophobicContact CG2-CD1 4.33Å; L88-L94 HydrophobicContact CD1-CD2 4.07Å; L88-L94 HydrophobicContact CD1-CG 3.99Å; L94-D96 PolarHBondContact O-N 3.06Å; L94-E97 HydrophobicContact CB-CB 4.29Å; L94-E97 HydrophobicContact CB-CG 3.9Å; L94-E97 HydrophobicContact CD1-CG 4.24Å; L94-E97 PolarHBondContact O-N 2.61Å; L94-E97 VanDerWaalsContact O-N 3.09Å; L94-I98 WeakPolarHBondContact O-CG1 3.48Å; L94-I98 PolarHBondContact O-N 2.94Å; L94-I98 VanDerWaalsContact O-N 3.17Å; L94-K132 HydrophobicContact CD2-CG 3.95Å
95	I	96.8	Very high	93.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-38.9	178.7	-64.1	168	0	0	0	110.4	E97 I98 I99 Y111 I114 I115 V128 S131 V133	I95-E97 PolarHBondContact O-N 3.15Å; I95-I98 PolarHBondContact O-N 2.88Å; I95-I98 VanDerWaalsContact O-N 3.1Å; I95-I99 HydrophobicContact CG2-CG2 4.29Å; I95-I99 PolarHBondContact O-N 2.8Å; I95-Y111 HydrophobicContact CB-CD2 3.7Å; I95-Y111 HydrophobicContact CB-CE2 3.66Å; I95-Y111 HydrophobicContact CD1-CD2 4.49Å; I95-Y111 HydrophobicContact CD1-CE2 3.91Å; I95-Y111 HydrophobicContact CG1-CE2 4.36Å; I95-Y111 HydrophobicContact CG2-CD2 3.38Å; I95-Y111 HydrophobicContact CG2-CE2 3.84Å; I95-Y111 HydrophobicContact CG2-CG 4.01Å; I95-I114 HydrophobicContact CD1-CG2 4.11Å; I95-I114 HydrophobicContact CG1-CG2 4.06Å; I95-I114 HydrophobicContact CG2-CB 3.87Å; I95-I114 HydrophobicContact CG2-CG1 4.1Å; I95-I114 HydrophobicContact CG2-CG2 3.86Å; I95-I115 HydrophobicContact CD1-CD1 3.45Å; I95-I115 VanDerWaalsContact CD1-CD1 3.45Å; I95-I115 HydrophobicContact CD1-CG1 4.26Å; I95-V128 HydrophobicContact CD1-CG2 4.2Å; I95-S131 WeakPolarHBondContact CG1-O 3.42Å; I95-S131 PolarHBondContact N-O 2.7Å; I95-V133 HydrophobicContact CD1-CB 4.4Å; I95-V133 HydrophobicContact CG1-CB 4.02Å; I95-V133 HydrophobicContact CG1-CG1 3.83Å
96	D	96.2	Very high	93.4	Very high	84 Å²	84	59.7 Å²	59.7	45%	0.449	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-28.7	178.1	-66.3	-40.2	0	0	0	113.3	L94 I99 Q100 Y111	L94-D96 PolarHBondContact O-N 3.06Å; D96-I99 WeakPolarHBondContact O-CG1 3.15Å; D96-Q100 VanDerWaalsContact O-CG 3.29Å; D96-Q100 WeakPolarHBondContact O-CG 3.22Å; D96-Y111 WeakPolarHBondContact OD1-CD2 3.43Å
97	E	95.3	Very high	93.3	Very high	32 Å²	32	59.5 Å²	59.5	15%	0.15	32%	0.315	C	S	.	.	H	α-helix	trans	-78.9	-37.8	174	-63.8	177.9	143	0	0	111	F85 T86 L94 I95 Q100	F85-E97 HydrophobicContact CD1-CB 3.67Å; F85-E97 HydrophobicContact CD1-CG 4.47Å; F85-E97 HydrophobicContact CE1-CB 3.8Å; T86-E97 WeakPolarHBondContact CB-OE1 3.49Å; T86-E97 PolarHBondContact N-OE1 3.28Å; T86-E97 PolarHBondContact N-OE2 2.49Å; T86-E97 VanDerWaalsContact N-OE2 3.16Å; T86-E97 PolarHBondContact OG1-OE1 3.02Å; L94-E97 HydrophobicContact CB-CB 4.29Å; L94-E97 HydrophobicContact CB-CG 3.9Å; L94-E97 HydrophobicContact CD1-CG 4.24Å; L94-E97 PolarHBondContact O-N 2.61Å; L94-E97 VanDerWaalsContact O-N 3.09Å; I95-E97 PolarHBondContact O-N 3.15Å; E97-Q100 PolarHBondContact O-N 2.96Å
98	I	95.3	Very high	93.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-47.3	179.4	-63.4	173.7	0	0	0	111	L71 F74 F93 L94 I95 Q100 L101 F104 V133	L71-I98 HydrophobicContact CD1-CD1 4.1Å; L71-I98 HydrophobicContact CD1-CG2 4.38Å; F74-I98 HydrophobicContact CD1-CD1 3.97Å; F74-I98 HydrophobicContact CD1-CG1 4.03Å; F74-I98 HydrophobicContact CD1-CG2 4.23Å; F74-I98 HydrophobicContact CE1-CD1 3.66Å; F74-I98 HydrophobicContact CE1-CG1 3.51Å; F74-I98 HydrophobicContact CE1-CG2 4.49Å; F74-I98 HydrophobicContact CZ-CG1 4.1Å; F93-I98 HydrophobicContact CB-CD1 3.86Å; F93-I98 HydrophobicContact CB-CG1 4.2Å; L94-I98 WeakPolarHBondContact O-CG1 3.48Å; L94-I98 PolarHBondContact O-N 2.94Å; L94-I98 VanDerWaalsContact O-N 3.17Å; I95-I98 PolarHBondContact O-N 2.88Å; I95-I98 VanDerWaalsContact O-N 3.1Å; I98-Q100 PolarHBondContact O-N 3.21Å; I98-L101 VanDerWaalsContact O-CB 3.3Å; I98-L101 WeakPolarHBondContact O-CB 3.4Å; I98-L101 WeakPolarHBondContact O-CG 3.35Å; I98-L101 PolarHBondContact O-N 2.71Å; I98-F104 HydrophobicContact CG2-CD1 3.86Å; I98-F104 HydrophobicContact CG2-CD2 3.97Å; I98-F104 HydrophobicContact CG2-CE1 3.53Å; I98-F104 HydrophobicContact CG2-CE2 3.64Å; I98-F104 HydrophobicContact CG2-CG 4.06Å; I98-F104 HydrophobicContact CG2-CZ 3.39Å; I98-V133 HydrophobicContact CD1-CG1 3.39Å
99	I	94.9	Very high	93.6	Very high	24 Å²	24	58.5 Å²	58.5	12%	0.123	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-11.1	-177.8	64.5	176.2	0	0	0	113.1	I95 D96 K105 I114	I95-I99 HydrophobicContact CG2-CG2 4.29Å; I95-I99 PolarHBondContact O-N 2.8Å; D96-I99 WeakPolarHBondContact O-CG1 3.15Å; I99-K105 WeakPolarHBondContact O-CG 3.29Å; I99-I114 HydrophobicContact CG2-CG1 4.05Å
100	Q	93.7	Very high	93.9	Very high	96 Å²	96	57.3 Å²	57.3	45%	0.449	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.7	174.9	-62.1	-56.6	-39.4	0	0	113.9	D96 E97 I98 K105	D96-Q100 VanDerWaalsContact O-CG 3.29Å; D96-Q100 WeakPolarHBondContact O-CG 3.22Å; E97-Q100 PolarHBondContact O-N 2.96Å; I98-Q100 PolarHBondContact O-N 3.21Å; Q100-K105 WeakPolarHBondContact O-CD 3.29Å; Q100-K105 WeakPolarHBondContact O-CE 3.1Å; Q100-K105 PolarHBondContact O-NZ 2.79Å; Q100-K105 VanDerWaalsContact O-NZ 3.08Å
101	L	93	Very high	94.3	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.026	28%	0.283	C	S	.	.	S	Bend	trans	-65.8	145.5	178.3	-69.7	177.1	0	0	0	111.7	F74 H81 H83 F85 I98 E103 F104 K105	F74-L101 HydrophobicContact CD2-CD1 3.49Å; F74-L101 VanDerWaalsContact CD2-CD1 3.49Å; F74-L101 HydrophobicContact CE2-CD1 3.51Å; F74-L101 HydrophobicContact CG-CD1 4.27Å; F74-L101 HydrophobicContact CZ-CD1 4.31Å; H81-L101 HydrophobicContact CB-CD2 3.78Å; H83-L101 HydrophobicContact CB-CD2 4.23Å; F85-L101 HydrophobicContact CZ-CD1 4.03Å; F85-L101 HydrophobicContact CZ-CD2 3.9Å; F85-L101 HydrophobicContact CZ-CG 4.16Å; I98-L101 VanDerWaalsContact O-CB 3.3Å; I98-L101 WeakPolarHBondContact O-CB 3.4Å; I98-L101 WeakPolarHBondContact O-CG 3.35Å; I98-L101 PolarHBondContact O-N 2.71Å; L101-E103 VanDerWaalsContact C-N 3.27Å; L101-E103 PolarHBondContact O-N 2.83Å; L101-F104 HydrophobicContact CB-CD2 3.85Å; L101-F104 HydrophobicContact CD1-CD2 4.06Å; L101-F104 HydrophobicContact CD1-CE2 3.99Å; L101-F104 PolarHBondContact O-N 3.04Å; L101-F104 VanDerWaalsContact O-N 3.12Å; L101-K105 PolarHBondContact O-N 3.3Å
102	P	92.9	Very high	94.4	Very high	96 Å²	96	59 Å²	59	62%	0.623	29%	0.29	S	S	*	.	H	α-helix	trans	-52.8	-41.1	-177.9	-27.2	35.2	0	0	0	113.9	K105 K106	P102-K105 PolarHBondContact O-N 3.49Å; P102-K106 WeakPolarHBondContact O-CB 3.35Å; P102-K106 PolarHBondContact O-N 2.79Å
103	E	92.8	Very high	94.4	Very high	52 Å²	52	60 Å²	60	24%	0.243	30%	0.295	C	S	.	.	H	α-helix	trans	-66.9	-39.7	-178.6	-58.2	90	155.1	0	0	112	L70 L79 L101 E107	L70-E103 HydrophobicContact CD1-CB 3.83Å; L70-E103 HydrophobicContact CD2-CB 4.15Å; L79-E103 HydrophobicContact CD1-CB 4.37Å; L79-E103 HydrophobicContact CD1-CG 4.32Å; L79-E103 HydrophobicContact CD2-CG 4.42Å; L101-E103 VanDerWaalsContact C-N 3.27Å; L101-E103 PolarHBondContact O-N 2.83Å; E103-E107 PolarHBondContact O-N 2.82Å
104	F	94.6	Very high	94.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-76.1	-37.1	178.2	-69.6	-98.2	0	0	0	111.7	L70 L71 F74 L79 I98 L101 K106 E107 H108 C109 I114	L70-F104 HydrophobicContact CD2-CD1 3.92Å; L70-F104 HydrophobicContact CD2-CD2 4.04Å; L70-F104 HydrophobicContact CD2-CE1 4.04Å; L70-F104 HydrophobicContact CD2-CE2 4.18Å; L70-F104 HydrophobicContact CD2-CG 3.94Å; L70-F104 HydrophobicContact CD2-CZ 4.18Å; L70-F104 HydrophobicContact CG-CD1 4.41Å; L70-F104 HydrophobicContact CG-CD2 4.31Å; L70-F104 HydrophobicContact CG-CE1 4.02Å; L70-F104 HydrophobicContact CG-CE2 3.95Å; L70-F104 HydrophobicContact CG-CZ 3.79Å; L71-F104 HydrophobicContact CB-CE1 4.4Å; L71-F104 HydrophobicContact CD1-CE1 4.44Å; L71-F104 HydrophobicContact CD1-CZ 4.43Å; F74-F104 HydrophobicContact CB-CE2 3.97Å; F74-F104 HydrophobicContact CB-CZ 3.92Å; F74-F104 HydrophobicContact CG-CE2 4.29Å; F74-F104 HydrophobicContact CG-CZ 4.42Å; L79-F104 HydrophobicContact CD1-CE2 3.96Å; I98-F104 HydrophobicContact CG2-CD1 3.86Å; I98-F104 HydrophobicContact CG2-CD2 3.97Å; I98-F104 HydrophobicContact CG2-CE1 3.53Å; I98-F104 HydrophobicContact CG2-CE2 3.64Å; I98-F104 HydrophobicContact CG2-CG 4.06Å; I98-F104 HydrophobicContact CG2-CZ 3.39Å; L101-F104 HydrophobicContact CB-CD2 3.85Å; L101-F104 HydrophobicContact CD1-CD2 4.06Å; L101-F104 HydrophobicContact CD1-CE2 3.99Å; L101-F104 PolarHBondContact O-N 3.04Å; L101-F104 VanDerWaalsContact O-N 3.12Å; F104-K106 VanDerWaalsContact C-N 3.32Å; F104-K106 PolarHBondContact O-N 2.89Å; F104-E107 PolarHBondContact O-N 2.83Å; F104-H108 PolarHBondContact O-N 2.98Å; F104-C109 HydrophobicContact CB-CB 4.23Å; F104-C109 HydrophobicContact CD1-CB 4.26Å; F104-C109 WeakPolarHBondContact O-CB 3.49Å; F104-C109 PolarHBondContact O-N 2.92Å; F104-I114 HydrophobicContact CD1-CD1 4.14Å; F104-I114 HydrophobicContact CE1-CD1 3.94Å
105	K	93.7	Very high	94.2	Very high	107 Å²	107	57 Å²	57	47%	0.465	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-40.6	172.2	-79.9	-176.7	165	149.7	0	112.2	I99 Q100 L101 P102 E107 H108	I99-K105 WeakPolarHBondContact O-CG 3.29Å; Q100-K105 WeakPolarHBondContact O-CD 3.29Å; Q100-K105 WeakPolarHBondContact O-CE 3.1Å; Q100-K105 PolarHBondContact O-NZ 2.79Å; Q100-K105 VanDerWaalsContact O-NZ 3.08Å; L101-K105 PolarHBondContact O-N 3.3Å; P102-K105 PolarHBondContact O-N 3.49Å; K105-E107 VanDerWaalsContact C-N 3.26Å; K105-E107 PolarHBondContact O-N 3.08Å; K105-H108 WeakPolarHBondContact O-CA 3.27Å; K105-H108 PolarHBondContact O-N 2.86Å
106	K	92.3	Very high	93.9	Very high	166 Å²	166	59.3 Å²	59.3	72%	0.722	29%	0.294	S	S	*	.	H	α-helix	trans	-61	-36.3	177.1	-176.1	-179	177	-175.8	0	112.2	P102 F104 H108	P102-K106 WeakPolarHBondContact O-CB 3.35Å; P102-K106 PolarHBondContact O-N 2.79Å; F104-K106 VanDerWaalsContact C-N 3.32Å; F104-K106 PolarHBondContact O-N 2.89Å; K106-H108 PolarHBondContact O-N 2.86Å
107	E	91.1	Very high	93.8	Very high	58 Å²	58	55.7 Å²	55.7	27%	0.271	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.3	174.9	-67.6	-63.4	141.8	0	0	113.2	R63 R66 L70 E103 F104 K105 C109	R63-E107 PolarHBondContact NH1-O 3.32Å; R63-E107 PolarHBondContact NH2-O 2.79Å; R66-E107 IonicContact NE-OE2 3.29Å; L70-E107 HydrophobicContact CD2-CG 4.29Å; E103-E107 PolarHBondContact O-N 2.82Å; F104-E107 PolarHBondContact O-N 2.83Å; K105-E107 VanDerWaalsContact C-N 3.26Å; K105-E107 PolarHBondContact O-N 3.08Å; E107-C109 PolarHBondContact O-N 2.84Å
108	H	93.1	Very high	93.7	Very high	153 Å²	153	54.6 Å²	54.6	71%	0.708	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	39.3	-172.2	-57	-74	0	0	0	112.4	R63 F104 K105 K106 T110	R63-H108 PolarHBondContact NH2-O 3.11Å; F104-H108 PolarHBondContact O-N 2.98Å; K105-H108 WeakPolarHBondContact O-CA 3.27Å; K105-H108 PolarHBondContact O-N 2.86Å; K106-H108 PolarHBondContact O-N 2.86Å; H108-T110 PolarHBondContact O-N 2.75Å
109	C	93.7	Very high	93.4	Very high	11 Å²	11	58.9 Å²	58.9	7%	0.074	29%	0.29	C	S	.	.			trans	-68.5	127.5	-175.9	-165.8	0	0	0	0	110.5	I67 F104 E107 E113 I114	I67-C109 VanDerWaalsContact CG2-SG 3.56Å; F104-C109 HydrophobicContact CB-CB 4.23Å; F104-C109 HydrophobicContact CD1-CB 4.26Å; F104-C109 WeakPolarHBondContact O-CB 3.49Å; F104-C109 PolarHBondContact O-N 2.92Å; E107-C109 PolarHBondContact O-N 2.84Å; C109-E113 WeakPolarHBondContact CA-OE2 3.37Å; C109-I114 WeakPolarHBondContact SG-CD1 3.36Å
110	T	95.2	Very high	93.1	Very high	66 Å²	66	59.4 Å²	59.4	41%	0.405	29%	0.293	S	S	.	.			trans	-93.9	164.7	173.5	73.9	0	0	0	0	111.7	H108 D112 E113 I114	H108-T110 PolarHBondContact O-N 2.75Å; T110-D112 VanDerWaalsContact C-N 3.31Å; T110-D112 PolarHBondContact O-N 3.16Å; T110-D112 PolarHBondContact OG1-N 2.92Å; T110-E113 PolarHBondContact N-OE2 3.3Å; T110-E113 PolarHBondContact O-N 2.92Å; T110-E113 WeakPolarHBondContact OG1-CG 3.43Å; T110-E113 PolarHBondContact OG1-N 3.46Å; T110-E113 VanDerWaalsContact OG1-N 3.11Å; T110-I114 PolarHBondContact O-N 3.39Å
111	Y	95.8	Very high	92.9	Very high	67 Å²	67	55.4 Å²	55.4	26%	0.263	28%	0.275	S	S	.	.	H	α-helix	trans	-55.2	-47.9	170.7	179.2	-81.8	0	0	0	111.1	I95 D96 E113 I114 I115 G130 S131	I95-Y111 HydrophobicContact CB-CD2 3.7Å; I95-Y111 HydrophobicContact CB-CE2 3.66Å; I95-Y111 HydrophobicContact CD1-CD2 4.49Å; I95-Y111 HydrophobicContact CD1-CE2 3.91Å; I95-Y111 HydrophobicContact CG1-CE2 4.36Å; I95-Y111 HydrophobicContact CG2-CD2 3.38Å; I95-Y111 HydrophobicContact CG2-CE2 3.84Å; I95-Y111 HydrophobicContact CG2-CG 4.01Å; D96-Y111 WeakPolarHBondContact OD1-CD2 3.43Å; Y111-E113 VanDerWaalsContact C-N 3.3Å; Y111-E113 PolarHBondContact O-N 2.91Å; Y111-I114 WeakPolarHBondContact O-CB 3.47Å; Y111-I114 PolarHBondContact O-N 3.17Å; Y111-I114 VanDerWaalsContact O-N 3.15Å; Y111-I115 HydrophobicContact CD1-CG1 3.88Å; Y111-I115 HydrophobicContact CE1-CD1 4Å; Y111-I115 HydrophobicContact CE1-CG1 3.49Å; Y111-I115 VanDerWaalsContact CE1-CG1 3.49Å; Y111-I115 WeakPolarHBondContact O-CG1 3.38Å; Y111-I115 PolarHBondContact O-N 3.07Å; Y111-G130 PolarHBondContact OH-O 2.9Å; Y111-S131 WeakPolarHBondContact OH-CA 3.49Å
112	D	94.1	Very high	92.6	Very high	119 Å²	119	58 Å²	58	64%	0.636	30%	0.297	S	S	*	.	H	α-helix	trans	-64.7	-33.9	-178.1	-65.7	-33.7	0	0	0	112.4	T110 I115 D116	T110-D112 VanDerWaalsContact C-N 3.31Å; T110-D112 PolarHBondContact O-N 3.16Å; T110-D112 PolarHBondContact OG1-N 2.92Å; D112-I115 PolarHBondContact O-N 3.38Å; D112-D116 PolarHBondContact O-N 2.64Å
113	E	94.4	Very high	92.4	Very high	32 Å²	32	58.5 Å²	58.5	15%	0.15	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-40.2	174.3	-74.1	179.1	137.4	0	0	112	R63 Y64 I67 C109 T110 Y111 I115 D116 V117	R63-E113 IonicContact CZ-OE1 2.72Å; R63-E113 VanDerWaalsContact CZ-OE1 3.24Å; R63-E113 IonicContact CZ-OE2 3.94Å; R63-E113 IonicContact NE-OE1 3.95Å; R63-E113 PolarHBondContact NE-OE1 2.98Å; R63-E113 IonicContact NE-OE2 2.93Å; R63-E113 VanDerWaalsContact NH2-CD 3.26Å; R63-E113 IonicContact NH2-OE1 3.98Å; R63-E113 PolarHBondContact NH2-OE1 2.87Å; R63-E113 IonicContact NH2-OE2 3.24Å; R63-E113 PolarHBondContact NH2-OE2 3.07Å; Y64-E113 HydrophobicContact CE1-CG 4.45Å; I67-E113 HydrophobicContact CD1-CB 4.14Å; C109-E113 WeakPolarHBondContact CA-OE2 3.37Å; T110-E113 PolarHBondContact N-OE2 3.3Å; T110-E113 PolarHBondContact O-N 2.92Å; T110-E113 WeakPolarHBondContact OG1-CG 3.43Å; T110-E113 PolarHBondContact OG1-N 3.46Å; T110-E113 VanDerWaalsContact OG1-N 3.11Å; Y111-E113 VanDerWaalsContact C-N 3.3Å; Y111-E113 PolarHBondContact O-N 2.91Å; E113-I115 VanDerWaalsContact C-N 3.3Å; E113-I115 PolarHBondContact O-N 2.96Å; E113-D116 PolarHBondContact O-N 3.08Å; E113-V117 WeakPolarHBondContact O-CB 3.5Å; E113-V117 VanDerWaalsContact O-CG2 3.31Å; E113-V117 WeakPolarHBondContact O-CG2 3.2Å; E113-V117 PolarHBondContact O-N 3.31Å
114	I	95.5	Very high	92.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.8	-43.5	173	-65.1	-66.1	0	0	0	110.2	I67 L71 I95 I99 F104 C109 T110 Y111 V117 V118	I67-I114 HydrophobicContact CG2-CD1 3.67Å; L71-I114 HydrophobicContact CD2-CD1 4.5Å; L71-I114 HydrophobicContact CD2-CG2 4.17Å; I95-I114 HydrophobicContact CD1-CG2 4.11Å; I95-I114 HydrophobicContact CG1-CG2 4.06Å; I95-I114 HydrophobicContact CG2-CB 3.87Å; I95-I114 HydrophobicContact CG2-CG1 4.1Å; I95-I114 HydrophobicContact CG2-CG2 3.86Å; I99-I114 HydrophobicContact CG2-CG1 4.05Å; F104-I114 HydrophobicContact CD1-CD1 4.14Å; F104-I114 HydrophobicContact CE1-CD1 3.94Å; C109-I114 WeakPolarHBondContact SG-CD1 3.36Å; T110-I114 PolarHBondContact O-N 3.39Å; Y111-I114 WeakPolarHBondContact O-CB 3.47Å; Y111-I114 PolarHBondContact O-N 3.17Å; Y111-I114 VanDerWaalsContact O-N 3.15Å; I114-V117 PolarHBondContact O-N 2.92Å; I114-V118 HydrophobicContact CG2-CG2 4.41Å; I114-V118 VanDerWaalsContact O-CG2 3.24Å; I114-V118 WeakPolarHBondContact O-CG2 3.32Å; I114-V118 PolarHBondContact O-N 3.08Å
115	I	94	Very high	92.2	Very high	30 Å²	30	59 Å²	59	15%	0.154	30%	0.295	C	S	.	.	H	α-helix	trans	-61.6	-45.9	176.7	-64.9	-63.1	0	0	0	111.2	I95 Y111 D112 E113 V117 V118 H119 V128	I95-I115 HydrophobicContact CD1-CD1 3.45Å; I95-I115 VanDerWaalsContact CD1-CD1 3.45Å; I95-I115 HydrophobicContact CD1-CG1 4.26Å; Y111-I115 HydrophobicContact CD1-CG1 3.88Å; Y111-I115 HydrophobicContact CE1-CD1 4Å; Y111-I115 HydrophobicContact CE1-CG1 3.49Å; Y111-I115 VanDerWaalsContact CE1-CG1 3.49Å; Y111-I115 WeakPolarHBondContact O-CG1 3.38Å; Y111-I115 PolarHBondContact O-N 3.07Å; D112-I115 PolarHBondContact O-N 3.38Å; E113-I115 VanDerWaalsContact C-N 3.3Å; E113-I115 PolarHBondContact O-N 2.96Å; I115-V117 PolarHBondContact O-N 3.32Å; I115-V118 PolarHBondContact O-N 2.94Å; I115-H119 WeakPolarHBondContact CG2-CE1 3.08Å; I115-H119 WeakPolarHBondContact CG2-ND1 3.39Å; I115-H119 PolarHBondContact O-N 3.29Å; I115-H119 PolarHBondContact O-ND1 3.25Å; I115-V128 HydrophobicContact CD1-CG2 3.66Å
116	D	91.3	Very high	92.3	Very high	48 Å²	48	54.1 Å²	54.1	26%	0.257	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-42.3	178.6	-167.3	62.4	0	0	0	111.7	Y64 D112 E113 V118 H119 N120 K182	Y64-D116 HydrophobicContact CD1-CB 4.42Å; Y64-D116 HydrophobicContact CE1-CB 3.85Å; Y64-D116 WeakPolarHBondContact CE1-OD2 3.46Å; D112-D116 PolarHBondContact O-N 2.64Å; E113-D116 PolarHBondContact O-N 3.08Å; D116-V118 PolarHBondContact O-N 3.25Å; D116-H119 PolarHBondContact O-N 2.98Å; D116-N120 WeakPolarHBondContact O-CB 3.14Å; D116-N120 PolarHBondContact O-N 3.07Å; D116-N120 PolarHBondContact O-ND2 2.86Å; D116-N120 PolarHBondContact OD1-ND2 3.42Å; D116-N120 PolarHBondContact OD2-ND2 3.28Å; D116-K182 IonicContact OD2-NZ 2.91Å; D116-K182 PolarHBondContact OD2-NZ 3.31Å
117	V	93.2	Very high	92.3	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-57.6	-49.6	173.5	165.4	0	0	0	0	110.8	Y64 I67 G68 E113 I114 I115 H119 N120 D121 F126	Y64-V117 HydrophobicContact CD1-CG2 3.71Å; Y64-V117 HydrophobicContact CG-CG2 4.43Å; Y64-V117 WeakPolarHBondContact O-CG2 3.46Å; I67-V117 HydrophobicContact CB-CG2 3.86Å; I67-V117 HydrophobicContact CG2-CB 4.5Å; I67-V117 HydrophobicContact CG2-CG2 3.69Å; G68-V117 VanDerWaalsContact CA-CG1 3.41Å; E113-V117 WeakPolarHBondContact O-CB 3.5Å; E113-V117 VanDerWaalsContact O-CG2 3.31Å; E113-V117 WeakPolarHBondContact O-CG2 3.2Å; E113-V117 PolarHBondContact O-N 3.31Å; I114-V117 PolarHBondContact O-N 2.92Å; I115-V117 PolarHBondContact O-N 3.32Å; V117-H119 PolarHBondContact O-N 3.23Å; V117-N120 PolarHBondContact O-N 2.91Å; V117-D121 WeakPolarHBondContact O-CB 3.27Å; V117-D121 PolarHBondContact O-N 3.23Å; V117-F126 HydrophobicContact CG1-CE2 4.28Å
118	V	93.4	Very high	92.4	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-41.6	-176.5	171.2	0	0	0	0	111.5	L71 I114 I115 D116 F126 V128 V133	L71-V118 HydrophobicContact CD2-CG2 3.9Å; I114-V118 HydrophobicContact CG2-CG2 4.41Å; I114-V118 VanDerWaalsContact O-CG2 3.24Å; I114-V118 WeakPolarHBondContact O-CG2 3.32Å; I114-V118 PolarHBondContact O-N 3.08Å; I115-V118 PolarHBondContact O-N 2.94Å; D116-V118 PolarHBondContact O-N 3.25Å; V118-F126 HydrophobicContact CB-CB 4.24Å; V118-F126 HydrophobicContact CG1-CB 3.8Å; V118-F126 HydrophobicContact CG2-CB 3.72Å; V118-F126 HydrophobicContact CG2-CD2 4.12Å; V118-F126 HydrophobicContact CG2-CG 4.07Å; V118-V128 HydrophobicContact CG1-CB 3.87Å; V118-V128 HydrophobicContact CG1-CG1 3.99Å; V118-V133 HydrophobicContact CG2-CG2 3.86Å
119	H	88.3	Confident	92.3	Very high	90 Å²	90	46.4 Å²	46.4	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-70.9	-33.5	-179.9	-72.5	147.2	0	0	0	113.4	I115 D116 V117	I115-H119 WeakPolarHBondContact CG2-CE1 3.08Å; I115-H119 WeakPolarHBondContact CG2-ND1 3.39Å; I115-H119 PolarHBondContact O-N 3.29Å; I115-H119 PolarHBondContact O-ND1 3.25Å; D116-H119 PolarHBondContact O-N 2.98Å; V117-H119 PolarHBondContact O-N 3.23Å
120	N	88.8	Confident	92.1	Very high	35 Å²	35	48.9 Å²	48.9	19%	0.187	27%	0.266	C	S	.	.	H	α-helix	trans	-98.2	3.4	-178.5	-63.1	-74.8	0	0	0	114.1	D116 V117 A122 K182 P183	D116-N120 WeakPolarHBondContact O-CB 3.14Å; D116-N120 PolarHBondContact O-N 3.07Å; D116-N120 PolarHBondContact O-ND2 2.86Å; D116-N120 PolarHBondContact OD1-ND2 3.42Å; D116-N120 PolarHBondContact OD2-ND2 3.28Å; V117-N120 PolarHBondContact O-N 2.91Å; N120-A122 PolarHBondContact O-N 3.26Å; N120-A122 VanDerWaalsContact O-N 3.09Å; N120-K182 HydrophobicContact CB-CD 3.98Å; N120-K182 HydrophobicContact CB-CG 4.23Å; N120-P183 WeakPolarHBondContact OD1-CD 3.31Å; N120-P183 WeakPolarHBondContact OD1-CG 3.42Å
121	D	90.5	Very high	92	Very high	13 Å²	13	47.9 Å²	47.9	7%	0.07	26%	0.262	C	S	.	.			trans	-60.7	115.2	180	-174.4	76.9	0	0	0	111.1	V117 L123 L124 R125 F126	V117-D121 WeakPolarHBondContact O-CB 3.27Å; V117-D121 PolarHBondContact O-N 3.23Å; D121-L123 PolarHBondContact O-N 3.49Å; D121-L123 VanDerWaalsContact O-N 3.14Å; D121-L123 VanDerWaalsContact OD2-C 3.32Å; D121-L123 PolarHBondContact OD2-N 2.98Å; D121-L124 PolarHBondContact O-N 2.71Å; D121-L124 VanDerWaalsContact O-N 3.09Å; D121-L124 WeakPolarHBondContact OD2-CA 3.28Å; D121-L124 PolarHBondContact OD2-N 2.97Å; D121-R125 IonicContact OD1-CZ 3.77Å; D121-R125 IonicContact OD1-NE 2.82Å; D121-R125 PolarHBondContact OD1-NE 2.9Å; D121-R125 IonicContact OD1-NH2 2.9Å; D121-R125 PolarHBondContact OD1-NH2 2.98Å; D121-R125 WeakPolarHBondContact OD2-CB 3.42Å; D121-R125 WeakPolarHBondContact OD2-CG 3.21Å; D121-R125 PolarHBondContact OD2-N 3.45Å; D121-R125 IonicContact OD2-NE 2.6Å; D121-F126 HydrophobicContact CB-CD2 4.17Å; D121-F126 HydrophobicContact CB-CE2 4.44Å
122	A	86.2	Confident	92	Very high	60 Å²	60	48.3 Å²	48.3	50%	0.496	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.4	-173.2	0	0	0	0	0	113	N120 I147 K151	N120-A122 PolarHBondContact O-N 3.26Å; N120-A122 VanDerWaalsContact O-N 3.09Å; A122-I147 WeakPolarHBondContact O-CG2 3.26Å; A122-K151 VanDerWaalsContact O-CE 3.26Å; A122-K151 WeakPolarHBondContact O-CE 3.29Å; A122-K151 PolarHBondContact O-NZ 3.2Å
123	L	87.9	Confident	92.2	Very high	105 Å²	105	42.7 Å²	42.7	55%	0.55	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-0.2	-176.6	-60.4	179.3	0	0	0	113	D121 R125 N141	D121-L123 PolarHBondContact O-N 3.49Å; D121-L123 VanDerWaalsContact O-N 3.14Å; D121-L123 VanDerWaalsContact OD2-C 3.32Å; D121-L123 PolarHBondContact OD2-N 2.98Å; L123-R125 HydrophobicContact CB-CG 3.95Å; L123-R125 PolarHBondContact O-N 3.33Å; L123-N141 PolarHBondContact O-ND2 3.2Å
124	L	91	Very high	92.3	Very high	25 Å²	25	43.9 Å²	43.9	13%	0.131	24%	0.238	C	C	.	.			trans	50.5	35.9	-174.8	-60.1	178.2	0	0	0	113.5	D121 F126 K136 N141 I147 K150 K151	D121-L124 PolarHBondContact O-N 2.71Å; D121-L124 VanDerWaalsContact O-N 3.09Å; D121-L124 WeakPolarHBondContact OD2-CA 3.28Å; D121-L124 PolarHBondContact OD2-N 2.97Å; L124-F126 PolarHBondContact O-N 3.48Å; L124-K136 WeakPolarHBondContact O-CD 3.5Å; L124-K136 PolarHBondContact O-NZ 3.29Å; L124-N141 WeakPolarHBondContact CB-ND2 3.3Å; L124-N141 PolarHBondContact O-ND2 3.47Å; L124-I147 HydrophobicContact CD1-CG2 3.97Å; L124-I147 HydrophobicContact CG-CG2 4.1Å; L124-K150 HydrophobicContact CD1-CB 3.63Å; L124-K150 HydrophobicContact CD1-CD 4.14Å; L124-K151 HydrophobicContact CD1-CG 4.23Å; L124-K151 HydrophobicContact CD2-CG 4.32Å; L124-K151 HydrophobicContact CG-CG 4.5Å
125	R	92.8	Very high	92.3	Very high	39 Å²	39	46 Å²	46	15%	0.147	25%	0.249	C	C	.	.			trans	-54.4	-33.7	-178.5	-71.4	179.7	-67.9	-180	-4	112.8	N69 E72 D121 L123 L135 K136	N69-R125 PolarHBondContact OD1-NH1 2.8Å; E72-R125 WeakPolarHBondContact OE2-CD 3.33Å; E72-R125 IonicContact OE2-CZ 3.93Å; E72-R125 IonicContact OE2-NE 2.87Å; E72-R125 IonicContact OE2-NH1 3.54Å; E72-R125 PolarHBondContact OE2-NH1 3.41Å; D121-R125 IonicContact OD1-CZ 3.77Å; D121-R125 IonicContact OD1-NE 2.82Å; D121-R125 PolarHBondContact OD1-NE 2.9Å; D121-R125 IonicContact OD1-NH2 2.9Å; D121-R125 PolarHBondContact OD1-NH2 2.98Å; D121-R125 WeakPolarHBondContact OD2-CB 3.42Å; D121-R125 WeakPolarHBondContact OD2-CG 3.21Å; D121-R125 PolarHBondContact OD2-N 3.45Å; D121-R125 IonicContact OD2-NE 2.6Å; L123-R125 HydrophobicContact CB-CG 3.95Å; L123-R125 PolarHBondContact O-N 3.33Å; R125-L135 HydrophobicContact CB-CD1 4.31Å; R125-K136 WeakPolarHBondContact O-CB 3.26Å; R125-K136 PolarHBondContact O-N 2.98Å
126	F	95.3	Very high	92.2	Very high	3 Å²	3	47 Å²	47	1%	0.013	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	158.3	-170.7	-46.9	-69.6	0	0	0	112.7	G68 L71 E72 L75 V117 V118 D121 L124 V133 R134 L135 K136	G68-F126 VanDerWaalsContact O-CZ 3.31Å; G68-F126 WeakPolarHBondContact O-CZ 3.42Å; L71-F126 HydrophobicContact CB-CE1 4.3Å; L71-F126 HydrophobicContact CB-CZ 4.29Å; L71-F126 HydrophobicContact CD2-CD1 3.95Å; L71-F126 HydrophobicContact CD2-CD2 4.26Å; L71-F126 HydrophobicContact CD2-CE1 3.99Å; L71-F126 HydrophobicContact CD2-CE2 4.3Å; L71-F126 HydrophobicContact CD2-CG 4.1Å; L71-F126 HydrophobicContact CD2-CZ 4.17Å; L71-F126 HydrophobicContact CG-CD1 4.16Å; L71-F126 HydrophobicContact CG-CE1 3.87Å; L71-F126 HydrophobicContact CG-CZ 4.25Å; E72-F126 HydrophobicContact CB-CE1 4.03Å; E72-F126 HydrophobicContact CB-CZ 3.96Å; L75-F126 HydrophobicContact CD1-CD1 3.71Å; L75-F126 HydrophobicContact CD1-CE1 3.96Å; V117-F126 HydrophobicContact CG1-CE2 4.28Å; V118-F126 HydrophobicContact CB-CB 4.24Å; V118-F126 HydrophobicContact CG1-CB 3.8Å; V118-F126 HydrophobicContact CG2-CB 3.72Å; V118-F126 HydrophobicContact CG2-CD2 4.12Å; V118-F126 HydrophobicContact CG2-CG 4.07Å; D121-F126 HydrophobicContact CB-CD2 4.17Å; D121-F126 HydrophobicContact CB-CE2 4.44Å; L124-F126 PolarHBondContact O-N 3.48Å; F126-V133 HydrophobicContact CB-CG2 4.29Å; F126-R134 CarbonylContact C-O 3.56Å; F126-R134 WeakPolarHBondContact CA-O 3.37Å; F126-L135 HydrophobicContact CD1-CD1 3.98Å; F126-L135 HydrophobicContact CE1-CD1 3.83Å; F126-K136 WeakPolarHBondContact O-CE 3.24Å; F126-K136 PolarHBondContact O-NZ 3Å
127	S	93.5	Very high	92	Very high	23 Å²	23	47.2 Å²	47.2	16%	0.161	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128.5	169.6	-177	0	0	0	0	108.9	Y92 V133 R134	Y92-S127 PolarHBondContact OH-OG 3.05Å; S127-V133 WeakPolarHBondContact O-CA 3.29Å; S127-R134 PolarHBondContact N-O 3.14Å; S127-R134 PolarHBondContact O-N 3.49Å
128	V	93.3	Very high	91.3	Very high	35 Å²	35	51.8 Å²	51.8	21%	0.212	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	142.7	174.2	70.6	0	0	0	0	111	I95 I115 V118 G130 K132	I95-V128 HydrophobicContact CD1-CG2 4.2Å; I115-V128 HydrophobicContact CD1-CG2 3.66Å; V118-V128 HydrophobicContact CG1-CB 3.87Å; V118-V128 HydrophobicContact CG1-CG1 3.99Å; V128-G130 WeakPolarHBondContact CG2-O 3.39Å; V128-K132 CarbonylContact C-O 3.27Å; V128-K132 VanDerWaalsContact CA-O 3.29Å; V128-K132 WeakPolarHBondContact CA-O 3.37Å; V128-K132 WeakPolarHBondContact CG2-O 3.28Å
129	R	90.1	Very high	90.8	Very high	158 Å²	158	57.1 Å²	57.1	60%	0.596	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.6	101.1	172.4	-73.3	-169.4	176.7	-179.9	-0.3	109.7	Y92 S131 K132	Y92-R129 HydrophobicContact CE1-CB 4.29Å; Y92-R129 HydrophobicContact CE1-CG 4.3Å; Y92-R129 WeakPolarHBondContact OH-CD 3.34Å; Y92-R129 PolarHBondContact OH-NE 3.41Å; R129-S131 PolarHBondContact O-N 3.1Å; R129-K132 PolarHBondContact N-O 3.05Å; R129-K132 WeakPolarHBondContact O-CB 3.49Å; R129-K132 PolarHBondContact O-N 2.76Å; R129-K132 VanDerWaalsContact O-N 3.13Å
130	G	88.9	Confident	90.3	Very high	63 Å²	63	56.9 Å²	56.9	65%	0.649	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	-127.2	-171.1	0	0	0	0	0	109.9	Y111 V128 K132	Y111-G130 PolarHBondContact OH-O 2.9Å; V128-G130 WeakPolarHBondContact CG2-O 3.39Å; G130-K132 PolarHBondContact O-N 2.92Å
131	S	94.4	Very high	90	Very high	44 Å²	44	56.4 Å²	56.4	31%	0.308	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	8.1	177.6	57.5	0	0	0	0	115.3	I95 Y111 R129	I95-S131 WeakPolarHBondContact CG1-O 3.42Å; I95-S131 PolarHBondContact N-O 2.7Å; Y111-S131 WeakPolarHBondContact OH-CA 3.49Å; R129-S131 PolarHBondContact O-N 3.1Å
132	K	96.3	Very high	89.7	Confident	77 Å²	77	63.7 Å²	63.7	34%	0.335	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.1	-172.6	-58.2	173.9	-178.7	-176.8	0	111.3	L88 Y92 F93 L94 V128 R129 G130	L88-K132 HydrophobicContact CD1-CD 3.91Å; L88-K132 HydrophobicContact CD1-CG 3.91Å; L88-K132 HydrophobicContact CD2-CD 4.49Å; Y92-K132 HydrophobicContact CD1-CB 3.64Å; Y92-K132 HydrophobicContact CE1-CB 4.37Å; Y92-K132 HydrophobicContact CG-CB 4.17Å; F93-K132 CarbonylContact O-C 3.55Å; F93-K132 VanDerWaalsContact O-CA 3.28Å; F93-K132 WeakPolarHBondContact O-CA 3.33Å; L94-K132 HydrophobicContact CD2-CG 3.95Å; V128-K132 CarbonylContact C-O 3.27Å; V128-K132 VanDerWaalsContact CA-O 3.29Å; V128-K132 WeakPolarHBondContact CA-O 3.37Å; V128-K132 WeakPolarHBondContact CG2-O 3.28Å; R129-K132 PolarHBondContact N-O 3.05Å; R129-K132 WeakPolarHBondContact O-CB 3.49Å; R129-K132 PolarHBondContact O-N 2.76Å; R129-K132 VanDerWaalsContact O-N 3.13Å; G130-K132 PolarHBondContact O-N 2.92Å
133	V	97.3	Very high	89.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.6	175.3	67.6	0	0	0	0	111.4	L71 Y92 F93 I95 I98 V118 F126 S127	L71-V133 HydrophobicContact CD1-CG1 4.33Å; L71-V133 HydrophobicContact CD2-CG2 4.3Å; Y92-V133 CarbonylContact C-O 3.48Å; Y92-V133 WeakPolarHBondContact CA-O 3.31Å; F93-V133 PolarHBondContact N-O 3.43Å; F93-V133 PolarHBondContact O-N 3.37Å; I95-V133 HydrophobicContact CD1-CB 4.4Å; I95-V133 HydrophobicContact CG1-CB 4.02Å; I95-V133 HydrophobicContact CG1-CG1 3.83Å; I98-V133 HydrophobicContact CD1-CG1 3.39Å; V118-V133 HydrophobicContact CG2-CG2 3.86Å; F126-V133 HydrophobicContact CB-CG2 4.29Å; S127-V133 WeakPolarHBondContact O-CA 3.29Å
134	R	95.8	Very high	90	Very high	57 Å²	57	64 Å²	64	22%	0.215	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	163.8	170.1	69.7	173.7	-178.7	-169.5	3.7	112.1	D90 G91 Y92 F126 S127	D90-R134 VanDerWaalsContact O-CD 3.25Å; D90-R134 WeakPolarHBondContact O-CD 3.3Å; D90-R134 PolarHBondContact O-NH1 2.88Å; D90-R134 VanDerWaalsContact O-NH1 3.08Å; G91-R134 WeakPolarHBondContact O-CB 3.26Å; Y92-R134 HydrophobicContact CD1-CB 3.86Å; Y92-R134 HydrophobicContact CD1-CG 3.93Å; Y92-R134 HydrophobicContact CD2-CG 4.45Å; Y92-R134 HydrophobicContact CE1-CB 4.09Å; Y92-R134 HydrophobicContact CE1-CG 3.63Å; Y92-R134 HydrophobicContact CE2-CG 4.18Å; Y92-R134 HydrophobicContact CG-CB 4.12Å; Y92-R134 HydrophobicContact CG-CG 4.33Å; Y92-R134 PolarHBondContact OH-NE 2.77Å; F126-R134 CarbonylContact C-O 3.56Å; F126-R134 WeakPolarHBondContact CA-O 3.37Å; S127-R134 PolarHBondContact N-O 3.14Å; S127-R134 PolarHBondContact O-N 3.49Å
135	L	95.3	Very high	90.1	Very high	44 Å²	44	64.2 Å²	64.2	23%	0.23	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	136.1	167.1	-165.5	69.1	0	0	0	109.5	E72 L75 K76 R125 F126	E72-L135 HydrophobicContact CG-CD1 4.2Å; L75-L135 HydrophobicContact CB-CB 3.9Å; L75-L135 HydrophobicContact CD1-CB 4.23Å; K76-L135 HydrophobicContact CD-CD2 4.49Å; K76-L135 HydrophobicContact CG-CD2 3.73Å; R125-L135 HydrophobicContact CB-CD1 4.31Å; F126-L135 HydrophobicContact CD1-CD1 3.98Å; F126-L135 HydrophobicContact CE1-CD1 3.83Å
136	K	91.9	Very high	90	Very high	51 Å²	51	65.1 Å²	65.1	22%	0.222	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-77.9	145	169.2	-63.9	-157.7	-175.3	92.8	0	109.2	L124 R125 F126	L124-K136 WeakPolarHBondContact O-CD 3.5Å; L124-K136 PolarHBondContact O-NZ 3.29Å; R125-K136 WeakPolarHBondContact O-CB 3.26Å; R125-K136 PolarHBondContact O-N 2.98Å; F126-K136 WeakPolarHBondContact O-CE 3.24Å; F126-K136 PolarHBondContact O-NZ 3Å
137	P	87.5	Confident	89.8	Confident	53 Å²	53	65.8 Å²	65.8	34%	0.344	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-55.5	135	171.5	-22.6	29.8	0	0	0	111.6	E139 L140	P137-E139 HydrophobicContact CB-CG 4.3Å; P137-E139 WeakPolarHBondContact CB-OE1 3.46Å; P137-E139 WeakPolarHBondContact CB-OE2 3.44Å; P137-E139 PolarHBondContact O-N 3.36Å; P137-E139 VanDerWaalsContact O-N 3.13Å; P137-L140 HydrophobicContact CB-CD1 4.15Å; P137-L140 HydrophobicContact CG-CD1 3.87Å; P137-L140 WeakPolarHBondContact O-CB 3.13Å; P137-L140 PolarHBondContact O-N 3.25Å
138	P	79.6	Confident	89.9	Confident	103 Å²	103	65.1 Å²	65.1	67%	0.669	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-62.4	-22.5	-172.5	23.4	-33.2	0	0	0	113.6	L140 K142	P138-L140 VanDerWaalsContact C-N 3.31Å; P138-L140 PolarHBondContact O-N 2.84Å; P138-K142 WeakPolarHBondContact O-CG 3.44Å
139	E	82	Confident	90	Very high	121 Å²	121	64.1 Å²	64.1	57%	0.565	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-69.5	-21.9	175.5	65	-84.4	-168.2	0	0	114.5	P137 N141	P137-E139 HydrophobicContact CB-CG 4.3Å; P137-E139 WeakPolarHBondContact CB-OE1 3.46Å; P137-E139 WeakPolarHBondContact CB-OE2 3.44Å; P137-E139 PolarHBondContact O-N 3.36Å; P137-E139 VanDerWaalsContact O-N 3.13Å; E139-N141 VanDerWaalsContact C-N 3.32Å; E139-N141 PolarHBondContact O-N 3.31Å
140	L	78.3	Confident	90.1	Very high	86 Å²	86	59.8 Å²	59.8	45%	0.45	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-73.6	-19.7	-172.8	-101.1	147.6	0	0	0	114.3	P137 P138 K150	P137-L140 HydrophobicContact CB-CD1 4.15Å; P137-L140 HydrophobicContact CG-CD1 3.87Å; P137-L140 WeakPolarHBondContact O-CB 3.13Å; P137-L140 PolarHBondContact O-N 3.25Å; P138-L140 VanDerWaalsContact C-N 3.31Å; P138-L140 PolarHBondContact O-N 2.84Å; L140-K150 PolarHBondContact O-NZ 2.95Å
141	N	82.9	Confident	90.4	Very high	24 Å²	24	57.9 Å²	57.9	13%	0.128	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-136.7	40.3	-171	-61	-22.7	0	0	0	111.9	L123 L124 E139 I147 K150	L123-N141 PolarHBondContact O-ND2 3.2Å; L124-N141 WeakPolarHBondContact CB-ND2 3.3Å; L124-N141 PolarHBondContact O-ND2 3.47Å; E139-N141 VanDerWaalsContact C-N 3.32Å; E139-N141 PolarHBondContact O-N 3.31Å; N141-I147 HydrophobicContact CB-CD1 4.11Å; N141-I147 HydrophobicContact CB-CG1 3.82Å; N141-I147 WeakPolarHBondContact O-CD1 3.17Å; N141-K150 PolarHBondContact OD1-NZ 3.38Å
142	K	83.9	Confident	90.5	Very high	167 Å²	167	55.8 Å²	55.8	73%	0.726	29%	0.287	S	S	*	.			trans	-77.9	-30.2	177.2	-69.1	-176.6	172.1	176.1	0	113.2	P138	P138-K142 WeakPolarHBondContact O-CG 3.44Å
143	D	89.7	Confident	90.4	Very high	80 Å²	80	52.8 Å²	52.8	43%	0.428	28%	0.277	S	S	.	.	S	Bend	trans	-92.4	120	-177.7	-178.5	-13.2	0	0	0	110.7	D145 V146 I147	D143-D145 VanDerWaalsContact C-N 3.26Å; D143-D145 PolarHBondContact O-N 2.82Å; D143-D145 WeakPolarHBondContact OD1-CB 3.4Å; D143-D145 PolarHBondContact OD1-N 3.37Å; D143-V146 HydrophobicContact CB-CB 3.98Å; D143-V146 HydrophobicContact CB-CG2 3.76Å; D143-V146 WeakPolarHBondContact O-CB 3.24Å; D143-V146 PolarHBondContact O-N 2.63Å; D143-V146 VanDerWaalsContact O-N 3.15Å; D143-I147 PolarHBondContact O-N 2.72Å
144	P	90.9	Very high	90.2	Very high	91 Å²	91	57 Å²	57	59%	0.591	29%	0.293	S	S	*	.	H	α-helix	trans	-54.6	-36.7	175.6	-25.8	35.1	0	0	0	114.2	I147 L148	P144-I147 WeakPolarHBondContact O-CB 3.4Å; P144-I147 PolarHBondContact O-N 3.14Å; P144-L148 WeakPolarHBondContact O-CB 3.37Å; P144-L148 PolarHBondContact O-N 3.38Å
145	D	92.5	Very high	90.2	Very high	29 Å²	29	54.2 Å²	54.2	16%	0.155	28%	0.283	C	S	.	.	H	α-helix	trans	-72.3	-33.6	-179.6	-79.8	5.4	0	0	0	110.6	D143 L148 S149 R194 V195	D143-D145 VanDerWaalsContact C-N 3.26Å; D143-D145 PolarHBondContact O-N 2.82Å; D143-D145 WeakPolarHBondContact OD1-CB 3.4Å; D143-D145 PolarHBondContact OD1-N 3.37Å; D145-L148 PolarHBondContact O-N 3.04Å; D145-S149 WeakPolarHBondContact O-CB 3.47Å; D145-S149 PolarHBondContact O-N 3Å; D145-R194 IonicContact OD1-CZ 3.95Å; D145-R194 IonicContact OD1-NE 3.14Å; D145-R194 PolarHBondContact OD1-NE 3.16Å; D145-R194 VanDerWaalsContact OD1-NE 3.11Å; D145-R194 IonicContact OD1-NH2 2.72Å; D145-R194 PolarHBondContact OD1-NH2 3.16Å; D145-R194 WeakPolarHBondContact OD2-CD 3.34Å; D145-R194 IonicContact OD2-CZ 3.2Å; D145-R194 IonicContact OD2-NE 2.8Å; D145-R194 PolarHBondContact OD2-NE 3.02Å; D145-V195 HydrophobicContact CB-CG2 3.78Å
146	V	90.4	Very high	90.3	Very high	59 Å²	59	52.1 Å²	52.1	36%	0.358	27%	0.272	S	S	.	.	H	α-helix	trans	-66.1	-40	171	173.6	0	0	0	0	111.2	D143 K150	D143-V146 HydrophobicContact CB-CB 3.98Å; D143-V146 HydrophobicContact CB-CG2 3.76Å; D143-V146 WeakPolarHBondContact O-CB 3.24Å; D143-V146 PolarHBondContact O-N 2.63Å; D143-V146 VanDerWaalsContact O-N 3.15Å; V146-K150 HydrophobicContact CG1-CD 4.29Å; V146-K150 WeakPolarHBondContact O-CG 3.5Å; V146-K150 PolarHBondContact O-N 3.31Å
147	I	92.4	Very high	90.5	Very high	16 Å²	16	50.9 Å²	50.9	8%	0.082	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-51.6	174.6	-68.1	169.3	0	0	0	110.1	A122 L124 N141 D143 P144 S149 K150 K151	A122-I147 WeakPolarHBondContact O-CG2 3.26Å; L124-I147 HydrophobicContact CD1-CG2 3.97Å; L124-I147 HydrophobicContact CG-CG2 4.1Å; N141-I147 HydrophobicContact CB-CD1 4.11Å; N141-I147 HydrophobicContact CB-CG1 3.82Å; N141-I147 WeakPolarHBondContact O-CD1 3.17Å; D143-I147 PolarHBondContact O-N 2.72Å; P144-I147 WeakPolarHBondContact O-CB 3.4Å; P144-I147 PolarHBondContact O-N 3.14Å; I147-S149 VanDerWaalsContact C-N 3.32Å; I147-S149 PolarHBondContact O-N 2.84Å; I147-K150 WeakPolarHBondContact O-CB 3.46Å; I147-K150 PolarHBondContact O-N 2.93Å; I147-K151 HydrophobicContact CG2-CD 4.3Å; I147-K151 PolarHBondContact O-N 3.11Å
148	L	94.9	Very high	90.7	Very high	10 Å²	10	51.4 Å²	51.4	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-43	179.7	177.2	55.5	0	0	0	111	P144 D145 K150 K151 L152 F184 V187 D191 I192 V195	P144-L148 WeakPolarHBondContact O-CB 3.37Å; P144-L148 PolarHBondContact O-N 3.38Å; D145-L148 PolarHBondContact O-N 3.04Å; L148-K150 VanDerWaalsContact C-N 3.28Å; L148-K150 PolarHBondContact O-N 3.27Å; L148-K151 PolarHBondContact O-N 3.14Å; L148-K151 VanDerWaalsContact O-N 3.16Å; L148-L152 HydrophobicContact CD1-CD1 4.35Å; L148-L152 HydrophobicContact CD1-CG 4.16Å; L148-L152 HydrophobicContact CG-CD1 4.2Å; L148-L152 HydrophobicContact CG-CG 4.48Å; L148-L152 WeakPolarHBondContact O-CB 3.48Å; L148-L152 WeakPolarHBondContact O-CG 3.49Å; L148-L152 PolarHBondContact O-N 3.39Å; L148-F184 HydrophobicContact CD1-CD1 3.94Å; L148-F184 HydrophobicContact CD1-CE1 3.76Å; L148-V187 HydrophobicContact CD1-CG1 3.85Å; L148-V187 HydrophobicContact CD1-CG2 4.05Å; L148-V187 HydrophobicContact CD2-CG1 3.85Å; L148-D191 HydrophobicContact CD2-CB 3.82Å; L148-I192 HydrophobicContact CD2-CG1 4.49Å; L148-V195 HydrophobicContact CB-CG2 4.08Å; L148-V195 HydrophobicContact CD2-CB 4.41Å; L148-V195 HydrophobicContact CD2-CG2 3.75Å; L148-V195 HydrophobicContact CG-CG2 3.98Å
149	S	94.6	Very high	91.2	Very high	13 Å²	13	46.5 Å²	46.5	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-37.7	174	-172.9	0	0	0	0	112.2	D145 I147 A153 Y204	D145-S149 WeakPolarHBondContact O-CB 3.47Å; D145-S149 PolarHBondContact O-N 3Å; I147-S149 VanDerWaalsContact C-N 3.32Å; I147-S149 PolarHBondContact O-N 2.84Å; S149-A153 WeakPolarHBondContact O-CB 3.35Å; S149-A153 PolarHBondContact O-N 3.44Å; S149-Y204 PolarHBondContact O-OH 3.35Å; S149-Y204 PolarHBondContact OG-OH 2.88Å
150	K	92.7	Very high	91.8	Very high	67 Å²	67	40.7 Å²	40.7	29%	0.291	20%	0.204	S	C	.	.	H	α-helix	trans	-69.4	-41.1	175	-75.7	167.2	173.6	169.6	0	112.3	L124 L140 N141 V146 I147 L148 A153 W154	L124-K150 HydrophobicContact CD1-CB 3.63Å; L124-K150 HydrophobicContact CD1-CD 4.14Å; L140-K150 PolarHBondContact O-NZ 2.95Å; N141-K150 PolarHBondContact OD1-NZ 3.38Å; V146-K150 HydrophobicContact CG1-CD 4.29Å; V146-K150 WeakPolarHBondContact O-CG 3.5Å; V146-K150 PolarHBondContact O-N 3.31Å; I147-K150 WeakPolarHBondContact O-CB 3.46Å; I147-K150 PolarHBondContact O-N 2.93Å; L148-K150 VanDerWaalsContact C-N 3.28Å; L148-K150 PolarHBondContact O-N 3.27Å; K150-A153 PolarHBondContact O-N 2.95Å; K150-W154 PolarHBondContact O-N 3.39Å
151	K	94.5	Very high	92.4	Very high	24 Å²	24	42.6 Å²	42.6	10%	0.104	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-47	174.7	-67.8	179.1	178.9	178	0	111.2	A122 L124 I147 L148 A153 W154 I155 P183 F184	A122-K151 VanDerWaalsContact O-CE 3.26Å; A122-K151 WeakPolarHBondContact O-CE 3.29Å; A122-K151 PolarHBondContact O-NZ 3.2Å; L124-K151 HydrophobicContact CD1-CG 4.23Å; L124-K151 HydrophobicContact CD2-CG 4.32Å; L124-K151 HydrophobicContact CG-CG 4.5Å; I147-K151 HydrophobicContact CG2-CD 4.3Å; I147-K151 PolarHBondContact O-N 3.11Å; L148-K151 PolarHBondContact O-N 3.14Å; L148-K151 VanDerWaalsContact O-N 3.16Å; K151-A153 PolarHBondContact O-N 3.42Å; K151-W154 PolarHBondContact O-N 3.08Å; K151-I155 PolarHBondContact O-N 3.47Å; K151-P183 HydrophobicContact CD-CB 4.49Å; K151-P183 WeakPolarHBondContact CD-O 3.36Å; K151-P183 WeakPolarHBondContact CE-O 3.22Å; K151-P183 PolarHBondContact NZ-O 3.17Å; K151-F184 HydrophobicContact CB-CE1 4.01Å; K151-F184 HydrophobicContact CB-CE2 4.35Å; K151-F184 HydrophobicContact CB-CZ 3.72Å
152	L	96.3	Very high	92.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.9	-46.1	174.1	-73.2	174.3	0	0	0	111.6	L148 W154 I155 L156 F184 I192 V195 Y204 I217	L148-L152 HydrophobicContact CD1-CD1 4.35Å; L148-L152 HydrophobicContact CD1-CG 4.16Å; L148-L152 HydrophobicContact CG-CD1 4.2Å; L148-L152 HydrophobicContact CG-CG 4.48Å; L148-L152 WeakPolarHBondContact O-CB 3.48Å; L148-L152 WeakPolarHBondContact O-CG 3.49Å; L148-L152 PolarHBondContact O-N 3.39Å; L152-W154 VanDerWaalsContact C-N 3.26Å; L152-W154 PolarHBondContact O-N 2.84Å; L152-I155 WeakPolarHBondContact O-CG2 3.23Å; L152-I155 PolarHBondContact O-N 3.34Å; L152-L156 HydrophobicContact CB-CD1 4.22Å; L152-L156 WeakPolarHBondContact O-CB 3.45Å; L152-L156 WeakPolarHBondContact O-CD1 3.17Å; L152-L156 WeakPolarHBondContact O-CG 3.44Å; L152-L156 PolarHBondContact O-N 3.13Å; L152-F184 HydrophobicContact CD2-CE1 3.75Å; L152-F184 HydrophobicContact CD2-CZ 4.17Å; L152-F184 HydrophobicContact CG-CE1 4.11Å; L152-I192 HydrophobicContact CD1-CG2 4.48Å; L152-V195 HydrophobicContact CD1-CG1 3.93Å; L152-Y204 HydrophobicContact CB-CE1 4.48Å; L152-Y204 HydrophobicContact CB-CE2 4.25Å; L152-Y204 HydrophobicContact CD1-CD2 4.46Å; L152-Y204 HydrophobicContact CD1-CE2 4.37Å; L152-I217 HydrophobicContact CD1-CD1 4.39Å; L152-I217 HydrophobicContact CD2-CD1 4.29Å
153	A	94.7	Very high	93.1	Very high	14 Å²	14	42.4 Å²	42.4	12%	0.116	22%	0.219	C	C	.	.	H	α-helix	trans	-58.3	-39.9	176.4	0	0	0	0	0	112.3	S149 K150 K151 R157 Y204	S149-A153 WeakPolarHBondContact O-CB 3.35Å; S149-A153 PolarHBondContact O-N 3.44Å; K150-A153 PolarHBondContact O-N 2.95Å; K151-A153 PolarHBondContact O-N 3.42Å; A153-R157 WeakPolarHBondContact O-CB 3.25Å; A153-R157 WeakPolarHBondContact O-CD 3.43Å; A153-R157 VanDerWaalsContact O-CG 3.31Å; A153-R157 WeakPolarHBondContact O-CG 3.22Å; A153-R157 PolarHBondContact O-N 3.33Å; A153-Y204 WeakPolarHBondContact CB-OH 3.43Å
154	W	94.2	Very high	93.2	Very high	87 Å²	87	41.9 Å²	41.9	33%	0.33	23%	0.233	S	C	.	.	H	α-helix	trans	-66.5	-53.5	179	178.5	87	0	0	0	111.8	K150 K151 L152 L156 R157 H158 G159 V163	K150-W154 PolarHBondContact O-N 3.39Å; K151-W154 PolarHBondContact O-N 3.08Å; L152-W154 VanDerWaalsContact C-N 3.26Å; L152-W154 PolarHBondContact O-N 2.84Å; W154-L156 PolarHBondContact O-N 3.41Å; W154-R157 PolarHBondContact O-N 3.43Å; W154-H158 WeakPolarHBondContact O-CB 2.99Å; W154-H158 PolarHBondContact O-N 2.63Å; W154-G159 PolarHBondContact O-N 3.17Å; W154-V163 HydrophobicContact CH2-CG1 4.28Å; W154-V163 HydrophobicContact CZ3-CG1 4.47Å
155	I	96	Very high	93.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	I	π-helix	trans	-64.8	-41.5	-177	-171	66.4	0	0	0	111.2	K151 L152 R157 A160 V163 Y167 L173 I178 L181 F184	K151-I155 PolarHBondContact O-N 3.47Å; L152-I155 WeakPolarHBondContact O-CG2 3.23Å; L152-I155 PolarHBondContact O-N 3.34Å; I155-R157 VanDerWaalsContact C-N 3.33Å; I155-R157 PolarHBondContact O-N 3.2Å; I155-A160 PolarHBondContact O-N 3.33Å; I155-V163 HydrophobicContact CD1-CG2 3.45Å; I155-V163 VanDerWaalsContact CD1-CG2 3.45Å; I155-Y167 PolarHBondContact O-OH 2.81Å; I155-L173 HydrophobicContact CG1-CD1 4.11Å; I155-I178 HydrophobicContact CG2-CD1 4.43Å; I155-L181 HydrophobicContact CD1-CD1 3.76Å; I155-L181 HydrophobicContact CG1-CD1 4.06Å; I155-F184 HydrophobicContact CB-CE2 4.44Å; I155-F184 HydrophobicContact CG2-CE2 4.18Å; I155-F184 HydrophobicContact CG2-CZ 3.8Å
156	L	96.6	Very high	93.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-74.1	-21	-176.7	-62.9	169.8	0	0	0	113.5	L152 W154 Y167 L173 I178 Y204 I217 A219 H223	L152-L156 HydrophobicContact CB-CD1 4.22Å; L152-L156 WeakPolarHBondContact O-CB 3.45Å; L152-L156 WeakPolarHBondContact O-CD1 3.17Å; L152-L156 WeakPolarHBondContact O-CG 3.44Å; L152-L156 PolarHBondContact O-N 3.13Å; W154-L156 PolarHBondContact O-N 3.41Å; L156-Y167 VanDerWaalsContact C-OH 3.23Å; L156-Y167 VanDerWaalsContact O-CE1 3.23Å; L156-Y167 WeakPolarHBondContact O-CE1 3.5Å; L156-Y167 PolarHBondContact O-OH 3.05Å; L156-L173 HydrophobicContact CD2-CB 4.23Å; L156-L173 HydrophobicContact CD2-CD1 3.88Å; L156-L173 HydrophobicContact CD2-CG 4.19Å; L156-I178 HydrophobicContact CD2-CD1 4.16Å; L156-Y204 HydrophobicContact CD1-CD1 3.73Å; L156-Y204 HydrophobicContact CD1-CE1 4.13Å; L156-Y204 HydrophobicContact CD1-CG 4.42Å; L156-I217 HydrophobicContact CD1-CD1 4.16Å; L156-I217 HydrophobicContact CD1-CG1 4.02Å; L156-I217 HydrophobicContact CD2-CG2 3.85Å; L156-I217 WeakPolarHBondContact CD2-O 3.42Å; L156-A219 HydrophobicContact CB-CB 3.97Å; L156-H223 PolarHBondContact O-CD2 2.76Å; L156-H223 VanDerWaalsContact O-CD2 3.29Å; L156-H223 PolarHBondContact O-NE2 3.45Å
157	R	95.5	Very high	93.9	Very high	24 Å²	24	44.8 Å²	44.8	9%	0.091	23%	0.23	C	C	.	.	I	π-helix	trans	-112.7	-22.8	-174.5	-64	170.7	170.9	179.2	-8.7	115.1	A153 W154 I155 A219 Q221 H223 T224	A153-R157 WeakPolarHBondContact O-CB 3.25Å; A153-R157 WeakPolarHBondContact O-CD 3.43Å; A153-R157 VanDerWaalsContact O-CG 3.31Å; A153-R157 WeakPolarHBondContact O-CG 3.22Å; A153-R157 PolarHBondContact O-N 3.33Å; W154-R157 PolarHBondContact O-N 3.43Å; I155-R157 VanDerWaalsContact C-N 3.33Å; I155-R157 PolarHBondContact O-N 3.2Å; R157-A219 HydrophobicContact CG-CB 3.91Å; R157-Q221 PolarHBondContact NE-O 3.2Å; R157-Q221 PolarHBondContact NH2-O 2.82Å; R157-H223 WeakPolarHBondContact O-CA 3.2Å; R157-T224 PolarHBondContact O-N 2.95Å; R157-T224 PolarHBondContact O-OG1 3.35Å
158	H	92	Very high	94	Very high	64 Å²	64	46.9 Å²	46.9	30%	0.296	24%	0.24	S	C	.	.	I	π-helix	trans	-139.9	-45.7	-164.9	-48.6	-49.8	0	0	0	112.8	W154 G222 T224	W154-H158 WeakPolarHBondContact O-CB 2.99Å; W154-H158 PolarHBondContact O-N 2.63Å; H158-G222 PolarHBondContact CE1-O 3.09Å; H158-T224 WeakPolarHBondContact CE1-CG2 3.16Å; H158-T224 WeakPolarHBondContact ND1-CG2 3.43Å; H158-T224 PolarHBondContact ND1-OG1 3.48Å
159	G	90	Very high	93.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-97.2	-3.3	-160.6	0	0	0	0	0	116.5	W154 E161 N162 V163	W154-G159 PolarHBondContact O-N 3.17Å; G159-E161 PolarHBondContact O-N 3.25Å; G159-N162 WeakPolarHBondContact O-CB 3.41Å; G159-N162 PolarHBondContact O-N 3.01Å; G159-V163 PolarHBondContact O-N 3.19Å
160	A	94.2	Very high	93.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-51.1	-171.9	0	0	0	0	0	112.4	I155 N162 V163 G164 M165 Y167 L173	I155-A160 PolarHBondContact O-N 3.33Å; A160-N162 VanDerWaalsContact C-N 3.29Å; A160-N162 PolarHBondContact O-N 3.16Å; A160-V163 WeakPolarHBondContact O-CG2 3.37Å; A160-V163 PolarHBondContact O-N 3.42Å; A160-V163 VanDerWaalsContact O-N 3.14Å; A160-G164 PolarHBondContact O-N 2.86Å; A160-M165 CarbonylContact C-O 3.4Å; A160-M165 VanDerWaalsContact C-O 3.27Å; A160-M165 HydrophobicContact CB-CB 4.18Å; A160-M165 WeakPolarHBondContact O-CA 3.14Å; A160-M165 WeakPolarHBondContact O-CB 3.39Å; A160-M165 PolarHBondContact O-N 2.84Å; A160-Y167 HydrophobicContact CB-CD2 4.2Å; A160-Y167 HydrophobicContact CB-CE1 4.07Å; A160-Y167 HydrophobicContact CB-CE2 3.52Å; A160-Y167 VanDerWaalsContact CB-CZ 3.47Å; A160-L173 HydrophobicContact CB-CD1 3.73Å; A160-L173 HydrophobicContact CB-CD2 4.02Å
161	E	92.5	Very high	94	Very high	126 Å²	126	46.6 Å²	46.6	59%	0.589	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-64.2	-35.3	-179.3	-63.7	-178.5	163.5	0	0	111.9	G159 V163 G164 M165	G159-E161 PolarHBondContact O-N 3.25Å; E161-V163 PolarHBondContact O-N 3.37Å; E161-V163 VanDerWaalsContact O-N 3.15Å; E161-G164 PolarHBondContact O-N 2.88Å; E161-M165 WeakPolarHBondContact CA-O 3.41Å; E161-M165 PolarHBondContact N-O 2.8Å
162	N	89.1	Confident	94.2	Very high	129 Å²	129	46.2 Å²	46.2	69%	0.69	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-62.6	-22.5	178.2	-63	-6.7	0	0	0	113	G159 A160	G159-N162 WeakPolarHBondContact O-CB 3.41Å; G159-N162 PolarHBondContact O-N 3.01Å; A160-N162 VanDerWaalsContact C-N 3.29Å; A160-N162 PolarHBondContact O-N 3.16Å
163	V	90.8	Very high	94.2	Very high	57 Å²	57	46.3 Å²	46.3	35%	0.345	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-108.7	17.9	176	-57.3	0	0	0	0	112.2	W154 I155 G159 A160 E161 M165 L181	W154-V163 HydrophobicContact CH2-CG1 4.28Å; W154-V163 HydrophobicContact CZ3-CG1 4.47Å; I155-V163 HydrophobicContact CD1-CG2 3.45Å; I155-V163 VanDerWaalsContact CD1-CG2 3.45Å; G159-V163 PolarHBondContact O-N 3.19Å; A160-V163 WeakPolarHBondContact O-CG2 3.37Å; A160-V163 PolarHBondContact O-N 3.42Å; A160-V163 VanDerWaalsContact O-N 3.14Å; E161-V163 PolarHBondContact O-N 3.37Å; E161-V163 VanDerWaalsContact O-N 3.15Å; V163-M165 VanDerWaalsContact C-N 3.27Å; V163-M165 HydrophobicContact CG2-CB 4.35Å; V163-M165 HydrophobicContact CG2-CG 3.95Å; V163-M165 HydrophobicContact CG2-SD 4.04Å; V163-M165 PolarHBondContact O-N 2.91Å; V163-L181 HydrophobicContact CB-CD2 3.93Å; V163-L181 HydrophobicContact CG1-CD2 4.47Å; V163-L181 HydrophobicContact CG2-CD1 3.95Å; V163-L181 HydrophobicContact CG2-CD2 3.93Å
164	G	93.5	Very high	94.4	Very high	70 Å²	70	47.6 Å²	47.6	72%	0.722	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.9	13.7	177.1	0	0	0	0	0	114.6	A160 E161	A160-G164 PolarHBondContact O-N 2.86Å; E161-G164 PolarHBondContact O-N 2.88Å
165	M	95.7	Very high	94.6	Very high	22 Å²	22	43.6 Å²	43.6	11%	0.108	23%	0.231	C	C	.	.			trans	-90.5	144.1	175	-65.5	-179.9	69.7	0	0	110.8	A160 E161 V163 L173 K177 I178 L181	A160-M165 CarbonylContact C-O 3.4Å; A160-M165 VanDerWaalsContact C-O 3.27Å; A160-M165 HydrophobicContact CB-CB 4.18Å; A160-M165 WeakPolarHBondContact O-CA 3.14Å; A160-M165 WeakPolarHBondContact O-CB 3.39Å; A160-M165 PolarHBondContact O-N 2.84Å; E161-M165 WeakPolarHBondContact CA-O 3.41Å; E161-M165 PolarHBondContact N-O 2.8Å; V163-M165 VanDerWaalsContact C-N 3.27Å; V163-M165 HydrophobicContact CG2-CB 4.35Å; V163-M165 HydrophobicContact CG2-CG 3.95Å; V163-M165 HydrophobicContact CG2-SD 4.04Å; V163-M165 PolarHBondContact O-N 2.91Å; M165-L173 HydrophobicContact CB-CD2 4.37Å; M165-L173 HydrophobicContact CE-CB 3.8Å; M165-L173 HydrophobicContact CE-CD1 4.14Å; M165-L173 HydrophobicContact CE-CD2 4.17Å; M165-L173 HydrophobicContact CE-CG 4.25Å; M165-K177 HydrophobicContact CE-CB 3.66Å; M165-K177 HydrophobicContact SD-CB 4.35Å; M165-I178 HydrophobicContact CE-CG1 3.89Å; M165-I178 HydrophobicContact SD-CG1 4.37Å; M165-L181 HydrophobicContact SD-CD1 4.01Å
166	K	94.9	Very high	94.6	Very high	179 Å²	179	46.6 Å²	46.6	78%	0.778	25%	0.247	S	C	*	.			trans	-108.1	144	173.5	-64.5	-176.3	179.8	-178.5	0	109.8	L173	K166-L173 VanDerWaalsContact O-CD2 3.23Å; K166-L173 WeakPolarHBondContact O-CD2 3.44Å
167	Y	96	Very high	94.6	Very high	39 Å²	39	51.5 Å²	51.5	15%	0.153	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-75	130.7	172.1	-69.7	-78.9	0	0	0	110.5	I155 L156 A160 L173 V225 I227	I155-Y167 PolarHBondContact O-OH 2.81Å; L156-Y167 VanDerWaalsContact C-OH 3.23Å; L156-Y167 VanDerWaalsContact O-CE1 3.23Å; L156-Y167 WeakPolarHBondContact O-CE1 3.5Å; L156-Y167 PolarHBondContact O-OH 3.05Å; A160-Y167 HydrophobicContact CB-CD2 4.2Å; A160-Y167 HydrophobicContact CB-CE1 4.07Å; A160-Y167 HydrophobicContact CB-CE2 3.52Å; A160-Y167 VanDerWaalsContact CB-CZ 3.47Å; Y167-L173 HydrophobicContact CD1-CD2 3.71Å; Y167-L173 HydrophobicContact CD1-CG 4.03Å; Y167-L173 HydrophobicContact CE1-CD1 4.13Å; Y167-L173 HydrophobicContact CE1-CD2 4.07Å; Y167-L173 HydrophobicContact CE1-CG 4.06Å; Y167-L173 HydrophobicContact CG-CD2 4.18Å; Y167-V225 HydrophobicContact CD2-CG2 4.21Å; Y167-V225 HydrophobicContact CE2-CG2 3.6Å; Y167-I227 HydrophobicContact CD1-CD1 3.69Å; Y167-I227 HydrophobicContact CD2-CD1 3.5Å; Y167-I227 HydrophobicContact CE1-CD1 4.02Å; Y167-I227 HydrophobicContact CE2-CD1 3.87Å; Y167-I227 HydrophobicContact CG-CD1 3.39Å
168	E	95.4	Very high	94.7	Very high	60 Å²	60	50.3 Å²	50.3	28%	0.28	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-76.8	160.8	163.2	-60.1	-75.6	90.1	0	0	109.4	G170 G171 Y172 Y174	E168-G170 PolarHBondContact O-N 3Å; E168-G171 WeakPolarHBondContact O-CA 3.33Å; E168-G171 PolarHBondContact O-N 2.89Å; E168-Y172 PolarHBondContact N-O 2.85Å; E168-Y172 PolarHBondContact O-N 2.84Å; E168-Y174 HydrophobicContact CG-CE2 3.94Å; E168-Y174 PolarHBondContact OE2-OH 3.14Å
169	P	93.3	Very high	95	Very high	80 Å²	80	49.4 Å²	49.4	52%	0.519	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	135.2	175.3	-28.6	35.4	0	0	0	112.3	G171 Y172	P169-G171 VanDerWaalsContact C-N 3.32Å; P169-Y172 WeakPolarHBondContact O-CD2 3.2Å
170	G	93.7	Very high	95.2	Very high	4 Å²	4	55.3 Å²	55.3	4%	0.041	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	84	1.3	-173.2	0	0	0	0	0	114.8	E168 R218 E228 G229	E168-G170 PolarHBondContact O-N 3Å; G170-R218 WeakPolarHBondContact O-CD 3.34Å; G170-R218 PolarHBondContact O-NH1 3.04Å; G170-E228 PolarHBondContact N-O 2.83Å; G170-G229 WeakPolarHBondContact CA-O 3.38Å
171	G	95.6	Very high	95.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	23.4	176.8	0	0	0	0	0	113.6	E168 P169 R218	E168-G171 WeakPolarHBondContact O-CA 3.33Å; E168-G171 PolarHBondContact O-N 2.89Å; P169-G171 VanDerWaalsContact C-N 3.32Å; G171-R218 VanDerWaalsContact O-CB 3.23Å; G171-R218 WeakPolarHBondContact O-CB 3.47Å
172	Y	97.5	Very high	95	Very high	16 Å²	16	54 Å²	54	6%	0.063	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	146.7	179.1	-70.8	-81	0	0	0	112	E168 P169 E205 R216 I217 R218	E168-Y172 PolarHBondContact N-O 2.85Å; E168-Y172 PolarHBondContact O-N 2.84Å; P169-Y172 WeakPolarHBondContact O-CD2 3.2Å; Y172-E205 PolarHBondContact OH-OE2 3.18Å; Y172-R216 HydrophobicContact CD1-CB 4.11Å; Y172-R216 HydrophobicContact CD1-CG 3.62Å; Y172-R216 HydrophobicContact CE1-CG 4.22Å; Y172-R216 HydrophobicContact CG-CB 4.4Å; Y172-R216 HydrophobicContact CG-CG 3.96Å; Y172-I217 CarbonylContact C-O 3.52Å; Y172-I217 WeakPolarHBondContact CA-O 3.04Å; Y172-R218 HydrophobicContact CD1-CB 3.6Å; Y172-R218 HydrophobicContact CD1-CG 3.72Å; Y172-R218 HydrophobicContact CE1-CB 3.91Å; Y172-R218 HydrophobicContact CE1-CG 3.45Å; Y172-R218 VanDerWaalsContact CE1-CG 3.45Å; Y172-R218 HydrophobicContact CE2-CG 4.39Å; Y172-R218 HydrophobicContact CG-CB 3.92Å; Y172-R218 HydrophobicContact CG-CG 4.28Å; Y172-R218 VanDerWaalsContact CZ-CD 3.41Å; Y172-R218 VanDerWaalsContact CZ-NE 3.31Å; Y172-R218 PolarHBondContact OH-NE 3.49Å; Y172-R218 VanDerWaalsContact OH-NE 3.14Å
173	L	98	Very high	95	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.7	168.4	-62.2	-179.2	0	0	0	108.8	I155 L156 A160 M165 K166 Y167 I178 R216 I217	I155-L173 HydrophobicContact CG1-CD1 4.11Å; L156-L173 HydrophobicContact CD2-CB 4.23Å; L156-L173 HydrophobicContact CD2-CD1 3.88Å; L156-L173 HydrophobicContact CD2-CG 4.19Å; A160-L173 HydrophobicContact CB-CD1 3.73Å; A160-L173 HydrophobicContact CB-CD2 4.02Å; M165-L173 HydrophobicContact CB-CD2 4.37Å; M165-L173 HydrophobicContact CE-CB 3.8Å; M165-L173 HydrophobicContact CE-CD1 4.14Å; M165-L173 HydrophobicContact CE-CD2 4.17Å; M165-L173 HydrophobicContact CE-CG 4.25Å; K166-L173 VanDerWaalsContact O-CD2 3.23Å; K166-L173 WeakPolarHBondContact O-CD2 3.44Å; Y167-L173 HydrophobicContact CD1-CD2 3.71Å; Y167-L173 HydrophobicContact CD1-CG 4.03Å; Y167-L173 HydrophobicContact CE1-CD1 4.13Å; Y167-L173 HydrophobicContact CE1-CD2 4.07Å; Y167-L173 HydrophobicContact CE1-CG 4.06Å; Y167-L173 HydrophobicContact CG-CD2 4.18Å; L173-I178 HydrophobicContact CB-CD1 4.02Å; L173-I178 HydrophobicContact CB-CG1 4.42Å; L173-R216 CarbonylContact O-C 3.58Å; L173-R216 VanDerWaalsContact O-CA 3.25Å; L173-R216 WeakPolarHBondContact O-CA 3.48Å; L173-R216 WeakPolarHBondContact O-CB 3.15Å; L173-I217 PolarHBondContact N-O 3.35Å; L173-I217 PolarHBondContact O-N 3.04Å
174	Y	98	Very high	95.1	Very high	41 Å²	41	46.2 Å²	46.2	16%	0.161	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	134.5	178.2	-66.9	-75.4	0	0	0	112	E168 D176 K177 I178 N209 N212 L214 R216	E168-Y174 HydrophobicContact CG-CE2 3.94Å; E168-Y174 PolarHBondContact OE2-OH 3.14Å; Y174-D176 WeakPolarHBondContact CB-OD1 3.5Å; Y174-K177 PolarHBondContact O-N 2.92Å; Y174-I178 WeakPolarHBondContact O-CG1 3.32Å; Y174-I178 PolarHBondContact O-N 2.84Å; Y174-N209 HydrophobicContact CE1-CB 4.08Å; Y174-N209 PolarHBondContact OH-ND2 2.88Å; Y174-N212 PolarHBondContact OH-ND2 3.46Å; Y174-L214 HydrophobicContact CD1-CB 3.71Å; Y174-L214 HydrophobicContact CD1-CD1 4.26Å; Y174-L214 HydrophobicContact CE1-CB 3.75Å; Y174-L214 HydrophobicContact CE1-CD1 4.23Å; Y174-R216 HydrophobicContact CD1-CB 4.24Å
175	V	98.1	Very high	95	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-68.9	-39.1	-173.5	174.2	0	0	0	0	111.6	K177 I178 L179 L189 I192 L206 L215 I217	V175-K177 VanDerWaalsContact C-N 3.26Å; V175-K177 PolarHBondContact O-N 2.69Å; V175-I178 PolarHBondContact O-N 3.31Å; V175-L179 HydrophobicContact CG1-CD1 3.97Å; V175-L179 HydrophobicContact CG1-CG 4.24Å; V175-L179 WeakPolarHBondContact O-CG 3.39Å; V175-L179 PolarHBondContact O-N 3.05Å; V175-L189 HydrophobicContact CG1-CD1 3.99Å; V175-I192 HydrophobicContact CG1-CD1 3.81Å; V175-L206 HydrophobicContact CG2-CD2 3.81Å; V175-L215 HydrophobicContact CB-CB 4.46Å; V175-L215 HydrophobicContact CB-CD2 4.25Å; V175-L215 HydrophobicContact CB-CG 4.42Å; V175-L215 HydrophobicContact CG1-CD2 4.39Å; V175-L215 HydrophobicContact CG2-CB 4.41Å; V175-L215 HydrophobicContact CG2-CD2 4.01Å; V175-L215 HydrophobicContact CG2-CG 3.96Å; V175-L215 PolarHBondContact N-O 3.25Å; V175-I217 HydrophobicContact CG2-CB 4.01Å; V175-I217 HydrophobicContact CG2-CG2 3.84Å
176	D	96.8	Very high	94.9	Very high	63 Å²	63	52.1 Å²	52.1	34%	0.337	27%	0.268	S	S	.	.	H	α-helix	trans	-58.7	-39.1	176.6	69.7	-46.9	0	0	0	111.7	Y174 L179 Q180	Y174-D176 WeakPolarHBondContact CB-OD1 3.5Å; D176-L179 PolarHBondContact O-N 3.01Å; D176-Q180 WeakPolarHBondContact O-CG 3.23Å; D176-Q180 PolarHBondContact O-N 2.73Å; D176-Q180 PolarHBondContact O-NE2 3.03Å
177	K	97	Very high	94.9	Very high	103 Å²	103	45 Å²	45	45%	0.448	24%	0.239	S	C	.	.	H	α-helix	trans	-68.8	-41.6	176.4	-60.5	-56.8	-179.2	-177.9	0	112.2	M165 Y174 V175 L179 Q180	M165-K177 HydrophobicContact CE-CB 3.66Å; M165-K177 HydrophobicContact SD-CB 4.35Å; Y174-K177 PolarHBondContact O-N 2.92Å; V175-K177 VanDerWaalsContact C-N 3.26Å; V175-K177 PolarHBondContact O-N 2.69Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 2.71Å; K177-Q180 PolarHBondContact O-N 3.31Å
178	I	97.4	Very high	94.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-44.2	174.8	-65.5	175	0	0	0	110.7	I155 L156 M165 L173 Y174 V175 Q180 L181 F184 I217	I155-I178 HydrophobicContact CG2-CD1 4.43Å; L156-I178 HydrophobicContact CD2-CD1 4.16Å; M165-I178 HydrophobicContact CE-CG1 3.89Å; M165-I178 HydrophobicContact SD-CG1 4.37Å; L173-I178 HydrophobicContact CB-CD1 4.02Å; L173-I178 HydrophobicContact CB-CG1 4.42Å; Y174-I178 WeakPolarHBondContact O-CG1 3.32Å; Y174-I178 PolarHBondContact O-N 2.84Å; V175-I178 PolarHBondContact O-N 3.31Å; I178-Q180 PolarHBondContact O-N 2.92Å; I178-L181 VanDerWaalsContact O-CB 3.3Å; I178-L181 WeakPolarHBondContact O-CB 3.23Å; I178-L181 WeakPolarHBondContact O-CG 3.21Å; I178-L181 PolarHBondContact O-N 3.43Å; I178-F184 HydrophobicContact CG2-CD1 3.76Å; I178-F184 HydrophobicContact CG2-CD2 3.88Å; I178-F184 HydrophobicContact CG2-CE1 3.68Å; I178-F184 HydrophobicContact CG2-CE2 3.79Å; I178-F184 HydrophobicContact CG2-CG 3.86Å; I178-F184 HydrophobicContact CG2-CZ 3.68Å; I178-F184 WeakPolarHBondContact O-CB 3.47Å; I178-I217 HydrophobicContact CD1-CG2 3.46Å; I178-I217 VanDerWaalsContact CD1-CG2 3.46Å
179	L	96.7	Very high	95	Very high	44 Å²	44	50.5 Å²	50.5	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-18.3	-178.6	-69.8	176.5	0	0	0	113.6	V175 D176 K177 L181 V187 I192	V175-L179 HydrophobicContact CG1-CD1 3.97Å; V175-L179 HydrophobicContact CG1-CG 4.24Å; V175-L179 WeakPolarHBondContact O-CG 3.39Å; V175-L179 PolarHBondContact O-N 3.05Å; D176-L179 PolarHBondContact O-N 3.01Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 2.71Å; L179-L181 VanDerWaalsContact C-N 3.34Å; L179-V187 HydrophobicContact CD2-CB 4.04Å; L179-V187 HydrophobicContact CD2-CG1 3.88Å; L179-V187 WeakPolarHBondContact CD2-O 3.38Å; L179-I192 HydrophobicContact CD2-CD1 3.63Å; L179-I192 HydrophobicContact CD2-CG1 4.5Å; L179-I192 HydrophobicContact CG-CD1 4.08Å
180	Q	95.3	Very high	95.2	Very high	125 Å²	125	51.8 Å²	51.8	58%	0.584	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-15.4	173.6	-70.6	165.5	29.8	0	0	113.1	D176 K177 I178	D176-Q180 WeakPolarHBondContact O-CG 3.23Å; D176-Q180 PolarHBondContact O-N 2.73Å; D176-Q180 PolarHBondContact O-NE2 3.03Å; K177-Q180 PolarHBondContact O-N 3.31Å; I178-Q180 PolarHBondContact O-N 2.92Å
181	L	93.3	Very high	95.3	Very high	29 Å²	29	52.5 Å²	52.5	15%	0.152	26%	0.264	C	S	.	.	S	Bend	trans	-73	142	-177.6	-58	175.9	0	0	0	111.7	I155 V163 M165 I178 L179 P183 F184 Q185	I155-L181 HydrophobicContact CD1-CD1 3.76Å; I155-L181 HydrophobicContact CG1-CD1 4.06Å; V163-L181 HydrophobicContact CB-CD2 3.93Å; V163-L181 HydrophobicContact CG1-CD2 4.47Å; V163-L181 HydrophobicContact CG2-CD1 3.95Å; V163-L181 HydrophobicContact CG2-CD2 3.93Å; M165-L181 HydrophobicContact SD-CD1 4.01Å; I178-L181 VanDerWaalsContact O-CB 3.3Å; I178-L181 WeakPolarHBondContact O-CB 3.23Å; I178-L181 WeakPolarHBondContact O-CG 3.21Å; I178-L181 PolarHBondContact O-N 3.43Å; L179-L181 VanDerWaalsContact C-N 3.34Å; L181-P183 VanDerWaalsContact C-CD 3.46Å; L181-P183 VanDerWaalsContact C-N 3.35Å; L181-F184 HydrophobicContact CB-CD2 4.02Å; L181-F184 HydrophobicContact CD1-CD2 4.35Å; L181-F184 HydrophobicContact CD1-CE2 4.4Å; L181-F184 WeakPolarHBondContact O-CA 3.19Å; L181-F184 PolarHBondContact O-N 3.02Å; L181-Q185 PolarHBondContact O-N 3.14Å
182	K	89.7	Confident	95.4	Very high	68 Å²	68	52.5 Å²	52.5	30%	0.296	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-48.8	-44	178.8	-177.6	179.2	172.3	-169.8	0	113.7	D116 N120 F184 Q185	D116-K182 IonicContact OD2-NZ 2.91Å; D116-K182 PolarHBondContact OD2-NZ 3.31Å; N120-K182 HydrophobicContact CB-CD 3.98Å; N120-K182 HydrophobicContact CB-CG 4.23Å; K182-F184 PolarHBondContact O-N 3.38Å; K182-F184 VanDerWaalsContact O-N 3.14Å; K182-Q185 WeakPolarHBondContact O-CB 3.46Å; K182-Q185 WeakPolarHBondContact O-CG 3.23Å; K182-Q185 PolarHBondContact O-N 3.36Å
183	P	89.1	Confident	95.4	Very high	20 Å²	20	53.4 Å²	53.4	13%	0.13	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-64.7	-17.1	177.9	-23	34.8	0	0	0	115.2	N120 K151 L181	N120-P183 WeakPolarHBondContact OD1-CD 3.31Å; N120-P183 WeakPolarHBondContact OD1-CG 3.42Å; K151-P183 HydrophobicContact CD-CB 4.49Å; K151-P183 WeakPolarHBondContact CD-O 3.36Å; K151-P183 WeakPolarHBondContact CE-O 3.22Å; K151-P183 PolarHBondContact NZ-O 3.17Å; L181-P183 VanDerWaalsContact C-CD 3.46Å; L181-P183 VanDerWaalsContact C-N 3.35Å
184	F	93.4	Very high	95.3	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.013	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-107.2	7.5	-177	-66.9	-93.9	0	0	0	112.9	L148 K151 L152 I155 I178 L181 K182 G186 V187	L148-F184 HydrophobicContact CD1-CD1 3.94Å; L148-F184 HydrophobicContact CD1-CE1 3.76Å; K151-F184 HydrophobicContact CB-CE1 4.01Å; K151-F184 HydrophobicContact CB-CE2 4.35Å; K151-F184 HydrophobicContact CB-CZ 3.72Å; L152-F184 HydrophobicContact CD2-CE1 3.75Å; L152-F184 HydrophobicContact CD2-CZ 4.17Å; L152-F184 HydrophobicContact CG-CE1 4.11Å; I155-F184 HydrophobicContact CB-CE2 4.44Å; I155-F184 HydrophobicContact CG2-CE2 4.18Å; I155-F184 HydrophobicContact CG2-CZ 3.8Å; I178-F184 HydrophobicContact CG2-CD1 3.76Å; I178-F184 HydrophobicContact CG2-CD2 3.88Å; I178-F184 HydrophobicContact CG2-CE1 3.68Å; I178-F184 HydrophobicContact CG2-CE2 3.79Å; I178-F184 HydrophobicContact CG2-CG 3.86Å; I178-F184 HydrophobicContact CG2-CZ 3.68Å; I178-F184 WeakPolarHBondContact O-CB 3.47Å; L181-F184 HydrophobicContact CB-CD2 4.02Å; L181-F184 HydrophobicContact CD1-CD2 4.35Å; L181-F184 HydrophobicContact CD1-CE2 4.4Å; L181-F184 WeakPolarHBondContact O-CA 3.19Å; L181-F184 PolarHBondContact O-N 3.02Å; K182-F184 PolarHBondContact O-N 3.38Å; K182-F184 VanDerWaalsContact O-N 3.14Å; F184-G186 PolarHBondContact O-N 2.89Å; F184-V187 HydrophobicContact CB-CB 4.41Å; F184-V187 HydrophobicContact CB-CG2 4.31Å; F184-V187 HydrophobicContact CD1-CG2 4.28Å; F184-V187 VanDerWaalsContact O-CB 3.23Å; F184-V187 WeakPolarHBondContact O-CB 3.43Å; F184-V187 WeakPolarHBondContact O-CG2 3.38Å; F184-V187 PolarHBondContact O-N 3.38Å
185	Q	90.6	Very high	95.1	Very high	146 Å²	146	56.4 Å²	56.4	68%	0.682	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	129.4	170.4	-76.6	-73	-24.2	0	0	110.9	L181 K182 V187	L181-Q185 PolarHBondContact O-N 3.14Å; K182-Q185 WeakPolarHBondContact O-CB 3.46Å; K182-Q185 WeakPolarHBondContact O-CG 3.23Å; K182-Q185 PolarHBondContact O-N 3.36Å; Q185-V187 VanDerWaalsContact C-N 3.26Å; Q185-V187 PolarHBondContact O-N 3.37Å
186	G	92.5	Very high	95	Very high	71 Å²	71	57.2 Å²	57.2	73%	0.732	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-7.3	-176.4	0	0	0	0	0	115.6	F184	F184-G186 PolarHBondContact O-N 2.89Å
187	V	96.1	Very high	94.7	Very high	29 Å²	29	60.8 Å²	60.8	18%	0.176	31%	0.308	C	S	.	.			trans	-76	133.9	171.8	180	0	0	0	0	108.7	L148 L179 F184 Q185 D191 I192	L148-V187 HydrophobicContact CD1-CG1 3.85Å; L148-V187 HydrophobicContact CD1-CG2 4.05Å; L148-V187 HydrophobicContact CD2-CG1 3.85Å; L179-V187 HydrophobicContact CD2-CB 4.04Å; L179-V187 HydrophobicContact CD2-CG1 3.88Å; L179-V187 WeakPolarHBondContact CD2-O 3.38Å; F184-V187 HydrophobicContact CB-CB 4.41Å; F184-V187 HydrophobicContact CB-CG2 4.31Å; F184-V187 HydrophobicContact CD1-CG2 4.28Å; F184-V187 VanDerWaalsContact O-CB 3.23Å; F184-V187 WeakPolarHBondContact O-CB 3.43Å; F184-V187 WeakPolarHBondContact O-CG2 3.38Å; F184-V187 PolarHBondContact O-N 3.38Å; Q185-V187 VanDerWaalsContact C-N 3.26Å; Q185-V187 PolarHBondContact O-N 3.37Å; V187-D191 HydrophobicContact CG1-CB 4.16Å; V187-I192 HydrophobicContact CG1-CD1 4.44Å; V187-I192 HydrophobicContact CG1-CG1 3.97Å
188	R	96.6	Very high	94.3	Very high	146 Å²	146	59.1 Å²	59.1	55%	0.551	31%	0.309	S	S	*	.			trans	-106.2	165.8	174.7	-51.5	171.4	-66.1	174.2	5.2	111.1	E190 D191 I192	R188-E190 WeakPolarHBondContact CB-OE2 3.41Å; R188-E190 IonicContact NE-OE2 3.29Å; R188-E190 PolarHBondContact O-N 2.87Å; R188-D191 WeakPolarHBondContact CB-OD2 3.41Å; R188-D191 PolarHBondContact N-OD2 3.15Å; R188-D191 IonicContact NE-OD2 3.81Å; R188-D191 PolarHBondContact NE-OD2 3.37Å; R188-D191 IonicContact NH2-OD1 2.82Å; R188-D191 IonicContact NH2-OD2 2.71Å; R188-D191 WeakPolarHBondContact O-CB 3.25Å; R188-D191 PolarHBondContact O-N 3.29Å; R188-I192 PolarHBondContact O-N 2.89Å
189	L	96.7	Very high	93.2	Very high	69 Å²	69	60 Å²	60	36%	0.361	31%	0.314	S	S	.	.	H	α-helix	trans	-58.2	-36.1	176.7	175	58.9	0	0	0	111.9	V175 D191 I192 S193 L215	V175-L189 HydrophobicContact CG1-CD1 3.99Å; L189-D191 PolarHBondContact O-N 3.21Å; L189-I192 PolarHBondContact O-N 2.68Å; L189-S193 WeakPolarHBondContact O-CB 3.28Å; L189-S193 PolarHBondContact O-N 2.97Å; L189-S193 PolarHBondContact O-OG 2.88Å; L189-L215 HydrophobicContact CD1-CD2 3.34Å; L189-L215 HydrophobicContact CD2-CD2 4.3Å; L189-L215 HydrophobicContact CG-CD2 4.45Å
190	E	96.9	Very high	92.2	Very high	107 Å²	107	64.9 Å²	64.9	50%	0.5	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-31.2	179.3	-56.1	72.4	-148.1	0	0	111.3	R188 S193 R194	R188-E190 WeakPolarHBondContact CB-OE2 3.41Å; R188-E190 IonicContact NE-OE2 3.29Å; R188-E190 PolarHBondContact O-N 2.87Å; E190-S193 PolarHBondContact O-N 3.36Å; E190-R194 VanDerWaalsContact O-CB 3.25Å; E190-R194 WeakPolarHBondContact O-CB 3.38Å; E190-R194 PolarHBondContact O-N 2.9Å
191	D	97	Very high	91.4	Very high	19 Å²	19	61.6 Å²	61.6	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-71.9	-41.4	177.4	-56.1	-51.9	0	0	0	110.8	L148 V187 R188 L189 R194 V195	L148-D191 HydrophobicContact CD2-CB 3.82Å; V187-D191 HydrophobicContact CG1-CB 4.16Å; R188-D191 WeakPolarHBondContact CB-OD2 3.41Å; R188-D191 PolarHBondContact N-OD2 3.15Å; R188-D191 IonicContact NE-OD2 3.81Å; R188-D191 PolarHBondContact NE-OD2 3.37Å; R188-D191 IonicContact NH2-OD1 2.82Å; R188-D191 IonicContact NH2-OD2 2.71Å; R188-D191 WeakPolarHBondContact O-CB 3.25Å; R188-D191 PolarHBondContact O-N 3.29Å; L189-D191 PolarHBondContact O-N 3.21Å; D191-R194 PolarHBondContact O-N 3.32Å; D191-R194 IonicContact OD1-CZ 3.67Å; D191-R194 VanDerWaalsContact OD1-CZ 3.29Å; D191-R194 IonicContact OD1-NH1 2.97Å; D191-R194 PolarHBondContact OD1-NH1 2.86Å; D191-R194 IonicContact OD1-NH2 3.93Å; D191-R194 PolarHBondContact OD1-NH2 2.95Å; D191-V195 WeakPolarHBondContact O-CG2 3.47Å; D191-V195 PolarHBondContact O-N 2.85Å
192	I	97.4	Very high	91	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62	-47.5	171.9	-66.4	178.9	0	0	0	110.1	L148 L152 V175 L179 V187 R188 L189 R194 V195 V196 L206 I217	L148-I192 HydrophobicContact CD2-CG1 4.49Å; L152-I192 HydrophobicContact CD1-CG2 4.48Å; V175-I192 HydrophobicContact CG1-CD1 3.81Å; L179-I192 HydrophobicContact CD2-CD1 3.63Å; L179-I192 HydrophobicContact CD2-CG1 4.5Å; L179-I192 HydrophobicContact CG-CD1 4.08Å; V187-I192 HydrophobicContact CG1-CD1 4.44Å; V187-I192 HydrophobicContact CG1-CG1 3.97Å; R188-I192 PolarHBondContact O-N 2.89Å; L189-I192 PolarHBondContact O-N 2.68Å; I192-R194 VanDerWaalsContact C-N 3.31Å; I192-R194 PolarHBondContact O-N 3.17Å; I192-V195 PolarHBondContact O-N 3.4Å; I192-V196 HydrophobicContact CG2-CG2 4.19Å; I192-V196 VanDerWaalsContact O-CG2 3.23Å; I192-V196 WeakPolarHBondContact O-CG2 3.37Å; I192-V196 PolarHBondContact O-N 3.44Å; I192-L206 HydrophobicContact CG2-CD1 4.43Å; I192-L206 HydrophobicContact CG2-CD2 4.32Å; I192-I217 HydrophobicContact CG2-CD1 3.87Å
193	S	96.2	Very high	91.1	Very high	35 Å²	35	65.7 Å²	65.7	25%	0.245	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-43.1	179.8	-58.1	0	0	0	0	111.3	L189 E190 V196 N197	L189-S193 WeakPolarHBondContact O-CB 3.28Å; L189-S193 PolarHBondContact O-N 2.97Å; L189-S193 PolarHBondContact O-OG 2.88Å; E190-S193 PolarHBondContact O-N 3.36Å; S193-V196 PolarHBondContact O-N 2.85Å; S193-N197 WeakPolarHBondContact O-CB 3.34Å; S193-N197 PolarHBondContact O-N 3.38Å; S193-N197 PolarHBondContact O-ND2 3.38Å; S193-N197 VanDerWaalsContact O-ND2 3.16Å
194	R	95.7	Very high	91.3	Very high	102 Å²	102	65.1 Å²	65.1	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-59.1	-51.1	174.5	-176	173.3	65.2	-114.6	-3.9	111	D145 E190 D191 I192 V196 N197 S198	D145-R194 IonicContact OD1-CZ 3.95Å; D145-R194 IonicContact OD1-NE 3.14Å; D145-R194 PolarHBondContact OD1-NE 3.16Å; D145-R194 VanDerWaalsContact OD1-NE 3.11Å; D145-R194 IonicContact OD1-NH2 2.72Å; D145-R194 PolarHBondContact OD1-NH2 3.16Å; D145-R194 WeakPolarHBondContact OD2-CD 3.34Å; D145-R194 IonicContact OD2-CZ 3.2Å; D145-R194 IonicContact OD2-NE 2.8Å; D145-R194 PolarHBondContact OD2-NE 3.02Å; E190-R194 VanDerWaalsContact O-CB 3.25Å; E190-R194 WeakPolarHBondContact O-CB 3.38Å; E190-R194 PolarHBondContact O-N 2.9Å; D191-R194 PolarHBondContact O-N 3.32Å; D191-R194 IonicContact OD1-CZ 3.67Å; D191-R194 VanDerWaalsContact OD1-CZ 3.29Å; D191-R194 IonicContact OD1-NH1 2.97Å; D191-R194 PolarHBondContact OD1-NH1 2.86Å; D191-R194 IonicContact OD1-NH2 3.93Å; D191-R194 PolarHBondContact OD1-NH2 2.95Å; I192-R194 VanDerWaalsContact C-N 3.31Å; I192-R194 PolarHBondContact O-N 3.17Å; R194-V196 VanDerWaalsContact C-N 3.32Å; R194-V196 PolarHBondContact O-N 3.09Å; R194-N197 PolarHBondContact O-N 2.95Å; R194-S198 WeakPolarHBondContact O-CB 3.39Å; R194-S198 PolarHBondContact O-N 3.21Å; R194-S198 PolarHBondContact O-OG 2.93Å
195	V	95.5	Very high	91.4	Very high	3 Å²	3	67 Å²	67	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-35.2	179.6	166.2	0	0	0	0	112.8	D145 L148 L152 D191 I192 N199 Y204	D145-V195 HydrophobicContact CB-CG2 3.78Å; L148-V195 HydrophobicContact CB-CG2 4.08Å; L148-V195 HydrophobicContact CD2-CB 4.41Å; L148-V195 HydrophobicContact CD2-CG2 3.75Å; L148-V195 HydrophobicContact CG-CG2 3.98Å; L152-V195 HydrophobicContact CD1-CG1 3.93Å; D191-V195 WeakPolarHBondContact O-CG2 3.47Å; D191-V195 PolarHBondContact O-N 2.85Å; I192-V195 PolarHBondContact O-N 3.4Å; V195-N199 WeakPolarHBondContact O-CB 3.48Å; V195-N199 PolarHBondContact O-N 2.88Å; V195-Y204 HydrophobicContact CG1-CD2 4.45Å; V195-Y204 HydrophobicContact CG1-CE2 4.17Å
196	V	94.6	Very high	91.7	Very high	19 Å²	19	62.2 Å²	62.2	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-68	-42.9	176.4	173.2	0	0	0	0	110.2	I192 S193 R194 Y204 L206 I217	I192-V196 HydrophobicContact CG2-CG2 4.19Å; I192-V196 VanDerWaalsContact O-CG2 3.23Å; I192-V196 WeakPolarHBondContact O-CG2 3.37Å; I192-V196 PolarHBondContact O-N 3.44Å; S193-V196 PolarHBondContact O-N 2.85Å; R194-V196 VanDerWaalsContact C-N 3.32Å; R194-V196 PolarHBondContact O-N 3.09Å; V196-Y204 HydrophobicContact CG2-CD2 4.38Å; V196-L206 HydrophobicContact CB-CD1 4.05Å; V196-L206 HydrophobicContact CB-CG 4.45Å; V196-L206 HydrophobicContact CG1-CD1 4.19Å; V196-L206 HydrophobicContact CG1-CG 4.26Å; V196-L206 HydrophobicContact CG2-CD1 3.89Å; V196-L206 HydrophobicContact CG2-CG 3.99Å; V196-I217 HydrophobicContact CG2-CD1 3.72Å
197	N	91.6	Very high	91.8	Very high	138 Å²	138	60.4 Å²	60.4	74%	0.738	30%	0.298	S	S	*	.	H	α-helix	trans	-75.3	-32.9	-177.5	-69	-24.8	0	0	0	113.9	S193 R194	S193-N197 WeakPolarHBondContact O-CB 3.34Å; S193-N197 PolarHBondContact O-N 3.38Å; S193-N197 PolarHBondContact O-ND2 3.38Å; S193-N197 VanDerWaalsContact O-ND2 3.16Å; R194-N197 PolarHBondContact O-N 2.95Å
198	S	87.3	Confident	91.9	Very high	68 Å²	68	63 Å²	63	48%	0.476	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	0.8	-178.6	66.7	0	0	0	0	114.2	R194 D200	R194-S198 WeakPolarHBondContact O-CB 3.39Å; R194-S198 PolarHBondContact O-N 3.21Å; R194-S198 PolarHBondContact O-OG 2.93Å; S198-D200 PolarHBondContact O-N 3.22Å; S198-D200 VanDerWaalsContact O-N 3.16Å
199	N	76.2	Confident	91.9	Very high	19 Å²	19	56.3 Å²	56.3	10%	0.102	29%	0.289	C	S	.	.			trans	-76	105.9	-175.2	-167.3	-40.1	0	0	0	112.2	V195 K201 K202 Y204	V195-N199 WeakPolarHBondContact O-CB 3.48Å; V195-N199 PolarHBondContact O-N 2.88Å; N199-K201 PolarHBondContact O-N 2.97Å; N199-K201 WeakPolarHBondContact OD1-CA 3.25Å; N199-K201 PolarHBondContact OD1-N 2.89Å; N199-K202 WeakPolarHBondContact O-CA 3.23Å; N199-K202 PolarHBondContact O-N 2.83Å; N199-K202 PolarHBondContact OD1-N 3.49Å; N199-Y204 WeakPolarHBondContact ND2-CE2 3.46Å
200	D	74.7	Confident	91.8	Very high	146 Å²	146	58.4 Å²	58.4	78%	0.781	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-38.4	176.2	-60.4	-30	0	0	0	113.6	S198 K202 I282	S198-D200 PolarHBondContact O-N 3.22Å; S198-D200 VanDerWaalsContact O-N 3.16Å; D200-K202 VanDerWaalsContact C-N 3.29Å; D200-K202 PolarHBondContact O-N 3.15Å; D200-I282 WeakPolarHBondContact O-CG2 3.38Å
201	K	79	Confident	91.7	Very high	56 Å²	56	61.9 Å²	61.9	24%	0.243	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	1.1	-177.4	-57.4	-158.5	-178.7	-156.2	0	113.6	N199 R203 N312	N199-K201 PolarHBondContact O-N 2.97Å; N199-K201 WeakPolarHBondContact OD1-CA 3.25Å; N199-K201 PolarHBondContact OD1-N 2.89Å; K201-R203 HydrophobicContact CB-CG 3.79Å; K201-R203 PolarHBondContact O-N 2.94Å; K201-R203 VanDerWaalsContact O-N 3.14Å; K201-N312 PolarHBondContact O-ND2 3.34Å
202	K	85.4	Confident	91.6	Very high	123 Å²	123	64.6 Å²	64.6	54%	0.535	34%	0.337	S	S	.	.			trans	42.8	50.2	-176.1	-59.2	-172.5	-180	-177.4	0	111.7	N199 D200 Y204 Y220 I282 N312	N199-K202 WeakPolarHBondContact O-CA 3.23Å; N199-K202 PolarHBondContact O-N 2.83Å; N199-K202 PolarHBondContact OD1-N 3.49Å; D200-K202 VanDerWaalsContact C-N 3.29Å; D200-K202 PolarHBondContact O-N 3.15Å; K202-Y204 VanDerWaalsContact C-N 3.27Å; K202-Y204 PolarHBondContact O-N 3.21Å; K202-Y220 WeakPolarHBondContact O-CD2 3.41Å; K202-Y220 WeakPolarHBondContact O-CE2 3.48Å; K202-I282 HydrophobicContact CB-CG2 4.43Å; K202-I282 HydrophobicContact CD-CD1 4.44Å; K202-I282 HydrophobicContact CD-CG2 4.19Å; K202-I282 HydrophobicContact CG-CG2 4.07Å; K202-N312 HydrophobicContact CB-CB 4.32Å; K202-N312 WeakPolarHBondContact O-CB 3.31Å
203	R	89.9	Confident	91.5	Very high	61 Å²	61	67 Å²	67	23%	0.23	36%	0.363	C	S	.	.			trans	-70.6	-25.9	-169.8	-62.9	-176.2	-171.1	149.7	9.5	113.6	K201 A219 Y220	K201-R203 HydrophobicContact CB-CG 3.79Å; K201-R203 PolarHBondContact O-N 2.94Å; K201-R203 VanDerWaalsContact O-N 3.14Å; R203-A219 VanDerWaalsContact O-CA 3.32Å; R203-A219 WeakPolarHBondContact O-CA 3.23Å; R203-Y220 PolarHBondContact O-N 3.13Å
204	Y	94.8	Very high	91.6	Very high	8 Å²	8	69.2 Å²	69.2	3%	0.031	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	157	-165.9	-44.6	-50.6	0	0	0	110.6	S149 L152 A153 L156 V195 V196 N199 K202 R218 A219	S149-Y204 PolarHBondContact O-OH 3.35Å; S149-Y204 PolarHBondContact OG-OH 2.88Å; L152-Y204 HydrophobicContact CB-CE1 4.48Å; L152-Y204 HydrophobicContact CB-CE2 4.25Å; L152-Y204 HydrophobicContact CD1-CD2 4.46Å; L152-Y204 HydrophobicContact CD1-CE2 4.37Å; A153-Y204 WeakPolarHBondContact CB-OH 3.43Å; L156-Y204 HydrophobicContact CD1-CD1 3.73Å; L156-Y204 HydrophobicContact CD1-CE1 4.13Å; L156-Y204 HydrophobicContact CD1-CG 4.42Å; V195-Y204 HydrophobicContact CG1-CD2 4.45Å; V195-Y204 HydrophobicContact CG1-CE2 4.17Å; V196-Y204 HydrophobicContact CG2-CD2 4.38Å; N199-Y204 WeakPolarHBondContact ND2-CE2 3.46Å; K202-Y204 VanDerWaalsContact C-N 3.27Å; K202-Y204 PolarHBondContact O-N 3.21Å; Y204-R218 WeakPolarHBondContact CA-O 2.97Å; Y204-A219 HydrophobicContact CD1-CB 4.28Å
205	E	94.7	Very high	91.7	Very high	43 Å²	43	67 Å²	67	20%	0.201	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.5	172.4	-174.9	-176.5	-130.3	0	0	108.7	Y172 I217 R218 Y220	Y172-E205 PolarHBondContact OH-OE2 3.18Å; E205-I217 VanDerWaalsContact O-CA 3.29Å; E205-I217 WeakPolarHBondContact O-CA 3.35Å; E205-R218 HydrophobicContact CB-CG 4.14Å; E205-R218 PolarHBondContact N-O 3.21Å; E205-R218 VanDerWaalsContact N-O 3.11Å; E205-R218 PolarHBondContact O-N 2.97Å; E205-R218 IonicContact OE1-NH2 3.6Å; E205-R218 IonicContact OE2-CZ 2.71Å; E205-R218 IonicContact OE2-NE 2.73Å; E205-R218 PolarHBondContact OE2-NE 3.35Å; E205-R218 IonicContact OE2-NH2 3.93Å; E205-R218 PolarHBondContact OE2-NH2 2.85Å; E205-Y220 HydrophobicContact CB-CE1 4.25Å; E205-Y220 HydrophobicContact CB-CE2 4.2Å; E205-Y220 PolarHBondContact OE1-OH 2.75Å
206	L	96.5	Very high	91.8	Very high	45 Å²	45	68.6 Å²	68.6	24%	0.236	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.9	166.2	-78.2	165	0	0	0	108.9	V175 I192 V196 L215 R216 I217	V175-L206 HydrophobicContact CG2-CD2 3.81Å; I192-L206 HydrophobicContact CG2-CD1 4.43Å; I192-L206 HydrophobicContact CG2-CD2 4.32Å; V196-L206 HydrophobicContact CB-CD1 4.05Å; V196-L206 HydrophobicContact CB-CG 4.45Å; V196-L206 HydrophobicContact CG1-CD1 4.19Å; V196-L206 HydrophobicContact CG1-CG 4.26Å; V196-L206 HydrophobicContact CG2-CD1 3.89Å; V196-L206 HydrophobicContact CG2-CG 3.99Å; L206-L215 HydrophobicContact CD2-CD1 4.39Å; L206-L215 HydrophobicContact CD2-CD2 4.06Å; L206-L215 HydrophobicContact CD2-CG 4.11Å; L206-R216 WeakPolarHBondContact CA-O 3.46Å; L206-I217 HydrophobicContact CD2-CB 3.82Å; L206-I217 HydrophobicContact CD2-CD1 4.23Å; L206-I217 HydrophobicContact CD2-CG1 4.19Å; L206-I217 HydrophobicContact CG-CD1 4.49Å
207	S	96.2	Very high	92	Very high	33 Å²	33	67.7 Å²	67.7	23%	0.231	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	154.7	178.7	177.9	0	0	0	0	109.2	R216	S207-R216 PolarHBondContact N-O 3.22Å; S207-R216 VanDerWaalsContact O-CG 3.23Å; S207-R216 WeakPolarHBondContact O-CG 3.47Å; S207-R216 PolarHBondContact O-N 3.46Å; S207-R216 VanDerWaalsContact O-O 3.08Å
208	T	97.2	Very high	92.2	Very high	82 Å²	82	61.8 Å²	61.8	50%	0.503	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.7	168.4	-55	0	0	0	0	108.2	G213	T208-G213 VanDerWaalsContact CG2-C 3.49Å; T208-G213 VanDerWaalsContact CG2-O 3.27Å; T208-G213 WeakPolarHBondContact CG2-O 3.25Å
209	N	96.4	Very high	92.6	Very high	6 Å²	6	58.5 Å²	58.5	3%	0.032	31%	0.311	C	S	.	.			trans	-64.6	125.3	172.2	178.5	-51	0	0	0	108.7	Y174 E211 N212 G213 L214	Y174-N209 HydrophobicContact CE1-CB 4.08Å; Y174-N209 PolarHBondContact OH-ND2 2.88Å; N209-E211 VanDerWaalsContact C-N 3.29Å; N209-E211 PolarHBondContact O-N 2.95Å; N209-E211 WeakPolarHBondContact OD1-CA 3.23Å; N209-E211 WeakPolarHBondContact OD1-CB 3.39Å; N209-E211 PolarHBondContact OD1-N 3.04Å; N209-N212 VanDerWaalsContact CB-OD1 3.23Å; N209-N212 WeakPolarHBondContact CB-OD1 3.29Å; N209-N212 PolarHBondContact OD1-N 3.27Å; N209-G213 VanDerWaalsContact O-CA 3.25Å; N209-G213 WeakPolarHBondContact O-CA 3.23Å; N209-G213 PolarHBondContact O-N 3.16Å; N209-L214 PolarHBondContact N-O 3.41Å
210	P	94	Very high	93.3	Very high	113 Å²	113	59.1 Å²	59.1	73%	0.734	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-22.4	-174.6	28.2	-34.9	0	0	0	114.1
211	E	94.6	Very high	94	Very high	180 Å²	180	53 Å²	53	84%	0.841	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-41	-176.8	-60.4	178.1	-179.6	0	0	112.3	N209	N209-E211 VanDerWaalsContact C-N 3.29Å; N209-E211 PolarHBondContact O-N 2.95Å; N209-E211 WeakPolarHBondContact OD1-CA 3.23Å; N209-E211 WeakPolarHBondContact OD1-CB 3.39Å; N209-E211 PolarHBondContact OD1-N 3.04Å
212	N	95.6	Very high	94.5	Very high	76 Å²	76	50.5 Å²	50.5	41%	0.406	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-4.4	-174.4	65.2	32	0	0	0	114.6	Y174 N209 L214	Y174-N212 PolarHBondContact OH-ND2 3.46Å; N209-N212 VanDerWaalsContact CB-OD1 3.23Å; N209-N212 WeakPolarHBondContact CB-OD1 3.29Å; N209-N212 PolarHBondContact OD1-N 3.27Å; N212-L214 HydrophobicContact CB-CG 4.45Å; N212-L214 PolarHBondContact O-N 3.36Å; N212-L214 VanDerWaalsContact OD1-CB 3.23Å; N212-L214 WeakPolarHBondContact OD1-CB 3.23Å; N212-L214 WeakPolarHBondContact OD1-CG 3.5Å; N212-L214 PolarHBondContact OD1-N 3.07Å
213	G	96.5	Very high	94.9	Very high	52 Å²	52	44.8 Å²	44.8	54%	0.536	24%	0.244	S	C	.	.			trans	71.3	4.9	178.7	0	0	0	0	0	115	T208 N209	T208-G213 VanDerWaalsContact CG2-C 3.49Å; T208-G213 VanDerWaalsContact CG2-O 3.27Å; T208-G213 WeakPolarHBondContact CG2-O 3.25Å; N209-G213 VanDerWaalsContact O-CA 3.25Å; N209-G213 WeakPolarHBondContact O-CA 3.23Å; N209-G213 PolarHBondContact O-N 3.16Å
214	L	96.8	Very high	94.9	Very high	80 Å²	80	44.4 Å²	44.4	42%	0.419	25%	0.249	S	C	.	.			trans	-80.7	142.9	-178.5	-60.8	177.1	0	0	0	111.5	Y174 N209 N212	Y174-L214 HydrophobicContact CD1-CB 3.71Å; Y174-L214 HydrophobicContact CD1-CD1 4.26Å; Y174-L214 HydrophobicContact CE1-CB 3.75Å; Y174-L214 HydrophobicContact CE1-CD1 4.23Å; N209-L214 PolarHBondContact N-O 3.41Å; N212-L214 HydrophobicContact CB-CG 4.45Å; N212-L214 PolarHBondContact O-N 3.36Å; N212-L214 VanDerWaalsContact OD1-CB 3.23Å; N212-L214 WeakPolarHBondContact OD1-CB 3.23Å; N212-L214 WeakPolarHBondContact OD1-CG 3.5Å; N212-L214 PolarHBondContact OD1-N 3.07Å
215	L	98	Very high	94.7	Very high	55 Å²	55	45.5 Å²	45.5	29%	0.288	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.3	177.4	-167.2	72.4	0	0	0	110.8	V175 L189 L206	V175-L215 HydrophobicContact CB-CB 4.46Å; V175-L215 HydrophobicContact CB-CD2 4.25Å; V175-L215 HydrophobicContact CB-CG 4.42Å; V175-L215 HydrophobicContact CG1-CD2 4.39Å; V175-L215 HydrophobicContact CG2-CB 4.41Å; V175-L215 HydrophobicContact CG2-CD2 4.01Å; V175-L215 HydrophobicContact CG2-CG 3.96Å; V175-L215 PolarHBondContact N-O 3.25Å; L189-L215 HydrophobicContact CD1-CD2 3.34Å; L189-L215 HydrophobicContact CD2-CD2 4.3Å; L189-L215 HydrophobicContact CG-CD2 4.45Å; L206-L215 HydrophobicContact CD2-CD1 4.39Å; L206-L215 HydrophobicContact CD2-CD2 4.06Å; L206-L215 HydrophobicContact CD2-CG 4.11Å
216	R	98	Very high	94.5	Very high	37 Å²	37	49.8 Å²	49.8	14%	0.14	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.3	179.6	60.8	178.7	-175.7	174.6	2.7	111.2	Y172 L173 Y174 L206 S207	Y172-R216 HydrophobicContact CD1-CB 4.11Å; Y172-R216 HydrophobicContact CD1-CG 3.62Å; Y172-R216 HydrophobicContact CE1-CG 4.22Å; Y172-R216 HydrophobicContact CG-CB 4.4Å; Y172-R216 HydrophobicContact CG-CG 3.96Å; L173-R216 CarbonylContact O-C 3.58Å; L173-R216 VanDerWaalsContact O-CA 3.25Å; L173-R216 WeakPolarHBondContact O-CA 3.48Å; L173-R216 WeakPolarHBondContact O-CB 3.15Å; Y174-R216 HydrophobicContact CD1-CB 4.24Å; L206-R216 WeakPolarHBondContact CA-O 3.46Å; S207-R216 PolarHBondContact N-O 3.22Å; S207-R216 VanDerWaalsContact O-CG 3.23Å; S207-R216 WeakPolarHBondContact O-CG 3.47Å; S207-R216 PolarHBondContact O-N 3.46Å; S207-R216 VanDerWaalsContact O-O 3.08Å
217	I	98	Very high	94.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.9	180	-174.1	170.5	0	0	0	110.1	L152 L156 Y172 L173 V175 I178 I192 V196 E205 L206	L152-I217 HydrophobicContact CD1-CD1 4.39Å; L152-I217 HydrophobicContact CD2-CD1 4.29Å; L156-I217 HydrophobicContact CD1-CD1 4.16Å; L156-I217 HydrophobicContact CD1-CG1 4.02Å; L156-I217 HydrophobicContact CD2-CG2 3.85Å; L156-I217 WeakPolarHBondContact CD2-O 3.42Å; Y172-I217 CarbonylContact C-O 3.52Å; Y172-I217 WeakPolarHBondContact CA-O 3.04Å; L173-I217 PolarHBondContact N-O 3.35Å; L173-I217 PolarHBondContact O-N 3.04Å; V175-I217 HydrophobicContact CG2-CB 4.01Å; V175-I217 HydrophobicContact CG2-CG2 3.84Å; I178-I217 HydrophobicContact CD1-CG2 3.46Å; I178-I217 VanDerWaalsContact CD1-CG2 3.46Å; I192-I217 HydrophobicContact CG2-CD1 3.87Å; V196-I217 HydrophobicContact CG2-CD1 3.72Å; E205-I217 VanDerWaalsContact O-CA 3.29Å; E205-I217 WeakPolarHBondContact O-CA 3.35Å; L206-I217 HydrophobicContact CD2-CB 3.82Å; L206-I217 HydrophobicContact CD2-CD1 4.23Å; L206-I217 HydrophobicContact CD2-CG1 4.19Å; L206-I217 HydrophobicContact CG-CD1 4.49Å
218	R	96.6	Very high	94	Very high	14 Å²	14	54.6 Å²	54.6	5%	0.053	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	164.9	172.6	67	174.5	173.5	175.8	0.7	112.1	G170 G171 Y172 Y204 E205 D231	G170-R218 WeakPolarHBondContact O-CD 3.34Å; G170-R218 PolarHBondContact O-NH1 3.04Å; G171-R218 VanDerWaalsContact O-CB 3.23Å; G171-R218 WeakPolarHBondContact O-CB 3.47Å; Y172-R218 HydrophobicContact CD1-CB 3.6Å; Y172-R218 HydrophobicContact CD1-CG 3.72Å; Y172-R218 HydrophobicContact CE1-CB 3.91Å; Y172-R218 HydrophobicContact CE1-CG 3.45Å; Y172-R218 VanDerWaalsContact CE1-CG 3.45Å; Y172-R218 HydrophobicContact CE2-CG 4.39Å; Y172-R218 HydrophobicContact CG-CB 3.92Å; Y172-R218 HydrophobicContact CG-CG 4.28Å; Y172-R218 VanDerWaalsContact CZ-CD 3.41Å; Y172-R218 VanDerWaalsContact CZ-NE 3.31Å; Y172-R218 PolarHBondContact OH-NE 3.49Å; Y172-R218 VanDerWaalsContact OH-NE 3.14Å; Y204-R218 WeakPolarHBondContact CA-O 2.97Å; E205-R218 HydrophobicContact CB-CG 4.14Å; E205-R218 PolarHBondContact N-O 3.21Å; E205-R218 VanDerWaalsContact N-O 3.11Å; E205-R218 PolarHBondContact O-N 2.97Å; E205-R218 IonicContact OE1-NH2 3.6Å; E205-R218 IonicContact OE2-CZ 2.71Å; E205-R218 IonicContact OE2-NE 2.73Å; E205-R218 PolarHBondContact OE2-NE 3.35Å; E205-R218 IonicContact OE2-NH2 3.93Å; E205-R218 PolarHBondContact OE2-NH2 2.85Å; R218-D231 IonicContact CZ-OD2 3.4Å; R218-D231 IonicContact NH2-OD2 2.84Å; R218-D231 PolarHBondContact NH2-OD2 2.97Å
219	A	95.3	Very high	93.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	143	160.1	0	0	0	0	0	110.1	L156 R157 R203 Y204 H223	L156-A219 HydrophobicContact CB-CB 3.97Å; R157-A219 HydrophobicContact CG-CB 3.91Å; R203-A219 VanDerWaalsContact O-CA 3.32Å; R203-A219 WeakPolarHBondContact O-CA 3.23Å; Y204-A219 HydrophobicContact CD1-CB 4.28Å; A219-H223 PolarHBondContact O-CE1 2.98Å; A219-H223 PolarHBondContact O-NE2 3.45Å
220	Y	91.5	Very high	93.3	Very high	32 Å²	32	54.7 Å²	54.7	13%	0.125	31%	0.314	C	S	.	.	S	Bend	trans	-71.8	-32.4	178.4	-73	-65.6	0	0	0	113.9	K202 R203 E205 K311 N312	K202-Y220 WeakPolarHBondContact O-CD2 3.41Å; K202-Y220 WeakPolarHBondContact O-CE2 3.48Å; R203-Y220 PolarHBondContact O-N 3.13Å; E205-Y220 HydrophobicContact CB-CE1 4.25Å; E205-Y220 HydrophobicContact CB-CE2 4.2Å; E205-Y220 PolarHBondContact OE1-OH 2.75Å; Y220-K311 HydrophobicContact CD1-CB 3.74Å; Y220-K311 HydrophobicContact CE1-CB 3.55Å; Y220-K311 HydrophobicContact CE1-CD 3.85Å; Y220-K311 HydrophobicContact CE1-CG 4.23Å; Y220-K311 HydrophobicContact CG-CB 4.4Å; Y220-N312 HydrophobicContact CD2-CB 4.02Å
221	Q	90	Very high	93.1	Very high	17 Å²	17	52 Å²	52	8%	0.079	29%	0.293	C	S	.	.	S	Bend	trans	-154.7	168.7	-175.6	57.7	80.6	-3.2	0	0	111	R157 H270 V314 L316	R157-Q221 PolarHBondContact NE-O 3.2Å; R157-Q221 PolarHBondContact NH2-O 2.82Å; Q221-H270 PolarHBondContact OE1-CD2 3.14Å; Q221-H270 VanDerWaalsContact OE1-CD2 3.25Å; Q221-H270 PolarHBondContact OE1-NE2 3.26Å; Q221-H270 VanDerWaalsContact OE1-NE2 3.08Å; Q221-V314 HydrophobicContact CG-CB 4.32Å; Q221-V314 HydrophobicContact CG-CG1 4.47Å; Q221-V314 HydrophobicContact CG-CG2 4.35Å; Q221-L316 HydrophobicContact CB-CD1 4.41Å; Q221-L316 HydrophobicContact CB-CD2 4.39Å
222	G	88.8	Confident	93.1	Very high	3 Å²	3	45.3 Å²	45.3	3%	0.031	26%	0.263	C	S	.	.			trans	98.4	13.4	169.4	0	0	0	0	0	114	H158	H158-G222 PolarHBondContact CE1-O 3.09Å
223	H	92.6	Very high	93.1	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.014	27%	0.265	C	S	.	.			trans	-62.9	144.8	175.1	-51.6	95.4	0	0	0	111.4	L156 R157 A219 V225 I227 T267	L156-H223 PolarHBondContact O-CD2 2.76Å; L156-H223 VanDerWaalsContact O-CD2 3.29Å; L156-H223 PolarHBondContact O-NE2 3.45Å; R157-H223 WeakPolarHBondContact O-CA 3.2Å; A219-H223 PolarHBondContact O-CE1 2.98Å; A219-H223 PolarHBondContact O-NE2 3.45Å; H223-V225 WeakPolarHBondContact CB-O 3.4Å; H223-I227 HydrophobicContact CB-CG1 4.17Å; H223-T267 PolarHBondContact O-N 3.39Å
224	T	90.2	Very high	93.1	Very high	54 Å²	54	45.9 Å²	45.9	33%	0.331	26%	0.261	S	S	.	.	S	Bend	trans	-100.2	-7.6	167.2	50.1	0	0	0	0	112.2	R157 H158 Q265 R266	R157-T224 PolarHBondContact O-N 2.95Å; R157-T224 PolarHBondContact O-OG1 3.35Å; H158-T224 WeakPolarHBondContact CE1-CG2 3.16Å; H158-T224 WeakPolarHBondContact ND1-CG2 3.43Å; H158-T224 PolarHBondContact ND1-OG1 3.48Å; T224-Q265 WeakPolarHBondContact CB-O 3.42Å; T224-Q265 HydrophobicContact CG2-CB 4.39Å; T224-Q265 WeakPolarHBondContact CG2-O 3.49Å; T224-R266 HydrophobicContact CG2-CG 4.48Å
225	V	90.9	Very high	93.1	Very high	31 Å²	31	42.4 Å²	42.4	19%	0.188	24%	0.243	C	C	.	.	S	Bend	trans	-108.6	154.3	173.3	-60.9	0	0	0	0	109.8	Y167 H223 I227 T267	Y167-V225 HydrophobicContact CD2-CG2 4.21Å; Y167-V225 HydrophobicContact CE2-CG2 3.6Å; H223-V225 WeakPolarHBondContact CB-O 3.4Å; V225-I227 HydrophobicContact CG2-CD1 3.72Å; V225-I227 HydrophobicContact CG2-CG1 4.29Å; V225-T267 WeakPolarHBondContact O-CG2 3.48Å
226	T	90.1	Very high	93	Very high	133 Å²	133	47.2 Å²	47.2	82%	0.816	26%	0.264	S	S	*	.			trans	-73.1	129.6	172.5	-58.3	0	0	0	0	109.1
227	I	92	Very high	92.9	Very high	20 Å²	20	50 Å²	50	10%	0.103	28%	0.281	C	S	.	.			trans	-118.1	124.9	-179.3	-61.6	-63	0	0	0	108.3	Y167 H223 V225 L230	Y167-I227 HydrophobicContact CD1-CD1 3.69Å; Y167-I227 HydrophobicContact CD2-CD1 3.5Å; Y167-I227 HydrophobicContact CE1-CD1 4.02Å; Y167-I227 HydrophobicContact CE2-CD1 3.87Å; Y167-I227 HydrophobicContact CG-CD1 3.39Å; H223-I227 HydrophobicContact CB-CG1 4.17Å; V225-I227 HydrophobicContact CG2-CD1 3.72Å; V225-I227 HydrophobicContact CG2-CG1 4.29Å; I227-L230 HydrophobicContact CB-CD1 3.7Å; I227-L230 HydrophobicContact CG1-CD1 4.25Å; I227-L230 HydrophobicContact CG2-CD1 3.58Å
228	E	90.8	Very high	92.8	Very high	159 Å²	159	51.1 Å²	51.1	74%	0.743	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	142.3	172.7	-173.3	178.6	-178.9	0	0	110.9	G170 L230	G170-E228 PolarHBondContact N-O 2.83Å; E228-L230 VanDerWaalsContact C-N 3.29Å; E228-L230 PolarHBondContact O-N 3.48Å
229	G	89.9	Confident	92.7	Very high	54 Å²	54	57 Å²	57	56%	0.557	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	23.3	173.3	0	0	0	0	0	114.8	G170 D231	G170-G229 WeakPolarHBondContact CA-O 3.38Å; G229-D231 PolarHBondContact O-N 3.25Å
230	L	88.5	Confident	92.7	Very high	35 Å²	35	62.3 Å²	62.3	18%	0.183	35%	0.345	C	S	.	.			trans	-58.8	132.2	176.7	-150.8	90.1	0	0	0	110.5	I227 E228 I232	I227-L230 HydrophobicContact CB-CD1 3.7Å; I227-L230 HydrophobicContact CG1-CD1 4.25Å; I227-L230 HydrophobicContact CG2-CD1 3.58Å; E228-L230 VanDerWaalsContact C-N 3.29Å; E228-L230 PolarHBondContact O-N 3.48Å; L230-I232 VanDerWaalsContact C-N 3.3Å; L230-I232 HydrophobicContact CD2-CD1 4.25Å; L230-I232 HydrophobicContact CD2-CG1 4.39Å; L230-I232 HydrophobicContact CD2-CG2 3.75Å; L230-I232 HydrophobicContact CG-CG2 4.48Å; L230-I232 PolarHBondContact O-N 3.49Å
231	D	91	Very high	92.8	Very high	56 Å²	56	62.8 Å²	62.8	30%	0.299	35%	0.347	S	S	.	.			trans	-82.8	75.3	-176.3	-168.3	-5.2	0	0	0	110.4	R218 G229 K311	R218-D231 IonicContact CZ-OD2 3.4Å; R218-D231 IonicContact NH2-OD2 2.84Å; R218-D231 PolarHBondContact NH2-OD2 2.97Å; G229-D231 PolarHBondContact O-N 3.25Å; D231-K311 IonicContact OD1-NZ 2.85Å; D231-K311 VanDerWaalsContact OD2-CD 3.23Å; D231-K311 WeakPolarHBondContact OD2-CD 3.39Å; D231-K311 WeakPolarHBondContact OD2-CE 3.35Å; D231-K311 IonicContact OD2-NZ 3.98Å; D231-K311 PolarHBondContact OD2-NZ 2.96Å
232	I	93.1	Very high	92.9	Very high	41 Å²	41	66.4 Å²	66.4	21%	0.21	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.6	175.7	57.8	171.9	0	0	0	109.3	L230 Y308 I309 L316	L230-I232 VanDerWaalsContact C-N 3.3Å; L230-I232 HydrophobicContact CD2-CD1 4.25Å; L230-I232 HydrophobicContact CD2-CG1 4.39Å; L230-I232 HydrophobicContact CD2-CG2 3.75Å; L230-I232 HydrophobicContact CG-CG2 4.48Å; L230-I232 PolarHBondContact O-N 3.49Å; I232-Y308 HydrophobicContact CD1-CD1 4.24Å; I232-Y308 HydrophobicContact CD1-CD2 4.33Å; I232-Y308 HydrophobicContact CD1-CG 3.98Å; I232-Y308 HydrophobicContact CG1-CD1 4.47Å; I232-I309 WeakPolarHBondContact CA-O 3.38Å; I232-L316 HydrophobicContact CG2-CD1 3.69Å
233	A	95.6	Very high	93.2	Very high	55 Å²	55	67.6 Å²	67.6	46%	0.455	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.1	-179.1	0	0	0	0	0	110.6	Y308 I309	A233-Y308 CarbonylContact O-C 3.49Å; A233-Y308 WeakPolarHBondContact O-CA 3.29Å; A233-Y308 WeakPolarHBondContact O-CB 3.44Å; A233-I309 HydrophobicContact CB-CG2 4.06Å; A233-I309 PolarHBondContact N-O 2.83Å; A233-I309 PolarHBondContact O-N 3.31Å
234	L	97.4	Very high	93.3	Very high	84 Å²	84	67.6 Å²	67.6	44%	0.44	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	137.6	173	-172.5	72.1	0	0	0	109.5	E236 K306 Y308	L234-E236 PolarHBondContact O-N 3.46Å; L234-K306 HydrophobicContact CD1-CB 4.01Å; L234-K306 HydrophobicContact CD1-CD 4.49Å; L234-K306 HydrophobicContact CD1-CG 4.25Å; L234-Y308 HydrophobicContact CB-CD1 4.26Å; L234-Y308 HydrophobicContact CB-CE1 4.36Å; L234-Y308 HydrophobicContact CD1-CD1 4.04Å; L234-Y308 HydrophobicContact CD1-CE1 3.7Å
235	I	97.8	Very high	93.6	Very high	8 Å²	8	65 Å²	65	4%	0.041	36%	0.363	C	S	.	.			trans	-81.2	105.4	172.2	-63	178.7	0	0	0	108.1	Y241 L297 I301 F307 I309 I315	I235-Y241 HydrophobicContact CB-CE2 4.35Å; I235-Y241 HydrophobicContact CD1-CD2 3.87Å; I235-Y241 HydrophobicContact CD1-CE2 3.79Å; I235-Y241 HydrophobicContact CD1-CG 4.42Å; I235-Y241 HydrophobicContact CG1-CD2 4.28Å; I235-Y241 HydrophobicContact CG1-CE2 3.81Å; I235-Y241 HydrophobicContact CG2-CD2 3.67Å; I235-Y241 HydrophobicContact CG2-CE2 3.71Å; I235-L297 HydrophobicContact CG2-CD2 4.46Å; I235-I301 HydrophobicContact CG2-CD1 4.21Å; I235-F307 HydrophobicContact CB-CB 4.45Å; I235-F307 HydrophobicContact CD1-CB 4.05Å; I235-F307 PolarHBondContact N-O 3.3Å; I235-I309 HydrophobicContact CD1-CB 4.38Å; I235-I309 HydrophobicContact CG1-CB 4.22Å; I235-I315 HydrophobicContact CD1-CD1 4.38Å; I235-I315 HydrophobicContact CD1-CG1 4.09Å; I235-I315 HydrophobicContact CD1-CG2 4Å
236	E	95	Very high	93.9	Very high	156 Å²	156	65.4 Å²	65.4	73%	0.729	36%	0.363	S	S	*	.	S	Bend	trans	-87.6	-34.7	178	-61.5	-174.2	147.9	0	0	112.2	L234 P238	L234-E236 PolarHBondContact O-N 3.46Å; E236-P238 WeakPolarHBondContact O-CD 3.14Å
237	N	96.2	Very high	94.1	Very high	96 Å²	96	60.1 Å²	60.1	51%	0.513	34%	0.335	S	S	.	.			trans	-112.2	94.4	179.8	-62.4	-45.2	0	0	0	109.9	E239 D240	N237-E239 PolarHBondContact O-N 3.04Å; N237-D240 WeakPolarHBondContact CB-OD2 3.37Å; N237-D240 WeakPolarHBondContact O-CB 3.43Å; N237-D240 PolarHBondContact O-N 3.15Å
238	P	95.7	Very high	94.3	Very high	23 Å²	23	59.5 Å²	59.5	15%	0.149	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-62	-23.4	-179.8	20.4	-30.5	0	0	0	114.1	E236 D240 Y241 L297 I298 I301	E236-P238 WeakPolarHBondContact O-CD 3.14Å; P238-D240 PolarHBondContact O-N 3.19Å; P238-Y241 CarbonylContact O-C 3.55Å; P238-Y241 PolarHBondContact O-N 3.42Å; P238-L297 HydrophobicContact CB-CD2 3.81Å; P238-L297 HydrophobicContact CB-CG 4.05Å; P238-I298 HydrophobicContact CB-CG1 3.76Å; P238-I298 HydrophobicContact CG-CG1 3.92Å; P238-I301 HydrophobicContact CB-CD1 4.08Å; P238-I301 HydrophobicContact CG-CD1 4.49Å
239	E	95.2	Very high	94.5	Very high	136 Å²	136	53.5 Å²	53.5	64%	0.636	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-63	-22.8	177.3	-60.7	-61.9	159.8	0	0	113.2	N237 Y241 I298	N237-E239 PolarHBondContact O-N 3.04Å; E239-Y241 PolarHBondContact O-N 3.36Å; E239-I298 WeakPolarHBondContact OE1-CD1 3.44Å
240	D	93.8	Very high	94.8	Very high	112 Å²	112	54.7 Å²	54.7	60%	0.599	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-67	-14	173.9	-65.5	-20.9	0	0	0	112	N237 P238	N237-D240 WeakPolarHBondContact CB-OD2 3.37Å; N237-D240 WeakPolarHBondContact O-CB 3.43Å; N237-D240 PolarHBondContact O-N 3.15Å; P238-D240 PolarHBondContact O-N 3.19Å
241	Y	94.4	Very high	95.1	Very high	43 Å²	43	61.4 Å²	61.4	17%	0.169	32%	0.315	C	S	.	.			trans	-128.3	67.8	-176.8	-55.8	-79.3	0	0	0	111.5	I235 P238 E239 T243 P273 I309 I315	I235-Y241 HydrophobicContact CB-CE2 4.35Å; I235-Y241 HydrophobicContact CD1-CD2 3.87Å; I235-Y241 HydrophobicContact CD1-CE2 3.79Å; I235-Y241 HydrophobicContact CD1-CG 4.42Å; I235-Y241 HydrophobicContact CG1-CD2 4.28Å; I235-Y241 HydrophobicContact CG1-CE2 3.81Å; I235-Y241 HydrophobicContact CG2-CD2 3.67Å; I235-Y241 HydrophobicContact CG2-CE2 3.71Å; P238-Y241 CarbonylContact O-C 3.55Å; P238-Y241 PolarHBondContact O-N 3.42Å; E239-Y241 PolarHBondContact O-N 3.36Å; Y241-T243 PolarHBondContact O-N 3.11Å; Y241-T243 VanDerWaalsContact O-N 3.1Å; Y241-P273 HydrophobicContact CD1-CB 4.18Å; Y241-I309 HydrophobicContact CE1-CD1 3.82Å; Y241-I309 HydrophobicContact CE1-CG1 4.22Å; Y241-I315 HydrophobicContact CD1-CD1 3.73Å; Y241-I315 HydrophobicContact CD1-CG1 4.39Å; Y241-I315 HydrophobicContact CE1-CD1 4.41Å; Y241-I315 HydrophobicContact CG-CD1 3.98Å
242	P	92.5	Very high	95.3	Very high	93 Å²	93	61.6 Å²	61.6	60%	0.604	32%	0.316	S	S	*	.	S	Bend	trans	-65.1	-19.9	-174	27.2	-36.4	0	0	0	113.9	R331	P242-R331 PolarHBondContact O-NH1 3.18Å
243	T	93.6	Very high	95.5	Very high	28 Å²	28	60.5 Å²	60.5	17%	0.172	31%	0.309	C	S	.	.			trans	-125.1	117.1	175.5	-64.2	0	0	0	0	109.5	Y241 I245 P273 Y294	Y241-T243 PolarHBondContact O-N 3.11Å; Y241-T243 VanDerWaalsContact O-N 3.1Å; T243-I245 HydrophobicContact CG2-CG2 3.7Å; T243-P273 CarbonylContact O-C 3.52Å; T243-P273 WeakPolarHBondContact O-CA 3.44Å; T243-Y294 HydrophobicContact CG2-CD1 4.24Å; T243-Y294 HydrophobicContact CG2-CE1 3.78Å
244	V	96.3	Very high	95.5	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.012	31%	0.313	C	S	.	.			trans	-125.2	121.4	170.6	-178.3	0	0	0	0	108.2	F271 A272 I295 L297 I315	V244-F271 HydrophobicContact CG1-CB 3.49Å; V244-F271 VanDerWaalsContact CG1-CB 3.49Å; V244-F271 HydrophobicContact CG1-CD1 4.1Å; V244-F271 HydrophobicContact CG1-CG 3.8Å; V244-A272 WeakPolarHBondContact CA-O 3.47Å; V244-I295 HydrophobicContact CB-CB 4.22Å; V244-I295 HydrophobicContact CG1-CB 4.16Å; V244-I295 HydrophobicContact CG1-CG1 4.33Å; V244-I295 PolarHBondContact O-N 2.98Å; V244-L297 HydrophobicContact CG2-CB 4.07Å; V244-L297 HydrophobicContact CG2-CD1 4.4Å; V244-L297 HydrophobicContact CG2-CD2 3.87Å; V244-L297 HydrophobicContact CG2-CG 4.33Å; V244-I315 HydrophobicContact CB-CD1 4.4Å; V244-I315 HydrophobicContact CG1-CD1 4.11Å; V244-I315 HydrophobicContact CG1-CG2 4.24Å; V244-I315 HydrophobicContact CG2-CD1 3.57Å
245	I	96.1	Very high	95.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150.6	-172.7	65.5	177.2	0	0	0	113.8	T243 F271 A272 G274 E275 M285 I292 I293 Y294	T243-I245 HydrophobicContact CG2-CG2 3.7Å; I245-F271 CarbonylContact O-C 3.59Å; I245-F271 WeakPolarHBondContact O-CA 3.45Å; I245-F271 WeakPolarHBondContact O-CB 3.26Å; I245-A272 HydrophobicContact CD1-CB 4.5Å; I245-A272 HydrophobicContact CG1-CB 3.92Å; I245-A272 PolarHBondContact N-O 3.09Å; I245-A272 PolarHBondContact O-N 3.14Å; I245-G274 VanDerWaalsContact CD1-C 3.4Å; I245-G274 WeakPolarHBondContact CD1-O 3.39Å; I245-E275 HydrophobicContact CD1-CB 4.17Å; I245-E275 HydrophobicContact CD1-CG 3.53Å; I245-M285 HydrophobicContact CB-SD 4.4Å; I245-M285 HydrophobicContact CD1-CE 3.34Å; I245-M285 HydrophobicContact CD1-CG 4.24Å; I245-M285 HydrophobicContact CD1-SD 3.62Å; I245-M285 HydrophobicContact CG1-CE 4.29Å; I245-M285 HydrophobicContact CG1-CG 4.33Å; I245-M285 HydrophobicContact CG1-SD 3.9Å; I245-I292 HydrophobicContact CB-CG2 3.93Å; I245-I292 HydrophobicContact CD1-CG2 3.99Å; I245-I292 HydrophobicContact CG2-CG2 4.02Å; I245-I293 CarbonylContact C-O 3.53Å; I245-I293 WeakPolarHBondContact CA-O 3.41Å; I245-Y294 HydrophobicContact CG2-CD1 3.56Å; I245-Y294 HydrophobicContact CG2-CD2 4.12Å; I245-Y294 HydrophobicContact CG2-CE1 3.68Å; I245-Y294 HydrophobicContact CG2-CE2 4.15Å; I245-Y294 HydrophobicContact CG2-CG 3.84Å
246	H	96.4	Very high	95.4	Very high	40 Å²	40	61.8 Å²	61.8	19%	0.185	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.7	171.1	-172.6	87.8	0	0	0	110.9	L261 H270 F271 I293	H246-L261 HydrophobicContact CB-CD1 3.7Å; H246-L261 HydrophobicContact CB-CD2 4.48Å; H246-L261 VanDerWaalsContact CD2-CD2 3.42Å; H246-L261 WeakPolarHBondContact CD2-CD2 3.42Å; H246-H270 PolarHBondContact ND1-O 3.29Å; H246-F271 HydrophobicContact CB-CD1 3.86Å; H246-F271 HydrophobicContact CB-CE1 4.11Å; H246-I293 HydrophobicContact CB-CB 4.4Å; H246-I293 PolarHBondContact N-O 3.43Å; H246-I293 PolarHBondContact O-N 2.89Å
247	G	95.3	Very high	95.5	Very high	22 Å²	22	56.6 Å²	56.6	23%	0.227	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.3	177.9	0	0	0	0	0	111.5	M285 I291	G247-M285 WeakPolarHBondContact CA-SD 3.33Å; G247-M285 PolarHBondContact N-SD 2.89Å; G247-I291 WeakPolarHBondContact CA-O 3.43Å
248	T	95.8	Very high	95.5	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	-173.6	179.6	-163.9	0	0	0	0	112.1	N252 I256 E290 I291 I293	T248-N252 PolarHBondContact OG1-ND2 3.06Å; T248-I256 HydrophobicContact CG2-CD1 3.78Å; T248-I256 WeakPolarHBondContact OG1-CD1 3.42Å; T248-E290 PolarHBondContact O-N 3.34Å; T248-I291 HydrophobicContact CG2-CB 3.81Å; T248-I291 HydrophobicContact CG2-CG2 4.02Å; T248-I291 PolarHBondContact N-O 3.47Å; T248-I291 PolarHBondContact O-N 3.44Å; T248-I293 HydrophobicContact CG2-CD1 3.98Å
249	Y	95.6	Very high	95.5	Very high	34 Å²	34	62.4 Å²	62.4	13%	0.133	31%	0.307	C	S	.	.			trans	-117.7	154.1	-178	-60.3	-82.8	0	0	0	110.4	R251 N252 W253 R286 S288 E290	Y249-R251 VanDerWaalsContact C-N 3.28Å; Y249-R251 PolarHBondContact O-N 3.35Å; Y249-N252 WeakPolarHBondContact O-CB 3.38Å; Y249-N252 PolarHBondContact O-N 3.48Å; Y249-W253 PolarHBondContact O-N 3.48Å; Y249-R286 WeakPolarHBondContact OH-CD 3.24Å; Y249-S288 WeakPolarHBondContact CE1-O 3.25Å; Y249-S288 PolarHBondContact OH-OG 3.18Å; Y249-E290 WeakPolarHBondContact CA-OE2 3.45Å; Y249-E290 VanDerWaalsContact CB-OE2 3.29Å; Y249-E290 WeakPolarHBondContact CB-OE2 3.48Å; Y249-E290 HydrophobicContact CD1-CG 4.19Å; Y249-E290 WeakPolarHBondContact CD1-OE2 3.35Å
250	F	95.9	Very high	95.6	Very high	79 Å²	79	56.1 Å²	56.1	35%	0.346	28%	0.278	S	S	.	.	H	α-helix	trans	-55.5	-41.6	-179.3	-88	-69.4	0	0	0	113	N252 W253 E290 I291 Q335	F250-N252 PolarHBondContact O-N 3.03Å; F250-W253 VanDerWaalsContact O-CB 3.31Å; F250-W253 WeakPolarHBondContact O-CB 3.41Å; F250-W253 PolarHBondContact O-N 3.1Å; F250-E290 HydrophobicContact CD2-CB 3.78Å; F250-E290 HydrophobicContact CD2-CG 4.34Å; F250-E290 HydrophobicContact CE2-CB 4.01Å; F250-E290 PolarHBondContact N-OE2 3.2Å; F250-I291 HydrophobicContact CD1-CD1 3.67Å; F250-I291 HydrophobicContact CD1-CG1 4.24Å; F250-I291 HydrophobicContact CE1-CD1 3.88Å; F250-I291 HydrophobicContact CE1-CG1 4.12Å; F250-I291 HydrophobicContact CG-CD1 4.13Å; F250-I291 HydrophobicContact CG-CG1 4.47Å; F250-I291 HydrophobicContact CZ-CG1 4.27Å; F250-Q335 HydrophobicContact CE2-CG 4.02Å; F250-Q335 HydrophobicContact CZ-CB 3.98Å; F250-Q335 HydrophobicContact CZ-CG 3.66Å
251	R	94.5	Very high	95.8	Very high	176 Å²	176	51 Å²	51	66%	0.664	25%	0.251	S	S	*	.	H	α-helix	trans	-57	-18.9	177.2	62.1	163.7	-178.3	-95.7	-12.9	115	Y249	Y249-R251 VanDerWaalsContact C-N 3.28Å; Y249-R251 PolarHBondContact O-N 3.35Å
252	N	95.2	Very high	96	Very high	60 Å²	60	53.1 Å²	53.1	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-100.3	-12.6	178.7	-58.9	-21.7	0	0	0	112.1	T248 Y249 F250 D254 S255 I256	T248-N252 PolarHBondContact OG1-ND2 3.06Å; Y249-N252 WeakPolarHBondContact O-CB 3.38Å; Y249-N252 PolarHBondContact O-N 3.48Å; F250-N252 PolarHBondContact O-N 3.03Å; N252-D254 PolarHBondContact O-N 3.04Å; N252-S255 PolarHBondContact O-N 3.28Å; N252-I256 HydrophobicContact CB-CD1 3.76Å; N252-I256 HydrophobicContact CB-CG1 4.48Å; N252-I256 VanDerWaalsContact O-CG1 3.28Å; N252-I256 WeakPolarHBondContact O-CG1 3.29Å; N252-I256 PolarHBondContact O-N 2.87Å
253	W	96.5	Very high	96.1	Very high	17 Å²	17	53.4 Å²	53.4	6%	0.064	25%	0.25	C	S	.	.	H	α-helix	trans	-64.6	-43.2	-165.9	-176.6	-128	0	0	0	112.9	Y249 F250 S255 I256 R257 I291 I293 A333 L342 S343 L344	Y249-W253 PolarHBondContact O-N 3.48Å; F250-W253 VanDerWaalsContact O-CB 3.31Å; F250-W253 WeakPolarHBondContact O-CB 3.41Å; F250-W253 PolarHBondContact O-N 3.1Å; W253-S255 PolarHBondContact O-N 3.25Å; W253-I256 HydrophobicContact CE3-CB 4.29Å; W253-I256 HydrophobicContact CE3-CG2 4.17Å; W253-I256 HydrophobicContact CZ3-CG2 3.97Å; W253-I256 PolarHBondContact O-N 3.11Å; W253-I256 VanDerWaalsContact O-N 3.17Å; W253-R257 HydrophobicContact CD2-CB 4.49Å; W253-R257 HydrophobicContact CH2-CB 4.25Å; W253-R257 HydrophobicContact CZ2-CB 4.12Å; W253-R257 WeakPolarHBondContact O-CG 3.43Å; W253-R257 PolarHBondContact O-N 3.32Å; W253-I291 HydrophobicContact CB-CD1 3.52Å; W253-I291 HydrophobicContact CD2-CD1 3.88Å; W253-I291 HydrophobicContact CE3-CD1 4.24Å; W253-I291 HydrophobicContact CE3-CG2 4.15Å; W253-I291 HydrophobicContact CG-CD1 3.55Å; W253-I291 HydrophobicContact CZ3-CG2 4.4Å; W253-I293 HydrophobicContact CE3-CD1 4.26Å; W253-I293 HydrophobicContact CH2-CG1 4.47Å; W253-I293 HydrophobicContact CZ3-CD1 3.68Å; W253-I293 HydrophobicContact CZ3-CG1 3.75Å; W253-A333 HydrophobicContact CH2-CB 3.25Å; W253-A333 HydrophobicContact CZ2-CB 3.67Å; W253-A333 HydrophobicContact CZ3-CB 4.01Å; W253-L342 HydrophobicContact CD2-CD1 4.43Å; W253-L342 HydrophobicContact CZ2-CB 3.94Å; W253-L342 HydrophobicContact CZ2-CD1 4.32Å; W253-S343 VanDerWaalsContact CZ2-O 3.31Å; W253-S343 WeakPolarHBondContact CZ2-O 3.49Å; W253-L344 HydrophobicContact CH2-CD2 4.02Å; W253-L344 HydrophobicContact CZ2-CD2 4.45Å
254	D	95.9	Very high	96.1	Very high	101 Å²	101	59 Å²	59	54%	0.54	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-41.7	-179.8	-73.9	-40.2	0	0	0	113	N252 R257 K258	N252-D254 PolarHBondContact O-N 3.04Å; D254-R257 IonicContact OD1-CZ 3.22Å; D254-R257 VanDerWaalsContact OD1-CZ 3.22Å; D254-R257 IonicContact OD1-NE 2.83Å; D254-R257 PolarHBondContact OD1-NE 3.25Å; D254-R257 IonicContact OD1-NH2 2.81Å; D254-R257 PolarHBondContact OD1-NH2 2.85Å; D254-K258 WeakPolarHBondContact O-CB 3.37Å; D254-K258 PolarHBondContact O-N 3.06Å
255	S	96.3	Very high	95.8	Very high	58 Å²	58	66.5 Å²	66.5	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-67.8	-43.5	174.2	177	0	0	0	0	110.9	N252 W253 R257 K258 E259	N252-S255 PolarHBondContact O-N 3.28Å; W253-S255 PolarHBondContact O-N 3.25Å; S255-R257 PolarHBondContact O-N 3.38Å; S255-K258 PolarHBondContact O-N 2.84Å; S255-E259 WeakPolarHBondContact O-CB 3.4Å; S255-E259 PolarHBondContact O-N 2.85Å; S255-E259 PolarHBondContact OG-OE1 3.5Å
256	I	97.6	Very high	95.6	Very high	16 Å²	16	70.4 Å²	70.4	8%	0.082	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-42.8	-179	-70.4	166.8	0	0	0	112.1	T248 N252 W253 K258 G260 L261 I293 T327 F330	T248-I256 HydrophobicContact CG2-CD1 3.78Å; T248-I256 WeakPolarHBondContact OG1-CD1 3.42Å; N252-I256 HydrophobicContact CB-CD1 3.76Å; N252-I256 HydrophobicContact CB-CG1 4.48Å; N252-I256 VanDerWaalsContact O-CG1 3.28Å; N252-I256 WeakPolarHBondContact O-CG1 3.29Å; N252-I256 PolarHBondContact O-N 2.87Å; W253-I256 HydrophobicContact CE3-CB 4.29Å; W253-I256 HydrophobicContact CE3-CG2 4.17Å; W253-I256 HydrophobicContact CZ3-CG2 3.97Å; W253-I256 PolarHBondContact O-N 3.11Å; W253-I256 VanDerWaalsContact O-N 3.17Å; I256-K258 PolarHBondContact O-N 2.91Å; I256-G260 VanDerWaalsContact O-CA 3.27Å; I256-G260 WeakPolarHBondContact O-CA 3.44Å; I256-G260 PolarHBondContact O-N 3.27Å; I256-L261 HydrophobicContact CD1-CD2 4.09Å; I256-L261 HydrophobicContact CG1-CD2 4.28Å; I256-L261 HydrophobicContact CG2-CD2 3.97Å; I256-L261 HydrophobicContact CG2-CG 4.26Å; I256-I293 HydrophobicContact CG2-CD1 3.62Å; I256-T327 VanDerWaalsContact O-CG2 3.25Å; I256-T327 WeakPolarHBondContact O-CG2 3.5Å; I256-F330 HydrophobicContact CG2-CE2 3.68Å; I256-F330 HydrophobicContact CG2-CZ 3.88Å
257	R	96.5	Very high	95.4	Very high	47 Å²	47	69.7 Å²	69.7	18%	0.177	32%	0.324	C	S	.	.	H	α-helix	trans	-73.7	-15.2	178.9	76.1	-170.5	178.1	116.2	6	113.5	W253 D254 S255 T345 P346	W253-R257 HydrophobicContact CD2-CB 4.49Å; W253-R257 HydrophobicContact CH2-CB 4.25Å; W253-R257 HydrophobicContact CZ2-CB 4.12Å; W253-R257 WeakPolarHBondContact O-CG 3.43Å; W253-R257 PolarHBondContact O-N 3.32Å; D254-R257 IonicContact OD1-CZ 3.22Å; D254-R257 VanDerWaalsContact OD1-CZ 3.22Å; D254-R257 IonicContact OD1-NE 2.83Å; D254-R257 PolarHBondContact OD1-NE 3.25Å; D254-R257 IonicContact OD1-NH2 2.81Å; D254-R257 PolarHBondContact OD1-NH2 2.85Å; S255-R257 PolarHBondContact O-N 3.38Å; R257-T345 PolarHBondContact NH1-O 2.94Å; R257-P346 HydrophobicContact CG-CG 4.33Å; R257-P346 VanDerWaalsContact CZ-OXT 3.25Å; R257-P346 PolarHBondContact NH1-OXT 3.07Å; R257-P346 PolarHBondContact NH2-OXT 3.46Å; R257-P346 VanDerWaalsContact NH2-OXT 3.16Å; R257-P346 WeakPolarHBondContact O-CD 3.27Å
258	K	96.4	Very high	95.4	Very high	156 Å²	156	69.3 Å²	69.3	68%	0.678	32%	0.316	S	S	*	.	H	α-helix	trans	-92	-39.7	173.7	-173.1	177.6	-179.6	-179.8	0	112.7	D254 S255 I256 P346	D254-K258 WeakPolarHBondContact O-CB 3.37Å; D254-K258 PolarHBondContact O-N 3.06Å; S255-K258 PolarHBondContact O-N 2.84Å; I256-K258 PolarHBondContact O-N 2.91Å; K258-P346 HydrophobicContact CB-CG 4.11Å; K258-P346 HydrophobicContact CG-CG 4.45Å
259	E	95.6	Very high	95.5	Very high	85 Å²	85	69.1 Å²	69.1	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-114.8	-19.6	-166	-60.9	171.6	-131.7	0	0	114.1	S255 K262 C324	S255-E259 WeakPolarHBondContact O-CB 3.4Å; S255-E259 PolarHBondContact O-N 2.85Å; S255-E259 PolarHBondContact OG-OE1 3.5Å; E259-K262 WeakPolarHBondContact OE2-CE 3.5Å; E259-K262 IonicContact OE2-NZ 2.61Å; E259-K262 PolarHBondContact OE2-NZ 3.33Å; E259-C324 PolarHBondContact O-SG 3.48Å
260	G	97.5	Very high	95.5	Very high	3 Å²	3	68.8 Å²	68.8	3%	0.031	32%	0.315	C	S	.	.			trans	96.3	-173.8	-170.9	0	0	0	0	0	113.7	I256 L325	I256-G260 VanDerWaalsContact O-CA 3.27Å; I256-G260 WeakPolarHBondContact O-CA 3.44Å; I256-G260 PolarHBondContact O-N 3.27Å; G260-L325 CarbonylContact C-O 3.52Å; G260-L325 VanDerWaalsContact CA-O 3.29Å; G260-L325 WeakPolarHBondContact CA-O 3.37Å
261	L	98.2	Very high	95.5	Very high	4 Å²	4	65.2 Å²	65.2	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	121.4	176.4	-77.2	169.4	0	0	0	110.1	H246 I256 I269 F271 I293 I295 C324 L325 F330	H246-L261 HydrophobicContact CB-CD1 3.7Å; H246-L261 HydrophobicContact CB-CD2 4.48Å; H246-L261 VanDerWaalsContact CD2-CD2 3.42Å; H246-L261 WeakPolarHBondContact CD2-CD2 3.42Å; I256-L261 HydrophobicContact CD1-CD2 4.09Å; I256-L261 HydrophobicContact CG1-CD2 4.28Å; I256-L261 HydrophobicContact CG2-CD2 3.97Å; I256-L261 HydrophobicContact CG2-CG 4.26Å; L261-I269 HydrophobicContact CB-CD1 4.41Å; L261-I269 HydrophobicContact CB-CG2 4.13Å; L261-I269 WeakPolarHBondContact O-CD1 3.3Å; L261-F271 HydrophobicContact CD1-CE1 3.72Å; L261-F271 HydrophobicContact CD1-CZ 4.39Å; L261-I293 HydrophobicContact CD1-CD1 4.41Å; L261-I293 HydrophobicContact CD2-CD1 3.99Å; L261-I293 HydrophobicContact CG-CD1 4.4Å; L261-I295 HydrophobicContact CD1-CD1 3.93Å; L261-C324 CarbonylContact O-C 3.56Å; L261-C324 WeakPolarHBondContact O-CA 3.19Å; L261-L325 HydrophobicContact CB-CB 4.49Å; L261-L325 PolarHBondContact N-O 3.39Å; L261-L325 PolarHBondContact O-N 2.96Å; L261-F330 HydrophobicContact CB-CE1 4.46Å; L261-F330 HydrophobicContact CB-CZ 4.37Å; L261-F330 HydrophobicContact CD1-CE1 3.86Å; L261-F330 HydrophobicContact CD1-CZ 4.08Å; L261-F330 HydrophobicContact CG-CE1 3.92Å; L261-F330 HydrophobicContact CG-CZ 3.69Å
262	K	97.5	Very high	95.4	Very high	89 Å²	89	57 Å²	57	39%	0.387	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145.7	177.6	-68.2	176.5	174.1	175.6	0	111.4	E259 M264 G323 C324	E259-K262 WeakPolarHBondContact OE2-CE 3.5Å; E259-K262 IonicContact OE2-NZ 2.61Å; E259-K262 PolarHBondContact OE2-NZ 3.33Å; K262-M264 HydrophobicContact CB-SD 3.85Å; K262-M264 PolarHBondContact O-N 3.31Å; K262-M264 VanDerWaalsContact O-N 3.16Å; K262-G323 CarbonylContact C-O 3.47Å; K262-G323 WeakPolarHBondContact CA-O 3.48Å; K262-C324 HydrophobicContact CG-CB 4.02Å
263	R	95.2	Very high	95.3	Very high	99 Å²	99	55.1 Å²	55.1	37%	0.374	26%	0.26	S	S	.	.			trans	-63.7	-15.5	170.4	67.9	-175.1	179.2	104.5	-9.7	112.8	Q265 R266 T267 I269 G323	R263-Q265 PolarHBondContact O-N 3.46Å; R263-R266 WeakPolarHBondContact CB-O 3.2Å; R263-R266 VanDerWaalsContact CD-O 3.26Å; R263-R266 WeakPolarHBondContact CD-O 3.5Å; R263-R266 VanDerWaalsContact CG-O 3.26Å; R263-R266 WeakPolarHBondContact CG-O 3.33Å; R263-R266 PolarHBondContact NH1-O 3.32Å; R263-R266 WeakPolarHBondContact O-CB 3.43Å; R263-R266 PolarHBondContact O-N 3.27Å; R263-T267 WeakPolarHBondContact CD-O 3.47Å; R263-I269 HydrophobicContact CB-CG1 4.06Å; R263-G323 PolarHBondContact N-O 2.84Å
264	M	92.8	Very high	95	Very high	144 Å²	144	54.3 Å²	54.3	71%	0.709	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-124.8	-174.5	-55.4	-58.4	-66.4	0	0	109.6	K262 R266	K262-M264 HydrophobicContact CB-SD 3.85Å; K262-M264 PolarHBondContact O-N 3.31Å; K262-M264 VanDerWaalsContact O-N 3.16Å; M264-R266 VanDerWaalsContact C-N 3.32Å
265	Q	90	Very high	94.4	Very high	160 Å²	160	51.1 Å²	51.1	75%	0.748	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.4	177.5	-60.5	-59.4	-25.7	0	0	113.5	T224 R263	T224-Q265 WeakPolarHBondContact CB-O 3.42Å; T224-Q265 HydrophobicContact CG2-CB 4.39Å; T224-Q265 WeakPolarHBondContact CG2-O 3.49Å; R263-Q265 PolarHBondContact O-N 3.46Å
266	R	92.3	Very high	93.3	Very high	83 Å²	83	52.1 Å²	52.1	31%	0.313	24%	0.242	S	C	.	.	S	Bend	trans	-83.4	165.5	-179.8	-60.2	-177.9	176.4	-170.3	-3.2	110.7	T224 R263 M264 H268 H270	T224-R266 HydrophobicContact CG2-CG 4.48Å; R263-R266 WeakPolarHBondContact CB-O 3.2Å; R263-R266 VanDerWaalsContact CD-O 3.26Å; R263-R266 WeakPolarHBondContact CD-O 3.5Å; R263-R266 VanDerWaalsContact CG-O 3.26Å; R263-R266 WeakPolarHBondContact CG-O 3.33Å; R263-R266 PolarHBondContact NH1-O 3.32Å; R263-R266 WeakPolarHBondContact O-CB 3.43Å; R263-R266 PolarHBondContact O-N 3.27Å; M264-R266 VanDerWaalsContact C-N 3.32Å; R266-H268 VanDerWaalsContact C-N 3.32Å; R266-H268 WeakPolarHBondContact CB-O 3.39Å; R266-H270 PolarHBondContact NH1-ND1 2.89Å
267	T	92.9	Very high	91.9	Very high	24 Å²	24	55 Å²	55	15%	0.147	28%	0.276	C	S	.	.	S	Bend	trans	-72.3	-27.6	171.5	53.9	0	0	0	0	112.7	H223 V225 R263	H223-T267 PolarHBondContact O-N 3.39Å; V225-T267 WeakPolarHBondContact O-CG2 3.48Å; R263-T267 WeakPolarHBondContact CD-O 3.47Å
268	H	95.7	Very high	90.8	Very high	14 Å²	14	56.9 Å²	56.9	7%	0.065	29%	0.287	C	S	.	.	S	Bend	trans	-138.1	153.1	-176.6	-59.5	75.4	0	0	0	111.8	R266 H270 L316 C317 E318	R266-H268 VanDerWaalsContact C-N 3.32Å; R266-H268 WeakPolarHBondContact CB-O 3.39Å; H268-H270 PolarHBondContact O-CE1 2.93Å; H268-H270 VanDerWaalsContact O-CE1 3.29Å; H268-H270 PolarHBondContact O-ND1 2.81Å; H268-L316 HydrophobicContact CB-CB 4Å; H268-L316 HydrophobicContact CB-CD2 4.16Å; H268-C317 CarbonylContact C-O 2.93Å; H268-C317 WeakPolarHBondContact CA-O 3.43Å; H268-E318 IonicContact NE2-OE1 3.85Å
269	I	96.8	Very high	89.4	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	133.2	158.9	-50.5	159.6	0	0	0	107.6	L261 R263 F271 L316 C317 L325	L261-I269 HydrophobicContact CB-CD1 4.41Å; L261-I269 HydrophobicContact CB-CG2 4.13Å; L261-I269 WeakPolarHBondContact O-CD1 3.3Å; R263-I269 HydrophobicContact CB-CG1 4.06Å; I269-F271 HydrophobicContact CB-CE2 3.78Å; I269-F271 HydrophobicContact CB-CZ 3.85Å; I269-F271 HydrophobicContact CG2-CD2 4.44Å; I269-F271 HydrophobicContact CG2-CE1 3.85Å; I269-F271 HydrophobicContact CG2-CE2 3.62Å; I269-F271 HydrophobicContact CG2-CZ 3.27Å; I269-L316 WeakPolarHBondContact O-CA 3.18Å; I269-C317 PolarHBondContact N-O 3.14Å; I269-C317 PolarHBondContact O-N 2.91Å; I269-C317 VanDerWaalsContact O-N 3.08Å; I269-L325 HydrophobicContact CD1-CB 3.61Å
270	H	95.1	Very high	87.9	Confident	26 Å²	26	54.8 Å²	54.8	12%	0.12	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	133	-179.1	-66.2	77.9	0	0	0	111.1	Q221 H246 R266 H268 V314 L316	Q221-H270 PolarHBondContact OE1-CD2 3.14Å; Q221-H270 VanDerWaalsContact OE1-CD2 3.25Å; Q221-H270 PolarHBondContact OE1-NE2 3.26Å; Q221-H270 VanDerWaalsContact OE1-NE2 3.08Å; H246-H270 PolarHBondContact ND1-O 3.29Å; R266-H270 PolarHBondContact NH1-ND1 2.89Å; H268-H270 PolarHBondContact O-CE1 2.93Å; H268-H270 VanDerWaalsContact O-CE1 3.29Å; H268-H270 PolarHBondContact O-ND1 2.81Å; H270-V314 HydrophobicContact CB-CG1 4.37Å; H270-L316 WeakPolarHBondContact CD2-CD2 3.31Å; H270-L316 VanDerWaalsContact NE2-CD2 3.26Å; H270-L316 WeakPolarHBondContact NE2-CD2 3.46Å
271	F	96	Very high	86.6	Confident	5 Å²	5	56 Å²	56	2%	0.022	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152.6	174.9	-50.1	-88.8	0	0	0	110.6	V244 I245 H246 L261 I269 I295 F307 V314 I315 C317 L325	V244-F271 HydrophobicContact CG1-CB 3.49Å; V244-F271 VanDerWaalsContact CG1-CB 3.49Å; V244-F271 HydrophobicContact CG1-CD1 4.1Å; V244-F271 HydrophobicContact CG1-CG 3.8Å; I245-F271 CarbonylContact O-C 3.59Å; I245-F271 WeakPolarHBondContact O-CA 3.45Å; I245-F271 WeakPolarHBondContact O-CB 3.26Å; H246-F271 HydrophobicContact CB-CD1 3.86Å; H246-F271 HydrophobicContact CB-CE1 4.11Å; L261-F271 HydrophobicContact CD1-CE1 3.72Å; L261-F271 HydrophobicContact CD1-CZ 4.39Å; I269-F271 HydrophobicContact CB-CE2 3.78Å; I269-F271 HydrophobicContact CB-CZ 3.85Å; I269-F271 HydrophobicContact CG2-CD2 4.44Å; I269-F271 HydrophobicContact CG2-CE1 3.85Å; I269-F271 HydrophobicContact CG2-CE2 3.62Å; I269-F271 HydrophobicContact CG2-CZ 3.27Å; F271-I295 HydrophobicContact CD1-CD1 4.41Å; F271-I295 HydrophobicContact CD1-CG1 3.69Å; F271-I295 HydrophobicContact CE1-CD1 3.83Å; F271-I295 HydrophobicContact CE1-CG1 3.52Å; F271-I295 HydrophobicContact CZ-CG1 4.45Å; F271-F307 HydrophobicContact CD2-CE1 4.15Å; F271-F307 HydrophobicContact CE2-CD1 4.4Å; F271-F307 AromaticContact CE2-CE1 3.75Å; F271-F307 HydrophobicContact CE2-CE1 3.75Å; F271-F307 HydrophobicContact CZ-CE1 4.25Å; F271-V314 WeakPolarHBondContact O-CG1 3.34Å; F271-I315 HydrophobicContact CB-CB 4.04Å; F271-I315 HydrophobicContact CB-CG2 4.28Å; F271-I315 HydrophobicContact CD2-CG2 4.19Å; F271-I315 PolarHBondContact N-O 3.34Å; F271-I315 PolarHBondContact O-N 3.28Å; F271-C317 HydrophobicContact CE2-CB 3.8Å; F271-L325 HydrophobicContact CE1-CD2 4.23Å; F271-L325 HydrophobicContact CZ-CD2 3.73Å
272	A	93.6	Very high	84.9	Confident	3 Å²	3	58.9 Å²	58.9	3%	0.025	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-97.2	145	168.1	0	0	0	0	0	109.5	V244 I245 G274 M285	V244-A272 WeakPolarHBondContact CA-O 3.47Å; I245-A272 HydrophobicContact CD1-CB 4.5Å; I245-A272 HydrophobicContact CG1-CB 3.92Å; I245-A272 PolarHBondContact N-O 3.09Å; I245-A272 PolarHBondContact O-N 3.14Å; A272-G274 WeakPolarHBondContact CB-O 3.5Å; A272-G274 PolarHBondContact O-N 2.95Å; A272-G274 VanDerWaalsContact O-N 3.15Å; A272-M285 HydrophobicContact CB-CG 4.44Å
273	P	92.8	Very high	83.2	Confident	21 Å²	21	55.2 Å²	55.2	14%	0.136	31%	0.309	C	S	.	.	S	Bend	trans	-79.3	18.2	176.9	34.4	-36.7	0	0	0	113.1	Y241 T243 N313 I315	Y241-P273 HydrophobicContact CD1-CB 4.18Å; T243-P273 CarbonylContact O-C 3.52Å; T243-P273 WeakPolarHBondContact O-CA 3.44Å; P273-N313 VanDerWaalsContact CD-O 3.24Å; P273-N313 WeakPolarHBondContact CD-O 3.29Å; P273-N313 WeakPolarHBondContact CG-O 3.46Å; P273-I315 HydrophobicContact CB-CD1 3.92Å; P273-I315 HydrophobicContact CB-CG1 4.5Å
274	G	89.8	Confident	82.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	166.3	165.7	-173.9	0	0	0	0	0	112.7	I245 A272 E278	I245-G274 VanDerWaalsContact CD1-C 3.4Å; I245-G274 WeakPolarHBondContact CD1-O 3.39Å; A272-G274 WeakPolarHBondContact CB-O 3.5Å; A272-G274 PolarHBondContact O-N 2.95Å; A272-G274 VanDerWaalsContact O-N 3.15Å; G274-E278 WeakPolarHBondContact CA-OE2 3.4Å
275	E	83	Confident	81.6	Confident	33 Å²	33	45.3 Å²	45.3	15%	0.154	27%	0.27	C	S	.	.			trans	-73.6	160.1	174.5	-71.4	-163.5	-153.2	0	0	112.2	I245 G277 E278 I292 Y294 R339	I245-E275 HydrophobicContact CD1-CB 4.17Å; I245-E275 HydrophobicContact CD1-CG 3.53Å; E275-G277 PolarHBondContact O-N 2.73Å; E275-E278 HydrophobicContact CB-CG 4.43Å; E275-E278 PolarHBondContact N-OE2 2.6Å; E275-E278 WeakPolarHBondContact O-CB 3.41Å; E275-E278 PolarHBondContact O-N 2.82Å; E275-E278 VanDerWaalsContact O-N 3.17Å; E275-I292 HydrophobicContact CG-CD1 4.33Å; E275-I292 WeakPolarHBondContact OE2-CD1 3.4Å; E275-Y294 PolarHBondContact OE1-OH 3.3Å; E275-R339 IonicContact OE1-CZ 3.24Å; E275-R339 VanDerWaalsContact OE1-CZ 3.24Å; E275-R339 IonicContact OE1-NH1 2.71Å; E275-R339 PolarHBondContact OE1-NH1 3.32Å; E275-R339 IonicContact OE1-NH2 2.88Å; E275-R339 PolarHBondContact OE1-NH2 2.95Å; E275-R339 IonicContact OE2-NH1 3.21Å; E275-R339 PolarHBondContact OE2-NH1 2.62Å
276	V	73.1	Confident	81.3	Confident	79 Å²	79	44.7 Å²	44.7	48%	0.479	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	122.1	179.8	179.5	0	0	0	0	109.4
277	G	69.1	Low	80.8	Confident	78 Å²	78	45.5 Å²	45.5	80%	0.804	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	106	-14.2	-178.9	0	0	0	0	0	113.9	E275	E275-G277 PolarHBondContact O-N 2.73Å
278	E	73.5	Confident	80.5	Confident	86 Å²	86	47.6 Å²	47.6	40%	0.402	30%	0.295	S	S	.	.	S	Bend	trans	-70.7	146.5	172	-67.7	176.5	-179.3	0	0	111.2	G274 E275 G280 V281	G274-E278 WeakPolarHBondContact CA-OE2 3.4Å; E275-E278 HydrophobicContact CB-CG 4.43Å; E275-E278 PolarHBondContact N-OE2 2.6Å; E275-E278 WeakPolarHBondContact O-CB 3.41Å; E275-E278 PolarHBondContact O-N 2.82Å; E275-E278 VanDerWaalsContact O-N 3.17Å; E278-G280 PolarHBondContact O-N 2.9Å; E278-V281 HydrophobicContact CB-CG2 4.01Å; E278-V281 PolarHBondContact O-N 2.73Å
279	T	67	Low	80.3	Confident	150 Å²	150	47.2 Å²	47.2	92%	0.92	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	131.1	-178.7	-50.1	0	0	0	0	110.9
280	G	64.8	Low	80.2	Confident	47 Å²	47	50.8 Å²	50.8	49%	0.485	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-8.3	177.8	0	0	0	0	0	115.4	E278 I282 N313	E278-G280 PolarHBondContact O-N 2.9Å; G280-I282 PolarHBondContact O-N 3.34Å; G280-I282 VanDerWaalsContact O-N 3.07Å; G280-N313 PolarHBondContact O-ND2 3.43Å
281	V	68.7	Low	80.3	Confident	28 Å²	28	49.5 Å²	49.5	17%	0.17	31%	0.305	C	S	.	.			trans	-80.1	91.4	176	-176.1	0	0	0	0	110.3	E278	E278-V281 HydrophobicContact CB-CG2 4.01Å; E278-V281 PolarHBondContact O-N 2.73Å
282	I	62.4	Low	80.3	Confident	65 Å²	65	49.3 Å²	49.3	33%	0.333	30%	0.304	S	S	.	.	S	Bend	trans	-74.4	-54.8	175.7	-56.2	173.8	0	0	0	110	D200 K202 G280 N313	D200-I282 WeakPolarHBondContact O-CG2 3.38Å; K202-I282 HydrophobicContact CB-CG2 4.43Å; K202-I282 HydrophobicContact CD-CD1 4.44Å; K202-I282 HydrophobicContact CD-CG2 4.19Å; K202-I282 HydrophobicContact CG-CG2 4.07Å; G280-I282 PolarHBondContact O-N 3.34Å; G280-I282 VanDerWaalsContact O-N 3.07Å; I282-N313 HydrophobicContact CD1-CB 4.42Å
283	S	62.5	Low	80.4	Confident	11 Å²	11	49.1 Å²	49.1	8%	0.077	30%	0.303	C	S	.	.	S	Bend	trans	-111.2	85.9	179.2	175.1	0	0	0	0	110.3
284	G	72.9	Confident	80.7	Confident	16 Å²	16	49.2 Å²	49.2	17%	0.165	30%	0.301	C	S	.	.			trans	-77.4	-175.8	171.4	0	0	0	0	0	114.2
285	M	82	Confident	81.1	Confident	19 Å²	19	49.4 Å²	49.4	9%	0.094	30%	0.302	C	S	.	.			trans	-58.1	162.2	170.2	-60.3	176.8	-59.7	0	0	111.2	I245 G247 A272 S287 A289 I292	I245-M285 HydrophobicContact CB-SD 4.4Å; I245-M285 HydrophobicContact CD1-CE 3.34Å; I245-M285 HydrophobicContact CD1-CG 4.24Å; I245-M285 HydrophobicContact CD1-SD 3.62Å; I245-M285 HydrophobicContact CG1-CE 4.29Å; I245-M285 HydrophobicContact CG1-CG 4.33Å; I245-M285 HydrophobicContact CG1-SD 3.9Å; G247-M285 WeakPolarHBondContact CA-SD 3.33Å; G247-M285 PolarHBondContact N-SD 2.89Å; A272-M285 HydrophobicContact CB-CG 4.44Å; M285-S287 PolarHBondContact O-N 2.98Å; M285-A289 HydrophobicContact CB-CB 4.44Å; M285-I292 HydrophobicContact CE-CB 4.32Å; M285-I292 HydrophobicContact CE-CD1 3.66Å; M285-I292 HydrophobicContact CE-CG1 3.58Å; M285-I292 HydrophobicContact CE-CG2 3.92Å; M285-I292 HydrophobicContact SD-CB 4.4Å; M285-I292 HydrophobicContact SD-CG1 4.07Å; M285-I292 HydrophobicContact SD-CG2 3.95Å
286	R	83.6	Confident	81.8	Confident	147 Å²	147	50.5 Å²	50.5	56%	0.555	31%	0.308	S	S	*	.			trans	-60.7	138.4	170	-70.9	-178.5	-179.5	154.5	1.1	109	Y249 S288 A289	Y249-R286 WeakPolarHBondContact OH-CD 3.24Å; R286-S288 PolarHBondContact O-N 3.45Å; R286-S288 VanDerWaalsContact O-N 3.1Å; R286-A289 VanDerWaalsContact O-CB 3.25Å; R286-A289 WeakPolarHBondContact O-CB 3.36Å; R286-A289 PolarHBondContact O-N 3.38Å
287	S	81.4	Confident	83	Confident	101 Å²	101	47 Å²	47	71%	0.706	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.8	174.7	53	0	0	0	0	112.9	M285 R336	M285-S287 PolarHBondContact O-N 2.98Å; S287-R336 PolarHBondContact O-NH1 2.98Å
288	S	86.4	Confident	84.3	Confident	67 Å²	67	46.4 Å²	46.4	47%	0.469	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	0.3	173.9	58.4	0	0	0	0	114.8	Y249 R286 E290	Y249-S288 WeakPolarHBondContact CE1-O 3.25Å; Y249-S288 PolarHBondContact OH-OG 3.18Å; R286-S288 PolarHBondContact O-N 3.45Å; R286-S288 VanDerWaalsContact O-N 3.1Å; S288-E290 PolarHBondContact O-N 3.03Å
289	A	92.2	Very high	85.5	Confident	6 Å²	6	46 Å²	46	5%	0.05	26%	0.262	C	S	.	.			trans	-62.6	133.5	174.6	0	0	0	0	0	110.1	M285 R286 R336	M285-A289 HydrophobicContact CB-CB 4.44Å; R286-A289 VanDerWaalsContact O-CB 3.25Å; R286-A289 WeakPolarHBondContact O-CB 3.36Å; R286-A289 PolarHBondContact O-N 3.38Å; A289-R336 WeakPolarHBondContact O-CD 3.32Å
290	E	94.4	Very high	87	Confident	78 Å²	78	38.9 Å²	38.9	36%	0.364	22%	0.218	S	C	.	.			trans	-97.9	-27.7	-175.5	-60.2	169.4	118.3	0	0	111.4	T248 Y249 F250 S288 Q335 R336	T248-E290 PolarHBondContact O-N 3.34Å; Y249-E290 WeakPolarHBondContact CA-OE2 3.45Å; Y249-E290 VanDerWaalsContact CB-OE2 3.29Å; Y249-E290 WeakPolarHBondContact CB-OE2 3.48Å; Y249-E290 HydrophobicContact CD1-CG 4.19Å; Y249-E290 WeakPolarHBondContact CD1-OE2 3.35Å; F250-E290 HydrophobicContact CD2-CB 3.78Å; F250-E290 HydrophobicContact CD2-CG 4.34Å; F250-E290 HydrophobicContact CE2-CB 4.01Å; F250-E290 PolarHBondContact N-OE2 3.2Å; S288-E290 PolarHBondContact O-N 3.03Å; E290-Q335 CarbonylContact O-C 3.52Å; E290-Q335 WeakPolarHBondContact O-CA 3.44Å; E290-R336 WeakPolarHBondContact O-CB 3.48Å; E290-R336 PolarHBondContact O-N 3.38Å
291	I	96.4	Very high	88.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.9	-179.3	-62.2	175.2	0	0	0	109.6	G247 T248 F250 W253 I293 Y334 L342	G247-I291 WeakPolarHBondContact CA-O 3.43Å; T248-I291 HydrophobicContact CG2-CB 3.81Å; T248-I291 HydrophobicContact CG2-CG2 4.02Å; T248-I291 PolarHBondContact N-O 3.47Å; T248-I291 PolarHBondContact O-N 3.44Å; F250-I291 HydrophobicContact CD1-CD1 3.67Å; F250-I291 HydrophobicContact CD1-CG1 4.24Å; F250-I291 HydrophobicContact CE1-CD1 3.88Å; F250-I291 HydrophobicContact CE1-CG1 4.12Å; F250-I291 HydrophobicContact CG-CD1 4.13Å; F250-I291 HydrophobicContact CG-CG1 4.47Å; F250-I291 HydrophobicContact CZ-CG1 4.27Å; W253-I291 HydrophobicContact CB-CD1 3.52Å; W253-I291 HydrophobicContact CD2-CD1 3.88Å; W253-I291 HydrophobicContact CE3-CD1 4.24Å; W253-I291 HydrophobicContact CE3-CG2 4.15Å; W253-I291 HydrophobicContact CG-CD1 3.55Å; W253-I291 HydrophobicContact CZ3-CG2 4.4Å; I291-I293 HydrophobicContact CG2-CG1 4.12Å; I291-Y334 CarbonylContact C-O 3.57Å; I291-Y334 VanDerWaalsContact CA-O 3.29Å; I291-Y334 WeakPolarHBondContact CA-O 3.41Å; I291-L342 HydrophobicContact CD1-CD1 3.8Å; I291-L342 HydrophobicContact CG1-CD1 3.87Å; I291-L342 HydrophobicContact CG2-CD1 3.92Å
292	I	96	Very high	90	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	119.4	174.8	-53.7	175.8	0	0	0	108	I245 E275 M285 Y294 A333 Y334 R336	I245-I292 HydrophobicContact CB-CG2 3.93Å; I245-I292 HydrophobicContact CD1-CG2 3.99Å; I245-I292 HydrophobicContact CG2-CG2 4.02Å; E275-I292 HydrophobicContact CG-CD1 4.33Å; E275-I292 WeakPolarHBondContact OE2-CD1 3.4Å; M285-I292 HydrophobicContact CE-CB 4.32Å; M285-I292 HydrophobicContact CE-CD1 3.66Å; M285-I292 HydrophobicContact CE-CG1 3.58Å; M285-I292 HydrophobicContact CE-CG2 3.92Å; M285-I292 HydrophobicContact SD-CB 4.4Å; M285-I292 HydrophobicContact SD-CG1 4.07Å; M285-I292 HydrophobicContact SD-CG2 3.95Å; I292-Y294 HydrophobicContact CG2-CD2 4.12Å; I292-Y294 HydrophobicContact CG2-CE2 3.75Å; I292-A333 CarbonylContact O-C 3.53Å; I292-A333 VanDerWaalsContact O-CA 3.28Å; I292-A333 WeakPolarHBondContact O-CA 3.3Å; I292-Y334 PolarHBondContact N-O 2.77Å; I292-Y334 PolarHBondContact O-N 3.35Å; I292-R336 HydrophobicContact CD1-CB 4.19Å; I292-R336 HydrophobicContact CD1-CG 3.87Å; I292-R336 HydrophobicContact CG1-CB 4.35Å; I292-R336 HydrophobicContact CG1-CG 4.48Å
293	I	97.4	Very high	91.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.4	176.6	-55.6	166.3	0	0	0	107.5	I245 H246 T248 W253 I256 L261 I291 I295 F330 A333	I245-I293 CarbonylContact C-O 3.53Å; I245-I293 WeakPolarHBondContact CA-O 3.41Å; H246-I293 HydrophobicContact CB-CB 4.4Å; H246-I293 PolarHBondContact N-O 3.43Å; H246-I293 PolarHBondContact O-N 2.89Å; T248-I293 HydrophobicContact CG2-CD1 3.98Å; W253-I293 HydrophobicContact CE3-CD1 4.26Å; W253-I293 HydrophobicContact CH2-CG1 4.47Å; W253-I293 HydrophobicContact CZ3-CD1 3.68Å; W253-I293 HydrophobicContact CZ3-CG1 3.75Å; I256-I293 HydrophobicContact CG2-CD1 3.62Å; L261-I293 HydrophobicContact CD1-CD1 4.41Å; L261-I293 HydrophobicContact CD2-CD1 3.99Å; L261-I293 HydrophobicContact CG-CD1 4.4Å; I291-I293 HydrophobicContact CG2-CG1 4.12Å; I293-I295 HydrophobicContact CG2-CD1 4.01Å; I293-F330 HydrophobicContact CG2-CB 4.25Å; I293-F330 HydrophobicContact CG2-CD1 3.87Å; I293-F330 HydrophobicContact CG2-CD2 3.76Å; I293-F330 HydrophobicContact CG2-CE1 4.19Å; I293-F330 HydrophobicContact CG2-CE2 4.07Å; I293-F330 HydrophobicContact CG2-CG 3.67Å; I293-F330 HydrophobicContact CG2-CZ 4.3Å; I293-A333 HydrophobicContact CG1-CB 4.36Å
294	Y	97.4	Very high	93.3	Very high	22 Å²	22	46.7 Å²	46.7	9%	0.086	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	133.8	173.8	-77.4	-101.5	0	0	0	110.2	T243 I245 E275 I292 F330 R331 A332 Y334 R339	T243-Y294 HydrophobicContact CG2-CD1 4.24Å; T243-Y294 HydrophobicContact CG2-CE1 3.78Å; I245-Y294 HydrophobicContact CG2-CD1 3.56Å; I245-Y294 HydrophobicContact CG2-CD2 4.12Å; I245-Y294 HydrophobicContact CG2-CE1 3.68Å; I245-Y294 HydrophobicContact CG2-CE2 4.15Å; I245-Y294 HydrophobicContact CG2-CG 3.84Å; E275-Y294 PolarHBondContact OE1-OH 3.3Å; I292-Y294 HydrophobicContact CG2-CD2 4.12Å; I292-Y294 HydrophobicContact CG2-CE2 3.75Å; Y294-F330 CarbonylContact O-C 3.59Å; Y294-F330 WeakPolarHBondContact O-CA 3.35Å; Y294-R331 PolarHBondContact O-N 3.5Å; Y294-A332 PolarHBondContact N-O 3.41Å; Y294-Y334 AromaticContact CD2-CD2 3.9Å; Y294-Y334 HydrophobicContact CD2-CD2 3.9Å; Y294-Y334 HydrophobicContact CD2-CE2 4Å; Y294-Y334 AromaticContact CE2-CD2 3.79Å; Y294-Y334 HydrophobicContact CE2-CD2 3.79Å; Y294-Y334 AromaticContact CE2-CE2 3.99Å; Y294-Y334 HydrophobicContact CE2-CE2 3.99Å; Y294-R339 PolarHBondContact OH-NH2 2.85Å
295	I	98.1	Very high	94.5	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	136.5	-179.6	-52.6	-56.6	0	0	0	109.8	V244 L261 F271 I293 L297 F307 L325 Y329 F330	V244-I295 HydrophobicContact CB-CB 4.22Å; V244-I295 HydrophobicContact CG1-CB 4.16Å; V244-I295 HydrophobicContact CG1-CG1 4.33Å; V244-I295 PolarHBondContact O-N 2.98Å; L261-I295 HydrophobicContact CD1-CD1 3.93Å; F271-I295 HydrophobicContact CD1-CD1 4.41Å; F271-I295 HydrophobicContact CD1-CG1 3.69Å; F271-I295 HydrophobicContact CE1-CD1 3.83Å; F271-I295 HydrophobicContact CE1-CG1 3.52Å; F271-I295 HydrophobicContact CZ-CG1 4.45Å; I293-I295 HydrophobicContact CG2-CD1 4.01Å; I295-L297 PolarHBondContact O-N 2.93Å; I295-F307 HydrophobicContact CG2-CZ 4.45Å; I295-L325 HydrophobicContact CD1-CD2 4.13Å; I295-L325 HydrophobicContact CG2-CD2 3.95Å; I295-Y329 CarbonylContact C-O 3.5Å; I295-Y329 WeakPolarHBondContact CA-O 3.25Å; I295-F330 HydrophobicContact CD1-CD1 3.72Å; I295-F330 HydrophobicContact CD1-CE1 4.02Å
296	D	98	Very high	95.3	Very high	56 Å²	56	53 Å²	53	30%	0.299	28%	0.283	S	S	.	.			trans	-81.8	85.9	165.5	-169.1	-22.1	0	0	0	108.8	K299 A300 Y329 R331	D296-K299 HydrophobicContact CB-CB 4.07Å; D296-K299 VanDerWaalsContact OD1-CB 3.27Å; D296-K299 WeakPolarHBondContact OD1-CB 3.43Å; D296-K299 PolarHBondContact OD1-N 3.42Å; D296-K299 VanDerWaalsContact OD1-N 3.08Å; D296-A300 WeakPolarHBondContact O-CB 3.43Å; D296-A300 PolarHBondContact O-N 2.82Å; D296-A300 VanDerWaalsContact O-N 3.11Å; D296-Y329 PolarHBondContact N-O 3.42Å; D296-R331 HydrophobicContact CB-CB 4.36Å
297	L	98.2	Very high	96	Very high	7 Å²	7	46 Å²	46	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-45	-175	-177.9	69.1	0	0	0	111.6	I235 P238 V244 I295 K299 A300 I301 F307	I235-L297 HydrophobicContact CG2-CD2 4.46Å; P238-L297 HydrophobicContact CB-CD2 3.81Å; P238-L297 HydrophobicContact CB-CG 4.05Å; V244-L297 HydrophobicContact CG2-CB 4.07Å; V244-L297 HydrophobicContact CG2-CD1 4.4Å; V244-L297 HydrophobicContact CG2-CD2 3.87Å; V244-L297 HydrophobicContact CG2-CG 4.33Å; I295-L297 PolarHBondContact O-N 2.93Å; L297-K299 PolarHBondContact O-N 2.99Å; L297-A300 PolarHBondContact O-N 2.93Å; L297-I301 HydrophobicContact CD1-CD1 4.06Å; L297-I301 HydrophobicContact CD1-CG1 4.32Å; L297-I301 HydrophobicContact CG-CD1 4.02Å; L297-I301 HydrophobicContact CG-CG1 4.49Å; L297-I301 WeakPolarHBondContact O-CG1 3.23Å; L297-I301 PolarHBondContact O-N 2.72Å; L297-F307 HydrophobicContact CD1-CB 3.95Å; L297-F307 HydrophobicContact CD1-CD1 3.49Å; L297-F307 VanDerWaalsContact CD1-CD1 3.49Å; L297-F307 HydrophobicContact CD1-CD2 3.73Å; L297-F307 HydrophobicContact CD1-CE1 3.81Å; L297-F307 HydrophobicContact CD1-CE2 4.05Å; L297-F307 HydrophobicContact CD1-CG 3.44Å; L297-F307 VanDerWaalsContact CD1-CG 3.44Å; L297-F307 HydrophobicContact CD1-CZ 4.09Å
298	I	98	Very high	96.7	Very high	64 Å²	64	43 Å²	43	33%	0.328	23%	0.23	S	C	.	.	H	α-helix	trans	-59.5	-49.6	-178.2	-63.8	164.6	0	0	0	109.6	P238 E239 A300 I301 N302	P238-I298 HydrophobicContact CB-CG1 3.76Å; P238-I298 HydrophobicContact CG-CG1 3.92Å; E239-I298 WeakPolarHBondContact OE1-CD1 3.44Å; I298-A300 VanDerWaalsContact C-N 3.34Å; I298-A300 PolarHBondContact O-N 2.86Å; I298-I301 PolarHBondContact O-N 2.93Å; I298-N302 WeakPolarHBondContact O-CB 3.4Å; I298-N302 VanDerWaalsContact O-CG 3.25Å; I298-N302 PolarHBondContact O-N 2.95Å; I298-N302 PolarHBondContact O-ND2 3Å
299	K	98.2	Very high	97.2	Very high	79 Å²	79	40.9 Å²	40.9	34%	0.343	21%	0.213	S	C	.	.	H	α-helix	trans	-60.6	-43.9	178.2	-173.4	-176.8	178.8	-174.1	0	112.1	D296 L297 N302 D303 T328 Y329	D296-K299 HydrophobicContact CB-CB 4.07Å; D296-K299 VanDerWaalsContact OD1-CB 3.27Å; D296-K299 WeakPolarHBondContact OD1-CB 3.43Å; D296-K299 PolarHBondContact OD1-N 3.42Å; D296-K299 VanDerWaalsContact OD1-N 3.08Å; L297-K299 PolarHBondContact O-N 2.99Å; K299-N302 PolarHBondContact O-N 3.49Å; K299-D303 WeakPolarHBondContact O-CB 3.43Å; K299-D303 PolarHBondContact O-N 3.21Å; K299-T328 PolarHBondContact NZ-O 3.06Å; K299-Y329 HydrophobicContact CB-CD1 4.45Å; K299-Y329 HydrophobicContact CD-CD1 4.29Å; K299-Y329 HydrophobicContact CG-CD1 4.14Å; K299-Y329 HydrophobicContact CG-CE1 4.13Å
300	A	98.3	Very high	97.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-42.6	-179.8	0	0	0	0	0	112.4	D296 L297 I298 D303 G304 Y305 F307 L325 Y329	D296-A300 WeakPolarHBondContact O-CB 3.43Å; D296-A300 PolarHBondContact O-N 2.82Å; D296-A300 VanDerWaalsContact O-N 3.11Å; L297-A300 PolarHBondContact O-N 2.93Å; I298-A300 VanDerWaalsContact C-N 3.34Å; I298-A300 PolarHBondContact O-N 2.86Å; A300-D303 PolarHBondContact O-N 3.27Å; A300-G304 PolarHBondContact O-N 2.9Å; A300-Y305 WeakPolarHBondContact O-CB 3.47Å; A300-Y305 WeakPolarHBondContact O-CD2 3.4Å; A300-Y305 PolarHBondContact O-N 3.2Å; A300-F307 HydrophobicContact CB-CE2 3.6Å; A300-F307 HydrophobicContact CB-CZ 3.99Å; A300-L325 HydrophobicContact CB-CD1 4.35Å; A300-Y329 VanDerWaalsContact CA-CD1 3.49Å; A300-Y329 HydrophobicContact CB-CD1 3.61Å; A300-Y329 HydrophobicContact CB-CE1 4.12Å; A300-Y329 HydrophobicContact CB-CG 3.89Å
301	I	98	Very high	96.9	Very high	40 Å²	40	43 Å²	43	21%	0.205	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-43.5	176.9	-69.2	-177.8	0	0	0	111.3	I235 P238 L297 I298 D303 G304 F307	I235-I301 HydrophobicContact CG2-CD1 4.21Å; P238-I301 HydrophobicContact CB-CD1 4.08Å; P238-I301 HydrophobicContact CG-CD1 4.49Å; L297-I301 HydrophobicContact CD1-CD1 4.06Å; L297-I301 HydrophobicContact CD1-CG1 4.32Å; L297-I301 HydrophobicContact CG-CD1 4.02Å; L297-I301 HydrophobicContact CG-CG1 4.49Å; L297-I301 WeakPolarHBondContact O-CG1 3.23Å; L297-I301 PolarHBondContact O-N 2.72Å; I298-I301 PolarHBondContact O-N 2.93Å; I301-D303 PolarHBondContact O-N 3.4Å; I301-G304 WeakPolarHBondContact O-CA 3.42Å; I301-G304 PolarHBondContact O-N 3.12Å; I301-F307 HydrophobicContact CD1-CB 4.4Å; I301-F307 HydrophobicContact CD1-CD2 4.42Å; I301-F307 HydrophobicContact CG1-CD2 3.8Å; I301-F307 HydrophobicContact CG1-CE2 4.47Å
302	N	97.5	Very high	96.5	Very high	123 Å²	123	43.1 Å²	43.1	66%	0.658	22%	0.221	S	C	*	.	H	α-helix	trans	-61.2	-33.2	176.8	-72.7	-15.5	0	0	0	112.4	I298 K299 G304	I298-N302 WeakPolarHBondContact O-CB 3.4Å; I298-N302 VanDerWaalsContact O-CG 3.25Å; I298-N302 PolarHBondContact O-N 2.95Å; I298-N302 PolarHBondContact O-ND2 3Å; K299-N302 PolarHBondContact O-N 3.49Å; N302-G304 PolarHBondContact O-N 3.49Å
303	D	97.8	Very high	96.2	Very high	92 Å²	92	45.1 Å²	45.1	49%	0.492	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	3.6	174.2	-73.1	0.7	0	0	0	113.3	K299 A300 I301 Y329	K299-D303 WeakPolarHBondContact O-CB 3.43Å; K299-D303 PolarHBondContact O-N 3.21Å; A300-D303 PolarHBondContact O-N 3.27Å; I301-D303 PolarHBondContact O-N 3.4Å; D303-Y329 HydrophobicContact CB-CE1 3.99Å; D303-Y329 VanDerWaalsContact CB-OH 3.25Å; D303-Y329 WeakPolarHBondContact CB-OH 3.35Å; D303-Y329 WeakPolarHBondContact OD2-CE1 3.46Å; D303-Y329 PolarHBondContact OD2-OH 3.49Å
304	G	97.4	Very high	95.9	Very high	60 Å²	60	45.3 Å²	45.3	62%	0.619	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.8	5.8	171.6	0	0	0	0	0	116	A300 I301 N302	A300-G304 PolarHBondContact O-N 2.9Å; I301-G304 WeakPolarHBondContact O-CA 3.42Å; I301-G304 PolarHBondContact O-N 3.12Å; N302-G304 PolarHBondContact O-N 3.49Å
305	Y	98.2	Very high	95.9	Very high	35 Å²	35	44.3 Å²	44.3	14%	0.137	23%	0.229	C	C	.	.			trans	-73.9	130.6	173.4	-72.3	-98.5	0	0	0	110.9	A300 N320 L325 P326 Y329	A300-Y305 WeakPolarHBondContact O-CB 3.47Å; A300-Y305 WeakPolarHBondContact O-CD2 3.4Å; A300-Y305 PolarHBondContact O-N 3.2Å; Y305-N320 HydrophobicContact CE1-CB 4.11Å; Y305-L325 HydrophobicContact CD1-CD1 3.77Å; Y305-L325 HydrophobicContact CE1-CD1 3.9Å; Y305-L325 HydrophobicContact CG-CD1 4.08Å; Y305-P326 WeakPolarHBondContact OH-CD 3.38Å; Y305-P326 WeakPolarHBondContact OH-CG 3.09Å; Y305-Y329 AromaticContact CD2-CE2 3.95Å; Y305-Y329 HydrophobicContact CD2-CE2 3.95Å; Y305-Y329 AromaticContact CD2-CZ 3.94Å; Y305-Y329 HydrophobicContact CE2-CD2 4.28Å; Y305-Y329 AromaticContact CE2-CE2 3.31Å; Y305-Y329 HydrophobicContact CE2-CE2 3.31Å; Y305-Y329 AromaticContact CE2-CZ 3.51Å; Y305-Y329 WeakPolarHBondContact CE2-OH 3.35Å; Y305-Y329 AromaticContact CZ-CE2 3.75Å
306	K	97.9	Very high	95.8	Very high	131 Å²	131	44.1 Å²	44.1	57%	0.57	23%	0.229	S	C	*	.			trans	-85.1	129.2	174	-63	-178.3	-177	178.5	0	110.3	L234 Y308 C317	L234-K306 HydrophobicContact CD1-CB 4.01Å; L234-K306 HydrophobicContact CD1-CD 4.49Å; L234-K306 HydrophobicContact CD1-CG 4.25Å; K306-Y308 HydrophobicContact CB-CE2 3.94Å; K306-Y308 WeakPolarHBondContact CD-OH 3.46Å; K306-C317 PolarHBondContact O-SG 3.24Å
307	F	98.3	Very high	95.8	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.7	170.1	-74.2	-104.4	0	0	0	109.5	I235 F271 I295 L297 A300 I301 I315 L316 C317 L325	I235-F307 HydrophobicContact CB-CB 4.45Å; I235-F307 HydrophobicContact CD1-CB 4.05Å; I235-F307 PolarHBondContact N-O 3.3Å; F271-F307 HydrophobicContact CD2-CE1 4.15Å; F271-F307 HydrophobicContact CE2-CD1 4.4Å; F271-F307 AromaticContact CE2-CE1 3.75Å; F271-F307 HydrophobicContact CE2-CE1 3.75Å; F271-F307 HydrophobicContact CZ-CE1 4.25Å; I295-F307 HydrophobicContact CG2-CZ 4.45Å; L297-F307 HydrophobicContact CD1-CB 3.95Å; L297-F307 HydrophobicContact CD1-CD1 3.49Å; L297-F307 VanDerWaalsContact CD1-CD1 3.49Å; L297-F307 HydrophobicContact CD1-CD2 3.73Å; L297-F307 HydrophobicContact CD1-CE1 3.81Å; L297-F307 HydrophobicContact CD1-CE2 4.05Å; L297-F307 HydrophobicContact CD1-CG 3.44Å; L297-F307 VanDerWaalsContact CD1-CG 3.44Å; L297-F307 HydrophobicContact CD1-CZ 4.09Å; A300-F307 HydrophobicContact CB-CE2 3.6Å; A300-F307 HydrophobicContact CB-CZ 3.99Å; I301-F307 HydrophobicContact CD1-CB 4.4Å; I301-F307 HydrophobicContact CD1-CD2 4.42Å; I301-F307 HydrophobicContact CG1-CD2 3.8Å; I301-F307 HydrophobicContact CG1-CE2 4.47Å; F307-I315 HydrophobicContact CB-CG2 4.46Å; F307-I315 HydrophobicContact CD1-CG2 3.72Å; F307-L316 CarbonylContact C-O 3.54Å; F307-L316 VanDerWaalsContact CA-O 3.3Å; F307-L316 WeakPolarHBondContact CA-O 3.45Å; F307-C317 HydrophobicContact CD1-CB 3.81Å; F307-C317 HydrophobicContact CE1-CB 3.65Å; F307-C317 HydrophobicContact CE2-CB 4.4Å; F307-C317 HydrophobicContact CG-CB 4.28Å; F307-C317 HydrophobicContact CZ-CB 3.97Å; F307-L325 HydrophobicContact CZ-CD1 4.18Å; F307-L325 HydrophobicContact CZ-CD2 4.04Å
308	Y	97.2	Very high	95.7	Very high	39 Å²	39	46 Å²	46	15%	0.153	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.3	179.7	-50.6	-91.6	0	0	0	110.4	I232 A233 L234 K306 I315 L316	I232-Y308 HydrophobicContact CD1-CD1 4.24Å; I232-Y308 HydrophobicContact CD1-CD2 4.33Å; I232-Y308 HydrophobicContact CD1-CG 3.98Å; I232-Y308 HydrophobicContact CG1-CD1 4.47Å; A233-Y308 CarbonylContact O-C 3.49Å; A233-Y308 WeakPolarHBondContact O-CA 3.29Å; A233-Y308 WeakPolarHBondContact O-CB 3.44Å; L234-Y308 HydrophobicContact CB-CD1 4.26Å; L234-Y308 HydrophobicContact CB-CE1 4.36Å; L234-Y308 HydrophobicContact CD1-CD1 4.04Å; L234-Y308 HydrophobicContact CD1-CE1 3.7Å; K306-Y308 HydrophobicContact CB-CE2 3.94Å; K306-Y308 WeakPolarHBondContact CD-OH 3.46Å; Y308-I315 CarbonylContact O-C 3.55Å; Y308-I315 VanDerWaalsContact O-CA 3.27Å; Y308-I315 WeakPolarHBondContact O-CA 3.49Å; Y308-L316 PolarHBondContact N-O 3.08Å; Y308-L316 PolarHBondContact O-N 2.87Å
309	I	95.2	Very high	95.7	Very high	22 Å²	22	43.8 Å²	43.8	11%	0.113	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.6	170.7	-168.3	72.2	0	0	0	109.9	I232 A233 I235 Y241 N313 I315	I232-I309 WeakPolarHBondContact CA-O 3.38Å; A233-I309 HydrophobicContact CB-CG2 4.06Å; A233-I309 PolarHBondContact N-O 2.83Å; A233-I309 PolarHBondContact O-N 3.31Å; I235-I309 HydrophobicContact CD1-CB 4.38Å; I235-I309 HydrophobicContact CG1-CB 4.22Å; Y241-I309 HydrophobicContact CE1-CD1 3.82Å; Y241-I309 HydrophobicContact CE1-CG1 4.22Å; I309-N313 WeakPolarHBondContact CD1-OD1 3.43Å; I309-I315 HydrophobicContact CD1-CG1 3.5Å; I309-I315 VanDerWaalsContact CD1-CG1 3.5Å
310	S	92.7	Very high	95.6	Very high	6 Å²	6	42.7 Å²	42.7	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	161	171.9	71.7	0	0	0	0	111.9	N312 N313 V314	S310-N312 PolarHBondContact O-N 3.29Å; S310-N312 VanDerWaalsContact O-N 3.07Å; S310-N312 PolarHBondContact OG-N 2.71Å; S310-N312 PolarHBondContact OG-OD1 2.96Å; S310-N313 PolarHBondContact O-N 2.88Å; S310-V314 PolarHBondContact N-O 3.48Å; S310-V314 WeakPolarHBondContact OG-CB 3.24Å; S310-V314 PolarHBondContact OG-N 3.39Å; S310-V314 VanDerWaalsContact OG-N 3.08Å; S310-V314 PolarHBondContact OG-O 3.33Å
311	K	88.6	Confident	95.5	Very high	122 Å²	122	51.8 Å²	51.8	53%	0.53	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.7	172.8	-84.9	-165.1	169.6	162.7	0	115.5	Y220 D231 N313	Y220-K311 HydrophobicContact CD1-CB 3.74Å; Y220-K311 HydrophobicContact CE1-CB 3.55Å; Y220-K311 HydrophobicContact CE1-CD 3.85Å; Y220-K311 HydrophobicContact CE1-CG 4.23Å; Y220-K311 HydrophobicContact CG-CB 4.4Å; D231-K311 IonicContact OD1-NZ 2.85Å; D231-K311 VanDerWaalsContact OD2-CD 3.23Å; D231-K311 WeakPolarHBondContact OD2-CD 3.39Å; D231-K311 WeakPolarHBondContact OD2-CE 3.35Å; D231-K311 IonicContact OD2-NZ 3.98Å; D231-K311 PolarHBondContact OD2-NZ 2.96Å; K311-N313 VanDerWaalsContact C-N 3.31Å
312	N	87.3	Confident	95.4	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.011	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	25.5	174.9	75.8	-35.4	0	0	0	113.7	K201 K202 Y220 S310 V314	K201-N312 PolarHBondContact O-ND2 3.34Å; K202-N312 HydrophobicContact CB-CB 4.32Å; K202-N312 WeakPolarHBondContact O-CB 3.31Å; Y220-N312 HydrophobicContact CD2-CB 4.02Å; S310-N312 PolarHBondContact O-N 3.29Å; S310-N312 VanDerWaalsContact O-N 3.07Å; S310-N312 PolarHBondContact OG-N 2.71Å; S310-N312 PolarHBondContact OG-OD1 2.96Å; N312-V314 PolarHBondContact O-N 2.85Å
313	N	89.9	Confident	95.3	Very high	43 Å²	43	49.4 Å²	49.4	23%	0.23	25%	0.25	C	S	.	.	S	Bend	trans	58.6	42.6	173.9	-150.6	27	0	0	0	113.5	P273 G280 I282 I309 S310 K311	P273-N313 VanDerWaalsContact CD-O 3.24Å; P273-N313 WeakPolarHBondContact CD-O 3.29Å; P273-N313 WeakPolarHBondContact CG-O 3.46Å; G280-N313 PolarHBondContact O-ND2 3.43Å; I282-N313 HydrophobicContact CD1-CB 4.42Å; I309-N313 WeakPolarHBondContact CD1-OD1 3.43Å; S310-N313 PolarHBondContact O-N 2.88Å; K311-N313 VanDerWaalsContact C-N 3.31Å
314	V	92.3	Very high	95.3	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.024	23%	0.229	C	C	.	.			trans	-110.1	127.7	174	-178.6	0	0	0	0	108.6	Q221 H270 F271 S310 N312 L316	Q221-V314 HydrophobicContact CG-CB 4.32Å; Q221-V314 HydrophobicContact CG-CG1 4.47Å; Q221-V314 HydrophobicContact CG-CG2 4.35Å; H270-V314 HydrophobicContact CB-CG1 4.37Å; F271-V314 WeakPolarHBondContact O-CG1 3.34Å; S310-V314 PolarHBondContact N-O 3.48Å; S310-V314 WeakPolarHBondContact OG-CB 3.24Å; S310-V314 PolarHBondContact OG-N 3.39Å; S310-V314 VanDerWaalsContact OG-N 3.08Å; S310-V314 PolarHBondContact OG-O 3.33Å; N312-V314 PolarHBondContact O-N 2.85Å; V314-L316 HydrophobicContact CG1-CD2 4.01Å
315	I	95.9	Very high	95.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.9	177.6	-64.1	171.2	0	0	0	108.8	I235 Y241 V244 F271 P273 F307 Y308 I309	I235-I315 HydrophobicContact CD1-CD1 4.38Å; I235-I315 HydrophobicContact CD1-CG1 4.09Å; I235-I315 HydrophobicContact CD1-CG2 4Å; Y241-I315 HydrophobicContact CD1-CD1 3.73Å; Y241-I315 HydrophobicContact CD1-CG1 4.39Å; Y241-I315 HydrophobicContact CE1-CD1 4.41Å; Y241-I315 HydrophobicContact CG-CD1 3.98Å; V244-I315 HydrophobicContact CB-CD1 4.4Å; V244-I315 HydrophobicContact CG1-CD1 4.11Å; V244-I315 HydrophobicContact CG1-CG2 4.24Å; V244-I315 HydrophobicContact CG2-CD1 3.57Å; F271-I315 HydrophobicContact CB-CB 4.04Å; F271-I315 HydrophobicContact CB-CG2 4.28Å; F271-I315 HydrophobicContact CD2-CG2 4.19Å; F271-I315 PolarHBondContact N-O 3.34Å; F271-I315 PolarHBondContact O-N 3.28Å; P273-I315 HydrophobicContact CB-CD1 3.92Å; P273-I315 HydrophobicContact CB-CG1 4.5Å; F307-I315 HydrophobicContact CB-CG2 4.46Å; F307-I315 HydrophobicContact CD1-CG2 3.72Å; Y308-I315 CarbonylContact O-C 3.55Å; Y308-I315 VanDerWaalsContact O-CA 3.27Å; Y308-I315 WeakPolarHBondContact O-CA 3.49Å; I309-I315 HydrophobicContact CD1-CG1 3.5Å; I309-I315 VanDerWaalsContact CD1-CG1 3.5Å
316	L	96.7	Very high	95.4	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.9	-171	-57	172.1	0	0	0	110.4	Q221 I232 H268 I269 H270 F307 Y308 V314	Q221-L316 HydrophobicContact CB-CD1 4.41Å; Q221-L316 HydrophobicContact CB-CD2 4.39Å; I232-L316 HydrophobicContact CG2-CD1 3.69Å; H268-L316 HydrophobicContact CB-CB 4Å; H268-L316 HydrophobicContact CB-CD2 4.16Å; I269-L316 WeakPolarHBondContact O-CA 3.18Å; H270-L316 WeakPolarHBondContact CD2-CD2 3.31Å; H270-L316 VanDerWaalsContact NE2-CD2 3.26Å; H270-L316 WeakPolarHBondContact NE2-CD2 3.46Å; F307-L316 CarbonylContact C-O 3.54Å; F307-L316 VanDerWaalsContact CA-O 3.3Å; F307-L316 WeakPolarHBondContact CA-O 3.45Å; Y308-L316 PolarHBondContact N-O 3.08Å; Y308-L316 PolarHBondContact O-N 2.87Å; V314-L316 HydrophobicContact CG1-CD2 4.01Å
317	C	97.6	Very high	95.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.1	171.2	-174.4	0	0	0	0	109.7	H268 I269 F271 K306 F307 G319	H268-C317 CarbonylContact C-O 2.93Å; H268-C317 WeakPolarHBondContact CA-O 3.43Å; I269-C317 PolarHBondContact N-O 3.14Å; I269-C317 PolarHBondContact O-N 2.91Å; I269-C317 VanDerWaalsContact O-N 3.08Å; F271-C317 HydrophobicContact CE2-CB 3.8Å; K306-C317 PolarHBondContact O-SG 3.24Å; F307-C317 HydrophobicContact CD1-CB 3.81Å; F307-C317 HydrophobicContact CE1-CB 3.65Å; F307-C317 HydrophobicContact CE2-CB 4.4Å; F307-C317 HydrophobicContact CG-CB 4.28Å; F307-C317 HydrophobicContact CZ-CB 3.97Å; C317-G319 PolarHBondContact O-N 3.09Å; C317-G319 PolarHBondContact SG-N 3.5Å; C317-G319 VanDerWaalsContact SG-N 3.37Å
318	E	96.3	Very high	95.3	Very high	101 Å²	101	42.1 Å²	42.1	47%	0.472	21%	0.213	S	C	.	.			trans	-68.3	-27.4	174.6	-65.8	-177.5	163.6	0	0	111.7	H268 G323	H268-E318 IonicContact NE2-OE1 3.85Å; E318-G323 VanDerWaalsContact O-CA 3.29Å; E318-G323 WeakPolarHBondContact O-CA 3.33Å
319	G	97.5	Very high	95.3	Very high	17 Å²	17	41.2 Å²	41.2	18%	0.175	21%	0.209	C	C	.	.			trans	84.2	-164.6	-169.4	0	0	0	0	0	111.7	C317 C324	C317-G319 PolarHBondContact O-N 3.09Å; C317-G319 PolarHBondContact SG-N 3.5Å; C317-G319 VanDerWaalsContact SG-N 3.37Å; G319-C324 CarbonylContact C-O 3.59Å; G319-C324 WeakPolarHBondContact CA-O 3.47Å
320	N	97.1	Very high	95.5	Very high	56 Å²	56	40.8 Å²	40.8	30%	0.299	21%	0.206	S	C	.	.	S	Bend	trans	-77.5	-168	173.7	68.2	0.5	0	0	0	111.4	Y305 E322 G323 C324	Y305-N320 HydrophobicContact CE1-CB 4.11Å; N320-E322 PolarHBondContact ND2-OE2 3.27Å; N320-E322 PolarHBondContact O-N 2.97Å; N320-E322 VanDerWaalsContact O-N 3.14Å; N320-E322 WeakPolarHBondContact OD1-CA 3.38Å; N320-E322 PolarHBondContact OD1-N 2.88Å; N320-E322 PolarHBondContact OD1-OE2 2.97Å; N320-E322 VanDerWaalsContact OD1-OE2 3.11Å; N320-G323 WeakPolarHBondContact O-CA 3.37Å; N320-G323 PolarHBondContact O-N 3.27Å; N320-G323 PolarHBondContact OD1-N 2.9Å; N320-C324 VanDerWaalsContact CG-O 3.27Å; N320-C324 PolarHBondContact N-O 3.23Å; N320-C324 WeakPolarHBondContact OD1-CA 3.43Å; N320-C324 WeakPolarHBondContact OD1-CB 3.37Å; N320-C324 PolarHBondContact OD1-N 3.27Å; N320-C324 PolarHBondContact OD1-O 3.41Å
321	K	95.7	Very high	95.7	Very high	192 Å²	192	46.6 Å²	46.6	84%	0.835	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-25	178.5	68.7	-173.7	-177.7	-176.1	0	114	G323	K321-G323 VanDerWaalsContact C-N 3.35Å
322	E	95.4	Very high	96.1	Very high	111 Å²	111	41.2 Å²	41.2	52%	0.519	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	3.4	172.9	-58.4	81.6	-170.5	0	0	113.6	N320	N320-E322 PolarHBondContact ND2-OE2 3.27Å; N320-E322 PolarHBondContact O-N 2.97Å; N320-E322 VanDerWaalsContact O-N 3.14Å; N320-E322 WeakPolarHBondContact OD1-CA 3.38Å; N320-E322 PolarHBondContact OD1-N 2.88Å; N320-E322 PolarHBondContact OD1-OE2 2.97Å; N320-E322 VanDerWaalsContact OD1-OE2 3.11Å
323	G	97	Very high	96.6	Very high	2 Å²	2	41.1 Å²	41.1	2%	0.021	21%	0.205	C	C	.	.	S	Bend	trans	71.3	31	-176.3	0	0	0	0	0	113.7	K262 R263 E318 N320 K321	K262-G323 CarbonylContact C-O 3.47Å; K262-G323 WeakPolarHBondContact CA-O 3.48Å; R263-G323 PolarHBondContact N-O 2.84Å; E318-G323 VanDerWaalsContact O-CA 3.29Å; E318-G323 WeakPolarHBondContact O-CA 3.33Å; N320-G323 WeakPolarHBondContact O-CA 3.37Å; N320-G323 PolarHBondContact O-N 3.27Å; N320-G323 PolarHBondContact OD1-N 2.9Å; K321-G323 VanDerWaalsContact C-N 3.35Å
324	C	98.1	Very high	96.9	Very high	7 Å²	7	41.9 Å²	41.9	5%	0.047	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	141.3	-175.4	-166.1	0	0	0	0	112.8	E259 L261 K262 G319 N320	E259-C324 PolarHBondContact O-SG 3.48Å; L261-C324 CarbonylContact O-C 3.56Å; L261-C324 WeakPolarHBondContact O-CA 3.19Å; K262-C324 HydrophobicContact CG-CB 4.02Å; G319-C324 CarbonylContact C-O 3.59Å; G319-C324 WeakPolarHBondContact CA-O 3.47Å; N320-C324 VanDerWaalsContact CG-O 3.27Å; N320-C324 PolarHBondContact N-O 3.23Å; N320-C324 WeakPolarHBondContact OD1-CA 3.43Å; N320-C324 WeakPolarHBondContact OD1-CB 3.37Å; N320-C324 PolarHBondContact OD1-N 3.27Å; N320-C324 PolarHBondContact OD1-O 3.41Å
325	L	98.5	Very high	97.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	107.7	162.5	-174.1	70.7	0	0	0	108.8	G260 L261 I269 F271 I295 A300 Y305 F307 Y329	G260-L325 CarbonylContact C-O 3.52Å; G260-L325 VanDerWaalsContact CA-O 3.29Å; G260-L325 WeakPolarHBondContact CA-O 3.37Å; L261-L325 HydrophobicContact CB-CB 4.49Å; L261-L325 PolarHBondContact N-O 3.39Å; L261-L325 PolarHBondContact O-N 2.96Å; I269-L325 HydrophobicContact CD1-CB 3.61Å; F271-L325 HydrophobicContact CE1-CD2 4.23Å; F271-L325 HydrophobicContact CZ-CD2 3.73Å; I295-L325 HydrophobicContact CD1-CD2 4.13Å; I295-L325 HydrophobicContact CG2-CD2 3.95Å; A300-L325 HydrophobicContact CB-CD1 4.35Å; Y305-L325 HydrophobicContact CD1-CD1 3.77Å; Y305-L325 HydrophobicContact CE1-CD1 3.9Å; Y305-L325 HydrophobicContact CG-CD1 4.08Å; F307-L325 HydrophobicContact CZ-CD1 4.18Å; F307-L325 HydrophobicContact CZ-CD2 4.04Å; L325-Y329 HydrophobicContact CD1-CD2 3.53Å; L325-Y329 HydrophobicContact CD1-CE2 4.25Å; L325-Y329 HydrophobicContact CD1-CG 4.03Å; L325-Y329 HydrophobicContact CG-CD2 4.03Å; L325-Y329 HydrophobicContact CG-CG 4.48Å
326	P	97.7	Very high	96.8	Very high	32 Å²	32	46.4 Å²	46.4	21%	0.208	22%	0.224	C	C	.	.			trans	-58.1	156.7	-178.1	-26.6	34.1	0	0	0	114.4	Y305 T328 Y329	Y305-P326 WeakPolarHBondContact OH-CD 3.38Å; Y305-P326 WeakPolarHBondContact OH-CG 3.09Å; P326-T328 PolarHBondContact O-N 2.92Å; P326-T328 VanDerWaalsContact O-N 3.14Å; P326-Y329 HydrophobicContact CB-CD2 4.27Å; P326-Y329 HydrophobicContact CB-CE2 4.27Å; P326-Y329 HydrophobicContact CG-CD2 4.45Å; P326-Y329 HydrophobicContact CG-CE2 4.14Å; P326-Y329 WeakPolarHBondContact O-CD2 3.31Å; P326-Y329 PolarHBondContact O-N 3.02Å
327	T	97.4	Very high	96.4	Very high	43 Å²	43	52.3 Å²	52.3	26%	0.264	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-62.6	-19.1	178	54.6	0	0	0	0	113.7	I256 Y329 F330	I256-T327 VanDerWaalsContact O-CG2 3.25Å; I256-T327 WeakPolarHBondContact O-CG2 3.5Å; T327-Y329 PolarHBondContact O-N 2.98Å; T327-F330 HydrophobicContact CG2-CD2 4.12Å; T327-F330 HydrophobicContact CG2-CE2 3.71Å; T327-F330 HydrophobicContact CG2-CZ 4.14Å; T327-F330 WeakPolarHBondContact O-CB 3.27Å; T327-F330 PolarHBondContact O-N 3.37Å
328	T	97.3	Very high	96.3	Very high	84 Å²	84	56.4 Å²	56.4	52%	0.515	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-54.9	-21.8	172.9	-49.4	0	0	0	0	113.6	K299 P326	K299-T328 PolarHBondContact NZ-O 3.06Å; P326-T328 PolarHBondContact O-N 2.92Å; P326-T328 VanDerWaalsContact O-N 3.14Å
329	Y	98.1	Very high	96.1	Very high	20 Å²	20	56.8 Å²	56.8	8%	0.078	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-100	6.1	178.4	-54.7	-64.3	0	0	0	113.4	I295 D296 K299 A300 D303 Y305 L325 P326 T327	I295-Y329 CarbonylContact C-O 3.5Å; I295-Y329 WeakPolarHBondContact CA-O 3.25Å; D296-Y329 PolarHBondContact N-O 3.42Å; K299-Y329 HydrophobicContact CB-CD1 4.45Å; K299-Y329 HydrophobicContact CD-CD1 4.29Å; K299-Y329 HydrophobicContact CG-CD1 4.14Å; K299-Y329 HydrophobicContact CG-CE1 4.13Å; A300-Y329 VanDerWaalsContact CA-CD1 3.49Å; A300-Y329 HydrophobicContact CB-CD1 3.61Å; A300-Y329 HydrophobicContact CB-CE1 4.12Å; A300-Y329 HydrophobicContact CB-CG 3.89Å; D303-Y329 HydrophobicContact CB-CE1 3.99Å; D303-Y329 VanDerWaalsContact CB-OH 3.25Å; D303-Y329 WeakPolarHBondContact CB-OH 3.35Å; D303-Y329 WeakPolarHBondContact OD2-CE1 3.46Å; D303-Y329 PolarHBondContact OD2-OH 3.49Å; Y305-Y329 AromaticContact CD2-CE2 3.95Å; Y305-Y329 HydrophobicContact CD2-CE2 3.95Å; Y305-Y329 AromaticContact CD2-CZ 3.94Å; Y305-Y329 HydrophobicContact CE2-CD2 4.28Å; Y305-Y329 AromaticContact CE2-CE2 3.31Å; Y305-Y329 HydrophobicContact CE2-CE2 3.31Å; Y305-Y329 AromaticContact CE2-CZ 3.51Å; Y305-Y329 WeakPolarHBondContact CE2-OH 3.35Å; Y305-Y329 AromaticContact CZ-CE2 3.75Å; L325-Y329 HydrophobicContact CD1-CD2 3.53Å; L325-Y329 HydrophobicContact CD1-CE2 4.25Å; L325-Y329 HydrophobicContact CD1-CG 4.03Å; L325-Y329 HydrophobicContact CG-CD2 4.03Å; L325-Y329 HydrophobicContact CG-CG 4.48Å; P326-Y329 HydrophobicContact CB-CD2 4.27Å; P326-Y329 HydrophobicContact CB-CE2 4.27Å; P326-Y329 HydrophobicContact CG-CD2 4.45Å; P326-Y329 HydrophobicContact CG-CE2 4.14Å; P326-Y329 WeakPolarHBondContact O-CD2 3.31Å; P326-Y329 PolarHBondContact O-N 3.02Å; T327-Y329 PolarHBondContact O-N 2.98Å
330	F	98	Very high	96.1	Very high	12 Å²	12	60.3 Å²	60.3	5%	0.053	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.8	174	-63.5	1.1	0	0	0	108.7	I256 L261 I293 Y294 I295 T327 L344	I256-F330 HydrophobicContact CG2-CE2 3.68Å; I256-F330 HydrophobicContact CG2-CZ 3.88Å; L261-F330 HydrophobicContact CB-CE1 4.46Å; L261-F330 HydrophobicContact CB-CZ 4.37Å; L261-F330 HydrophobicContact CD1-CE1 3.86Å; L261-F330 HydrophobicContact CD1-CZ 4.08Å; L261-F330 HydrophobicContact CG-CE1 3.92Å; L261-F330 HydrophobicContact CG-CZ 3.69Å; I293-F330 HydrophobicContact CG2-CB 4.25Å; I293-F330 HydrophobicContact CG2-CD1 3.87Å; I293-F330 HydrophobicContact CG2-CD2 3.76Å; I293-F330 HydrophobicContact CG2-CE1 4.19Å; I293-F330 HydrophobicContact CG2-CE2 4.07Å; I293-F330 HydrophobicContact CG2-CG 3.67Å; I293-F330 HydrophobicContact CG2-CZ 4.3Å; Y294-F330 CarbonylContact O-C 3.59Å; Y294-F330 WeakPolarHBondContact O-CA 3.35Å; I295-F330 HydrophobicContact CD1-CD1 3.72Å; I295-F330 HydrophobicContact CD1-CE1 4.02Å; T327-F330 HydrophobicContact CG2-CD2 4.12Å; T327-F330 HydrophobicContact CG2-CE2 3.71Å; T327-F330 HydrophobicContact CG2-CZ 4.14Å; T327-F330 WeakPolarHBondContact O-CB 3.27Å; T327-F330 PolarHBondContact O-N 3.37Å; F330-L344 HydrophobicContact CB-CD1 4.02Å; F330-L344 HydrophobicContact CB-CD2 4.09Å; F330-L344 HydrophobicContact CD2-CD2 4.29Å; F330-L344 WeakPolarHBondContact O-CD1 3.46Å
331	R	97.3	Very high	96.1	Very high	129 Å²	129	65.1 Å²	65.1	49%	0.487	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-41.4	174.3	-174	175	74.5	-176.6	2.6	111.3	P242 Y294 D296	P242-R331 PolarHBondContact O-NH1 3.18Å; Y294-R331 PolarHBondContact O-N 3.5Å; D296-R331 HydrophobicContact CB-CB 4.36Å
332	A	97.3	Very high	96.1	Very high	8 Å²	8	57.5 Å²	57.5	7%	0.066	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	163	179.3	0	0	0	0	0	110.9	Y294 Y334	Y294-A332 PolarHBondContact N-O 3.41Å; A332-Y334 HydrophobicContact CB-CD2 4.36Å; A332-Y334 HydrophobicContact CB-CE2 3.56Å
333	A	97.6	Very high	96.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.2	166.8	0	0	0	0	0	110.4	W253 I292 I293 L342 L344	W253-A333 HydrophobicContact CH2-CB 3.25Å; W253-A333 HydrophobicContact CZ2-CB 3.67Å; W253-A333 HydrophobicContact CZ3-CB 4.01Å; I292-A333 CarbonylContact O-C 3.53Å; I292-A333 VanDerWaalsContact O-CA 3.28Å; I292-A333 WeakPolarHBondContact O-CA 3.3Å; I293-A333 HydrophobicContact CG1-CB 4.36Å; A333-L342 HydrophobicContact CB-CB 4.28Å; A333-L342 PolarHBondContact O-N 2.99Å; A333-L344 HydrophobicContact CB-CD2 3.63Å
334	Y	96.8	Very high	96.1	Very high	60 Å²	60	57.5 Å²	57.5	24%	0.235	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.8	-179.6	-62.1	-91	0	0	0	110.7	I291 I292 Y294 A332 R339 L340 K341	I291-Y334 CarbonylContact C-O 3.57Å; I291-Y334 VanDerWaalsContact CA-O 3.29Å; I291-Y334 WeakPolarHBondContact CA-O 3.41Å; I292-Y334 PolarHBondContact N-O 2.77Å; I292-Y334 PolarHBondContact O-N 3.35Å; Y294-Y334 AromaticContact CD2-CD2 3.9Å; Y294-Y334 HydrophobicContact CD2-CD2 3.9Å; Y294-Y334 HydrophobicContact CD2-CE2 4Å; Y294-Y334 AromaticContact CE2-CD2 3.79Å; Y294-Y334 HydrophobicContact CE2-CD2 3.79Å; Y294-Y334 AromaticContact CE2-CE2 3.99Å; Y294-Y334 HydrophobicContact CE2-CE2 3.99Å; A332-Y334 HydrophobicContact CB-CD2 4.36Å; A332-Y334 HydrophobicContact CB-CE2 3.56Å; Y334-R339 HydrophobicContact CD1-CG 4.34Å; Y334-L340 CarbonylContact C-O 3.54Å; Y334-L340 WeakPolarHBondContact CA-O 3Å; Y334-K341 HydrophobicContact CD1-CB 4.09Å; Y334-K341 HydrophobicContact CD1-CG 4.49Å; Y334-K341 HydrophobicContact CE1-CB 3.87Å; Y334-K341 HydrophobicContact CE1-CG 4.06Å
335	Q	95.5	Very high	95.5	Very high	41 Å²	41	61.8 Å²	61.8	19%	0.192	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	135.5	152.2	178.3	174.6	-14.4	0	0	107.5	F250 E290 N337 P338 R339 L340 L342	F250-Q335 HydrophobicContact CE2-CG 4.02Å; F250-Q335 HydrophobicContact CZ-CB 3.98Å; F250-Q335 HydrophobicContact CZ-CG 3.66Å; E290-Q335 CarbonylContact O-C 3.52Å; E290-Q335 WeakPolarHBondContact O-CA 3.44Å; Q335-N337 PolarHBondContact NE2-O 3.33Å; Q335-P338 CarbonylContact C-O 3.55Å; Q335-P338 WeakPolarHBondContact CG-O 3.38Å; Q335-R339 VanDerWaalsContact O-CA 3.3Å; Q335-R339 WeakPolarHBondContact O-CA 3.37Å; Q335-L340 HydrophobicContact CB-CB 4.23Å; Q335-L340 PolarHBondContact N-O 3.03Å; Q335-L340 PolarHBondContact O-N 3.36Å; Q335-L342 HydrophobicContact CB-CD2 4.41Å
336	R	90.5	Very high	94.7	Very high	58 Å²	58	67.5 Å²	67.5	22%	0.219	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-47.1	-176.3	-172.3	174.3	175.7	-149.3	-6.5	111.7	S287 A289 E290 I292 R339	S287-R336 PolarHBondContact O-NH1 2.98Å; A289-R336 WeakPolarHBondContact O-CD 3.32Å; E290-R336 WeakPolarHBondContact O-CB 3.48Å; E290-R336 PolarHBondContact O-N 3.38Å; I292-R336 HydrophobicContact CD1-CB 4.19Å; I292-R336 HydrophobicContact CD1-CG 3.87Å; I292-R336 HydrophobicContact CG1-CB 4.35Å; I292-R336 HydrophobicContact CG1-CG 4.48Å; R336-R339 PolarHBondContact O-N 3.45Å
337	N	88.8	Confident	94.6	Very high	125 Å²	125	69.3 Å²	69.3	67%	0.668	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.8	115.2	-175.5	-67	-38.2	0	0	0	111.2	Q335	Q335-N337 PolarHBondContact NE2-O 3.33Å
338	P	93.5	Very high	94.4	Very high	86 Å²	86	70.7 Å²	70.7	56%	0.558	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	cis	-60.2	159.4	-16.7	28.2	-37.4	0	0	0	112.3	Q335 L340	Q335-P338 CarbonylContact C-O 3.55Å; Q335-P338 WeakPolarHBondContact CG-O 3.38Å; P338-L340 HydrophobicContact CB-CG 4.46Å; P338-L340 HydrophobicContact CG-CD1 3.83Å; P338-L340 HydrophobicContact CG-CG 4.08Å; P338-L340 PolarHBondContact O-N 2.99Å
339	R	93	Very high	94.3	Very high	109 Å²	109	69.9 Å²	69.9	41%	0.411	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	96.4	176.8	-171.5	78.1	172.1	-167.1	-3.9	109.8	E275 Y294 Y334 Q335 R336	E275-R339 IonicContact OE1-CZ 3.24Å; E275-R339 VanDerWaalsContact OE1-CZ 3.24Å; E275-R339 IonicContact OE1-NH1 2.71Å; E275-R339 PolarHBondContact OE1-NH1 3.32Å; E275-R339 IonicContact OE1-NH2 2.88Å; E275-R339 PolarHBondContact OE1-NH2 2.95Å; E275-R339 IonicContact OE2-NH1 3.21Å; E275-R339 PolarHBondContact OE2-NH1 2.62Å; Y294-R339 PolarHBondContact OH-NH2 2.85Å; Y334-R339 HydrophobicContact CD1-CG 4.34Å; Q335-R339 VanDerWaalsContact O-CA 3.3Å; Q335-R339 WeakPolarHBondContact O-CA 3.37Å; R336-R339 PolarHBondContact O-N 3.45Å
340	L	96.6	Very high	94	Very high	92 Å²	92	72.9 Å²	72.9	48%	0.482	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.5	179	-66.9	172.3	0	0	0	110.2	Y334 Q335 P338 L342	Y334-L340 CarbonylContact C-O 3.54Å; Y334-L340 WeakPolarHBondContact CA-O 3Å; Q335-L340 HydrophobicContact CB-CB 4.23Å; Q335-L340 PolarHBondContact N-O 3.03Å; Q335-L340 PolarHBondContact O-N 3.36Å; P338-L340 HydrophobicContact CB-CG 4.46Å; P338-L340 HydrophobicContact CG-CD1 3.83Å; P338-L340 HydrophobicContact CG-CG 4.08Å; P338-L340 PolarHBondContact O-N 2.99Å; L340-L342 PolarHBondContact O-N 3.08Å
341	K	97.3	Very high	93.8	Very high	156 Å²	156	76.7 Å²	76.7	68%	0.678	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	130	176.2	-169.3	176.3	-177.6	-179.7	0	109.4	Y334	Y334-K341 HydrophobicContact CD1-CB 4.09Å; Y334-K341 HydrophobicContact CD1-CG 4.49Å; Y334-K341 HydrophobicContact CE1-CB 3.87Å; Y334-K341 HydrophobicContact CE1-CG 4.06Å
342	L	97.4	Very high	93.5	Very high	32 Å²	32	73.2 Å²	73.2	17%	0.168	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-99.5	149.6	178.7	-58.8	176.4	0	0	0	110.5	W253 I291 A333 Q335 L340	W253-L342 HydrophobicContact CD2-CD1 4.43Å; W253-L342 HydrophobicContact CZ2-CB 3.94Å; W253-L342 HydrophobicContact CZ2-CD1 4.32Å; I291-L342 HydrophobicContact CD1-CD1 3.8Å; I291-L342 HydrophobicContact CG1-CD1 3.87Å; I291-L342 HydrophobicContact CG2-CD1 3.92Å; A333-L342 HydrophobicContact CB-CB 4.28Å; A333-L342 PolarHBondContact O-N 2.99Å; Q335-L342 HydrophobicContact CB-CD2 4.41Å; L340-L342 PolarHBondContact O-N 3.08Å
343	S	96.1	Very high	93.3	Very high	66 Å²	66	77.9 Å²	77.9	46%	0.462	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-67.6	131.3	170	-179.1	0	0	0	0	110.3	W253 T345	W253-S343 VanDerWaalsContact CZ2-O 3.31Å; W253-S343 WeakPolarHBondContact CZ2-O 3.49Å; S343-T345 PolarHBondContact OG-N 3.24Å; S343-T345 PolarHBondContact OG-O 2.99Å; S343-T345 PolarHBondContact OG-OG1 2.87Å
344	L	94.9	Very high	92.9	Very high	47 Å²	47	83.8 Å²	83.8	25%	0.246	44%	0.438	C	S	.	.	S	Bend	trans	-80	-20.1	175.2	-62.3	-177.4	0	0	0	112.8	W253 F330 A333	W253-L344 HydrophobicContact CH2-CD2 4.02Å; W253-L344 HydrophobicContact CZ2-CD2 4.45Å; F330-L344 HydrophobicContact CB-CD1 4.02Å; F330-L344 HydrophobicContact CB-CD2 4.09Å; F330-L344 HydrophobicContact CD2-CD2 4.29Å; F330-L344 WeakPolarHBondContact O-CD1 3.46Å; A333-L344 HydrophobicContact CB-CD2 3.63Å
345	T	86.2	Confident	92.6	Very high	98 Å²	98	85.8 Å²	85.8	60%	0.601	46%	0.455	S	S	*	.			trans	-97.4	141.9	176	51.5	0	0	0	0	110.7	R257 S343	R257-T345 PolarHBondContact NH1-O 2.94Å; S343-T345 PolarHBondContact OG-N 3.24Å; S343-T345 PolarHBondContact OG-O 2.99Å; S343-T345 PolarHBondContact OG-OG1 2.87Å
346	P	81.7	Confident	92.4	Very high	120 Å²	120	89.9 Å²	89.9	78%	0.779	48%	0.479	S	S	*	.			trans	-48.1	0	173	-29.5	36.5	0	0	0	114.4	R257 K258	R257-P346 HydrophobicContact CG-CG 4.33Å; R257-P346 VanDerWaalsContact CZ-OXT 3.25Å; R257-P346 PolarHBondContact NH1-OXT 3.07Å; R257-P346 PolarHBondContact NH2-OXT 3.46Å; R257-P346 VanDerWaalsContact NH2-OXT 3.16Å; R257-P346 WeakPolarHBondContact O-CD 3.27Å; K258-P346 HydrophobicContact CB-CG 4.11Å; K258-P346 HydrophobicContact CG-CG 4.45Å

Retrieved 346 of 346 residues in 122.4 ms (Link to these results)

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