A0A2K5YYV9_MANLE Loading...

ATP synthase subunit beta

Catalytic subunit beta, of the mitochondrial membrane ATP synthase complex (F(1)F(0) ATP synthase or Complex V) that produces ATP from ADP in the presence of a proton gradient across the membrane which is generated by electron transport complexes of the respiratory chain. ATP synthase complex consist of a soluble F(1) head domain - the catalytic core - and a membrane F(1) domain - the membrane proton channel. These two domains are linked by a central stalk rotating inside the F(1) region and a stationary peripheral stalk. During catalysis, ATP synthesis in the catalytic domain of F(1) is coupled via a rotary mechanism of the central stalk subunits to proton translocation. In vivo, can only synthesize ATP although its ATP hydrolase activity can be activated artificially in vitro. With the subunit alpha (ATP5F1A), forms the catalytic core in the F(1) domain. Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB , UniProt , Accession A0A2K5YYV9, Species MANLE (Mandrillus leucophaeus, Drill), Gene ATP5F1B, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	28.1	Very low	236 Å²	236	139.9 Å²	139.9	100%	1.163	85%	0.85	S	S	*	*				0	125.5	0	-90	-178	177.3	0	0	108.1
2	L	28.2	Very low	28	Very low	169 Å²	169	137.8 Å²	137.8	89%	0.885	85%	0.846	S	S	*	*			trans	26.5	128.2	153.8	-66.3	119.9	0	0	0	118.7
3	G	25.4	Very low	27.8	Very low	67 Å²	67	134.9 Å²	134.9	69%	0.691	84%	0.844	S	S	*	*			cis	114.1	115.1	42.8	0	0	0	0	0	107.5
4	L	27.8	Very low	27.9	Very low	160 Å²	160	134.7 Å²	134.7	84%	0.838	85%	0.85	S	S	*	*				176.4	125.3	94	-111	81.9	0	0	0	105.2
5	V	31.6	Very low	27.7	Very low	126 Å²	126	130.8 Å²	130.8	76%	0.764	85%	0.846	S	S	*	*				61.6	108.2	72.1	-171.4	0	0	0	0	115	R7	V5-R7 HydrophobicContact CG1-CG 4.49Å
6	G	25.7	Very low	27.7	Very low	88 Å²	88	129.2 Å²	129.2	91%	0.907	85%	0.847	S	S	*	*			trans	-132.9	104.2	156.1	0	0	0	0	0	109.3
7	R	29.2	Very low	28	Very low	233 Å²	233	132 Å²	132	88%	0.879	85%	0.852	S	S	*	*			trans	-96.6	148.7	-177.8	-101.8	-176.7	174.1	178.6	-1.9	111.6	V5	V5-R7 HydrophobicContact CG1-CG 4.49Å
8	V	27.1	Very low	28.1	Very low	134 Å²	134	138.8 Å²	138.8	81%	0.812	86%	0.858	S	S	*	*			trans	-50.4	138.6	163.1	174.9	0	0	0	0	112.2
9	A	26.4	Very low	28	Very low	102 Å²	102	135.3 Å²	135.3	84%	0.843	85%	0.852	S	S	*	*			trans	-105.5	127.6	170.8	0	0	0	0	0	111
10	T	28.3	Very low	28	Very low	134 Å²	134	136.7 Å²	136.7	82%	0.822	85%	0.852	S	S	*	*			trans	-112.8	142.6	168.5	40.9	0	0	0	0	109
11	A	27.3	Very low	28.2	Very low	90 Å²	90	136.2 Å²	136.2	74%	0.744	85%	0.848	S	S	*	*			trans	-159.6	107.1	159.6	0	0	0	0	0	108
12	S	27.2	Very low	28.4	Very low	115 Å²	115	130.9 Å²	130.9	80%	0.804	83%	0.831	S	S	*	*				75.2	132.9	101.8	74.1	0	0	0	0	113.6
13	A	26.1	Very low	28.4	Very low	100 Å²	100	128.4 Å²	128.4	83%	0.826	83%	0.828	S	S	*	*				-159.9	156.9	53.5	0	0	0	0	0	113.6
14	S	28	Very low	28.6	Very low	132 Å²	132	129.5 Å²	129.5	92%	0.923	83%	0.831	S	S	*	*			trans	-79.2	152.4	175.7	-62.3	0	0	0	0	112.4
15	G	25.3	Very low	28.7	Very low	76 Å²	76	127.3 Å²	127.3	78%	0.784	83%	0.829	S	S	*	*			trans	-166.1	105.8	167	0	0	0	0	0	113.8
16	A	28.3	Very low	28.6	Very low	105 Å²	105	129.4 Å²	129.4	87%	0.868	84%	0.835	S	S	*	*			trans	72.9	94.7	154.3	0	0	0	0	0	120.1
17	L	33.3	Very low	28.9	Very low	177 Å²	177	130.6 Å²	130.6	93%	0.927	83%	0.827	S	S	*	*			trans	-89	120.6	142.2	-93.2	158	0	0	0	108.5
18	R	28.2	Very low	29	Very low	255 Å²	255	125.5 Å²	125.5	96%	0.962	82%	0.823	S	S	*	*			trans	-172.7	118.8	151.7	-110.2	175.9	-174.3	-163.9	1.8	111.9
19	G	27.2	Very low	29.1	Very low	72 Å²	72	124 Å²	124	74%	0.742	83%	0.825	S	S	*	*			trans	129.1	118.3	147.3	0	0	0	0	0	117.6
20	L	28.1	Very low	29.2	Very low	163 Å²	163	127.8 Å²	127.8	85%	0.853	83%	0.825	S	S	*	*			trans	98.9	96.4	146.1	-58.3	165.5	0	0	0	120.2
21	T	31.2	Very low	29.2	Very low	127 Å²	127	129 Å²	129	78%	0.779	83%	0.826	S	S	*	*			trans	55.1	145.7	130.2	52.9	0	0	0	0	123.6
22	P	35.5	Very low	29.1	Very low	123 Å²	123	132.5 Å²	132.5	80%	0.799	83%	0.831	S	S	*	*			trans	-95.4	126.5	-175.8	36.2	-27.1	0	0	0	112.7
23	S	29.7	Very low	29.1	Very low	117 Å²	117	134.4 Å²	134.4	82%	0.818	83%	0.831	S	S	*	*			trans	-172.9	140.1	149.3	61.4	0	0	0	0	112.8
24	A	28.8	Very low	29.1	Very low	91 Å²	91	141.2 Å²	141.2	75%	0.752	84%	0.836	S	S	*	*			trans	91.2	83.8	154	0	0	0	0	0	120
25	S	30.7	Very low	29.1	Very low	113 Å²	113	139.4 Å²	139.4	79%	0.79	83%	0.829	S	S	*	*			trans	32.6	120.9	130.9	61.6	0	0	0	0	122.6
26	L	29.9	Very low	29.2	Very low	171 Å²	171	140 Å²	140	90%	0.895	83%	0.826	S	S	*	*			trans	-141.7	150.6	144.7	-79.1	173.5	0	0	0	111.1
27	P	30.9	Very low	29.1	Very low	113 Å²	113	141 Å²	141	73%	0.734	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-85.9	169.1	-161.4	-2.5	22.8	0	0	0	114.7
28	P	31.7	Very low	28.9	Very low	125 Å²	125	138.4 Å²	138.4	81%	0.812	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-74.6	136.2	-166.4	29.9	-33	0	0	0	113.4	Q30	P28-Q30 PolarHBondContact O-N 3.39Å
29	A	28.6	Very low	28.9	Very low	102 Å²	102	130.5 Å²	130.5	84%	0.843	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-63.7	121.4	173.2	0	0	0	0	0	111.3
30	Q	28.8	Very low	28.9	Very low	183 Å²	183	133.3 Å²	133.3	86%	0.855	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.6	128.3	163.6	-81.1	174.2	-22.4	0	0	109.6	P28 L32	P28-Q30 PolarHBondContact O-N 3.39Å; Q30-L32 PolarHBondContact O-N 3.25Å
31	L	27.8	Very low	29.2	Very low	159 Å²	159	133.3 Å²	133.3	83%	0.832	80%	0.803	S	S	*	*			trans	-55	115.9	166.4	-114.6	87.3	0	0	0	109.8
32	L	26.1	Very low	29.3	Very low	163 Å²	163	131.8 Å²	131.8	85%	0.853	80%	0.795	S	S	*	*			trans	-102.6	99.6	160.9	-87.9	164.2	0	0	0	108.3	Q30 R34	Q30-L32 PolarHBondContact O-N 3.25Å; L32-R34 PolarHBondContact O-N 3.15Å; L32-R34 VanDerWaalsContact O-N 3.15Å
33	L	26.6	Very low	29.4	Very low	155 Å²	155	131.1 Å²	131.1	81%	0.812	79%	0.788	S	S	*	*			trans	-63.6	105.2	161	-133	88.8	0	0	0	107	A35	L33-A35 PolarHBondContact O-N 3.18Å
34	R	25.4	Very low	30.1	Very low	244 Å²	244	131.3 Å²	131.3	92%	0.921	77%	0.771	S	S	*	*			trans	-71.1	107.1	169.8	-99.8	-177	169.8	-174.3	-3.2	108.3	L32	L32-R34 PolarHBondContact O-N 3.15Å; L32-R34 VanDerWaalsContact O-N 3.15Å
35	A	28.1	Very low	30.5	Very low	93 Å²	93	132.8 Å²	132.8	77%	0.769	77%	0.766	S	S	*	*			trans	-59.7	138.2	162.9	0	0	0	0	0	109.8	L33	L33-A35 PolarHBondContact O-N 3.18Å
36	A	27.5	Very low	31.1	Very low	88 Å²	88	133.2 Å²	133.2	73%	0.727	75%	0.751	S	S	*	*			trans	-62.4	144.5	172.2	0	0	0	0	0	110.2	T38	A36-T38 PolarHBondContact O-N 3.43Å
37	P	27.7	Very low	31.7	Very low	128 Å²	128	126 Å²	126	83%	0.831	72%	0.716	S	S	*	*			trans	-71.8	115.9	179.8	29.3	-30.3	0	0	0	109	A39	P37-A39 PolarHBondContact O-N 3.19Å
38	T	28.6	Very low	32	Very low	122 Å²	122	124.6 Å²	124.6	75%	0.748	71%	0.714	S	S	*	*			trans	-60.1	126.2	160.2	39.5	0	0	0	0	108.4	A36 V40	A36-T38 PolarHBondContact O-N 3.43Å; T38-V40 PolarHBondContact O-N 3.09Å; T38-V40 VanDerWaalsContact O-N 3.09Å
39	A	28.8	Very low	32.3	Very low	89 Å²	89	125.1 Å²	125.1	74%	0.736	71%	0.706	S	S	*	*			trans	-59.2	112.1	174.2	0	0	0	0	0	109.3	P37 H41	P37-A39 PolarHBondContact O-N 3.19Å; A39-H41 PolarHBondContact O-N 3.24Å
40	V	27.5	Very low	32.9	Very low	131 Å²	131	120.9 Å²	120.9	79%	0.794	67%	0.67	S	S	*	*			trans	-83.3	105.8	173.6	179.4	0	0	0	0	106.7	T38	T38-V40 PolarHBondContact O-N 3.09Å; T38-V40 VanDerWaalsContact O-N 3.09Å
41	H	33	Very low	33.6	Very low	163 Å²	163	113.9 Å²	113.9	76%	0.755	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-71.2	131.6	165.8	-72.8	-73.9	0	0	0	108.6	A39 V43	A39-H41 PolarHBondContact O-N 3.24Å; H41-V43 PolarHBondContact O-N 3.2Å
42	P	32.9	Very low	34.3	Very low	94 Å²	94	110.1 Å²	110.1	61%	0.61	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-66.4	134	178.8	26.3	-31.1	0	0	0	110.2	R44	P42-R44 PolarHBondContact O-N 3.42Å
43	V	38.6	Very low	35	Very low	109 Å²	109	107.3 Å²	107.3	66%	0.661	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-61.3	117.7	177.5	179.6	0	0	0	0	109.1	H41 D45	H41-V43 PolarHBondContact O-N 3.2Å; V43-D45 WeakPolarHBondContact CG1-OD1 3.41Å; V43-D45 PolarHBondContact O-N 3.45Å
44	R	44.6	Very low	35.9	Very low	122 Å²	122	102.9 Å²	102.9	46%	0.46	60%	0.6	S	S	.	*			trans	-85.3	80.2	175.6	-67.9	-179.6	174.7	177.6	-4.1	109.6	P42 Y46 A47	P42-R44 PolarHBondContact O-N 3.42Å; R44-Y46 PolarHBondContact O-N 2.82Å; R44-A47 WeakPolarHBondContact O-CB 3.22Å; R44-A47 PolarHBondContact O-N 2.8Å
45	D	36	Very low	36.7	Very low	121 Å²	121	100 Å²	100	65%	0.647	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-58.6	-14.5	179.6	-80.8	-25.2	0	0	0	114.4	V43	V43-D45 WeakPolarHBondContact CG1-OD1 3.41Å; V43-D45 PolarHBondContact O-N 3.45Å
46	Y	44.9	Very low	37	Very low	122 Å²	122	100.9 Å²	100.9	48%	0.478	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-78.1	-17.3	175.4	-52	-69.2	0	0	0	114.1	R44 A48 Q49 P157	R44-Y46 PolarHBondContact O-N 2.82Å; Y46-A48 PolarHBondContact O-N 3.13Å; Y46-Q49 PolarHBondContact O-N 3.37Å; Y46-P157 HydrophobicContact CD1-CG 4.17Å
47	A	40.5	Very low	38.2	Very low	19 Å²	19	100.5 Å²	100.5	16%	0.157	61%	0.607	C	S	.	*	G	3₁₀ helix	trans	-59.7	-28.9	178.3	0	0	0	0	0	112.3	R44 T50	R44-A47 WeakPolarHBondContact O-CB 3.22Å; R44-A47 PolarHBondContact O-N 2.8Å; A47-T50 PolarHBondContact O-OG1 3.24Å
48	A	37.7	Very low	39.8	Very low	85 Å²	85	95.8 Å²	95.8	70%	0.702	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-80.7	-15.6	177.2	0	0	0	0	0	114.2	Y46	Y46-A48 PolarHBondContact O-N 3.13Å
49	Q	39.3	Very low	42.1	Very low	136 Å²	136	91 Å²	91	64%	0.636	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-12.9	-173.7	-68.3	-174.6	-1.1	0	0	114	Y46	Y46-Q49 PolarHBondContact O-N 3.37Å
50	T	39.6	Very low	45	Very low	13 Å²	13	89.8 Å²	89.8	8%	0.08	54%	0.535	C	S	.	.	S	Bend	trans	-94.9	0	-172.8	42.7	0	0	0	0	114.8	A47 F163	A47-T50 PolarHBondContact O-OG1 3.24Å; T50-F163 WeakPolarHBondContact O-CE1 3.46Å
51	S	45.1	Very low	48.2	Very low	35 Å²	35	83.5 Å²	83.5	25%	0.245	50%	0.497	C	S	.	.	S	Bend	trans	-97.8	137.7	180	-46.3	0	0	0	0	111.6	S53 R94	S51-S53 PolarHBondContact O-N 3.16Å; S51-S53 VanDerWaalsContact O-N 3.17Å; S51-R94 VanDerWaalsContact OG-CZ 3.23Å; S51-R94 PolarHBondContact OG-NH2 3.28Å
52	P	42.6	Very low	51.1	Low	80 Å²	80	82.1 Å²	82.1	52%	0.519	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-60.1	120.4	155.3	26.1	-29.6	0	0	0	107.5
53	S	41	Very low	54.2	Low	105 Å²	105	77.8 Å²	77.8	73%	0.734	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-48.9	134.2	177.3	34	0	0	0	0	110.6	S51 K55	S51-S53 PolarHBondContact O-N 3.16Å; S51-S53 VanDerWaalsContact O-N 3.17Å; S53-K55 PolarHBondContact O-N 3.3Å
54	P	43.5	Very low	57	Low	61 Å²	61	74.9 Å²	74.9	40%	0.396	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-55	137.1	-178.2	19.7	-29.9	0	0	0	109.8	A56 A58	P54-A56 PolarHBondContact O-N 3.05Å; P54-A58 HydrophobicContact CB-CB 4.46Å
55	K	43.9	Very low	59.4	Low	183 Å²	183	70.2 Å²	70.2	80%	0.796	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-54.5	133.4	177.6	-84.1	-177.9	175.8	176.3	0	109.2	S53 G57 A58	S53-K55 PolarHBondContact O-N 3.3Å; K55-G57 PolarHBondContact O-N 3.41Å; K55-A58 PolarHBondContact O-N 2.79Å; K55-A58 VanDerWaalsContact O-N 3.09Å
56	A	32.9	Very low	62.2	Low	113 Å²	113	66.8 Å²	66.8	93%	0.934	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	115	171.1	0	0	0	0	0	109.1	P54	P54-A56 PolarHBondContact O-N 3.05Å
57	G	52.5	Low	64.5	Low	80 Å²	80	65.6 Å²	65.6	83%	0.825	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.7	9.5	-172.4	0	0	0	0	0	115.9	K55 A59	K55-G57 PolarHBondContact O-N 3.41Å; G57-A59 PolarHBondContact O-N 2.98Å
58	A	61.7	Low	67	Low	29 Å²	29	67 Å²	67	24%	0.24	43%	0.427	C	S	.	.			trans	-52.8	126.2	176.9	0	0	0	0	0	112.5	P54 K55 T60 D127	P54-A58 HydrophobicContact CB-CB 4.46Å; K55-A58 PolarHBondContact O-N 2.79Å; K55-A58 VanDerWaalsContact O-N 3.09Å; A58-T60 PolarHBondContact O-N 3.02Å; A58-T60 PolarHBondContact O-OG1 3.27Å; A58-D127 VanDerWaalsContact CB-O 3.31Å; A58-D127 WeakPolarHBondContact CB-O 3.42Å
59	A	77.8	Confident	69.6	Low	22 Å²	22	63.5 Å²	63.5	18%	0.182	40%	0.398	C	S	.	.			trans	-54.7	128.2	173.6	0	0	0	0	0	108.9	G57 F75 G78 D127	G57-A59 PolarHBondContact O-N 2.98Å; A59-F75 HydrophobicContact CB-CD1 4Å; A59-F75 HydrophobicContact CB-CE1 4.2Å; A59-G78 WeakPolarHBondContact CB-O 3.43Å; A59-D127 HydrophobicContact CB-CB 4.44Å; A59-D127 PolarHBondContact O-N 2.8Å; A59-D127 VanDerWaalsContact O-N 3.14Å
60	T	89.4	Confident	72.3	Confident	62 Å²	62	57.2 Å²	57.2	38%	0.38	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.8	-177.8	-57.2	0	0	0	0	108.8	A58 K124 V125 L126	A58-T60 PolarHBondContact O-N 3.02Å; A58-T60 PolarHBondContact O-OG1 3.27Å; T60-K124 HydrophobicContact CG2-CB 4.46Å; T60-V125 CarbonylContact C-O 3.54Å; T60-V125 WeakPolarHBondContact CA-O 3.4Å; T60-L126 HydrophobicContact CG2-CD2 4.19Å
61	G	93.7	Very high	75.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	172.1	175	0	0	0	0	0	112.6	Q74 V125	G61-Q74 CarbonylContact C-O 3.45Å; G61-Q74 WeakPolarHBondContact CA-O 3.12Å; G61-V125 PolarHBondContact N-O 3.28Å; G61-V125 PolarHBondContact O-N 3.12Å
62	R	95.8	Very high	77.6	Confident	134 Å²	134	55.7 Å²	55.7	51%	0.506	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.2	174.7	-57	-178.4	-158.4	-172.7	9.6	110.2	V64 V73 Q74 D76 Q123	R62-V64 PolarHBondContact O-N 2.88Å; R62-V73 WeakPolarHBondContact O-CA 3.36Å; R62-Q74 PolarHBondContact N-O 3.25Å; R62-Q74 PolarHBondContact O-N 2.93Å; R62-D76 IonicContact CZ-OD2 3.96Å; R62-D76 IonicContact NE-OD2 3.89Å; R62-D76 IonicContact NH2-OD2 3.3Å; R62-D76 PolarHBondContact NH2-OD2 3.13Å; R62-Q123 WeakPolarHBondContact CA-O 3.34Å
63	I	96.9	Very high	80.2	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	125.6	176.8	-59.7	-177	0	0	0	109.8	V66 V71 V88 L119 R121 G122 Q123 V125	I63-V66 HydrophobicContact CG2-CG2 3.69Å; I63-V71 HydrophobicContact CD1-CG1 4.2Å; I63-V71 HydrophobicContact CG1-CG1 4.19Å; I63-V71 HydrophobicContact CG2-CG1 3.88Å; I63-V88 HydrophobicContact CD1-CG1 4.16Å; I63-L119 HydrophobicContact CD1-CB 4.47Å; I63-L119 HydrophobicContact CD1-CD1 4.29Å; I63-L119 HydrophobicContact CD1-CD2 3.89Å; I63-L119 HydrophobicContact CD1-CG 4.47Å; I63-R121 CarbonylContact O-C 3.59Å; I63-R121 WeakPolarHBondContact O-CA 3.48Å; I63-G122 PolarHBondContact O-N 2.86Å; I63-Q123 HydrophobicContact CD1-CB 4.04Å; I63-Q123 HydrophobicContact CG1-CB 4.37Å; I63-Q123 PolarHBondContact N-O 3.11Å; I63-V125 HydrophobicContact CD1-CG2 4.25Å; I63-V125 HydrophobicContact CG1-CG2 3.64Å
64	V	96.7	Very high	82.8	Confident	49 Å²	49	50.3 Å²	50.3	30%	0.297	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-36.1	177	-65.6	0	0	0	0	112.5	R62 D72 Q74 T107 R121	R62-V64 PolarHBondContact O-N 2.88Å; V64-D72 HydrophobicContact CG2-CB 3.7Å; V64-D72 WeakPolarHBondContact CG2-O 3.28Å; V64-D72 PolarHBondContact N-O 3.49Å; V64-Q74 HydrophobicContact CG1-CB 3.57Å; V64-T107 HydrophobicContact CG2-CG2 4.04Å; V64-R121 VanDerWaalsContact O-CD 3.28Å; V64-R121 WeakPolarHBondContact O-CD 3.41Å; V64-R121 PolarHBondContact O-NE 3.1Å
65	A	95.3	Very high	85.3	Confident	23 Å²	23	47.5 Å²	47.5	19%	0.19	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	150.6	178.6	0	0	0	0	0	111.7	D72	A65-D72 HydrophobicContact CB-CB 4.17Å; A65-D72 PolarHBondContact N-O 2.92Å; A65-D72 PolarHBondContact O-N 2.8Å
66	V	95.8	Very high	87.3	Confident	49 Å²	49	43.9 Å²	43.9	30%	0.297	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	118.5	175.6	-178	0	0	0	0	106.9	I63 V71 L119	I63-V66 HydrophobicContact CG2-CG2 3.69Å; V66-V71 HydrophobicContact CG1-CG2 4.35Å; V66-V71 HydrophobicContact CG2-CG1 4.35Å; V66-L119 HydrophobicContact CG1-CD1 4.37Å; V66-L119 HydrophobicContact CG2-CB 3.96Å; V66-L119 HydrophobicContact CG2-CD1 4.21Å
67	I	93.1	Very high	89.7	Confident	98 Å²	98	46.5 Å²	46.5	50%	0.503	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	94.3	-178.4	-55.8	172.6	0	0	0	107.6	A69 V70	I67-A69 PolarHBondContact O-N 2.89Å; I67-V70 PolarHBondContact N-O 2.8Å; I67-V70 PolarHBondContact O-N 3.46Å
68	G	92.3	Very high	91.2	Very high	48 Å²	48	45.1 Å²	45.1	50%	0.495	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	-122.6	-173.5	0	0	0	0	0	111.2	V70 T116	G68-V70 VanDerWaalsContact C-N 3.33Å; G68-T116 WeakPolarHBondContact O-CG2 3.36Å; G68-T116 PolarHBondContact O-OG1 2.98Å
69	A	93.4	Very high	92.6	Very high	12 Å²	12	47.2 Å²	47.2	10%	0.099	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.1	177.1	0	0	0	0	0	114.3	I67 A112 P276 L321	I67-A69 PolarHBondContact O-N 2.89Å; A69-A112 WeakPolarHBondContact O-CB 3.45Å; A69-A112 PolarHBondContact O-N 2.96Å; A69-P276 HydrophobicContact CB-CG 4.28Å; A69-L321 HydrophobicContact CB-CD1 4.04Å
70	V	96.1	Very high	93.4	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.024	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.6	178.2	173.3	0	0	0	0	109.8	I67 G68 R109 T110 L321 L322	I67-V70 PolarHBondContact N-O 2.8Å; I67-V70 PolarHBondContact O-N 3.46Å; G68-V70 VanDerWaalsContact C-N 3.33Å; V70-R109 HydrophobicContact CG1-CG 3.58Å; V70-T110 WeakPolarHBondContact CA-O 3.36Å; V70-L321 HydrophobicContact CB-CB 4.49Å; V70-L321 HydrophobicContact CG2-CB 3.49Å; V70-L321 VanDerWaalsContact CG2-CB 3.49Å; V70-L321 HydrophobicContact CG2-CD1 4.4Å; V70-L322 HydrophobicContact CG2-CD2 4.23Å
71	V	97.1	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.7	-179.1	-177.2	0	0	0	0	108.6	I63 V66 V73 L97 T110 T116 L119	I63-V71 HydrophobicContact CD1-CG1 4.2Å; I63-V71 HydrophobicContact CG1-CG1 4.19Å; I63-V71 HydrophobicContact CG2-CG1 3.88Å; V66-V71 HydrophobicContact CG1-CG2 4.35Å; V66-V71 HydrophobicContact CG2-CG1 4.35Å; V71-V73 HydrophobicContact CG1-CG2 4.1Å; V71-L97 HydrophobicContact CB-CD1 4.11Å; V71-L97 HydrophobicContact CB-CD2 4.33Å; V71-L97 HydrophobicContact CG1-CD1 3.96Å; V71-L97 HydrophobicContact CG2-CD2 4.09Å; V71-T110 PolarHBondContact N-O 2.88Å; V71-T110 WeakPolarHBondContact O-CA 3.37Å; V71-T110 WeakPolarHBondContact O-CB 3.39Å; V71-T110 PolarHBondContact O-N 2.72Å; V71-T110 PolarHBondContact O-OG1 2.64Å; V71-T116 HydrophobicContact CG2-CG2 3.99Å; V71-L119 HydrophobicContact CG2-CD1 3.82Å
72	D	97.3	Very high	93.7	Very high	15 Å²	15	51.4 Å²	51.4	8%	0.08	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.4	174.4	-67.8	-19.9	0	0	0	108.6	V64 A65 T107 V108 R109	V64-D72 HydrophobicContact CG2-CB 3.7Å; V64-D72 WeakPolarHBondContact CG2-O 3.28Å; V64-D72 PolarHBondContact N-O 3.49Å; A65-D72 HydrophobicContact CB-CB 4.17Å; A65-D72 PolarHBondContact N-O 2.92Å; A65-D72 PolarHBondContact O-N 2.8Å; D72-T107 HydrophobicContact CB-CG2 4.15Å; D72-V108 WeakPolarHBondContact CA-O 3.26Å; D72-R109 WeakPolarHBondContact OD1-CA 3.32Å; D72-R109 WeakPolarHBondContact OD1-CB 3.34Å; D72-R109 WeakPolarHBondContact OD1-CG 3.46Å; D72-R109 IonicContact OD1-CZ 2.97Å; D72-R109 IonicContact OD1-NE 2.82Å; D72-R109 PolarHBondContact OD1-NE 2.91Å; D72-R109 IonicContact OD1-NH2 2.87Å; D72-R109 IonicContact OD2-CZ 3.79Å; D72-R109 IonicContact OD2-NE 3.19Å; D72-R109 IonicContact OD2-NH2 3.77Å; D72-R109 PolarHBondContact OD2-NH2 3.28Å; D72-R109 VanDerWaalsContact OD2-NH2 3.11Å
73	V	97.3	Very high	93.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125.1	-176.6	-174.8	0	0	0	0	109	R62 V71 F75 L86 L97 T107 V108 T110 V125	R62-V73 WeakPolarHBondContact O-CA 3.36Å; V71-V73 HydrophobicContact CG1-CG2 4.1Å; V73-F75 HydrophobicContact CB-CE2 4.1Å; V73-F75 HydrophobicContact CG1-CD2 4.16Å; V73-F75 HydrophobicContact CG1-CE2 3.56Å; V73-F75 HydrophobicContact CG1-CZ 4.01Å; V73-L86 HydrophobicContact CG2-CD1 4.42Å; V73-L97 HydrophobicContact CG2-CD1 4.05Å; V73-T107 WeakPolarHBondContact O-CA 3.14Å; V73-V108 HydrophobicContact CB-CG2 4.07Å; V73-V108 PolarHBondContact N-O 2.81Å; V73-V108 WeakPolarHBondContact O-CG2 3.43Å; V73-V108 PolarHBondContact O-N 2.96Å; V73-T110 HydrophobicContact CG2-CG2 4.36Å; V73-V125 HydrophobicContact CG1-CB 3.86Å; V73-V125 HydrophobicContact CG1-CG1 4.13Å; V73-V125 HydrophobicContact CG1-CG2 3.95Å; V73-V125 HydrophobicContact CG2-CG1 4.48Å; V73-V125 HydrophobicContact CG2-CG2 4.17Å
74	Q	96.7	Very high	93.6	Very high	73 Å²	73	48.3 Å²	48.3	34%	0.341	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133.2	176.3	-175.3	172.9	45.5	0	0	110.3	G61 R62 V64 E105	G61-Q74 CarbonylContact C-O 3.45Å; G61-Q74 WeakPolarHBondContact CA-O 3.12Å; R62-Q74 PolarHBondContact N-O 3.25Å; R62-Q74 PolarHBondContact O-N 2.93Å; V64-Q74 HydrophobicContact CG1-CB 3.57Å; Q74-E105 PolarHBondContact NE2-O 3.38Å
75	F	94.9	Very high	93.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.009	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.8	176.5	-74	-95.4	0	0	0	109.9	A59 V73 L79 P80 L86 S106 V108 D127	A59-F75 HydrophobicContact CB-CD1 4Å; A59-F75 HydrophobicContact CB-CE1 4.2Å; V73-F75 HydrophobicContact CB-CE2 4.1Å; V73-F75 HydrophobicContact CG1-CD2 4.16Å; V73-F75 HydrophobicContact CG1-CE2 3.56Å; V73-F75 HydrophobicContact CG1-CZ 4.01Å; F75-L79 HydrophobicContact CB-CD1 4.41Å; F75-L79 HydrophobicContact CD2-CD1 4.49Å; F75-P80 HydrophobicContact CD2-CG 4.18Å; F75-P80 HydrophobicContact CE1-CG 4.39Å; F75-P80 HydrophobicContact CE2-CG 3.66Å; F75-P80 HydrophobicContact CZ-CG 3.78Å; F75-L86 HydrophobicContact CE2-CD1 4.03Å; F75-L86 HydrophobicContact CZ-CD1 3.88Å; F75-L86 HydrophobicContact CZ-CD2 4.01Å; F75-S106 PolarHBondContact N-O 3.27Å; F75-S106 WeakPolarHBondContact O-CB 3.21Å; F75-V108 HydrophobicContact CD2-CG2 4.14Å; F75-V108 HydrophobicContact CE2-CG2 3.7Å; F75-D127 HydrophobicContact CE1-CB 4.39Å
76	D	87.3	Confident	93.6	Very high	106 Å²	106	45.2 Å²	45.2	57%	0.567	26%	0.264	S	S	*	.	S	Bend	trans	-72.8	-42.3	176.3	-66.6	-35.6	0	0	0	110	R62	R62-D76 IonicContact CZ-OD2 3.96Å; R62-D76 IonicContact NE-OD2 3.89Å; R62-D76 IonicContact NH2-OD2 3.3Å; R62-D76 PolarHBondContact NH2-OD2 3.13Å
77	E	83.4	Confident	93.7	Very high	168 Å²	168	44.9 Å²	44.9	79%	0.785	26%	0.259	S	S	*	.	S	Bend	trans	-144.1	151.2	175.7	-65.2	-179.6	-177.2	0	0	109.9
78	G	82.6	Confident	93.8	Very high	52 Å²	52	40.7 Å²	40.7	54%	0.536	24%	0.238	S	C	.	.			trans	72.1	76.3	174.3	0	0	0	0	0	113.9	A59 P80	A59-G78 WeakPolarHBondContact CB-O 3.43Å; G78-P80 WeakPolarHBondContact O-CD 3.14Å
79	L	91.5	Very high	93.8	Very high	72 Å²	72	41.9 Å²	41.9	38%	0.377	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-69.1	122	178.9	-158.1	72.2	0	0	0	110.6	F75 H102 S106 V108	F75-L79 HydrophobicContact CB-CD1 4.41Å; F75-L79 HydrophobicContact CD2-CD1 4.49Å; L79-H102 HydrophobicContact CD2-CB 4.35Å; L79-S106 WeakPolarHBondContact CD1-O 3.31Å; L79-V108 HydrophobicContact CD1-CG1 3.52Å; L79-V108 HydrophobicContact CD2-CG1 4.36Å; L79-V108 HydrophobicContact CG-CG1 3.77Å
80	P	94.1	Very high	93.5	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.013	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-68.3	142.1	-179.1	26.3	-33.7	0	0	0	111.2	F75 G78 N84 L86 V99 H102 V108	F75-P80 HydrophobicContact CD2-CG 4.18Å; F75-P80 HydrophobicContact CE1-CG 4.39Å; F75-P80 HydrophobicContact CE2-CG 3.66Å; F75-P80 HydrophobicContact CZ-CG 3.78Å; G78-P80 WeakPolarHBondContact O-CD 3.14Å; P80-N84 HydrophobicContact CB-CB 4.22Å; P80-L86 HydrophobicContact CB-CD2 4.11Å; P80-L86 HydrophobicContact CG-CD2 3.98Å; P80-V99 HydrophobicContact CB-CG2 4.28Å; P80-V99 HydrophobicContact CG-CG2 3.99Å; P80-H102 PolarHBondContact O-CE1 2.87Å; P80-H102 PolarHBondContact O-NE2 3.25Å; P80-V108 HydrophobicContact CG-CG1 4.16Å; P80-V108 HydrophobicContact CG-CG2 4.36Å
81	P	94.6	Very high	93.2	Very high	78 Å²	78	48 Å²	48	51%	0.506	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-56.7	161	172.8	-25.2	34.2	0	0	0	113.4	N84 V99	P81-N84 WeakPolarHBondContact O-CB 3.35Å; P81-N84 PolarHBondContact O-N 3.22Å; P81-V99 WeakPolarHBondContact O-CB 3.39Å
82	I	95.8	Very high	92.7	Very high	92 Å²	92	57.2 Å²	57.2	47%	0.472	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	145.6	170	-58	169.9	0	0	0	108.5	N84	I82-N84 VanDerWaalsContact C-N 3.26Å; I82-N84 PolarHBondContact O-N 3.08Å
83	L	95.5	Very high	92.3	Very high	61 Å²	61	60.1 Å²	60.1	32%	0.319	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	-0.1	-174.7	-46.5	179.5	0	0	0	115.9	V99 P131 H167	L83-V99 WeakPolarHBondContact CA-O 3.07Å; L83-V99 PolarHBondContact N-O 2.74Å; L83-P131 VanDerWaalsContact O-CA 3.24Å; L83-P131 WeakPolarHBondContact O-CA 3.47Å; L83-P131 WeakPolarHBondContact O-CB 3.33Å; L83-H167 HydrophobicContact CD1-CB 4.12Å
84	N	95.5	Very high	92.1	Very high	11 Å²	11	63.2 Å²	63.2	6%	0.059	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	147	172.5	-98.4	26.5	0	0	0	112.1	P80 P81 I82 E98 V99 D127 G129 A130	P80-N84 HydrophobicContact CB-CB 4.22Å; P81-N84 WeakPolarHBondContact O-CB 3.35Å; P81-N84 PolarHBondContact O-N 3.22Å; I82-N84 VanDerWaalsContact C-N 3.26Å; I82-N84 PolarHBondContact O-N 3.08Å; N84-E98 WeakPolarHBondContact O-CA 3.12Å; N84-V99 HydrophobicContact CB-CG2 4.42Å; N84-V99 PolarHBondContact O-N 3.39Å; N84-D127 PolarHBondContact ND2-OD1 2.73Å; N84-D127 VanDerWaalsContact ND2-OD1 3.14Å; N84-G129 VanDerWaalsContact ND2-C 3.31Å; N84-G129 WeakPolarHBondContact ND2-CA 3.3Å; N84-A130 WeakPolarHBondContact CA-O 3.44Å; N84-A130 PolarHBondContact ND2-N 3.36Å; N84-A130 VanDerWaalsContact OD1-C 3.31Å; N84-A130 WeakPolarHBondContact OD1-CA 3.46Å
85	A	96.4	Very high	92	Very high	7 Å²	7	59.8 Å²	59.8	6%	0.058	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135.1	172.6	0	0	0	0	0	111	V96 L97 S128 A130 I132	A85-V96 HydrophobicContact CB-CG1 3.95Å; A85-L97 CarbonylContact C-O 3.49Å; A85-L97 WeakPolarHBondContact CA-O 3.38Å; A85-S128 VanDerWaalsContact O-CB 3.27Å; A85-S128 WeakPolarHBondContact O-CB 3.47Å; A85-S128 PolarHBondContact O-N 3.39Å; A85-S128 PolarHBondContact O-OG 3.29Å; A85-A130 PolarHBondContact N-O 2.78Å; A85-I132 HydrophobicContact CB-CG1 3.75Å
86	L	96	Very high	92.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.2	174.5	-46.4	-179.4	0	0	0	110	V73 F75 P80 V96 L97 V99 V108 T110 V125 L126 D127	V73-L86 HydrophobicContact CG2-CD1 4.42Å; F75-L86 HydrophobicContact CE2-CD1 4.03Å; F75-L86 HydrophobicContact CZ-CD1 3.88Å; F75-L86 HydrophobicContact CZ-CD2 4.01Å; P80-L86 HydrophobicContact CB-CD2 4.11Å; P80-L86 HydrophobicContact CG-CD2 3.98Å; L86-V96 CarbonylContact O-C 3.56Å; L86-V96 WeakPolarHBondContact O-CA 3.46Å; L86-L97 HydrophobicContact CB-CB 4.28Å; L86-L97 PolarHBondContact N-O 3.05Å; L86-L97 PolarHBondContact O-N 3.31Å; L86-V99 HydrophobicContact CD1-CG2 3.89Å; L86-V99 HydrophobicContact CD2-CG2 4.15Å; L86-V99 HydrophobicContact CG-CG2 3.93Å; L86-V108 HydrophobicContact CD1-CG2 4.3Å; L86-T110 HydrophobicContact CD1-CG2 3.73Å; L86-V125 HydrophobicContact CB-CG1 3.53Å; L86-V125 HydrophobicContact CD1-CG1 3.97Å; L86-V125 HydrophobicContact CG-CG1 4.35Å; L86-L126 CarbonylContact C-O 3.58Å; L86-L126 VanDerWaalsContact CA-O 3.26Å; L86-L126 WeakPolarHBondContact CA-O 3.4Å; L86-D127 HydrophobicContact CD2-CB 3.86Å
87	E	96.1	Very high	92.6	Very high	42 Å²	42	54.9 Å²	54.9	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.7	179.6	-65.1	-164.4	160.7	0	0	111.9	Q89 R94 V125 L126	E87-Q89 PolarHBondContact O-NE2 3.03Å; E87-R94 IonicContact OE1-CZ 3.66Å; E87-R94 VanDerWaalsContact OE1-CZ 3.26Å; E87-R94 IonicContact OE1-NE 2.78Å; E87-R94 PolarHBondContact OE1-NE 3.45Å; E87-R94 IonicContact OE1-NH2 3.65Å; E87-R94 PolarHBondContact OE1-NH2 3.02Å; E87-V125 WeakPolarHBondContact O-CA 3.45Å; E87-L126 PolarHBondContact N-O 3.36Å; E87-L126 PolarHBondContact O-N 2.75Å
88	V	95.2	Very high	93.2	Very high	10 Å²	10	46.9 Å²	46.9	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.3	177.4	-174.4	0	0	0	0	110.3	I63 L95 L97 L119 Q123 V125	I63-V88 HydrophobicContact CD1-CG1 4.16Å; V88-L95 HydrophobicContact CB-CB 4.34Å; V88-L95 HydrophobicContact CB-CD2 4.24Å; V88-L95 HydrophobicContact CG2-CB 4.45Å; V88-L95 HydrophobicContact CG2-CD2 3.82Å; V88-L95 HydrophobicContact CG2-CG 4.1Å; V88-L95 PolarHBondContact N-O 3.22Å; V88-L95 VanDerWaalsContact N-O 3.13Å; V88-L97 HydrophobicContact CG2-CD1 3.6Å; V88-L97 HydrophobicContact CG2-CD2 4.37Å; V88-L97 HydrophobicContact CG2-CG 3.85Å; V88-L119 HydrophobicContact CG1-CD2 3.83Å; V88-Q123 HydrophobicContact CG1-CG 3.9Å; V88-V125 HydrophobicContact CG2-CG2 4.3Å
89	Q	94	Very high	93.9	Very high	73 Å²	73	44.4 Å²	44.4	34%	0.341	24%	0.244	S	C	.	.	S	Bend	trans	-89.1	152.5	-176.4	-58.5	-58.5	-58.6	0	0	112.7	E87 Q123 K124 L126	E87-Q89 PolarHBondContact O-NE2 3.03Å; Q89-Q123 PolarHBondContact O-NE2 2.94Å; Q89-K124 HydrophobicContact CB-CB 4.23Å; Q89-K124 HydrophobicContact CG-CB 4.36Å; Q89-K124 PolarHBondContact N-O 3.27Å; Q89-L126 VanDerWaalsContact CD-CD1 3.43Å; Q89-L126 HydrophobicContact CG-CD1 3.95Å; Q89-L126 HydrophobicContact CG-CG 3.74Å; Q89-L126 VanDerWaalsContact NE2-CD1 3.35Å
90	G	86.9	Confident	94.1	Very high	80 Å²	80	41.7 Å²	41.7	83%	0.825	23%	0.232	S	C	*	.	S	Bend	trans	77.5	29.7	173.5	0	0	0	0	0	114.4
91	R	88.9	Confident	94.2	Very high	63 Å²	63	44.1 Å²	44.1	24%	0.238	24%	0.243	C	C	.	.			trans	-112.7	153	170.8	-66.4	-179.4	68.3	92	-6.6	110.1	T93 G115 E117	R91-T93 VanDerWaalsContact CB-O 3.22Å; R91-T93 WeakPolarHBondContact CB-O 3.34Å; R91-G115 PolarHBondContact NH2-O 3.17Å; R91-E117 PolarHBondContact NH1-O 2.89Å; R91-E117 PolarHBondContact NH2-O 2.83Å; R91-E117 VanDerWaalsContact NH2-O 3.13Å
92	E	86.1	Confident	94.2	Very high	195 Å²	195	44.4 Å²	44.4	91%	0.911	24%	0.238	S	C	*	.	S	Bend	trans	-71.3	-42.6	172.1	-65.2	-178.9	177.1	0	0	111.1
93	T	89.1	Confident	94.1	Very high	76 Å²	76	43.8 Å²	43.8	47%	0.466	24%	0.235	S	C	.	.	S	Bend	trans	-94.6	142	173.5	60.4	0	0	0	0	111	R91 L95	R91-T93 VanDerWaalsContact CB-O 3.22Å; R91-T93 WeakPolarHBondContact CB-O 3.34Å; T93-L95 PolarHBondContact O-N 2.92Å
94	R	92.7	Very high	93.9	Very high	64 Å²	64	43 Å²	43	24%	0.242	24%	0.241	C	C	.	.			trans	-71	115.1	178.2	-172.8	-171	178.4	-158.3	-4.8	109.6	S51 E87 V96 E150	S51-R94 VanDerWaalsContact OG-CZ 3.23Å; S51-R94 PolarHBondContact OG-NH2 3.28Å; E87-R94 IonicContact OE1-CZ 3.66Å; E87-R94 VanDerWaalsContact OE1-CZ 3.26Å; E87-R94 IonicContact OE1-NE 2.78Å; E87-R94 PolarHBondContact OE1-NE 3.45Å; E87-R94 IonicContact OE1-NH2 3.65Å; E87-R94 PolarHBondContact OE1-NH2 3.02Å; R94-V96 HydrophobicContact CG-CG2 4.4Å; R94-E150 WeakPolarHBondContact CD-OE1 3.35Å; R94-E150 IonicContact CZ-OE1 2.8Å; R94-E150 IonicContact NE-OE1 3.81Å; R94-E150 IonicContact NH1-OE1 2.79Å; R94-E150 PolarHBondContact NH1-OE1 3.45Å
95	L	95.1	Very high	93.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	28%	0.276	C	S	.	.			trans	-107	116.3	175	175.9	65	0	0	0	110.1	V88 T93 L97 A112 D114 L119	V88-L95 HydrophobicContact CB-CB 4.34Å; V88-L95 HydrophobicContact CB-CD2 4.24Å; V88-L95 HydrophobicContact CG2-CB 4.45Å; V88-L95 HydrophobicContact CG2-CD2 3.82Å; V88-L95 HydrophobicContact CG2-CG 4.1Å; V88-L95 PolarHBondContact N-O 3.22Å; V88-L95 VanDerWaalsContact N-O 3.13Å; T93-L95 PolarHBondContact O-N 2.92Å; L95-L97 HydrophobicContact CD1-CD2 4.31Å; L95-L97 HydrophobicContact CD2-CD2 4.22Å; L95-L97 HydrophobicContact CG-CD2 4.1Å; L95-A112 HydrophobicContact CD1-CB 4.23Å; L95-D114 HydrophobicContact CD1-CB 3.72Å; L95-L119 HydrophobicContact CD2-CD1 3.93Å; L95-L119 HydrophobicContact CD2-CD2 3.78Å; L95-L119 HydrophobicContact CD2-CG 4.19Å
96	V	97.1	Very high	93.5	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.03	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134.5	173.9	-178.1	0	0	0	0	109.5	A85 L86 R94 M113 I132 I148	A85-V96 HydrophobicContact CB-CG1 3.95Å; L86-V96 CarbonylContact O-C 3.56Å; L86-V96 WeakPolarHBondContact O-CA 3.46Å; R94-V96 HydrophobicContact CG-CG2 4.4Å; V96-M113 HydrophobicContact CB-CB 4.47Å; V96-M113 HydrophobicContact CB-CG 4.43Å; V96-M113 WeakPolarHBondContact O-CB 3.26Å; V96-M113 PolarHBondContact O-N 3.39Å; V96-I132 HydrophobicContact CG1-CD1 4.27Å; V96-I132 HydrophobicContact CG1-CG1 4.13Å; V96-I148 HydrophobicContact CB-CG2 4.08Å; V96-I148 HydrophobicContact CG1-CG2 4.47Å; V96-I148 HydrophobicContact CG2-CD1 4.08Å; V96-I148 HydrophobicContact CG2-CG2 4.07Å
97	L	97.3	Very high	93.5	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.2	172.6	-49.8	175.8	0	0	0	108.8	V71 V73 A85 L86 V88 L95 T110 I111 A112	V71-L97 HydrophobicContact CB-CD1 4.11Å; V71-L97 HydrophobicContact CB-CD2 4.33Å; V71-L97 HydrophobicContact CG1-CD1 3.96Å; V71-L97 HydrophobicContact CG2-CD2 4.09Å; V73-L97 HydrophobicContact CG2-CD1 4.05Å; A85-L97 CarbonylContact C-O 3.49Å; A85-L97 WeakPolarHBondContact CA-O 3.38Å; L86-L97 HydrophobicContact CB-CB 4.28Å; L86-L97 PolarHBondContact N-O 3.05Å; L86-L97 PolarHBondContact O-N 3.31Å; V88-L97 HydrophobicContact CG2-CD1 3.6Å; V88-L97 HydrophobicContact CG2-CD2 4.37Å; V88-L97 HydrophobicContact CG2-CG 3.85Å; L95-L97 HydrophobicContact CD1-CD2 4.31Å; L95-L97 HydrophobicContact CD2-CD2 4.22Å; L95-L97 HydrophobicContact CG-CD2 4.1Å; L97-T110 HydrophobicContact CB-CG2 4.43Å; L97-I111 CarbonylContact C-O 3.58Å; L97-I111 WeakPolarHBondContact CA-O 3.44Å; L97-A112 HydrophobicContact CD2-CB 3.68Å
98	E	97.5	Very high	93.5	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.5	173.1	-175.4	-170.5	95	0	0	110.4	N84 A100 T110 I111 M113 H167 R281	N84-E98 WeakPolarHBondContact O-CA 3.12Å; E98-A100 PolarHBondContact O-N 3.09Å; E98-T110 CarbonylContact O-C 3.57Å; E98-T110 WeakPolarHBondContact O-CA 3.31Å; E98-T110 VanDerWaalsContact O-CB 3.26Å; E98-T110 WeakPolarHBondContact O-CB 3.43Å; E98-I111 PolarHBondContact N-O 3.23Å; E98-I111 PolarHBondContact O-N 2.87Å; E98-M113 HydrophobicContact CB-CE 3.57Å; E98-H167 IonicContact OE1-NE2 3.11Å; E98-H167 IonicContact OE2-CD2 3.71Å; E98-H167 IonicContact OE2-CE1 3.73Å; E98-H167 IonicContact OE2-NE2 2.92Å; E98-H167 PolarHBondContact OE2-NE2 3.09Å; E98-R281 VanDerWaalsContact CD-NE 3.27Å; E98-R281 IonicContact OE1-CZ 3.91Å; E98-R281 IonicContact OE1-NE 3.79Å; E98-R281 PolarHBondContact OE1-NE 2.97Å; E98-R281 IonicContact OE1-NH2 2.94Å; E98-R281 PolarHBondContact OE1-NH2 3.43Å; E98-R281 WeakPolarHBondContact OE2-CD 3.46Å; E98-R281 IonicContact OE2-NE 3.76Å; E98-R281 PolarHBondContact OE2-NE 3.26Å
99	V	97.3	Very high	93.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	119.6	176.9	-178.8	0	0	0	0	110.6	P80 P81 L83 N84 L86 V108 T110	P80-V99 HydrophobicContact CB-CG2 4.28Å; P80-V99 HydrophobicContact CG-CG2 3.99Å; P81-V99 WeakPolarHBondContact O-CB 3.39Å; L83-V99 WeakPolarHBondContact CA-O 3.07Å; L83-V99 PolarHBondContact N-O 2.74Å; N84-V99 HydrophobicContact CB-CG2 4.42Å; N84-V99 PolarHBondContact O-N 3.39Å; L86-V99 HydrophobicContact CD1-CG2 3.89Å; L86-V99 HydrophobicContact CD2-CG2 4.15Å; L86-V99 HydrophobicContact CG-CG2 3.93Å; V99-V108 HydrophobicContact CG1-CB 3.97Å; V99-V108 HydrophobicContact CG1-CG1 4.23Å; V99-V108 HydrophobicContact CG1-CG2 4.47Å; V99-V108 HydrophobicContact CG2-CG2 4.25Å; V99-T110 HydrophobicContact CB-CG2 4.46Å; V99-T110 HydrophobicContact CG2-CG2 3.99Å
100	A	95.6	Very high	93.8	Very high	15 Å²	15	50.3 Å²	50.3	12%	0.124	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-38.4	-180	0	0	0	0	0	113.1	E98 R109 I111 L322	E98-A100 PolarHBondContact O-N 3.09Å; A100-R109 PolarHBondContact N-O 3.49Å; A100-I111 HydrophobicContact CB-CD1 3.73Å; A100-I111 HydrophobicContact CB-CG1 4.04Å; A100-L322 HydrophobicContact CB-CD1 4.31Å; A100-L322 HydrophobicContact CB-CD2 4.07Å
101	Q	94.9	Very high	94.3	Very high	53 Å²	53	46.7 Å²	46.7	25%	0.248	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	157.1	-175.6	-62	177.5	-36.1	0	0	111.8	V108 R109	Q101-V108 WeakPolarHBondContact O-CA 3.36Å; Q101-R109 HydrophobicContact CB-CB 4.23Å; Q101-R109 PolarHBondContact N-O 3.03Å; Q101-R109 PolarHBondContact O-N 3.14Å
102	H	96.4	Very high	94.6	Very high	85 Å²	85	43.7 Å²	43.7	39%	0.394	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.3	167.9	-63.2	174.1	0	0	0	109	L79 P80	L79-H102 HydrophobicContact CD2-CB 4.35Å; P80-H102 PolarHBondContact O-CE1 2.87Å; P80-H102 PolarHBondContact O-NE2 3.25Å
103	L	92.9	Very high	95.1	Very high	79 Å²	79	34.9 Å²	34.9	41%	0.414	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-18.8	-175.6	-61.1	179.8	0	0	0	113.3	T107 R109	L103-T107 HydrophobicContact CD1-CG2 4.2Å; L103-T107 PolarHBondContact N-O 3.11Å; L103-R109 HydrophobicContact CD1-CB 4.13Å; L103-R109 HydrophobicContact CD2-CB 4.19Å; L103-R109 HydrophobicContact CG-CB 4.08Å
104	G	90.5	Very high	95.4	Very high	43 Å²	43	34.6 Å²	34.6	44%	0.443	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	103.4	174.7	-166.9	0	0	0	0	0	111.7	S106 T107	G104-S106 PolarHBondContact O-N 2.92Å; G104-S106 VanDerWaalsContact O-N 3.12Å; G104-T107 WeakPolarHBondContact O-CB 3.44Å; G104-T107 PolarHBondContact O-N 3.42Å
105	E	90.4	Very high	95.4	Very high	173 Å²	173	32.4 Å²	32.4	81%	0.808	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	40.7	-178.1	-60.2	-173	167.1	0	0	113.6	Q74 T107	Q74-E105 PolarHBondContact NE2-O 3.38Å; E105-T107 PolarHBondContact O-N 3.32Å; E105-T107 VanDerWaalsContact O-N 3.1Å; E105-T107 PolarHBondContact O-OG1 2.82Å
106	S	93.3	Very high	95.4	Very high	61 Å²	61	33.6 Å²	33.6	43%	0.427	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	28.6	-175.7	-53.7	0	0	0	0	114.7	F75 L79 G104	F75-S106 PolarHBondContact N-O 3.27Å; F75-S106 WeakPolarHBondContact O-CB 3.21Å; L79-S106 WeakPolarHBondContact CD1-O 3.31Å; G104-S106 PolarHBondContact O-N 2.92Å; G104-S106 VanDerWaalsContact O-N 3.12Å
107	T	95.8	Very high	95.1	Very high	17 Å²	17	40.2 Å²	40.2	10%	0.104	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.1	178.3	-56.1	0	0	0	0	110.8	V64 D72 V73 L103 G104 E105	V64-T107 HydrophobicContact CG2-CG2 4.04Å; D72-T107 HydrophobicContact CB-CG2 4.15Å; V73-T107 WeakPolarHBondContact O-CA 3.14Å; L103-T107 HydrophobicContact CD1-CG2 4.2Å; L103-T107 PolarHBondContact N-O 3.11Å; G104-T107 WeakPolarHBondContact O-CB 3.44Å; G104-T107 PolarHBondContact O-N 3.42Å; E105-T107 PolarHBondContact O-N 3.32Å; E105-T107 VanDerWaalsContact O-N 3.1Å; E105-T107 PolarHBondContact O-OG1 2.82Å
108	V	96.9	Very high	94.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.1	171.8	-57.4	0	0	0	0	110.2	D72 V73 F75 L79 P80 L86 V99 Q101 T110	D72-V108 WeakPolarHBondContact CA-O 3.26Å; V73-V108 HydrophobicContact CB-CG2 4.07Å; V73-V108 PolarHBondContact N-O 2.81Å; V73-V108 WeakPolarHBondContact O-CG2 3.43Å; V73-V108 PolarHBondContact O-N 2.96Å; F75-V108 HydrophobicContact CD2-CG2 4.14Å; F75-V108 HydrophobicContact CE2-CG2 3.7Å; L79-V108 HydrophobicContact CD1-CG1 3.52Å; L79-V108 HydrophobicContact CD2-CG1 4.36Å; L79-V108 HydrophobicContact CG-CG1 3.77Å; P80-V108 HydrophobicContact CG-CG1 4.16Å; P80-V108 HydrophobicContact CG-CG2 4.36Å; L86-V108 HydrophobicContact CD1-CG2 4.3Å; V99-V108 HydrophobicContact CG1-CB 3.97Å; V99-V108 HydrophobicContact CG1-CG1 4.23Å; V99-V108 HydrophobicContact CG1-CG2 4.47Å; V99-V108 HydrophobicContact CG2-CG2 4.25Å; Q101-V108 WeakPolarHBondContact O-CA 3.36Å; V108-T110 HydrophobicContact CG2-CG2 3.83Å
109	R	97.4	Very high	94.7	Very high	47 Å²	47	44.6 Å²	44.6	18%	0.177	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126	170.9	178.4	158.8	-71.2	169.5	1.8	109	V70 D72 A100 Q101 L103 L322	V70-R109 HydrophobicContact CG1-CG 3.58Å; D72-R109 WeakPolarHBondContact OD1-CA 3.32Å; D72-R109 WeakPolarHBondContact OD1-CB 3.34Å; D72-R109 WeakPolarHBondContact OD1-CG 3.46Å; D72-R109 IonicContact OD1-CZ 2.97Å; D72-R109 IonicContact OD1-NE 2.82Å; D72-R109 PolarHBondContact OD1-NE 2.91Å; D72-R109 IonicContact OD1-NH2 2.87Å; D72-R109 IonicContact OD2-CZ 3.79Å; D72-R109 IonicContact OD2-NE 3.19Å; D72-R109 IonicContact OD2-NH2 3.77Å; D72-R109 PolarHBondContact OD2-NH2 3.28Å; D72-R109 VanDerWaalsContact OD2-NH2 3.11Å; A100-R109 PolarHBondContact N-O 3.49Å; Q101-R109 HydrophobicContact CB-CB 4.23Å; Q101-R109 PolarHBondContact N-O 3.03Å; Q101-R109 PolarHBondContact O-N 3.14Å; L103-R109 HydrophobicContact CD1-CB 4.13Å; L103-R109 HydrophobicContact CD2-CB 4.19Å; L103-R109 HydrophobicContact CG-CB 4.08Å; R109-L322 VanDerWaalsContact CD-CD2 3.47Å; R109-L322 HydrophobicContact CG-CD2 3.61Å; R109-L322 PolarHBondContact NH1-O 3.15Å
110	T	97.4	Very high	94.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	159.7	-175.6	70.7	0	0	0	0	112.4	V70 V71 V73 L86 L97 E98 V99 V108	V70-T110 WeakPolarHBondContact CA-O 3.36Å; V71-T110 PolarHBondContact N-O 2.88Å; V71-T110 WeakPolarHBondContact O-CA 3.37Å; V71-T110 WeakPolarHBondContact O-CB 3.39Å; V71-T110 PolarHBondContact O-N 2.72Å; V71-T110 PolarHBondContact O-OG1 2.64Å; V73-T110 HydrophobicContact CG2-CG2 4.36Å; L86-T110 HydrophobicContact CD1-CG2 3.73Å; L97-T110 HydrophobicContact CB-CG2 4.43Å; E98-T110 CarbonylContact O-C 3.57Å; E98-T110 WeakPolarHBondContact O-CA 3.31Å; E98-T110 VanDerWaalsContact O-CB 3.26Å; E98-T110 WeakPolarHBondContact O-CB 3.43Å; V99-T110 HydrophobicContact CB-CG2 4.46Å; V99-T110 HydrophobicContact CG2-CG2 3.99Å; V108-T110 HydrophobicContact CG2-CG2 3.83Å
111	I	97	Very high	94.5	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.015	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128.5	176.7	-58.8	158.1	0	0	0	108	L97 E98 A100 M113 G277 V318 L322	L97-I111 CarbonylContact C-O 3.58Å; L97-I111 WeakPolarHBondContact CA-O 3.44Å; E98-I111 PolarHBondContact N-O 3.23Å; E98-I111 PolarHBondContact O-N 2.87Å; A100-I111 HydrophobicContact CB-CD1 3.73Å; A100-I111 HydrophobicContact CB-CG1 4.04Å; I111-M113 HydrophobicContact CB-CE 4.48Å; I111-M113 HydrophobicContact CG2-CE 4.35Å; I111-G277 VanDerWaalsContact CG2-CA 3.45Å; I111-V318 HydrophobicContact CD1-CG1 3.37Å; I111-V318 HydrophobicContact CG1-CG1 3.89Å; I111-V318 HydrophobicContact CG2-CG2 4.25Å; I111-L322 HydrophobicContact CG1-CD2 4.44Å
112	A	96.6	Very high	94.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	138.8	178.3	0	0	0	0	0	112.4	A69 L95 L97 T116	A69-A112 WeakPolarHBondContact O-CB 3.45Å; A69-A112 PolarHBondContact O-N 2.96Å; L95-A112 HydrophobicContact CD1-CB 4.23Å; L97-A112 HydrophobicContact CD2-CB 3.68Å; A112-T116 HydrophobicContact CB-CG2 3.46Å; A112-T116 VanDerWaalsContact CB-CG2 3.46Å
113	M	96	Very high	94.3	Very high	10 Å²	10	54.9 Å²	54.9	5%	0.049	31%	0.314	C	S	.	.	S	Bend	trans	-92.8	-5.5	175.4	-59.4	-59.4	146.8	0	0	113.3	V96 E98 I111 I132 V147 I148 G277 R281	V96-M113 HydrophobicContact CB-CB 4.47Å; V96-M113 HydrophobicContact CB-CG 4.43Å; V96-M113 WeakPolarHBondContact O-CB 3.26Å; V96-M113 PolarHBondContact O-N 3.39Å; E98-M113 HydrophobicContact CB-CE 3.57Å; I111-M113 HydrophobicContact CB-CE 4.48Å; I111-M113 HydrophobicContact CG2-CE 4.35Å; M113-I132 HydrophobicContact CE-CD1 4.27Å; M113-I132 HydrophobicContact CG-CD1 4.04Å; M113-I132 HydrophobicContact SD-CD1 4.31Å; M113-V147 HydrophobicContact CB-CG1 4.4Å; M113-I148 HydrophobicContact CB-CG2 4.23Å; M113-I148 HydrophobicContact CG-CG2 4.38Å; M113-G277 VanDerWaalsContact SD-C 3.56Å; M113-R281 HydrophobicContact CE-CG 3.93Å; M113-R281 HydrophobicContact SD-CB 4.46Å; M113-R281 HydrophobicContact SD-CG 4.17Å
114	D	95.1	Very high	94.5	Very high	71 Å²	71	57.6 Å²	57.6	38%	0.38	32%	0.322	S	S	.	.	S	Bend	trans	-145.1	177.1	176.3	-159.7	-5.1	0	0	0	109.3	L95 T116	L95-D114 HydrophobicContact CD1-CB 3.72Å; D114-T116 PolarHBondContact O-N 2.83Å
115	G	93.1	Very high	94.7	Very high	17 Å²	17	55.5 Å²	55.5	18%	0.175	30%	0.301	C	S	.	.			trans	-52.9	132.6	179.6	0	0	0	0	0	113.3	R91 E117	R91-G115 PolarHBondContact NH2-O 3.17Å; G115-E117 VanDerWaalsContact C-N 3.32Å; G115-E117 WeakPolarHBondContact CA-OE2 3.41Å
116	T	94.4	Very high	94.9	Very high	26 Å²	26	49.2 Å²	49.2	16%	0.16	27%	0.273	C	S	.	.			trans	-91.1	5.8	179.8	55.3	0	0	0	0	113	G68 V71 A112 D114 L119	G68-T116 WeakPolarHBondContact O-CG2 3.36Å; G68-T116 PolarHBondContact O-OG1 2.98Å; V71-T116 HydrophobicContact CG2-CG2 3.99Å; A112-T116 HydrophobicContact CB-CG2 3.46Å; A112-T116 VanDerWaalsContact CB-CG2 3.46Å; D114-T116 PolarHBondContact O-N 2.83Å; T116-L119 HydrophobicContact CG2-CD1 4Å; T116-L119 WeakPolarHBondContact O-CB 3.46Å; T116-L119 WeakPolarHBondContact O-CG 3.46Å; T116-L119 PolarHBondContact O-N 2.88Å
117	E	92.1	Very high	94.9	Very high	145 Å²	145	47.2 Å²	47.2	68%	0.678	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	139	175.7	-59	81	-176.8	0	0	110.6	R91 G115 L119	R91-E117 PolarHBondContact NH1-O 2.89Å; R91-E117 PolarHBondContact NH2-O 2.83Å; R91-E117 VanDerWaalsContact NH2-O 3.13Å; G115-E117 VanDerWaalsContact C-N 3.32Å; G115-E117 WeakPolarHBondContact CA-OE2 3.41Å; E117-L119 VanDerWaalsContact C-N 3.26Å; E117-L119 PolarHBondContact O-N 2.85Å
118	G	90.7	Very high	94.6	Very high	67 Å²	67	48.7 Å²	48.7	69%	0.691	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	4.9	-179.4	0	0	0	0	0	115.1
119	L	94.1	Very high	94.4	Very high	25 Å²	25	51.1 Å²	51.1	13%	0.131	29%	0.294	C	S	.	.			trans	-70.3	133	169.9	-70.3	-176.4	0	0	0	111.5	I63 V66 V71 V88 L95 T116 E117	I63-L119 HydrophobicContact CD1-CB 4.47Å; I63-L119 HydrophobicContact CD1-CD1 4.29Å; I63-L119 HydrophobicContact CD1-CD2 3.89Å; I63-L119 HydrophobicContact CD1-CG 4.47Å; V66-L119 HydrophobicContact CG1-CD1 4.37Å; V66-L119 HydrophobicContact CG2-CB 3.96Å; V66-L119 HydrophobicContact CG2-CD1 4.21Å; V71-L119 HydrophobicContact CG2-CD1 3.82Å; V88-L119 HydrophobicContact CG1-CD2 3.83Å; L95-L119 HydrophobicContact CD2-CD1 3.93Å; L95-L119 HydrophobicContact CD2-CD2 3.78Å; L95-L119 HydrophobicContact CD2-CG 4.19Å; T116-L119 HydrophobicContact CG2-CD1 4Å; T116-L119 WeakPolarHBondContact O-CB 3.46Å; T116-L119 WeakPolarHBondContact O-CG 3.46Å; T116-L119 PolarHBondContact O-N 2.88Å; E117-L119 VanDerWaalsContact C-N 3.26Å; E117-L119 PolarHBondContact O-N 2.85Å
120	V	94.3	Very high	94.2	Very high	96 Å²	96	49.7 Å²	49.7	58%	0.582	29%	0.292	S	S	*	.			trans	-119.9	140.9	-180	-173.3	0	0	0	0	109.9	Q123	V120-Q123 WeakPolarHBondContact O-CB 3Å; V120-Q123 PolarHBondContact O-N 3.12Å; V120-Q123 VanDerWaalsContact O-N 3.16Å
121	R	95.4	Very high	94.1	Very high	191 Å²	191	51.2 Å²	51.2	72%	0.721	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	139.6	174.4	-62.4	-179.1	-173.7	178.7	-0.5	110.5	I63 V64 Q123	I63-R121 CarbonylContact O-C 3.59Å; I63-R121 WeakPolarHBondContact O-CA 3.48Å; V64-R121 VanDerWaalsContact O-CD 3.28Å; V64-R121 WeakPolarHBondContact O-CD 3.41Å; V64-R121 PolarHBondContact O-NE 3.1Å; R121-Q123 VanDerWaalsContact C-N 3.3Å
122	G	93.4	Very high	94.1	Very high	46 Å²	46	51.4 Å²	51.4	47%	0.474	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-5.1	-174.5	0	0	0	0	0	114.5	I63	I63-G122 PolarHBondContact O-N 2.86Å
123	Q	94.4	Very high	94	Very high	35 Å²	35	55.9 Å²	55.9	16%	0.164	32%	0.322	C	S	.	.			trans	-61.8	139.7	174.2	-171.6	167.2	15.2	0	0	110.6	R62 I63 V88 Q89 V120 R121	R62-Q123 WeakPolarHBondContact CA-O 3.34Å; I63-Q123 HydrophobicContact CD1-CB 4.04Å; I63-Q123 HydrophobicContact CG1-CB 4.37Å; I63-Q123 PolarHBondContact N-O 3.11Å; V88-Q123 HydrophobicContact CG1-CG 3.9Å; Q89-Q123 PolarHBondContact O-NE2 2.94Å; V120-Q123 WeakPolarHBondContact O-CB 3Å; V120-Q123 PolarHBondContact O-N 3.12Å; V120-Q123 VanDerWaalsContact O-N 3.16Å; R121-Q123 VanDerWaalsContact C-N 3.3Å
124	K	95.2	Very high	94.1	Very high	136 Å²	136	55.4 Å²	55.4	59%	0.591	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.5	-175.6	-65.9	-175.4	179.7	-177	0	111	T60 Q89	T60-K124 HydrophobicContact CG2-CB 4.46Å; Q89-K124 HydrophobicContact CB-CB 4.23Å; Q89-K124 HydrophobicContact CG-CB 4.36Å; Q89-K124 PolarHBondContact N-O 3.27Å
125	V	95.7	Very high	94.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.4	177.3	-178.2	0	0	0	0	108.2	T60 G61 I63 V73 L86 E87 V88	T60-V125 CarbonylContact C-O 3.54Å; T60-V125 WeakPolarHBondContact CA-O 3.4Å; G61-V125 PolarHBondContact N-O 3.28Å; G61-V125 PolarHBondContact O-N 3.12Å; I63-V125 HydrophobicContact CD1-CG2 4.25Å; I63-V125 HydrophobicContact CG1-CG2 3.64Å; V73-V125 HydrophobicContact CG1-CB 3.86Å; V73-V125 HydrophobicContact CG1-CG1 4.13Å; V73-V125 HydrophobicContact CG1-CG2 3.95Å; V73-V125 HydrophobicContact CG2-CG1 4.48Å; V73-V125 HydrophobicContact CG2-CG2 4.17Å; L86-V125 HydrophobicContact CB-CG1 3.53Å; L86-V125 HydrophobicContact CD1-CG1 3.97Å; L86-V125 HydrophobicContact CG-CG1 4.35Å; E87-V125 WeakPolarHBondContact O-CA 3.45Å; V88-V125 HydrophobicContact CG2-CG2 4.3Å
126	L	94.4	Very high	94.3	Very high	40 Å²	40	51.4 Å²	51.4	21%	0.209	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.8	177.8	-62.2	-177.7	0	0	0	110.3	T60 L86 E87 Q89	T60-L126 HydrophobicContact CG2-CD2 4.19Å; L86-L126 CarbonylContact C-O 3.58Å; L86-L126 VanDerWaalsContact CA-O 3.26Å; L86-L126 WeakPolarHBondContact CA-O 3.4Å; E87-L126 PolarHBondContact N-O 3.36Å; E87-L126 PolarHBondContact O-N 2.75Å; Q89-L126 VanDerWaalsContact CD-CD1 3.43Å; Q89-L126 HydrophobicContact CG-CD1 3.95Å; Q89-L126 HydrophobicContact CG-CG 3.74Å; Q89-L126 VanDerWaalsContact NE2-CD1 3.35Å
127	D	93.6	Very high	94.2	Very high	20 Å²	20	50.2 Å²	50.2	11%	0.107	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	129.2	168.6	179.9	25.4	0	0	0	110.9	A58 A59 F75 N84 L86 G129	A58-D127 VanDerWaalsContact CB-O 3.31Å; A58-D127 WeakPolarHBondContact CB-O 3.42Å; A59-D127 HydrophobicContact CB-CB 4.44Å; A59-D127 PolarHBondContact O-N 2.8Å; A59-D127 VanDerWaalsContact O-N 3.14Å; F75-D127 HydrophobicContact CE1-CB 4.39Å; N84-D127 PolarHBondContact ND2-OD1 2.73Å; N84-D127 VanDerWaalsContact ND2-OD1 3.14Å; L86-D127 HydrophobicContact CD2-CB 3.86Å; D127-G129 VanDerWaalsContact C-N 3.27Å; D127-G129 PolarHBondContact OD1-N 3.08Å
128	S	90.2	Very high	94.3	Very high	47 Å²	47	45.9 Å²	45.9	33%	0.329	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-17.2	173.8	70.6	0	0	0	0	112.7	A85 A130	A85-S128 VanDerWaalsContact O-CB 3.27Å; A85-S128 WeakPolarHBondContact O-CB 3.47Å; A85-S128 PolarHBondContact O-N 3.39Å; A85-S128 PolarHBondContact O-OG 3.29Å; S128-A130 VanDerWaalsContact C-N 3.26Å; S128-A130 PolarHBondContact O-N 3.4Å; S128-A130 PolarHBondContact OG-O 3.22Å
129	G	91	Very high	94.4	Very high	52 Å²	52	46.6 Å²	46.6	54%	0.536	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.3	6.9	-179.4	0	0	0	0	0	114.3	N84 D127	N84-G129 VanDerWaalsContact ND2-C 3.31Å; N84-G129 WeakPolarHBondContact ND2-CA 3.3Å; D127-G129 VanDerWaalsContact C-N 3.27Å; D127-G129 PolarHBondContact OD1-N 3.08Å
130	A	93.3	Very high	94.4	Very high	17 Å²	17	45.4 Å²	45.4	14%	0.14	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	169.4	176	0	0	0	0	0	110.7	N84 A85 S128	N84-A130 WeakPolarHBondContact CA-O 3.44Å; N84-A130 PolarHBondContact ND2-N 3.36Å; N84-A130 VanDerWaalsContact OD1-C 3.31Å; N84-A130 WeakPolarHBondContact OD1-CA 3.46Å; A85-A130 PolarHBondContact N-O 2.78Å; S128-A130 VanDerWaalsContact C-N 3.26Å; S128-A130 PolarHBondContact O-N 3.4Å; S128-A130 PolarHBondContact OG-O 3.22Å
131	P	96.1	Very high	94.4	Very high	32 Å²	32	42 Å²	42	21%	0.208	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	171.4	167.4	-19	31.8	0	0	0	112.4	L83 K133 A165 H167	L83-P131 VanDerWaalsContact O-CA 3.24Å; L83-P131 WeakPolarHBondContact O-CA 3.47Å; L83-P131 WeakPolarHBondContact O-CB 3.33Å; P131-K133 PolarHBondContact O-N 3.22Å; P131-K133 VanDerWaalsContact O-N 3.14Å; P131-A165 HydrophobicContact CB-CB 4.19Å; P131-A165 HydrophobicContact CG-CB 4.34Å; P131-H167 HydrophobicContact CB-CB 4.38Å
132	I	96.3	Very high	94.3	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	20%	0.195	C	C	.	.			trans	-54.2	122.8	174.6	-59.5	174.1	0	0	0	108.7	A85 V96 M113 I134 I148 A165 I166	A85-I132 HydrophobicContact CB-CG1 3.75Å; V96-I132 HydrophobicContact CG1-CD1 4.27Å; V96-I132 HydrophobicContact CG1-CG1 4.13Å; M113-I132 HydrophobicContact CE-CD1 4.27Å; M113-I132 HydrophobicContact CG-CD1 4.04Å; M113-I132 HydrophobicContact SD-CD1 4.31Å; I132-I134 HydrophobicContact CG2-CG2 4.32Å; I132-I148 HydrophobicContact CG2-CB 4.34Å; I132-I148 HydrophobicContact CG2-CG2 4.23Å; I132-A165 WeakPolarHBondContact O-CA 3.14Å; I132-I166 HydrophobicContact CB-CD1 3.83Å; I132-I166 HydrophobicContact CB-CG1 4.08Å; I132-I166 HydrophobicContact CD1-CD1 4.06Å; I132-I166 HydrophobicContact CG1-CD1 4.39Å; I132-I166 HydrophobicContact CG2-CD1 4.28Å; I132-I166 PolarHBondContact O-N 2.87Å
133	K	95.9	Very high	94.4	Very high	94 Å²	94	31.9 Å²	31.9	41%	0.409	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.6	179	-74.1	-175	179.5	-178.1	0	110.6	P131 F163 A164 A165	P131-K133 PolarHBondContact O-N 3.22Å; P131-K133 VanDerWaalsContact O-N 3.14Å; K133-F163 HydrophobicContact CB-CB 4.44Å; K133-A164 CarbonylContact C-O 3.59Å; K133-A164 VanDerWaalsContact CA-O 3.27Å; K133-A164 WeakPolarHBondContact CA-O 3.1Å; K133-A165 HydrophobicContact CG-CB 4.41Å
134	I	96.8	Very high	94.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	152	-176.9	67.4	169.2	0	0	0	110.2	I132 V136 F163 A164 I166 T285 T288 V289	I132-I134 HydrophobicContact CG2-CG2 4.32Å; I134-V136 HydrophobicContact CD1-CG1 4.43Å; I134-V136 HydrophobicContact CG1-CG1 4.18Å; I134-V136 PolarHBondContact O-N 3.48Å; I134-F163 VanDerWaalsContact O-CA 3.24Å; I134-F163 WeakPolarHBondContact O-CA 2.94Å; I134-A164 PolarHBondContact N-O 3.31Å; I134-A164 PolarHBondContact O-N 3.26Å; I134-I166 HydrophobicContact CD1-CG2 4.14Å; I134-I166 HydrophobicContact CG1-CG2 4.22Å; I134-I166 HydrophobicContact CG2-CG2 3.65Å; I134-T285 HydrophobicContact CD1-CG2 3.63Å; I134-T285 VanDerWaalsContact CD1-O 3.32Å; I134-T285 WeakPolarHBondContact CD1-O 3.46Å; I134-T285 HydrophobicContact CG2-CG2 4.11Å; I134-T288 HydrophobicContact CD1-CG2 3.9Å; I134-T288 HydrophobicContact CG1-CG2 4.12Å; I134-V289 HydrophobicContact CD1-CG2 3.86Å
135	P	96.8	Very high	94.5	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.013	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131.9	171.6	29.3	-32.3	0	0	0	109.6	T140 M145 G149 I158 T160 F163	P135-T140 WeakPolarHBondContact O-CG2 3.21Å; P135-M145 HydrophobicContact CG-CE 3.95Å; P135-G149 WeakPolarHBondContact CD-O 3.44Å; P135-G149 VanDerWaalsContact CG-O 3.23Å; P135-G149 WeakPolarHBondContact CG-O 3.48Å; P135-I158 HydrophobicContact CB-CB 4.42Å; P135-I158 HydrophobicContact CB-CG2 4.04Å; P135-I158 HydrophobicContact CG-CB 4.29Å; P135-I158 HydrophobicContact CG-CD1 4.09Å; P135-I158 HydrophobicContact CG-CG2 4.26Å; P135-T160 HydrophobicContact CB-CG2 3.27Å; P135-F163 HydrophobicContact CB-CD1 4.33Å; P135-F163 HydrophobicContact CB-CE1 4.01Å
136	V	95.9	Very high	94.5	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.018	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	164.3	173.6	-65.7	0	0	0	0	109.4	I134 T160 Q162 A164 T288 V289 Y292	I134-V136 HydrophobicContact CD1-CG1 4.43Å; I134-V136 HydrophobicContact CG1-CG1 4.18Å; I134-V136 PolarHBondContact O-N 3.48Å; V136-T160 WeakPolarHBondContact O-CB 3.05Å; V136-T160 PolarHBondContact O-OG1 3.24Å; V136-Q162 HydrophobicContact CG2-CB 4.11Å; V136-Q162 PolarHBondContact N-O 2.89Å; V136-Q162 VanDerWaalsContact N-O 3.15Å; V136-A164 HydrophobicContact CG1-CB 3.78Å; V136-A164 HydrophobicContact CG2-CB 4.01Å; V136-T288 HydrophobicContact CG1-CG2 4.2Å; V136-V289 HydrophobicContact CG1-CG2 4.5Å; V136-Y292 HydrophobicContact CB-CD2 3.91Å; V136-Y292 HydrophobicContact CB-CG 3.84Å; V136-Y292 HydrophobicContact CG2-CD2 3.54Å; V136-Y292 HydrophobicContact CG2-CE2 3.98Å; V136-Y292 HydrophobicContact CG2-CG 4.02Å
137	G	93.3	Very high	94.6	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.01	14%	0.142	C	C	.	.	S	Bend	trans	124.4	169.9	-178.3	0	0	0	0	0	114.1	E139 T140 Y292	G137-E139 PolarHBondContact O-N 2.85Å; G137-E139 VanDerWaalsContact O-N 3.16Å; G137-T140 WeakPolarHBondContact O-CB 3.23Å; G137-T140 WeakPolarHBondContact O-CG2 3.5Å; G137-T140 PolarHBondContact O-N 2.68Å; G137-T140 PolarHBondContact O-OG1 3.5Å; G137-Y292 VanDerWaalsContact CA-CE1 3.41Å
138	P	92.8	Very high	94.7	Very high	54 Å²	54	23.6 Å²	23.6	35%	0.351	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-62.4	-21.6	177.4	27.1	-34.5	0	0	0	112.3	T140 L141 E297	P138-T140 PolarHBondContact O-N 3.44Å; P138-L141 HydrophobicContact CB-CD1 4.41Å; P138-L141 WeakPolarHBondContact O-CB 3.32Å; P138-L141 WeakPolarHBondContact O-CG 3.45Å; P138-L141 PolarHBondContact O-N 2.94Å; P138-L141 VanDerWaalsContact O-N 3.13Å; P138-E297 WeakPolarHBondContact CD-OE1 3.34Å
139	E	93.6	Very high	94.9	Very high	81 Å²	81	21.4 Å²	21.4	38%	0.379	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-69.7	-9.4	176.1	-56.1	92	161.1	0	0	113.7	G137 K159	G137-E139 PolarHBondContact O-N 2.85Å; G137-E139 VanDerWaalsContact O-N 3.16Å; E139-K159 WeakPolarHBondContact CG-O 3.26Å
140	T	95.1	Very high	95.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-81.9	-15	172.7	67.2	0	0	0	0	112.9	P135 G137 P138 G142 R143 M145 I158	P135-T140 WeakPolarHBondContact O-CG2 3.21Å; G137-T140 WeakPolarHBondContact O-CB 3.23Å; G137-T140 WeakPolarHBondContact O-CG2 3.5Å; G137-T140 PolarHBondContact O-N 2.68Å; G137-T140 PolarHBondContact O-OG1 3.5Å; P138-T140 PolarHBondContact O-N 3.44Å; T140-G142 PolarHBondContact O-N 2.89Å; T140-R143 WeakPolarHBondContact O-CB 3.46Å; T140-R143 PolarHBondContact O-N 2.95Å; T140-M145 HydrophobicContact CG2-CE 3.83Å; T140-I158 HydrophobicContact CG2-CG2 4.17Å
141	L	93.5	Very high	95.2	Very high	24 Å²	24	19.7 Å²	19.7	13%	0.126	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	133.8	-180	-63.6	171.2	0	0	0	111.3	P138 R143 Y230 A266 F293	P138-L141 HydrophobicContact CB-CD1 4.41Å; P138-L141 WeakPolarHBondContact O-CB 3.32Å; P138-L141 WeakPolarHBondContact O-CG 3.45Å; P138-L141 PolarHBondContact O-N 2.94Å; P138-L141 VanDerWaalsContact O-N 3.13Å; L141-R143 PolarHBondContact O-N 3.13Å; L141-Y230 HydrophobicContact CD1-CD1 3.67Å; L141-Y230 HydrophobicContact CD1-CD2 4.39Å; L141-Y230 HydrophobicContact CD1-CE1 3.38Å; L141-Y230 HydrophobicContact CD1-CE2 4.15Å; L141-Y230 HydrophobicContact CD1-CG 4.2Å; L141-Y230 HydrophobicContact CD2-CD1 3.96Å; L141-Y230 HydrophobicContact CD2-CG 4.09Å; L141-Y230 HydrophobicContact CG-CD1 4.5Å; L141-A266 HydrophobicContact CD2-CB 4.47Å; L141-F293 HydrophobicContact CD2-CE2 4.3Å; L141-F293 HydrophobicContact CD2-CZ 3.97Å; L141-F293 HydrophobicContact CG-CZ 4.15Å
142	G	92.8	Very high	95.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	8.4	-176.6	0	0	0	0	0	114.3	T140 R155 V265	T140-G142 PolarHBondContact O-N 2.89Å; G142-R155 PolarHBondContact O-NH1 2.92Å; G142-V265 WeakPolarHBondContact CA-O 3.3Å; G142-V265 PolarHBondContact N-O 3.24Å
143	R	95.9	Very high	95	Very high	26 Å²	26	20.9 Å²	20.9	10%	0.098	11%	0.106	C	C	.	.			trans	-102.7	155.5	178.4	-52.5	-56.2	-55.9	-84.2	-4.2	111	T140 L141 D153 G156 P157 I158 L267	T140-R143 WeakPolarHBondContact O-CB 3.46Å; T140-R143 PolarHBondContact O-N 2.95Å; L141-R143 PolarHBondContact O-N 3.13Å; R143-D153 WeakPolarHBondContact CA-OD2 3.46Å; R143-D153 IonicContact CZ-OD1 3.04Å; R143-D153 IonicContact CZ-OD2 3.72Å; R143-D153 IonicContact NE-OD1 2.94Å; R143-D153 IonicContact NE-OD2 2.7Å; R143-D153 PolarHBondContact NE-OD2 3.11Å; R143-D153 IonicContact NH2-OD1 3.93Å; R143-D153 PolarHBondContact NH2-OD1 3.49Å; R143-D153 IonicContact NH2-OD2 2.69Å; R143-D153 PolarHBondContact NH2-OD2 2.89Å; R143-G156 PolarHBondContact NH2-O 2.75Å; R143-P157 PolarHBondContact NH1-O 2.86Å; R143-I158 HydrophobicContact CB-CD1 4.22Å; R143-I158 HydrophobicContact CB-CG1 4.48Å; R143-I158 HydrophobicContact CG-CG1 4.36Å; R143-L267 WeakPolarHBondContact O-CB 3.44Å; R143-L267 PolarHBondContact O-N 2.95Å
144	I	96.4	Very high	94.9	Very high	14 Å²	14	23.9 Å²	23.9	7%	0.072	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123	168.3	-45.3	176.3	0	0	0	108.5	P151 I152 D153 Y247 L267 Y269	I144-P151 VanDerWaalsContact O-CA 3.31Å; I144-P151 WeakPolarHBondContact O-CA 3.42Å; I144-I152 HydrophobicContact CB-CG1 3.91Å; I144-I152 HydrophobicContact CG2-CD1 3.68Å; I144-I152 HydrophobicContact CG2-CG1 3.45Å; I144-I152 VanDerWaalsContact CG2-CG1 3.45Å; I144-I152 PolarHBondContact O-N 3.04Å; I144-D153 HydrophobicContact CB-CB 4Å; I144-D153 HydrophobicContact CD1-CB 4.11Å; I144-D153 HydrophobicContact CG1-CB 3.95Å; I144-D153 PolarHBondContact N-OD2 3.2Å; I144-Y247 HydrophobicContact CD1-CD1 4.09Å; I144-Y247 HydrophobicContact CD1-CD2 3.76Å; I144-Y247 HydrophobicContact CD1-CE1 4.22Å; I144-Y247 HydrophobicContact CD1-CE2 3.89Å; I144-Y247 HydrophobicContact CD1-CG 3.84Å; I144-Y247 HydrophobicContact CG1-CD2 4.14Å; I144-Y247 HydrophobicContact CG1-CE2 4.05Å; I144-L267 CarbonylContact C-O 3.59Å; I144-L267 WeakPolarHBondContact CA-O 3.39Å; I144-L267 HydrophobicContact CB-CB 4.39Å; I144-L267 HydrophobicContact CD1-CD1 4.41Å; I144-L267 HydrophobicContact CG1-CB 4.13Å; I144-L267 HydrophobicContact CG1-CD1 3.92Å; I144-L267 HydrophobicContact CG2-CB 4.25Å; I144-Y269 HydrophobicContact CD1-CE2 4.38Å; I144-Y269 HydrophobicContact CG2-CD2 3.39Å; I144-Y269 HydrophobicContact CG2-CE2 3.91Å; I144-Y269 HydrophobicContact CG2-CG 4.04Å
145	M	96.2	Very high	94.6	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.015	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.8	175	61.8	174.6	55.5	0	0	112.6	P135 T140 E150 I158 L267 V268 Y269 T285 V289	P135-M145 HydrophobicContact CG-CE 3.95Å; T140-M145 HydrophobicContact CG2-CE 3.83Å; M145-E150 CarbonylContact C-O 3.43Å; M145-E150 VanDerWaalsContact CA-O 3.26Å; M145-E150 WeakPolarHBondContact CA-O 3.35Å; M145-I158 HydrophobicContact CB-CD1 4.28Å; M145-I158 HydrophobicContact CE-CD1 3.67Å; M145-L267 PolarHBondContact N-O 2.98Å; M145-V268 HydrophobicContact CG-CB 4.23Å; M145-V268 HydrophobicContact CG-CG1 4.18Å; M145-V268 HydrophobicContact CG-CG2 3.73Å; M145-V268 CarbonylContact O-C 3.57Å; M145-V268 WeakPolarHBondContact O-CA 3.27Å; M145-V268 HydrophobicContact SD-CG2 3.94Å; M145-Y269 PolarHBondContact O-N 3.12Å; M145-T285 HydrophobicContact SD-CG2 4.24Å; M145-V289 HydrophobicContact SD-CG2 4.01Å
146	N	95.8	Very high	94.5	Very high	23 Å²	23	29 Å²	29	12%	0.123	15%	0.145	C	C	.	.			trans	-86.7	-179.1	171.5	70	8.5	0	0	0	112.1	I148 G149 E150 I152 Y269	N146-I148 PolarHBondContact O-N 3.17Å; N146-I148 WeakPolarHBondContact OD1-CG1 3.45Å; N146-I148 PolarHBondContact OD1-N 3.19Å; N146-G149 PolarHBondContact O-N 3Å; N146-G149 PolarHBondContact OD1-N 2.88Å; N146-G149 VanDerWaalsContact OD1-N 3.12Å; N146-E150 PolarHBondContact N-O 2.66Å; N146-E150 PolarHBondContact OD1-N 2.93Å; N146-E150 PolarHBondContact OD1-O 2.9Å; N146-I152 HydrophobicContact CB-CG2 3.86Å; N146-Y269 WeakPolarHBondContact CA-O 3.31Å
147	V	96.4	Very high	94.3	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.018	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-34.3	179.9	64.5	0	0	0	0	114.4	M113 A278 R281 V282 T285	M113-V147 HydrophobicContact CB-CG1 4.4Å; V147-A278 HydrophobicContact CB-CB 4.39Å; V147-A278 HydrophobicContact CG1-CB 3.78Å; V147-R281 HydrophobicContact CG2-CB 3.56Å; V147-V282 HydrophobicContact CB-CB 4.28Å; V147-V282 HydrophobicContact CG2-CB 4.32Å; V147-T285 PolarHBondContact O-OG1 2.83Å
148	I	95.6	Very high	94.4	Very high	13 Å²	13	30.6 Å²	30.6	7%	0.067	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	6.8	-179.9	62.2	171.6	0	0	0	113.5	V96 M113 I132 N146 E150	V96-I148 HydrophobicContact CB-CG2 4.08Å; V96-I148 HydrophobicContact CG1-CG2 4.47Å; V96-I148 HydrophobicContact CG2-CD1 4.08Å; V96-I148 HydrophobicContact CG2-CG2 4.07Å; M113-I148 HydrophobicContact CB-CG2 4.23Å; M113-I148 HydrophobicContact CG-CG2 4.38Å; I132-I148 HydrophobicContact CG2-CB 4.34Å; I132-I148 HydrophobicContact CG2-CG2 4.23Å; N146-I148 PolarHBondContact O-N 3.17Å; N146-I148 WeakPolarHBondContact OD1-CG1 3.45Å; N146-I148 PolarHBondContact OD1-N 3.19Å; I148-E150 VanDerWaalsContact CD1-CD 3.5Å; I148-E150 HydrophobicContact CD1-CG 4.1Å; I148-E150 HydrophobicContact CG1-CG 4.03Å
149	G	94.4	Very high	94.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	85.1	12.7	175	0	0	0	0	0	115.3	P135 N146	P135-G149 WeakPolarHBondContact CD-O 3.44Å; P135-G149 VanDerWaalsContact CG-O 3.23Å; P135-G149 WeakPolarHBondContact CG-O 3.48Å; N146-G149 PolarHBondContact O-N 3Å; N146-G149 PolarHBondContact OD1-N 2.88Å; N146-G149 VanDerWaalsContact OD1-N 3.12Å
150	E	94.8	Very high	94.2	Very high	18 Å²	18	33.3 Å²	33.3	8%	0.084	16%	0.161	C	C	.	.			trans	-85.7	140.2	176.4	-66	175.3	168.5	0	0	111.2	R94 M145 N146 I148	R94-E150 WeakPolarHBondContact CD-OE1 3.35Å; R94-E150 IonicContact CZ-OE1 2.8Å; R94-E150 IonicContact NE-OE1 3.81Å; R94-E150 IonicContact NH1-OE1 2.79Å; R94-E150 PolarHBondContact NH1-OE1 3.45Å; M145-E150 CarbonylContact C-O 3.43Å; M145-E150 VanDerWaalsContact CA-O 3.26Å; M145-E150 WeakPolarHBondContact CA-O 3.35Å; N146-E150 PolarHBondContact N-O 2.66Å; N146-E150 PolarHBondContact OD1-N 2.93Å; N146-E150 PolarHBondContact OD1-O 2.9Å; I148-E150 VanDerWaalsContact CD1-CD 3.5Å; I148-E150 HydrophobicContact CD1-CG 4.1Å; I148-E150 HydrophobicContact CG1-CG 4.03Å
151	P	96.1	Very high	93.8	Very high	16 Å²	16	42.5 Å²	42.5	10%	0.104	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-70.1	133	176.5	27	-31.2	0	0	0	111.3	I144 G156 I158	I144-P151 VanDerWaalsContact O-CA 3.31Å; I144-P151 WeakPolarHBondContact O-CA 3.42Å; P151-G156 WeakPolarHBondContact CG-O 3.45Å; P151-I158 HydrophobicContact CB-CD1 4.24Å; P151-I158 HydrophobicContact CB-CG1 4.03Å; P151-I158 HydrophobicContact CG-CG1 4.3Å
152	I	94.4	Very high	93.8	Very high	43 Å²	43	45.5 Å²	45.5	22%	0.221	22%	0.215	C	C	.	.			trans	-115	8.3	177.7	67.6	176.4	0	0	0	113.1	I144 N146	I144-I152 HydrophobicContact CB-CG1 3.91Å; I144-I152 HydrophobicContact CG2-CD1 3.68Å; I144-I152 HydrophobicContact CG2-CG1 3.45Å; I144-I152 VanDerWaalsContact CG2-CG1 3.45Å; I144-I152 PolarHBondContact O-N 3.04Å; N146-I152 HydrophobicContact CB-CG2 3.86Å
153	D	93.1	Very high	93.9	Very high	20 Å²	20	49.4 Å²	49.4	11%	0.107	23%	0.232	C	C	.	.	S	Bend	trans	-92.6	4.2	-178.9	62.6	-0.9	0	0	0	114.4	R143 I144 R155	R143-D153 WeakPolarHBondContact CA-OD2 3.46Å; R143-D153 IonicContact CZ-OD1 3.04Å; R143-D153 IonicContact CZ-OD2 3.72Å; R143-D153 IonicContact NE-OD1 2.94Å; R143-D153 IonicContact NE-OD2 2.7Å; R143-D153 PolarHBondContact NE-OD2 3.11Å; R143-D153 IonicContact NH2-OD1 3.93Å; R143-D153 PolarHBondContact NH2-OD1 3.49Å; R143-D153 IonicContact NH2-OD2 2.69Å; R143-D153 PolarHBondContact NH2-OD2 2.89Å; I144-D153 HydrophobicContact CB-CB 4Å; I144-D153 HydrophobicContact CD1-CB 4.11Å; I144-D153 HydrophobicContact CG1-CB 3.95Å; I144-D153 PolarHBondContact N-OD2 3.2Å; D153-R155 HydrophobicContact CB-CG 4.48Å; D153-R155 WeakPolarHBondContact O-CG 3.46Å; D153-R155 PolarHBondContact O-N 3.2Å; D153-R155 VanDerWaalsContact O-N 3.08Å; D153-R155 PolarHBondContact OD1-N 2.72Å
154	E	93.3	Very high	93.9	Very high	157 Å²	157	49.5 Å²	49.5	73%	0.734	24%	0.238	S	C	*	.	S	Bend	trans	59.1	17.1	-178.7	-55.7	-172.1	165.9	0	0	115	G156	E154-G156 VanDerWaalsContact C-N 3.32Å; E154-G156 PolarHBondContact O-N 2.92Å
155	R	91.4	Very high	94	Very high	96 Å²	96	50.2 Å²	50.2	36%	0.362	25%	0.246	S	C	.	.	S	Bend	trans	-95.2	26.1	-178.8	-66.2	171.1	70.4	-157.9	3.6	113.6	G142 D153 L258	G142-R155 PolarHBondContact O-NH1 2.92Å; D153-R155 HydrophobicContact CB-CG 4.48Å; D153-R155 WeakPolarHBondContact O-CG 3.46Å; D153-R155 PolarHBondContact O-N 3.2Å; D153-R155 VanDerWaalsContact O-N 3.08Å; D153-R155 PolarHBondContact OD1-N 2.72Å; R155-L258 PolarHBondContact NH2-O 3.17Å; R155-L258 VanDerWaalsContact NH2-O 3.12Å
156	G	93.2	Very high	94	Very high	14 Å²	14	50 Å²	50	14%	0.144	25%	0.245	C	C	.	.			trans	74.2	-171.3	-176.4	0	0	0	0	0	113.6	R143 P151 E154	R143-G156 PolarHBondContact NH2-O 2.75Å; P151-G156 WeakPolarHBondContact CG-O 3.45Å; E154-G156 VanDerWaalsContact C-N 3.32Å; E154-G156 PolarHBondContact O-N 2.92Å
157	P	93.6	Very high	94	Very high	29 Å²	29	51 Å²	51	19%	0.188	25%	0.249	C	C	.	.			trans	-70.9	153	-174	28.3	-33.3	0	0	0	112.5	Y46 R143 K159	Y46-P157 HydrophobicContact CD1-CG 4.17Å; R143-P157 PolarHBondContact NH1-O 2.86Å; P157-K159 PolarHBondContact O-N 2.92Å
158	I	93.4	Very high	93.9	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.036	26%	0.264	C	S	.	.			trans	-80.9	106.8	168.8	-58.2	175.7	0	0	0	107.5	P135 T140 R143 M145 P151 T160	P135-I158 HydrophobicContact CB-CB 4.42Å; P135-I158 HydrophobicContact CB-CG2 4.04Å; P135-I158 HydrophobicContact CG-CB 4.29Å; P135-I158 HydrophobicContact CG-CD1 4.09Å; P135-I158 HydrophobicContact CG-CG2 4.26Å; T140-I158 HydrophobicContact CG2-CG2 4.17Å; R143-I158 HydrophobicContact CB-CD1 4.22Å; R143-I158 HydrophobicContact CB-CG1 4.48Å; R143-I158 HydrophobicContact CG-CG1 4.36Å; M145-I158 HydrophobicContact CB-CD1 4.28Å; M145-I158 HydrophobicContact CE-CD1 3.67Å; P151-I158 HydrophobicContact CB-CD1 4.24Å; P151-I158 HydrophobicContact CB-CG1 4.03Å; P151-I158 HydrophobicContact CG-CG1 4.3Å; I158-T160 PolarHBondContact O-N 3.14Å; I158-T160 VanDerWaalsContact O-N 3.14Å
159	K	91.5	Very high	93.8	Very high	170 Å²	170	60.4 Å²	60.4	74%	0.739	30%	0.299	S	S	*	.			trans	-86	82.5	-177.4	-64.6	179.4	-176.6	176	0	110.1	E139 P157	E139-K159 WeakPolarHBondContact CG-O 3.26Å; P157-K159 PolarHBondContact O-N 2.92Å
160	T	90.8	Very high	93.9	Very high	22 Å²	22	62.2 Å²	62.2	14%	0.135	31%	0.314	C	S	.	.			trans	-107.2	158.4	173.5	-177.9	0	0	0	0	112	P135 V136 I158 Q162 F163	P135-T160 HydrophobicContact CB-CG2 3.27Å; V136-T160 WeakPolarHBondContact O-CB 3.05Å; V136-T160 PolarHBondContact O-OG1 3.24Å; I158-T160 PolarHBondContact O-N 3.14Å; I158-T160 VanDerWaalsContact O-N 3.14Å; T160-Q162 VanDerWaalsContact CG2-O 3.25Å; T160-Q162 WeakPolarHBondContact CG2-O 3.38Å; T160-Q162 PolarHBondContact OG1-N 3.4Å; T160-Q162 PolarHBondContact OG1-O 2.91Å; T160-F163 HydrophobicContact CG2-CE1 4.33Å; T160-F163 HydrophobicContact CG2-CE2 4.19Å; T160-F163 HydrophobicContact CG2-CZ 4.03Å
161	K	87.8	Confident	93.9	Very high	193 Å²	193	62.1 Å²	62.1	84%	0.839	32%	0.315	S	S	*	.	S	Bend	trans	-92.3	-15.3	171	-61.1	175.8	-173.3	169.6	0	112.7
162	Q	93.2	Very high	93.8	Very high	88 Å²	88	68 Å²	68	41%	0.411	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.1	-170.1	-63	-170.6	6.8	0	0	111.6	V136 T160 Y292	V136-Q162 HydrophobicContact CG2-CB 4.11Å; V136-Q162 PolarHBondContact N-O 2.89Å; V136-Q162 VanDerWaalsContact N-O 3.15Å; T160-Q162 VanDerWaalsContact CG2-O 3.25Å; T160-Q162 WeakPolarHBondContact CG2-O 3.38Å; T160-Q162 PolarHBondContact OG1-N 3.4Å; T160-Q162 PolarHBondContact OG1-O 2.91Å; Q162-Y292 PolarHBondContact OE1-OH 3.18Å
163	F	94.9	Very high	93.7	Very high	81 Å²	81	74.2 Å²	74.2	36%	0.355	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.2	177.7	-68.4	-93.8	0	0	0	108.7	T50 K133 I134 P135 T160	T50-F163 WeakPolarHBondContact O-CE1 3.46Å; K133-F163 HydrophobicContact CB-CB 4.44Å; I134-F163 VanDerWaalsContact O-CA 3.24Å; I134-F163 WeakPolarHBondContact O-CA 2.94Å; P135-F163 HydrophobicContact CB-CD1 4.33Å; P135-F163 HydrophobicContact CB-CE1 4.01Å; T160-F163 HydrophobicContact CG2-CE1 4.33Å; T160-F163 HydrophobicContact CG2-CE2 4.19Å; T160-F163 HydrophobicContact CG2-CZ 4.03Å
164	A	96.2	Very high	93.7	Very high	28 Å²	28	79.5 Å²	79.5	23%	0.231	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.7	178.8	0	0	0	0	0	110.4	K133 I134 V136 T288	K133-A164 CarbonylContact C-O 3.59Å; K133-A164 VanDerWaalsContact CA-O 3.27Å; K133-A164 WeakPolarHBondContact CA-O 3.1Å; I134-A164 PolarHBondContact N-O 3.31Å; I134-A164 PolarHBondContact O-N 3.26Å; V136-A164 HydrophobicContact CG1-CB 3.78Å; V136-A164 HydrophobicContact CG2-CB 4.01Å; A164-T288 HydrophobicContact CB-CG2 3.51Å
165	A	97.1	Very high	93.6	Very high	29 Å²	29	76.2 Å²	76.2	24%	0.24	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	139.6	172.8	0	0	0	0	0	109.7	P131 I132 K133 H167	P131-A165 HydrophobicContact CB-CB 4.19Å; P131-A165 HydrophobicContact CG-CB 4.34Å; I132-A165 WeakPolarHBondContact O-CA 3.14Å; K133-A165 HydrophobicContact CG-CB 4.41Å; A165-H167 PolarHBondContact O-N 3.04Å
166	I	96.8	Very high	93.4	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	37%	0.374	C	S	.	.	S	Bend	trans	-70.7	-21.6	-179.1	66.2	174.1	0	0	0	113.5	I132 I134 R281 L284 T288 R345	I132-I166 HydrophobicContact CB-CD1 3.83Å; I132-I166 HydrophobicContact CB-CG1 4.08Å; I132-I166 HydrophobicContact CD1-CD1 4.06Å; I132-I166 HydrophobicContact CG1-CD1 4.39Å; I132-I166 HydrophobicContact CG2-CD1 4.28Å; I132-I166 PolarHBondContact O-N 2.87Å; I134-I166 HydrophobicContact CD1-CG2 4.14Å; I134-I166 HydrophobicContact CG1-CG2 4.22Å; I134-I166 HydrophobicContact CG2-CG2 3.65Å; I166-R281 HydrophobicContact CD1-CB 4.2Å; I166-L284 HydrophobicContact CB-CB 4.25Å; I166-T288 WeakPolarHBondContact CA-OG1 3.37Å; I166-T288 PolarHBondContact O-OG1 3.06Å; I166-R345 PolarHBondContact O-NH1 3.08Å; I166-R345 PolarHBondContact O-NH2 3.06Å
167	H	96.1	Very high	93.2	Very high	42 Å²	42	76 Å²	76	19%	0.194	38%	0.382	C	S	.	.			trans	-94.7	112.6	176.6	-68.2	-67.9	0	0	0	109	L83 E98 P131 A165	L83-H167 HydrophobicContact CD1-CB 4.12Å; E98-H167 IonicContact OE1-NE2 3.11Å; E98-H167 IonicContact OE2-CD2 3.71Å; E98-H167 IonicContact OE2-CE1 3.73Å; E98-H167 IonicContact OE2-NE2 2.92Å; E98-H167 PolarHBondContact OE2-NE2 3.09Å; P131-H167 HydrophobicContact CB-CB 4.38Å; A165-H167 PolarHBondContact O-N 3.04Å
168	A	93.7	Very high	92.8	Very high	41 Å²	41	81.1 Å²	81.1	34%	0.339	41%	0.412	S	S	.	.			trans	-136.4	153.6	175.7	0	0	0	0	0	108.7	R345	A168-R345 WeakPolarHBondContact O-CD 3.49Å
169	E	94.9	Very high	92.4	Very high	174 Å²	174	87.4 Å²	87.4	81%	0.813	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-76.1	155.9	171.8	-64.3	-60.5	151.4	0	0	110.4
170	A	95.3	Very high	92	Very high	38 Å²	38	85 Å²	85	31%	0.314	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-65.2	150.5	171.7	0	0	0	0	0	110.8	E344 R345	A170-E344 HydrophobicContact CB-CB 3.88Å; A170-R345 HydrophobicContact CB-CG 4.23Å
171	P	94.4	Very high	91.7	Very high	16 Å²	16	88.6 Å²	88.6	10%	0.104	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-53.9	142.1	175	-27.3	36.3	0	0	0	112.3	M176 T347 T349	P171-M176 WeakPolarHBondContact O-CE 3.47Å; P171-T347 HydrophobicContact CB-CG2 4.29Å; P171-T347 HydrophobicContact CG-CG2 3.75Å; P171-T349 HydrophobicContact CB-CG2 3.91Å; P171-T349 HydrophobicContact CG-CG2 3.82Å
172	E	94.7	Very high	91.9	Very high	141 Å²	141	81.9 Å²	81.9	66%	0.659	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-67.7	154.6	178.9	-67.4	-170.7	178.2	0	0	111.4	M174 E175	E172-M174 PolarHBondContact O-N 3.39Å; E172-E175 HydrophobicContact CB-CG 4.5Å; E172-E175 WeakPolarHBondContact O-CB 3.48Å; E172-E175 PolarHBondContact O-N 3.36Å
173	F	93.1	Very high	91.8	Very high	172 Å²	172	78.4 Å²	78.4	75%	0.754	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-52.3	-35.7	178.5	-179.2	-100.5	0	0	0	113.4	E175 M176	F173-E175 PolarHBondContact O-N 2.86Å; F173-M176 PolarHBondContact O-N 2.84Å
174	M	92.9	Very high	91.7	Very high	131 Å²	131	76.7 Å²	76.7	65%	0.645	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-71.4	-16.4	179.9	-64.2	-57.2	-63	0	0	113.7	E172 K350	E172-M174 PolarHBondContact O-N 3.39Å; M174-K350 WeakPolarHBondContact O-CE 3.42Å; M174-K350 PolarHBondContact O-NZ 3.45Å
175	E	90.6	Very high	91.5	Very high	89 Å²	89	75.5 Å²	75.5	42%	0.416	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-94.6	-14.4	179.7	-60.2	-167.3	145.6	0	0	113.1	E172 F173 T349 K350	E172-E175 HydrophobicContact CB-CG 4.5Å; E172-E175 WeakPolarHBondContact O-CB 3.48Å; E172-E175 PolarHBondContact O-N 3.36Å; F173-E175 PolarHBondContact O-N 2.86Å; E175-T349 CarbonylContact O-C 2.92Å; E175-T349 VanDerWaalsContact O-CA 3.28Å; E175-T349 WeakPolarHBondContact O-CA 3.47Å; E175-K350 PolarHBondContact O-N 2.89Å
176	M	87.9	Confident	91.3	Very high	62 Å²	62	74.1 Å²	74.1	31%	0.305	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-68.1	138.5	-179.3	-63.9	-173.6	179.6	0	0	111.6	P171 F173	P171-M176 WeakPolarHBondContact O-CE 3.47Å; F173-M176 PolarHBondContact O-N 2.84Å
177	S	87.8	Confident	91.2	Very high	42 Å²	42	74.1 Å²	74.1	29%	0.294	38%	0.38	S	S	.	.			trans	-80.5	145.5	169.5	-172.1	0	0	0	0	110.7	E179 T348	S177-E179 PolarHBondContact OG-N 3.33Å; S177-T348 PolarHBondContact N-O 2.98Å
178	V	85.8	Confident	91.3	Very high	138 Å²	138	72.1 Å²	72.1	84%	0.836	37%	0.371	S	S	*	.			trans	-101.2	-6.4	175	-63.6	0	0	0	0	112.5	Q180	V178-Q180 PolarHBondContact O-N 2.8Å
179	E	84.3	Confident	91.4	Very high	139 Å²	139	70.3 Å²	70.3	65%	0.65	36%	0.355	S	S	*	.			trans	-77.7	122.7	-176.6	-67.3	177.3	171.7	0	0	110.2	S177	S177-E179 PolarHBondContact OG-N 3.33Å
180	Q	82.8	Confident	91.5	Very high	119 Å²	119	62 Å²	62	56%	0.556	32%	0.317	S	S	*	.			trans	-102.7	100	175.1	-68.3	-179	-21.6	0	0	108.5	V178	V178-Q180 PolarHBondContact O-N 2.8Å
181	E	86.4	Confident	91.5	Very high	98 Å²	98	60.2 Å²	60.2	46%	0.458	30%	0.302	S	S	.	.			trans	-110.3	148	177.2	-62.7	-171.1	153	0	0	110.9	A197 K198	E181-A197 CarbonylContact O-C 3.58Å; E181-A197 WeakPolarHBondContact O-CA 3.4Å; E181-K198 HydrophobicContact CB-CB 4.29Å; E181-K198 PolarHBondContact O-N 3.1Å
182	I	91.4	Very high	91.6	Very high	52 Å²	52	59.5 Å²	59.5	27%	0.267	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.3	172.7	-171.2	170.1	0	0	0	110.5	V184 P195 Y196 I407 V413 L484	I182-V184 HydrophobicContact CG2-CG2 4.39Å; I182-P195 HydrophobicContact CD1-CB 3.51Å; I182-P195 HydrophobicContact CG1-CB 4.01Å; I182-Y196 CarbonylContact C-O 3.6Å; I182-I407 HydrophobicContact CB-CD1 4.28Å; I182-I407 HydrophobicContact CG1-CD1 4.21Å; I182-V413 HydrophobicContact CD1-CG1 4.47Å; I182-L484 HydrophobicContact CD1-CD2 4.14Å
183	L	90.7	Very high	91.7	Very high	14 Å²	14	52.9 Å²	52.9	7%	0.073	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	104.2	165.8	179.8	67.6	0	0	0	108.6	T185 Y196 L302 T355	L183-T185 PolarHBondContact O-N 3.46Å; L183-Y196 PolarHBondContact N-O 3.19Å; L183-L302 HydrophobicContact CD2-CD2 4.1Å; L183-T355 HydrophobicContact CD2-CG2 3.79Å
184	V	92.1	Very high	91.9	Very high	46 Å²	46	44.8 Å²	44.8	28%	0.279	23%	0.231	S	C	.	.			trans	-71.7	118	176.2	-177	0	0	0	0	109.4	I182 H227 L484	I182-V184 HydrophobicContact CG2-CG2 4.39Å; V184-H227 PolarHBondContact O-NE2 2.95Å; V184-L484 HydrophobicContact CG1-CB 4.27Å; V184-L484 HydrophobicContact CG2-CB 4.46Å; V184-L484 HydrophobicContact CG2-CD2 4.34Å
185	T	91.9	Very high	92	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.2	C	C	.	.			trans	-93.2	-19.8	-177.4	67	0	0	0	0	113.2	L183 I187 V190 D191 Y196 L219 N222	L183-T185 PolarHBondContact O-N 3.46Å; T185-I187 VanDerWaalsContact C-N 3.26Å; T185-I187 PolarHBondContact OG1-N 3.04Å; T185-V190 HydrophobicContact CG2-CG1 3.97Å; T185-D191 WeakPolarHBondContact CB-OD1 3.49Å; T185-D191 PolarHBondContact N-OD1 2.94Å; T185-D191 PolarHBondContact N-OD2 2.91Å; T185-D191 VanDerWaalsContact OG1-CG 3.29Å; T185-D191 PolarHBondContact OG1-OD1 3.38Å; T185-Y196 HydrophobicContact CG2-CD2 3.63Å; T185-Y196 HydrophobicContact CG2-CE2 4.13Å; T185-Y196 HydrophobicContact CG2-CG 4.3Å; T185-L219 HydrophobicContact CG2-CD2 3.75Å; T185-N222 VanDerWaalsContact O-CB 3.29Å; T185-N222 WeakPolarHBondContact O-CB 3.21Å; T185-N222 PolarHBondContact O-ND2 2.7Å
186	G	93.2	Very high	92.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.01	18%	0.18	C	C	.	.	S	Bend	trans	78.6	9.1	-174.1	0	0	0	0	0	113.6	D191 Q466 V482	G186-D191 WeakPolarHBondContact CA-OD2 3.42Å; G186-D191 PolarHBondContact N-OD2 3.43Å; G186-Q466 PolarHBondContact O-NE2 3.35Å; G186-V482 WeakPolarHBondContact CA-O 3.34Å; G186-V482 PolarHBondContact O-N 3.14Å; G186-V482 VanDerWaalsContact O-N 3.16Å
187	I	96.1	Very high	92.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.			trans	-107.3	115.5	179.8	-59.2	171.7	0	0	0	108.4	T185 V189 V190 D191 L215 E218 L219 P396 F468	T185-I187 VanDerWaalsContact C-N 3.26Å; T185-I187 PolarHBondContact OG1-N 3.04Å; I187-V189 HydrophobicContact CG2-CG1 4.01Å; I187-V189 PolarHBondContact O-N 2.83Å; I187-V190 HydrophobicContact CB-CB 4.2Å; I187-V190 HydrophobicContact CB-CG2 4.26Å; I187-V190 HydrophobicContact CG2-CB 4.27Å; I187-V190 HydrophobicContact CG2-CG2 3.93Å; I187-V190 PolarHBondContact O-N 2.8Å; I187-V190 VanDerWaalsContact O-N 3.15Å; I187-D191 PolarHBondContact N-OD2 3.37Å; I187-D191 WeakPolarHBondContact O-CB 3.5Å; I187-D191 PolarHBondContact O-N 2.94Å; I187-L215 HydrophobicContact CD1-CD1 3.64Å; I187-E218 HydrophobicContact CD1-CG 4.26Å; I187-L219 HydrophobicContact CD1-CD2 3.81Å; I187-L219 HydrophobicContact CD1-CG 4.19Å; I187-P396 HydrophobicContact CG2-CG 4.04Å; I187-F468 HydrophobicContact CD1-CE1 4.17Å; I187-F468 HydrophobicContact CD1-CZ 3.91Å; I187-F468 HydrophobicContact CG1-CE1 4Å; I187-F468 HydrophobicContact CG1-CZ 4.23Å; I187-F468 HydrophobicContact CG2-CE1 4.09Å; I187-F468 HydrophobicContact CG2-CZ 4.14Å
188	K	96.9	Very high	92.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-50.6	-51.3	-171.8	-75.2	-176.4	-70.6	-175.1	0	114	L192 F463 S465 V482 T487 F491 V510 G511	K188-L192 WeakPolarHBondContact O-CB 3.36Å; K188-L192 PolarHBondContact O-N 3.44Å; K188-F463 HydrophobicContact CD-CE1 4.36Å; K188-F463 HydrophobicContact CD-CZ 4.29Å; K188-F463 WeakPolarHBondContact CE-O 3.31Å; K188-F463 PolarHBondContact NZ-O 3.34Å; K188-S465 WeakPolarHBondContact CE-O 3.44Å; K188-S465 PolarHBondContact NZ-O 3.43Å; K188-S465 VanDerWaalsContact NZ-O 3.08Å; K188-V482 HydrophobicContact CD-CG1 4.37Å; K188-V482 HydrophobicContact CD-CG2 4.25Å; K188-V482 HydrophobicContact CG-CB 4.02Å; K188-V482 HydrophobicContact CG-CG1 4.04Å; K188-V482 HydrophobicContact CG-CG2 4.07Å; K188-T487 HydrophobicContact CB-CG2 4.15Å; K188-T487 HydrophobicContact CG-CG2 4.11Å; K188-F491 HydrophobicContact CB-CE2 4.28Å; K188-F491 HydrophobicContact CD-CE2 4.38Å; K188-V510 PolarHBondContact NZ-O 2.86Å; K188-G511 PolarHBondContact NZ-O 3.34Å
189	V	96.6	Very high	92.4	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-67.4	-36.9	-176.4	62.3	0	0	0	0	112.8	I187 L193 P396 V398 L464	I187-V189 HydrophobicContact CG2-CG1 4.01Å; I187-V189 PolarHBondContact O-N 2.83Å; V189-L193 HydrophobicContact CG2-CD1 4.2Å; V189-L193 WeakPolarHBondContact O-CB 3.42Å; V189-L193 PolarHBondContact O-N 3.19Å; V189-L193 VanDerWaalsContact O-N 3.07Å; V189-P396 HydrophobicContact CG1-CG 3.74Å; V189-V398 HydrophobicContact CB-CB 4.45Å; V189-V398 HydrophobicContact CG1-CB 3.8Å; V189-V398 HydrophobicContact CG1-CG1 4.3Å; V189-V398 HydrophobicContact CG1-CG2 3.76Å; V189-V398 HydrophobicContact CG2-CB 3.76Å; V189-V398 HydrophobicContact CG2-CG1 3.67Å; V189-L464 HydrophobicContact CB-CB 4.48Å; V189-L464 HydrophobicContact CB-CD2 3.84Å; V189-L464 HydrophobicContact CG2-CD2 3.96Å
190	V	96	Very high	92.7	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-71.2	-55	178.6	174.4	0	0	0	0	109.2	T185 I187 L192 A194 P195 Y196	T185-V190 HydrophobicContact CG2-CG1 3.97Å; I187-V190 HydrophobicContact CB-CB 4.2Å; I187-V190 HydrophobicContact CB-CG2 4.26Å; I187-V190 HydrophobicContact CG2-CB 4.27Å; I187-V190 HydrophobicContact CG2-CG2 3.93Å; I187-V190 PolarHBondContact O-N 2.8Å; I187-V190 VanDerWaalsContact O-N 3.15Å; V190-L192 VanDerWaalsContact C-N 3.28Å; V190-L192 PolarHBondContact O-N 3.3Å; V190-A194 CarbonylContact O-C 3.46Å; V190-A194 PolarHBondContact O-N 2.83Å; V190-A194 VanDerWaalsContact O-N 3.07Å; V190-P195 VanDerWaalsContact O-CA 3.32Å; V190-P195 WeakPolarHBondContact O-CA 3.42Å; V190-Y196 HydrophobicContact CG1-CD1 3.81Å; V190-Y196 HydrophobicContact CG1-CD2 4Å; V190-Y196 HydrophobicContact CG1-CE1 3.51Å; V190-Y196 HydrophobicContact CG1-CE2 3.72Å; V190-Y196 HydrophobicContact CG1-CG 4.04Å; V190-Y196 VanDerWaalsContact CG1-CZ 3.45Å
191	D	96.1	Very high	93.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-33.6	-176.5	-71.8	-12.2	0	0	0	112.3	T185 G186 I187 H417 L484	T185-D191 WeakPolarHBondContact CB-OD1 3.49Å; T185-D191 PolarHBondContact N-OD1 2.94Å; T185-D191 PolarHBondContact N-OD2 2.91Å; T185-D191 VanDerWaalsContact OG1-CG 3.29Å; T185-D191 PolarHBondContact OG1-OD1 3.38Å; G186-D191 WeakPolarHBondContact CA-OD2 3.42Å; G186-D191 PolarHBondContact N-OD2 3.43Å; I187-D191 PolarHBondContact N-OD2 3.37Å; I187-D191 WeakPolarHBondContact O-CB 3.5Å; I187-D191 PolarHBondContact O-N 2.94Å; D191-H417 PolarHBondContact O-CE1 3.15Å; D191-H417 PolarHBondContact O-NE2 3.2Å; D191-L484 HydrophobicContact CB-CD1 4.07Å
192	L	97.2	Very high	93.7	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-80.5	-51.5	179	-174.7	69.1	0	0	0	113.2	K188 V190 M408 H417 V420 A421 V424 T487 F491	K188-L192 WeakPolarHBondContact O-CB 3.36Å; K188-L192 PolarHBondContact O-N 3.44Å; V190-L192 VanDerWaalsContact C-N 3.28Å; V190-L192 PolarHBondContact O-N 3.3Å; L192-M408 WeakPolarHBondContact O-CE 3.34Å; L192-H417 PolarHBondContact O-NE2 2.98Å; L192-H417 VanDerWaalsContact O-NE2 3.15Å; L192-V420 HydrophobicContact CD1-CG1 4.11Å; L192-A421 HydrophobicContact CD1-CB 4.36Å; L192-A421 HydrophobicContact CG-CB 4.39Å; L192-A421 WeakPolarHBondContact O-CB 3.44Å; L192-V424 HydrophobicContact CD2-CG2 4.13Å; L192-T487 HydrophobicContact CB-CG2 3.98Å; L192-F491 HydrophobicContact CD2-CB 4.08Å; L192-F491 HydrophobicContact CD2-CD1 3.94Å; L192-F491 HydrophobicContact CD2-CD2 3.48Å; L192-F491 VanDerWaalsContact CD2-CD2 3.48Å; L192-F491 HydrophobicContact CD2-CE1 4.24Å; L192-F491 HydrophobicContact CD2-CE2 3.83Å; L192-F491 HydrophobicContact CD2-CG 3.55Å; L192-F491 HydrophobicContact CD2-CZ 4.2Å
193	L	96.7	Very high	93.8	Very high	3 Å²	3	8.4 Å²	8.4	2%	0.016	5%	0.047	C	C	.	.	H	α-helix	trans	-103.6	-35.1	-164.4	-59.8	-179.4	0	0	0	113.8	V189 P195 P400 A421 V424 Q425 L464	V189-L193 HydrophobicContact CG2-CD1 4.2Å; V189-L193 WeakPolarHBondContact O-CB 3.42Å; V189-L193 PolarHBondContact O-N 3.19Å; V189-L193 VanDerWaalsContact O-N 3.07Å; L193-P195 VanDerWaalsContact C-CD 3.44Å; L193-P400 HydrophobicContact CD1-CB 3.28Å; L193-A421 HydrophobicContact CD2-CB 4.19Å; L193-V424 HydrophobicContact CD1-CG1 4.34Å; L193-V424 HydrophobicContact CD2-CB 4.27Å; L193-V424 HydrophobicContact CD2-CG1 3.97Å; L193-Q425 HydrophobicContact CD2-CG 4.05Å; L193-L464 HydrophobicContact CD1-CD2 4.22Å
194	A	95.9	Very high	93.9	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.008	4%	0.044	C	C	.	.	S	Bend	trans	-131.9	61.1	-180	0	0	0	0	0	110.6	V190 Y196	V190-A194 CarbonylContact O-C 3.46Å; V190-A194 PolarHBondContact O-N 2.83Å; V190-A194 VanDerWaalsContact O-N 3.07Å; A194-Y196 WeakPolarHBondContact O-CD1 3.45Å; A194-Y196 WeakPolarHBondContact O-CE1 3.46Å
195	P	95.9	Very high	93.7	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.033	C	C	.	.	P	Polyproline II helix	trans	-62	140.8	-173.1	24	-33.7	0	0	0	110.9	I182 V190 L193 S405 I407 M408 V413	I182-P195 HydrophobicContact CD1-CB 3.51Å; I182-P195 HydrophobicContact CG1-CB 4.01Å; V190-P195 VanDerWaalsContact O-CA 3.32Å; V190-P195 WeakPolarHBondContact O-CA 3.42Å; L193-P195 VanDerWaalsContact C-CD 3.44Å; P195-S405 VanDerWaalsContact O-CB 3.31Å; P195-S405 WeakPolarHBondContact O-CB 3.41Å; P195-S405 PolarHBondContact O-OG 3.01Å; P195-I407 HydrophobicContact CB-CD1 3.96Å; P195-I407 HydrophobicContact CB-CG1 4.38Å; P195-I407 HydrophobicContact CG-CD1 4.14Å; P195-I407 HydrophobicContact CG-CG1 4.06Å; P195-I407 WeakPolarHBondContact O-CG1 3.3Å; P195-M408 HydrophobicContact CG-CE 3.6Å; P195-V413 HydrophobicContact CG-CG1 4.29Å
196	Y	94.4	Very high	93.1	Very high	2 Å²	2	6.9 Å²	6.9	1%	0.008	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.8	-178.7	-65.4	-9.2	0	0	0	110.4	I182 L183 T185 V190 A194 I202 L219 A381 T383 I407	I182-Y196 CarbonylContact C-O 3.6Å; L183-Y196 PolarHBondContact N-O 3.19Å; T185-Y196 HydrophobicContact CG2-CD2 3.63Å; T185-Y196 HydrophobicContact CG2-CE2 4.13Å; T185-Y196 HydrophobicContact CG2-CG 4.3Å; V190-Y196 HydrophobicContact CG1-CD1 3.81Å; V190-Y196 HydrophobicContact CG1-CD2 4Å; V190-Y196 HydrophobicContact CG1-CE1 3.51Å; V190-Y196 HydrophobicContact CG1-CE2 3.72Å; V190-Y196 HydrophobicContact CG1-CG 4.04Å; V190-Y196 VanDerWaalsContact CG1-CZ 3.45Å; A194-Y196 WeakPolarHBondContact O-CD1 3.45Å; A194-Y196 WeakPolarHBondContact O-CE1 3.46Å; Y196-I202 HydrophobicContact CD1-CG1 3.66Å; Y196-I202 HydrophobicContact CD1-CG2 4.14Å; Y196-I202 HydrophobicContact CD2-CD1 4.21Å; Y196-I202 HydrophobicContact CD2-CG1 3.94Å; Y196-I202 HydrophobicContact CE1-CB 4.38Å; Y196-I202 HydrophobicContact CE1-CG1 3.93Å; Y196-I202 HydrophobicContact CE1-CG2 3.5Å; Y196-I202 VanDerWaalsContact CE1-CG2 3.5Å; Y196-I202 HydrophobicContact CE2-CG1 4.19Å; Y196-I202 HydrophobicContact CE2-CG2 4.05Å; Y196-I202 HydrophobicContact CG-CD1 4.11Å; Y196-I202 HydrophobicContact CG-CG1 3.68Å; Y196-I202 VanDerWaalsContact CZ-CG2 3.46Å; Y196-L219 HydrophobicContact CE2-CD1 4.16Å; Y196-L219 HydrophobicContact CE2-CD2 4.18Å; Y196-A381 HydrophobicContact CD1-CB 4.04Å; Y196-A381 HydrophobicContact CE1-CB 4.35Å; Y196-T383 WeakPolarHBondContact CE1-OG1 3.48Å; Y196-T383 PolarHBondContact OH-OG1 3.44Å; Y196-I407 WeakPolarHBondContact O-CD1 3.44Å
197	A	91.4	Very high	92.1	Very high	12 Å²	12	8.6 Å²	8.6	10%	0.099	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	140.8	172.1	0	0	0	0	0	109.7	E181 G199 G200 I407	E181-A197 CarbonylContact O-C 3.58Å; E181-A197 WeakPolarHBondContact O-CA 3.4Å; A197-G199 PolarHBondContact O-N 3.11Å; A197-G200 PolarHBondContact O-N 2.88Å; A197-I407 HydrophobicContact CB-CD1 4.21Å; A197-I407 HydrophobicContact CB-CG1 4.49Å; A197-I407 HydrophobicContact CB-CG2 3.82Å
198	K	88.4	Confident	91.1	Very high	65 Å²	65	12.5 Å²	12.5	28%	0.283	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	120.5	172.4	-172.5	177.2	-179.2	176.5	0	110	E181 G200 D300 T348	E181-K198 HydrophobicContact CB-CB 4.29Å; E181-K198 PolarHBondContact O-N 3.1Å; K198-G200 PolarHBondContact O-N 3.16Å; K198-D300 WeakPolarHBondContact CE-OD1 3.25Å; K198-D300 WeakPolarHBondContact CE-OD2 3.32Å; K198-D300 IonicContact NZ-OD1 3.4Å; K198-D300 PolarHBondContact NZ-OD1 2.96Å; K198-D300 IonicContact NZ-OD2 3.11Å; K198-D300 PolarHBondContact NZ-OD2 2.98Å; K198-T348 PolarHBondContact O-OG1 3.43Å
199	G	86.5	Confident	90.2	Very high	8 Å²	8	16 Å²	16	8%	0.082	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	17.2	-171.7	0	0	0	0	0	115.4	A197 T348 I354 T355	A197-G199 PolarHBondContact O-N 3.11Å; G199-T348 VanDerWaalsContact CA-OG1 3.27Å; G199-T348 WeakPolarHBondContact CA-OG1 3.41Å; G199-I354 CarbonylContact C-O 3.49Å; G199-I354 VanDerWaalsContact CA-O 3.29Å; G199-I354 WeakPolarHBondContact CA-O 3.36Å; G199-T355 WeakPolarHBondContact CA-OG1 3.29Å; G199-T355 PolarHBondContact N-OG1 3.48Å
200	G	90.7	Very high	89.7	Confident	3 Å²	3	16 Å²	16	3%	0.031	13%	0.128	C	C	.	.			trans	-75.4	169.1	169.6	0	0	0	0	0	112.7	A197 K198 S356 D380	A197-G200 PolarHBondContact O-N 2.88Å; K198-G200 PolarHBondContact O-N 3.16Å; G200-S356 PolarHBondContact O-N 3.01Å; G200-D380 WeakPolarHBondContact CA-OD2 3.41Å
201	K	94.5	Very high	89.2	Confident	15 Å²	15	17 Å²	17	7%	0.065	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.9	174.8	-63.7	156.7	-177.1	175.9	0	109.4	Q343 E344 I346 H378 L379 D380 A381	K201-Q343 WeakPolarHBondContact CE-O 3.09Å; K201-Q343 PolarHBondContact NZ-O 3.32Å; K201-E344 IonicContact NZ-OE1 3.24Å; K201-E344 PolarHBondContact NZ-OE1 3.36Å; K201-E344 VanDerWaalsContact NZ-OE1 3.15Å; K201-I346 WeakPolarHBondContact CE-O 3.47Å; K201-I346 HydrophobicContact CG-CG2 4.09Å; K201-H378 WeakPolarHBondContact CB-O 3.23Å; K201-H378 HydrophobicContact CD-CB 4.28Å; K201-H378 WeakPolarHBondContact CD-O 3.34Å; K201-L379 HydrophobicContact CB-CD2 4.18Å; K201-D380 PolarHBondContact N-OD2 3.08Å; K201-D380 PolarHBondContact O-N 3.14Å; K201-A381 PolarHBondContact O-N 2.91Å
202	I	95.1	Very high	88.7	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.7	-176.8	-59.7	90.7	0	0	0	109.3	Y196 L204 T355 S356 V357 Q358 A381	Y196-I202 HydrophobicContact CD1-CG1 3.66Å; Y196-I202 HydrophobicContact CD1-CG2 4.14Å; Y196-I202 HydrophobicContact CD2-CD1 4.21Å; Y196-I202 HydrophobicContact CD2-CG1 3.94Å; Y196-I202 HydrophobicContact CE1-CB 4.38Å; Y196-I202 HydrophobicContact CE1-CG1 3.93Å; Y196-I202 HydrophobicContact CE1-CG2 3.5Å; Y196-I202 VanDerWaalsContact CE1-CG2 3.5Å; Y196-I202 HydrophobicContact CE2-CG1 4.19Å; Y196-I202 HydrophobicContact CE2-CG2 4.05Å; Y196-I202 HydrophobicContact CG-CD1 4.11Å; Y196-I202 HydrophobicContact CG-CG1 3.68Å; Y196-I202 VanDerWaalsContact CZ-CG2 3.46Å; I202-L204 HydrophobicContact CG2-CD2 4.43Å; I202-T355 HydrophobicContact CD1-CG2 3.46Å; I202-T355 VanDerWaalsContact CD1-CG2 3.46Å; I202-S356 WeakPolarHBondContact CB-O 3.27Å; I202-S356 WeakPolarHBondContact CD1-O 3.24Å; I202-S356 PolarHBondContact N-O 2.92Å; I202-V357 HydrophobicContact CB-CG2 4.36Å; I202-V357 HydrophobicContact CD1-CG2 4.32Å; I202-Q358 PolarHBondContact O-N 3.14Å; I202-A381 WeakPolarHBondContact CA-O 3.5Å; I202-A381 HydrophobicContact CG1-CB 4.25Å
203	G	94.1	Very high	87.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.4	169.7	0	0	0	0	0	111.9	F205 Q358 A381 T383	G203-F205 WeakPolarHBondContact O-CD2 3.07Å; G203-Q358 CarbonylContact C-O 3.34Å; G203-Q358 WeakPolarHBondContact CA-O 3.42Å; G203-A381 PolarHBondContact N-O 3.4Å; G203-T383 PolarHBondContact O-N 3.31Å
204	L	92	Very high	87.3	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	110.7	168.3	-64.7	-175	0	0	0	109.8	I202 L215 I216 V357 Q358 A359 I360 T383	I202-L204 HydrophobicContact CG2-CD2 4.43Å; L204-L215 HydrophobicContact CD2-CD2 3.98Å; L204-I216 HydrophobicContact CD1-CD1 4.04Å; L204-I216 HydrophobicContact CD1-CG1 3.6Å; L204-V357 HydrophobicContact CD1-CG1 3.35Å; L204-V357 HydrophobicContact CD2-CG1 4.17Å; L204-V357 HydrophobicContact CG-CG1 3.52Å; L204-Q358 PolarHBondContact N-O 3.31Å; L204-A359 WeakPolarHBondContact O-CA 3.39Å; L204-I360 PolarHBondContact O-N 3.38Å; L204-T383 WeakPolarHBondContact CA-O 3.36Å; L204-T383 HydrophobicContact CD2-CG2 4.16Å
205	F	87.5	Confident	87.1	Confident	11 Å²	11	23.3 Å²	23.3	5%	0.048	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	147.2	176.6	-60.1	-92.3	0	0	0	109.9	G203 I360 V362 F376 L379 T382 T383 V384 L385	G203-F205 WeakPolarHBondContact O-CD2 3.07Å; F205-I360 HydrophobicContact CD1-CB 4Å; F205-I360 HydrophobicContact CD1-CG2 4.09Å; F205-I360 HydrophobicContact CE1-CB 3.64Å; F205-I360 HydrophobicContact CE1-CD1 3.8Å; F205-I360 HydrophobicContact CE1-CG1 4.32Å; F205-I360 HydrophobicContact CE1-CG2 3.51Å; F205-I360 HydrophobicContact CE2-CD1 3.99Å; F205-I360 HydrophobicContact CZ-CB 4.08Å; F205-I360 HydrophobicContact CZ-CD1 3.33Å; F205-I360 HydrophobicContact CZ-CG1 4.28Å; F205-I360 HydrophobicContact CZ-CG2 4.23Å; F205-V362 HydrophobicContact CD1-CG2 3.8Å; F205-V362 HydrophobicContact CE1-CG2 4.2Å; F205-F376 HydrophobicContact CD1-CZ 4.34Å; F205-F376 AromaticContact CE1-CE1 3.53Å; F205-F376 HydrophobicContact CE1-CE1 3.53Å; F205-F376 HydrophobicContact CE1-CE2 4.44Å; F205-F376 AromaticContact CE1-CZ 3.4Å; F205-F376 HydrophobicContact CE1-CZ 3.4Å; F205-F376 AromaticContact CE2-CE1 3.75Å; F205-F376 HydrophobicContact CE2-CE1 3.75Å; F205-F376 HydrophobicContact CE2-CZ 4.41Å; F205-F376 AromaticContact CZ-CD1 3.89Å; F205-F376 HydrophobicContact CZ-CD1 3.89Å; F205-F376 AromaticContact CZ-CE1 3.03Å; F205-F376 HydrophobicContact CZ-CE1 3.03Å; F205-F376 AromaticContact CZ-CZ 3.47Å; F205-F376 HydrophobicContact CZ-CZ 3.47Å; F205-F376 VanDerWaalsContact CZ-CZ 3.47Å; F205-L379 HydrophobicContact CE2-CD1 4.13Å; F205-L379 HydrophobicContact CZ-CD1 3.94Å; F205-T382 HydrophobicContact CE2-CG2 3.87Å; F205-T383 PolarHBondContact N-O 3.08Å; F205-V384 HydrophobicContact CB-CB 4.45Å; F205-V384 HydrophobicContact CB-CG1 4.36Å; F205-V384 HydrophobicContact CB-CG2 4.2Å; F205-V384 HydrophobicContact CD2-CG2 4.29Å; F205-V384 HydrophobicContact CG-CG2 4.49Å; F205-L385 WeakPolarHBondContact O-CB 3.36Å; F205-L385 PolarHBondContact O-N 2.91Å
206	G	80.1	Confident	86.7	Confident	20 Å²	20	23.4 Å²	23.4	21%	0.206	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.7	151.9	172.9	0	0	0	0	0	113.5	K212 L385	G206-K212 WeakPolarHBondContact O-CE 3.38Å; G206-K212 PolarHBondContact O-NZ 3.48Å; G206-L385 WeakPolarHBondContact CA-O 3.39Å
207	G	72.9	Confident	86.2	Confident	37 Å²	37	23.7 Å²	23.7	38%	0.381	18%	0.176	S	C	.	.			trans	-69.1	-179.8	176.1	0	0	0	0	0	113.4	V210	G207-V210 VanDerWaalsContact O-CG2 3.31Å; G207-V210 WeakPolarHBondContact O-CG2 3.32Å
208	A	74.7	Confident	86.1	Confident	81 Å²	81	23.2 Å²	23.2	67%	0.669	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	140.6	169.6	0	0	0	0	0	110.6	R387	A208-R387 PolarHBondContact O-NH2 3.17Å
209	G	77.5	Confident	86.1	Confident	73 Å²	73	20.3 Å²	20.3	75%	0.753	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	0.1	173.3	0	0	0	0	0	116.6	G211	G209-G211 VanDerWaalsContact C-N 3.3Å; G209-G211 PolarHBondContact O-N 3.12Å
210	V	85.2	Confident	86	Confident	3 Å²	3	20 Å²	20	2%	0.018	16%	0.155	C	C	.	.	S	Bend	trans	-84.1	0.9	-179.7	-56	0	0	0	0	114.3	G207 K212 L385 R387	G207-V210 VanDerWaalsContact O-CG2 3.31Å; G207-V210 WeakPolarHBondContact O-CG2 3.32Å; V210-K212 HydrophobicContact CG2-CG 4.19Å; V210-L385 HydrophobicContact CB-CB 4.06Å; V210-L385 HydrophobicContact CG2-CB 3.46Å; V210-L385 VanDerWaalsContact CG2-CB 3.46Å; V210-L385 HydrophobicContact CG2-CD1 3.91Å; V210-L385 HydrophobicContact CG2-CG 4.35Å; V210-R387 HydrophobicContact CG1-CB 4.2Å
211	G	85.9	Confident	85.7	Confident	22 Å²	22	20.2 Å²	20.2	23%	0.227	16%	0.156	C	C	.	.	S	Bend	trans	93.3	21.9	176.6	0	0	0	0	0	116.5	G209 T213 V214 L215	G209-G211 VanDerWaalsContact C-N 3.3Å; G209-G211 PolarHBondContact O-N 3.12Å; G211-T213 PolarHBondContact O-N 2.98Å; G211-V214 PolarHBondContact O-N 3.2Å; G211-L215 PolarHBondContact O-N 3.06Å
212	K	85.2	Confident	85.3	Confident	34 Å²	34	19.6 Å²	19.6	15%	0.148	15%	0.153	C	C	.	.	H	α-helix	trans	-51.2	-53.3	176.9	-77.1	-175.4	-62.7	-171	0	113.4	G206 V210 V214 L215 I216 L385	G206-K212 WeakPolarHBondContact O-CE 3.38Å; G206-K212 PolarHBondContact O-NZ 3.48Å; V210-K212 HydrophobicContact CG2-CG 4.19Å; K212-V214 VanDerWaalsContact C-N 3.32Å; K212-V214 PolarHBondContact O-N 3.5Å; K212-L215 PolarHBondContact O-N 2.6Å; K212-I216 WeakPolarHBondContact O-CG1 3.04Å; K212-I216 PolarHBondContact O-N 3.25Å; K212-L385 HydrophobicContact CB-CD1 4.25Å; K212-L385 HydrophobicContact CG-CD1 3.47Å; K212-L385 VanDerWaalsContact CG-CD1 3.47Å
213	T	80.1	Confident	84.4	Confident	55 Å²	55	20 Å²	20	34%	0.337	16%	0.156	S	C	.	.	H	α-helix	trans	-62.1	-41	-178.6	-47	0	0	0	0	111.6	G211 L215 I216 M217 L246	G211-T213 PolarHBondContact O-N 2.98Å; T213-L215 PolarHBondContact O-N 3.4Å; T213-I216 PolarHBondContact O-N 3.36Å; T213-M217 HydrophobicContact CG2-CE 4.44Å; T213-M217 WeakPolarHBondContact O-CG 3.23Å; T213-M217 PolarHBondContact O-N 3.42Å; T213-L246 HydrophobicContact CG2-CD1 3.81Å
214	V	86.2	Confident	83.4	Confident	47 Å²	47	21 Å²	21	29%	0.285	16%	0.164	S	C	.	.	H	α-helix	trans	-63.9	-42.3	177.7	-171.8	0	0	0	0	110.9	G211 K212 M217 E218 F468 V470 A471	G211-V214 PolarHBondContact O-N 3.2Å; K212-V214 VanDerWaalsContact C-N 3.32Å; K212-V214 PolarHBondContact O-N 3.5Å; V214-M217 HydrophobicContact CG2-CE 4.45Å; V214-M217 PolarHBondContact O-N 2.72Å; V214-E218 WeakPolarHBondContact O-CB 3.28Å; V214-E218 PolarHBondContact O-N 3.06Å; V214-F468 HydrophobicContact CG1-CD2 4.1Å; V214-V470 HydrophobicContact CG1-CG2 3.97Å; V214-A471 HydrophobicContact CG1-CB 4.24Å
215	L	90.4	Very high	82.6	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-42.6	174.8	-178.1	63.8	0	0	0	112.1	I187 L204 G211 K212 T213 E218 L219 L385 P396 F468	I187-L215 HydrophobicContact CD1-CD1 3.64Å; L204-L215 HydrophobicContact CD2-CD2 3.98Å; G211-L215 PolarHBondContact O-N 3.06Å; K212-L215 PolarHBondContact O-N 2.6Å; T213-L215 PolarHBondContact O-N 3.4Å; L215-E218 PolarHBondContact O-N 3.48Å; L215-L219 HydrophobicContact CG-CD1 4.3Å; L215-L219 WeakPolarHBondContact O-CG 3.47Å; L215-L219 PolarHBondContact O-N 2.92Å; L215-L385 HydrophobicContact CD2-CD1 4.36Å; L215-L385 HydrophobicContact CD2-CD2 4.16Å; L215-P396 HydrophobicContact CD1-CB 4.3Å; L215-F468 HydrophobicContact CB-CE2 4.48Å; L215-F468 HydrophobicContact CD1-CE2 3.83Å; L215-F468 HydrophobicContact CD1-CZ 3.72Å
216	I	87.6	Confident	81.9	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-48	176.2	-73.5	168	0	0	0	110.9	L204 K212 T213 E218 L219 I220 F233 F304	L204-I216 HydrophobicContact CD1-CD1 4.04Å; L204-I216 HydrophobicContact CD1-CG1 3.6Å; K212-I216 WeakPolarHBondContact O-CG1 3.04Å; K212-I216 PolarHBondContact O-N 3.25Å; T213-I216 PolarHBondContact O-N 3.36Å; I216-E218 VanDerWaalsContact C-N 3.33Å; I216-E218 PolarHBondContact O-N 3.15Å; I216-L219 PolarHBondContact O-N 3.02Å; I216-I220 HydrophobicContact CG2-CD1 3.97Å; I216-I220 WeakPolarHBondContact O-CG1 3.49Å; I216-I220 PolarHBondContact O-N 2.98Å; I216-F233 HydrophobicContact CG2-CD2 4.29Å; I216-F233 HydrophobicContact CG2-CE2 4.08Å; I216-F304 HydrophobicContact CB-CD1 4.2Å; I216-F304 HydrophobicContact CB-CE1 4.33Å; I216-F304 HydrophobicContact CG1-CD1 4.09Å; I216-F304 HydrophobicContact CG1-CE1 4.41Å; I216-F304 HydrophobicContact CG2-CB 4.42Å; I216-F304 HydrophobicContact CG2-CD1 3.41Å; I216-F304 VanDerWaalsContact CG2-CD1 3.41Å; I216-F304 HydrophobicContact CG2-CE1 3.77Å; I216-F304 HydrophobicContact CG2-CG 3.94Å
217	M	84.3	Confident	81.3	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.039	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-40.9	178.3	-71.8	-169.8	-66.6	0	0	112.3	T213 V214 I220 N221 L246 E249 V470	T213-M217 HydrophobicContact CG2-CE 4.44Å; T213-M217 WeakPolarHBondContact O-CG 3.23Å; T213-M217 PolarHBondContact O-N 3.42Å; V214-M217 HydrophobicContact CG2-CE 4.45Å; V214-M217 PolarHBondContact O-N 2.72Å; M217-I220 PolarHBondContact O-N 2.9Å; M217-N221 WeakPolarHBondContact O-CB 3.12Å; M217-N221 PolarHBondContact O-N 2.78Å; M217-L246 HydrophobicContact CG-CD1 3.51Å; M217-L246 HydrophobicContact SD-CD1 3.62Å; M217-E249 WeakPolarHBondContact CE-OE2 3.31Å; M217-E249 HydrophobicContact SD-CB 3.78Å; M217-V470 HydrophobicContact CB-CB 4.3Å; M217-V470 HydrophobicContact CB-CG1 4.11Å; M217-V470 HydrophobicContact CB-CG2 4.07Å
218	E	89.3	Confident	81.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-41	176.5	-174.2	69.1	-179	0	0	111.4	I187 V214 L215 I216 I220 N221 N222 F468 Q469 V470	I187-E218 HydrophobicContact CD1-CG 4.26Å; V214-E218 WeakPolarHBondContact O-CB 3.28Å; V214-E218 PolarHBondContact O-N 3.06Å; L215-E218 PolarHBondContact O-N 3.48Å; I216-E218 VanDerWaalsContact C-N 3.33Å; I216-E218 PolarHBondContact O-N 3.15Å; E218-I220 PolarHBondContact O-N 3.03Å; E218-N221 PolarHBondContact O-N 2.8Å; E218-N222 WeakPolarHBondContact O-CB 3.43Å; E218-N222 VanDerWaalsContact O-CG 3.22Å; E218-N222 PolarHBondContact O-N 3.48Å; E218-N222 PolarHBondContact O-OD1 3.46Å; E218-N222 PolarHBondContact OE1-ND2 3.25Å; E218-N222 PolarHBondContact OE1-OD1 3.2Å; E218-F468 HydrophobicContact CB-CB 4.37Å; E218-F468 HydrophobicContact CB-CD1 4.48Å; E218-F468 HydrophobicContact CB-CD2 3.69Å; E218-F468 HydrophobicContact CB-CE2 3.97Å; E218-F468 HydrophobicContact CB-CG 3.97Å; E218-F468 HydrophobicContact CB-CZ 4.44Å; E218-F468 HydrophobicContact CG-CB 4.01Å; E218-F468 HydrophobicContact CG-CD1 3.69Å; E218-F468 HydrophobicContact CG-CD2 3.82Å; E218-F468 HydrophobicContact CG-CE1 3.99Å; E218-F468 HydrophobicContact CG-CE2 4.12Å; E218-F468 HydrophobicContact CG-CG 3.58Å; E218-F468 HydrophobicContact CG-CZ 4.18Å; E218-Q469 PolarHBondContact OE1-N 3.49Å; E218-Q469 PolarHBondContact OE2-N 2.87Å; E218-V470 HydrophobicContact CB-CG2 4.01Å; E218-V470 WeakPolarHBondContact OE2-CG2 3.38Å; E218-V470 PolarHBondContact OE2-N 2.91Å; E218-V470 VanDerWaalsContact OE2-N 3.16Å
219	L	89.2	Confident	81.5	Confident	4 Å²	4	29 Å²	29	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-44	174.6	-73.6	169.8	0	0	0	111.8	T185 I187 Y196 L215 I216 N221 N222 V223 F304 V357	T185-L219 HydrophobicContact CG2-CD2 3.75Å; I187-L219 HydrophobicContact CD1-CD2 3.81Å; I187-L219 HydrophobicContact CD1-CG 4.19Å; Y196-L219 HydrophobicContact CE2-CD1 4.16Å; Y196-L219 HydrophobicContact CE2-CD2 4.18Å; L215-L219 HydrophobicContact CG-CD1 4.3Å; L215-L219 WeakPolarHBondContact O-CG 3.47Å; L215-L219 PolarHBondContact O-N 2.92Å; I216-L219 PolarHBondContact O-N 3.02Å; L219-N221 PolarHBondContact O-N 3.14Å; L219-N222 PolarHBondContact O-N 3.42Å; L219-V223 WeakPolarHBondContact O-CB 3.33Å; L219-V223 WeakPolarHBondContact O-CG2 3.24Å; L219-V223 PolarHBondContact O-N 3.43Å; L219-F304 HydrophobicContact CB-CE1 4.15Å; L219-F304 HydrophobicContact CB-CZ 4.08Å; L219-F304 HydrophobicContact CD1-CE1 4.48Å; L219-V357 HydrophobicContact CD1-CG1 4.2Å; L219-V357 HydrophobicContact CD1-CG2 4.38Å
220	I	84.3	Confident	82.1	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-50.4	174.1	-67.7	166.9	0	0	0	110	I216 M217 E218 A224 M250 V255 F304	I216-I220 HydrophobicContact CG2-CD1 3.97Å; I216-I220 WeakPolarHBondContact O-CG1 3.49Å; I216-I220 PolarHBondContact O-N 2.98Å; M217-I220 PolarHBondContact O-N 2.9Å; E218-I220 PolarHBondContact O-N 3.03Å; I220-A224 WeakPolarHBondContact O-CB 3.23Å; I220-A224 PolarHBondContact O-N 3.23Å; I220-M250 HydrophobicContact CD1-CE 3.51Å; I220-V255 HydrophobicContact CG2-CG1 3.76Å; I220-F304 HydrophobicContact CB-CE2 4.41Å; I220-F304 HydrophobicContact CB-CZ 4.48Å; I220-F304 HydrophobicContact CD1-CD2 3.97Å; I220-F304 HydrophobicContact CD1-CE2 3.87Å; I220-F304 HydrophobicContact CD1-CG 4.45Å; I220-F304 HydrophobicContact CD1-CZ 4.24Å; I220-F304 HydrophobicContact CG1-CD2 3.78Å; I220-F304 HydrophobicContact CG1-CE1 4.19Å; I220-F304 HydrophobicContact CG1-CE2 3.15Å; I220-F304 HydrophobicContact CG1-CZ 3.38Å
221	N	84.2	Confident	82.4	Confident	9 Å²	9	27.3 Å²	27.3	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-46.6	-178.1	176.7	68.1	0	0	0	112.4	M217 E218 L219 K225 Q469 V470	M217-N221 WeakPolarHBondContact O-CB 3.12Å; M217-N221 PolarHBondContact O-N 2.78Å; E218-N221 PolarHBondContact O-N 2.8Å; L219-N221 PolarHBondContact O-N 3.14Å; N221-K225 PolarHBondContact ND2-NZ 2.79Å; N221-K225 WeakPolarHBondContact O-CB 3.43Å; N221-K225 WeakPolarHBondContact O-CG 3.2Å; N221-K225 PolarHBondContact O-N 2.99Å; N221-K225 VanDerWaalsContact O-N 3.08Å; N221-K225 WeakPolarHBondContact OD1-CE 3.47Å; N221-K225 PolarHBondContact OD1-NZ 3.38Å; N221-Q469 PolarHBondContact ND2-OE1 3.17Å; N221-V470 HydrophobicContact CB-CG1 4.01Å
222	N	85.3	Confident	82.9	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.011	16%	0.155	C	C	.	.	H	α-helix	trans	-71.5	-41.8	-174.6	-69.5	-2.7	0	0	0	111.5	T185 E218 L219 K225 A226 L481	T185-N222 VanDerWaalsContact O-CB 3.29Å; T185-N222 WeakPolarHBondContact O-CB 3.21Å; T185-N222 PolarHBondContact O-ND2 2.7Å; E218-N222 WeakPolarHBondContact O-CB 3.43Å; E218-N222 VanDerWaalsContact O-CG 3.22Å; E218-N222 PolarHBondContact O-N 3.48Å; E218-N222 PolarHBondContact O-OD1 3.46Å; E218-N222 PolarHBondContact OE1-ND2 3.25Å; E218-N222 PolarHBondContact OE1-OD1 3.2Å; L219-N222 PolarHBondContact O-N 3.42Å; N222-K225 PolarHBondContact O-N 3.14Å; N222-A226 WeakPolarHBondContact O-CB 3.35Å; N222-A226 PolarHBondContact O-N 3.36Å; N222-L481 HydrophobicContact CB-CD1 4.16Å
223	V	77.1	Confident	83.3	Confident	9 Å²	9	25.1 Å²	25.1	6%	0.055	15%	0.15	C	C	.	.	H	α-helix	trans	-73.5	-37.2	178.7	176.6	0	0	0	0	111.6	L219 K225 A226 H227 G228 L302	L219-V223 WeakPolarHBondContact O-CB 3.33Å; L219-V223 WeakPolarHBondContact O-CG2 3.24Å; L219-V223 PolarHBondContact O-N 3.43Å; V223-K225 VanDerWaalsContact C-N 3.28Å; V223-K225 PolarHBondContact O-N 2.9Å; V223-A226 PolarHBondContact O-N 3.35Å; V223-H227 HydrophobicContact CG1-CB 4.08Å; V223-H227 WeakPolarHBondContact O-CA 3.49Å; V223-H227 WeakPolarHBondContact O-CB 3.41Å; V223-H227 PolarHBondContact O-N 3.31Å; V223-G228 PolarHBondContact O-N 3.37Å; V223-L302 HydrophobicContact CB-CD1 3.53Å; V223-L302 HydrophobicContact CB-CG 4.31Å; V223-L302 HydrophobicContact CG1-CD1 3.66Å; V223-L302 HydrophobicContact CG1-CD2 4.29Å; V223-L302 HydrophobicContact CG1-CG 3.87Å; V223-L302 HydrophobicContact CG2-CD1 3.76Å
224	A	72.1	Confident	84.1	Confident	21 Å²	21	22.5 Å²	22.5	17%	0.174	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-37.4	173.2	0	0	0	0	0	112.3	I220 G228 K264	I220-A224 WeakPolarHBondContact O-CB 3.23Å; I220-A224 PolarHBondContact O-N 3.23Å; A224-G228 WeakPolarHBondContact O-CA 3.23Å; A224-G228 PolarHBondContact O-N 2.95Å; A224-K264 HydrophobicContact CB-CB 4.42Å
225	K	75.3	Confident	84.5	Confident	112 Å²	112	20.2 Å²	20.2	49%	0.487	12%	0.12	S	C	.	.	H	α-helix	trans	-76.2	-41.1	177.7	-76.7	172.5	173.5	155.6	0	113.6	N221 N222 V223 Q469	N221-K225 PolarHBondContact ND2-NZ 2.79Å; N221-K225 WeakPolarHBondContact O-CB 3.43Å; N221-K225 WeakPolarHBondContact O-CG 3.2Å; N221-K225 PolarHBondContact O-N 2.99Å; N221-K225 VanDerWaalsContact O-N 3.08Å; N221-K225 WeakPolarHBondContact OD1-CE 3.47Å; N221-K225 PolarHBondContact OD1-NZ 3.38Å; N222-K225 PolarHBondContact O-N 3.14Å; V223-K225 VanDerWaalsContact C-N 3.28Å; V223-K225 PolarHBondContact O-N 2.9Å; K225-Q469 VanDerWaalsContact NZ-NE2 3.15Å
226	A	72.4	Confident	84.7	Confident	64 Å²	64	20.2 Å²	20.2	53%	0.529	12%	0.12	S	C	.	.	H	α-helix	trans	-86.9	-37.9	-173.3	0	0	0	0	0	113.5	N222 V223	N222-A226 WeakPolarHBondContact O-CB 3.35Å; N222-A226 PolarHBondContact O-N 3.36Å; V223-A226 PolarHBondContact O-N 3.35Å
227	H	68.7	Low	84.9	Confident	94 Å²	94	20.1 Å²	20.1	44%	0.435	12%	0.119	S	C	.	.	H	α-helix	trans	-114.3	-9.3	-171.1	-61.6	-80.2	0	0	0	113.6	V184 V223 G229	V184-H227 PolarHBondContact O-NE2 2.95Å; V223-H227 HydrophobicContact CG1-CB 4.08Å; V223-H227 WeakPolarHBondContact O-CA 3.49Å; V223-H227 WeakPolarHBondContact O-CB 3.41Å; V223-H227 PolarHBondContact O-N 3.31Å; H227-G229 PolarHBondContact O-N 3.09Å; H227-G229 VanDerWaalsContact O-N 3.11Å
228	G	70.6	Confident	85	Confident	41 Å²	41	20.8 Å²	20.8	42%	0.423	12%	0.122	S	C	.	.			trans	69.2	4.5	175.3	0	0	0	0	0	115.7	V223 A224	V223-G228 PolarHBondContact O-N 3.37Å; A224-G228 WeakPolarHBondContact O-CA 3.23Å; A224-G228 PolarHBondContact O-N 2.95Å
229	G	80.6	Confident	85	Confident	7 Å²	7	26.7 Å²	26.7	7%	0.072	14%	0.144	C	C	.	.			trans	-74.7	163.7	-178.7	0	0	0	0	0	114.2	H227 D300	H227-G229 PolarHBondContact O-N 3.09Å; H227-G229 VanDerWaalsContact O-N 3.11Å; G229-D300 WeakPolarHBondContact CA-O 3.32Å
230	Y	89.4	Confident	85	Confident	39 Å²	39	30.5 Å²	30.5	15%	0.153	17%	0.168	C	C	.	.			trans	-88.2	155.2	173.5	-63	-48.2	0	0	0	112	L141 K264 F293 E297 V301 L302	L141-Y230 HydrophobicContact CD1-CD1 3.67Å; L141-Y230 HydrophobicContact CD1-CD2 4.39Å; L141-Y230 HydrophobicContact CD1-CE1 3.38Å; L141-Y230 HydrophobicContact CD1-CE2 4.15Å; L141-Y230 HydrophobicContact CD1-CG 4.2Å; L141-Y230 HydrophobicContact CD2-CD1 3.96Å; L141-Y230 HydrophobicContact CD2-CG 4.09Å; L141-Y230 HydrophobicContact CG-CD1 4.5Å; Y230-K264 HydrophobicContact CD1-CD 3.92Å; Y230-K264 HydrophobicContact CE1-CD 3.81Å; Y230-F293 AromaticContact CD2-CD1 3.56Å; Y230-F293 HydrophobicContact CD2-CD1 3.56Å; Y230-F293 AromaticContact CD2-CE1 3.71Å; Y230-F293 HydrophobicContact CD2-CE1 3.71Å; Y230-F293 HydrophobicContact CD2-CG 4.01Å; Y230-F293 HydrophobicContact CD2-CZ 4.26Å; Y230-F293 HydrophobicContact CE2-CD1 4.05Å; Y230-F293 HydrophobicContact CE2-CE1 4.01Å; Y230-E297 WeakPolarHBondContact CE2-OE2 3.35Å; Y230-V301 WeakPolarHBondContact O-CA 3.46Å; Y230-L302 PolarHBondContact O-N 2.97Å
231	S	92.4	Very high	85.3	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	146.4	173.8	-62.3	0	0	0	0	110.7	K264 V265 A266 L302	S231-K264 PolarHBondContact N-O 2.76Å; S231-V265 CarbonylContact O-C 3.59Å; S231-V265 WeakPolarHBondContact O-CA 3.49Å; S231-A266 PolarHBondContact O-N 2.79Å; S231-L302 CarbonylContact C-O 3.58Å; S231-L302 VanDerWaalsContact CA-O 3.28Å; S231-L302 WeakPolarHBondContact CA-O 3.33Å
232	V	95.3	Very high	85.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.5	170.3	-176.8	0	0	0	0	107.6	A266 V268 G286 V289 A290 F293 V301 L302 L303 F304	V232-A266 WeakPolarHBondContact CA-O 3.37Å; V232-V268 HydrophobicContact CG1-CG2 4.3Å; V232-G286 WeakPolarHBondContact CG1-O 3.48Å; V232-V289 HydrophobicContact CG1-CB 4.26Å; V232-V289 HydrophobicContact CG1-CG1 4.3Å; V232-V289 HydrophobicContact CG2-CB 4.37Å; V232-V289 HydrophobicContact CG2-CG1 3.84Å; V232-A290 HydrophobicContact CB-CB 4.41Å; V232-A290 HydrophobicContact CG2-CB 4.08Å; V232-F293 HydrophobicContact CG2-CD2 4.28Å; V232-F293 HydrophobicContact CG2-CE2 4.33Å; V232-V301 HydrophobicContact CG2-CG1 4.29Å; V232-L302 PolarHBondContact N-O 2.82Å; V232-L303 HydrophobicContact CB-CD1 4.02Å; V232-L303 HydrophobicContact CG1-CD1 4.13Å; V232-L303 WeakPolarHBondContact O-CA 3.26Å; V232-F304 PolarHBondContact O-N 2.7Å
233	F	95.3	Very high	85.4	Confident	9 Å²	9	39.7 Å²	39.7	4%	0.039	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117	175.6	-173.7	-80.8	0	0	0	109.7	I216 L246 V265 A266 L267 V268 Y269 F304 D306	I216-F233 HydrophobicContact CG2-CD2 4.29Å; I216-F233 HydrophobicContact CG2-CE2 4.08Å; F233-L246 HydrophobicContact CD1-CD2 4.08Å; F233-L246 HydrophobicContact CD2-CD2 3.95Å; F233-L246 HydrophobicContact CE1-CD2 3.72Å; F233-L246 HydrophobicContact CE2-CD2 3.57Å; F233-L246 HydrophobicContact CG-CD2 4.19Å; F233-L246 HydrophobicContact CZ-CD2 3.44Å; F233-L246 VanDerWaalsContact CZ-CD2 3.44Å; F233-V265 HydrophobicContact CB-CG2 4.42Å; F233-A266 PolarHBondContact N-O 3.49Å; F233-L267 HydrophobicContact CB-CD2 3.64Å; F233-L267 HydrophobicContact CD1-CD2 4.44Å; F233-L267 HydrophobicContact CG-CD2 4.27Å; F233-V268 PolarHBondContact O-N 3.33Å; F233-Y269 HydrophobicContact CD1-CD1 4.47Å; F233-Y269 AromaticContact CD1-CE1 3.67Å; F233-Y269 HydrophobicContact CD1-CE1 3.67Å; F233-Y269 AromaticContact CE1-CE1 3.72Å; F233-Y269 HydrophobicContact CE1-CE1 3.72Å; F233-F304 HydrophobicContact CB-CB 4.44Å; F233-F304 HydrophobicContact CD2-CB 3.57Å; F233-F304 HydrophobicContact CD2-CG 4.35Å; F233-F304 HydrophobicContact CE2-CB 4.18Å; F233-F304 HydrophobicContact CG-CB 4.29Å; F233-D306 HydrophobicContact CE1-CB 4.5Å; F233-D306 HydrophobicContact CE2-CB 4.26Å; F233-D306 HydrophobicContact CZ-CB 3.72Å
234	A	96.1	Very high	86	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	102.1	174.2	0	0	0	0	0	109.7	V236 V268 F304 I305 D306	A234-V236 HydrophobicContact CB-CG2 4.38Å; A234-V236 PolarHBondContact O-N 2.79Å; A234-V268 CarbonylContact C-O 3.54Å; A234-V268 WeakPolarHBondContact CA-O 3.37Å; A234-F304 PolarHBondContact N-O 3.5Å; A234-I305 HydrophobicContact CB-CG1 4.47Å; A234-D306 PolarHBondContact O-N 2.98Å
235	G	94.9	Very high	86.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	89.4	172.3	0	0	0	0	0	110.8	V268 G270 D306	G235-V268 PolarHBondContact N-O 3.49Å; G235-G270 PolarHBondContact O-N 3.42Å; G235-D306 CarbonylContact C-O 3.56Å; G235-D306 VanDerWaalsContact CA-O 3.23Å; G235-D306 WeakPolarHBondContact CA-O 3.26Å
236	V	95.1	Very high	87.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	104.7	-179.4	-171	0	0	0	0	109.9	A234 E238 R279 V282 A283 I305 D306 N307 R310 F311	A234-V236 HydrophobicContact CB-CG2 4.38Å; A234-V236 PolarHBondContact O-N 2.79Å; V236-E238 VanDerWaalsContact C-N 3.26Å; V236-E238 PolarHBondContact O-N 2.95Å; V236-R279 WeakPolarHBondContact CG1-O 3.42Å; V236-V282 HydrophobicContact CB-CG1 4.09Å; V236-V282 HydrophobicContact CG1-CG1 3.92Å; V236-V282 HydrophobicContact CG2-CG1 3.94Å; V236-A283 HydrophobicContact CG2-CB 3.85Å; V236-I305 HydrophobicContact CG2-CG2 3.71Å; V236-D306 PolarHBondContact N-O 3.25Å; V236-N307 PolarHBondContact O-N 2.88Å; V236-N307 VanDerWaalsContact O-N 3.09Å; V236-R310 HydrophobicContact CG1-CB 4.11Å; V236-R310 WeakPolarHBondContact O-CB 3.42Å; V236-R310 WeakPolarHBondContact O-CG 3.32Å; V236-F311 HydrophobicContact CG1-CB 4.06Å
237	G	91	Very high	88.1	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	60.7	34.7	174.5	0	0	0	0	0	113.6	G270 M272	G237-G270 WeakPolarHBondContact CA-O 3.37Å; G237-G270 PolarHBondContact N-O 3.04Å; G237-M272 WeakPolarHBondContact O-CE 3.34Å; G237-M272 WeakPolarHBondContact O-CG 3.21Å
238	E	85.9	Confident	89.1	Confident	22 Å²	22	37.8 Å²	37.8	10%	0.103	19%	0.187	C	C	.	.			trans	-89.2	170.1	175.1	-70.7	-55.8	119.9	0	0	112.2	V236 Q271 M272 D306 N307	V236-E238 VanDerWaalsContact C-N 3.26Å; V236-E238 PolarHBondContact O-N 2.95Å; E238-Q271 PolarHBondContact O-OE1 3.38Å; E238-M272 WeakPolarHBondContact O-CG 3.22Å; E238-M272 PolarHBondContact O-N 2.96Å; E238-D306 HydrophobicContact CG-CB 4.29Å; E238-D306 WeakPolarHBondContact CG-O 3.4Å; E238-N307 WeakPolarHBondContact OE1-CB 3.29Å; E238-N307 PolarHBondContact OE1-N 3.14Å
239	R	89.7	Confident	89.7	Confident	125 Å²	125	38.5 Å²	38.5	47%	0.472	18%	0.18	S	C	.	.			trans	-75.9	135.8	176.9	-61.1	-175.9	-178.8	75.4	5.8	110	R241 E242 G243 Q271 M272	R239-R241 PolarHBondContact O-N 3.48Å; R239-R241 VanDerWaalsContact O-N 3.11Å; R239-E242 HydrophobicContact CB-CB 4.39Å; R239-E242 HydrophobicContact CB-CG 4.21Å; R239-E242 WeakPolarHBondContact CB-OE2 3.43Å; R239-E242 IonicContact NH1-OE1 3.61Å; R239-E242 PolarHBondContact NH1-OE1 3.47Å; R239-E242 IonicContact NH1-OE2 3.87Å; R239-E242 PolarHBondContact NH1-OE2 3.33Å; R239-E242 WeakPolarHBondContact O-CB 3.38Å; R239-E242 PolarHBondContact O-N 2.96Å; R239-G243 PolarHBondContact O-N 3.05Å; R239-G243 VanDerWaalsContact O-N 3.11Å; R239-Q271 PolarHBondContact O-OE1 3.41Å; R239-M272 HydrophobicContact CG-CE 4.27Å; R239-M272 HydrophobicContact CG-SD 3.87Å
240	T	90.2	Very high	89.9	Confident	84 Å²	84	38.3 Å²	38.3	52%	0.515	18%	0.177	S	C	.	.	H	α-helix	trans	-56.6	-34.3	178	-42.3	0	0	0	0	112.7	G243 N244	T240-G243 PolarHBondContact O-N 2.7Å; T240-N244 WeakPolarHBondContact O-CB 3.38Å; T240-N244 PolarHBondContact O-N 3.31Å
241	R	89.4	Confident	89.9	Confident	144 Å²	144	38.5 Å²	38.5	54%	0.543	18%	0.18	S	C	.	.	H	α-helix	trans	-60.6	-46.7	173.8	-174.1	-166.5	60	75.3	1.5	111.6	R239 N244 D245	R239-R241 PolarHBondContact O-N 3.48Å; R239-R241 VanDerWaalsContact O-N 3.11Å; R241-N244 PolarHBondContact O-N 3.15Å; R241-D245 IonicContact CZ-OD2 3.44Å; R241-D245 IonicContact NH1-OD2 3.55Å; R241-D245 PolarHBondContact NH1-OD2 3.23Å; R241-D245 WeakPolarHBondContact O-CB 3.34Å; R241-D245 PolarHBondContact O-N 3.09Å
242	E	84.1	Confident	89.5	Confident	56 Å²	56	45.6 Å²	45.6	26%	0.262	21%	0.213	S	C	.	.	H	α-helix	trans	-67.3	-38.3	-178.1	-69.9	160.6	-178.6	0	0	111.1	R239 D245 L246	R239-E242 HydrophobicContact CB-CB 4.39Å; R239-E242 HydrophobicContact CB-CG 4.21Å; R239-E242 WeakPolarHBondContact CB-OE2 3.43Å; R239-E242 IonicContact NH1-OE1 3.61Å; R239-E242 PolarHBondContact NH1-OE1 3.47Å; R239-E242 IonicContact NH1-OE2 3.87Å; R239-E242 PolarHBondContact NH1-OE2 3.33Å; R239-E242 WeakPolarHBondContact O-CB 3.38Å; R239-E242 PolarHBondContact O-N 2.96Å; E242-D245 PolarHBondContact O-N 3.04Å; E242-L246 VanDerWaalsContact O-CB 3.3Å; E242-L246 WeakPolarHBondContact O-CB 3.22Å; E242-L246 PolarHBondContact O-N 3.42Å
243	G	87.2	Confident	88.6	Confident	5 Å²	5	47.9 Å²	47.9	5%	0.052	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-39.2	171.9	0	0	0	0	0	113.4	R239 T240 Y247 Y269	R239-G243 PolarHBondContact O-N 3.05Å; R239-G243 VanDerWaalsContact O-N 3.11Å; T240-G243 PolarHBondContact O-N 2.7Å; G243-Y247 WeakPolarHBondContact O-CB 3.43Å; G243-Y247 PolarHBondContact O-N 3.18Å; G243-Y269 PolarHBondContact O-OH 3.02Å; G243-Y269 VanDerWaalsContact O-OH 3.13Å
244	N	90.8	Very high	87.8	Confident	81 Å²	81	49 Å²	49	43%	0.433	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-47.2	175.4	-179.4	84.5	0	0	0	111.9	T240 R241 L246 Y247 H248	T240-N244 WeakPolarHBondContact O-CB 3.38Å; T240-N244 PolarHBondContact O-N 3.31Å; R241-N244 PolarHBondContact O-N 3.15Å; N244-L246 VanDerWaalsContact C-N 3.34Å; N244-L246 PolarHBondContact O-N 2.87Å; N244-Y247 PolarHBondContact O-N 3.17Å; N244-H248 PolarHBondContact O-CD2 2.66Å; N244-H248 VanDerWaalsContact O-CD2 3.29Å; N244-H248 PolarHBondContact O-N 2.72Å; N244-H248 VanDerWaalsContact O-N 3.08Å
245	D	86.4	Confident	87.2	Confident	57 Å²	57	49.7 Å²	49.7	31%	0.305	25%	0.247	S	C	.	.	H	α-helix	trans	-60.3	-46.8	179.4	-62.9	-14.2	0	0	0	109.9	R241 E242 Y247 H248 E249	R241-D245 IonicContact CZ-OD2 3.44Å; R241-D245 IonicContact NH1-OD2 3.55Å; R241-D245 PolarHBondContact NH1-OD2 3.23Å; R241-D245 WeakPolarHBondContact O-CB 3.34Å; R241-D245 PolarHBondContact O-N 3.09Å; E242-D245 PolarHBondContact O-N 3.04Å; D245-Y247 VanDerWaalsContact C-N 3.33Å; D245-Y247 PolarHBondContact O-N 3.2Å; D245-H248 PolarHBondContact O-N 3.5Å; D245-E249 WeakPolarHBondContact O-CB 3.32Å; D245-E249 WeakPolarHBondContact O-CG 3.43Å; D245-E249 PolarHBondContact O-N 3.13Å
246	L	85.8	Confident	86.9	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-41.5	175.8	-174.5	63.9	0	0	0	112.6	T213 M217 F233 E242 N244 E249 M250	T213-L246 HydrophobicContact CG2-CD1 3.81Å; M217-L246 HydrophobicContact CG-CD1 3.51Å; M217-L246 HydrophobicContact SD-CD1 3.62Å; F233-L246 HydrophobicContact CD1-CD2 4.08Å; F233-L246 HydrophobicContact CD2-CD2 3.95Å; F233-L246 HydrophobicContact CE1-CD2 3.72Å; F233-L246 HydrophobicContact CE2-CD2 3.57Å; F233-L246 HydrophobicContact CG-CD2 4.19Å; F233-L246 HydrophobicContact CZ-CD2 3.44Å; F233-L246 VanDerWaalsContact CZ-CD2 3.44Å; E242-L246 VanDerWaalsContact O-CB 3.3Å; E242-L246 WeakPolarHBondContact O-CB 3.22Å; E242-L246 PolarHBondContact O-N 3.42Å; N244-L246 VanDerWaalsContact C-N 3.34Å; N244-L246 PolarHBondContact O-N 2.87Å; L246-E249 PolarHBondContact O-N 3.32Å; L246-M250 HydrophobicContact CD1-CE 3.76Å; L246-M250 HydrophobicContact CD1-CG 4.43Å; L246-M250 HydrophobicContact CD2-CE 4.01Å; L246-M250 HydrophobicContact CG-CE 3.78Å; L246-M250 HydrophobicContact CG-SD 4.32Å; L246-M250 WeakPolarHBondContact O-CB 3.38Å; L246-M250 VanDerWaalsContact O-CG 3.23Å; L246-M250 WeakPolarHBondContact O-CG 3.3Å; L246-M250 PolarHBondContact O-N 3.18Å
247	Y	91	Very high	86.7	Confident	27 Å²	27	52.3 Å²	52.3	11%	0.106	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-44.9	177.7	179.5	-121.9	0	0	0	112	I144 G243 N244 D245 M250 I251 I256 L258 L267	I144-Y247 HydrophobicContact CD1-CD1 4.09Å; I144-Y247 HydrophobicContact CD1-CD2 3.76Å; I144-Y247 HydrophobicContact CD1-CE1 4.22Å; I144-Y247 HydrophobicContact CD1-CE2 3.89Å; I144-Y247 HydrophobicContact CD1-CG 3.84Å; I144-Y247 HydrophobicContact CG1-CD2 4.14Å; I144-Y247 HydrophobicContact CG1-CE2 4.05Å; G243-Y247 WeakPolarHBondContact O-CB 3.43Å; G243-Y247 PolarHBondContact O-N 3.18Å; N244-Y247 PolarHBondContact O-N 3.17Å; D245-Y247 VanDerWaalsContact C-N 3.33Å; D245-Y247 PolarHBondContact O-N 3.2Å; Y247-M250 PolarHBondContact O-N 2.86Å; Y247-I251 HydrophobicContact CD1-CD1 3.92Å; Y247-I251 HydrophobicContact CD2-CD1 4.3Å; Y247-I251 HydrophobicContact CE1-CD1 3.61Å; Y247-I251 HydrophobicContact CE2-CD1 4.03Å; Y247-I251 HydrophobicContact CE2-CG1 4.47Å; Y247-I251 HydrophobicContact CG-CD1 4.28Å; Y247-I251 WeakPolarHBondContact O-CD1 3.49Å; Y247-I251 VanDerWaalsContact O-CG1 3.3Å; Y247-I251 WeakPolarHBondContact O-CG1 3.35Å; Y247-I251 PolarHBondContact O-N 2.85Å; Y247-I251 VanDerWaalsContact O-N 3.12Å; Y247-I256 HydrophobicContact CD2-CD1 3.72Å; Y247-I256 HydrophobicContact CE2-CD1 3.88Å; Y247-I256 HydrophobicContact CE2-CG2 4.28Å; Y247-L258 WeakPolarHBondContact OH-CD2 3.41Å; Y247-L267 HydrophobicContact CD2-CD1 3.58Å; Y247-L267 HydrophobicContact CE2-CD1 4.31Å; Y247-L267 HydrophobicContact CG-CD1 4.45Å
248	H	89.8	Confident	86.6	Confident	91 Å²	91	56.2 Å²	56.2	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-68.6	-42.4	177.8	-79.3	-74.7	0	0	0	112.3	N244 D245 M250 I251 E252	N244-H248 PolarHBondContact O-CD2 2.66Å; N244-H248 VanDerWaalsContact O-CD2 3.29Å; N244-H248 PolarHBondContact O-N 2.72Å; N244-H248 VanDerWaalsContact O-N 3.08Å; D245-H248 PolarHBondContact O-N 3.5Å; H248-M250 VanDerWaalsContact C-N 3.29Å; H248-M250 PolarHBondContact O-N 3.17Å; H248-I251 WeakPolarHBondContact O-CB 3.22Å; H248-I251 PolarHBondContact O-N 2.87Å; H248-I251 VanDerWaalsContact O-N 3.08Å; H248-E252 WeakPolarHBondContact O-CG 3.43Å; H248-E252 PolarHBondContact O-N 3.12Å
249	E	82.6	Confident	86.7	Confident	56 Å²	56	64.7 Å²	64.7	26%	0.262	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-38.8	175.2	-73.3	176.2	167	0	0	111.7	M217 D245 L246 I251 E252 S253	M217-E249 WeakPolarHBondContact CE-OE2 3.31Å; M217-E249 HydrophobicContact SD-CB 3.78Å; D245-E249 WeakPolarHBondContact O-CB 3.32Å; D245-E249 WeakPolarHBondContact O-CG 3.43Å; D245-E249 PolarHBondContact O-N 3.13Å; L246-E249 PolarHBondContact O-N 3.32Å; E249-I251 VanDerWaalsContact C-N 3.33Å; E249-I251 PolarHBondContact O-N 3.29Å; E249-E252 PolarHBondContact O-N 2.87Å; E249-S253 VanDerWaalsContact O-CB 3.3Å; E249-S253 WeakPolarHBondContact O-CB 3.48Å; E249-S253 PolarHBondContact O-N 2.8Å; E249-S253 PolarHBondContact O-OG 3.39Å
250	M	85.9	Confident	86.5	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-68.1	-30.4	174.8	-75.6	-175.5	178.4	0	0	113.3	I220 L246 Y247 H248 S253 G254 V255 I256 V265 L267	I220-M250 HydrophobicContact CD1-CE 3.51Å; L246-M250 HydrophobicContact CD1-CE 3.76Å; L246-M250 HydrophobicContact CD1-CG 4.43Å; L246-M250 HydrophobicContact CD2-CE 4.01Å; L246-M250 HydrophobicContact CG-CE 3.78Å; L246-M250 HydrophobicContact CG-SD 4.32Å; L246-M250 WeakPolarHBondContact O-CB 3.38Å; L246-M250 VanDerWaalsContact O-CG 3.23Å; L246-M250 WeakPolarHBondContact O-CG 3.3Å; L246-M250 PolarHBondContact O-N 3.18Å; Y247-M250 PolarHBondContact O-N 2.86Å; H248-M250 VanDerWaalsContact C-N 3.29Å; H248-M250 PolarHBondContact O-N 3.17Å; M250-S253 WeakPolarHBondContact CA-OG 3.49Å; M250-S253 PolarHBondContact O-OG 2.92Å; M250-G254 PolarHBondContact O-N 3.29Å; M250-V255 HydrophobicContact CB-CB 4.33Å; M250-V255 PolarHBondContact O-N 3.1Å; M250-I256 HydrophobicContact CB-CB 4.38Å; M250-I256 HydrophobicContact CB-CD1 3.68Å; M250-I256 HydrophobicContact CB-CG1 3.88Å; M250-I256 HydrophobicContact CG-CD1 4.46Å; M250-I256 PolarHBondContact O-N 3.31Å; M250-I256 HydrophobicContact SD-CD1 3.94Å; M250-I256 HydrophobicContact SD-CG1 4.48Å; M250-V265 HydrophobicContact CE-CG2 4.43Å; M250-V265 HydrophobicContact SD-CG1 3.8Å; M250-V265 HydrophobicContact SD-CG2 4.35Å; M250-L267 HydrophobicContact CE-CD2 4.35Å; M250-L267 HydrophobicContact SD-CD2 3.89Å
251	I	88.5	Confident	86.1	Confident	44 Å²	44	65.2 Å²	65.2	23%	0.226	34%	0.343	C	S	.	.	H	α-helix	trans	-71.1	-46.7	173.1	-68.6	160.7	0	0	0	110.2	Y247 H248 E249 G254 I256 L258	Y247-I251 HydrophobicContact CD1-CD1 3.92Å; Y247-I251 HydrophobicContact CD2-CD1 4.3Å; Y247-I251 HydrophobicContact CE1-CD1 3.61Å; Y247-I251 HydrophobicContact CE2-CD1 4.03Å; Y247-I251 HydrophobicContact CE2-CG1 4.47Å; Y247-I251 HydrophobicContact CG-CD1 4.28Å; Y247-I251 WeakPolarHBondContact O-CD1 3.49Å; Y247-I251 VanDerWaalsContact O-CG1 3.3Å; Y247-I251 WeakPolarHBondContact O-CG1 3.35Å; Y247-I251 PolarHBondContact O-N 2.85Å; Y247-I251 VanDerWaalsContact O-N 3.12Å; H248-I251 WeakPolarHBondContact O-CB 3.22Å; H248-I251 PolarHBondContact O-N 2.87Å; H248-I251 VanDerWaalsContact O-N 3.08Å; E249-I251 VanDerWaalsContact C-N 3.33Å; E249-I251 PolarHBondContact O-N 3.29Å; I251-G254 PolarHBondContact O-N 3.4Å; I251-G254 VanDerWaalsContact O-N 3.17Å; I251-I256 HydrophobicContact CG1-CB 4.06Å; I251-I256 HydrophobicContact CG1-CG2 3.95Å; I251-L258 HydrophobicContact CD1-CD1 4Å; I251-L258 HydrophobicContact CD1-CD2 4.17Å; I251-L258 HydrophobicContact CD1-CG 4.3Å; I251-L258 HydrophobicContact CG1-CD1 4.42Å; I251-L258 HydrophobicContact CG1-CD2 4.27Å; I251-L258 HydrophobicContact CG1-CG 4.28Å; I251-L258 HydrophobicContact CG2-CD1 4.29Å; I251-L258 HydrophobicContact CG2-CG 4.44Å
252	E	84.2	Confident	86	Confident	150 Å²	150	61.9 Å²	61.9	70%	0.701	34%	0.339	S	S	*	.	H	α-helix	trans	-66	-38.9	-178.2	-71.2	177.6	-173.7	0	0	112.4	H248 E249 G254	H248-E252 WeakPolarHBondContact O-CG 3.43Å; H248-E252 PolarHBondContact O-N 3.12Å; E249-E252 PolarHBondContact O-N 2.87Å; E252-G254 PolarHBondContact O-N 2.95Å
253	S	76	Confident	86.3	Confident	48 Å²	48	59.5 Å²	59.5	34%	0.336	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.2	175.3	58.5	0	0	0	0	114	E249 M250 V255	E249-S253 VanDerWaalsContact O-CB 3.3Å; E249-S253 WeakPolarHBondContact O-CB 3.48Å; E249-S253 PolarHBondContact O-N 2.8Å; E249-S253 PolarHBondContact O-OG 3.39Å; M250-S253 WeakPolarHBondContact CA-OG 3.49Å; M250-S253 PolarHBondContact O-OG 2.92Å; S253-V255 VanDerWaalsContact C-N 3.33Å; S253-V255 PolarHBondContact O-N 3.44Å
254	G	79.6	Confident	86.2	Confident	33 Å²	33	62.7 Å²	62.7	34%	0.34	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	9.4	178.1	0	0	0	0	0	115.2	M250 I251 E252 N257	M250-G254 PolarHBondContact O-N 3.29Å; I251-G254 PolarHBondContact O-N 3.4Å; I251-G254 VanDerWaalsContact O-N 3.17Å; E252-G254 PolarHBondContact O-N 2.95Å; G254-N257 PolarHBondContact O-ND2 3.22Å
255	V	83.3	Confident	86.2	Confident	14 Å²	14	58.9 Å²	58.9	9%	0.085	32%	0.32	C	S	.	.	S	Bend	trans	-69	-38.5	173.5	178.6	0	0	0	0	110.7	I220 M250 S253 K264 V265	I220-V255 HydrophobicContact CG2-CG1 3.76Å; M250-V255 HydrophobicContact CB-CB 4.33Å; M250-V255 PolarHBondContact O-N 3.1Å; S253-V255 VanDerWaalsContact C-N 3.33Å; S253-V255 PolarHBondContact O-N 3.44Å; V255-K264 PolarHBondContact O-N 3.49Å; V255-K264 VanDerWaalsContact O-N 3.17Å; V255-V265 HydrophobicContact CG1-CB 4.08Å; V255-V265 HydrophobicContact CG1-CG1 3.71Å
256	I	89.3	Confident	86.6	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	31%	0.306	C	S	.	.	S	Bend	trans	-107.1	117.8	171.5	-65.1	175.2	0	0	0	109	Y247 M250 I251 L258 V265 L267	Y247-I256 HydrophobicContact CD2-CD1 3.72Å; Y247-I256 HydrophobicContact CE2-CD1 3.88Å; Y247-I256 HydrophobicContact CE2-CG2 4.28Å; M250-I256 HydrophobicContact CB-CB 4.38Å; M250-I256 HydrophobicContact CB-CD1 3.68Å; M250-I256 HydrophobicContact CB-CG1 3.88Å; M250-I256 HydrophobicContact CG-CD1 4.46Å; M250-I256 PolarHBondContact O-N 3.31Å; M250-I256 HydrophobicContact SD-CD1 3.94Å; M250-I256 HydrophobicContact SD-CG1 4.48Å; I251-I256 HydrophobicContact CG1-CB 4.06Å; I251-I256 HydrophobicContact CG1-CG2 3.95Å; I256-L258 HydrophobicContact CG2-CD2 3.96Å; I256-V265 HydrophobicContact CD1-CG1 3.71Å; I256-V265 HydrophobicContact CG1-CG1 3.32Å; I256-L267 HydrophobicContact CD1-CD1 3.72Å; I256-L267 HydrophobicContact CD1-CG 4.29Å
257	N	89.2	Confident	87.1	Confident	54 Å²	54	56 Å²	56	29%	0.289	31%	0.305	S	S	.	.			trans	-103.6	117.4	174.8	-69.7	-65.6	0	0	0	109.5	G254 T262 S263	G254-N257 PolarHBondContact O-ND2 3.22Å; N257-T262 WeakPolarHBondContact CB-OG1 3.37Å; N257-T262 PolarHBondContact ND2-OG1 3.42Å; N257-T262 VanDerWaalsContact ND2-OG1 3.09Å; N257-S263 PolarHBondContact N-OG 2.92Å; N257-S263 PolarHBondContact O-OG 3.26Å; N257-S263 VanDerWaalsContact O-OG 3.11Å
258	L	90.1	Very high	87.4	Confident	82 Å²	82	54.7 Å²	54.7	43%	0.429	30%	0.3	S	S	.	.	S	Bend	trans	-79.2	-22.3	-177.7	-60.7	-177.5	0	0	0	113.5	R155 Y247 I251 I256	R155-L258 PolarHBondContact NH2-O 3.17Å; R155-L258 VanDerWaalsContact NH2-O 3.12Å; Y247-L258 WeakPolarHBondContact OH-CD2 3.41Å; I251-L258 HydrophobicContact CD1-CD1 4Å; I251-L258 HydrophobicContact CD1-CD2 4.17Å; I251-L258 HydrophobicContact CD1-CG 4.3Å; I251-L258 HydrophobicContact CG1-CD1 4.42Å; I251-L258 HydrophobicContact CG1-CD2 4.27Å; I251-L258 HydrophobicContact CG1-CG 4.28Å; I251-L258 HydrophobicContact CG2-CD1 4.29Å; I251-L258 HydrophobicContact CG2-CG 4.44Å; I256-L258 HydrophobicContact CG2-CD2 3.96Å
259	K	86.9	Confident	87.7	Confident	199 Å²	199	50.9 Å²	50.9	87%	0.865	28%	0.282	S	S	*	.	S	Bend	trans	-94	-38	-173.5	-62.3	177.7	-176.9	173.4	0	112.8
260	D	85.3	Confident	88.3	Confident	109 Å²	109	48.2 Å²	48.2	58%	0.583	27%	0.269	S	S	*	.	S	Bend	trans	-121.8	156.7	-172.7	-57	-49.2	0	0	0	111.2	T262	D260-T262 HydrophobicContact CB-CG2 4.28Å; D260-T262 PolarHBondContact O-N 3.27Å
261	A	83.4	Confident	88.6	Confident	111 Å²	111	48.6 Å²	48.6	92%	0.917	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	35	180	0	0	0	0	0	113.3
262	T	86.5	Confident	88.7	Confident	75 Å²	75	49.9 Å²	49.9	46%	0.46	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	3.1	-176.8	54.3	0	0	0	0	113.2	N257 D260	N257-T262 WeakPolarHBondContact CB-OG1 3.37Å; N257-T262 PolarHBondContact ND2-OG1 3.42Å; N257-T262 VanDerWaalsContact ND2-OG1 3.09Å; D260-T262 HydrophobicContact CB-CG2 4.28Å; D260-T262 PolarHBondContact O-N 3.27Å
263	S	89.7	Confident	89.1	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.042	28%	0.275	C	S	.	.			trans	-57	141.3	175.8	-64.3	0	0	0	0	111	N257	N257-S263 PolarHBondContact N-OG 2.92Å; N257-S263 PolarHBondContact O-OG 3.26Å; N257-S263 VanDerWaalsContact O-OG 3.11Å
264	K	85.3	Confident	90	Very high	72 Å²	72	48.2 Å²	48.2	31%	0.313	27%	0.268	S	S	.	.			trans	-113.1	-2.1	-176.6	-64	-61.1	-171.6	170.3	0	114.5	A224 Y230 S231 V255	A224-K264 HydrophobicContact CB-CB 4.42Å; Y230-K264 HydrophobicContact CD1-CD 3.92Å; Y230-K264 HydrophobicContact CE1-CD 3.81Å; S231-K264 PolarHBondContact N-O 2.76Å; V255-K264 PolarHBondContact O-N 3.49Å; V255-K264 VanDerWaalsContact O-N 3.17Å
265	V	91.6	Very high	90.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.5	-177.5	67.7	0	0	0	0	111.6	G142 S231 F233 M250 V255 I256 L267	G142-V265 WeakPolarHBondContact CA-O 3.3Å; G142-V265 PolarHBondContact N-O 3.24Å; S231-V265 CarbonylContact O-C 3.59Å; S231-V265 WeakPolarHBondContact O-CA 3.49Å; F233-V265 HydrophobicContact CB-CG2 4.42Å; M250-V265 HydrophobicContact CE-CG2 4.43Å; M250-V265 HydrophobicContact SD-CG1 3.8Å; M250-V265 HydrophobicContact SD-CG2 4.35Å; V255-V265 HydrophobicContact CG1-CB 4.08Å; V255-V265 HydrophobicContact CG1-CG1 3.71Å; I256-V265 HydrophobicContact CD1-CG1 3.71Å; I256-V265 HydrophobicContact CG1-CG1 3.32Å; V265-L267 HydrophobicContact CG2-CD2 3.92Å
266	A	94.9	Very high	91.3	Very high	1 Å²	1	48 Å²	48	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	135.6	164.9	0	0	0	0	0	109.7	L141 S231 V232 F233 V289	L141-A266 HydrophobicContact CD2-CB 4.47Å; S231-A266 PolarHBondContact O-N 2.79Å; V232-A266 WeakPolarHBondContact CA-O 3.37Å; F233-A266 PolarHBondContact N-O 3.49Å; A266-V289 HydrophobicContact CB-CG1 4.16Å
267	L	95.9	Very high	91.6	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.6	-178.7	-57.2	179.6	0	0	0	110.2	R143 I144 M145 F233 Y247 M250 I256 V265	R143-L267 WeakPolarHBondContact O-CB 3.44Å; R143-L267 PolarHBondContact O-N 2.95Å; I144-L267 CarbonylContact C-O 3.59Å; I144-L267 WeakPolarHBondContact CA-O 3.39Å; I144-L267 HydrophobicContact CB-CB 4.39Å; I144-L267 HydrophobicContact CD1-CD1 4.41Å; I144-L267 HydrophobicContact CG1-CB 4.13Å; I144-L267 HydrophobicContact CG1-CD1 3.92Å; I144-L267 HydrophobicContact CG2-CB 4.25Å; M145-L267 PolarHBondContact N-O 2.98Å; F233-L267 HydrophobicContact CB-CD2 3.64Å; F233-L267 HydrophobicContact CD1-CD2 4.44Å; F233-L267 HydrophobicContact CG-CD2 4.27Å; Y247-L267 HydrophobicContact CD2-CD1 3.58Å; Y247-L267 HydrophobicContact CE2-CD1 4.31Å; Y247-L267 HydrophobicContact CG-CD1 4.45Å; M250-L267 HydrophobicContact CE-CD2 4.35Å; M250-L267 HydrophobicContact SD-CD2 3.89Å; I256-L267 HydrophobicContact CD1-CD1 3.72Å; I256-L267 HydrophobicContact CD1-CG 4.29Å; V265-L267 HydrophobicContact CG2-CD2 3.92Å
268	V	97.4	Very high	91.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.5	176.4	-173.3	0	0	0	0	108.2	M145 V232 F233 A234 G235 V282 T285	M145-V268 HydrophobicContact CG-CB 4.23Å; M145-V268 HydrophobicContact CG-CG1 4.18Å; M145-V268 HydrophobicContact CG-CG2 3.73Å; M145-V268 CarbonylContact O-C 3.57Å; M145-V268 WeakPolarHBondContact O-CA 3.27Å; M145-V268 HydrophobicContact SD-CG2 3.94Å; V232-V268 HydrophobicContact CG1-CG2 4.3Å; F233-V268 PolarHBondContact O-N 3.33Å; A234-V268 CarbonylContact C-O 3.54Å; A234-V268 WeakPolarHBondContact CA-O 3.37Å; G235-V268 PolarHBondContact N-O 3.49Å; V268-V282 HydrophobicContact CG1-CG2 3.62Å; V268-T285 HydrophobicContact CG1-CG2 3.44Å; V268-T285 VanDerWaalsContact CG1-CG2 3.44Å
269	Y	96.4	Very high	92.1	Very high	11 Å²	11	42.5 Å²	42.5	4%	0.043	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134	-173.9	-75.1	-19.8	0	0	0	112.3	I144 M145 N146 F233 G243 Q271	I144-Y269 HydrophobicContact CD1-CE2 4.38Å; I144-Y269 HydrophobicContact CG2-CD2 3.39Å; I144-Y269 HydrophobicContact CG2-CE2 3.91Å; I144-Y269 HydrophobicContact CG2-CG 4.04Å; M145-Y269 PolarHBondContact O-N 3.12Å; N146-Y269 WeakPolarHBondContact CA-O 3.31Å; F233-Y269 HydrophobicContact CD1-CD1 4.47Å; F233-Y269 AromaticContact CD1-CE1 3.67Å; F233-Y269 HydrophobicContact CD1-CE1 3.67Å; F233-Y269 AromaticContact CE1-CE1 3.72Å; F233-Y269 HydrophobicContact CE1-CE1 3.72Å; G243-Y269 PolarHBondContact O-OH 3.02Å; G243-Y269 VanDerWaalsContact O-OH 3.13Å; Y269-Q271 VanDerWaalsContact CG-NE2 3.32Å
270	G	94.2	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	86.1	172.9	0	0	0	0	0	107	G235 G237 E274	G235-G270 PolarHBondContact O-N 3.42Å; G237-G270 WeakPolarHBondContact CA-O 3.37Å; G237-G270 PolarHBondContact N-O 3.04Å; G270-E274 WeakPolarHBondContact CA-OE1 3.45Å
271	Q	91.9	Very high	93.1	Very high	10 Å²	10	30 Å²	30	5%	0.047	17%	0.17	C	C	.	.			trans	-79.6	171.3	-160.5	-63	-68.9	-48.6	0	0	112.6	E238 R239 Y269 N273 E274	E238-Q271 PolarHBondContact O-OE1 3.38Å; R239-Q271 PolarHBondContact O-OE1 3.41Å; Y269-Q271 VanDerWaalsContact CG-NE2 3.32Å; Q271-N273 WeakPolarHBondContact CB-OD1 3.49Å; Q271-N273 PolarHBondContact O-N 3.1Å; Q271-N273 VanDerWaalsContact O-N 3.15Å; Q271-E274 PolarHBondContact N-OE1 3.36Å; Q271-E274 WeakPolarHBondContact O-CB 3.4Å; Q271-E274 PolarHBondContact O-N 3.02Å
272	M	91.8	Very high	93.7	Very high	71 Å²	71	24.7 Å²	24.7	35%	0.35	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.9	179.4	-76.1	-175.4	178	0	0	114.6	G237 E238 R239 E274	G237-M272 WeakPolarHBondContact O-CE 3.34Å; G237-M272 WeakPolarHBondContact O-CG 3.21Å; E238-M272 WeakPolarHBondContact O-CG 3.22Å; E238-M272 PolarHBondContact O-N 2.96Å; R239-M272 HydrophobicContact CG-CE 4.27Å; R239-M272 HydrophobicContact CG-SD 3.87Å; M272-E274 VanDerWaalsContact C-N 3.25Å; M272-E274 PolarHBondContact O-N 3.45Å
273	N	92.4	Very high	94.2	Very high	122 Å²	122	21.1 Å²	21.1	65%	0.652	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9	179	64.4	-61	0	0	0	113.3	Q271	Q271-N273 WeakPolarHBondContact CB-OD1 3.49Å; Q271-N273 PolarHBondContact O-N 3.1Å; Q271-N273 VanDerWaalsContact O-N 3.15Å
274	E	94.4	Very high	94.6	Very high	41 Å²	41	21.4 Å²	21.4	19%	0.192	11%	0.105	C	C	.	.	S	Bend	trans	-83.1	151.2	177.3	-69	-178.2	-141.8	0	0	111.7	G270 Q271 M272 A278 R279	G270-E274 WeakPolarHBondContact CA-OE1 3.45Å; Q271-E274 PolarHBondContact N-OE1 3.36Å; Q271-E274 WeakPolarHBondContact O-CB 3.4Å; Q271-E274 PolarHBondContact O-N 3.02Å; M272-E274 VanDerWaalsContact C-N 3.25Å; M272-E274 PolarHBondContact O-N 3.45Å; E274-A278 HydrophobicContact CB-CB 4.01Å; E274-A278 WeakPolarHBondContact OE2-CB 3.41Å; E274-R279 PolarHBondContact O-NE 2.85Å
275	P	95.1	Very high	95.2	Very high	25 Å²	25	18 Å²	18	16%	0.162	9%	0.09	C	C	.	.			trans	-60.6	157.5	179.2	26.6	-35.8	0	0	0	111.6	G277 A278 R279	P275-G277 PolarHBondContact O-N 3.43Å; P275-G277 VanDerWaalsContact O-N 3.09Å; P275-A278 HydrophobicContact CG-CB 4.3Å; P275-A278 PolarHBondContact O-N 3.45Å; P275-A278 VanDerWaalsContact O-N 3.08Å; P275-R279 PolarHBondContact O-N 3.32Å
276	P	95.3	Very high	95.4	Very high	16 Å²	16	18 Å²	18	10%	0.104	9%	0.09	C	C	.	.	H	α-helix	trans	-59.6	-26.1	-178.1	24.5	-34.7	0	0	0	113.3	A69 A280 A314 E317 V318	A69-P276 HydrophobicContact CB-CG 4.28Å; P276-A280 WeakPolarHBondContact O-CB 3.4Å; P276-A280 PolarHBondContact O-N 3.27Å; P276-A314 HydrophobicContact CB-CB 4.44Å; P276-E317 HydrophobicContact CB-CB 3.82Å; P276-E317 WeakPolarHBondContact CB-OE2 3.42Å; P276-E317 HydrophobicContact CG-CB 4.27Å; P276-V318 HydrophobicContact CB-CG2 4.02Å; P276-V318 HydrophobicContact CG-CG2 4.45Å
277	G	95.1	Very high	95.5	Very high	1 Å²	1	18 Å²	18	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-59.4	-49	173.1	0	0	0	0	0	113.3	I111 M113 P275 A280 R281	I111-G277 VanDerWaalsContact CG2-CA 3.45Å; M113-G277 VanDerWaalsContact SD-C 3.56Å; P275-G277 PolarHBondContact O-N 3.43Å; P275-G277 VanDerWaalsContact O-N 3.09Å; G277-A280 PolarHBondContact O-N 2.99Å; G277-R281 WeakPolarHBondContact O-CG 3.2Å; G277-R281 PolarHBondContact O-N 2.85Å
278	A	95.6	Very high	95.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.1	-47.3	178.4	0	0	0	0	0	111.9	V147 E274 P275 A280 R281 V282	V147-A278 HydrophobicContact CB-CB 4.39Å; V147-A278 HydrophobicContact CG1-CB 3.78Å; E274-A278 HydrophobicContact CB-CB 4.01Å; E274-A278 WeakPolarHBondContact OE2-CB 3.41Å; P275-A278 HydrophobicContact CG-CB 4.3Å; P275-A278 PolarHBondContact O-N 3.45Å; P275-A278 VanDerWaalsContact O-N 3.08Å; A278-A280 VanDerWaalsContact C-N 3.27Å; A278-A280 PolarHBondContact O-N 3.02Å; A278-R281 PolarHBondContact O-N 2.89Å; A278-V282 PolarHBondContact O-N 3.2Å
279	R	95.9	Very high	95.6	Very high	21 Å²	21	18.1 Å²	18.1	8%	0.079	9%	0.091	C	C	.	.	H	α-helix	trans	-60.3	-35.3	177.2	-68.6	-172.2	-73.7	121.8	-5	112.7	V236 E274 P275 R281 A314 E317	V236-R279 WeakPolarHBondContact CG1-O 3.42Å; E274-R279 PolarHBondContact O-NE 2.85Å; P275-R279 PolarHBondContact O-N 3.32Å; R279-R281 PolarHBondContact O-N 2.77Å; R279-A314 HydrophobicContact CB-CB 3.66Å; R279-E317 IonicContact CZ-OE1 3.55Å; R279-E317 IonicContact CZ-OE2 3.26Å; R279-E317 IonicContact NH1-OE1 3.88Å; R279-E317 PolarHBondContact NH1-OE1 2.88Å; R279-E317 IonicContact NH2-OE1 2.82Å; R279-E317 PolarHBondContact NH2-OE1 3.3Å; R279-E317 IonicContact NH2-OE2 2.74Å; R279-E317 PolarHBondContact NH2-OE2 2.98Å
280	A	95.1	Very high	95.6	Very high	3 Å²	3	17.6 Å²	17.6	3%	0.025	9%	0.089	C	C	.	.	H	α-helix	trans	-76.6	-5.4	177.7	0	0	0	0	0	114.1	P276 G277 A278 F311 A314	P276-A280 WeakPolarHBondContact O-CB 3.4Å; P276-A280 PolarHBondContact O-N 3.27Å; G277-A280 PolarHBondContact O-N 2.99Å; A278-A280 VanDerWaalsContact C-N 3.27Å; A278-A280 PolarHBondContact O-N 3.02Å; A280-F311 VanDerWaalsContact O-CE2 3.23Å; A280-F311 WeakPolarHBondContact O-CE2 3.45Å; A280-A314 HydrophobicContact CB-CB 3.9Å
281	R	96.7	Very high	95.7	Very high	42 Å²	42	18.3 Å²	18.3	16%	0.158	9%	0.092	C	C	.	.	H	α-helix	trans	-120.5	-22.3	-179	-66.6	-63.1	176.4	-88.2	-1.4	113.8	E98 M113 V147 I166 G277 A278 R279 A283 L284 T285	E98-R281 VanDerWaalsContact CD-NE 3.27Å; E98-R281 IonicContact OE1-CZ 3.91Å; E98-R281 IonicContact OE1-NE 3.79Å; E98-R281 PolarHBondContact OE1-NE 2.97Å; E98-R281 IonicContact OE1-NH2 2.94Å; E98-R281 PolarHBondContact OE1-NH2 3.43Å; E98-R281 WeakPolarHBondContact OE2-CD 3.46Å; E98-R281 IonicContact OE2-NE 3.76Å; E98-R281 PolarHBondContact OE2-NE 3.26Å; M113-R281 HydrophobicContact CE-CG 3.93Å; M113-R281 HydrophobicContact SD-CB 4.46Å; M113-R281 HydrophobicContact SD-CG 4.17Å; V147-R281 HydrophobicContact CG2-CB 3.56Å; I166-R281 HydrophobicContact CD1-CB 4.2Å; G277-R281 WeakPolarHBondContact O-CG 3.2Å; G277-R281 PolarHBondContact O-N 2.85Å; A278-R281 PolarHBondContact O-N 2.89Å; R279-R281 PolarHBondContact O-N 2.77Å; R281-A283 PolarHBondContact O-N 3.27Å; R281-L284 WeakPolarHBondContact O-CA 3.48Å; R281-L284 VanDerWaalsContact O-CB 3.28Å; R281-L284 WeakPolarHBondContact O-CB 3.41Å; R281-L284 PolarHBondContact O-N 3.08Å; R281-T285 PolarHBondContact O-N 3.07Å; R281-T285 VanDerWaalsContact O-N 3.14Å
282	V	97	Very high	95.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-30.1	-175.9	71.7	0	0	0	0	114	V147 V236 V268 A278 L284 T285 G286	V147-V282 HydrophobicContact CB-CB 4.28Å; V147-V282 HydrophobicContact CG2-CB 4.32Å; V236-V282 HydrophobicContact CB-CG1 4.09Å; V236-V282 HydrophobicContact CG1-CG1 3.92Å; V236-V282 HydrophobicContact CG2-CG1 3.94Å; V268-V282 HydrophobicContact CG1-CG2 3.62Å; A278-V282 PolarHBondContact O-N 3.2Å; V282-L284 VanDerWaalsContact C-N 3.29Å; V282-L284 PolarHBondContact O-N 2.99Å; V282-T285 WeakPolarHBondContact O-CB 3.48Å; V282-T285 PolarHBondContact O-N 3.22Å; V282-G286 PolarHBondContact O-N 3.48Å
283	A	96.9	Very high	96.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.3	-40.2	171.4	0	0	0	0	0	111.8	V236 R281 G286 L287 F311 M342	V236-A283 HydrophobicContact CG2-CB 3.85Å; R281-A283 PolarHBondContact O-N 3.27Å; A283-G286 PolarHBondContact O-N 3.36Å; A283-L287 WeakPolarHBondContact O-CB 3.46Å; A283-L287 PolarHBondContact O-N 2.69Å; A283-F311 HydrophobicContact CB-CD2 3.97Å; A283-M342 HydrophobicContact CB-SD 3.92Å
284	L	97.6	Very high	96.2	Very high	12 Å²	12	10.5 Å²	10.5	6%	0.063	5%	0.05	C	C	.	.	H	α-helix	trans	-68.3	-36.9	176.5	-52.4	178	0	0	0	111.4	I166 R281 V282 L287 T288 M342	I166-L284 HydrophobicContact CB-CB 4.25Å; R281-L284 WeakPolarHBondContact O-CA 3.48Å; R281-L284 VanDerWaalsContact O-CB 3.28Å; R281-L284 WeakPolarHBondContact O-CB 3.41Å; R281-L284 PolarHBondContact O-N 3.08Å; V282-L284 VanDerWaalsContact C-N 3.29Å; V282-L284 PolarHBondContact O-N 2.99Å; L284-L287 PolarHBondContact O-N 3.43Å; L284-T288 WeakPolarHBondContact O-CB 3.32Å; L284-T288 PolarHBondContact O-N 3.33Å; L284-T288 PolarHBondContact O-OG1 3.17Å; L284-T288 VanDerWaalsContact O-OG1 3.1Å; L284-M342 HydrophobicContact CD2-CB 4.11Å; L284-M342 HydrophobicContact CD2-CG 3.8Å
285	T	97.8	Very high	96.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.6	-48.9	174	-56.7	0	0	0	0	111.1	I134 M145 V147 V268 R281 V282 L287 T288 V289	I134-T285 HydrophobicContact CD1-CG2 3.63Å; I134-T285 VanDerWaalsContact CD1-O 3.32Å; I134-T285 WeakPolarHBondContact CD1-O 3.46Å; I134-T285 HydrophobicContact CG2-CG2 4.11Å; M145-T285 HydrophobicContact SD-CG2 4.24Å; V147-T285 PolarHBondContact O-OG1 2.83Å; V268-T285 HydrophobicContact CG1-CG2 3.44Å; V268-T285 VanDerWaalsContact CG1-CG2 3.44Å; R281-T285 PolarHBondContact O-N 3.07Å; R281-T285 VanDerWaalsContact O-N 3.14Å; V282-T285 WeakPolarHBondContact O-CB 3.48Å; V282-T285 PolarHBondContact O-N 3.22Å; T285-L287 VanDerWaalsContact C-N 3.35Å; T285-L287 PolarHBondContact O-N 3Å; T285-T288 PolarHBondContact O-N 3.18Å; T285-V289 WeakPolarHBondContact O-CG2 3.33Å; T285-V289 PolarHBondContact O-N 3.17Å
286	G	97.1	Very high	96.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.3	-41.7	175.4	0	0	0	0	0	112.7	V232 V282 A283 T288 V289 A290	V232-G286 WeakPolarHBondContact CG1-O 3.48Å; V282-G286 PolarHBondContact O-N 3.48Å; A283-G286 PolarHBondContact O-N 3.36Å; G286-T288 PolarHBondContact O-N 2.94Å; G286-V289 PolarHBondContact O-N 2.97Å; G286-A290 PolarHBondContact O-N 2.94Å
287	L	96.8	Very high	95.9	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-61.5	-43.9	176.5	179.8	56	0	0	0	112.4	A283 L284 T285 V289 A290 E291 L303 M342 R345 I346 I354	A283-L287 WeakPolarHBondContact O-CB 3.46Å; A283-L287 PolarHBondContact O-N 2.69Å; L284-L287 PolarHBondContact O-N 3.43Å; T285-L287 VanDerWaalsContact C-N 3.35Å; T285-L287 PolarHBondContact O-N 3Å; L287-V289 VanDerWaalsContact C-N 3.31Å; L287-V289 PolarHBondContact O-N 2.82Å; L287-A290 CarbonylContact O-C 3.53Å; L287-A290 WeakPolarHBondContact O-CA 3.41Å; L287-A290 WeakPolarHBondContact O-CB 3.36Å; L287-A290 PolarHBondContact O-N 3.11Å; L287-E291 HydrophobicContact CD1-CG 4.11Å; L287-E291 HydrophobicContact CG-CG 4.3Å; L287-E291 WeakPolarHBondContact O-CB 3.12Å; L287-E291 VanDerWaalsContact O-CG 3.29Å; L287-E291 WeakPolarHBondContact O-CG 3.47Å; L287-E291 PolarHBondContact O-N 3.42Å; L287-L303 HydrophobicContact CB-CD2 4.47Å; L287-L303 HydrophobicContact CD1-CD2 3.87Å; L287-M342 HydrophobicContact CD2-CG 4.16Å; L287-R345 HydrophobicContact CD1-CB 4.42Å; L287-R345 HydrophobicContact CD2-CB 3.68Å; L287-R345 HydrophobicContact CD2-CG 4.43Å; L287-R345 HydrophobicContact CG-CB 4.36Å; L287-I346 HydrophobicContact CD1-CG1 3.58Å; L287-I346 HydrophobicContact CD2-CG1 4.38Å; L287-I354 HydrophobicContact CD1-CD1 4.41Å
288	T	97.8	Very high	95.7	Very high	4 Å²	4	20.2 Å²	20.2	3%	0.025	10%	0.104	C	C	.	.	H	α-helix	trans	-64.8	-33.8	178.4	-67.8	0	0	0	0	112.8	I134 V136 A164 I166 L284 T285 G286 Y292 R345	I134-T288 HydrophobicContact CD1-CG2 3.9Å; I134-T288 HydrophobicContact CG1-CG2 4.12Å; V136-T288 HydrophobicContact CG1-CG2 4.2Å; A164-T288 HydrophobicContact CB-CG2 3.51Å; I166-T288 WeakPolarHBondContact CA-OG1 3.37Å; I166-T288 PolarHBondContact O-OG1 3.06Å; L284-T288 WeakPolarHBondContact O-CB 3.32Å; L284-T288 PolarHBondContact O-N 3.33Å; L284-T288 PolarHBondContact O-OG1 3.17Å; L284-T288 VanDerWaalsContact O-OG1 3.1Å; T285-T288 PolarHBondContact O-N 3.18Å; G286-T288 PolarHBondContact O-N 2.94Å; T288-Y292 PolarHBondContact O-N 2.74Å; T288-R345 PolarHBondContact OG1-NH2 3.17Å
289	V	97.3	Very high	95.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.9	-41.6	170.6	177.8	0	0	0	0	110.7	I134 V136 M145 V232 A266 T285 G286 L287 Y292 F293	I134-V289 HydrophobicContact CD1-CG2 3.86Å; V136-V289 HydrophobicContact CG1-CG2 4.5Å; M145-V289 HydrophobicContact SD-CG2 4.01Å; V232-V289 HydrophobicContact CG1-CB 4.26Å; V232-V289 HydrophobicContact CG1-CG1 4.3Å; V232-V289 HydrophobicContact CG2-CB 4.37Å; V232-V289 HydrophobicContact CG2-CG1 3.84Å; A266-V289 HydrophobicContact CB-CG1 4.16Å; T285-V289 WeakPolarHBondContact O-CG2 3.33Å; T285-V289 PolarHBondContact O-N 3.17Å; G286-V289 PolarHBondContact O-N 2.97Å; L287-V289 VanDerWaalsContact C-N 3.31Å; L287-V289 PolarHBondContact O-N 2.82Å; V289-Y292 WeakPolarHBondContact O-CB 3.36Å; V289-Y292 PolarHBondContact O-N 3.21Å; V289-F293 HydrophobicContact CG1-CD2 4.33Å; V289-F293 HydrophobicContact CG1-CE2 3.76Å; V289-F293 WeakPolarHBondContact O-CD2 3.47Å
290	A	96.4	Very high	95	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.5	-41.1	177.6	0	0	0	0	0	112.8	V232 G286 L287 Y292 F293 R294 V301 L303 I354	V232-A290 HydrophobicContact CB-CB 4.41Å; V232-A290 HydrophobicContact CG2-CB 4.08Å; G286-A290 PolarHBondContact O-N 2.94Å; L287-A290 CarbonylContact O-C 3.53Å; L287-A290 WeakPolarHBondContact O-CA 3.41Å; L287-A290 WeakPolarHBondContact O-CB 3.36Å; L287-A290 PolarHBondContact O-N 3.11Å; A290-Y292 VanDerWaalsContact C-N 3.27Å; A290-Y292 PolarHBondContact O-N 3.44Å; A290-F293 PolarHBondContact O-N 3.37Å; A290-R294 PolarHBondContact O-N 3.46Å; A290-V301 HydrophobicContact CB-CG1 3.9Å; A290-L303 HydrophobicContact CB-CB 4.45Å; A290-L303 HydrophobicContact CB-CD1 4.28Å; A290-I354 HydrophobicContact CB-CD1 4.12Å; A290-I354 HydrophobicContact CB-CG1 4.44Å; A290-I354 HydrophobicContact CB-CG2 4.48Å
291	E	96.6	Very high	94.9	Very high	15 Å²	15	24.4 Å²	24.4	7%	0.07	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-35.9	176.2	-73.1	174.1	150.7	0	0	112	L287 F293 R294 D295 R345 I354	L287-E291 HydrophobicContact CD1-CG 4.11Å; L287-E291 HydrophobicContact CG-CG 4.3Å; L287-E291 WeakPolarHBondContact O-CB 3.12Å; L287-E291 VanDerWaalsContact O-CG 3.29Å; L287-E291 WeakPolarHBondContact O-CG 3.47Å; L287-E291 PolarHBondContact O-N 3.42Å; E291-F293 PolarHBondContact O-N 2.92Å; E291-R294 PolarHBondContact O-N 2.74Å; E291-D295 WeakPolarHBondContact O-CB 3.21Å; E291-D295 PolarHBondContact O-N 3.3Å; E291-R345 WeakPolarHBondContact OE1-CB 3.24Å; E291-R345 IonicContact OE1-CZ 3.15Å; E291-R345 IonicContact OE1-NE 3.54Å; E291-R345 PolarHBondContact OE1-NE 2.73Å; E291-R345 IonicContact OE1-NH2 3.51Å; E291-R345 PolarHBondContact OE1-NH2 3.39Å; E291-R345 IonicContact OE2-CZ 2.69Å; E291-R345 IonicContact OE2-NE 2.97Å; E291-R345 IonicContact OE2-NH2 2.73Å; E291-R345 PolarHBondContact OE2-NH2 3.06Å; E291-I354 HydrophobicContact CG-CD1 3.99Å
292	Y	96.4	Very high	94.7	Very high	36 Å²	36	22.8 Å²	22.8	14%	0.141	12%	0.121	C	C	.	.	H	α-helix	trans	-57	-50.4	173.3	179.9	-94.2	0	0	0	112	V136 G137 Q162 T288 V289 A290 R294 Q296 E297	V136-Y292 HydrophobicContact CB-CD2 3.91Å; V136-Y292 HydrophobicContact CB-CG 3.84Å; V136-Y292 HydrophobicContact CG2-CD2 3.54Å; V136-Y292 HydrophobicContact CG2-CE2 3.98Å; V136-Y292 HydrophobicContact CG2-CG 4.02Å; G137-Y292 VanDerWaalsContact CA-CE1 3.41Å; Q162-Y292 PolarHBondContact OE1-OH 3.18Å; T288-Y292 PolarHBondContact O-N 2.74Å; V289-Y292 WeakPolarHBondContact O-CB 3.36Å; V289-Y292 PolarHBondContact O-N 3.21Å; A290-Y292 VanDerWaalsContact C-N 3.27Å; A290-Y292 PolarHBondContact O-N 3.44Å; Y292-R294 VanDerWaalsContact C-N 3.31Å; Y292-R294 PolarHBondContact O-N 3.37Å; Y292-Q296 HydrophobicContact CD2-CB 3.97Å; Y292-Q296 HydrophobicContact CD2-CG 4.42Å; Y292-Q296 HydrophobicContact CE2-CB 3.72Å; Y292-Q296 HydrophobicContact CE2-CG 3.71Å; Y292-Q296 WeakPolarHBondContact O-CA 3.47Å; Y292-Q296 VanDerWaalsContact O-CB 3.24Å; Y292-Q296 WeakPolarHBondContact O-CB 3.35Å; Y292-Q296 PolarHBondContact O-N 3.08Å; Y292-E297 HydrophobicContact CE1-CG 3.96Å; Y292-E297 PolarHBondContact O-N 3.47Å
293	F	94.7	Very high	94.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.3	-34.4	179.5	-65.9	-56.1	0	0	0	111.9	L141 Y230 V232 V289 A290 E291 E297 G298 Q299 V301	L141-F293 HydrophobicContact CD2-CE2 4.3Å; L141-F293 HydrophobicContact CD2-CZ 3.97Å; L141-F293 HydrophobicContact CG-CZ 4.15Å; Y230-F293 AromaticContact CD2-CD1 3.56Å; Y230-F293 HydrophobicContact CD2-CD1 3.56Å; Y230-F293 AromaticContact CD2-CE1 3.71Å; Y230-F293 HydrophobicContact CD2-CE1 3.71Å; Y230-F293 HydrophobicContact CD2-CG 4.01Å; Y230-F293 HydrophobicContact CD2-CZ 4.26Å; Y230-F293 HydrophobicContact CE2-CD1 4.05Å; Y230-F293 HydrophobicContact CE2-CE1 4.01Å; V232-F293 HydrophobicContact CG2-CD2 4.28Å; V232-F293 HydrophobicContact CG2-CE2 4.33Å; V289-F293 HydrophobicContact CG1-CD2 4.33Å; V289-F293 HydrophobicContact CG1-CE2 3.76Å; V289-F293 WeakPolarHBondContact O-CD2 3.47Å; A290-F293 PolarHBondContact O-N 3.37Å; E291-F293 PolarHBondContact O-N 2.92Å; F293-E297 HydrophobicContact CD1-CG 4.27Å; F293-E297 CarbonylContact O-C 3.53Å; F293-E297 WeakPolarHBondContact O-CB 3.28Å; F293-G298 PolarHBondContact O-N 3.45Å; F293-G298 VanDerWaalsContact O-N 3.14Å; F293-Q299 PolarHBondContact O-N 3.33Å; F293-V301 HydrophobicContact CB-CG2 3.42Å; F293-V301 VanDerWaalsContact CB-CG2 3.42Å
294	R	94.8	Very high	94.5	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-66.5	-54	174	-175.2	-167.3	62.1	-154.3	-7.3	112.3	A290 E291 Y292 G298 R345 T347 I354	A290-R294 PolarHBondContact O-N 3.46Å; E291-R294 PolarHBondContact O-N 2.74Å; Y292-R294 VanDerWaalsContact C-N 3.31Å; Y292-R294 PolarHBondContact O-N 3.37Å; R294-G298 VanDerWaalsContact O-CA 3.27Å; R294-G298 WeakPolarHBondContact O-CA 3.43Å; R294-G298 PolarHBondContact O-N 3.03Å; R294-R345 PolarHBondContact NH1-O 3.4Å; R294-T347 PolarHBondContact NH1-O 3.38Å; R294-I354 HydrophobicContact CB-CD1 4.09Å; R294-I354 HydrophobicContact CB-CG1 3.91Å; R294-I354 HydrophobicContact CG-CG1 4.21Å
295	D	94.4	Very high	94.4	Very high	54 Å²	54	22.3 Å²	22.3	29%	0.289	12%	0.118	S	C	.	.	H	α-helix	trans	-91.7	-31.9	-164.1	-65.2	-31.3	0	0	0	113.5	E291 K351	E291-D295 WeakPolarHBondContact O-CB 3.21Å; E291-D295 PolarHBondContact O-N 3.3Å; D295-K351 WeakPolarHBondContact O-CD 3.35Å
296	Q	93.6	Very high	94.1	Very high	129 Å²	129	23 Å²	23	60%	0.603	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-38	-176.2	-163.9	60.6	55.2	0	0	112.3	Y292	Y292-Q296 HydrophobicContact CD2-CB 3.97Å; Y292-Q296 HydrophobicContact CD2-CG 4.42Å; Y292-Q296 HydrophobicContact CE2-CB 3.72Å; Y292-Q296 HydrophobicContact CE2-CG 3.71Å; Y292-Q296 WeakPolarHBondContact O-CA 3.47Å; Y292-Q296 VanDerWaalsContact O-CB 3.24Å; Y292-Q296 WeakPolarHBondContact O-CB 3.35Å; Y292-Q296 PolarHBondContact O-N 3.08Å
297	E	91.4	Very high	93.7	Very high	62 Å²	62	23.3 Å²	23.3	29%	0.29	12%	0.123	S	C	.	.	S	Bend	trans	-94.9	-15	176.5	-60.8	-163.7	-177.4	0	0	113.7	P138 Y230 Y292 F293 Q299	P138-E297 WeakPolarHBondContact CD-OE1 3.34Å; Y230-E297 WeakPolarHBondContact CE2-OE2 3.35Å; Y292-E297 HydrophobicContact CE1-CG 3.96Å; Y292-E297 PolarHBondContact O-N 3.47Å; F293-E297 HydrophobicContact CD1-CG 4.27Å; F293-E297 CarbonylContact O-C 3.53Å; F293-E297 WeakPolarHBondContact O-CB 3.28Å; E297-Q299 VanDerWaalsContact C-N 3.35Å; E297-Q299 HydrophobicContact CB-CG 4.07Å; E297-Q299 PolarHBondContact OE2-NE2 3.33Å
298	G	90.8	Very high	93.4	Very high	41 Å²	41	23.2 Å²	23.2	42%	0.423	12%	0.123	S	C	.	.			trans	67.7	33.8	178	0	0	0	0	0	113.4	F293 R294 K351	F293-G298 PolarHBondContact O-N 3.45Å; F293-G298 VanDerWaalsContact O-N 3.14Å; R294-G298 VanDerWaalsContact O-CA 3.27Å; R294-G298 WeakPolarHBondContact O-CA 3.43Å; R294-G298 PolarHBondContact O-N 3.03Å; G298-K351 CarbonylContact C-O 3.51Å; G298-K351 WeakPolarHBondContact CA-O 3.49Å
299	Q	87.8	Confident	93.1	Very high	51 Å²	51	23.9 Å²	23.9	24%	0.238	13%	0.125	C	C	.	.			trans	-102.5	160.4	-176.7	-64.5	-164.2	2.6	0	0	112.8	F293 E297 S353	F293-Q299 PolarHBondContact O-N 3.33Å; E297-Q299 VanDerWaalsContact C-N 3.35Å; E297-Q299 HydrophobicContact CB-CG 4.07Å; E297-Q299 PolarHBondContact OE2-NE2 3.33Å; Q299-S353 PolarHBondContact O-N 3.16Å
300	D	88.7	Confident	92.9	Very high	61 Å²	61	26.1 Å²	26.1	33%	0.326	13%	0.134	S	C	.	.			trans	-85.3	118.4	166	-63.3	-43.5	0	0	0	109.2	K198 G229 S353	K198-D300 WeakPolarHBondContact CE-OD1 3.25Å; K198-D300 WeakPolarHBondContact CE-OD2 3.32Å; K198-D300 IonicContact NZ-OD1 3.4Å; K198-D300 PolarHBondContact NZ-OD1 2.96Å; K198-D300 IonicContact NZ-OD2 3.11Å; K198-D300 PolarHBondContact NZ-OD2 2.98Å; G229-D300 WeakPolarHBondContact CA-O 3.32Å; D300-S353 WeakPolarHBondContact CA-O 3.35Å; D300-S353 WeakPolarHBondContact OD1-CB 3.27Å; D300-S353 PolarHBondContact OD1-N 2.85Å; D300-S353 PolarHBondContact OD1-OG 2.96Å
301	V	92.2	Very high	92.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.1	-171.4	-171.8	0	0	0	0	109.3	Y230 V232 A290 F293 S353 I354 T355	Y230-V301 WeakPolarHBondContact O-CA 3.46Å; V232-V301 HydrophobicContact CG2-CG1 4.29Å; A290-V301 HydrophobicContact CB-CG1 3.9Å; F293-V301 HydrophobicContact CB-CG2 3.42Å; F293-V301 VanDerWaalsContact CB-CG2 3.42Å; V301-S353 PolarHBondContact N-O 3.44Å; V301-I354 HydrophobicContact CB-CG1 4.32Å; V301-I354 CarbonylContact O-C 3.55Å; V301-I354 WeakPolarHBondContact O-CA 3.16Å; V301-T355 PolarHBondContact O-N 3.37Å
302	L	93.1	Very high	92.8	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.042	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124	165.3	-65.8	-170	0	0	0	110.6	L183 V223 Y230 S231 V232 F304 T355	L183-L302 HydrophobicContact CD2-CD2 4.1Å; V223-L302 HydrophobicContact CB-CD1 3.53Å; V223-L302 HydrophobicContact CB-CG 4.31Å; V223-L302 HydrophobicContact CG1-CD1 3.66Å; V223-L302 HydrophobicContact CG1-CD2 4.29Å; V223-L302 HydrophobicContact CG1-CG 3.87Å; V223-L302 HydrophobicContact CG2-CD1 3.76Å; Y230-L302 PolarHBondContact O-N 2.97Å; S231-L302 CarbonylContact C-O 3.58Å; S231-L302 VanDerWaalsContact CA-O 3.28Å; S231-L302 WeakPolarHBondContact CA-O 3.33Å; V232-L302 PolarHBondContact N-O 2.82Å; L302-F304 HydrophobicContact CB-CD2 4.29Å; L302-F304 HydrophobicContact CB-CE2 3.51Å; L302-F304 HydrophobicContact CB-CZ 4.1Å; L302-F304 HydrophobicContact CD1-CE2 3.87Å; L302-F304 HydrophobicContact CD1-CZ 3.74Å; L302-F304 HydrophobicContact CG-CE2 4.38Å; L302-T355 WeakPolarHBondContact CA-O 3.46Å; L302-T355 HydrophobicContact CD2-CG2 4.28Å
303	L	95.5	Very high	92.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	115.4	173.8	177.6	62.6	0	0	0	109.9	V232 L287 A290 I305 I346 I354 T355 S356 V357	V232-L303 HydrophobicContact CB-CD1 4.02Å; V232-L303 HydrophobicContact CG1-CD1 4.13Å; V232-L303 WeakPolarHBondContact O-CA 3.26Å; L287-L303 HydrophobicContact CB-CD2 4.47Å; L287-L303 HydrophobicContact CD1-CD2 3.87Å; A290-L303 HydrophobicContact CB-CB 4.45Å; A290-L303 HydrophobicContact CB-CD1 4.28Å; L303-I305 HydrophobicContact CD1-CG1 4.47Å; L303-I305 HydrophobicContact CD2-CD1 4.09Å; L303-I305 HydrophobicContact CD2-CG1 4.3Å; L303-I305 HydrophobicContact CG-CD1 4.37Å; L303-I305 HydrophobicContact CG-CG1 4.02Å; L303-I346 HydrophobicContact CD2-CD1 3.97Å; L303-I346 HydrophobicContact CD2-CG1 4.06Å; L303-I354 HydrophobicContact CB-CG2 3.68Å; L303-I354 HydrophobicContact CD2-CG2 4.23Å; L303-T355 PolarHBondContact N-O 3.26Å; L303-S356 CarbonylContact O-C 3.53Å; L303-S356 WeakPolarHBondContact O-CA 3.41Å; L303-V357 PolarHBondContact O-N 2.94Å
304	F	94.6	Very high	92.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.8	174.1	-63.8	-88	0	0	0	109.4	I216 L219 I220 V232 F233 A234 L302 V357	I216-F304 HydrophobicContact CB-CD1 4.2Å; I216-F304 HydrophobicContact CB-CE1 4.33Å; I216-F304 HydrophobicContact CG1-CD1 4.09Å; I216-F304 HydrophobicContact CG1-CE1 4.41Å; I216-F304 HydrophobicContact CG2-CB 4.42Å; I216-F304 HydrophobicContact CG2-CD1 3.41Å; I216-F304 VanDerWaalsContact CG2-CD1 3.41Å; I216-F304 HydrophobicContact CG2-CE1 3.77Å; I216-F304 HydrophobicContact CG2-CG 3.94Å; L219-F304 HydrophobicContact CB-CE1 4.15Å; L219-F304 HydrophobicContact CB-CZ 4.08Å; L219-F304 HydrophobicContact CD1-CE1 4.48Å; I220-F304 HydrophobicContact CB-CE2 4.41Å; I220-F304 HydrophobicContact CB-CZ 4.48Å; I220-F304 HydrophobicContact CD1-CD2 3.97Å; I220-F304 HydrophobicContact CD1-CE2 3.87Å; I220-F304 HydrophobicContact CD1-CG 4.45Å; I220-F304 HydrophobicContact CD1-CZ 4.24Å; I220-F304 HydrophobicContact CG1-CD2 3.78Å; I220-F304 HydrophobicContact CG1-CE1 4.19Å; I220-F304 HydrophobicContact CG1-CE2 3.15Å; I220-F304 HydrophobicContact CG1-CZ 3.38Å; V232-F304 PolarHBondContact O-N 2.7Å; F233-F304 HydrophobicContact CB-CB 4.44Å; F233-F304 HydrophobicContact CD2-CB 3.57Å; F233-F304 HydrophobicContact CD2-CG 4.35Å; F233-F304 HydrophobicContact CE2-CB 4.18Å; F233-F304 HydrophobicContact CG-CB 4.29Å; A234-F304 PolarHBondContact N-O 3.5Å; L302-F304 HydrophobicContact CB-CD2 4.29Å; L302-F304 HydrophobicContact CB-CE2 3.51Å; L302-F304 HydrophobicContact CB-CZ 4.1Å; L302-F304 HydrophobicContact CD1-CE2 3.87Å; L302-F304 HydrophobicContact CD1-CZ 3.74Å; L302-F304 HydrophobicContact CG-CE2 4.38Å; F304-V357 VanDerWaalsContact CA-O 3.32Å; F304-V357 WeakPolarHBondContact CA-O 3.29Å; F304-V357 HydrophobicContact CD1-CB 3.66Å; F304-V357 HydrophobicContact CD1-CG1 4.11Å; F304-V357 HydrophobicContact CD1-CG2 4.35Å; F304-V357 HydrophobicContact CE1-CB 3.69Å; F304-V357 HydrophobicContact CE1-CG1 4.08Å; F304-V357 HydrophobicContact CE1-CG2 3.91Å
305	I	94.5	Very high	92.6	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	108	175.3	-53.3	-179.9	0	0	0	108	A234 V236 L303 I308 I346 V357 Q358 A359	A234-I305 HydrophobicContact CB-CG1 4.47Å; V236-I305 HydrophobicContact CG2-CG2 3.71Å; L303-I305 HydrophobicContact CD1-CG1 4.47Å; L303-I305 HydrophobicContact CD2-CD1 4.09Å; L303-I305 HydrophobicContact CD2-CG1 4.3Å; L303-I305 HydrophobicContact CG-CD1 4.37Å; L303-I305 HydrophobicContact CG-CG1 4.02Å; I305-I308 HydrophobicContact CD1-CD1 4.46Å; I305-I308 HydrophobicContact CG2-CB 4.15Å; I305-I308 HydrophobicContact CG2-CD1 4.06Å; I305-I346 HydrophobicContact CD1-CD1 4.02Å; I305-V357 PolarHBondContact N-O 3.49Å; I305-Q358 HydrophobicContact CB-CB 4.45Å; I305-Q358 HydrophobicContact CB-CG 4.21Å; I305-Q358 HydrophobicContact CD1-CG 4.26Å; I305-Q358 HydrophobicContact CG1-CG 4.39Å; I305-Q358 CarbonylContact O-C 3.45Å; I305-Q358 WeakPolarHBondContact O-CA 3.5Å; I305-A359 PolarHBondContact O-N 3.35Å
306	D	90.9	Very high	92.7	Very high	16 Å²	16	26.4 Å²	26.4	9%	0.086	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	106.6	174.6	-163	1.8	0	0	0	107.8	F233 A234 G235 V236 E238 A359	F233-D306 HydrophobicContact CE1-CB 4.5Å; F233-D306 HydrophobicContact CE2-CB 4.26Å; F233-D306 HydrophobicContact CZ-CB 3.72Å; A234-D306 PolarHBondContact O-N 2.98Å; G235-D306 CarbonylContact C-O 3.56Å; G235-D306 VanDerWaalsContact CA-O 3.23Å; G235-D306 WeakPolarHBondContact CA-O 3.26Å; V236-D306 PolarHBondContact N-O 3.25Å; E238-D306 HydrophobicContact CG-CB 4.29Å; E238-D306 WeakPolarHBondContact CG-O 3.4Å; D306-A359 HydrophobicContact CB-CB 4.21Å; D306-A359 WeakPolarHBondContact OD1-CB 3.4Å
307	N	89.3	Confident	92.7	Very high	5 Å²	5	23.3 Å²	23.3	3%	0.027	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	cis	-122	134.7	1.9	-168	-64.3	0	0	0	111.5	V236 E238 F309 R310 A359 Y361	V236-N307 PolarHBondContact O-N 2.88Å; V236-N307 VanDerWaalsContact O-N 3.09Å; E238-N307 WeakPolarHBondContact OE1-CB 3.29Å; E238-N307 PolarHBondContact OE1-N 3.14Å; N307-F309 PolarHBondContact O-N 2.95Å; N307-F309 WeakPolarHBondContact OD1-CB 3.43Å; N307-F309 PolarHBondContact OD1-N 3Å; N307-R310 HydrophobicContact CB-CG 4.07Å; N307-R310 WeakPolarHBondContact O-CB 3.44Å; N307-R310 PolarHBondContact O-N 2.83Å; N307-A359 PolarHBondContact ND2-O 3.47Å; N307-A359 PolarHBondContact OD1-O 2.72Å; N307-Y361 PolarHBondContact ND2-N 3.45Å; N307-Y361 PolarHBondContact OD1-N 2.99Å; N307-Y361 VanDerWaalsContact OD1-N 3.07Å
308	I	91.8	Very high	92.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66.1	-26.4	-176.4	-168.5	60.7	0	0	0	112.8	I305 R310 F311 T312 M339 M342 Q358 A359 I360 T375	I305-I308 HydrophobicContact CD1-CD1 4.46Å; I305-I308 HydrophobicContact CG2-CB 4.15Å; I305-I308 HydrophobicContact CG2-CD1 4.06Å; I308-R310 PolarHBondContact O-N 3.06Å; I308-F311 HydrophobicContact CD1-CB 4.11Å; I308-F311 HydrophobicContact CD1-CD1 4.36Å; I308-F311 HydrophobicContact CD1-CG 4.41Å; I308-F311 WeakPolarHBondContact O-CB 3.21Å; I308-F311 PolarHBondContact O-N 3.28Å; I308-T312 PolarHBondContact O-N 3.37Å; I308-M339 HydrophobicContact CG1-CE 4.24Å; I308-M339 HydrophobicContact CG1-SD 4.28Å; I308-M342 HydrophobicContact CD1-CE 3.41Å; I308-M342 VanDerWaalsContact CD1-CE 3.41Å; I308-M342 HydrophobicContact CD1-SD 3.63Å; I308-M342 HydrophobicContact CG1-CE 4.35Å; I308-Q358 HydrophobicContact CB-CB 4.49Å; I308-Q358 HydrophobicContact CG2-CB 4.33Å; I308-A359 PolarHBondContact N-O 2.79Å; I308-A359 VanDerWaalsContact N-O 3.08Å; I308-I360 HydrophobicContact CG2-CB 4.42Å; I308-I360 HydrophobicContact CG2-CD1 4.46Å; I308-I360 HydrophobicContact CG2-CG1 3.48Å; I308-I360 VanDerWaalsContact CG2-CG1 3.48Å; I308-T375 HydrophobicContact CG2-CG2 4.24Å
309	F	91.5	Very high	93	Very high	17 Å²	17	19.2 Å²	19.2	8%	0.075	10%	0.097	C	C	.	.	H	α-helix	trans	-60.6	-33.2	173.1	176.8	-97.5	0	0	0	112	N307 F311 T312 Q313 Y331 Y361 P363 A371	N307-F309 PolarHBondContact O-N 2.95Å; N307-F309 WeakPolarHBondContact OD1-CB 3.43Å; N307-F309 PolarHBondContact OD1-N 3Å; F309-F311 VanDerWaalsContact C-N 3.3Å; F309-F311 PolarHBondContact O-N 2.79Å; F309-T312 WeakPolarHBondContact O-CB 3.41Å; F309-T312 PolarHBondContact O-N 3.06Å; F309-Q313 HydrophobicContact CE1-CB 4.19Å; F309-Q313 PolarHBondContact O-N 3.43Å; F309-Y331 HydrophobicContact CE2-CE1 4.48Å; F309-Y331 WeakPolarHBondContact CE2-OH 3.35Å; F309-Y361 AromaticContact CD1-CD1 3.63Å; F309-Y361 HydrophobicContact CD1-CD1 3.63Å; F309-Y361 HydrophobicContact CD1-CG 4.41Å; F309-Y361 AromaticContact CE1-CD1 3.83Å; F309-Y361 HydrophobicContact CE1-CD1 3.83Å; F309-Y361 HydrophobicContact CE1-CE1 4.33Å; F309-Y361 HydrophobicContact CG-CD1 4.13Å; F309-P363 HydrophobicContact CD2-CG 4.02Å; F309-P363 HydrophobicContact CE1-CG 4.26Å; F309-P363 HydrophobicContact CE2-CG 3.26Å; F309-P363 HydrophobicContact CZ-CB 4.48Å; F309-P363 HydrophobicContact CZ-CG 3.41Å; F309-P363 VanDerWaalsContact CZ-CG 3.41Å; F309-A371 HydrophobicContact CD2-CB 3.81Å; F309-A371 HydrophobicContact CE2-CB 3.72Å
310	R	93.1	Very high	93.3	Very high	48 Å²	48	20 Å²	20	18%	0.181	11%	0.113	C	C	.	.	H	α-helix	trans	-70	-27.4	-179.7	-62.1	-65.5	-177.2	-160.1	-5.5	112.6	V236 N307 I308 A314	V236-R310 HydrophobicContact CG1-CB 4.11Å; V236-R310 WeakPolarHBondContact O-CB 3.42Å; V236-R310 WeakPolarHBondContact O-CG 3.32Å; N307-R310 HydrophobicContact CB-CG 4.07Å; N307-R310 WeakPolarHBondContact O-CB 3.44Å; N307-R310 PolarHBondContact O-N 2.83Å; I308-R310 PolarHBondContact O-N 3.06Å; R310-A314 VanDerWaalsContact O-CB 3.23Å; R310-A314 WeakPolarHBondContact O-CB 3.46Å; R310-A314 PolarHBondContact O-N 2.79Å
311	F	94.8	Very high	93.4	Very high	16 Å²	16	20.2 Å²	20.2	7%	0.07	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-49.4	168.9	169.8	-98.6	0	0	0	110.4	V236 A280 A283 I308 F309 A314 G315 M339 M342	V236-F311 HydrophobicContact CG1-CB 4.06Å; A280-F311 VanDerWaalsContact O-CE2 3.23Å; A280-F311 WeakPolarHBondContact O-CE2 3.45Å; A283-F311 HydrophobicContact CB-CD2 3.97Å; I308-F311 HydrophobicContact CD1-CB 4.11Å; I308-F311 HydrophobicContact CD1-CD1 4.36Å; I308-F311 HydrophobicContact CD1-CG 4.41Å; I308-F311 WeakPolarHBondContact O-CB 3.21Å; I308-F311 PolarHBondContact O-N 3.28Å; F309-F311 VanDerWaalsContact C-N 3.3Å; F309-F311 PolarHBondContact O-N 2.79Å; F311-A314 PolarHBondContact O-N 2.96Å; F311-G315 PolarHBondContact O-N 3.26Å; F311-M339 HydrophobicContact CD1-CE 4.45Å; F311-M342 HydrophobicContact CD1-SD 4.47Å; F311-M342 HydrophobicContact CE1-SD 4.4Å; F311-M342 HydrophobicContact CZ-CB 4.36Å; F311-M342 HydrophobicContact CZ-SD 4.44Å
312	T	94.4	Very high	93.5	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-47	176.4	-66.9	0	0	0	0	112.3	I308 F309 A314 G315 S316 Y331 L335 M339 A371	I308-T312 PolarHBondContact O-N 3.37Å; F309-T312 WeakPolarHBondContact O-CB 3.41Å; F309-T312 PolarHBondContact O-N 3.06Å; T312-A314 PolarHBondContact O-N 2.81Å; T312-G315 WeakPolarHBondContact O-CA 3.48Å; T312-G315 PolarHBondContact O-N 2.82Å; T312-G315 VanDerWaalsContact O-N 3.14Å; T312-S316 PolarHBondContact O-N 2.97Å; T312-S316 PolarHBondContact O-OG 3.24Å; T312-Y331 HydrophobicContact CG2-CD1 3.77Å; T312-Y331 HydrophobicContact CG2-CE1 3.75Å; T312-L335 HydrophobicContact CG2-CD1 3.31Å; T312-M339 WeakPolarHBondContact OG1-CE 3.48Å; T312-A371 HydrophobicContact CG2-CB 3.73Å
313	Q	93.8	Very high	93.4	Very high	64 Å²	64	23.1 Å²	23.1	30%	0.299	14%	0.144	S	C	.	.	H	α-helix	trans	-59.5	-47.2	179.1	-172.6	-170.8	18.1	0	0	111.4	F309 G315 S316 E317	F309-Q313 HydrophobicContact CE1-CB 4.19Å; F309-Q313 PolarHBondContact O-N 3.43Å; Q313-G315 VanDerWaalsContact C-N 3.28Å; Q313-G315 PolarHBondContact O-N 2.71Å; Q313-S316 WeakPolarHBondContact O-CB 3.49Å; Q313-S316 PolarHBondContact O-N 3.37Å; Q313-S316 VanDerWaalsContact O-N 3.15Å; Q313-E317 WeakPolarHBondContact O-CG 3.49Å; Q313-E317 PolarHBondContact O-N 3.46Å
314	A	94.9	Very high	93.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.4	-38.7	176.2	0	0	0	0	0	111.6	P276 R279 A280 R310 F311 T312 S316 E317 V318	P276-A314 HydrophobicContact CB-CB 4.44Å; R279-A314 HydrophobicContact CB-CB 3.66Å; A280-A314 HydrophobicContact CB-CB 3.9Å; R310-A314 VanDerWaalsContact O-CB 3.23Å; R310-A314 WeakPolarHBondContact O-CB 3.46Å; R310-A314 PolarHBondContact O-N 2.79Å; F311-A314 PolarHBondContact O-N 2.96Å; T312-A314 PolarHBondContact O-N 2.81Å; A314-S316 PolarHBondContact O-N 2.9Å; A314-E317 PolarHBondContact O-N 2.69Å; A314-V318 WeakPolarHBondContact O-CG2 3.5Å; A314-V318 PolarHBondContact O-N 3.44Å
315	G	94.4	Very high	93.3	Very high	14 Å²	14	33.5 Å²	33.5	14%	0.144	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-40.3	172.7	0	0	0	0	0	113.5	F311 T312 Q313 S319	F311-G315 PolarHBondContact O-N 3.26Å; T312-G315 WeakPolarHBondContact O-CA 3.48Å; T312-G315 PolarHBondContact O-N 2.82Å; T312-G315 VanDerWaalsContact O-N 3.14Å; Q313-G315 VanDerWaalsContact C-N 3.28Å; Q313-G315 PolarHBondContact O-N 2.71Å; G315-S319 WeakPolarHBondContact O-CB 3.32Å; G315-S319 PolarHBondContact O-N 3.45Å
316	S	94.9	Very high	93.3	Very high	19 Å²	19	37.5 Å²	37.5	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-44.5	174.7	-64.9	0	0	0	0	112.4	T312 Q313 A314 S319 A320 Y331 Q332	T312-S316 PolarHBondContact O-N 2.97Å; T312-S316 PolarHBondContact O-OG 3.24Å; Q313-S316 WeakPolarHBondContact O-CB 3.49Å; Q313-S316 PolarHBondContact O-N 3.37Å; Q313-S316 VanDerWaalsContact O-N 3.15Å; A314-S316 PolarHBondContact O-N 2.9Å; S316-S319 PolarHBondContact O-N 2.8Å; S316-A320 PolarHBondContact O-N 2.95Å; S316-Y331 WeakPolarHBondContact OG-CA 3.25Å; S316-Y331 VanDerWaalsContact OG-CD1 3.26Å; S316-Y331 WeakPolarHBondContact OG-CD1 3.4Å; S316-Q332 PolarHBondContact OG-OE1 3.42Å
317	E	94.7	Very high	93.4	Very high	65 Å²	65	40 Å²	40	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-60.2	-47.4	176.1	-67.3	173.2	-125.4	0	0	111.4	P276 R279 Q313 A314 A320 L321	P276-E317 HydrophobicContact CB-CB 3.82Å; P276-E317 WeakPolarHBondContact CB-OE2 3.42Å; P276-E317 HydrophobicContact CG-CB 4.27Å; R279-E317 IonicContact CZ-OE1 3.55Å; R279-E317 IonicContact CZ-OE2 3.26Å; R279-E317 IonicContact NH1-OE1 3.88Å; R279-E317 PolarHBondContact NH1-OE1 2.88Å; R279-E317 IonicContact NH2-OE1 2.82Å; R279-E317 PolarHBondContact NH2-OE1 3.3Å; R279-E317 IonicContact NH2-OE2 2.74Å; R279-E317 PolarHBondContact NH2-OE2 2.98Å; Q313-E317 WeakPolarHBondContact O-CG 3.49Å; Q313-E317 PolarHBondContact O-N 3.46Å; A314-E317 PolarHBondContact O-N 2.69Å; E317-A320 PolarHBondContact O-N 3.34Å; E317-L321 WeakPolarHBondContact O-CG 3.16Å; E317-L321 PolarHBondContact O-N 3.21Å
318	V	93.6	Very high	93.3	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-45	175.9	169.4	0	0	0	0	111.1	I111 P276 A314 A320 L321 L322	I111-V318 HydrophobicContact CD1-CG1 3.37Å; I111-V318 HydrophobicContact CG1-CG1 3.89Å; I111-V318 HydrophobicContact CG2-CG2 4.25Å; P276-V318 HydrophobicContact CB-CG2 4.02Å; P276-V318 HydrophobicContact CG-CG2 4.45Å; A314-V318 WeakPolarHBondContact O-CG2 3.5Å; A314-V318 PolarHBondContact O-N 3.44Å; V318-A320 VanDerWaalsContact C-N 3.31Å; V318-A320 PolarHBondContact O-N 3.19Å; V318-L321 PolarHBondContact O-N 3.43Å; V318-L321 VanDerWaalsContact O-N 3.15Å; V318-L322 HydrophobicContact CG1-CD1 3.9Å; V318-L322 HydrophobicContact CG1-CG 4.19Å; V318-L322 WeakPolarHBondContact O-CG 3.44Å; V318-L322 PolarHBondContact O-N 3.45Å
319	S	94.8	Very high	93.2	Very high	5 Å²	5	48.1 Å²	48.1	4%	0.035	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-40.3	-179.1	178.6	0	0	0	0	112.5	G315 S316 L322 G323 R324 Q332	G315-S319 WeakPolarHBondContact O-CB 3.32Å; G315-S319 PolarHBondContact O-N 3.45Å; S316-S319 PolarHBondContact O-N 2.8Å; S319-L322 PolarHBondContact O-N 2.77Å; S319-G323 PolarHBondContact O-N 2.93Å; S319-R324 PolarHBondContact O-N 2.91Å; S319-R324 WeakPolarHBondContact OG-CB 3.35Å; S319-R324 WeakPolarHBondContact OG-CD 3.31Å; S319-Q332 VanDerWaalsContact OG-CB 3.29Å; S319-Q332 WeakPolarHBondContact OG-CB 3.24Å
320	A	93.7	Very high	93.3	Very high	69 Å²	69	49.5 Å²	49.5	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-62.9	-44	174.9	0	0	0	0	0	111.4	S316 E317 V318 L322 G323	S316-A320 PolarHBondContact O-N 2.95Å; E317-A320 PolarHBondContact O-N 3.34Å; V318-A320 VanDerWaalsContact C-N 3.31Å; V318-A320 PolarHBondContact O-N 3.19Å; A320-L322 VanDerWaalsContact C-N 3.32Å; A320-L322 PolarHBondContact O-N 2.87Å; A320-G323 PolarHBondContact O-N 3.11Å; A320-G323 VanDerWaalsContact O-N 3.1Å
321	L	92	Very high	93.4	Very high	64 Å²	64	48.2 Å²	48.2	34%	0.335	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-30.2	177.6	-66	173.7	0	0	0	113.2	A69 V70 E317 V318 G323	A69-L321 HydrophobicContact CB-CD1 4.04Å; V70-L321 HydrophobicContact CB-CB 4.49Å; V70-L321 HydrophobicContact CG2-CB 3.49Å; V70-L321 VanDerWaalsContact CG2-CB 3.49Å; V70-L321 HydrophobicContact CG2-CD1 4.4Å; E317-L321 WeakPolarHBondContact O-CG 3.16Å; E317-L321 PolarHBondContact O-N 3.21Å; V318-L321 PolarHBondContact O-N 3.43Å; V318-L321 VanDerWaalsContact O-N 3.15Å; L321-G323 PolarHBondContact O-N 2.85Å
322	L	92.9	Very high	93.4	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.037	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-9.7	173.6	-69.6	176.5	0	0	0	113.1	V70 A100 R109 I111 V318 S319 A320 R324	V70-L322 HydrophobicContact CG2-CD2 4.23Å; A100-L322 HydrophobicContact CB-CD1 4.31Å; A100-L322 HydrophobicContact CB-CD2 4.07Å; R109-L322 VanDerWaalsContact CD-CD2 3.47Å; R109-L322 HydrophobicContact CG-CD2 3.61Å; R109-L322 PolarHBondContact NH1-O 3.15Å; I111-L322 HydrophobicContact CG1-CD2 4.44Å; V318-L322 HydrophobicContact CG1-CD1 3.9Å; V318-L322 HydrophobicContact CG1-CG 4.19Å; V318-L322 WeakPolarHBondContact O-CG 3.44Å; V318-L322 PolarHBondContact O-N 3.45Å; S319-L322 PolarHBondContact O-N 2.77Å; A320-L322 VanDerWaalsContact C-N 3.32Å; A320-L322 PolarHBondContact O-N 2.87Å; L322-R324 HydrophobicContact CB-CG 4.36Å
323	G	91.1	Very high	93.4	Very high	63 Å²	63	51.1 Å²	51.1	65%	0.649	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	22.1	-179.3	0	0	0	0	0	113.9	S319 A320 L321	S319-G323 PolarHBondContact O-N 2.93Å; A320-G323 PolarHBondContact O-N 3.11Å; A320-G323 VanDerWaalsContact O-N 3.1Å; L321-G323 PolarHBondContact O-N 2.85Å
324	R	93.1	Very high	93.5	Very high	74 Å²	74	50 Å²	50	28%	0.279	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-76.2	143	173.7	-61.1	177.4	-177.4	177	1.1	109.5	S319 L322 P333 T334	S319-R324 PolarHBondContact O-N 2.91Å; S319-R324 WeakPolarHBondContact OG-CB 3.35Å; S319-R324 WeakPolarHBondContact OG-CD 3.31Å; L322-R324 HydrophobicContact CB-CG 4.36Å; R324-P333 HydrophobicContact CB-CG 4.28Å; R324-T334 PolarHBondContact NH1-OG1 3.48Å; R324-T334 VanDerWaalsContact NH1-OG1 3.17Å
325	I	95.1	Very high	93.4	Very high	144 Å²	144	50.5 Å²	50.5	74%	0.738	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-66.9	126.7	173.9	-60.7	175.2	0	0	0	108.2	P333	I325-P333 WeakPolarHBondContact O-CD 3.2Å
326	P	94.1	Very high	93.4	Very high	86 Å²	86	52.9 Å²	52.9	56%	0.558	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-67.1	150.1	178.1	27.5	-34	0	0	0	111.5
327	S	93.7	Very high	93.4	Very high	69 Å²	69	56.4 Å²	56.4	48%	0.483	37%	0.367	S	S	.	.			trans	-94.8	-162.1	175.8	-166.5	0	0	0	0	110.9	V329 G330 Y331	S327-V329 PolarHBondContact O-N 2.79Å; S327-G330 PolarHBondContact O-N 3.42Å; S327-G330 VanDerWaalsContact O-N 3.11Å; S327-Y331 WeakPolarHBondContact CB-O 3.38Å; S327-Y331 PolarHBondContact N-O 3.25Å
328	A	87.9	Confident	93.4	Very high	59 Å²	59	56 Å²	56	49%	0.488	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-48.3	135.7	176.6	0	0	0	0	0	111.8	G330 Y331 P370	A328-G330 PolarHBondContact O-N 3.47Å; A328-Y331 WeakPolarHBondContact O-CD2 3.26Å; A328-Y331 PolarHBondContact O-N 2.83Å; A328-P370 HydrophobicContact CB-CG 4.31Å
329	V	89.8	Confident	93.4	Very high	115 Å²	115	55.5 Å²	55.5	70%	0.697	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	58.3	11.2	177.7	-161	0	0	0	0	113.8	S327 Y331 P370	S327-V329 PolarHBondContact O-N 2.79Å; V329-Y331 HydrophobicContact CB-CD2 4.1Å; V329-Y331 HydrophobicContact CB-CE2 4.07Å; V329-Y331 HydrophobicContact CG1-CE2 4.31Å; V329-P370 HydrophobicContact CG2-CG 4.2Å
330	G	91.8	Very high	93.4	Very high	47 Å²	47	55.9 Å²	55.9	49%	0.485	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	91.4	4.9	178.2	0	0	0	0	0	115.2	S327 A328	S327-G330 PolarHBondContact O-N 3.42Å; S327-G330 VanDerWaalsContact O-N 3.11Å; A328-G330 PolarHBondContact O-N 3.47Å
331	Y	95.4	Very high	93.5	Very high	21 Å²	21	56.1 Å²	56.1	8%	0.082	36%	0.363	C	S	.	.			trans	-70.6	163.2	176.4	-69.6	-73.8	0	0	0	112.7	F309 T312 S316 S327 A328 V329 L335 D369 P370 A371	F309-Y331 HydrophobicContact CE2-CE1 4.48Å; F309-Y331 WeakPolarHBondContact CE2-OH 3.35Å; T312-Y331 HydrophobicContact CG2-CD1 3.77Å; T312-Y331 HydrophobicContact CG2-CE1 3.75Å; S316-Y331 WeakPolarHBondContact OG-CA 3.25Å; S316-Y331 VanDerWaalsContact OG-CD1 3.26Å; S316-Y331 WeakPolarHBondContact OG-CD1 3.4Å; S327-Y331 WeakPolarHBondContact CB-O 3.38Å; S327-Y331 PolarHBondContact N-O 3.25Å; A328-Y331 WeakPolarHBondContact O-CD2 3.26Å; A328-Y331 PolarHBondContact O-N 2.83Å; V329-Y331 HydrophobicContact CB-CD2 4.1Å; V329-Y331 HydrophobicContact CB-CE2 4.07Å; V329-Y331 HydrophobicContact CG1-CE2 4.31Å; Y331-L335 HydrophobicContact CD1-CD2 4.48Å; Y331-L335 HydrophobicContact CG-CD2 4.16Å; Y331-D369 WeakPolarHBondContact CE2-OD1 3.17Å; Y331-D369 WeakPolarHBondContact CE2-OD2 3.44Å; Y331-D369 VanDerWaalsContact CZ-OD1 3.22Å; Y331-D369 VanDerWaalsContact OH-CG 3.26Å; Y331-D369 PolarHBondContact OH-OD1 3.23Å; Y331-D369 PolarHBondContact OH-OD2 3.5Å; Y331-D369 VanDerWaalsContact OH-OD2 3.06Å; Y331-P370 HydrophobicContact CD2-CB 3.9Å; Y331-P370 HydrophobicContact CD2-CG 3.96Å; Y331-P370 HydrophobicContact CE2-CB 4.21Å; Y331-P370 HydrophobicContact CE2-CG 4.2Å; Y331-A371 HydrophobicContact CE1-CB 3.84Å; Y331-A371 HydrophobicContact CE2-CB 4.46Å
332	Q	95	Very high	93.6	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.019	35%	0.348	C	S	.	.			trans	-64.6	144.9	174.1	71.3	-83.9	23.3	0	0	111.7	S316 S319 T334 L335	S316-Q332 PolarHBondContact OG-OE1 3.42Å; S319-Q332 VanDerWaalsContact OG-CB 3.29Å; S319-Q332 WeakPolarHBondContact OG-CB 3.24Å; Q332-T334 WeakPolarHBondContact CG-OG1 3.2Å; Q332-T334 PolarHBondContact O-N 3.23Å; Q332-T334 VanDerWaalsContact O-N 3.17Å; Q332-L335 HydrophobicContact CG-CB 4.24Å; Q332-L335 WeakPolarHBondContact O-CB 3.39Å; Q332-L335 PolarHBondContact O-N 2.86Å
333	P	95.3	Very high	93.8	Very high	74 Å²	74	52.9 Å²	52.9	48%	0.481	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18	176.3	27.3	-34.8	0	0	0	112.9	R324 I325	R324-P333 HydrophobicContact CB-CG 4.28Å; I325-P333 WeakPolarHBondContact O-CD 3.2Å
334	T	95	Very high	93.9	Very high	39 Å²	39	53.5 Å²	53.5	24%	0.239	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	10.2	179	52.7	0	0	0	0	113.7	R324 Q332 A336 T337 D338	R324-T334 PolarHBondContact NH1-OG1 3.48Å; R324-T334 VanDerWaalsContact NH1-OG1 3.17Å; Q332-T334 WeakPolarHBondContact CG-OG1 3.2Å; Q332-T334 PolarHBondContact O-N 3.23Å; Q332-T334 VanDerWaalsContact O-N 3.17Å; T334-A336 VanDerWaalsContact C-N 3.35Å; T334-A336 PolarHBondContact O-N 3.09Å; T334-T337 PolarHBondContact O-N 3.29Å; T334-D338 WeakPolarHBondContact CB-OD2 3.45Å; T334-D338 VanDerWaalsContact O-CG 3.29Å; T334-D338 PolarHBondContact O-N 2.77Å; T334-D338 PolarHBondContact OG1-OD2 3.22Å
335	L	94.3	Very high	94.1	Very high	12 Å²	12	50.1 Å²	50.1	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-50.2	-51.4	-170.2	173.3	62.1	0	0	0	113	T312 Y331 Q332 T337 M339 P370 T374	T312-L335 HydrophobicContact CG2-CD1 3.31Å; Y331-L335 HydrophobicContact CD1-CD2 4.48Å; Y331-L335 HydrophobicContact CG-CD2 4.16Å; Q332-L335 HydrophobicContact CG-CB 4.24Å; Q332-L335 WeakPolarHBondContact O-CB 3.39Å; Q332-L335 PolarHBondContact O-N 2.86Å; L335-T337 VanDerWaalsContact C-N 3.34Å; L335-T337 PolarHBondContact O-N 3.41Å; L335-M339 VanDerWaalsContact O-CB 3.32Å; L335-M339 WeakPolarHBondContact O-CB 3.33Å; L335-M339 PolarHBondContact O-N 2.89Å; L335-P370 HydrophobicContact CD2-CB 3.83Å; L335-T374 HydrophobicContact CD2-CG2 4.25Å; L335-T374 HydrophobicContact CG-CG2 4.39Å
336	A	94.6	Very high	94	Very high	63 Å²	63	43.2 Å²	43.2	52%	0.521	28%	0.284	S	S	.	.	H	α-helix	trans	-65.4	-37.7	-178.2	0	0	0	0	0	112.4	T334 G340	T334-A336 VanDerWaalsContact C-N 3.35Å; T334-A336 PolarHBondContact O-N 3.09Å; A336-G340 PolarHBondContact O-N 3.01Å
337	T	94.6	Very high	94	Very high	94 Å²	94	40.5 Å²	40.5	58%	0.577	27%	0.266	S	S	*	.	H	α-helix	trans	-71.5	-46.4	178.6	-51.3	0	0	0	0	111.2	T334 L335 M339 G340 T341	T334-T337 PolarHBondContact O-N 3.29Å; L335-T337 VanDerWaalsContact C-N 3.34Å; L335-T337 PolarHBondContact O-N 3.41Å; T337-M339 VanDerWaalsContact C-N 3.31Å; T337-M339 PolarHBondContact O-N 3.41Å; T337-G340 PolarHBondContact O-N 2.86Å; T337-T341 WeakPolarHBondContact O-CB 3.49Å; T337-T341 PolarHBondContact O-N 3.46Å; T337-T341 PolarHBondContact O-OG1 3.03Å; T337-T341 VanDerWaalsContact O-OG1 3.09Å
338	D	93.7	Very high	93.9	Very high	55 Å²	55	38.5 Å²	38.5	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-41.7	179.7	-61.8	-27.7	0	0	0	110.9	T334 M342	T334-D338 WeakPolarHBondContact CB-OD2 3.45Å; T334-D338 VanDerWaalsContact O-CG 3.29Å; T334-D338 PolarHBondContact O-N 2.77Å; T334-D338 PolarHBondContact OG1-OD2 3.22Å; D338-M342 PolarHBondContact O-N 2.87Å
339	M	94.3	Very high	94.1	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-49	173.6	-175.3	62.3	69.3	0	0	111.2	I308 F311 T312 L335 T337 T341 M342 Q343	I308-M339 HydrophobicContact CG1-CE 4.24Å; I308-M339 HydrophobicContact CG1-SD 4.28Å; F311-M339 HydrophobicContact CD1-CE 4.45Å; T312-M339 WeakPolarHBondContact OG1-CE 3.48Å; L335-M339 VanDerWaalsContact O-CB 3.32Å; L335-M339 WeakPolarHBondContact O-CB 3.33Å; L335-M339 PolarHBondContact O-N 2.89Å; T337-M339 VanDerWaalsContact C-N 3.31Å; T337-M339 PolarHBondContact O-N 3.41Å; M339-T341 PolarHBondContact O-N 3.01Å; M339-M342 PolarHBondContact O-N 3.15Å; M339-M342 HydrophobicContact SD-CE 4.2Å; M339-Q343 HydrophobicContact CG-CG 3.87Å; M339-Q343 WeakPolarHBondContact O-CB 3.44Å; M339-Q343 VanDerWaalsContact O-CG 3.25Å; M339-Q343 WeakPolarHBondContact O-CG 3.33Å; M339-Q343 PolarHBondContact O-N 3.21Å; M339-Q343 HydrophobicContact SD-CG 3.63Å; M339-Q343 PolarHBondContact SD-NE2 2.86Å; M339-Q343 VanDerWaalsContact SD-NE2 3.42Å
340	G	95.3	Very high	94.1	Very high	13 Å²	13	38 Å²	38	13%	0.134	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-46.3	-178.5	0	0	0	0	0	113	A336 T337 M342 Q343 E344	A336-G340 PolarHBondContact O-N 3.01Å; T337-G340 PolarHBondContact O-N 2.86Å; G340-M342 PolarHBondContact O-N 2.95Å; G340-Q343 PolarHBondContact O-N 3.2Å; G340-E344 WeakPolarHBondContact O-CB 3.41Å; G340-E344 VanDerWaalsContact O-CG 3.27Å; G340-E344 WeakPolarHBondContact O-CG 3.2Å; G340-E344 PolarHBondContact O-N 3.26Å
341	T	94.6	Very high	94.1	Very high	75 Å²	75	41.8 Å²	41.8	46%	0.46	23%	0.232	S	C	.	.	H	α-helix	trans	-57.7	-36.7	178.1	-62.7	0	0	0	0	112.2	T337 M339 R345	T337-T341 WeakPolarHBondContact O-CB 3.49Å; T337-T341 PolarHBondContact O-N 3.46Å; T337-T341 PolarHBondContact O-OG1 3.03Å; T337-T341 VanDerWaalsContact O-OG1 3.09Å; M339-T341 PolarHBondContact O-N 3.01Å; T341-R345 WeakPolarHBondContact O-CD 3.49Å
342	M	95.1	Very high	93.9	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-77.4	-48.6	175.5	-173.4	-147.7	68.2	0	0	111.9	A283 L284 L287 I308 F311 D338 M339 G340 E344 R345 I346	A283-M342 HydrophobicContact CB-SD 3.92Å; L284-M342 HydrophobicContact CD2-CB 4.11Å; L284-M342 HydrophobicContact CD2-CG 3.8Å; L287-M342 HydrophobicContact CD2-CG 4.16Å; I308-M342 HydrophobicContact CD1-CE 3.41Å; I308-M342 VanDerWaalsContact CD1-CE 3.41Å; I308-M342 HydrophobicContact CD1-SD 3.63Å; I308-M342 HydrophobicContact CG1-CE 4.35Å; F311-M342 HydrophobicContact CD1-SD 4.47Å; F311-M342 HydrophobicContact CE1-SD 4.4Å; F311-M342 HydrophobicContact CZ-CB 4.36Å; F311-M342 HydrophobicContact CZ-SD 4.44Å; D338-M342 PolarHBondContact O-N 2.87Å; M339-M342 PolarHBondContact O-N 3.15Å; M339-M342 HydrophobicContact SD-CE 4.2Å; G340-M342 PolarHBondContact O-N 2.95Å; M342-E344 PolarHBondContact O-N 2.7Å; M342-R345 PolarHBondContact O-N 3.02Å; M342-I346 HydrophobicContact CE-CD1 4.36Å
343	Q	95.6	Very high	93.8	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.5	-37.6	-174.2	-68.6	-69.1	-2.6	0	0	112	K201 M339 G340 R345 I346 H378	K201-Q343 WeakPolarHBondContact CE-O 3.09Å; K201-Q343 PolarHBondContact NZ-O 3.32Å; M339-Q343 HydrophobicContact CG-CG 3.87Å; M339-Q343 WeakPolarHBondContact O-CB 3.44Å; M339-Q343 VanDerWaalsContact O-CG 3.25Å; M339-Q343 WeakPolarHBondContact O-CG 3.33Å; M339-Q343 PolarHBondContact O-N 3.21Å; M339-Q343 HydrophobicContact SD-CG 3.63Å; M339-Q343 PolarHBondContact SD-NE2 2.86Å; M339-Q343 VanDerWaalsContact SD-NE2 3.42Å; G340-Q343 PolarHBondContact O-N 3.2Å; Q343-R345 PolarHBondContact O-N 3.36Å; Q343-I346 WeakPolarHBondContact O-CB 3.22Å; Q343-I346 PolarHBondContact O-N 2.62Å; Q343-H378 HydrophobicContact CB-CB 4.06Å; Q343-H378 HydrophobicContact CG-CB 4.06Å
344	E	94.6	Very high	93.7	Very high	76 Å²	76	37.5 Å²	37.5	36%	0.355	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.7	-176.7	-65.4	-49.8	113	0	0	113.8	A170 K201 G340 M342 I346 H378	A170-E344 HydrophobicContact CB-CB 3.88Å; K201-E344 IonicContact NZ-OE1 3.24Å; K201-E344 PolarHBondContact NZ-OE1 3.36Å; K201-E344 VanDerWaalsContact NZ-OE1 3.15Å; G340-E344 WeakPolarHBondContact O-CB 3.41Å; G340-E344 VanDerWaalsContact O-CG 3.27Å; G340-E344 WeakPolarHBondContact O-CG 3.2Å; G340-E344 PolarHBondContact O-N 3.26Å; M342-E344 PolarHBondContact O-N 2.7Å; E344-I346 VanDerWaalsContact C-N 3.31Å; E344-H378 IonicContact OE1-CE1 3.44Å; E344-H378 IonicContact OE1-ND1 2.68Å; E344-H378 PolarHBondContact OE1-ND1 2.84Å
345	R	95.8	Very high	93.7	Very high	3 Å²	3	35.9 Å²	35.9	1%	0.011	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-26.6	169.4	-76.3	169.1	65.9	-177.5	-1.9	112.9	I166 A168 A170 L287 T288 E291 R294 T341 M342 Q343 T347	I166-R345 PolarHBondContact O-NH1 3.08Å; I166-R345 PolarHBondContact O-NH2 3.06Å; A168-R345 WeakPolarHBondContact O-CD 3.49Å; A170-R345 HydrophobicContact CB-CG 4.23Å; L287-R345 HydrophobicContact CD1-CB 4.42Å; L287-R345 HydrophobicContact CD2-CB 3.68Å; L287-R345 HydrophobicContact CD2-CG 4.43Å; L287-R345 HydrophobicContact CG-CB 4.36Å; T288-R345 PolarHBondContact OG1-NH2 3.17Å; E291-R345 WeakPolarHBondContact OE1-CB 3.24Å; E291-R345 IonicContact OE1-CZ 3.15Å; E291-R345 IonicContact OE1-NE 3.54Å; E291-R345 PolarHBondContact OE1-NE 2.73Å; E291-R345 IonicContact OE1-NH2 3.51Å; E291-R345 PolarHBondContact OE1-NH2 3.39Å; E291-R345 IonicContact OE2-CZ 2.69Å; E291-R345 IonicContact OE2-NE 2.97Å; E291-R345 IonicContact OE2-NH2 2.73Å; E291-R345 PolarHBondContact OE2-NH2 3.06Å; R294-R345 PolarHBondContact NH1-O 3.4Å; T341-R345 WeakPolarHBondContact O-CD 3.49Å; M342-R345 PolarHBondContact O-N 3.02Å; Q343-R345 PolarHBondContact O-N 3.36Å; R345-T347 PolarHBondContact O-N 2.69Å
346	I	94.9	Very high	93.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-81.4	93.4	174.7	-56.9	171	0	0	0	107.8	K201 L287 L303 I305 M342 Q343 E344 I354 S356	K201-I346 WeakPolarHBondContact CE-O 3.47Å; K201-I346 HydrophobicContact CG-CG2 4.09Å; L287-I346 HydrophobicContact CD1-CG1 3.58Å; L287-I346 HydrophobicContact CD2-CG1 4.38Å; L303-I346 HydrophobicContact CD2-CD1 3.97Å; L303-I346 HydrophobicContact CD2-CG1 4.06Å; I305-I346 HydrophobicContact CD1-CD1 4.02Å; M342-I346 HydrophobicContact CE-CD1 4.36Å; Q343-I346 WeakPolarHBondContact O-CB 3.22Å; Q343-I346 PolarHBondContact O-N 2.62Å; E344-I346 VanDerWaalsContact C-N 3.31Å; I346-I354 HydrophobicContact CG2-CB 4.45Å; I346-I354 HydrophobicContact CG2-CG2 3.94Å; I346-S356 WeakPolarHBondContact CG2-OG 3.41Å
347	T	92.4	Very high	93.7	Very high	29 Å²	29	32.5 Å²	32.5	18%	0.178	17%	0.172	C	C	.	.	S	Bend	trans	-158.4	167.3	-178.6	-169.9	0	0	0	0	111.4	P171 R294 R345	P171-T347 HydrophobicContact CB-CG2 4.29Å; P171-T347 HydrophobicContact CG-CG2 3.75Å; R294-T347 PolarHBondContact NH1-O 3.38Å; R345-T347 PolarHBondContact O-N 2.69Å
348	T	92	Very high	93.7	Very high	27 Å²	27	28 Å²	28	17%	0.166	14%	0.144	C	C	.	.			trans	-83.7	124.3	169.5	-58	0	0	0	0	110.7	S177 K198 G199 S353	S177-T348 PolarHBondContact N-O 2.98Å; K198-T348 PolarHBondContact O-OG1 3.43Å; G199-T348 VanDerWaalsContact CA-OG1 3.27Å; G199-T348 WeakPolarHBondContact CA-OG1 3.41Å; T348-S353 WeakPolarHBondContact OG1-CB 3.19Å
349	T	92.9	Very high	93.5	Very high	8 Å²	8	25.4 Å²	25.4	5%	0.049	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-104.6	174.5	169.8	71.1	0	0	0	0	109.8	P171 E175 K351 G352	P171-T349 HydrophobicContact CB-CG2 3.91Å; P171-T349 HydrophobicContact CG-CG2 3.82Å; E175-T349 CarbonylContact O-C 2.92Å; E175-T349 VanDerWaalsContact O-CA 3.28Å; E175-T349 WeakPolarHBondContact O-CA 3.47Å; T349-K351 PolarHBondContact O-N 3.41Å; T349-K351 VanDerWaalsContact O-N 3.14Å; T349-K351 PolarHBondContact OG1-N 3.37Å; T349-G352 PolarHBondContact N-O 3.39Å; T349-G352 VanDerWaalsContact O-O 3.08Å; T349-G352 PolarHBondContact OG1-O 3.11Å
350	K	90.3	Very high	93.1	Very high	156 Å²	156	25.5 Å²	25.5	68%	0.678	13%	0.131	S	C	*	.	S	Bend	trans	-63.4	-12.1	172	-70.6	170	178.2	170.5	0	114.5	M174 E175	M174-K350 WeakPolarHBondContact O-CE 3.42Å; M174-K350 PolarHBondContact O-NZ 3.45Å; E175-K350 PolarHBondContact O-N 2.89Å
351	K	91.2	Very high	92.6	Very high	125 Å²	125	29.7 Å²	29.7	54%	0.543	14%	0.144	S	C	.	.	S	Bend	trans	-97.1	-31.7	-177.4	-63.1	-177.2	-176.4	170.9	0	113.1	D295 G298 T349	D295-K351 WeakPolarHBondContact O-CD 3.35Å; G298-K351 CarbonylContact C-O 3.51Å; G298-K351 WeakPolarHBondContact CA-O 3.49Å; T349-K351 PolarHBondContact O-N 3.41Å; T349-K351 VanDerWaalsContact O-N 3.14Å; T349-K351 PolarHBondContact OG1-N 3.37Å
352	G	90.9	Very high	91.9	Very high	9 Å²	9	27 Å²	27	9%	0.093	13%	0.127	C	C	.	.			trans	-179.4	-178.7	-177	0	0	0	0	0	110.9	T349	T349-G352 PolarHBondContact N-O 3.39Å; T349-G352 VanDerWaalsContact O-O 3.08Å; T349-G352 PolarHBondContact OG1-O 3.11Å
353	S	92.1	Very high	91	Very high	1 Å²	1	28 Å²	28	1%	0.007	13%	0.134	C	C	.	.			trans	-124.9	148	-179.3	70.2	0	0	0	0	112.7	Q299 D300 V301 T348	Q299-S353 PolarHBondContact O-N 3.16Å; D300-S353 WeakPolarHBondContact CA-O 3.35Å; D300-S353 WeakPolarHBondContact OD1-CB 3.27Å; D300-S353 PolarHBondContact OD1-N 2.85Å; D300-S353 PolarHBondContact OD1-OG 2.96Å; V301-S353 PolarHBondContact N-O 3.44Å; T348-S353 WeakPolarHBondContact OG1-CB 3.19Å
354	I	94.6	Very high	90.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	106.8	164.8	-63	167.6	0	0	0	107	G199 L287 A290 E291 R294 V301 L303 I346	G199-I354 CarbonylContact C-O 3.49Å; G199-I354 VanDerWaalsContact CA-O 3.29Å; G199-I354 WeakPolarHBondContact CA-O 3.36Å; L287-I354 HydrophobicContact CD1-CD1 4.41Å; A290-I354 HydrophobicContact CB-CD1 4.12Å; A290-I354 HydrophobicContact CB-CG1 4.44Å; A290-I354 HydrophobicContact CB-CG2 4.48Å; E291-I354 HydrophobicContact CG-CD1 3.99Å; R294-I354 HydrophobicContact CB-CD1 4.09Å; R294-I354 HydrophobicContact CB-CG1 3.91Å; R294-I354 HydrophobicContact CG-CG1 4.21Å; V301-I354 HydrophobicContact CB-CG1 4.32Å; V301-I354 CarbonylContact O-C 3.55Å; V301-I354 WeakPolarHBondContact O-CA 3.16Å; L303-I354 HydrophobicContact CB-CG2 3.68Å; L303-I354 HydrophobicContact CD2-CG2 4.23Å; I346-I354 HydrophobicContact CG2-CB 4.45Å; I346-I354 HydrophobicContact CG2-CG2 3.94Å
355	T	93.7	Very high	89.1	Confident	4 Å²	4	35.9 Å²	35.9	3%	0.025	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	118.9	170.7	-47.1	0	0	0	0	107.7	L183 G199 I202 V301 L302 L303	L183-T355 HydrophobicContact CD2-CG2 3.79Å; G199-T355 WeakPolarHBondContact CA-OG1 3.29Å; G199-T355 PolarHBondContact N-OG1 3.48Å; I202-T355 HydrophobicContact CD1-CG2 3.46Å; I202-T355 VanDerWaalsContact CD1-CG2 3.46Å; V301-T355 PolarHBondContact O-N 3.37Å; L302-T355 WeakPolarHBondContact CA-O 3.46Å; L302-T355 HydrophobicContact CD2-CG2 4.28Å; L303-T355 PolarHBondContact N-O 3.26Å
356	S	95	Very high	88.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	136.8	-178.1	70.5	0	0	0	0	112.7	G200 I202 L303 I346 Q358	G200-S356 PolarHBondContact O-N 3.01Å; I202-S356 WeakPolarHBondContact CB-O 3.27Å; I202-S356 WeakPolarHBondContact CD1-O 3.24Å; I202-S356 PolarHBondContact N-O 2.92Å; L303-S356 CarbonylContact O-C 3.53Å; L303-S356 WeakPolarHBondContact O-CA 3.41Å; I346-S356 WeakPolarHBondContact CG2-OG 3.41Å; S356-Q358 PolarHBondContact OG-NE2 2.69Å
357	V	94.1	Very high	87.4	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	109.2	174	-177.3	0	0	0	0	107.4	I202 L204 L219 L303 F304 I305	I202-V357 HydrophobicContact CB-CG2 4.36Å; I202-V357 HydrophobicContact CD1-CG2 4.32Å; L204-V357 HydrophobicContact CD1-CG1 3.35Å; L204-V357 HydrophobicContact CD2-CG1 4.17Å; L204-V357 HydrophobicContact CG-CG1 3.52Å; L219-V357 HydrophobicContact CD1-CG1 4.2Å; L219-V357 HydrophobicContact CD1-CG2 4.38Å; L303-V357 PolarHBondContact O-N 2.94Å; F304-V357 VanDerWaalsContact CA-O 3.32Å; F304-V357 WeakPolarHBondContact CA-O 3.29Å; F304-V357 HydrophobicContact CD1-CB 3.66Å; F304-V357 HydrophobicContact CD1-CG1 4.11Å; F304-V357 HydrophobicContact CD1-CG2 4.35Å; F304-V357 HydrophobicContact CE1-CB 3.69Å; F304-V357 HydrophobicContact CE1-CG1 4.08Å; F304-V357 HydrophobicContact CE1-CG2 3.91Å; I305-V357 PolarHBondContact N-O 3.49Å
358	Q	94	Very high	87.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.8	-168	-52.4	-178.3	16.7	0	0	109.1	I202 G203 L204 I305 I308 S356 I360	I202-Q358 PolarHBondContact O-N 3.14Å; G203-Q358 CarbonylContact C-O 3.34Å; G203-Q358 WeakPolarHBondContact CA-O 3.42Å; L204-Q358 PolarHBondContact N-O 3.31Å; I305-Q358 HydrophobicContact CB-CB 4.45Å; I305-Q358 HydrophobicContact CB-CG 4.21Å; I305-Q358 HydrophobicContact CD1-CG 4.26Å; I305-Q358 HydrophobicContact CG1-CG 4.39Å; I305-Q358 CarbonylContact O-C 3.45Å; I305-Q358 WeakPolarHBondContact O-CA 3.5Å; I308-Q358 HydrophobicContact CB-CB 4.49Å; I308-Q358 HydrophobicContact CG2-CB 4.33Å; S356-Q358 PolarHBondContact OG-NE2 2.69Å; Q358-I360 PolarHBondContact O-N 3.21Å
359	A	89.6	Confident	86.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.6	170.1	0	0	0	0	0	108.9	L204 I305 D306 N307 I308	L204-A359 WeakPolarHBondContact O-CA 3.39Å; I305-A359 PolarHBondContact O-N 3.35Å; D306-A359 HydrophobicContact CB-CB 4.21Å; D306-A359 WeakPolarHBondContact OD1-CB 3.4Å; N307-A359 PolarHBondContact ND2-O 3.47Å; N307-A359 PolarHBondContact OD1-O 2.72Å; I308-A359 PolarHBondContact N-O 2.79Å; I308-A359 VanDerWaalsContact N-O 3.08Å
360	I	87.5	Confident	86.8	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.4	-178.7	-62.8	162.2	0	0	0	108.4	L204 F205 I308 Q358 T375 L379	L204-I360 PolarHBondContact O-N 3.38Å; F205-I360 HydrophobicContact CD1-CB 4Å; F205-I360 HydrophobicContact CD1-CG2 4.09Å; F205-I360 HydrophobicContact CE1-CB 3.64Å; F205-I360 HydrophobicContact CE1-CD1 3.8Å; F205-I360 HydrophobicContact CE1-CG1 4.32Å; F205-I360 HydrophobicContact CE1-CG2 3.51Å; F205-I360 HydrophobicContact CE2-CD1 3.99Å; F205-I360 HydrophobicContact CZ-CB 4.08Å; F205-I360 HydrophobicContact CZ-CD1 3.33Å; F205-I360 HydrophobicContact CZ-CG1 4.28Å; F205-I360 HydrophobicContact CZ-CG2 4.23Å; I308-I360 HydrophobicContact CG2-CB 4.42Å; I308-I360 HydrophobicContact CG2-CD1 4.46Å; I308-I360 HydrophobicContact CG2-CG1 3.48Å; I308-I360 VanDerWaalsContact CG2-CG1 3.48Å; Q358-I360 PolarHBondContact O-N 3.21Å; I360-T375 HydrophobicContact CD1-CG2 3.71Å; I360-T375 HydrophobicContact CG1-CG2 4.21Å; I360-L379 HydrophobicContact CD1-CD1 3.62Å; I360-L379 HydrophobicContact CD1-CD2 4.44Å
361	Y	83.6	Confident	86.7	Confident	101 Å²	101	41.1 Å²	41.1	40%	0.396	23%	0.23	S	C	.	.			trans	-83.3	123.8	167.6	177.6	-106.2	0	0	0	109.3	N307 F309 P363	N307-Y361 PolarHBondContact ND2-N 3.45Å; N307-Y361 PolarHBondContact OD1-N 2.99Å; N307-Y361 VanDerWaalsContact OD1-N 3.07Å; F309-Y361 AromaticContact CD1-CD1 3.63Å; F309-Y361 HydrophobicContact CD1-CD1 3.63Å; F309-Y361 HydrophobicContact CD1-CG 4.41Å; F309-Y361 AromaticContact CE1-CD1 3.83Å; F309-Y361 HydrophobicContact CE1-CD1 3.83Å; F309-Y361 HydrophobicContact CE1-CE1 4.33Å; F309-Y361 HydrophobicContact CG-CD1 4.13Å; Y361-P363 HydrophobicContact CD1-CG 4.35Å; Y361-P363 HydrophobicContact CE1-CB 4.31Å; Y361-P363 HydrophobicContact CE1-CG 4.31Å; Y361-P363 WeakPolarHBondContact O-CD 3.49Å
362	V	80.1	Confident	86.5	Confident	17 Å²	17	35.2 Å²	35.2	10%	0.103	20%	0.204	C	C	.	.			trans	-95	112.6	173.8	-175.5	0	0	0	0	107.7	F205 A364 D365 D366 L367	F205-V362 HydrophobicContact CD1-CG2 3.8Å; F205-V362 HydrophobicContact CE1-CG2 4.2Å; V362-A364 PolarHBondContact O-N 3.23Å; V362-D365 PolarHBondContact O-N 3.5Å; V362-D366 VanDerWaalsContact CG1-C 3.46Å; V362-D366 WeakPolarHBondContact CG1-O 3.24Å; V362-L367 HydrophobicContact CG1-CD2 3.94Å; V362-L367 HydrophobicContact CG2-CD2 3.89Å
363	P	76.8	Confident	86.3	Confident	24 Å²	24	36.9 Å²	36.9	16%	0.156	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-62.9	127.8	179.7	-21.8	34.7	0	0	0	110.9	F309 Y361 D365 D366	F309-P363 HydrophobicContact CD2-CG 4.02Å; F309-P363 HydrophobicContact CE1-CG 4.26Å; F309-P363 HydrophobicContact CE2-CG 3.26Å; F309-P363 HydrophobicContact CZ-CB 4.48Å; F309-P363 HydrophobicContact CZ-CG 3.41Å; F309-P363 VanDerWaalsContact CZ-CG 3.41Å; Y361-P363 HydrophobicContact CD1-CG 4.35Å; Y361-P363 HydrophobicContact CE1-CB 4.31Å; Y361-P363 HydrophobicContact CE1-CG 4.31Å; Y361-P363 WeakPolarHBondContact O-CD 3.49Å; P363-D365 PolarHBondContact O-N 2.87Å; P363-D366 PolarHBondContact O-N 3.23Å
364	A	77.8	Confident	86.3	Confident	93 Å²	93	38.4 Å²	38.4	77%	0.769	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	51.7	27.1	178.4	0	0	0	0	0	114.7	V362 D366	V362-A364 PolarHBondContact O-N 3.23Å; A364-D366 PolarHBondContact O-N 3.04Å
365	D	72.6	Confident	86	Confident	148 Å²	148	38.6 Å²	38.6	79%	0.791	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	56.5	22.9	-174.9	-56.1	-44.8	0	0	0	114.2	V362 P363	V362-D365 PolarHBondContact O-N 3.5Å; P363-D365 PolarHBondContact O-N 2.87Å
366	D	77.4	Confident	85.7	Confident	72 Å²	72	41.5 Å²	41.5	39%	0.385	24%	0.24	S	C	.	.			trans	-93.2	101.1	176.9	-173.7	3	0	0	0	111.9	V362 P363 A364 T368 D369	V362-D366 VanDerWaalsContact CG1-C 3.46Å; V362-D366 WeakPolarHBondContact CG1-O 3.24Å; P363-D366 PolarHBondContact O-N 3.23Å; A364-D366 PolarHBondContact O-N 3.04Å; D366-T368 PolarHBondContact O-N 2.83Å; D366-T368 WeakPolarHBondContact OD1-CA 3.43Å; D366-T368 WeakPolarHBondContact OD1-CB 3.26Å; D366-T368 PolarHBondContact OD1-N 2.92Å; D366-T368 PolarHBondContact OD1-OG1 2.92Å; D366-T368 PolarHBondContact OD2-OG1 2.57Å; D366-D369 WeakPolarHBondContact O-CB 3.29Å; D366-D369 PolarHBondContact O-N 2.99Å
367	L	76.9	Confident	85.4	Confident	99 Å²	99	45.1 Å²	45.1	52%	0.518	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.6	175.9	-63.8	176.6	0	0	0	113.5	V362 F376	V362-L367 HydrophobicContact CG1-CD2 3.94Å; V362-L367 HydrophobicContact CG2-CD2 3.89Å; L367-F376 HydrophobicContact CD2-CE2 3.96Å; L367-F376 HydrophobicContact CD2-CZ 3.81Å
368	T	85.4	Confident	85.4	Confident	114 Å²	114	46.8 Å²	46.8	70%	0.699	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-5.8	179	75.2	0	0	0	0	113.2	D366	D366-T368 PolarHBondContact O-N 2.83Å; D366-T368 WeakPolarHBondContact OD1-CA 3.43Å; D366-T368 WeakPolarHBondContact OD1-CB 3.26Å; D366-T368 PolarHBondContact OD1-N 2.92Å; D366-T368 PolarHBondContact OD1-OG1 2.92Å; D366-T368 PolarHBondContact OD2-OG1 2.57Å
369	D	88.4	Confident	85.3	Confident	15 Å²	15	47.2 Å²	47.2	8%	0.08	28%	0.28	C	S	.	.	S	Bend	trans	-56.8	138.1	172.3	-178.6	-75.9	0	0	0	110.4	Y331 D366 A371 P372 A373	Y331-D369 WeakPolarHBondContact CE2-OD1 3.17Å; Y331-D369 WeakPolarHBondContact CE2-OD2 3.44Å; Y331-D369 VanDerWaalsContact CZ-OD1 3.22Å; Y331-D369 VanDerWaalsContact OH-CG 3.26Å; Y331-D369 PolarHBondContact OH-OD1 3.23Å; Y331-D369 PolarHBondContact OH-OD2 3.5Å; Y331-D369 VanDerWaalsContact OH-OD2 3.06Å; D366-D369 WeakPolarHBondContact O-CB 3.29Å; D366-D369 PolarHBondContact O-N 2.99Å; D369-A371 PolarHBondContact O-N 2.78Å; D369-A371 VanDerWaalsContact O-N 3.15Å; D369-A371 WeakPolarHBondContact OD1-CB 3.47Å; D369-A371 PolarHBondContact OD1-N 2.9Å; D369-P372 HydrophobicContact CB-CG 3.83Å; D369-P372 WeakPolarHBondContact O-CD 3.39Å; D369-P372 VanDerWaalsContact O-CG 3.31Å; D369-P372 WeakPolarHBondContact O-CG 2.87Å; D369-P372 VanDerWaalsContact OD1-CD 3.24Å; D369-P372 WeakPolarHBondContact OD1-CD 2.95Å; D369-A373 WeakPolarHBondContact O-CB 3.38Å; D369-A373 PolarHBondContact O-N 3.19Å
370	P	90.5	Very high	85.4	Confident	31 Å²	31	49.2 Å²	49.2	20%	0.201	29%	0.291	C	S	.	.	H	α-helix	trans	-54.7	-32.4	-178.3	-29.2	35	0	0	0	115.4	A328 V329 Y331 L335 T374	A328-P370 HydrophobicContact CB-CG 4.31Å; V329-P370 HydrophobicContact CG2-CG 4.2Å; Y331-P370 HydrophobicContact CD2-CB 3.9Å; Y331-P370 HydrophobicContact CD2-CG 3.96Å; Y331-P370 HydrophobicContact CE2-CB 4.21Å; Y331-P370 HydrophobicContact CE2-CG 4.2Å; L335-P370 HydrophobicContact CD2-CB 3.83Å; P370-T374 WeakPolarHBondContact O-CB 3.37Å; P370-T374 VanDerWaalsContact O-CG2 3.26Å; P370-T374 WeakPolarHBondContact O-CG2 3.41Å; P370-T374 PolarHBondContact O-N 2.79Å; P370-T374 PolarHBondContact O-OG1 3.39Å
371	A	89	Confident	85.7	Confident	2 Å²	2	49.1 Å²	49.1	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-68.3	-55.2	-178.3	0	0	0	0	0	113.2	F309 T312 Y331 D369 T374 T375	F309-A371 HydrophobicContact CD2-CB 3.81Å; F309-A371 HydrophobicContact CE2-CB 3.72Å; T312-A371 HydrophobicContact CG2-CB 3.73Å; Y331-A371 HydrophobicContact CE1-CB 3.84Å; Y331-A371 HydrophobicContact CE2-CB 4.46Å; D369-A371 PolarHBondContact O-N 2.78Å; D369-A371 VanDerWaalsContact O-N 3.15Å; D369-A371 WeakPolarHBondContact OD1-CB 3.47Å; D369-A371 PolarHBondContact OD1-N 2.9Å; A371-T374 PolarHBondContact O-OG1 2.79Å; A371-T375 WeakPolarHBondContact O-CB 2.97Å; A371-T375 PolarHBondContact O-N 3.04Å; A371-T375 VanDerWaalsContact O-N 3.13Å; A371-T375 PolarHBondContact O-OG1 2.82Å
372	P	86.4	Confident	86.2	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-40.4	172.3	24.9	-32.7	0	0	0	111.7	D369 T374 T375 F376	D369-P372 HydrophobicContact CB-CG 3.83Å; D369-P372 WeakPolarHBondContact O-CD 3.39Å; D369-P372 VanDerWaalsContact O-CG 3.31Å; D369-P372 WeakPolarHBondContact O-CG 2.87Å; D369-P372 VanDerWaalsContact OD1-CD 3.24Å; D369-P372 WeakPolarHBondContact OD1-CD 2.95Å; P372-T374 VanDerWaalsContact C-N 3.35Å; P372-T374 PolarHBondContact O-N 2.79Å; P372-T375 PolarHBondContact O-N 3.3Å; P372-T375 VanDerWaalsContact O-N 3.08Å; P372-F376 VanDerWaalsContact C-CD2 3.48Å; P372-F376 HydrophobicContact CB-CD2 4.35Å; P372-F376 HydrophobicContact CB-CE2 3.9Å; P372-F376 WeakPolarHBondContact O-CD2 3.42Å; P372-F376 WeakPolarHBondContact O-CG 3.42Å; P372-F376 PolarHBondContact O-N 2.9Å
373	A	87.6	Confident	86.9	Confident	45 Å²	45	44.4 Å²	44.4	37%	0.372	27%	0.272	S	S	.	.	H	α-helix	trans	-56.6	-44.3	178.7	0	0	0	0	0	113.2	D369	D369-A373 WeakPolarHBondContact O-CB 3.38Å; D369-A373 PolarHBondContact O-N 3.19Å
374	T	90.5	Very high	87.6	Confident	33 Å²	33	45 Å²	45	20%	0.202	28%	0.275	C	S	.	.	H	α-helix	trans	-69.8	-37.4	175.4	49.1	0	0	0	0	112.2	L335 P370 A371 P372 F376 A377 H378	L335-T374 HydrophobicContact CD2-CG2 4.25Å; L335-T374 HydrophobicContact CG-CG2 4.39Å; P370-T374 WeakPolarHBondContact O-CB 3.37Å; P370-T374 VanDerWaalsContact O-CG2 3.26Å; P370-T374 WeakPolarHBondContact O-CG2 3.41Å; P370-T374 PolarHBondContact O-N 2.79Å; P370-T374 PolarHBondContact O-OG1 3.39Å; A371-T374 PolarHBondContact O-OG1 2.79Å; P372-T374 VanDerWaalsContact C-N 3.35Å; P372-T374 PolarHBondContact O-N 2.79Å; T374-F376 PolarHBondContact O-N 2.97Å; T374-A377 PolarHBondContact O-N 2.82Å; T374-H378 PolarHBondContact O-CD2 2.89Å; T374-H378 VanDerWaalsContact O-CD2 3.31Å
375	T	89.1	Confident	88.2	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-41.6	177.2	-53.6	0	0	0	0	111.2	I308 I360 A371 P372 A377 H378 L379	I308-T375 HydrophobicContact CG2-CG2 4.24Å; I360-T375 HydrophobicContact CD1-CG2 3.71Å; I360-T375 HydrophobicContact CG1-CG2 4.21Å; A371-T375 WeakPolarHBondContact O-CB 2.97Å; A371-T375 PolarHBondContact O-N 3.04Å; A371-T375 VanDerWaalsContact O-N 3.13Å; A371-T375 PolarHBondContact O-OG1 2.82Å; P372-T375 PolarHBondContact O-N 3.3Å; P372-T375 VanDerWaalsContact O-N 3.08Å; T375-A377 PolarHBondContact O-N 2.77Å; T375-H378 PolarHBondContact O-N 2.97Å; T375-L379 HydrophobicContact CG2-CD2 4.47Å
376	F	86.6	Confident	89	Confident	66 Å²	66	35.1 Å²	35.1	29%	0.289	21%	0.212	S	C	.	.	H	α-helix	trans	-56.4	-35.7	-179.6	-79.3	-56.5	0	0	0	113.6	F205 L367 P372 T374 H378 L379 T382	F205-F376 HydrophobicContact CD1-CZ 4.34Å; F205-F376 AromaticContact CE1-CE1 3.53Å; F205-F376 HydrophobicContact CE1-CE1 3.53Å; F205-F376 HydrophobicContact CE1-CE2 4.44Å; F205-F376 AromaticContact CE1-CZ 3.4Å; F205-F376 HydrophobicContact CE1-CZ 3.4Å; F205-F376 AromaticContact CE2-CE1 3.75Å; F205-F376 HydrophobicContact CE2-CE1 3.75Å; F205-F376 HydrophobicContact CE2-CZ 4.41Å; F205-F376 AromaticContact CZ-CD1 3.89Å; F205-F376 HydrophobicContact CZ-CD1 3.89Å; F205-F376 AromaticContact CZ-CE1 3.03Å; F205-F376 HydrophobicContact CZ-CE1 3.03Å; F205-F376 AromaticContact CZ-CZ 3.47Å; F205-F376 HydrophobicContact CZ-CZ 3.47Å; F205-F376 VanDerWaalsContact CZ-CZ 3.47Å; L367-F376 HydrophobicContact CD2-CE2 3.96Å; L367-F376 HydrophobicContact CD2-CZ 3.81Å; P372-F376 VanDerWaalsContact C-CD2 3.48Å; P372-F376 HydrophobicContact CB-CD2 4.35Å; P372-F376 HydrophobicContact CB-CE2 3.9Å; P372-F376 WeakPolarHBondContact O-CD2 3.42Å; P372-F376 WeakPolarHBondContact O-CG 3.42Å; P372-F376 PolarHBondContact O-N 2.9Å; T374-F376 PolarHBondContact O-N 2.97Å; F376-H378 PolarHBondContact O-N 3.15Å; F376-H378 VanDerWaalsContact O-N 3.16Å; F376-L379 HydrophobicContact CD1-CD1 4Å; F376-L379 HydrophobicContact CE1-CD1 4.5Å; F376-L379 PolarHBondContact O-N 3.5Å; F376-L379 VanDerWaalsContact O-N 3.14Å; F376-T382 HydrophobicContact CD1-CG2 4.33Å; F376-T382 HydrophobicContact CE1-CG2 4.27Å
377	A	90.4	Very high	89.5	Confident	76 Å²	76	38.6 Å²	38.6	63%	0.628	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.8	179	0	0	0	0	0	113	T374 T375	T374-A377 PolarHBondContact O-N 2.82Å; T375-A377 PolarHBondContact O-N 2.77Å
378	H	92.6	Very high	90.1	Very high	38 Å²	38	36.8 Å²	36.8	18%	0.176	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-9.6	179.3	-62	-80.1	0	0	0	113.6	K201 Q343 E344 T374 T375 F376	K201-H378 WeakPolarHBondContact CB-O 3.23Å; K201-H378 HydrophobicContact CD-CB 4.28Å; K201-H378 WeakPolarHBondContact CD-O 3.34Å; Q343-H378 HydrophobicContact CB-CB 4.06Å; Q343-H378 HydrophobicContact CG-CB 4.06Å; E344-H378 IonicContact OE1-CE1 3.44Å; E344-H378 IonicContact OE1-ND1 2.68Å; E344-H378 PolarHBondContact OE1-ND1 2.84Å; T374-H378 PolarHBondContact O-CD2 2.89Å; T374-H378 VanDerWaalsContact O-CD2 3.31Å; T375-H378 PolarHBondContact O-N 2.97Å; F376-H378 PolarHBondContact O-N 3.15Å; F376-H378 VanDerWaalsContact O-N 3.16Å
379	L	92.7	Very high	90.5	Very high	10 Å²	10	32.1 Å²	32.1	5%	0.052	19%	0.189	C	C	.	.			trans	-84.4	140.5	-175.7	-58	177.9	0	0	0	112.1	K201 F205 I360 T375 F376 T382 R406	K201-L379 HydrophobicContact CB-CD2 4.18Å; F205-L379 HydrophobicContact CE2-CD1 4.13Å; F205-L379 HydrophobicContact CZ-CD1 3.94Å; I360-L379 HydrophobicContact CD1-CD1 3.62Å; I360-L379 HydrophobicContact CD1-CD2 4.44Å; T375-L379 HydrophobicContact CG2-CD2 4.47Å; F376-L379 HydrophobicContact CD1-CD1 4Å; F376-L379 HydrophobicContact CE1-CD1 4.5Å; F376-L379 PolarHBondContact O-N 3.5Å; F376-L379 VanDerWaalsContact O-N 3.14Å; L379-T382 HydrophobicContact CB-CG2 4.46Å; L379-T382 HydrophobicContact CD1-CG2 4.02Å; L379-R406 PolarHBondContact O-NH2 3.21Å
380	D	92	Very high	90.6	Very high	41 Å²	41	32 Å²	32	22%	0.219	19%	0.19	C	C	.	.	S	Bend	trans	-93.9	-33.2	172.6	-61.5	-61.8	0	0	0	111.9	G200 K201 R406	G200-D380 WeakPolarHBondContact CA-OD2 3.41Å; K201-D380 PolarHBondContact N-OD2 3.08Å; K201-D380 PolarHBondContact O-N 3.14Å; D380-R406 WeakPolarHBondContact O-CB 3.34Å; D380-R406 PolarHBondContact O-N 2.96Å; D380-R406 IonicContact OD1-CZ 2.75Å; D380-R406 IonicContact OD1-NH1 2.79Å; D380-R406 PolarHBondContact OD1-NH1 3Å
381	A	93.8	Very high	90.7	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.017	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.5	175.6	0	0	0	0	0	111.3	Y196 K201 I202 G203 T404	Y196-A381 HydrophobicContact CD1-CB 4.04Å; Y196-A381 HydrophobicContact CE1-CB 4.35Å; K201-A381 PolarHBondContact O-N 2.91Å; I202-A381 WeakPolarHBondContact CA-O 3.5Å; I202-A381 HydrophobicContact CG1-CB 4.25Å; G203-A381 PolarHBondContact N-O 3.4Å; A381-T404 CarbonylContact C-O 3.48Å; A381-T404 WeakPolarHBondContact CA-O 3.42Å
382	T	93.3	Very high	90.8	Very high	19 Å²	19	41.4 Å²	41.4	12%	0.117	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.9	176.7	58.5	0	0	0	0	108.6	F205 F376 L379 S403 T404	F205-T382 HydrophobicContact CE2-CG2 3.87Å; F376-T382 HydrophobicContact CD1-CG2 4.33Å; F376-T382 HydrophobicContact CE1-CG2 4.27Å; L379-T382 HydrophobicContact CB-CG2 4.46Å; L379-T382 HydrophobicContact CD1-CG2 4.02Å; T382-S403 CarbonylContact O-C 3.55Å; T382-S403 WeakPolarHBondContact O-CA 3.41Å; T382-S403 WeakPolarHBondContact O-CB 3.42Å; T382-T404 PolarHBondContact N-O 3.24Å; T382-T404 PolarHBondContact O-N 2.99Å; T382-T404 PolarHBondContact OG1-N 2.94Å; T382-T404 PolarHBondContact OG1-O 3.03Å; T382-T404 PolarHBondContact OG1-OG1 3.13Å
383	T	94.3	Very high	91	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.1	175.7	-54.3	0	0	0	0	107.6	Y196 G203 L204 F205 V398	Y196-T383 WeakPolarHBondContact CE1-OG1 3.48Å; Y196-T383 PolarHBondContact OH-OG1 3.44Å; G203-T383 PolarHBondContact O-N 3.31Å; L204-T383 WeakPolarHBondContact CA-O 3.36Å; L204-T383 HydrophobicContact CD2-CG2 4.16Å; F205-T383 PolarHBondContact N-O 3.08Å; T383-V398 HydrophobicContact CG2-CB 4.38Å; T383-V398 HydrophobicContact CG2-CG1 3.73Å; T383-V398 HydrophobicContact CG2-CG2 3.73Å
384	V	92.3	Very high	91.3	Very high	36 Å²	36	40.4 Å²	40.4	22%	0.218	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.8	-177.2	-176.9	0	0	0	0	108.9	F205 V398 D399 D402 S403	F205-V384 HydrophobicContact CB-CB 4.45Å; F205-V384 HydrophobicContact CB-CG1 4.36Å; F205-V384 HydrophobicContact CB-CG2 4.2Å; F205-V384 HydrophobicContact CD2-CG2 4.29Å; F205-V384 HydrophobicContact CG-CG2 4.49Å; V384-V398 CarbonylContact O-C 3.58Å; V384-V398 WeakPolarHBondContact O-CA 3.33Å; V384-D399 HydrophobicContact CB-CB 4.44Å; V384-D399 PolarHBondContact O-N 3.25Å; V384-D402 HydrophobicContact CB-CB 4.17Å; V384-D402 HydrophobicContact CG1-CB 4.38Å; V384-D402 HydrophobicContact CG2-CB 4.15Å; V384-S403 PolarHBondContact N-OG 3.34Å
385	L	90.8	Very high	91.5	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.037	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.7	174.9	-60.6	174.9	0	0	0	110.4	F205 G206 V210 K212 L215 A397 V398	F205-L385 WeakPolarHBondContact O-CB 3.36Å; F205-L385 PolarHBondContact O-N 2.91Å; G206-L385 WeakPolarHBondContact CA-O 3.39Å; V210-L385 HydrophobicContact CB-CB 4.06Å; V210-L385 HydrophobicContact CG2-CB 3.46Å; V210-L385 VanDerWaalsContact CG2-CB 3.46Å; V210-L385 HydrophobicContact CG2-CD1 3.91Å; V210-L385 HydrophobicContact CG2-CG 4.35Å; K212-L385 HydrophobicContact CB-CD1 4.25Å; K212-L385 HydrophobicContact CG-CD1 3.47Å; K212-L385 VanDerWaalsContact CG-CD1 3.47Å; L215-L385 HydrophobicContact CD2-CD1 4.36Å; L215-L385 HydrophobicContact CD2-CD2 4.16Å; L385-A397 CarbonylContact C-O 3.55Å; L385-A397 WeakPolarHBondContact CA-O 3.27Å; L385-V398 HydrophobicContact CD2-CB 4.29Å; L385-V398 HydrophobicContact CD2-CG2 3.55Å
386	S	88.6	Confident	91.8	Very high	28 Å²	28	43.6 Å²	43.6	20%	0.196	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-100.8	134.4	-174.2	178	0	0	0	0	112	A388 I389 A390 A397	S386-A388 PolarHBondContact OG-N 2.96Å; S386-I389 PolarHBondContact O-N 3.14Å; S386-A390 PolarHBondContact O-N 3.49Å; S386-A397 PolarHBondContact N-O 3.39Å
387	R	89.1	Confident	92.2	Very high	145 Å²	145	40.5 Å²	40.5	55%	0.547	22%	0.223	S	C	.	.	H	α-helix	trans	-65.1	-39.9	174.3	-178.7	176.3	-65.9	-151.7	-4.2	112	A208 V210 I389 A390 E391	A208-R387 PolarHBondContact O-NH2 3.17Å; V210-R387 HydrophobicContact CG1-CB 4.2Å; R387-I389 PolarHBondContact O-N 3.34Å; R387-A390 WeakPolarHBondContact O-CB 3.49Å; R387-A390 PolarHBondContact O-N 3Å; R387-A390 VanDerWaalsContact O-N 3.11Å; R387-E391 WeakPolarHBondContact CD-OE1 3.5Å; R387-E391 HydrophobicContact CG-CG 4.25Å; R387-E391 WeakPolarHBondContact CG-OE1 3.46Å; R387-E391 WeakPolarHBondContact O-CG 3.42Å; R387-E391 PolarHBondContact O-N 3.47Å
388	A	89.9	Confident	92.5	Very high	60 Å²	60	37.1 Å²	37.1	50%	0.496	20%	0.195	S	C	.	.	H	α-helix	trans	-60.7	-36	-179.7	0	0	0	0	0	111.5	S386 L392	S386-A388 PolarHBondContact OG-N 2.96Å; A388-L392 WeakPolarHBondContact O-CG 2.97Å; A388-L392 PolarHBondContact O-N 3.18Å
389	I	92.4	Very high	92.6	Very high	16 Å²	16	36.2 Å²	36.2	8%	0.082	19%	0.191	C	C	.	.	H	α-helix	trans	-71.3	-41.5	175.9	-62.8	179.6	0	0	0	111	S386 R387 E391 L392 I394 A397 V398 D399	S386-I389 PolarHBondContact O-N 3.14Å; R387-I389 PolarHBondContact O-N 3.34Å; I389-E391 VanDerWaalsContact C-N 3.34Å; I389-E391 PolarHBondContact O-N 3.44Å; I389-L392 WeakPolarHBondContact O-CB 3Å; I389-L392 PolarHBondContact O-N 3.16Å; I389-I394 HydrophobicContact CG2-CB 3.73Å; I389-I394 HydrophobicContact CG2-CG2 3.82Å; I389-I394 PolarHBondContact O-N 2.95Å; I389-A397 HydrophobicContact CG2-CB 4.39Å; I389-V398 WeakPolarHBondContact CD1-O 3.5Å; I389-D399 HydrophobicContact CD1-CB 4.05Å
390	A	91	Very high	92.7	Very high	12 Å²	12	36.3 Å²	36.3	10%	0.099	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-39.5	176.1	0	0	0	0	0	112.4	S386 R387 L392 G393 Y395 A397	S386-A390 PolarHBondContact O-N 3.49Å; R387-A390 WeakPolarHBondContact O-CB 3.49Å; R387-A390 PolarHBondContact O-N 3Å; R387-A390 VanDerWaalsContact O-N 3.11Å; A390-L392 PolarHBondContact O-N 3.43Å; A390-G393 WeakPolarHBondContact O-CA 3.34Å; A390-G393 PolarHBondContact O-N 3.24Å; A390-Y395 HydrophobicContact CB-CE1 4.36Å; A390-A397 HydrophobicContact CB-CB 3.79Å
391	E	91.7	Very high	92.8	Very high	149 Å²	149	36.2 Å²	36.2	70%	0.696	19%	0.191	S	C	*	.	H	α-helix	trans	-64.2	-25.5	177	-73.9	172.5	-178.3	0	0	112.9	R387 I389 G393	R387-E391 WeakPolarHBondContact CD-OE1 3.5Å; R387-E391 HydrophobicContact CG-CG 4.25Å; R387-E391 WeakPolarHBondContact CG-OE1 3.46Å; R387-E391 WeakPolarHBondContact O-CG 3.42Å; R387-E391 PolarHBondContact O-N 3.47Å; I389-E391 VanDerWaalsContact C-N 3.34Å; I389-E391 PolarHBondContact O-N 3.44Å; E391-G393 PolarHBondContact O-N 3.39Å
392	L	91.6	Very high	92.7	Very high	83 Å²	83	40.5 Å²	40.5	44%	0.435	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.5	170.7	-62.7	173	0	0	0	113.1	A388 I389 A390 I394 R462	A388-L392 WeakPolarHBondContact O-CG 2.97Å; A388-L392 PolarHBondContact O-N 3.18Å; I389-L392 WeakPolarHBondContact O-CB 3Å; I389-L392 PolarHBondContact O-N 3.16Å; A390-L392 PolarHBondContact O-N 3.43Å; L392-I394 VanDerWaalsContact C-N 3.31Å; L392-I394 HydrophobicContact CB-CD1 4.2Å; L392-I394 HydrophobicContact CB-CG1 4.16Å; L392-I394 HydrophobicContact CD1-CD1 4.47Å; L392-R462 PolarHBondContact O-NH1 3.22Å
393	G	91.8	Very high	92.7	Very high	21 Å²	21	39.6 Å²	39.6	22%	0.216	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	16.5	-176.8	0	0	0	0	0	114.1	A390 E391 Y508	A390-G393 WeakPolarHBondContact O-CA 3.34Å; A390-G393 PolarHBondContact O-N 3.24Å; E391-G393 PolarHBondContact O-N 3.39Å; G393-Y508 VanDerWaalsContact O-CE2 3.26Å; G393-Y508 WeakPolarHBondContact O-CE2 3.43Å; G393-Y508 PolarHBondContact O-OH 2.91Å
394	I	94.1	Very high	92.7	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	23%	0.232	C	C	.	.			trans	-89.3	115.3	-179.4	-60.2	178.4	0	0	0	108.6	I389 L392 Q461	I389-I394 HydrophobicContact CG2-CB 3.73Å; I389-I394 HydrophobicContact CG2-CG2 3.82Å; I389-I394 PolarHBondContact O-N 2.95Å; L392-I394 VanDerWaalsContact C-N 3.31Å; L392-I394 HydrophobicContact CB-CD1 4.2Å; L392-I394 HydrophobicContact CB-CG1 4.16Å; L392-I394 HydrophobicContact CD1-CD1 4.47Å; I394-Q461 HydrophobicContact CD1-CG 3.69Å
395	Y	94.1	Very high	92.9	Very high	95 Å²	95	42.4 Å²	42.4	37%	0.373	23%	0.227	S	C	.	.	S	Bend	trans	-124.9	136.3	176	-71.4	-83.2	0	0	0	110.5	A390 S465 Q466	A390-Y395 HydrophobicContact CB-CE1 4.36Å; Y395-S465 CarbonylContact O-C 3.26Å; Y395-S465 VanDerWaalsContact O-CA 3.26Å; Y395-S465 WeakPolarHBondContact O-CA 3.23Å; Y395-S465 WeakPolarHBondContact O-CB 3.44Å; Y395-Q466 PolarHBondContact O-N 2.92Å
396	P	95.5	Very high	92.9	Very high	7 Å²	7	49 Å²	49	5%	0.045	25%	0.251	C	S	.	.	S	Bend	cis	-68.1	147.1	-2.4	32.1	-37.7	0	0	0	112.4	I187 V189 L215 V398 F468	I187-P396 HydrophobicContact CG2-CG 4.04Å; V189-P396 HydrophobicContact CG1-CG 3.74Å; L215-P396 HydrophobicContact CD1-CB 4.3Å; P396-V398 HydrophobicContact CB-CG2 4.14Å; P396-V398 HydrophobicContact CG-CG2 4.28Å; P396-V398 PolarHBondContact O-N 3Å; P396-F468 HydrophobicContact CB-CE2 3.94Å; P396-F468 HydrophobicContact CB-CZ 3.61Å; P396-F468 HydrophobicContact CG-CE1 4.14Å; P396-F468 HydrophobicContact CG-CE2 4.4Å; P396-F468 HydrophobicContact CG-CZ 3.58Å
397	A	94.6	Very high	93.1	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	24%	0.243	C	C	.	.			trans	-80.4	39.6	-172.7	0	0	0	0	0	113.5	L385 S386 I389 A390	L385-A397 CarbonylContact C-O 3.55Å; L385-A397 WeakPolarHBondContact CA-O 3.27Å; S386-A397 PolarHBondContact N-O 3.39Å; I389-A397 HydrophobicContact CG2-CB 4.39Å; A390-A397 HydrophobicContact CB-CB 3.79Å
398	V	95.7	Very high	93.4	Very high	6 Å²	6	41.8 Å²	41.8	4%	0.036	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-74.5	129.7	-177.5	179.6	0	0	0	0	110	V189 T383 V384 L385 I389 P396 P400 S403	V189-V398 HydrophobicContact CB-CB 4.45Å; V189-V398 HydrophobicContact CG1-CB 3.8Å; V189-V398 HydrophobicContact CG1-CG1 4.3Å; V189-V398 HydrophobicContact CG1-CG2 3.76Å; V189-V398 HydrophobicContact CG2-CB 3.76Å; V189-V398 HydrophobicContact CG2-CG1 3.67Å; T383-V398 HydrophobicContact CG2-CB 4.38Å; T383-V398 HydrophobicContact CG2-CG1 3.73Å; T383-V398 HydrophobicContact CG2-CG2 3.73Å; V384-V398 CarbonylContact O-C 3.58Å; V384-V398 WeakPolarHBondContact O-CA 3.33Å; L385-V398 HydrophobicContact CD2-CB 4.29Å; L385-V398 HydrophobicContact CD2-CG2 3.55Å; I389-V398 WeakPolarHBondContact CD1-O 3.5Å; P396-V398 HydrophobicContact CB-CG2 4.14Å; P396-V398 HydrophobicContact CG-CG2 4.28Å; P396-V398 PolarHBondContact O-N 3Å; V398-P400 WeakPolarHBondContact O-CD 3.27Å; V398-S403 WeakPolarHBondContact CG1-OG 3.04Å
399	D	94.8	Very high	93.6	Very high	18 Å²	18	41.7 Å²	41.7	10%	0.096	21%	0.212	C	C	.	.			trans	-76.4	114.7	172.1	-162.9	-55	0	0	0	110.1	V384 I389 L401 D402 S403	V384-D399 HydrophobicContact CB-CB 4.44Å; V384-D399 PolarHBondContact O-N 3.25Å; I389-D399 HydrophobicContact CD1-CB 4.05Å; D399-L401 PolarHBondContact O-N 2.69Å; D399-L401 PolarHBondContact OD1-N 3.45Å; D399-D402 HydrophobicContact CB-CB 4.13Å; D399-D402 PolarHBondContact OD1-N 3Å; D399-D402 VanDerWaalsContact OD1-N 3.13Å; D399-S403 WeakPolarHBondContact O-CB 3.38Å; D399-S403 PolarHBondContact O-N 3.06Å; D399-S403 PolarHBondContact O-OG 3.43Å
400	P	94.8	Very high	93.7	Very high	13 Å²	13	43.5 Å²	43.5	8%	0.084	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.5	-175.3	29.6	-34.6	0	0	0	113.9	L193 V398 Q425 L428 L464	L193-P400 HydrophobicContact CD1-CB 3.28Å; V398-P400 WeakPolarHBondContact O-CD 3.27Å; P400-Q425 PolarHBondContact O-NE2 2.89Å; P400-L428 HydrophobicContact CB-CD1 3.72Å; P400-L428 HydrophobicContact CG-CD1 3.64Å; P400-L464 HydrophobicContact CB-CD1 4.05Å; P400-L464 HydrophobicContact CG-CD1 4.29Å
401	L	94.5	Very high	93.8	Very high	38 Å²	38	49.9 Å²	49.9	20%	0.199	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-38	-177.7	-61.2	176.2	0	0	0	111.7	D399 Q425 L428 Q429 K432	D399-L401 PolarHBondContact O-N 2.69Å; D399-L401 PolarHBondContact OD1-N 3.45Å; L401-Q425 HydrophobicContact CD2-CB 4.4Å; L401-L428 HydrophobicContact CD2-CB 4.18Å; L401-Q429 HydrophobicContact CD2-CB 4.28Å; L401-K432 HydrophobicContact CD1-CD 3.98Å
402	D	91.6	Very high	93.8	Very high	92 Å²	92	45.4 Å²	45.4	49%	0.492	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-19.2	-179.3	-67.7	-14.3	0	0	0	113	V384 D399	V384-D402 HydrophobicContact CB-CB 4.17Å; V384-D402 HydrophobicContact CG1-CB 4.38Å; V384-D402 HydrophobicContact CG2-CB 4.15Å; D399-D402 HydrophobicContact CB-CB 4.13Å; D399-D402 PolarHBondContact OD1-N 3Å; D399-D402 VanDerWaalsContact OD1-N 3.13Å
403	S	94.1	Very high	93.9	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	22%	0.224	C	C	.	.			trans	-79.2	134.5	175.2	-56.9	0	0	0	0	111.3	T382 V384 V398 D399	T382-S403 CarbonylContact O-C 3.55Å; T382-S403 WeakPolarHBondContact O-CA 3.41Å; T382-S403 WeakPolarHBondContact O-CB 3.42Å; V384-S403 PolarHBondContact N-OG 3.34Å; V398-S403 WeakPolarHBondContact CG1-OG 3.04Å; D399-S403 WeakPolarHBondContact O-CB 3.38Å; D399-S403 PolarHBondContact O-N 3.06Å; D399-S403 PolarHBondContact O-OG 3.43Å
404	T	94.4	Very high	94.1	Very high	79 Å²	79	43.1 Å²	43.1	49%	0.485	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.5	-175.4	63.8	0	0	0	0	112.1	A381 T382	A381-T404 CarbonylContact C-O 3.48Å; A381-T404 WeakPolarHBondContact CA-O 3.42Å; T382-T404 PolarHBondContact N-O 3.24Å; T382-T404 PolarHBondContact O-N 2.99Å; T382-T404 PolarHBondContact OG1-N 2.94Å; T382-T404 PolarHBondContact OG1-O 3.03Å; T382-T404 PolarHBondContact OG1-OG1 3.13Å
405	S	94.9	Very high	94.2	Very high	16 Å²	16	46.7 Å²	46.7	11%	0.112	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	140.1	173.8	177.5	0	0	0	0	110.7	P195 I407 M408	P195-S405 VanDerWaalsContact O-CB 3.31Å; P195-S405 WeakPolarHBondContact O-CB 3.41Å; P195-S405 PolarHBondContact O-OG 3.01Å; S405-I407 VanDerWaalsContact C-N 3.25Å; S405-I407 PolarHBondContact O-N 2.99Å; S405-I407 VanDerWaalsContact OG-CG1 3.23Å; S405-I407 WeakPolarHBondContact OG-CG1 3.36Å; S405-I407 PolarHBondContact OG-N 2.74Å; S405-M408 WeakPolarHBondContact O-CB 3.28Å; S405-M408 PolarHBondContact O-N 3.16Å
406	R	92.2	Very high	94.3	Very high	144 Å²	144	47.4 Å²	47.4	54%	0.543	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-30.3	175.8	-172.6	-179.2	-66.3	151.6	2	112.2	L379 D380 M408	L379-R406 PolarHBondContact O-NH2 3.21Å; D380-R406 WeakPolarHBondContact O-CB 3.34Å; D380-R406 PolarHBondContact O-N 2.96Å; D380-R406 IonicContact OD1-CZ 2.75Å; D380-R406 IonicContact OD1-NH1 2.79Å; D380-R406 PolarHBondContact OD1-NH1 3Å; R406-M408 PolarHBondContact O-N 3.42Å
407	I	93.3	Very high	94.4	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.5	-179.3	63.6	154.7	0	0	0	113.3	I182 P195 Y196 A197 S405 D409 I412 V413	I182-I407 HydrophobicContact CB-CD1 4.28Å; I182-I407 HydrophobicContact CG1-CD1 4.21Å; P195-I407 HydrophobicContact CB-CD1 3.96Å; P195-I407 HydrophobicContact CB-CG1 4.38Å; P195-I407 HydrophobicContact CG-CD1 4.14Å; P195-I407 HydrophobicContact CG-CG1 4.06Å; P195-I407 WeakPolarHBondContact O-CG1 3.3Å; Y196-I407 WeakPolarHBondContact O-CD1 3.44Å; A197-I407 HydrophobicContact CB-CD1 4.21Å; A197-I407 HydrophobicContact CB-CG1 4.49Å; A197-I407 HydrophobicContact CB-CG2 3.82Å; S405-I407 VanDerWaalsContact C-N 3.25Å; S405-I407 PolarHBondContact O-N 2.99Å; S405-I407 VanDerWaalsContact OG-CG1 3.23Å; S405-I407 WeakPolarHBondContact OG-CG1 3.36Å; S405-I407 PolarHBondContact OG-N 2.74Å; I407-D409 PolarHBondContact O-N 2.82Å; I407-I412 HydrophobicContact CB-CD1 4.24Å; I407-I412 HydrophobicContact CB-CG2 4.17Å; I407-I412 HydrophobicContact CG2-CD1 4.21Å; I407-V413 VanDerWaalsContact O-CG1 3.32Å; I407-V413 WeakPolarHBondContact O-CG1 3.44Å
408	M	94.6	Very high	94.6	Very high	17 Å²	17	50 Å²	50	8%	0.084	27%	0.27	C	S	.	.			trans	-73.2	64.7	169	-171.8	52.3	69.6	0	0	110.3	L192 P195 S405 R406 V413 Y418 A421	L192-M408 WeakPolarHBondContact O-CE 3.34Å; P195-M408 HydrophobicContact CG-CE 3.6Å; S405-M408 WeakPolarHBondContact O-CB 3.28Å; S405-M408 PolarHBondContact O-N 3.16Å; R406-M408 PolarHBondContact O-N 3.42Å; M408-V413 HydrophobicContact SD-CG2 4.2Å; M408-Y418 HydrophobicContact CG-CD2 4.18Å; M408-Y418 HydrophobicContact CG-CE2 4.28Å; M408-Y418 WeakPolarHBondContact O-CE2 3.37Å; M408-Y418 HydrophobicContact SD-CD2 3.94Å; M408-A421 HydrophobicContact CE-CB 3.96Å; M408-A421 HydrophobicContact SD-CB 3.98Å
409	D	93.7	Very high	94.7	Very high	59 Å²	59	54.7 Å²	54.7	32%	0.316	30%	0.295	S	S	.	.	S	Bend	trans	-129.2	131.4	-179.4	-173.7	-50.5	0	0	0	108.2	I407 N411 I412 V413	I407-D409 PolarHBondContact O-N 2.82Å; D409-N411 PolarHBondContact O-N 3.39Å; D409-N411 VanDerWaalsContact OD1-CB 3.3Å; D409-N411 WeakPolarHBondContact OD1-CB 3.13Å; D409-N411 PolarHBondContact OD1-N 3.27Å; D409-N411 PolarHBondContact OD1-ND2 2.87Å; D409-I412 HydrophobicContact CB-CD1 4.13Å; D409-I412 HydrophobicContact CB-CG1 4.33Å; D409-I412 PolarHBondContact O-N 3.32Å; D409-V413 VanDerWaalsContact O-CG2 3.29Å; D409-V413 WeakPolarHBondContact O-CG2 3.4Å; D409-V413 PolarHBondContact O-N 2.58Å
410	P	94.8	Very high	94.8	Very high	54 Å²	54	54.2 Å²	54.2	35%	0.351	29%	0.293	S	S	.	.	H	α-helix	trans	-58.5	-21.2	-178.9	25.7	-36.6	0	0	0	114	I412 G414 Y418	P410-I412 VanDerWaalsContact C-N 3.33Å; P410-G414 CarbonylContact O-C 3.43Å; P410-G414 WeakPolarHBondContact O-CA 3.43Å; P410-G414 PolarHBondContact O-N 3.44Å; P410-Y418 HydrophobicContact CB-CD1 4.33Å; P410-Y418 HydrophobicContact CB-CG 4.12Å; P410-Y418 HydrophobicContact CG-CG 4.47Å
411	N	92.9	Very high	94.9	Very high	146 Å²	146	53.6 Å²	53.6	78%	0.781	29%	0.289	S	S	*	.	H	α-helix	trans	-76.5	-19	176.1	-58.7	-62.5	0	0	0	113.3	D409	D409-N411 PolarHBondContact O-N 3.39Å; D409-N411 VanDerWaalsContact OD1-CB 3.3Å; D409-N411 WeakPolarHBondContact OD1-CB 3.13Å; D409-N411 PolarHBondContact OD1-N 3.27Å; D409-N411 PolarHBondContact OD1-ND2 2.87Å
412	I	92.3	Very high	95.1	Very high	54 Å²	54	56.9 Å²	56.9	28%	0.277	30%	0.299	S	S	.	.	H	α-helix	trans	-105.5	-56.4	-177.7	-56.7	169.9	0	0	0	110.2	I407 D409 P410	I407-I412 HydrophobicContact CB-CD1 4.24Å; I407-I412 HydrophobicContact CB-CG2 4.17Å; I407-I412 HydrophobicContact CG2-CD1 4.21Å; D409-I412 HydrophobicContact CB-CD1 4.13Å; D409-I412 HydrophobicContact CB-CG1 4.33Å; D409-I412 PolarHBondContact O-N 3.32Å; P410-I412 VanDerWaalsContact C-N 3.33Å
413	V	93.8	Very high	95.4	Very high	26 Å²	26	53.6 Å²	53.6	16%	0.158	29%	0.286	C	S	.	.	H	α-helix	trans	-84.1	-12.1	-177.5	-67	0	0	0	0	113.6	I182 P195 I407 M408 D409 H417	I182-V413 HydrophobicContact CD1-CG1 4.47Å; P195-V413 HydrophobicContact CG-CG1 4.29Å; I407-V413 VanDerWaalsContact O-CG1 3.32Å; I407-V413 WeakPolarHBondContact O-CG1 3.44Å; M408-V413 HydrophobicContact SD-CG2 4.2Å; D409-V413 VanDerWaalsContact O-CG2 3.29Å; D409-V413 WeakPolarHBondContact O-CG2 3.4Å; D409-V413 PolarHBondContact O-N 2.58Å; V413-H417 HydrophobicContact CB-CB 4.17Å; V413-H417 HydrophobicContact CG2-CB 4.3Å
414	G	95.3	Very high	95.5	Very high	31 Å²	31	53.5 Å²	53.5	32%	0.32	29%	0.286	S	S	.	.			trans	87.3	156.5	-173.2	0	0	0	0	0	113	P410 E416 Y418	P410-G414 CarbonylContact O-C 3.43Å; P410-G414 WeakPolarHBondContact O-CA 3.43Å; P410-G414 PolarHBondContact O-N 3.44Å; G414-E416 PolarHBondContact O-N 2.93Å; G414-Y418 WeakPolarHBondContact O-CB 3.27Å; G414-Y418 PolarHBondContact O-N 3.33Å; G414-Y418 VanDerWaalsContact O-N 3.15Å
415	S	96.3	Very high	95.7	Very high	78 Å²	78	51.1 Å²	51.1	55%	0.545	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-39.8	-175.8	59.4	0	0	0	0	113	Y418 D419	S415-Y418 PolarHBondContact O-N 3.16Å; S415-D419 WeakPolarHBondContact O-CB 3.38Å; S415-D419 PolarHBondContact O-N 3.35Å
416	E	96.7	Very high	95.8	Very high	110 Å²	110	57 Å²	57	51%	0.514	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-49.1	-178.2	-174.4	-177.3	172.5	0	0	111.9	G414 V420 I488	G414-E416 PolarHBondContact O-N 2.93Å; E416-V420 VanDerWaalsContact O-CG2 3.27Å; E416-V420 WeakPolarHBondContact O-CG2 3.42Å; E416-V420 PolarHBondContact O-N 3.43Å; E416-V420 VanDerWaalsContact O-N 3.14Å; E416-I488 HydrophobicContact CG-CG2 4.05Å
417	H	97.6	Very high	96	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-48.4	176.2	-171	168.8	0	0	0	110.3	D191 L192 V413 D419 V420 A421 I488	D191-H417 PolarHBondContact O-CE1 3.15Å; D191-H417 PolarHBondContact O-NE2 3.2Å; L192-H417 PolarHBondContact O-NE2 2.98Å; L192-H417 VanDerWaalsContact O-NE2 3.15Å; V413-H417 HydrophobicContact CB-CB 4.17Å; V413-H417 HydrophobicContact CG2-CB 4.3Å; H417-D419 PolarHBondContact O-N 3.28Å; H417-V420 PolarHBondContact O-N 3.14Å; H417-A421 WeakPolarHBondContact O-CB 3.35Å; H417-A421 PolarHBondContact O-N 2.75Å; H417-I488 HydrophobicContact CB-CD1 3.76Å; H417-I488 HydrophobicContact CB-CG1 4.4Å
418	Y	97.8	Very high	96.2	Very high	58 Å²	58	51 Å²	51	23%	0.227	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-48.4	-179.1	-176	-95.7	0	0	0	112.8	M408 P410 G414 S415 V420 A421 R422	M408-Y418 HydrophobicContact CG-CD2 4.18Å; M408-Y418 HydrophobicContact CG-CE2 4.28Å; M408-Y418 WeakPolarHBondContact O-CE2 3.37Å; M408-Y418 HydrophobicContact SD-CD2 3.94Å; P410-Y418 HydrophobicContact CB-CD1 4.33Å; P410-Y418 HydrophobicContact CB-CG 4.12Å; P410-Y418 HydrophobicContact CG-CG 4.47Å; G414-Y418 WeakPolarHBondContact O-CB 3.27Å; G414-Y418 PolarHBondContact O-N 3.33Å; G414-Y418 VanDerWaalsContact O-N 3.15Å; S415-Y418 PolarHBondContact O-N 3.16Å; Y418-V420 PolarHBondContact O-N 3.24Å; Y418-A421 PolarHBondContact O-N 3.4Å; Y418-R422 HydrophobicContact CD1-CG 4.08Å; Y418-R422 HydrophobicContact CE1-CG 3.68Å; Y418-R422 HydrophobicContact CE2-CG 4.17Å; Y418-R422 HydrophobicContact CG-CG 4.49Å; Y418-R422 VanDerWaalsContact CZ-NE 3.35Å; Y418-R422 WeakPolarHBondContact O-CB 3.49Å; Y418-R422 WeakPolarHBondContact O-CG 3.32Å; Y418-R422 PolarHBondContact O-N 3.23Å; Y418-R422 PolarHBondContact OH-NE 2.88Å; Y418-R422 PolarHBondContact OH-NH2 3.15Å
419	D	97.9	Very high	96.3	Very high	103 Å²	103	54.4 Å²	54.4	55%	0.551	29%	0.287	S	S	*	.	H	α-helix	trans	-65.4	-39.9	-177.4	-69.5	-25.6	0	0	0	111.6	S415 H417 G423	S415-D419 WeakPolarHBondContact O-CB 3.38Å; S415-D419 PolarHBondContact O-N 3.35Å; H417-D419 PolarHBondContact O-N 3.28Å; D419-G423 PolarHBondContact O-N 3.39Å
420	V	97.9	Very high	96.4	Very high	9 Å²	9	54.8 Å²	54.8	6%	0.055	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-46.8	175	174.3	0	0	0	0	110.7	L192 E416 H417 Y418 R422 G423 V424 I488 F491 Q492 L495	L192-V420 HydrophobicContact CD1-CG1 4.11Å; E416-V420 VanDerWaalsContact O-CG2 3.27Å; E416-V420 WeakPolarHBondContact O-CG2 3.42Å; E416-V420 PolarHBondContact O-N 3.43Å; E416-V420 VanDerWaalsContact O-N 3.14Å; H417-V420 PolarHBondContact O-N 3.14Å; Y418-V420 PolarHBondContact O-N 3.24Å; V420-R422 PolarHBondContact O-N 3.43Å; V420-G423 PolarHBondContact O-N 3.12Å; V420-V424 WeakPolarHBondContact O-CG2 3.32Å; V420-V424 PolarHBondContact O-N 3.08Å; V420-I488 HydrophobicContact CB-CG2 4.49Å; V420-I488 HydrophobicContact CG2-CG2 4.13Å; V420-F491 HydrophobicContact CG1-CB 3.71Å; V420-Q492 HydrophobicContact CG2-CB 3.83Å; V420-Q492 HydrophobicContact CG2-CG 4.06Å; V420-L495 HydrophobicContact CG1-CD1 4.24Å
421	A	97.4	Very high	96.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-44.1	178.5	0	0	0	0	0	111.9	L192 L193 M408 H417 Y418 V424 Q425	L192-A421 HydrophobicContact CD1-CB 4.36Å; L192-A421 HydrophobicContact CG-CB 4.39Å; L192-A421 WeakPolarHBondContact O-CB 3.44Å; L193-A421 HydrophobicContact CD2-CB 4.19Å; M408-A421 HydrophobicContact CE-CB 3.96Å; M408-A421 HydrophobicContact SD-CB 3.98Å; H417-A421 WeakPolarHBondContact O-CB 3.35Å; H417-A421 PolarHBondContact O-N 2.75Å; Y418-A421 PolarHBondContact O-N 3.4Å; A421-V424 PolarHBondContact O-N 3.41Å; A421-Q425 WeakPolarHBondContact O-CG 3.15Å; A421-Q425 PolarHBondContact O-N 3.36Å
422	R	97.5	Very high	96.4	Very high	106 Å²	106	51.4 Å²	51.4	40%	0.4	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-37.1	175.6	-68.5	-55	-173.3	-172.2	1.3	112.7	Y418 V420 Q425 K426	Y418-R422 HydrophobicContact CD1-CG 4.08Å; Y418-R422 HydrophobicContact CE1-CG 3.68Å; Y418-R422 HydrophobicContact CE2-CG 4.17Å; Y418-R422 HydrophobicContact CG-CG 4.49Å; Y418-R422 VanDerWaalsContact CZ-NE 3.35Å; Y418-R422 WeakPolarHBondContact O-CB 3.49Å; Y418-R422 WeakPolarHBondContact O-CG 3.32Å; Y418-R422 PolarHBondContact O-N 3.23Å; Y418-R422 PolarHBondContact OH-NE 2.88Å; Y418-R422 PolarHBondContact OH-NH2 3.15Å; V420-R422 PolarHBondContact O-N 3.43Å; R422-Q425 PolarHBondContact O-N 3.18Å; R422-K426 WeakPolarHBondContact O-CB 3.21Å; R422-K426 PolarHBondContact O-N 3.25Å
423	G	97.5	Very high	96.5	Very high	23 Å²	23	52.2 Å²	52.2	24%	0.237	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-45	172.9	0	0	0	0	0	112.4	D419 V420 K426 I427	D419-G423 PolarHBondContact O-N 3.39Å; V420-G423 PolarHBondContact O-N 3.12Å; G423-K426 PolarHBondContact O-N 2.62Å; G423-I427 WeakPolarHBondContact O-CG2 3.32Å; G423-I427 PolarHBondContact O-N 2.84Å; G423-I427 VanDerWaalsContact O-N 3.08Å
424	V	97.6	Very high	96.5	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-45	175.1	168	0	0	0	0	111.6	L192 L193 V420 A421 K426 I427 L428 I460 F491 L495	L192-V424 HydrophobicContact CD2-CG2 4.13Å; L193-V424 HydrophobicContact CD1-CG1 4.34Å; L193-V424 HydrophobicContact CD2-CB 4.27Å; L193-V424 HydrophobicContact CD2-CG1 3.97Å; V420-V424 WeakPolarHBondContact O-CG2 3.32Å; V420-V424 PolarHBondContact O-N 3.08Å; A421-V424 PolarHBondContact O-N 3.41Å; V424-K426 PolarHBondContact O-N 2.93Å; V424-I427 VanDerWaalsContact O-CG2 3.28Å; V424-I427 WeakPolarHBondContact O-CG2 3.33Å; V424-L428 HydrophobicContact CG1-CD1 3.77Å; V424-L428 HydrophobicContact CG1-CG 4.5Å; V424-L428 WeakPolarHBondContact O-CB 3.33Å; V424-L428 WeakPolarHBondContact O-CD1 3.17Å; V424-L428 VanDerWaalsContact O-CG 3.23Å; V424-L428 WeakPolarHBondContact O-CG 3.37Å; V424-L428 PolarHBondContact O-N 3.24Å; V424-L428 VanDerWaalsContact O-N 3.15Å; V424-I460 HydrophobicContact CG1-CG2 3.72Å; V424-I460 HydrophobicContact CG2-CG2 4.46Å; V424-F491 HydrophobicContact CG2-CB 4.13Å; V424-F491 HydrophobicContact CG2-CD1 3.74Å; V424-F491 HydrophobicContact CG2-CG 4.23Å; V424-L495 HydrophobicContact CG2-CD1 4Å; V424-L495 HydrophobicContact CG2-CD2 4.48Å; V424-L495 HydrophobicContact CG2-CG 4.34Å
425	Q	96.9	Very high	96.4	Very high	28 Å²	28	54 Å²	54	13%	0.131	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-42.5	177.4	-73	-179.1	-34.9	0	0	111.8	L193 P400 L401 A421 R422 L428 Q429	L193-Q425 HydrophobicContact CD2-CG 4.05Å; P400-Q425 PolarHBondContact O-NE2 2.89Å; L401-Q425 HydrophobicContact CD2-CB 4.4Å; A421-Q425 WeakPolarHBondContact O-CG 3.15Å; A421-Q425 PolarHBondContact O-N 3.36Å; R422-Q425 PolarHBondContact O-N 3.18Å; Q425-L428 PolarHBondContact O-N 3.07Å; Q425-Q429 WeakPolarHBondContact O-CB 3.39Å; Q425-Q429 PolarHBondContact O-N 2.94Å
426	K	97.5	Very high	96.1	Very high	139 Å²	139	55.9 Å²	55.9	60%	0.604	28%	0.275	S	S	*	.	H	α-helix	trans	-60.1	-51.2	179.4	-172.1	-169.9	173.3	-148.7	0	111.5	R422 G423 V424 L428 Q429 D430	R422-K426 WeakPolarHBondContact O-CB 3.21Å; R422-K426 PolarHBondContact O-N 3.25Å; G423-K426 PolarHBondContact O-N 2.62Å; V424-K426 PolarHBondContact O-N 2.93Å; K426-L428 VanDerWaalsContact C-N 3.3Å; K426-L428 PolarHBondContact O-N 3.38Å; K426-Q429 WeakPolarHBondContact O-CB 3.5Å; K426-Q429 PolarHBondContact O-N 3.31Å; K426-Q429 VanDerWaalsContact O-N 3.17Å; K426-D430 VanDerWaalsContact O-CG 3.29Å; K426-D430 PolarHBondContact O-N 2.93Å
427	I	97.2	Very high	95.8	Very high	17 Å²	17	54.1 Å²	54.1	9%	0.087	27%	0.268	C	S	.	.	H	α-helix	trans	-65.6	-33.8	-177.8	-162.3	174.7	0	0	0	112.5	G423 V424 Y431 T453 R456 A457 I460 L495	G423-I427 WeakPolarHBondContact O-CG2 3.32Å; G423-I427 PolarHBondContact O-N 2.84Å; G423-I427 VanDerWaalsContact O-N 3.08Å; V424-I427 VanDerWaalsContact O-CG2 3.28Å; V424-I427 WeakPolarHBondContact O-CG2 3.33Å; I427-Y431 WeakPolarHBondContact O-CB 3.32Å; I427-Y431 PolarHBondContact O-N 3.08Å; I427-T453 HydrophobicContact CG1-CG2 3.96Å; I427-R456 HydrophobicContact CD1-CB 3.53Å; I427-A457 HydrophobicContact CG1-CB 4.35Å; I427-I460 HydrophobicContact CD1-CD1 4.22Å; I427-I460 HydrophobicContact CG2-CD1 3.5Å; I427-L495 HydrophobicContact CG2-CD2 4.08Å
428	L	96.4	Very high	95.6	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-71.3	-35.5	174.9	-69.5	172.8	0	0	0	112.2	P400 L401 V424 Q425 K426 K432 A457 I460 Q461 L464	P400-L428 HydrophobicContact CB-CD1 3.72Å; P400-L428 HydrophobicContact CG-CD1 3.64Å; L401-L428 HydrophobicContact CD2-CB 4.18Å; V424-L428 HydrophobicContact CG1-CD1 3.77Å; V424-L428 HydrophobicContact CG1-CG 4.5Å; V424-L428 WeakPolarHBondContact O-CB 3.33Å; V424-L428 WeakPolarHBondContact O-CD1 3.17Å; V424-L428 VanDerWaalsContact O-CG 3.23Å; V424-L428 WeakPolarHBondContact O-CG 3.37Å; V424-L428 PolarHBondContact O-N 3.24Å; V424-L428 VanDerWaalsContact O-N 3.15Å; Q425-L428 PolarHBondContact O-N 3.07Å; K426-L428 VanDerWaalsContact C-N 3.3Å; K426-L428 PolarHBondContact O-N 3.38Å; L428-K432 PolarHBondContact O-N 2.99Å; L428-A457 HydrophobicContact CD2-CB 4.48Å; L428-I460 HydrophobicContact CD1-CG2 4.12Å; L428-I460 HydrophobicContact CD2-CG2 4.12Å; L428-I460 HydrophobicContact CG-CG2 4.2Å; L428-Q461 HydrophobicContact CD2-CB 4.39Å; L428-L464 HydrophobicContact CD1-CD1 4.15Å
429	Q	96.4	Very high	95.3	Very high	87 Å²	87	57.1 Å²	57.1	41%	0.407	30%	0.3	S	S	.	.	H	α-helix	trans	-66.9	-45	174.1	-177.2	59.1	55.9	0	0	111.4	L401 Q425 K426 Y431 K432 S433	L401-Q429 HydrophobicContact CD2-CB 4.28Å; Q425-Q429 WeakPolarHBondContact O-CB 3.39Å; Q425-Q429 PolarHBondContact O-N 2.94Å; K426-Q429 WeakPolarHBondContact O-CB 3.5Å; K426-Q429 PolarHBondContact O-N 3.31Å; K426-Q429 VanDerWaalsContact O-N 3.17Å; Q429-Y431 VanDerWaalsContact C-N 3.32Å; Q429-Y431 PolarHBondContact O-N 2.79Å; Q429-K432 WeakPolarHBondContact O-CB 3.25Å; Q429-K432 PolarHBondContact O-N 3.31Å; Q429-S433 PolarHBondContact O-N 3.07Å; Q429-S433 VanDerWaalsContact O-N 3.14Å
430	D	95.8	Very high	95.1	Very high	67 Å²	67	58.9 Å²	58.9	36%	0.358	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-43.3	176	-66.7	-22.5	0	0	0	110.3	K426 K432 S433 L434 T453	K426-D430 VanDerWaalsContact O-CG 3.29Å; K426-D430 PolarHBondContact O-N 2.93Å; D430-K432 PolarHBondContact O-N 3.07Å; D430-S433 PolarHBondContact O-N 2.8Å; D430-L434 WeakPolarHBondContact O-CG 3.41Å; D430-L434 PolarHBondContact O-N 2.79Å; D430-T453 HydrophobicContact CB-CG2 4.21Å
431	Y	95.8	Very high	94.8	Very high	33 Å²	33	63.7 Å²	63.7	13%	0.129	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-44.2	173.9	172.4	-127	0	0	0	113	I427 Q429 S433 L434 Q435 V454 A457 R458	I427-Y431 WeakPolarHBondContact O-CB 3.32Å; I427-Y431 PolarHBondContact O-N 3.08Å; Q429-Y431 VanDerWaalsContact C-N 3.32Å; Q429-Y431 PolarHBondContact O-N 2.79Å; Y431-S433 VanDerWaalsContact C-N 3.28Å; Y431-S433 PolarHBondContact O-N 3.32Å; Y431-L434 PolarHBondContact O-N 3.24Å; Y431-L434 VanDerWaalsContact O-N 3.08Å; Y431-Q435 HydrophobicContact CD2-CG 4.24Å; Y431-Q435 HydrophobicContact CE1-CG 4.28Å; Y431-Q435 HydrophobicContact CE2-CG 3.77Å; Y431-Q435 WeakPolarHBondContact O-CG 3.43Å; Y431-Q435 PolarHBondContact O-N 2.96Å; Y431-Q435 PolarHBondContact OH-NE2 2.79Å; Y431-Q435 VanDerWaalsContact OH-NE2 3.09Å; Y431-V454 HydrophobicContact CD2-CB 4.34Å; Y431-V454 HydrophobicContact CD2-CG1 3.95Å; Y431-V454 HydrophobicContact CD2-CG2 4.09Å; Y431-V454 HydrophobicContact CE2-CG1 3.72Å; Y431-A457 VanDerWaalsContact CB-CB 3.42Å; Y431-A457 HydrophobicContact CD1-CB 3.98Å; Y431-A457 HydrophobicContact CD2-CB 4.25Å; Y431-A457 HydrophobicContact CG-CB 3.62Å; Y431-R458 HydrophobicContact CE2-CG 4.46Å
432	K	93.4	Very high	94.5	Very high	96 Å²	96	65.1 Å²	65.1	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-38.5	177.6	-166.7	175.1	-176.6	174.3	0	111.7	L401 L428 Q429 D430 Q435	L401-K432 HydrophobicContact CD1-CD 3.98Å; L428-K432 PolarHBondContact O-N 2.99Å; Q429-K432 WeakPolarHBondContact O-CB 3.25Å; Q429-K432 PolarHBondContact O-N 3.31Å; D430-K432 PolarHBondContact O-N 3.07Å; K432-Q435 PolarHBondContact O-N 2.7Å
433	S	92.9	Very high	94.2	Very high	72 Å²	72	63.3 Å²	63.3	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-68.5	-32.9	174.4	-66.8	0	0	0	0	113.3	Q429 D430 Y431	Q429-S433 PolarHBondContact O-N 3.07Å; Q429-S433 VanDerWaalsContact O-N 3.14Å; D430-S433 PolarHBondContact O-N 2.8Å; Y431-S433 VanDerWaalsContact C-N 3.28Å; Y431-S433 PolarHBondContact O-N 3.32Å
434	L	94.7	Very high	93.8	Very high	20 Å²	20	69 Å²	69	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-76.6	-22.7	176.5	-66.3	173.2	0	0	0	113.1	D430 Y431 D436 I437 I438 L446 D450 T453 V454	D430-L434 WeakPolarHBondContact O-CG 3.41Å; D430-L434 PolarHBondContact O-N 2.79Å; Y431-L434 PolarHBondContact O-N 3.24Å; Y431-L434 VanDerWaalsContact O-N 3.08Å; L434-D436 VanDerWaalsContact C-N 3.33Å; L434-D436 PolarHBondContact O-N 2.81Å; L434-I437 HydrophobicContact CD2-CD1 4.28Å; L434-I437 WeakPolarHBondContact O-CB 3.45Å; L434-I437 PolarHBondContact O-N 2.82Å; L434-I437 VanDerWaalsContact O-N 3.16Å; L434-I438 HydrophobicContact CB-CD1 4.31Å; L434-I438 WeakPolarHBondContact O-CD1 3.39Å; L434-I438 VanDerWaalsContact O-CG1 3.26Å; L434-I438 WeakPolarHBondContact O-CG1 3.32Å; L434-I438 PolarHBondContact O-N 3.4Å; L434-L446 HydrophobicContact CD2-CD2 4.09Å; L434-D450 HydrophobicContact CD1-CB 4.05Å; L434-D450 HydrophobicContact CD2-CB 4.39Å; L434-T453 HydrophobicContact CD1-CG2 4.42Å; L434-V454 HydrophobicContact CB-CG2 4.33Å; L434-V454 HydrophobicContact CD1-CG2 3.78Å
435	Q	92.3	Very high	93.5	Very high	74 Å²	74	75.9 Å²	75.9	35%	0.346	40%	0.401	S	S	.	.	H	α-helix	trans	-58.5	-40.8	-179.2	-80.2	-179.2	-24.2	0	0	113.1	Y431 K432 I437 I438 A439	Y431-Q435 HydrophobicContact CD2-CG 4.24Å; Y431-Q435 HydrophobicContact CE1-CG 4.28Å; Y431-Q435 HydrophobicContact CE2-CG 3.77Å; Y431-Q435 WeakPolarHBondContact O-CG 3.43Å; Y431-Q435 PolarHBondContact O-N 2.96Å; Y431-Q435 PolarHBondContact OH-NE2 2.79Å; Y431-Q435 VanDerWaalsContact OH-NE2 3.09Å; K432-Q435 PolarHBondContact O-N 2.7Å; Q435-I437 VanDerWaalsContact C-N 3.32Å; Q435-I437 PolarHBondContact O-N 3.18Å; Q435-I438 PolarHBondContact O-N 3.34Å; Q435-A439 WeakPolarHBondContact O-CB 3.39Å; Q435-A439 PolarHBondContact O-N 3.48Å
436	D	90.4	Very high	93.3	Very high	118 Å²	118	75.2 Å²	75.2	63%	0.631	40%	0.398	S	S	*	.	H	α-helix	trans	-64.9	-38.7	178.1	-70.9	-20	0	0	0	111.5	L434 A439 I440	L434-D436 VanDerWaalsContact C-N 3.33Å; L434-D436 PolarHBondContact O-N 2.81Å; D436-A439 PolarHBondContact O-N 2.75Å; D436-I440 WeakPolarHBondContact O-CG1 3.48Å; D436-I440 PolarHBondContact O-N 3.14Å
437	I	91.2	Very high	93.1	Very high	73 Å²	73	71.2 Å²	71.2	37%	0.374	39%	0.388	S	S	.	.	H	α-helix	trans	-66.5	-47	176.5	-57.1	180	0	0	0	109.9	L434 Q435 A439 I440 L441 L446	L434-I437 HydrophobicContact CD2-CD1 4.28Å; L434-I437 WeakPolarHBondContact O-CB 3.45Å; L434-I437 PolarHBondContact O-N 2.82Å; L434-I437 VanDerWaalsContact O-N 3.16Å; Q435-I437 VanDerWaalsContact C-N 3.32Å; Q435-I437 PolarHBondContact O-N 3.18Å; I437-A439 VanDerWaalsContact C-N 3.28Å; I437-A439 PolarHBondContact O-N 3.33Å; I437-I440 PolarHBondContact O-N 3.09Å; I437-I440 VanDerWaalsContact O-N 3.16Å; I437-L441 HydrophobicContact CG2-CD1 3.93Å; I437-L441 HydrophobicContact CG2-CG 4.49Å; I437-L441 PolarHBondContact O-N 3.13Å; I437-L446 HydrophobicContact CG2-CD2 4.16Å
438	I	92.1	Very high	93	Very high	40 Å²	40	77.2 Å²	77.2	21%	0.205	42%	0.416	C	S	.	.	H	α-helix	trans	-59.5	-40.5	178	-67.6	161.1	0	0	0	110.9	L434 Q435 I440 G442 L446 V454	L434-I438 HydrophobicContact CB-CD1 4.31Å; L434-I438 WeakPolarHBondContact O-CD1 3.39Å; L434-I438 VanDerWaalsContact O-CG1 3.26Å; L434-I438 WeakPolarHBondContact O-CG1 3.32Å; L434-I438 PolarHBondContact O-N 3.4Å; Q435-I438 PolarHBondContact O-N 3.34Å; I438-I440 VanDerWaalsContact C-N 3.26Å; I438-I440 PolarHBondContact O-N 2.96Å; I438-G442 VanDerWaalsContact O-CA 3.25Å; I438-G442 WeakPolarHBondContact O-CA 3.37Å; I438-G442 PolarHBondContact O-N 2.84Å; I438-L446 HydrophobicContact CD1-CD1 3.95Å; I438-L446 HydrophobicContact CG1-CD1 3.67Å; I438-L446 HydrophobicContact CG1-CG 4.4Å; I438-V454 HydrophobicContact CD1-CG1 4.27Å; I438-V454 HydrophobicContact CD1-CG2 3.91Å
439	A	92.6	Very high	92.8	Very high	87 Å²	87	84 Å²	84	72%	0.719	45%	0.447	S	S	*	.	H	α-helix	trans	-65.9	-27.6	-179.8	0	0	0	0	0	113.2	Q435 D436 I437	Q435-A439 WeakPolarHBondContact O-CB 3.39Å; Q435-A439 PolarHBondContact O-N 3.48Å; D436-A439 PolarHBondContact O-N 2.75Å; I437-A439 VanDerWaalsContact C-N 3.28Å; I437-A439 PolarHBondContact O-N 3.33Å
440	I	92.8	Very high	92.7	Very high	140 Å²	140	82.4 Å²	82.4	72%	0.718	44%	0.442	S	S	*	.	H	α-helix	trans	-96.5	-51.1	-178	-63.2	165.6	0	0	0	112	D436 I437 I438	D436-I440 WeakPolarHBondContact O-CG1 3.48Å; D436-I440 PolarHBondContact O-N 3.14Å; I437-I440 PolarHBondContact O-N 3.09Å; I437-I440 VanDerWaalsContact O-N 3.16Å; I438-I440 VanDerWaalsContact C-N 3.26Å; I438-I440 PolarHBondContact O-N 2.96Å
441	L	91.8	Very high	92.6	Very high	110 Å²	110	81.8 Å²	81.8	58%	0.576	44%	0.436	S	S	*	.	H	α-helix	trans	-96.5	-20.1	-171	-62.1	-179.1	0	0	0	113.1	I437 E445	I437-L441 HydrophobicContact CG2-CD1 3.93Å; I437-L441 HydrophobicContact CG2-CG 4.49Å; I437-L441 PolarHBondContact O-N 3.13Å; L441-E445 HydrophobicContact CB-CB 4.05Å; L441-E445 HydrophobicContact CB-CG 4.12Å; L441-E445 WeakPolarHBondContact O-CG 3.49Å
442	G	91.6	Very high	92.5	Very high	29 Å²	29	83.5 Å²	83.5	30%	0.299	45%	0.447	S	S	.	.			trans	87.1	168	-172.2	0	0	0	0	0	113	I438 D444	I438-G442 VanDerWaalsContact O-CA 3.25Å; I438-G442 WeakPolarHBondContact O-CA 3.37Å; I438-G442 PolarHBondContact O-N 2.84Å; G442-D444 VanDerWaalsContact C-N 3.34Å; G442-D444 PolarHBondContact O-N 3.16Å
443	M	90.5	Very high	92.6	Very high	69 Å²	69	80.3 Å²	80.3	34%	0.34	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-75.7	-22.4	-172.8	-162	158.6	-165.8	0	0	113.6	E445 L446 K451 V454	M443-E445 VanDerWaalsContact C-N 3.31Å; M443-E445 PolarHBondContact O-N 3.36Å; M443-L446 PolarHBondContact O-N 2.92Å; M443-K451 VanDerWaalsContact O-CE 3.24Å; M443-K451 WeakPolarHBondContact O-CE 3.34Å; M443-V454 HydrophobicContact CE-CB 3.92Å; M443-V454 HydrophobicContact CE-CG1 3.35Å
444	D	90.1	Very high	92.7	Very high	141 Å²	141	77 Å²	77	75%	0.754	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-73.1	-25.2	-176.1	-64.3	-43.1	0	0	0	113.1	G442 L446 K451	G442-D444 VanDerWaalsContact C-N 3.34Å; G442-D444 PolarHBondContact O-N 3.16Å; D444-L446 VanDerWaalsContact C-N 3.28Å; D444-L446 PolarHBondContact O-N 3Å; D444-K451 PolarHBondContact O-NZ 3.13Å
445	E	90.9	Very high	92.7	Very high	146 Å²	146	77.7 Å²	77.7	68%	0.682	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-79.7	-7.4	-179	-65.4	-62.7	148	0	0	113.5	L441 M443	L441-E445 HydrophobicContact CB-CB 4.05Å; L441-E445 HydrophobicContact CB-CG 4.12Å; L441-E445 WeakPolarHBondContact O-CG 3.49Å; M443-E445 VanDerWaalsContact C-N 3.31Å; M443-E445 PolarHBondContact O-N 3.36Å
446	L	92.7	Very high	92.9	Very high	13 Å²	13	76.7 Å²	76.7	7%	0.068	41%	0.412	C	S	.	.	S	Bend	trans	-74.9	150.7	175.8	-70	-179.8	0	0	0	111.6	L434 I437 I438 M443 D444 D450 K451 V454	L434-L446 HydrophobicContact CD2-CD2 4.09Å; I437-L446 HydrophobicContact CG2-CD2 4.16Å; I438-L446 HydrophobicContact CD1-CD1 3.95Å; I438-L446 HydrophobicContact CG1-CD1 3.67Å; I438-L446 HydrophobicContact CG1-CG 4.4Å; M443-L446 PolarHBondContact O-N 2.92Å; D444-L446 VanDerWaalsContact C-N 3.28Å; D444-L446 PolarHBondContact O-N 3Å; L446-D450 HydrophobicContact CB-CB 4.02Å; L446-D450 HydrophobicContact CD1-CB 4.42Å; L446-D450 HydrophobicContact CD2-CB 4.18Å; L446-D450 HydrophobicContact CG-CB 4.45Å; L446-K451 HydrophobicContact CB-CG 3.87Å; L446-K451 VanDerWaalsContact O-CE 3.22Å; L446-K451 WeakPolarHBondContact O-CE 3.04Å; L446-V454 HydrophobicContact CD1-CG2 4.07Å
447	S	94.2	Very high	93.2	Very high	56 Å²	56	71.1 Å²	71.1	39%	0.392	38%	0.382	S	S	.	.			trans	-63.9	157.9	168.8	76.6	0	0	0	0	110.7	E449 D450 K451	S447-E449 PolarHBondContact O-N 3.47Å; S447-D450 WeakPolarHBondContact CB-OD2 3.46Å; S447-D450 PolarHBondContact O-N 3.35Å; S447-D450 VanDerWaalsContact O-N 3.14Å; S447-D450 PolarHBondContact OG-N 2.91Å; S447-D450 VanDerWaalsContact OG-N 3.16Å; S447-D450 PolarHBondContact OG-OD2 3.16Å; S447-K451 WeakPolarHBondContact O-CG 3.42Å; S447-K451 PolarHBondContact O-N 3.46Å
448	E	93.3	Very high	93.4	Very high	142 Å²	142	71.8 Å²	71.8	66%	0.664	38%	0.379	S	S	*	.	H	α-helix	trans	-62.3	-29.3	178.5	-65.6	-58.9	123.7	0	0	112.6	K451 L452	E448-K451 IonicContact OE1-NZ 3.48Å; E448-K451 PolarHBondContact OE1-NZ 3.32Å; E448-L452 WeakPolarHBondContact O-CB 3.29Å; E448-L452 PolarHBondContact O-N 3.12Å
449	E	92.9	Very high	93.7	Very high	151 Å²	151	70 Å²	70	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-69.6	-41.8	173.7	-174.3	175.6	-177.8	0	0	111.9	S447 L452 T453	S447-E449 PolarHBondContact O-N 3.47Å; E449-L452 WeakPolarHBondContact O-CB 3.26Å; E449-L452 PolarHBondContact O-N 3.4Å; E449-T453 PolarHBondContact O-N 3.05Å; E449-T453 PolarHBondContact O-OG1 3.31Å
450	D	94.5	Very high	93.9	Very high	54 Å²	54	65.9 Å²	65.9	29%	0.289	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-40.1	175.8	-64.5	-40.8	0	0	0	111.1	L434 L446 S447 L452 T453 V454	L434-D450 HydrophobicContact CD1-CB 4.05Å; L434-D450 HydrophobicContact CD2-CB 4.39Å; L446-D450 HydrophobicContact CB-CB 4.02Å; L446-D450 HydrophobicContact CD1-CB 4.42Å; L446-D450 HydrophobicContact CD2-CB 4.18Å; L446-D450 HydrophobicContact CG-CB 4.45Å; S447-D450 WeakPolarHBondContact CB-OD2 3.46Å; S447-D450 PolarHBondContact O-N 3.35Å; S447-D450 VanDerWaalsContact O-N 3.14Å; S447-D450 PolarHBondContact OG-N 2.91Å; S447-D450 VanDerWaalsContact OG-N 3.16Å; S447-D450 PolarHBondContact OG-OD2 3.16Å; D450-L452 VanDerWaalsContact C-N 3.3Å; D450-L452 PolarHBondContact O-N 3.25Å; D450-T453 WeakPolarHBondContact O-CB 3.31Å; D450-T453 PolarHBondContact O-N 2.84Å; D450-V454 VanDerWaalsContact O-CG2 3.23Å; D450-V454 WeakPolarHBondContact O-CG2 3.13Å; D450-V454 PolarHBondContact O-N 3.34Å
451	K	93.6	Very high	94	Very high	53 Å²	53	60.7 Å²	60.7	23%	0.23	31%	0.309	C	S	.	.	H	α-helix	trans	-59.6	-42.4	173.5	-71.9	176.6	-172.9	164.2	0	111.4	M443 D444 L446 S447 E448 V454 S455	M443-K451 VanDerWaalsContact O-CE 3.24Å; M443-K451 WeakPolarHBondContact O-CE 3.34Å; D444-K451 PolarHBondContact O-NZ 3.13Å; L446-K451 HydrophobicContact CB-CG 3.87Å; L446-K451 VanDerWaalsContact O-CE 3.22Å; L446-K451 WeakPolarHBondContact O-CE 3.04Å; S447-K451 WeakPolarHBondContact O-CG 3.42Å; S447-K451 PolarHBondContact O-N 3.46Å; E448-K451 IonicContact OE1-NZ 3.48Å; E448-K451 PolarHBondContact OE1-NZ 3.32Å; K451-V454 PolarHBondContact O-N 3.37Å; K451-S455 WeakPolarHBondContact O-CB 3.42Å; K451-S455 PolarHBondContact O-N 3.24Å
452	L	94.4	Very high	94.3	Very high	70 Å²	70	58 Å²	58	37%	0.366	29%	0.291	S	S	.	.	H	α-helix	trans	-63.8	-43.9	175.7	-175.5	62.9	0	0	0	111.5	E448 E449 D450 V454 S455 R456	E448-L452 WeakPolarHBondContact O-CB 3.29Å; E448-L452 PolarHBondContact O-N 3.12Å; E449-L452 WeakPolarHBondContact O-CB 3.26Å; E449-L452 PolarHBondContact O-N 3.4Å; D450-L452 VanDerWaalsContact C-N 3.3Å; D450-L452 PolarHBondContact O-N 3.25Å; L452-V454 PolarHBondContact O-N 3.01Å; L452-S455 PolarHBondContact O-N 3.06Å; L452-R456 PolarHBondContact O-N 3.32Å
453	T	95.1	Very high	94.5	Very high	28 Å²	28	56.7 Å²	56.7	17%	0.172	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-47.4	175.7	-62.2	0	0	0	0	111.2	I427 D430 L434 E449 D450 R456 A457	I427-T453 HydrophobicContact CG1-CG2 3.96Å; D430-T453 HydrophobicContact CB-CG2 4.21Å; L434-T453 HydrophobicContact CD1-CG2 4.42Å; E449-T453 PolarHBondContact O-N 3.05Å; E449-T453 PolarHBondContact O-OG1 3.31Å; D450-T453 WeakPolarHBondContact O-CB 3.31Å; D450-T453 PolarHBondContact O-N 2.84Å; T453-R456 PolarHBondContact O-N 3.15Å; T453-A457 VanDerWaalsContact O-CB 3.24Å; T453-A457 WeakPolarHBondContact O-CB 3.49Å; T453-A457 PolarHBondContact O-N 3Å
454	V	95.6	Very high	94.8	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-43.7	177.8	176.4	0	0	0	0	111.3	Y431 L434 I438 M443 L446 D450 K451 L452 A457 R458	Y431-V454 HydrophobicContact CD2-CB 4.34Å; Y431-V454 HydrophobicContact CD2-CG1 3.95Å; Y431-V454 HydrophobicContact CD2-CG2 4.09Å; Y431-V454 HydrophobicContact CE2-CG1 3.72Å; L434-V454 HydrophobicContact CB-CG2 4.33Å; L434-V454 HydrophobicContact CD1-CG2 3.78Å; I438-V454 HydrophobicContact CD1-CG1 4.27Å; I438-V454 HydrophobicContact CD1-CG2 3.91Å; M443-V454 HydrophobicContact CE-CB 3.92Å; M443-V454 HydrophobicContact CE-CG1 3.35Å; L446-V454 HydrophobicContact CD1-CG2 4.07Å; D450-V454 VanDerWaalsContact O-CG2 3.23Å; D450-V454 WeakPolarHBondContact O-CG2 3.13Å; D450-V454 PolarHBondContact O-N 3.34Å; K451-V454 PolarHBondContact O-N 3.37Å; L452-V454 PolarHBondContact O-N 3.01Å; V454-A457 PolarHBondContact O-N 2.72Å; V454-R458 HydrophobicContact CG1-CG 4.36Å; V454-R458 WeakPolarHBondContact O-CG 3.4Å; V454-R458 PolarHBondContact O-N 2.97Å
455	S	95.2	Very high	95.1	Very high	35 Å²	35	47.1 Å²	47.1	25%	0.245	23%	0.227	C	C	.	.	H	α-helix	trans	-58.7	-48.9	177.6	177.3	0	0	0	0	111.7	K451 L452 R458 K459	K451-S455 WeakPolarHBondContact O-CB 3.42Å; K451-S455 PolarHBondContact O-N 3.24Å; L452-S455 PolarHBondContact O-N 3.06Å; S455-R458 PolarHBondContact O-N 2.96Å; S455-K459 WeakPolarHBondContact O-CG 3.34Å; S455-K459 PolarHBondContact O-N 2.76Å; S455-K459 VanDerWaalsContact O-N 3.14Å
456	R	96.4	Very high	95.4	Very high	54 Å²	54	40.3 Å²	40.3	20%	0.204	20%	0.195	C	C	.	.	H	α-helix	trans	-65.4	-42.6	176.8	-72.8	-178.3	-177.4	174.4	5.5	112.1	I427 L452 T453 R458 K459 I460 L495 D500	I427-R456 HydrophobicContact CD1-CB 3.53Å; L452-R456 PolarHBondContact O-N 3.32Å; T453-R456 PolarHBondContact O-N 3.15Å; R456-R458 VanDerWaalsContact C-N 3.35Å; R456-R458 PolarHBondContact O-N 3.28Å; R456-K459 PolarHBondContact O-N 2.83Å; R456-I460 WeakPolarHBondContact O-CG1 3.42Å; R456-I460 PolarHBondContact O-N 3.42Å; R456-L495 PolarHBondContact NH1-O 3.04Å; R456-D500 VanDerWaalsContact CG-OD1 3.28Å; R456-D500 WeakPolarHBondContact CG-OD1 3.49Å; R456-D500 IonicContact CZ-OD1 3Å; R456-D500 IonicContact CZ-OD2 3.29Å; R456-D500 VanDerWaalsContact CZ-OD2 3.29Å; R456-D500 IonicContact NE-OD1 2.86Å; R456-D500 PolarHBondContact NE-OD1 3.45Å; R456-D500 IonicContact NE-OD2 3.06Å; R456-D500 PolarHBondContact NE-OD2 2.95Å; R456-D500 IonicContact NH2-OD2 2.69Å; R456-D500 PolarHBondContact NH2-OD2 3.31Å
457	A	96.4	Very high	95.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60	-43.3	177.5	0	0	0	0	0	112.1	I427 L428 Y431 T453 V454 K459 I460 Q461	I427-A457 HydrophobicContact CG1-CB 4.35Å; L428-A457 HydrophobicContact CD2-CB 4.48Å; Y431-A457 VanDerWaalsContact CB-CB 3.42Å; Y431-A457 HydrophobicContact CD1-CB 3.98Å; Y431-A457 HydrophobicContact CD2-CB 4.25Å; Y431-A457 HydrophobicContact CG-CB 3.62Å; T453-A457 VanDerWaalsContact O-CB 3.24Å; T453-A457 WeakPolarHBondContact O-CB 3.49Å; T453-A457 PolarHBondContact O-N 3Å; V454-A457 PolarHBondContact O-N 2.72Å; A457-K459 PolarHBondContact O-N 3.32Å; A457-I460 PolarHBondContact O-N 3.33Å; A457-Q461 WeakPolarHBondContact O-CB 3.01Å; A457-Q461 PolarHBondContact O-N 3.33Å
458	R	95.6	Very high	95.5	Very high	87 Å²	87	37.8 Å²	37.8	33%	0.328	18%	0.178	S	C	.	.	H	α-helix	trans	-62.9	-41.7	175.8	-71.8	176.7	69.1	164.2	-2.9	111.9	Y431 V454 S455 R456 Q461 R462 E504	Y431-R458 HydrophobicContact CE2-CG 4.46Å; V454-R458 HydrophobicContact CG1-CG 4.36Å; V454-R458 WeakPolarHBondContact O-CG 3.4Å; V454-R458 PolarHBondContact O-N 2.97Å; S455-R458 PolarHBondContact O-N 2.96Å; R456-R458 VanDerWaalsContact C-N 3.35Å; R456-R458 PolarHBondContact O-N 3.28Å; R458-Q461 PolarHBondContact O-N 3Å; R458-R462 VanDerWaalsContact O-CG 3.32Å; R458-R462 WeakPolarHBondContact O-CG 3.23Å; R458-R462 PolarHBondContact O-N 3.04Å; R458-E504 HydrophobicContact CB-CG 4.35Å; R458-E504 WeakPolarHBondContact CD-OE1 3.22Å; R458-E504 IonicContact CZ-OE1 3.62Å; R458-E504 VanDerWaalsContact CZ-OE1 3.26Å; R458-E504 IonicContact CZ-OE2 2.81Å; R458-E504 IonicContact NE-OE1 3.57Å; R458-E504 PolarHBondContact NE-OE1 3.47Å; R458-E504 IonicContact NE-OE2 3.26Å; R458-E504 PolarHBondContact NE-OE2 2.96Å; R458-E504 IonicContact NH1-OE1 2.96Å; R458-E504 IonicContact NH2-OE1 3.86Å; R458-E504 IonicContact NH2-OE2 2.82Å; R458-E504 PolarHBondContact NH2-OE2 3.44Å
459	K	97	Very high	95.3	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.017	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-46.3	174.5	-70	172.3	-177.3	179.1	0	112	S455 R456 A457 R462 F463 Y499 D500 L502 E504 F507	S455-K459 WeakPolarHBondContact O-CG 3.34Å; S455-K459 PolarHBondContact O-N 2.76Å; S455-K459 VanDerWaalsContact O-N 3.14Å; R456-K459 PolarHBondContact O-N 2.83Å; A457-K459 PolarHBondContact O-N 3.32Å; K459-R462 PolarHBondContact O-N 2.89Å; K459-F463 VanDerWaalsContact O-CB 3.29Å; K459-F463 WeakPolarHBondContact O-CB 3.42Å; K459-F463 PolarHBondContact O-N 3.14Å; K459-Y499 PolarHBondContact NZ-O 3.46Å; K459-D500 VanDerWaalsContact NZ-CA 3.3Å; K459-D500 PolarHBondContact NZ-O 2.93Å; K459-L502 WeakPolarHBondContact CE-O 3.36Å; K459-L502 PolarHBondContact NZ-O 3.31Å; K459-E504 HydrophobicContact CG-CG 4.25Å; K459-F507 HydrophobicContact CB-CD2 3.95Å; K459-F507 HydrophobicContact CB-CE2 4.1Å; K459-F507 HydrophobicContact CB-CG 4.27Å; K459-F507 HydrophobicContact CD-CD2 4.23Å; K459-F507 HydrophobicContact CD-CE2 3.68Å; K459-F507 HydrophobicContact CD-CZ 4.23Å; K459-F507 HydrophobicContact CG-CD2 3.77Å; K459-F507 HydrophobicContact CG-CE2 3.76Å
460	I	97.1	Very high	94.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-47.7	175.7	-72.1	171.1	0	0	0	110.4	V424 I427 L428 R456 A457 R462 F463 L464 F491 I494 L495	V424-I460 HydrophobicContact CG1-CG2 3.72Å; V424-I460 HydrophobicContact CG2-CG2 4.46Å; I427-I460 HydrophobicContact CD1-CD1 4.22Å; I427-I460 HydrophobicContact CG2-CD1 3.5Å; L428-I460 HydrophobicContact CD1-CG2 4.12Å; L428-I460 HydrophobicContact CD2-CG2 4.12Å; L428-I460 HydrophobicContact CG-CG2 4.2Å; R456-I460 WeakPolarHBondContact O-CG1 3.42Å; R456-I460 PolarHBondContact O-N 3.42Å; A457-I460 PolarHBondContact O-N 3.33Å; I460-R462 VanDerWaalsContact C-N 3.28Å; I460-R462 PolarHBondContact O-N 3.49Å; I460-F463 PolarHBondContact O-N 2.83Å; I460-F463 VanDerWaalsContact O-N 3.08Å; I460-L464 HydrophobicContact CG2-CD1 4.47Å; I460-L464 WeakPolarHBondContact O-CG 3.24Å; I460-L464 PolarHBondContact O-N 2.64Å; I460-F491 HydrophobicContact CG2-CD1 4.32Å; I460-F491 HydrophobicContact CG2-CE1 4.03Å; I460-I494 HydrophobicContact CD1-CG2 4.13Å; I460-I494 HydrophobicContact CG1-CB 4.49Å; I460-I494 HydrophobicContact CG1-CG2 3.57Å; I460-L495 HydrophobicContact CD1-CD2 3.87Å; I460-L495 HydrophobicContact CD1-CG 4.46Å
461	Q	96	Very high	94.5	Very high	31 Å²	31	26.2 Å²	26.2	15%	0.145	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-41	179.4	-159.2	-166.4	24.3	0	0	111.6	I394 L428 A457 R458	I394-Q461 HydrophobicContact CD1-CG 3.69Å; L428-Q461 HydrophobicContact CD2-CB 4.39Å; A457-Q461 WeakPolarHBondContact O-CB 3.01Å; A457-Q461 PolarHBondContact O-N 3.33Å; R458-Q461 PolarHBondContact O-N 3Å
462	R	96.4	Very high	94.1	Very high	53 Å²	53	27 Å²	27	20%	0.2	13%	0.129	C	C	.	.	H	α-helix	trans	-71.3	-39.4	173.9	-64.1	-61.9	175.1	-166.9	-2.6	112	L392 R458 K459 I460 L464 S465 F507	L392-R462 PolarHBondContact O-NH1 3.22Å; R458-R462 VanDerWaalsContact O-CG 3.32Å; R458-R462 WeakPolarHBondContact O-CG 3.23Å; R458-R462 PolarHBondContact O-N 3.04Å; K459-R462 PolarHBondContact O-N 2.89Å; I460-R462 VanDerWaalsContact C-N 3.28Å; I460-R462 PolarHBondContact O-N 3.49Å; R462-L464 PolarHBondContact O-N 3.29Å; R462-S465 VanDerWaalsContact O-CB 3.24Å; R462-S465 WeakPolarHBondContact O-CB 3.5Å; R462-S465 PolarHBondContact O-N 2.94Å; R462-S465 PolarHBondContact O-OG 3.44Å; R462-F507 CarbonylContact C-O 3.57Å; R462-F507 VanDerWaalsContact C-O 3.26Å; R462-F507 HydrophobicContact CB-CB 4.09Å
463	F	97.7	Very high	93.3	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-68.7	-21.2	-180	-165.8	-123.6	0	0	0	113.5	K188 K459 I460 S465 F491 I494 F507 V510 I513	K188-F463 HydrophobicContact CD-CE1 4.36Å; K188-F463 HydrophobicContact CD-CZ 4.29Å; K188-F463 WeakPolarHBondContact CE-O 3.31Å; K188-F463 PolarHBondContact NZ-O 3.34Å; K459-F463 VanDerWaalsContact O-CB 3.29Å; K459-F463 WeakPolarHBondContact O-CB 3.42Å; K459-F463 PolarHBondContact O-N 3.14Å; I460-F463 PolarHBondContact O-N 2.83Å; I460-F463 VanDerWaalsContact O-N 3.08Å; F463-S465 PolarHBondContact O-N 3.43Å; F463-F491 HydrophobicContact CB-CE1 4.4Å; F463-F491 HydrophobicContact CB-CZ 4.44Å; F463-F491 HydrophobicContact CD1-CD1 4.08Å; F463-F491 HydrophobicContact CD1-CD2 4.07Å; F463-F491 AromaticContact CD1-CE1 3.67Å; F463-F491 HydrophobicContact CD1-CE1 3.67Å; F463-F491 AromaticContact CD1-CE2 3.65Å; F463-F491 HydrophobicContact CD1-CE2 3.65Å; F463-F491 HydrophobicContact CD1-CG 4.27Å; F463-F491 AromaticContact CD1-CZ 3.43Å; F463-F491 HydrophobicContact CD1-CZ 3.43Å; F463-F491 VanDerWaalsContact CD1-CZ 3.43Å; F463-F491 AromaticContact CE1-CD2 3.97Å; F463-F491 HydrophobicContact CE1-CD2 3.97Å; F463-F491 AromaticContact CE1-CE2 3.77Å; F463-F491 HydrophobicContact CE1-CE2 3.77Å; F463-F491 HydrophobicContact CE1-CG 4.42Å; F463-F491 HydrophobicContact CE1-CZ 4.06Å; F463-F491 HydrophobicContact CG-CZ 4.28Å; F463-I494 HydrophobicContact CB-CD1 4.16Å; F463-I494 HydrophobicContact CD1-CD1 3.48Å; F463-I494 VanDerWaalsContact CD1-CD1 3.48Å; F463-I494 HydrophobicContact CE1-CD1 4Å; F463-I494 HydrophobicContact CG-CD1 3.84Å; F463-F507 WeakPolarHBondContact CA-O 3.42Å; F463-F507 HydrophobicContact CB-CB 4.08Å; F463-F507 HydrophobicContact CB-CD1 4.06Å; F463-F507 HydrophobicContact CB-CG 4.49Å; F463-F507 HydrophobicContact CD2-CB 4.43Å; F463-F507 AromaticContact CD2-CD1 3.88Å; F463-F507 HydrophobicContact CD2-CD1 3.88Å; F463-F507 HydrophobicContact CG-CD1 4.09Å; F463-F507 PolarHBondContact N-O 3.08Å; F463-V510 HydrophobicContact CD2-CG2 3.88Å; F463-V510 HydrophobicContact CE2-CG2 3.9Å; F463-I513 HydrophobicContact CE1-CD1 4.48Å; F463-I513 HydrophobicContact CE2-CD1 4.23Å; F463-I513 HydrophobicContact CZ-CB 4.19Å; F463-I513 HydrophobicContact CZ-CD1 4.07Å
464	L	96.9	Very high	92.5	Very high	10 Å²	10	34 Å²	34	5%	0.052	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.1	168.6	-70.7	168.2	0	0	0	112.7	V189 L193 P400 L428 I460 R462 F491	V189-L464 HydrophobicContact CB-CB 4.48Å; V189-L464 HydrophobicContact CB-CD2 3.84Å; V189-L464 HydrophobicContact CG2-CD2 3.96Å; L193-L464 HydrophobicContact CD1-CD2 4.22Å; P400-L464 HydrophobicContact CB-CD1 4.05Å; P400-L464 HydrophobicContact CG-CD1 4.29Å; L428-L464 HydrophobicContact CD1-CD1 4.15Å; I460-L464 HydrophobicContact CG2-CD1 4.47Å; I460-L464 WeakPolarHBondContact O-CG 3.24Å; I460-L464 PolarHBondContact O-N 2.64Å; R462-L464 PolarHBondContact O-N 3.29Å; L464-F491 HydrophobicContact CD2-CE1 3.85Å; L464-F491 HydrophobicContact CD2-CE2 4.42Å; L464-F491 HydrophobicContact CD2-CZ 3.49Å; L464-F491 VanDerWaalsContact CD2-CZ 3.49Å; L464-F491 HydrophobicContact CG-CE1 4.05Å; L464-F491 HydrophobicContact CG-CZ 3.96Å
465	S	96.1	Very high	91.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.181	C	C	.	.			trans	-69.6	148.3	171.1	72.8	0	0	0	0	111.7	K188 Y395 R462 F463 M509	K188-S465 WeakPolarHBondContact CE-O 3.44Å; K188-S465 PolarHBondContact NZ-O 3.43Å; K188-S465 VanDerWaalsContact NZ-O 3.08Å; Y395-S465 CarbonylContact O-C 3.26Å; Y395-S465 VanDerWaalsContact O-CA 3.26Å; Y395-S465 WeakPolarHBondContact O-CA 3.23Å; Y395-S465 WeakPolarHBondContact O-CB 3.44Å; R462-S465 VanDerWaalsContact O-CB 3.24Å; R462-S465 WeakPolarHBondContact O-CB 3.5Å; R462-S465 PolarHBondContact O-N 2.94Å; R462-S465 PolarHBondContact O-OG 3.44Å; F463-S465 PolarHBondContact O-N 3.43Å; S465-M509 PolarHBondContact OG-N 3.07Å
466	Q	96.1	Very high	91.3	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.009	20%	0.204	C	C	.	.			trans	-150.9	130.8	-178.3	-177.2	174.8	-34.6	0	0	109.8	G186 Y395 F468 K480	G186-Q466 PolarHBondContact O-NE2 3.35Å; Y395-Q466 PolarHBondContact O-N 2.92Å; Q466-F468 HydrophobicContact CB-CE1 4.42Å; Q466-F468 HydrophobicContact CG-CD1 4.47Å; Q466-F468 PolarHBondContact O-N 2.85Å; Q466-K480 PolarHBondContact NE2-O 3.36Å
467	P	94.8	Very high	90.9	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.032	21%	0.214	C	C	.	.			trans	-71.3	121.2	172.5	30.1	-32.8	0	0	0	109.3	H477 M478 G479 K480 M509	P467-H477 HydrophobicContact CB-CB 3.97Å; P467-M478 WeakPolarHBondContact CG-O 3.26Å; P467-G479 WeakPolarHBondContact O-CA 3.5Å; P467-K480 HydrophobicContact CG-CB 4.26Å; P467-K480 HydrophobicContact CG-CG 3.8Å; P467-K480 PolarHBondContact O-N 3.06Å; P467-M509 HydrophobicContact CB-SD 4.36Å
468	F	93.6	Very high	90.6	Very high	12 Å²	12	47 Å²	47	5%	0.053	25%	0.248	C	C	.	.			trans	-84.8	144.6	176.8	-73.9	-7.7	0	0	0	111.2	I187 V214 L215 E218 P396 Q466 V470 A471 E472	I187-F468 HydrophobicContact CD1-CE1 4.17Å; I187-F468 HydrophobicContact CD1-CZ 3.91Å; I187-F468 HydrophobicContact CG1-CE1 4Å; I187-F468 HydrophobicContact CG1-CZ 4.23Å; I187-F468 HydrophobicContact CG2-CE1 4.09Å; I187-F468 HydrophobicContact CG2-CZ 4.14Å; V214-F468 HydrophobicContact CG1-CD2 4.1Å; L215-F468 HydrophobicContact CB-CE2 4.48Å; L215-F468 HydrophobicContact CD1-CE2 3.83Å; L215-F468 HydrophobicContact CD1-CZ 3.72Å; E218-F468 HydrophobicContact CB-CB 4.37Å; E218-F468 HydrophobicContact CB-CD1 4.48Å; E218-F468 HydrophobicContact CB-CD2 3.69Å; E218-F468 HydrophobicContact CB-CE2 3.97Å; E218-F468 HydrophobicContact CB-CG 3.97Å; E218-F468 HydrophobicContact CB-CZ 4.44Å; E218-F468 HydrophobicContact CG-CB 4.01Å; E218-F468 HydrophobicContact CG-CD1 3.69Å; E218-F468 HydrophobicContact CG-CD2 3.82Å; E218-F468 HydrophobicContact CG-CE1 3.99Å; E218-F468 HydrophobicContact CG-CE2 4.12Å; E218-F468 HydrophobicContact CG-CG 3.58Å; E218-F468 HydrophobicContact CG-CZ 4.18Å; P396-F468 HydrophobicContact CB-CE2 3.94Å; P396-F468 HydrophobicContact CB-CZ 3.61Å; P396-F468 HydrophobicContact CG-CE1 4.14Å; P396-F468 HydrophobicContact CG-CE2 4.4Å; P396-F468 HydrophobicContact CG-CZ 3.58Å; Q466-F468 HydrophobicContact CB-CE1 4.42Å; Q466-F468 HydrophobicContact CG-CD1 4.47Å; Q466-F468 PolarHBondContact O-N 2.85Å; F468-V470 HydrophobicContact CB-CG2 4.31Å; F468-A471 HydrophobicContact CB-CB 3.99Å; F468-A471 PolarHBondContact O-N 3.02Å; F468-A471 VanDerWaalsContact O-N 3.12Å; F468-E472 PolarHBondContact O-N 3.48Å
469	Q	89.3	Confident	90.4	Very high	76 Å²	76	43.8 Å²	43.8	36%	0.355	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-67.9	-39	-179.8	-174.9	166.4	13.6	0	0	111.7	E218 N221 K225 A471 E472	E218-Q469 PolarHBondContact OE1-N 3.49Å; E218-Q469 PolarHBondContact OE2-N 2.87Å; N221-Q469 PolarHBondContact ND2-OE1 3.17Å; K225-Q469 VanDerWaalsContact NZ-NE2 3.15Å; Q469-A471 PolarHBondContact O-N 2.98Å; Q469-E472 WeakPolarHBondContact O-CB 3.23Å; Q469-E472 VanDerWaalsContact O-CG 3.31Å; Q469-E472 WeakPolarHBondContact O-CG 3.44Å; Q469-E472 PolarHBondContact O-N 3.47Å
470	V	84.6	Confident	90.3	Very high	16 Å²	16	46.7 Å²	46.7	10%	0.097	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-65.9	-17.8	175.6	-57.8	0	0	0	0	112.5	V214 M217 E218 N221 F468	V214-V470 HydrophobicContact CG1-CG2 3.97Å; M217-V470 HydrophobicContact CB-CB 4.3Å; M217-V470 HydrophobicContact CB-CG1 4.11Å; M217-V470 HydrophobicContact CB-CG2 4.07Å; E218-V470 HydrophobicContact CB-CG2 4.01Å; E218-V470 WeakPolarHBondContact OE2-CG2 3.38Å; E218-V470 PolarHBondContact OE2-N 2.91Å; E218-V470 VanDerWaalsContact OE2-N 3.16Å; N221-V470 HydrophobicContact CB-CG1 4.01Å; F468-V470 HydrophobicContact CB-CG2 4.31Å
471	A	86	Confident	90	Very high	12 Å²	12	50.8 Å²	50.8	10%	0.099	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-97.8	3.3	-179.9	0	0	0	0	0	113.9	V214 F468 Q469 V473 F474 T475	V214-A471 HydrophobicContact CG1-CB 4.24Å; F468-A471 HydrophobicContact CB-CB 3.99Å; F468-A471 PolarHBondContact O-N 3.02Å; F468-A471 VanDerWaalsContact O-N 3.12Å; Q469-A471 PolarHBondContact O-N 2.98Å; A471-V473 PolarHBondContact O-N 3.36Å; A471-F474 PolarHBondContact O-N 3.49Å; A471-F474 VanDerWaalsContact O-N 3.1Å; A471-T475 HydrophobicContact CB-CG2 4.26Å; A471-T475 PolarHBondContact O-N 2.91Å; A471-T475 PolarHBondContact O-OG1 3.4Å
472	E	86.4	Confident	90	Very high	69 Å²	69	49.3 Å²	49.3	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-55.3	-40.6	178.2	-77.9	-179.6	-178.9	0	0	111.9	F468 Q469 F474 G476 H477 G479	F468-E472 PolarHBondContact O-N 3.48Å; Q469-E472 WeakPolarHBondContact O-CB 3.23Å; Q469-E472 VanDerWaalsContact O-CG 3.31Å; Q469-E472 WeakPolarHBondContact O-CG 3.44Å; Q469-E472 PolarHBondContact O-N 3.47Å; E472-F474 PolarHBondContact O-N 3.5Å; E472-G476 WeakPolarHBondContact O-CA 3.49Å; E472-G476 PolarHBondContact O-N 3.43Å; E472-H477 WeakPolarHBondContact CG-O 3.36Å; E472-G479 PolarHBondContact OE1-N 3.36Å
473	V	77.2	Confident	89.9	Confident	110 Å²	110	49.5 Å²	49.5	67%	0.667	28%	0.276	S	S	*	.	H	α-helix	trans	-64.3	-27.5	-179.7	-63.3	0	0	0	0	113.4	A471	A471-V473 PolarHBondContact O-N 3.36Å
474	F	78.1	Confident	89.8	Confident	136 Å²	136	51 Å²	51	60%	0.596	28%	0.284	S	S	*	.	H	α-helix	trans	-96	-36.8	-178.9	-54.9	-65.8	0	0	0	112.5	A471 E472	A471-F474 PolarHBondContact O-N 3.49Å; A471-F474 VanDerWaalsContact O-N 3.1Å; E472-F474 PolarHBondContact O-N 3.5Å
475	T	82.8	Confident	89.8	Confident	60 Å²	60	59 Å²	59	37%	0.368	32%	0.319	S	S	.	.	H	α-helix	trans	-97.7	-23.3	-171.7	63.2	0	0	0	0	113.4	A471 H477	A471-T475 HydrophobicContact CB-CG2 4.26Å; A471-T475 PolarHBondContact O-N 2.91Å; A471-T475 PolarHBondContact O-OG1 3.4Å; T475-H477 PolarHBondContact O-N 2.98Å; T475-H477 PolarHBondContact OG1-N 3.16Å
476	G	83.9	Confident	89.8	Confident	71 Å²	71	62.7 Å²	62.7	73%	0.732	34%	0.336	S	S	*	.			trans	69.4	-0.6	-172.3	0	0	0	0	0	114.5	E472	E472-G476 WeakPolarHBondContact O-CA 3.49Å; E472-G476 PolarHBondContact O-N 3.43Å
477	H	86.9	Confident	89.9	Confident	89 Å²	89	62.6 Å²	62.6	41%	0.412	34%	0.336	S	S	.	.	S	Bend	trans	-91	131.4	175.8	-69	-66.7	0	0	0	110	P467 E472 T475 G479	P467-H477 HydrophobicContact CB-CB 3.97Å; E472-H477 WeakPolarHBondContact CG-O 3.36Å; T475-H477 PolarHBondContact O-N 2.98Å; T475-H477 PolarHBondContact OG1-N 3.16Å; H477-G479 PolarHBondContact O-N 3.08Å
478	M	90.9	Very high	90	Very high	144 Å²	144	63.2 Å²	63.2	71%	0.709	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-62.3	131.9	174.7	-74.3	-155.6	-76.4	0	0	111.2	P467	P467-M478 WeakPolarHBondContact CG-O 3.26Å
479	G	91.6	Very high	90.2	Very high	19 Å²	19	66.8 Å²	66.8	20%	0.196	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-64.2	146.2	179.2	0	0	0	0	0	112.1	P467 E472 H477	P467-G479 WeakPolarHBondContact O-CA 3.5Å; E472-G479 PolarHBondContact OE1-N 3.36Å; H477-G479 PolarHBondContact O-N 3.08Å
480	K	92.9	Very high	90.5	Very high	64 Å²	64	63.1 Å²	63.1	28%	0.278	34%	0.337	S	S	.	.			trans	-127.6	129.4	-178.6	-61.3	-67.2	177.3	165.9	0	109.6	Q466 P467 E515	Q466-K480 PolarHBondContact NE2-O 3.36Å; P467-K480 HydrophobicContact CG-CB 4.26Å; P467-K480 HydrophobicContact CG-CG 3.8Å; P467-K480 PolarHBondContact O-N 3.06Å; K480-E515 WeakPolarHBondContact CD-OE1 3.49Å; K480-E515 WeakPolarHBondContact CE-OE1 3.4Å; K480-E515 WeakPolarHBondContact CE-OE2 3.46Å; K480-E515 IonicContact NZ-OE1 3.77Å; K480-E515 PolarHBondContact NZ-OE1 3.21Å; K480-E515 IonicContact NZ-OE2 3.4Å
481	L	92.8	Very high	91.1	Very high	86 Å²	86	62.4 Å²	62.4	45%	0.45	33%	0.332	S	S	.	.			trans	-103.7	113.5	169.1	-171.1	156.9	0	0	0	107.2	N222	N222-L481 HydrophobicContact CB-CD1 4.16Å
482	V	95	Very high	91.7	Very high	1 Å²	1	66 Å²	66	1%	0.006	35%	0.347	C	S	.	.			trans	-100	120.6	-172	-173.2	0	0	0	0	110.1	G186 K188 E486 T487	G186-V482 WeakPolarHBondContact CA-O 3.34Å; G186-V482 PolarHBondContact O-N 3.14Å; G186-V482 VanDerWaalsContact O-N 3.16Å; K188-V482 HydrophobicContact CD-CG1 4.37Å; K188-V482 HydrophobicContact CD-CG2 4.25Å; K188-V482 HydrophobicContact CG-CB 4.02Å; K188-V482 HydrophobicContact CG-CG1 4.04Å; K188-V482 HydrophobicContact CG-CG2 4.07Å; V482-E486 HydrophobicContact CG1-CB 4.28Å; V482-T487 WeakPolarHBondContact CG1-OG1 3.31Å
483	P	95.3	Very high	92.2	Very high	56 Å²	56	64 Å²	64	36%	0.364	34%	0.338	S	S	.	.			trans	-62.8	143.4	174.3	-21.9	33.3	0	0	0	112.6	K485 E486 T487	P483-K485 VanDerWaalsContact C-N 3.27Å; P483-K485 PolarHBondContact O-N 3.43Å; P483-K485 VanDerWaalsContact O-N 3.15Å; P483-E486 HydrophobicContact CB-CG 4.4Å; P483-E486 WeakPolarHBondContact CD-OE2 3.29Å; P483-E486 HydrophobicContact CG-CG 4.45Å; P483-E486 PolarHBondContact O-N 3.21Å; P483-T487 PolarHBondContact O-N 3.42Å; P483-T487 PolarHBondContact O-OG1 2.92Å
484	L	95.1	Very high	93.1	Very high	32 Å²	32	58.9 Å²	58.9	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-52	-41.7	-179.6	177.2	62.5	0	0	0	113.6	I182 V184 D191 E486 T487 I488	I182-L484 HydrophobicContact CD1-CD2 4.14Å; V184-L484 HydrophobicContact CG1-CB 4.27Å; V184-L484 HydrophobicContact CG2-CB 4.46Å; V184-L484 HydrophobicContact CG2-CD2 4.34Å; D191-L484 HydrophobicContact CB-CD1 4.07Å; L484-E486 VanDerWaalsContact C-N 3.32Å; L484-E486 PolarHBondContact O-N 3.46Å; L484-T487 WeakPolarHBondContact O-CB 3.42Å; L484-T487 PolarHBondContact O-N 3.27Å; L484-I488 HydrophobicContact CD1-CD1 4.03Å; L484-I488 HydrophobicContact CD1-CG1 4.23Å; L484-I488 HydrophobicContact CG-CD1 3.98Å; L484-I488 WeakPolarHBondContact O-CG1 3.37Å; L484-I488 PolarHBondContact O-N 2.79Å
485	K	96.3	Very high	93.9	Very high	180 Å²	180	54.4 Å²	54.4	78%	0.783	29%	0.289	S	S	*	.	H	α-helix	trans	-62.7	-38.1	179.6	-65.8	-177.3	178.8	-179.7	0	112.6	P483 K489	P483-K485 VanDerWaalsContact C-N 3.27Å; P483-K485 PolarHBondContact O-N 3.43Å; P483-K485 VanDerWaalsContact O-N 3.15Å; K485-K489 WeakPolarHBondContact O-CB 3.28Å; K485-K489 PolarHBondContact O-N 3.11Å; K485-K489 VanDerWaalsContact O-N 3.11Å
486	E	96.6	Very high	94.5	Very high	76 Å²	76	54.7 Å²	54.7	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-73.1	-35.7	177.9	-66.3	-179.4	-175	0	0	111	V482 P483 L484 G490 P512	V482-E486 HydrophobicContact CG1-CB 4.28Å; P483-E486 HydrophobicContact CB-CG 4.4Å; P483-E486 WeakPolarHBondContact CD-OE2 3.29Å; P483-E486 HydrophobicContact CG-CG 4.45Å; P483-E486 PolarHBondContact O-N 3.21Å; L484-E486 VanDerWaalsContact C-N 3.32Å; L484-E486 PolarHBondContact O-N 3.46Å; E486-G490 PolarHBondContact O-N 2.99Å; E486-P512 HydrophobicContact CB-CB 4.32Å; E486-P512 WeakPolarHBondContact OE2-CB 3.48Å
487	T	96.9	Very high	95	Very high	1 Å²	1	52 Å²	52	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-57.6	-56.3	171.4	-56.5	0	0	0	0	110.6	K188 L192 V482 P483 L484 K489 G490 F491	K188-T487 HydrophobicContact CB-CG2 4.15Å; K188-T487 HydrophobicContact CG-CG2 4.11Å; L192-T487 HydrophobicContact CB-CG2 3.98Å; V482-T487 WeakPolarHBondContact CG1-OG1 3.31Å; P483-T487 PolarHBondContact O-N 3.42Å; P483-T487 PolarHBondContact O-OG1 2.92Å; L484-T487 WeakPolarHBondContact O-CB 3.42Å; L484-T487 PolarHBondContact O-N 3.27Å; T487-K489 PolarHBondContact O-N 3.42Å; T487-G490 PolarHBondContact O-N 3.21Å; T487-F491 HydrophobicContact CG2-CD2 3.89Å; T487-F491 HydrophobicContact CG2-CE2 3.91Å; T487-F491 VanDerWaalsContact O-CD2 3.26Å; T487-F491 WeakPolarHBondContact O-CD2 3.5Å; T487-F491 PolarHBondContact O-N 3.25Å; T487-F491 VanDerWaalsContact O-N 3.09Å
488	I	97.3	Very high	95.4	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.092	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-49.6	-177.8	-63.7	165.7	0	0	0	110.7	E416 H417 V420 L484 G490 F491 Q492	E416-I488 HydrophobicContact CG-CG2 4.05Å; H417-I488 HydrophobicContact CB-CD1 3.76Å; H417-I488 HydrophobicContact CB-CG1 4.4Å; V420-I488 HydrophobicContact CB-CG2 4.49Å; V420-I488 HydrophobicContact CG2-CG2 4.13Å; L484-I488 HydrophobicContact CD1-CD1 4.03Å; L484-I488 HydrophobicContact CD1-CG1 4.23Å; L484-I488 HydrophobicContact CG-CD1 3.98Å; L484-I488 WeakPolarHBondContact O-CG1 3.37Å; L484-I488 PolarHBondContact O-N 2.79Å; I488-G490 PolarHBondContact O-N 3.15Å; I488-F491 PolarHBondContact O-N 3.21Å; I488-Q492 VanDerWaalsContact O-CB 3.31Å; I488-Q492 WeakPolarHBondContact O-CB 3.32Å; I488-Q492 PolarHBondContact O-N 3.15Å
489	K	97.4	Very high	95.7	Very high	86 Å²	86	47.7 Å²	47.7	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-55.7	-49.9	177.8	-179.6	-167.6	168.6	-158.4	0	111.7	K485 T487 F491 Q492 Q493 E514	K485-K489 WeakPolarHBondContact O-CB 3.28Å; K485-K489 PolarHBondContact O-N 3.11Å; K485-K489 VanDerWaalsContact O-N 3.11Å; T487-K489 PolarHBondContact O-N 3.42Å; K489-F491 PolarHBondContact O-N 3.06Å; K489-Q492 PolarHBondContact O-N 3.19Å; K489-Q493 WeakPolarHBondContact O-CG 3.44Å; K489-Q493 PolarHBondContact O-N 3.41Å; K489-E514 IonicContact NZ-OE1 3.93Å; K489-E514 PolarHBondContact NZ-OE1 3.05Å
490	G	96.5	Very high	95.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-60.6	-46.6	-177.7	0	0	0	0	0	112.7	E486 T487 I488 Q493 I494	E486-G490 PolarHBondContact O-N 2.99Å; T487-G490 PolarHBondContact O-N 3.21Å; I488-G490 PolarHBondContact O-N 3.15Å; G490-Q493 PolarHBondContact O-N 3.28Å; G490-I494 VanDerWaalsContact O-CG1 3.29Å; G490-I494 WeakPolarHBondContact O-CG1 3.39Å; G490-I494 PolarHBondContact O-N 3.39Å
491	F	97.8	Very high	95.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.1	-35.4	177.9	-78.2	-80.8	0	0	0	112.7	K188 L192 V420 V424 I460 F463 L464 T487 I488 K489 I494 L495	K188-F491 HydrophobicContact CB-CE2 4.28Å; K188-F491 HydrophobicContact CD-CE2 4.38Å; L192-F491 HydrophobicContact CD2-CB 4.08Å; L192-F491 HydrophobicContact CD2-CD1 3.94Å; L192-F491 HydrophobicContact CD2-CD2 3.48Å; L192-F491 VanDerWaalsContact CD2-CD2 3.48Å; L192-F491 HydrophobicContact CD2-CE1 4.24Å; L192-F491 HydrophobicContact CD2-CE2 3.83Å; L192-F491 HydrophobicContact CD2-CG 3.55Å; L192-F491 HydrophobicContact CD2-CZ 4.2Å; V420-F491 HydrophobicContact CG1-CB 3.71Å; V424-F491 HydrophobicContact CG2-CB 4.13Å; V424-F491 HydrophobicContact CG2-CD1 3.74Å; V424-F491 HydrophobicContact CG2-CG 4.23Å; I460-F491 HydrophobicContact CG2-CD1 4.32Å; I460-F491 HydrophobicContact CG2-CE1 4.03Å; F463-F491 HydrophobicContact CB-CE1 4.4Å; F463-F491 HydrophobicContact CB-CZ 4.44Å; F463-F491 HydrophobicContact CD1-CD1 4.08Å; F463-F491 HydrophobicContact CD1-CD2 4.07Å; F463-F491 AromaticContact CD1-CE1 3.67Å; F463-F491 HydrophobicContact CD1-CE1 3.67Å; F463-F491 AromaticContact CD1-CE2 3.65Å; F463-F491 HydrophobicContact CD1-CE2 3.65Å; F463-F491 HydrophobicContact CD1-CG 4.27Å; F463-F491 AromaticContact CD1-CZ 3.43Å; F463-F491 HydrophobicContact CD1-CZ 3.43Å; F463-F491 VanDerWaalsContact CD1-CZ 3.43Å; F463-F491 AromaticContact CE1-CD2 3.97Å; F463-F491 HydrophobicContact CE1-CD2 3.97Å; F463-F491 AromaticContact CE1-CE2 3.77Å; F463-F491 HydrophobicContact CE1-CE2 3.77Å; F463-F491 HydrophobicContact CE1-CG 4.42Å; F463-F491 HydrophobicContact CE1-CZ 4.06Å; F463-F491 HydrophobicContact CG-CZ 4.28Å; L464-F491 HydrophobicContact CD2-CE1 3.85Å; L464-F491 HydrophobicContact CD2-CE2 4.42Å; L464-F491 HydrophobicContact CD2-CZ 3.49Å; L464-F491 VanDerWaalsContact CD2-CZ 3.49Å; L464-F491 HydrophobicContact CG-CE1 4.05Å; L464-F491 HydrophobicContact CG-CZ 3.96Å; T487-F491 HydrophobicContact CG2-CD2 3.89Å; T487-F491 HydrophobicContact CG2-CE2 3.91Å; T487-F491 VanDerWaalsContact O-CD2 3.26Å; T487-F491 WeakPolarHBondContact O-CD2 3.5Å; T487-F491 PolarHBondContact O-N 3.25Å; T487-F491 VanDerWaalsContact O-N 3.09Å; I488-F491 PolarHBondContact O-N 3.21Å; K489-F491 PolarHBondContact O-N 3.06Å; F491-I494 PolarHBondContact O-N 3.09Å; F491-L495 WeakPolarHBondContact O-CB 3.34Å; F491-L495 WeakPolarHBondContact O-CG 3.29Å; F491-L495 PolarHBondContact O-N 3.15Å
492	Q	97.6	Very high	95.9	Very high	87 Å²	87	49.5 Å²	49.5	41%	0.407	25%	0.251	S	S	.	.	H	α-helix	trans	-61.3	-45.2	175.5	-171.7	-179.1	17.9	0	0	112	V420 I488 K489 L495 A496	V420-Q492 HydrophobicContact CG2-CB 3.83Å; V420-Q492 HydrophobicContact CG2-CG 4.06Å; I488-Q492 VanDerWaalsContact O-CB 3.31Å; I488-Q492 WeakPolarHBondContact O-CB 3.32Å; I488-Q492 PolarHBondContact O-N 3.15Å; K489-Q492 PolarHBondContact O-N 3.19Å; Q492-L495 PolarHBondContact O-N 3.41Å; Q492-A496 WeakPolarHBondContact O-CB 3.41Å; Q492-A496 PolarHBondContact O-N 3.29Å
493	Q	97	Very high	95.9	Very high	28 Å²	28	52.1 Å²	52.1	13%	0.131	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-35.5	179.8	-67.2	-178.9	-65.5	0	0	112.5	K489 G490 A496 G497 E498 Y499	K489-Q493 WeakPolarHBondContact O-CG 3.44Å; K489-Q493 PolarHBondContact O-N 3.41Å; G490-Q493 PolarHBondContact O-N 3.28Å; Q493-A496 PolarHBondContact O-N 2.93Å; Q493-G497 PolarHBondContact O-N 3.46Å; Q493-E498 HydrophobicContact CB-CB 4.34Å; Q493-E498 WeakPolarHBondContact CG-OE2 3.28Å; Q493-E498 PolarHBondContact NE2-OE2 2.73Å; Q493-E498 PolarHBondContact O-N 3Å; Q493-E498 VanDerWaalsContact O-N 3.08Å; Q493-Y499 HydrophobicContact CB-CD2 3.94Å; Q493-Y499 HydrophobicContact CB-CE2 3.5Å; Q493-Y499 VanDerWaalsContact CB-CE2 3.5Å; Q493-Y499 HydrophobicContact CG-CE2 4.31Å; Q493-Y499 PolarHBondContact OE1-OH 2.98Å
494	I	95.7	Very high	95.9	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-43.4	173.2	-63.6	165.4	0	0	0	110.5	I460 F463 G490 F491 A496 G497 Y499 F507 I513	I460-I494 HydrophobicContact CD1-CG2 4.13Å; I460-I494 HydrophobicContact CG1-CB 4.49Å; I460-I494 HydrophobicContact CG1-CG2 3.57Å; F463-I494 HydrophobicContact CB-CD1 4.16Å; F463-I494 HydrophobicContact CD1-CD1 3.48Å; F463-I494 VanDerWaalsContact CD1-CD1 3.48Å; F463-I494 HydrophobicContact CE1-CD1 4Å; F463-I494 HydrophobicContact CG-CD1 3.84Å; G490-I494 VanDerWaalsContact O-CG1 3.29Å; G490-I494 WeakPolarHBondContact O-CG1 3.39Å; G490-I494 PolarHBondContact O-N 3.39Å; F491-I494 PolarHBondContact O-N 3.09Å; I494-A496 VanDerWaalsContact C-N 3.32Å; I494-A496 PolarHBondContact O-N 3.48Å; I494-G497 PolarHBondContact O-N 3.04Å; I494-G497 VanDerWaalsContact O-N 3.16Å; I494-Y499 HydrophobicContact CG1-CD2 4.28Å; I494-F507 HydrophobicContact CD1-CD1 3.96Å; I494-F507 HydrophobicContact CD1-CE1 3.69Å; I494-F507 HydrophobicContact CG1-CE1 3.9Å; I494-I513 HydrophobicContact CD1-CD1 3.94Å; I494-I513 HydrophobicContact CG1-CD1 4.06Å
495	L	95.9	Very high	95.8	Very high	41 Å²	41	55.5 Å²	55.5	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-37.7	176.3	-74.9	172.7	0	0	0	112.4	V420 V424 I427 R456 I460 F491 Q492 G497	V420-L495 HydrophobicContact CG1-CD1 4.24Å; V424-L495 HydrophobicContact CG2-CD1 4Å; V424-L495 HydrophobicContact CG2-CD2 4.48Å; V424-L495 HydrophobicContact CG2-CG 4.34Å; I427-L495 HydrophobicContact CG2-CD2 4.08Å; R456-L495 PolarHBondContact NH1-O 3.04Å; I460-L495 HydrophobicContact CD1-CD2 3.87Å; I460-L495 HydrophobicContact CD1-CG 4.46Å; F491-L495 WeakPolarHBondContact O-CB 3.34Å; F491-L495 WeakPolarHBondContact O-CG 3.29Å; F491-L495 PolarHBondContact O-N 3.15Å; Q492-L495 PolarHBondContact O-N 3.41Å; L495-G497 PolarHBondContact O-N 3.47Å
496	A	96.1	Very high	95.8	Very high	67 Å²	67	46.9 Å²	46.9	55%	0.554	24%	0.24	S	C	*	.	H	α-helix	trans	-70.2	-17.2	176.5	0	0	0	0	0	113.4	Q492 Q493 I494 E498	Q492-A496 WeakPolarHBondContact O-CB 3.41Å; Q492-A496 PolarHBondContact O-N 3.29Å; Q493-A496 PolarHBondContact O-N 2.93Å; I494-A496 VanDerWaalsContact C-N 3.32Å; I494-A496 PolarHBondContact O-N 3.48Å; A496-E498 HydrophobicContact CB-CG 4.37Å
497	G	94.3	Very high	95.8	Very high	15 Å²	15	43.3 Å²	43.3	16%	0.155	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	11.4	179.8	0	0	0	0	0	115.1	Q493 I494 L495 Y499 D500	Q493-G497 PolarHBondContact O-N 3.46Å; I494-G497 PolarHBondContact O-N 3.04Å; I494-G497 VanDerWaalsContact O-N 3.16Å; L495-G497 PolarHBondContact O-N 3.47Å; G497-Y499 PolarHBondContact O-N 3.16Å; G497-Y499 VanDerWaalsContact O-N 3.15Å; G497-D500 WeakPolarHBondContact CA-OD2 3.33Å; G497-D500 PolarHBondContact O-N 3.23Å
498	E	95.6	Very high	95.7	Very high	105 Å²	105	46.7 Å²	46.7	49%	0.491	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.1	-179	-66.3	-179.4	-161.5	0	0	112.1	Q493 A496 H501	Q493-E498 HydrophobicContact CB-CB 4.34Å; Q493-E498 WeakPolarHBondContact CG-OE2 3.28Å; Q493-E498 PolarHBondContact NE2-OE2 2.73Å; Q493-E498 PolarHBondContact O-N 3Å; Q493-E498 VanDerWaalsContact O-N 3.08Å; A496-E498 HydrophobicContact CB-CG 4.37Å; E498-H501 PolarHBondContact O-CE1 2.79Å; E498-H501 PolarHBondContact O-ND1 3.47Å
499	Y	95.6	Very high	95.6	Very high	36 Å²	36	46.8 Å²	46.8	14%	0.141	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	24.7	-178.2	-57.7	-70.8	0	0	0	114	K459 Q493 I494 G497 H501 L502 I513 V517	K459-Y499 PolarHBondContact NZ-O 3.46Å; Q493-Y499 HydrophobicContact CB-CD2 3.94Å; Q493-Y499 HydrophobicContact CB-CE2 3.5Å; Q493-Y499 VanDerWaalsContact CB-CE2 3.5Å; Q493-Y499 HydrophobicContact CG-CE2 4.31Å; Q493-Y499 PolarHBondContact OE1-OH 2.98Å; I494-Y499 HydrophobicContact CG1-CD2 4.28Å; G497-Y499 PolarHBondContact O-N 3.16Å; G497-Y499 VanDerWaalsContact O-N 3.15Å; Y499-H501 PolarHBondContact O-N 3.41Å; Y499-L502 HydrophobicContact CD1-CD1 3.64Å; Y499-L502 HydrophobicContact CD1-CG 4.32Å; Y499-L502 HydrophobicContact CE1-CD1 4.5Å; Y499-L502 HydrophobicContact CG-CD1 4.23Å; Y499-L502 PolarHBondContact O-N 3.42Å; Y499-I513 HydrophobicContact CD2-CD1 3.99Å; Y499-I513 HydrophobicContact CD2-CG1 4.02Å; Y499-I513 HydrophobicContact CE2-CD1 3.91Å; Y499-I513 HydrophobicContact CE2-CG1 3.4Å; Y499-I513 VanDerWaalsContact CE2-CG1 3.4Å; Y499-V517 HydrophobicContact CD1-CG2 4.15Å; Y499-V517 HydrophobicContact CE1-CG2 3.54Å
500	D	94.1	Very high	95.5	Very high	50 Å²	50	43 Å²	43	27%	0.267	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25.7	178.3	-78.6	-17.9	0	0	0	113.3	R456 K459 G497	R456-D500 VanDerWaalsContact CG-OD1 3.28Å; R456-D500 WeakPolarHBondContact CG-OD1 3.49Å; R456-D500 IonicContact CZ-OD1 3Å; R456-D500 IonicContact CZ-OD2 3.29Å; R456-D500 VanDerWaalsContact CZ-OD2 3.29Å; R456-D500 IonicContact NE-OD1 2.86Å; R456-D500 PolarHBondContact NE-OD1 3.45Å; R456-D500 IonicContact NE-OD2 3.06Å; R456-D500 PolarHBondContact NE-OD2 2.95Å; R456-D500 IonicContact NH2-OD2 2.69Å; R456-D500 PolarHBondContact NH2-OD2 3.31Å; K459-D500 VanDerWaalsContact NZ-CA 3.3Å; K459-D500 PolarHBondContact NZ-O 2.93Å; G497-D500 WeakPolarHBondContact CA-OD2 3.33Å; G497-D500 PolarHBondContact O-N 3.23Å
501	H	93.7	Very high	95.4	Very high	143 Å²	143	43 Å²	43	66%	0.662	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-15.2	178.7	62.2	-81	0	0	0	114.3	E498 Y499	E498-H501 PolarHBondContact O-CE1 2.79Å; E498-H501 PolarHBondContact O-ND1 3.47Å; Y499-H501 PolarHBondContact O-N 3.41Å
502	L	94.9	Very high	95.3	Very high	15 Å²	15	44 Å²	44	8%	0.079	23%	0.227	C	C	.	.	S	Bend	trans	-82.4	147.8	-178.9	-60.7	-171.8	0	0	0	112.3	K459 Y499 F507 V517 A520	K459-L502 WeakPolarHBondContact CE-O 3.36Å; K459-L502 PolarHBondContact NZ-O 3.31Å; Y499-L502 HydrophobicContact CD1-CD1 3.64Å; Y499-L502 HydrophobicContact CD1-CG 4.32Å; Y499-L502 HydrophobicContact CE1-CD1 4.5Å; Y499-L502 HydrophobicContact CG-CD1 4.23Å; Y499-L502 PolarHBondContact O-N 3.42Å; L502-F507 HydrophobicContact CB-CE2 3.92Å; L502-F507 HydrophobicContact CB-CZ 4.24Å; L502-F507 HydrophobicContact CD1-CZ 4.23Å; L502-V517 HydrophobicContact CD1-CG2 4.16Å; L502-A520 HydrophobicContact CD1-CB 4.37Å; L502-A520 HydrophobicContact CD2-CB 3.72Å; L502-A520 HydrophobicContact CG-CB 4.45Å
503	P	95	Very high	95.2	Very high	55 Å²	55	39.9 Å²	39.9	36%	0.357	21%	0.208	S	C	.	.			trans	-71.5	151.7	176	29.9	-34.3	0	0	0	112.2	Q505 A506 A520 L523	P503-Q505 VanDerWaalsContact C-N 3.26Å; P503-Q505 PolarHBondContact O-N 3.41Å; P503-A506 HydrophobicContact CG-CB 4.18Å; P503-A506 VanDerWaalsContact O-CB 3.3Å; P503-A506 WeakPolarHBondContact O-CB 3.24Å; P503-A506 PolarHBondContact O-N 3.15Å; P503-A506 VanDerWaalsContact O-N 3.16Å; P503-A520 HydrophobicContact CG-CB 4.48Å; P503-L523 HydrophobicContact CG-CD1 4.39Å
504	E	93.9	Very high	95.1	Very high	37 Å²	37	42.5 Å²	42.5	17%	0.173	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-58	-36.6	-179.4	-65.7	178.4	-165.9	0	0	113.1	R458 K459 A506 F507	R458-E504 HydrophobicContact CB-CG 4.35Å; R458-E504 WeakPolarHBondContact CD-OE1 3.22Å; R458-E504 IonicContact CZ-OE1 3.62Å; R458-E504 VanDerWaalsContact CZ-OE1 3.26Å; R458-E504 IonicContact CZ-OE2 2.81Å; R458-E504 IonicContact NE-OE1 3.57Å; R458-E504 PolarHBondContact NE-OE1 3.47Å; R458-E504 IonicContact NE-OE2 3.26Å; R458-E504 PolarHBondContact NE-OE2 2.96Å; R458-E504 IonicContact NH1-OE1 2.96Å; R458-E504 IonicContact NH2-OE1 3.86Å; R458-E504 IonicContact NH2-OE2 2.82Å; R458-E504 PolarHBondContact NH2-OE2 3.44Å; K459-E504 HydrophobicContact CG-CG 4.25Å; E504-A506 PolarHBondContact O-N 3.33Å; E504-F507 PolarHBondContact O-N 3.4Å; E504-F507 VanDerWaalsContact O-N 3.12Å
505	Q	94.1	Very high	95.1	Very high	122 Å²	122	45 Å²	45	57%	0.57	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-64.3	-23.2	-177.8	-70	76.2	9.2	0	0	112.9	P503 F507 Y508 L523	P503-Q505 VanDerWaalsContact C-N 3.26Å; P503-Q505 PolarHBondContact O-N 3.41Å; Q505-F507 PolarHBondContact O-N 2.95Å; Q505-Y508 PolarHBondContact O-N 3.49Å; Q505-L523 HydrophobicContact CB-CD1 4.1Å
506	A	95.8	Very high	95	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.3	-29.1	176.2	0	0	0	0	0	112.3	P503 E504 V510 A516 A520	P503-A506 HydrophobicContact CG-CB 4.18Å; P503-A506 VanDerWaalsContact O-CB 3.3Å; P503-A506 WeakPolarHBondContact O-CB 3.24Å; P503-A506 PolarHBondContact O-N 3.15Å; P503-A506 VanDerWaalsContact O-N 3.16Å; E504-A506 PolarHBondContact O-N 3.33Å; A506-V510 WeakPolarHBondContact O-CG1 3.42Å; A506-A516 WeakPolarHBondContact CB-O 3.42Å; A506-A516 WeakPolarHBondContact O-CA 3.35Å; A506-A520 HydrophobicContact CB-CB 3.76Å
507	F	96.6	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-87	-5.7	-178.8	-64.1	-86.6	0	0	0	113.9	K459 R462 F463 I494 L502 E504 Q505 I513 A516	K459-F507 HydrophobicContact CB-CD2 3.95Å; K459-F507 HydrophobicContact CB-CE2 4.1Å; K459-F507 HydrophobicContact CB-CG 4.27Å; K459-F507 HydrophobicContact CD-CD2 4.23Å; K459-F507 HydrophobicContact CD-CE2 3.68Å; K459-F507 HydrophobicContact CD-CZ 4.23Å; K459-F507 HydrophobicContact CG-CD2 3.77Å; K459-F507 HydrophobicContact CG-CE2 3.76Å; R462-F507 CarbonylContact C-O 3.57Å; R462-F507 VanDerWaalsContact C-O 3.26Å; R462-F507 HydrophobicContact CB-CB 4.09Å; F463-F507 WeakPolarHBondContact CA-O 3.42Å; F463-F507 HydrophobicContact CB-CB 4.08Å; F463-F507 HydrophobicContact CB-CD1 4.06Å; F463-F507 HydrophobicContact CB-CG 4.49Å; F463-F507 HydrophobicContact CD2-CB 4.43Å; F463-F507 AromaticContact CD2-CD1 3.88Å; F463-F507 HydrophobicContact CD2-CD1 3.88Å; F463-F507 HydrophobicContact CG-CD1 4.09Å; F463-F507 PolarHBondContact N-O 3.08Å; I494-F507 HydrophobicContact CD1-CD1 3.96Å; I494-F507 HydrophobicContact CD1-CE1 3.69Å; I494-F507 HydrophobicContact CG1-CE1 3.9Å; L502-F507 HydrophobicContact CB-CE2 3.92Å; L502-F507 HydrophobicContact CB-CZ 4.24Å; L502-F507 HydrophobicContact CD1-CZ 4.23Å; E504-F507 PolarHBondContact O-N 3.4Å; E504-F507 VanDerWaalsContact O-N 3.12Å; Q505-F507 PolarHBondContact O-N 2.95Å; F507-I513 HydrophobicContact CD1-CD1 4.4Å; F507-I513 HydrophobicContact CE1-CD1 3.79Å; F507-A516 HydrophobicContact CD1-CB 4.04Å; F507-A516 HydrophobicContact CE1-CB 4.2Å
508	Y	95.9	Very high	95	Very high	73 Å²	73	44.2 Å²	44.2	29%	0.286	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	131.1	-177.5	-179.2	-112	0	0	0	111.8	G393 Q505 V510 K519	G393-Y508 VanDerWaalsContact O-CE2 3.26Å; G393-Y508 WeakPolarHBondContact O-CE2 3.43Å; G393-Y508 PolarHBondContact O-OH 2.91Å; Q505-Y508 PolarHBondContact O-N 3.49Å; Y508-V510 PolarHBondContact O-N 3.45Å; Y508-K519 PolarHBondContact O-NZ 3.45Å
509	M	93.5	Very high	94.9	Very high	20 Å²	20	42.1 Å²	42.1	10%	0.099	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	52.7	176.9	-68.6	-70.1	-169.8	0	0	113.3	S465 P467	S465-M509 PolarHBondContact OG-N 3.07Å; P467-M509 HydrophobicContact CB-SD 4.36Å
510	V	95.1	Very high	94.9	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.03	21%	0.21	C	C	.	.			trans	-125.7	157	175.8	-64.6	0	0	0	0	110.4	K188 F463 A506 Y508 E515 A516 K519	K188-V510 PolarHBondContact NZ-O 2.86Å; F463-V510 HydrophobicContact CD2-CG2 3.88Å; F463-V510 HydrophobicContact CE2-CG2 3.9Å; A506-V510 WeakPolarHBondContact O-CG1 3.42Å; Y508-V510 PolarHBondContact O-N 3.45Å; V510-E515 HydrophobicContact CB-CB 4.17Å; V510-A516 HydrophobicContact CG2-CB 4.2Å; V510-K519 HydrophobicContact CG1-CD 3.71Å
511	G	94.6	Very high	94.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-81.5	-109	173.5	0	0	0	0	0	111.8	K188 E515	K188-G511 PolarHBondContact NZ-O 3.34Å; G511-E515 PolarHBondContact N-OE2 2.86Å
512	P	95.8	Very high	94.8	Very high	22 Å²	22	41.6 Å²	41.6	14%	0.143	21%	0.214	C	C	.	.	S	Bend	trans	-73.1	168.3	178.3	33.9	-37.3	0	0	0	112.6	E486 E514 E515	E486-P512 HydrophobicContact CB-CB 4.32Å; E486-P512 WeakPolarHBondContact OE2-CB 3.48Å; P512-E514 WeakPolarHBondContact CB-OE2 3.33Å; P512-E514 PolarHBondContact O-N 3.43Å; P512-E515 HydrophobicContact CG-CG 4.13Å; P512-E515 WeakPolarHBondContact O-CB 3.47Å; P512-E515 PolarHBondContact O-N 3.42Å; P512-E515 VanDerWaalsContact O-N 3.12Å
513	I	95.6	Very high	94.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-30.4	-172	-168.9	61.1	0	0	0	112.8	F463 I494 Y499 F507 E515 A516 V517	F463-I513 HydrophobicContact CE1-CD1 4.48Å; F463-I513 HydrophobicContact CE2-CD1 4.23Å; F463-I513 HydrophobicContact CZ-CB 4.19Å; F463-I513 HydrophobicContact CZ-CD1 4.07Å; I494-I513 HydrophobicContact CD1-CD1 3.94Å; I494-I513 HydrophobicContact CG1-CD1 4.06Å; Y499-I513 HydrophobicContact CD2-CD1 3.99Å; Y499-I513 HydrophobicContact CD2-CG1 4.02Å; Y499-I513 HydrophobicContact CE2-CD1 3.91Å; Y499-I513 HydrophobicContact CE2-CG1 3.4Å; Y499-I513 VanDerWaalsContact CE2-CG1 3.4Å; F507-I513 HydrophobicContact CD1-CD1 4.4Å; F507-I513 HydrophobicContact CE1-CD1 3.79Å; I513-E515 PolarHBondContact O-N 2.9Å; I513-A516 HydrophobicContact CD1-CB 4.34Å; I513-A516 VanDerWaalsContact O-CB 3.31Å; I513-A516 WeakPolarHBondContact O-CB 3.33Å; I513-A516 PolarHBondContact O-N 3.22Å; I513-V517 PolarHBondContact O-N 3.14Å
514	E	95.9	Very high	94.5	Very high	84 Å²	84	43 Å²	43	39%	0.393	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-32.2	178	-64.2	76.7	-168.5	0	0	111.8	K489 P512 A516 V517 A518	K489-E514 IonicContact NZ-OE1 3.93Å; K489-E514 PolarHBondContact NZ-OE1 3.05Å; P512-E514 WeakPolarHBondContact CB-OE2 3.33Å; P512-E514 PolarHBondContact O-N 3.43Å; E514-A516 VanDerWaalsContact C-N 3.33Å; E514-V517 PolarHBondContact O-N 3.3Å; E514-A518 PolarHBondContact O-N 3.25Å; E514-A518 VanDerWaalsContact O-N 3.13Å
515	E	95.2	Very high	94.3	Very high	56 Å²	56	47.9 Å²	47.9	26%	0.262	25%	0.249	S	C	.	.	H	α-helix	trans	-70.8	-29.9	174.8	-68.5	-173.1	-178.4	0	0	112.3	K480 V510 G511 P512 I513 K519	K480-E515 WeakPolarHBondContact CD-OE1 3.49Å; K480-E515 WeakPolarHBondContact CE-OE1 3.4Å; K480-E515 WeakPolarHBondContact CE-OE2 3.46Å; K480-E515 IonicContact NZ-OE1 3.77Å; K480-E515 PolarHBondContact NZ-OE1 3.21Å; K480-E515 IonicContact NZ-OE2 3.4Å; V510-E515 HydrophobicContact CB-CB 4.17Å; G511-E515 PolarHBondContact N-OE2 2.86Å; P512-E515 HydrophobicContact CG-CG 4.13Å; P512-E515 WeakPolarHBondContact O-CB 3.47Å; P512-E515 PolarHBondContact O-N 3.42Å; P512-E515 VanDerWaalsContact O-N 3.12Å; I513-E515 PolarHBondContact O-N 2.9Å; E515-K519 VanDerWaalsContact O-CB 3.27Å; E515-K519 WeakPolarHBondContact O-CB 3.27Å; E515-K519 PolarHBondContact O-N 2.95Å
516	A	94.4	Very high	94	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.8	-41.3	174.6	0	0	0	0	0	110.8	A506 F507 V510 I513 E514 K519 A520	A506-A516 WeakPolarHBondContact CB-O 3.42Å; A506-A516 WeakPolarHBondContact O-CA 3.35Å; F507-A516 HydrophobicContact CD1-CB 4.04Å; F507-A516 HydrophobicContact CE1-CB 4.2Å; V510-A516 HydrophobicContact CG2-CB 4.2Å; I513-A516 HydrophobicContact CD1-CB 4.34Å; I513-A516 VanDerWaalsContact O-CB 3.31Å; I513-A516 WeakPolarHBondContact O-CB 3.33Å; I513-A516 PolarHBondContact O-N 3.22Å; E514-A516 VanDerWaalsContact C-N 3.33Å; A516-K519 PolarHBondContact O-N 2.91Å; A516-A520 PolarHBondContact O-N 2.65Å
517	V	94.9	Very high	93.3	Very high	44 Å²	44	54.6 Å²	54.6	27%	0.267	28%	0.281	S	S	.	.	H	α-helix	trans	-62.9	-50.9	175.8	-176.2	0	0	0	0	110.6	Y499 L502 I513 E514 K519 A520 D521	Y499-V517 HydrophobicContact CD1-CG2 4.15Å; Y499-V517 HydrophobicContact CE1-CG2 3.54Å; L502-V517 HydrophobicContact CD1-CG2 4.16Å; I513-V517 PolarHBondContact O-N 3.14Å; E514-V517 PolarHBondContact O-N 3.3Å; V517-K519 PolarHBondContact O-N 2.9Å; V517-A520 WeakPolarHBondContact O-CA 3.42Å; V517-A520 WeakPolarHBondContact O-CB 3.19Å; V517-A520 PolarHBondContact O-N 2.82Å; V517-D521 PolarHBondContact O-N 3.08Å
518	A	94.7	Very high	92.3	Very high	61 Å²	61	58.9 Å²	58.9	50%	0.504	32%	0.316	S	S	.	.	H	α-helix	trans	-59.7	-35.6	178.8	0	0	0	0	0	112.7	E514 K522	E514-A518 PolarHBondContact O-N 3.25Å; E514-A518 VanDerWaalsContact O-N 3.13Å; A518-K522 PolarHBondContact O-N 2.92Å
519	K	94.4	Very high	90.5	Very high	61 Å²	61	62.3 Å²	62.3	27%	0.265	35%	0.351	S	S	.	.	H	α-helix	trans	-69.5	-37	174.9	-171.6	171.1	-179.2	174.5	0	112.1	Y508 V510 E515 A516 V517 K522 L523	Y508-K519 PolarHBondContact O-NZ 3.45Å; V510-K519 HydrophobicContact CG1-CD 3.71Å; E515-K519 VanDerWaalsContact O-CB 3.27Å; E515-K519 WeakPolarHBondContact O-CB 3.27Å; E515-K519 PolarHBondContact O-N 2.95Å; A516-K519 PolarHBondContact O-N 2.91Å; V517-K519 PolarHBondContact O-N 2.9Å; K519-K522 PolarHBondContact O-N 3.28Å; K519-L523 WeakPolarHBondContact O-CG 3.33Å; K519-L523 PolarHBondContact O-N 3.22Å
520	A	93.9	Very high	90.3	Very high	6 Å²	6	64.5 Å²	64.5	5%	0.05	36%	0.363	C	S	.	.	H	α-helix	trans	-64.1	-41.7	174.9	0	0	0	0	0	112	L502 P503 A506 A516 V517 K522 L523 A524	L502-A520 HydrophobicContact CD1-CB 4.37Å; L502-A520 HydrophobicContact CD2-CB 3.72Å; L502-A520 HydrophobicContact CG-CB 4.45Å; P503-A520 HydrophobicContact CG-CB 4.48Å; A506-A520 HydrophobicContact CB-CB 3.76Å; A516-A520 PolarHBondContact O-N 2.65Å; V517-A520 WeakPolarHBondContact O-CA 3.42Å; V517-A520 WeakPolarHBondContact O-CB 3.19Å; V517-A520 PolarHBondContact O-N 2.82Å; A520-K522 VanDerWaalsContact C-N 3.34Å; A520-K522 PolarHBondContact O-N 3.14Å; A520-L523 PolarHBondContact O-N 2.69Å; A520-A524 PolarHBondContact O-N 3.38Å
521	D	93.5	Very high	90	Very high	92 Å²	92	67.6 Å²	67.6	49%	0.492	38%	0.381	S	S	.	.	H	α-helix	trans	-60.2	-45.4	176.4	-65.5	-26.1	0	0	0	110.9	V517 L523 A524 E525	V517-D521 PolarHBondContact O-N 3.08Å; D521-L523 PolarHBondContact O-N 3.17Å; D521-A524 WeakPolarHBondContact O-CB 3.4Å; D521-A524 PolarHBondContact O-N 3.43Å; D521-A524 VanDerWaalsContact O-N 3.16Å; D521-E525 WeakPolarHBondContact O-CG 3.47Å; D521-E525 PolarHBondContact O-N 3.25Å
522	K	92.7	Very high	89.8	Confident	121 Å²	121	71.3 Å²	71.3	53%	0.526	40%	0.402	S	S	.	.	H	α-helix	trans	-61.1	-42	176.1	-173.8	178.7	175.1	-174	0	112.7	A518 K519 A520 A524 E525 E526	A518-K522 PolarHBondContact O-N 2.92Å; K519-K522 PolarHBondContact O-N 3.28Å; A520-K522 VanDerWaalsContact C-N 3.34Å; A520-K522 PolarHBondContact O-N 3.14Å; K522-A524 VanDerWaalsContact C-N 3.31Å; K522-A524 PolarHBondContact O-N 3.45Å; K522-E525 PolarHBondContact O-N 2.89Å; K522-E526 WeakPolarHBondContact CE-OE1 3.3Å; K522-E526 IonicContact NZ-OE1 2.69Å; K522-E526 WeakPolarHBondContact O-CG 3.34Å; K522-E526 PolarHBondContact O-N 3.15Å
523	L	92.3	Very high	89.4	Confident	38 Å²	38	74.2 Å²	74.2	20%	0.199	42%	0.417	C	S	.	.	H	α-helix	trans	-63.9	-38.7	175.9	-71.7	170	0	0	0	111.3	P503 Q505 K519 A520 D521 E526 H527	P503-L523 HydrophobicContact CG-CD1 4.39Å; Q505-L523 HydrophobicContact CB-CD1 4.1Å; K519-L523 WeakPolarHBondContact O-CG 3.33Å; K519-L523 PolarHBondContact O-N 3.22Å; A520-L523 PolarHBondContact O-N 2.69Å; D521-L523 PolarHBondContact O-N 3.17Å; L523-E526 PolarHBondContact O-N 2.9Å; L523-H527 WeakPolarHBondContact O-CB 3.5Å; L523-H527 PolarHBondContact O-CD2 3.06Å; L523-H527 PolarHBondContact O-N 3.34Å
524	A	91	Very high	89.1	Confident	61 Å²	61	78.9 Å²	78.9	50%	0.504	44%	0.443	S	S	.	.	H	α-helix	trans	-65.1	-39.9	176.4	0	0	0	0	0	112	A520 D521 K522 H527 A528	A520-A524 PolarHBondContact O-N 3.38Å; D521-A524 WeakPolarHBondContact O-CB 3.4Å; D521-A524 PolarHBondContact O-N 3.43Å; D521-A524 VanDerWaalsContact O-N 3.16Å; K522-A524 VanDerWaalsContact C-N 3.31Å; K522-A524 PolarHBondContact O-N 3.45Å; A524-H527 PolarHBondContact O-N 2.92Å; A524-A528 WeakPolarHBondContact O-CB 3.47Å; A524-A528 PolarHBondContact O-N 2.81Å
525	E	90.8	Very high	88.6	Confident	139 Å²	139	78.5 Å²	78.5	65%	0.65	45%	0.447	S	S	*	.	H	α-helix	trans	-62.5	-46.9	173.8	-71.6	177.8	176.3	0	0	112	D521 K522 H527 A528 S529	D521-E525 WeakPolarHBondContact O-CG 3.47Å; D521-E525 PolarHBondContact O-N 3.25Å; K522-E525 PolarHBondContact O-N 2.89Å; E525-H527 VanDerWaalsContact C-N 3.29Å; E525-H527 PolarHBondContact O-N 3.47Å; E525-A528 PolarHBondContact O-N 2.85Å; E525-A528 VanDerWaalsContact O-N 3.14Å; E525-S529 PolarHBondContact O-N 2.84Å; E525-S529 PolarHBondContact O-OG 3.05Å
526	E	86.6	Confident	88.1	Confident	101 Å²	101	80.1 Å²	80.1	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-65.9	-29.2	178.8	-72.9	177.4	180	0	0	113.1	K522 L523 S529	K522-E526 WeakPolarHBondContact CE-OE1 3.3Å; K522-E526 IonicContact NZ-OE1 2.69Å; K522-E526 WeakPolarHBondContact O-CG 3.34Å; K522-E526 PolarHBondContact O-N 3.15Å; L523-E526 PolarHBondContact O-N 2.9Å; E526-S529 PolarHBondContact O-OG 3.16Å; E526-S529 VanDerWaalsContact O-OG 3.06Å
527	H	81.6	Confident	87.6	Confident	163 Å²	163	86.3 Å²	86.3	76%	0.755	50%	0.495	S	S	*	.	H	α-helix	trans	-81.2	-20.9	174	-76.5	-55.6	0	0	0	113.5	L523 A524 E525	L523-H527 WeakPolarHBondContact O-CB 3.5Å; L523-H527 PolarHBondContact O-CD2 3.06Å; L523-H527 PolarHBondContact O-N 3.34Å; A524-H527 PolarHBondContact O-N 2.92Å; E525-H527 VanDerWaalsContact C-N 3.29Å; E525-H527 PolarHBondContact O-N 3.47Å
528	A	75.8	Confident	87	Confident	89 Å²	89	89.8 Å²	89.8	74%	0.736	51%	0.514	S	S	*	.	H	α-helix	trans	-86.5	-24.3	177.1	0	0	0	0	0	113	A524 E525	A524-A528 WeakPolarHBondContact O-CB 3.47Å; A524-A528 PolarHBondContact O-N 2.81Å; E525-A528 PolarHBondContact O-N 2.85Å; E525-A528 VanDerWaalsContact O-N 3.14Å
529	S	57.3	Low	86.3	Confident	146 Å²	146	92.5 Å²	92.5	100%	1.021	52%	0.515	S	S	*	.			trans	-83	0	171.3	64.6	0	0	0	0	112.5	E525 E526	E525-S529 PolarHBondContact O-N 2.84Å; E525-S529 PolarHBondContact O-OG 3.05Å; E526-S529 PolarHBondContact O-OG 3.16Å; E526-S529 VanDerWaalsContact O-OG 3.06Å

Retrieved 529 of 529 residues in 97.7 ms (Link to these results)

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