X5D8X5_HUMAN Loading...

Cadherin-10

Cadherins are calcium-dependent cell adhesion proteins. They preferentially interact with themselves in a homophilic manner in connecting cells; cadherins may thus contribute to the sorting of heterogeneous cell types.

AlphaFold DB (Q9Y6N8), UniProt , Accession X5D8X5, Species HUMAN (Homo sapiens, Human), Gene CDH10, Length 788 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	35.7	Very low	232 Å²	232	148.8 Å²	148.8	100%	1.143	74%	0.736	S	S	*	*				0	126.9	0	-71.5	160.3	65.6	0	0	107.1
2	T	36.7	Very low	35.6	Very low	111 Å²	111	148.8 Å²	148.8	68%	0.681	73%	0.729	S	S	*	*			cis	-169.5	113.2	-13.8	5.4	0	0	0	0	104.3
3	I	35.5	Very low	35.5	Very low	142 Å²	142	153.5 Å²	153.5	73%	0.728	73%	0.734	S	S	*	*				83.4	122.4	87.5	-85	173.1	0	0	0	113
4	H	35.3	Very low	35.5	Very low	146 Å²	146	150.9 Å²	150.9	68%	0.676	73%	0.732	S	S	*	*			trans	40.8	122.3	155.3	-66.7	-60.1	0	0	0	119.6
5	Q	34.7	Very low	35.4	Very low	155 Å²	155	147.8 Å²	147.8	72%	0.724	73%	0.731	S	S	*	*				73.9	161.5	73.1	-164.8	178.9	5.3	0	0	112.4
6	F	35.9	Very low	35.3	Very low	177 Å²	177	148.8 Å²	148.8	78%	0.776	74%	0.739	S	S	*	*			trans	79.9	144.5	-169.3	-67.8	-102.4	0	0	0	114.2
7	L	32.8	Very low	35.3	Very low	126 Å²	126	145.6 Å²	145.6	66%	0.66	73%	0.731	S	S	*	*			cis	-167.6	177.8	-18.6	-170.6	70.6	0	0	0	107.9
8	L	34.8	Very low	35.2	Very low	145 Å²	145	145.9 Å²	145.9	76%	0.759	73%	0.73	S	S	*	*			trans	86	152.8	158.9	-62.5	119.8	0	0	0	118
9	L	35.4	Very low	34.9	Very low	110 Å²	110	147.7 Å²	147.7	58%	0.576	73%	0.733	S	S	*	*			cis	177.5	128.9	-40.8	-124.3	159.1	0	0	0	109.3	L11	L9-L11 HydrophobicContact CD2-CG 4.23Å
10	F	35	Very low	34.7	Very low	188 Å²	188	146.5 Å²	146.5	83%	0.825	74%	0.737	S	S	*	*			trans	-155.8	112.5	148.2	-96	-84.2	0	0	0	105.1
11	L	36.3	Very low	34.5	Very low	105 Å²	105	144.7 Å²	144.7	55%	0.55	74%	0.739	S	S	.	*				69.1	132.2	68.6	-62.6	167	0	0	0	111.1	L9	L9-L11 HydrophobicContact CD2-CG 4.23Å
12	F	34.8	Very low	34.4	Very low	149 Å²	149	138.9 Å²	138.9	65%	0.654	72%	0.718	S	S	*	*			cis	-137.1	143.9	32.3	-99.5	-91.1	0	0	0	112.8
13	W	34.7	Very low	34	Very low	210 Å²	210	142.4 Å²	142.4	80%	0.795	73%	0.727	S	S	*	*				58.6	145.4	115	-87.3	20.7	0	0	0	117.9
14	V	34.6	Very low	33.9	Very low	116 Å²	116	142.5 Å²	142.5	70%	0.703	73%	0.728	S	S	*	*			cis	-135.3	121.1	9.3	174	0	0	0	0	107.7
15	C	33.8	Very low	33.5	Very low	105 Å²	105	143 Å²	143	71%	0.709	73%	0.732	S	S	*	*				58.2	80.9	76	-74.4	0	0	0	0	117.5
16	L	34.4	Very low	33.3	Very low	164 Å²	164	145.2 Å²	145.2	86%	0.859	74%	0.739	S	S	*	*			trans	-32.6	147.6	135.6	-89.3	160.9	0	0	0	111.2
17	P	35.5	Very low	33	Very low	94 Å²	94	145.7 Å²	145.7	61%	0.61	74%	0.736	S	S	*	*				-162.8	-178.2	69	45.7	-25	0	0	0	119.6
18	H	33	Very low	32.7	Very low	152 Å²	152	152 Å²	152	70%	0.704	75%	0.751	S	S	*	*			trans	77.7	133.9	139.2	-73	-22.6	0	0	0	123.5
19	F	29.8	Very low	32.4	Very low	180 Å²	180	149.8 Å²	149.8	79%	0.789	74%	0.744	S	S	*	*			trans	28.7	110.8	140.7	-61.2	-79.4	0	0	0	119.1
20	C	31.5	Very low	32	Very low	122 Å²	122	150 Å²	150	82%	0.824	75%	0.752	S	S	*	*				-169.9	141	91.3	-117.8	0	0	0	0	112.9
21	S	29.5	Very low	31.7	Very low	110 Å²	110	147.3 Å²	147.3	77%	0.769	75%	0.751	S	S	*	*			trans	-69.7	151.6	163.1	-46	0	0	0	0	110.6
22	P	38.8	Very low	31.7	Very low	109 Å²	109	148.1 Å²	148.1	71%	0.708	76%	0.762	S	S	*	*			trans	-119.7	106.5	134.2	33	-28.1	0	0	0	111.1	I24	P22-I24 HydrophobicContact CB-CD1 4.3Å; P22-I24 HydrophobicContact CB-CG1 4.22Å; P22-I24 PolarHBondContact O-N 3.47Å
23	E	27.3	Very low	31.4	Very low	186 Å²	186	149.1 Å²	149.1	87%	0.869	77%	0.769	S	S	*	*			trans	-65.6	98	155.8	-73.7	-169.7	118.6	0	0	108.6
24	I	33.3	Very low	31.3	Very low	144 Å²	144	148 Å²	148	74%	0.738	77%	0.773	S	S	*	*			trans	-118.3	91.2	168.6	-61.8	-179	0	0	0	110.5	P22 F26	P22-I24 HydrophobicContact CB-CD1 4.3Å; P22-I24 HydrophobicContact CB-CG1 4.22Å; P22-I24 PolarHBondContact O-N 3.47Å; I24-F26 PolarHBondContact O-N 3.13Å
25	M	27.9	Very low	31.1	Very low	155 Å²	155	153.4 Å²	153.4	76%	0.764	78%	0.78	S	S	*	*			trans	-26.8	114.6	160.3	-55.9	-179.9	-173.4	0	0	115.8
26	F	31.4	Very low	31	Very low	202 Å²	202	156.3 Å²	156.3	89%	0.886	79%	0.787	S	S	*	*			trans	-135.4	62	137.3	-90.2	-77.9	0	0	0	109	I24	I24-F26 PolarHBondContact O-N 3.13Å
27	R	28.8	Very low	30.9	Very low	188 Å²	188	155.9 Å²	155.9	71%	0.709	79%	0.785	S	S	*	*				59.4	96.8	89.4	-164.6	-172.9	-172.9	-169.3	5	111.9	T29	R27-T29 HydrophobicContact CG-CG2 3.98Å; R27-T29 PolarHBondContact O-N 3.29Å
28	R	25.9	Very low	30.5	Very low	257 Å²	257	156.2 Å²	156.2	97%	0.97	79%	0.789	S	S	*	*			trans	-55.2	102.6	159.3	-72.6	177.3	173	171.3	-3.1	108.9
29	T	28.3	Very low	30.4	Very low	100 Å²	100	153.4 Å²	153.4	61%	0.613	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-99.3	135.5	169.8	41.1	0	0	0	0	110.7	R27	R27-T29 HydrophobicContact CG-CG2 3.98Å; R27-T29 PolarHBondContact O-N 3.29Å
30	P	26.9	Very low	30.5	Very low	114 Å²	114	156 Å²	156	74%	0.74	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-84.1	165.3	-169.1	34.8	-37.5	0	0	0	113.5	P32	P30-P32 VanDerWaalsContact O-CD 3.25Å; P30-P32 WeakPolarHBondContact O-CD 3.39Å
31	V	30.4	Very low	30.6	Very low	132 Å²	132	156.7 Å²	156.7	80%	0.8	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-53.3	119.2	168.5	176.6	0	0	0	0	111.1
32	P	34.4	Very low	31.1	Very low	122 Å²	122	157 Å²	157	79%	0.792	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-87.8	116.8	169.5	-1.9	21.8	0	0	0	110	P30 Q34	P30-P32 VanDerWaalsContact O-CD 3.25Å; P30-P32 WeakPolarHBondContact O-CD 3.39Å; P32-Q34 PolarHBondContact O-N 3.22Å
33	Q	29.7	Very low	31.1	Very low	169 Å²	169	163.6 Å²	163.6	79%	0.79	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-75.9	120.2	174.7	-67.6	178.3	-13.9	0	0	111.7
34	Q	33	Very low	31.7	Very low	188 Å²	188	159.4 Å²	159.4	88%	0.879	79%	0.793	S	S	*	*			trans	-126.2	98.1	151.9	-68.7	-174.8	-13	0	0	106.8	P32	P32-Q34 PolarHBondContact O-N 3.22Å
35	R	30.1	Very low	32.1	Very low	228 Å²	228	159.4 Å²	159.4	86%	0.86	80%	0.795	S	S	*	*				41.5	91	82.2	-72.8	-170.1	172	-169.2	-0.4	112.4
36	I	31.5	Very low	32.7	Very low	166 Å²	166	155.7 Å²	155.7	85%	0.851	80%	0.796	S	S	*	*				-146.6	140.2	123.8	-100.3	147	0	0	0	110.4
37	L	31	Very low	33.6	Very low	155 Å²	155	155.7 Å²	155.7	81%	0.812	80%	0.796	S	S	*	*			trans	-42.7	147.1	-174	-79.1	63.7	0	0	0	118.6
38	S	28.5	Very low	34.3	Very low	101 Å²	101	154.1 Å²	154.1	71%	0.706	80%	0.8	S	S	*	*				78.5	122.7	125.7	-171.7	0	0	0	0	121.5
39	S	29.7	Very low	35.3	Very low	94 Å²	94	150.1 Å²	150.1	66%	0.657	80%	0.797	S	S	*	*			trans	88.3	126.9	137.7	70.3	0	0	0	0	121.4
40	R	32.6	Very low	36	Very low	234 Å²	234	154.2 Å²	154.2	88%	0.883	81%	0.808	S	S	*	*			trans	65.7	109.5	142.8	-69	174.6	178.8	-179	-0.6	118.9	P42	R40-P42 WeakPolarHBondContact O-CD 3.49Å
41	V	33.4	Very low	36.6	Very low	137 Å²	137	160.2 Å²	160.2	83%	0.83	82%	0.816	S	S	*	*			trans	-40.4	130.4	154.8	177.9	0	0	0	0	113
42	P	41.4	Very low	37.7	Very low	116 Å²	116	162.5 Å²	162.5	75%	0.753	82%	0.818	S	S	*	*			trans	-113.5	152.5	149.5	19.5	0.1	0	0	0	111.6	R40	R40-P42 WeakPolarHBondContact O-CD 3.49Å
43	R	37.5	Very low	38.7	Very low	247 Å²	247	162.6 Å²	162.6	93%	0.932	81%	0.806	S	S	*	*			trans	-96.3	116.6	166.7	-74.1	173.6	167.9	167.8	-6.6	109.2
44	S	39.4	Very low	39.8	Very low	98 Å²	98	165 Å²	165	69%	0.685	81%	0.808	S	S	*	*			trans	168.4	144.4	170.5	163.7	0	0	0	0	107.1
45	D	41.8	Very low	41.1	Very low	145 Å²	145	159.2 Å²	159.2	78%	0.775	80%	0.799	S	S	*	*			cis	-146.8	169.6	-21.2	-93.3	-45	0	0	0	108.4	K47	D45-K47 PolarHBondContact O-N 3.13Å; D45-K47 VanDerWaalsContact O-N 3.13Å
46	G	42	Very low	42.6	Very low	77 Å²	77	155 Å²	155	79%	0.794	78%	0.783	S	S	*	*			trans	-65	108.7	-172.9	0	0	0	0	0	114.3	I48	G46-I48 PolarHBondContact O-N 2.97Å
47	K	49.4	Very low	43.9	Very low	201 Å²	201	154.2 Å²	154.2	87%	0.874	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.9	118.1	164.2	-86.5	-171.9	173	-177.5	0	110.4	D45 L49	D45-K47 PolarHBondContact O-N 3.13Å; D45-K47 VanDerWaalsContact O-N 3.13Å; K47-L49 PolarHBondContact O-N 3.41Å
48	I	44.7	Very low	45.4	Very low	156 Å²	156	156.5 Å²	156.5	80%	0.8	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.1	176.2	-62.5	165.2	0	0	0	109.4	G46	G46-I48 PolarHBondContact O-N 2.97Å
49	L	46.2	Very low	47.8	Very low	173 Å²	173	155.4 Å²	155.4	91%	0.906	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-74.4	133.5	167.9	-66.3	172.3	0	0	0	109.3	K47	K47-L49 PolarHBondContact O-N 3.41Å
50	H	42.5	Very low	50.6	Low	185 Å²	185	154.6 Å²	154.6	86%	0.856	75%	0.748	S	S	*	*			trans	-110.8	125.6	179.2	-144.7	65	0	0	0	109.9
51	R	40.5	Very low	53.3	Low	241 Å²	241	145.5 Å²	145.5	91%	0.909	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-86.7	125.4	179.7	-168.3	-174.7	-167.7	-146.9	6.4	109.3
52	Q	53.1	Low	56	Low	180 Å²	180	143.3 Å²	143.3	84%	0.841	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-86.5	141.6	174.5	-160.1	165.4	-3.2	0	0	110	R54	Q52-R54 PolarHBondContact O-N 2.82Å
53	K	54.3	Low	58.3	Low	123 Å²	123	138 Å²	138	54%	0.535	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-62.3	126.4	174.9	-164.5	172.1	-178.5	174.6	0	107.7	D81 E141	K53-D81 WeakPolarHBondContact CE-OD2 3.37Å; K53-D81 IonicContact NZ-OD1 3.91Å; K53-D81 PolarHBondContact NZ-OD1 3.2Å; K53-D81 IonicContact NZ-OD2 2.75Å; K53-D81 PolarHBondContact NZ-OD2 3.5Å; K53-E141 IonicContact NZ-OE1 3.51Å; K53-E141 PolarHBondContact NZ-OE1 2.9Å; K53-E141 IonicContact NZ-OE2 3.64Å; K53-E141 PolarHBondContact NZ-OE2 3.35Å
54	R	52.8	Low	60.7	Low	219 Å²	219	129.9 Å²	129.9	83%	0.826	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-66.8	149.9	168.7	-85	-172.8	170.6	-173.4	-3.9	108.2	Q52	Q52-R54 PolarHBondContact O-N 2.82Å
55	G	61.2	Low	63.1	Low	67 Å²	67	125.4 Å²	125.4	69%	0.691	60%	0.603	S	S	*	*			trans	-67.5	179.4	167.2	0	0	0	0	0	111.9	M57	G55-M57 PolarHBondContact O-N 3.5Å
56	W	60.6	Low	65.2	Low	141 Å²	141	121.5 Å²	121.5	53%	0.534	58%	0.58	S	S	.	*			trans	-52.5	128.9	175.4	-67.7	90.9	0	0	0	111.2	L78 S144	W56-L78 HydrophobicContact CH2-CD2 4.11Å; W56-L78 HydrophobicContact CZ3-CD2 4.21Å; W56-S144 PolarHBondContact NE1-OG 3.06Å
57	M	58.5	Low	67.1	Low	148 Å²	148	122.4 Å²	122.4	73%	0.729	56%	0.56	S	S	*	*	S	Bend	trans	-82.8	-24.7	175.2	-159	179.8	-44.7	0	0	111.6	G55	G55-M57 PolarHBondContact O-N 3.5Å
58	W	63.9	Low	68.5	Low	203 Å²	203	118.5 Å²	118.5	77%	0.769	55%	0.553	S	S	*	*			trans	-127	114.2	174.7	-58	99.8	0	0	0	107.4
59	N	78.9	Confident	70.2	Confident	78 Å²	78	112.7 Å²	112.7	42%	0.417	53%	0.531	S	S	.	.			trans	-120.8	20.4	174.6	71.8	-34.9	0	0	0	111.5	F146 V147	N59-F146 CarbonylContact O-C 3.53Å; N59-F146 WeakPolarHBondContact O-CA 3.3Å; N59-F146 WeakPolarHBondContact O-CB 3.45Å; N59-V147 PolarHBondContact O-N 3.35Å
60	Q	87.8	Confident	71.6	Confident	78 Å²	78	110 Å²	110	36%	0.364	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.1	176.5	-62.9	-179.5	36.8	0	0	108.5	F62 V147	Q60-F62 HydrophobicContact CB-CE2 4.47Å; Q60-F62 HydrophobicContact CB-CZ 4.5Å; Q60-V147 CarbonylContact C-O 3.5Å; Q60-V147 VanDerWaalsContact CA-O 3.27Å; Q60-V147 WeakPolarHBondContact CA-O 3.36Å; Q60-V147 HydrophobicContact CG-CB 4.46Å
61	F	89.5	Confident	73.5	Confident	43 Å²	43	107 Å²	107	19%	0.189	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	161.4	163	-63	-84.3	0	0	0	108.6	V75 L78 F146 V147 I148 K149	F61-V75 HydrophobicContact CB-CG1 3.76Å; F61-V75 WeakPolarHBondContact CD1-O 3.33Å; F61-V75 HydrophobicContact CG-CG1 4.11Å; F61-L78 HydrophobicContact CE2-CD2 4.11Å; F61-L78 HydrophobicContact CZ-CD2 3.9Å; F61-F146 AromaticContact CD2-CD2 3.52Å; F61-F146 HydrophobicContact CD2-CD2 3.52Å; F61-F146 AromaticContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CG 4.36Å; F61-F146 AromaticContact CE2-CD2 3.69Å; F61-F146 HydrophobicContact CE2-CD2 3.69Å; F61-F146 AromaticContact CE2-CE2 3.88Å; F61-F146 HydrophobicContact CE2-CE2 3.88Å; F61-F146 HydrophobicContact CE2-CG 4.17Å; F61-V147 PolarHBondContact N-O 3.31Å; F61-I148 HydrophobicContact CB-CG1 4.42Å; F61-I148 WeakPolarHBondContact O-CA 3.4Å; F61-K149 PolarHBondContact O-N 3.2Å
62	F	89.6	Confident	75.9	Confident	90 Å²	90	102.3 Å²	102.3	40%	0.395	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139	-178.5	-61.3	-84.5	0	0	0	110.2	Q60 K149 H151	Q60-F62 HydrophobicContact CB-CE2 4.47Å; Q60-F62 HydrophobicContact CB-CZ 4.5Å; F62-K149 WeakPolarHBondContact CA-O 3.29Å; F62-K149 HydrophobicContact CD1-CB 3.67Å; F62-K149 HydrophobicContact CD1-CD 4.03Å; F62-K149 HydrophobicContact CE1-CB 3.99Å; F62-K149 HydrophobicContact CE1-CD 3.44Å; F62-K149 VanDerWaalsContact CE1-CD 3.44Å; F62-K149 HydrophobicContact CE1-CG 4.36Å; F62-K149 HydrophobicContact CZ-CD 4.22Å; F62-H151 WeakPolarHBondContact CB-NE2 3.44Å; F62-H151 AromaticContact CD1-CE1 3Å; F62-H151 WeakPolarHBondContact CD1-CE1 3.43Å; F62-H151 AromaticContact CD1-ND1 3.73Å; F62-H151 AromaticContact CD1-NE2 3.53Å; F62-H151 AromaticContact CE1-CE1 3.63Å; F62-H151 AromaticContact CG-CE1 3.58Å; F62-H151 AromaticContact CG-NE2 3.58Å
63	L	90	Very high	77.6	Confident	6 Å²	6	94.7 Å²	94.7	3%	0.031	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134.6	176.8	-70.9	-179.9	0	0	0	110.4	Q73 V75 F102 A113 I117 I148 K149 I150 H151	L63-Q73 HydrophobicContact CD2-CG 4.05Å; L63-V75 HydrophobicContact CD1-CG1 4.29Å; L63-V75 HydrophobicContact CD1-CG2 3.92Å; L63-V75 HydrophobicContact CD2-CB 4.21Å; L63-V75 HydrophobicContact CD2-CG1 4.17Å; L63-V75 HydrophobicContact CD2-CG2 4.07Å; L63-V75 HydrophobicContact CG-CG1 4.19Å; L63-V75 HydrophobicContact CG-CG2 4.41Å; L63-F102 HydrophobicContact CD1-CE1 3.79Å; L63-A113 HydrophobicContact CD1-CB 4.06Å; L63-I117 HydrophobicContact CD1-CD1 4.08Å; L63-I148 HydrophobicContact CB-CG2 4.47Å; L63-I148 HydrophobicContact CD1-CG2 3.69Å; L63-I148 HydrophobicContact CG-CG2 3.86Å; L63-K149 PolarHBondContact N-O 2.89Å; L63-I150 HydrophobicContact CB-CD1 4.11Å; L63-I150 CarbonylContact O-C 3.55Å; L63-I150 WeakPolarHBondContact O-CA 3.32Å; L63-H151 WeakPolarHBondContact O-CB 3.28Å; L63-H151 PolarHBondContact O-N 2.95Å
64	L	87.7	Confident	79.4	Confident	76 Å²	76	94.6 Å²	94.6	40%	0.398	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.3	167.2	-166.1	74.2	0	0	0	109.7	Q73 H151 I153	L64-Q73 PolarHBondContact O-NE2 3.17Å; L64-H151 HydrophobicContact CD1-CB 4.27Å; L64-I153 HydrophobicContact CD1-CG2 3.68Å; L64-I153 HydrophobicContact CG-CG2 4.06Å
65	E	91	Very high	81.2	Confident	4 Å²	4	84.8 Å²	84.8	2%	0.019	43%	0.427	C	S	.	.	S	Bend	trans	-74.8	175.2	175.3	76.8	-169	114.3	0	0	113.9	Y67 I117 R119 I150 H151 D152 I153	E65-Y67 PolarHBondContact O-N 2.85Å; E65-I117 WeakPolarHBondContact CA-O 3.34Å; E65-I117 VanDerWaalsContact CB-O 3.31Å; E65-I117 WeakPolarHBondContact CB-O 3.37Å; E65-R119 WeakPolarHBondContact OE1-CB 3.28Å; E65-R119 WeakPolarHBondContact OE2-CB 3.01Å; E65-R119 PolarHBondContact OE2-N 2.96Å; E65-I150 HydrophobicContact CB-CG2 3.65Å; E65-H151 PolarHBondContact N-O 3.47Å; E65-D152 WeakPolarHBondContact OE1-CA 3.2Å; E65-I153 HydrophobicContact CG-CB 4.36Å; E65-I153 HydrophobicContact CG-CD1 3.93Å; E65-I153 HydrophobicContact CG-CG1 3.65Å; E65-I153 HydrophobicContact CG-CG2 4.16Å; E65-I153 PolarHBondContact OE1-N 3.46Å
66	E	84.8	Confident	82.6	Confident	63 Å²	63	82 Å²	82	29%	0.294	40%	0.397	S	S	.	.	S	Bend	trans	40.7	34.4	-179.5	-96.5	-60.2	107.6	0	0	115.1	T68 R116 I117 I153	E66-T68 WeakPolarHBondContact O-CG2 3.44Å; E66-T68 PolarHBondContact O-N 3.45Å; E66-R116 VanDerWaalsContact OE1-CB 3.26Å; E66-R116 WeakPolarHBondContact OE1-CB 3.49Å; E66-R116 WeakPolarHBondContact OE1-CD 3.49Å; E66-R116 WeakPolarHBondContact OE2-CD 3.38Å; E66-R116 IonicContact OE2-CZ 2.77Å; E66-R116 IonicContact OE2-NE 2.91Å; E66-R116 IonicContact OE2-NH1 2.78Å; E66-R116 PolarHBondContact OE2-NH1 2.71Å; E66-I117 PolarHBondContact N-O 2.71Å; E66-I153 HydrophobicContact CB-CD1 3.96Å
67	Y	81.3	Confident	84	Confident	95 Å²	95	79.7 Å²	79.7	37%	0.373	39%	0.391	S	S	.	.			trans	-55.2	117.3	-170.2	-178.4	-107.3	0	0	0	112.1	E65 G69 Q73 R116	E65-Y67 PolarHBondContact O-N 2.85Å; Y67-G69 VanDerWaalsContact C-N 3.32Å; Y67-G69 PolarHBondContact O-N 2.79Å; Y67-Q73 HydrophobicContact CD1-CB 3.8Å; Y67-Q73 HydrophobicContact CD1-CG 3.87Å; Y67-Q73 HydrophobicContact CD2-CG 4.24Å; Y67-Q73 HydrophobicContact CE1-CB 4.14Å; Y67-Q73 HydrophobicContact CE1-CG 4.2Å; Y67-Q73 HydrophobicContact CG-CB 4.27Å; Y67-Q73 HydrophobicContact CG-CG 3.89Å; Y67-R116 PolarHBondContact O-NE 2.88Å; Y67-R116 VanDerWaalsContact O-NE 3.16Å
68	T	80.1	Confident	85.4	Confident	119 Å²	119	73.2 Å²	73.2	73%	0.73	36%	0.36	S	S	*	.			trans	-85.9	1	-169.1	51.7	0	0	0	0	114.5	E66	E66-T68 WeakPolarHBondContact O-CG2 3.44Å; E66-T68 PolarHBondContact O-N 3.45Å
69	G	79.2	Confident	86.5	Confident	34 Å²	34	69.1 Å²	69.1	35%	0.351	35%	0.349	S	S	.	.			trans	-66.8	158.5	177.1	0	0	0	0	0	114.1	Y67	Y67-G69 VanDerWaalsContact C-N 3.32Å; Y67-G69 PolarHBondContact O-N 2.79Å
70	S	77.2	Confident	86.9	Confident	118 Å²	118	65.6 Å²	65.6	83%	0.825	33%	0.33	S	S	*	.	S	Bend	trans	-78.5	-21.1	175.4	53.3	0	0	0	0	114.1
71	D	82.5	Confident	86.9	Confident	120 Å²	120	67.3 Å²	67.3	64%	0.642	34%	0.342	S	S	*	.	S	Bend	trans	-107.5	159.8	-166.9	-55.8	-7.4	0	0	0	109.7	Q73	D71-Q73 PolarHBondContact O-N 2.97Å
72	Y	89.5	Confident	86.7	Confident	144 Å²	144	69.5 Å²	69.5	57%	0.565	35%	0.352	S	S	*	.			trans	-61.9	128.6	177.7	-59.7	-28.4	0	0	0	110.9	Y74 I103 A113 T114	Y72-Y74 PolarHBondContact O-N 3.48Å; Y72-I103 HydrophobicContact CD2-CD1 3.85Å; Y72-I103 HydrophobicContact CE2-CD1 3.84Å; Y72-A113 CarbonylContact C-O 3.52Å; Y72-A113 WeakPolarHBondContact CA-O 3.08Å; Y72-A113 WeakPolarHBondContact CB-O 3.35Å; Y72-T114 HydrophobicContact CD1-CG2 4.22Å; Y72-T114 HydrophobicContact CD2-CG2 4.1Å; Y72-T114 HydrophobicContact CE1-CG2 4.14Å; Y72-T114 HydrophobicContact CE2-CG2 4.03Å; Y72-T114 HydrophobicContact CG-CG2 4.19Å
73	Q	90.1	Very high	86.6	Confident	19 Å²	19	66.5 Å²	66.5	9%	0.089	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	114.7	-174.6	-168.4	-172.8	23.7	0	0	109.6	L63 L64 Y67 D71 V75 H112 A113	L63-Q73 HydrophobicContact CD2-CG 4.05Å; L64-Q73 PolarHBondContact O-NE2 3.17Å; Y67-Q73 HydrophobicContact CD1-CB 3.8Å; Y67-Q73 HydrophobicContact CD1-CG 3.87Å; Y67-Q73 HydrophobicContact CD2-CG 4.24Å; Y67-Q73 HydrophobicContact CE1-CB 4.14Å; Y67-Q73 HydrophobicContact CE1-CG 4.2Å; Y67-Q73 HydrophobicContact CG-CB 4.27Å; Y67-Q73 HydrophobicContact CG-CG 3.89Å; D71-Q73 PolarHBondContact O-N 2.97Å; Q73-V75 PolarHBondContact O-N 3.35Å; Q73-H112 CarbonylContact O-C 3.57Å; Q73-H112 VanDerWaalsContact O-CA 3.31Å; Q73-H112 WeakPolarHBondContact O-CA 3.49Å; Q73-A113 HydrophobicContact CB-CB 4.29Å; Q73-A113 PolarHBondContact N-O 2.65Å; Q73-A113 PolarHBondContact O-N 2.81Å
74	Y	91	Very high	86.3	Confident	122 Å²	122	74.6 Å²	74.6	48%	0.478	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	125.1	179.7	173	-100.4	0	0	0	110.8	Y72 G76 K77 D110 H112	Y72-Y74 PolarHBondContact O-N 3.48Å; Y74-G76 WeakPolarHBondContact CE2-O 3.3Å; Y74-K77 WeakPolarHBondContact OH-CB 3.45Å; Y74-K77 PolarHBondContact OH-N 2.59Å; Y74-D110 HydrophobicContact CE2-CB 4.06Å; Y74-H112 AromaticContact CD2-NE2 3.79Å
75	V	91.1	Very high	86	Confident	13 Å²	13	74.4 Å²	74.4	8%	0.079	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-37.1	-177.4	-168.1	0	0	0	0	111.6	F61 L63 Q73 F102 I111 A113 I148	F61-V75 HydrophobicContact CB-CG1 3.76Å; F61-V75 WeakPolarHBondContact CD1-O 3.33Å; F61-V75 HydrophobicContact CG-CG1 4.11Å; L63-V75 HydrophobicContact CD1-CG1 4.29Å; L63-V75 HydrophobicContact CD1-CG2 3.92Å; L63-V75 HydrophobicContact CD2-CB 4.21Å; L63-V75 HydrophobicContact CD2-CG1 4.17Å; L63-V75 HydrophobicContact CD2-CG2 4.07Å; L63-V75 HydrophobicContact CG-CG1 4.19Å; L63-V75 HydrophobicContact CG-CG2 4.41Å; Q73-V75 PolarHBondContact O-N 3.35Å; V75-F102 HydrophobicContact CG2-CD1 4.25Å; V75-I111 HydrophobicContact CB-CB 4.12Å; V75-I111 HydrophobicContact CB-CG2 3.93Å; V75-I111 HydrophobicContact CG2-CB 4.39Å; V75-I111 HydrophobicContact CG2-CG2 3.78Å; V75-I111 PolarHBondContact N-O 2.8Å; V75-A113 HydrophobicContact CG2-CB 4.45Å; V75-I148 HydrophobicContact CG1-CD1 3.81Å; V75-I148 HydrophobicContact CG1-CG1 4.01Å; V75-I148 HydrophobicContact CG1-CG2 4.27Å
76	G	89.8	Confident	85.8	Confident	7 Å²	7	78.9 Å²	78.9	7%	0.072	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-177.6	-171	0	0	0	0	0	112.1	Y74 I111	Y74-G76 WeakPolarHBondContact CE2-O 3.3Å; G76-I111 PolarHBondContact O-N 3.36Å
77	K	89.6	Confident	85.7	Confident	93 Å²	93	77.2 Å²	77.2	40%	0.404	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.2	-175.8	-175.6	-176.6	-153.7	65.4	0	111	Y74 T108 D110	Y74-K77 WeakPolarHBondContact OH-CB 3.45Å; Y74-K77 PolarHBondContact OH-N 2.59Å; K77-T108 VanDerWaalsContact CE-O 3.25Å; K77-T108 WeakPolarHBondContact CE-O 3.39Å; K77-T108 PolarHBondContact NZ-O 3.34Å; K77-D110 WeakPolarHBondContact CB-OD1 3.28Å; K77-D110 WeakPolarHBondContact CD-OD1 3.49Å; K77-D110 VanDerWaalsContact CG-OD1 3.28Å; K77-D110 WeakPolarHBondContact CG-OD1 3.46Å; K77-D110 IonicContact NZ-OD1 2.73Å; K77-D110 PolarHBondContact NZ-OD1 2.93Å; K77-D110 IonicContact NZ-OD2 2.94Å; K77-D110 PolarHBondContact NZ-OD2 3.22Å
78	L	88	Confident	86.1	Confident	13 Å²	13	73.7 Å²	73.7	7%	0.068	41%	0.405	C	S	.	.			trans	-102.9	136.5	167.7	-61.9	-178.7	0	0	0	110.1	W56 F61 I104 G109 I111 A129 F146	W56-L78 HydrophobicContact CH2-CD2 4.11Å; W56-L78 HydrophobicContact CZ3-CD2 4.21Å; F61-L78 HydrophobicContact CE2-CD2 4.11Å; F61-L78 HydrophobicContact CZ-CD2 3.9Å; L78-I104 HydrophobicContact CD1-CD1 4.37Å; L78-G109 PolarHBondContact N-O 2.91Å; L78-G109 WeakPolarHBondContact O-CA 3.35Å; L78-I111 HydrophobicContact CD1-CD1 3.77Å; L78-I111 HydrophobicContact CG-CD1 3.86Å; L78-A129 HydrophobicContact CD1-CB 3.18Å; L78-F146 HydrophobicContact CD1-CD1 4.49Å; L78-F146 HydrophobicContact CD1-CE1 3.84Å; L78-F146 HydrophobicContact CD1-CZ 4.32Å
79	H	88.2	Confident	86.7	Confident	117 Å²	117	68.2 Å²	68.2	54%	0.542	37%	0.371	S	S	.	.			trans	-141.5	146	-176.8	-173.2	57.8	0	0	0	110.6	Y91	H79-Y91 PolarHBondContact ND1-OH 2.92Å
80	S	87.5	Confident	87.3	Confident	3 Å²	3	69 Å²	69	2%	0.021	37%	0.365	C	S	.	.			trans	-110.2	136.4	174.2	175.8	0	0	0	0	110.4	Q82 D83 Y91 E141	S80-Q82 PolarHBondContact O-N 2.87Å; S80-Q82 PolarHBondContact OG-N 2.77Å; S80-D83 VanDerWaalsContact O-CB 3.26Å; S80-D83 WeakPolarHBondContact O-CB 3.25Å; S80-D83 PolarHBondContact O-N 2.91Å; S80-Y91 PolarHBondContact N-OH 2.95Å; S80-E141 WeakPolarHBondContact OG-CG 3.44Å
81	D	86.4	Confident	88	Confident	115 Å²	115	63.8 Å²	63.8	62%	0.615	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-3.7	170.1	53.1	-45.4	0	0	0	114.1	K53	K53-D81 WeakPolarHBondContact CE-OD2 3.37Å; K53-D81 IonicContact NZ-OD1 3.91Å; K53-D81 PolarHBondContact NZ-OD1 3.2Å; K53-D81 IonicContact NZ-OD2 2.75Å; K53-D81 PolarHBondContact NZ-OD2 3.5Å
82	Q	86.8	Confident	88.5	Confident	88 Å²	88	61 Å²	61	41%	0.411	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-7.4	169.6	-61.5	-173.3	55.4	0	0	113.5	S80 L89 V140 E141	S80-Q82 PolarHBondContact O-N 2.87Å; S80-Q82 PolarHBondContact OG-N 2.77Å; Q82-L89 HydrophobicContact CB-CD1 4.47Å; Q82-V140 HydrophobicContact CB-CG2 4.45Å; Q82-V140 PolarHBondContact NE2-O 3.4Å; Q82-E141 PolarHBondContact NE2-OE1 3.42Å
83	D	87.8	Confident	88.7	Confident	28 Å²	28	55.3 Å²	55.3	15%	0.15	29%	0.291	C	S	.	.			trans	-72.7	143.1	174	-156.5	-21.2	0	0	0	110.5	S80 G85 L89 Y91	S80-D83 VanDerWaalsContact O-CB 3.26Å; S80-D83 WeakPolarHBondContact O-CB 3.25Å; S80-D83 PolarHBondContact O-N 2.91Å; D83-G85 PolarHBondContact OD1-N 2.91Å; D83-L89 HydrophobicContact CB-CD1 3.75Å; D83-L89 HydrophobicContact CB-CG 4.41Å; D83-Y91 WeakPolarHBondContact CB-OH 3.33Å; D83-Y91 WeakPolarHBondContact OD2-CE2 3.22Å; D83-Y91 PolarHBondContact OD2-OH 2.87Å
84	K	83.1	Confident	88.8	Confident	175 Å²	175	56.4 Å²	56.4	76%	0.761	30%	0.301	S	S	*	.			trans	-118.4	3.6	-180	-63.2	-178.7	-178.3	178.2	0	112.5	D86	K84-D86 HydrophobicContact CB-CB 4.39Å; K84-D86 PolarHBondContact O-N 3.17Å
85	G	81.6	Confident	88.9	Confident	73 Å²	73	52.9 Å²	52.9	75%	0.753	30%	0.301	S	S	*	.	S	Bend	trans	67.5	7.2	-170	0	0	0	0	0	113.4	D83 G87	D83-G85 PolarHBondContact OD1-N 2.91Å; G85-G87 VanDerWaalsContact C-N 3.28Å; G85-G87 PolarHBondContact O-N 3.01Å
86	D	85.3	Confident	88.8	Confident	98 Å²	98	55.5 Å²	55.5	52%	0.524	32%	0.315	S	S	.	.	S	Bend	trans	-86.2	2.2	-179	75.4	-24.4	0	0	0	113.2	K84 S88	K84-D86 HydrophobicContact CB-CB 4.39Å; K84-D86 PolarHBondContact O-N 3.17Å; D86-S88 PolarHBondContact O-N 2.82Å; D86-S88 WeakPolarHBondContact OD1-CB 3.37Å; D86-S88 PolarHBondContact OD1-N 2.77Å; D86-S88 PolarHBondContact OD1-OG 3.05Å; D86-S88 WeakPolarHBondContact OD2-CB 3.24Å; D86-S88 PolarHBondContact OD2-OG 2.74Å
87	G	84.5	Confident	88.8	Confident	27 Å²	27	56 Å²	56	28%	0.278	32%	0.321	S	S	.	.	S	Bend	trans	64.6	24.8	-175.2	0	0	0	0	0	113.4	G85 R134	G85-G87 VanDerWaalsContact C-N 3.28Å; G85-G87 PolarHBondContact O-N 3.01Å; G87-R134 WeakPolarHBondContact O-CD 3.34Å; G87-R134 PolarHBondContact O-NH1 2.81Å
88	S	89	Confident	88.8	Confident	21 Å²	21	53 Å²	53	15%	0.147	31%	0.313	C	S	.	.			trans	-79.9	-21.7	172.9	66.5	0	0	0	0	113.5	D86 N133 R134	D86-S88 PolarHBondContact O-N 2.82Å; D86-S88 WeakPolarHBondContact OD1-CB 3.37Å; D86-S88 PolarHBondContact OD1-N 2.77Å; D86-S88 PolarHBondContact OD1-OG 3.05Å; D86-S88 WeakPolarHBondContact OD2-CB 3.24Å; D86-S88 PolarHBondContact OD2-OG 2.74Å; S88-N133 CarbonylContact O-C 3.59Å; S88-R134 PolarHBondContact O-N 2.81Å
89	L	91.6	Very high	88.8	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.026	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	160.3	170.2	-58.3	-165.9	0	0	0	112.1	Q82 D83 A131 I132 N133 R134 V140	Q82-L89 HydrophobicContact CB-CD1 4.47Å; D83-L89 HydrophobicContact CB-CD1 3.75Å; D83-L89 HydrophobicContact CB-CG 4.41Å; L89-A131 HydrophobicContact CD1-CB 4.47Å; L89-I132 CarbonylContact C-O 3.49Å; L89-I132 VanDerWaalsContact CA-O 3.3Å; L89-I132 WeakPolarHBondContact CA-O 3.44Å; L89-N133 HydrophobicContact CD2-CB 4.25Å; L89-R134 WeakPolarHBondContact O-CD 3.27Å; L89-R134 WeakPolarHBondContact O-CG 3.36Å; L89-V140 HydrophobicContact CD1-CG2 3.81Å; L89-V140 HydrophobicContact CD2-CB 4.43Å; L89-V140 HydrophobicContact CD2-CG1 3.82Å; L89-V140 HydrophobicContact CD2-CG2 3.81Å; L89-V140 HydrophobicContact CG-CG2 4.47Å
90	K	92	Very high	88.9	Confident	50 Å²	50	54.4 Å²	54.4	22%	0.217	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131	166.8	157	168.2	-179.8	157.7	0	108.6	I92 E106 I132 R134	K90-I92 HydrophobicContact CD-CG1 4.35Å; K90-I92 HydrophobicContact CG-CG1 4.03Å; K90-E106 CarbonylContact C-O 3.55Å; K90-E106 VanDerWaalsContact CA-O 3.22Å; K90-E106 WeakPolarHBondContact CA-O 3.23Å; K90-E106 HydrophobicContact CD-CB 4.43Å; K90-E106 WeakPolarHBondContact CD-OE2 3.25Å; K90-E106 WeakPolarHBondContact CE-OE1 3.45Å; K90-E106 VanDerWaalsContact CE-OE2 3.24Å; K90-E106 WeakPolarHBondContact CE-OE2 3.35Å; K90-E106 HydrophobicContact CG-CB 4.21Å; K90-E106 IonicContact NZ-OE1 3.22Å; K90-E106 PolarHBondContact NZ-OE1 3.01Å; K90-E106 IonicContact NZ-OE2 3.99Å; K90-E106 PolarHBondContact NZ-OE2 2.9Å; K90-I132 HydrophobicContact CB-CG1 3.98Å; K90-I132 HydrophobicContact CD-CD1 4.39Å; K90-I132 HydrophobicContact CG-CD1 4.43Å; K90-I132 HydrophobicContact CG-CG1 4.11Å; K90-I132 PolarHBondContact N-O 2.92Å; K90-I132 PolarHBondContact O-N 2.91Å; K90-R134 HydrophobicContact CB-CG 3.38Å
91	Y	92.6	Very high	89.1	Confident	9 Å²	9	56 Å²	56	4%	0.035	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	140.9	169.6	-59.7	-85.9	0	0	0	110	H79 S80 D83 E106 A131	H79-Y91 PolarHBondContact ND1-OH 2.92Å; S80-Y91 PolarHBondContact N-OH 2.95Å; D83-Y91 WeakPolarHBondContact CB-OH 3.33Å; D83-Y91 WeakPolarHBondContact OD2-CE2 3.22Å; D83-Y91 PolarHBondContact OD2-OH 2.87Å; Y91-E106 PolarHBondContact N-O 2.86Å; Y91-A131 HydrophobicContact CD1-CB 4.26Å; Y91-A131 HydrophobicContact CE1-CB 4.16Å
92	I	92.5	Very high	89.5	Confident	61 Å²	61	50.5 Å²	50.5	31%	0.313	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.6	176.2	-61.6	-177.7	0	0	0	107.9	K90 A129 Q130 I132	K90-I92 HydrophobicContact CD-CG1 4.35Å; K90-I92 HydrophobicContact CG-CG1 4.03Å; I92-A129 VanDerWaalsContact O-CA 3.23Å; I92-A129 WeakPolarHBondContact O-CA 3.36Å; I92-Q130 PolarHBondContact N-O 3.09Å; I92-Q130 PolarHBondContact O-N 2.64Å; I92-I132 HydrophobicContact CD1-CD1 3.65Å; I92-I132 HydrophobicContact CD1-CG1 3.97Å; I92-I132 HydrophobicContact CD1-CG2 4.36Å; I92-I132 HydrophobicContact CG1-CG1 4.46Å
93	L	93.6	Very high	89.8	Confident	24 Å²	24	49.2 Å²	49.2	13%	0.126	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143	175.3	-174.9	66.2	0	0	0	109.4	A98 F102 I104 I111 L127 R128 A129 F146	L93-A98 HydrophobicContact CG-CB 4.09Å; L93-F102 HydrophobicContact CD2-CB 3.98Å; L93-I104 HydrophobicContact CB-CB 3.96Å; L93-I104 HydrophobicContact CB-CD1 4.45Å; L93-I104 HydrophobicContact CB-CG2 3.56Å; L93-I104 HydrophobicContact CD2-CB 4.25Å; L93-I111 HydrophobicContact CD1-CD1 4.42Å; L93-I111 HydrophobicContact CD2-CG2 4.28Å; L93-L127 HydrophobicContact CD1-CB 4Å; L93-L127 HydrophobicContact CD1-CD2 3.72Å; L93-L127 HydrophobicContact CD2-CD2 3.78Å; L93-L127 HydrophobicContact CG-CD2 3.83Å; L93-R128 CarbonylContact C-O 3.57Å; L93-A129 HydrophobicContact CD1-CB 4.5Å; L93-F146 HydrophobicContact CD1-CE1 3.89Å; L93-F146 HydrophobicContact CD1-CZ 3.62Å
94	S	93.3	Very high	90.1	Very high	42 Å²	42	49.3 Å²	49.3	29%	0.294	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	173.5	-178.7	59.4	0	0	0	0	109.9	A98 L127 R128	S94-A98 VanDerWaalsContact C-CB 3.46Å; S94-A98 VanDerWaalsContact CA-CB 3.45Å; S94-L127 CarbonylContact O-C 3.57Å; S94-L127 WeakPolarHBondContact O-CA 3.48Å; S94-R128 PolarHBondContact N-O 3.22Å; S94-R128 PolarHBondContact O-N 3.39Å; S94-R128 WeakPolarHBondContact OG-CB 3.31Å; S94-R128 PolarHBondContact OG-O 2.97Å
95	G	91.9	Very high	90.6	Very high	48 Å²	48	44.1 Å²	44.1	50%	0.495	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	92.2	-158.3	-173.1	0	0	0	0	0	112.9	G97 A98	G95-G97 PolarHBondContact O-N 3.43Å; G95-A98 WeakPolarHBondContact O-CB 3.38Å; G95-A98 PolarHBondContact O-N 3.26Å
96	D	90.4	Very high	91.1	Very high	68 Å²	68	45.3 Å²	45.3	36%	0.364	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	124.9	-168.2	-81	15.8	0	0	0	112.5	A98 K122 Y125 T126 L127	D96-A98 PolarHBondContact O-N 2.68Å; D96-A98 VanDerWaalsContact O-N 3.13Å; D96-K122 IonicContact OD2-NZ 2.72Å; D96-K122 PolarHBondContact OD2-NZ 2.78Å; D96-Y125 HydrophobicContact CB-CD1 4.18Å; D96-T126 PolarHBondContact N-O 2.93Å; D96-L127 WeakPolarHBondContact O-CD2 3.26Å; D96-L127 WeakPolarHBondContact O-CG 3.39Å
97	G	88.1	Confident	91.2	Very high	19 Å²	19	47.7 Å²	47.7	20%	0.196	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	2	-179.6	0	0	0	0	0	115.1	G95 G99 T100 L101 F102	G95-G97 PolarHBondContact O-N 3.43Å; G97-G99 PolarHBondContact O-N 3.38Å; G97-T100 PolarHBondContact O-N 3.34Å; G97-T100 VanDerWaalsContact O-N 3.09Å; G97-T100 PolarHBondContact O-OG1 2.97Å; G97-L101 PolarHBondContact O-N 3.5Å; G97-F102 PolarHBondContact O-N 2.91Å
98	A	91.1	Very high	91.5	Very high	29 Å²	29	48.9 Å²	48.9	24%	0.24	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-63.6	120.2	-179	0	0	0	0	0	111.6	L93 S94 G95 D96 L127	L93-A98 HydrophobicContact CG-CB 4.09Å; S94-A98 VanDerWaalsContact C-CB 3.46Å; S94-A98 VanDerWaalsContact CA-CB 3.45Å; G95-A98 WeakPolarHBondContact O-CB 3.38Å; G95-A98 PolarHBondContact O-N 3.26Å; D96-A98 PolarHBondContact O-N 2.68Å; D96-A98 VanDerWaalsContact O-N 3.13Å; A98-L127 HydrophobicContact CB-CD2 4.23Å
99	G	87	Confident	91.6	Very high	60 Å²	60	47.9 Å²	47.9	62%	0.619	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	-1.2	-176.9	0	0	0	0	0	115.6	G97 F102	G97-G99 PolarHBondContact O-N 3.38Å; G99-F102 PolarHBondContact N-O 2.62Å
100	T	90.6	Very high	91.6	Very high	100 Å²	100	49.1 Å²	49.1	61%	0.613	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.7	-37.8	179.8	55.4	0	0	0	0	114	G97 T114	G97-T100 PolarHBondContact O-N 3.34Å; G97-T100 VanDerWaalsContact O-N 3.09Å; G97-T100 PolarHBondContact O-OG1 2.97Å; T100-T114 PolarHBondContact O-OG1 2.9Å
101	L	92.2	Very high	91.7	Very high	35 Å²	35	46.8 Å²	46.8	18%	0.183	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-45.5	170.6	-65	173.1	0	0	0	110.3	G97 A113 T114 R115 Y125	G97-L101 PolarHBondContact O-N 3.5Å; L101-A113 CarbonylContact O-C 3.57Å; L101-A113 VanDerWaalsContact O-CA 3.27Å; L101-A113 WeakPolarHBondContact O-CA 3.48Å; L101-T114 PolarHBondContact O-N 3.06Å; L101-T114 PolarHBondContact O-OG1 2.81Å; L101-R115 HydrophobicContact CD2-CB 4.22Å; L101-R115 HydrophobicContact CD2-CG 4.5Å; L101-Y125 HydrophobicContact CD1-CD1 4.35Å; L101-Y125 HydrophobicContact CD1-CE1 3.52Å
102	F	94	Very high	91.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.3	-178.3	-54.4	-70.8	0	0	0	110.9	L63 V75 L93 G97 G99 I111 H112 A113 I117 Y125 L127 I148	L63-F102 HydrophobicContact CD1-CE1 3.79Å; V75-F102 HydrophobicContact CG2-CD1 4.25Å; L93-F102 HydrophobicContact CD2-CB 3.98Å; G97-F102 PolarHBondContact O-N 2.91Å; G99-F102 PolarHBondContact N-O 2.62Å; F102-I111 HydrophobicContact CB-CG2 4.42Å; F102-H112 WeakPolarHBondContact CA-O 3.42Å; F102-A113 HydrophobicContact CD1-CB 3.97Å; F102-A113 HydrophobicContact CE1-CB 3.9Å; F102-I117 HydrophobicContact CE1-CD1 3.66Å; F102-I117 HydrophobicContact CZ-CD1 3.63Å; F102-Y125 AromaticContact CE2-CD1 3.74Å; F102-Y125 HydrophobicContact CE2-CD1 3.74Å; F102-Y125 AromaticContact CE2-CD2 4Å; F102-Y125 HydrophobicContact CE2-CD2 4Å; F102-Y125 HydrophobicContact CE2-CE1 4.3Å; F102-Y125 AromaticContact CE2-CG 3.57Å; F102-Y125 HydrophobicContact CE2-CG 3.57Å; F102-Y125 HydrophobicContact CZ-CD1 4.4Å; F102-Y125 AromaticContact CZ-CD2 3.88Å; F102-Y125 HydrophobicContact CZ-CD2 3.88Å; F102-Y125 HydrophobicContact CZ-CE2 4.28Å; F102-Y125 AromaticContact CZ-CG 3.95Å; F102-Y125 HydrophobicContact CZ-CG 3.95Å; F102-L127 HydrophobicContact CB-CD2 3.92Å; F102-L127 HydrophobicContact CD2-CD1 4.05Å; F102-L127 HydrophobicContact CD2-CD2 3.83Å; F102-L127 HydrophobicContact CE2-CD1 4.21Å; F102-L127 HydrophobicContact CG-CD2 4.12Å; F102-I148 HydrophobicContact CD1-CD1 3.51Å; F102-I148 HydrophobicContact CD2-CD1 4.08Å; F102-I148 HydrophobicContact CE1-CD1 3.48Å; F102-I148 VanDerWaalsContact CE1-CD1 3.48Å; F102-I148 HydrophobicContact CE1-CG2 4.25Å; F102-I148 HydrophobicContact CE2-CD1 4.05Å; F102-I148 HydrophobicContact CG-CD1 3.82Å; F102-I148 HydrophobicContact CZ-CB 4.44Å; F102-I148 HydrophobicContact CZ-CD1 3.75Å; F102-I148 HydrophobicContact CZ-CG2 4.26Å
103	I	93.8	Very high	91.7	Very high	61 Å²	61	46 Å²	46	31%	0.313	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	150.5	173.5	62.5	172.9	0	0	0	110.2	Y72 I111 H112 T114	Y72-I103 HydrophobicContact CD2-CD1 3.85Å; Y72-I103 HydrophobicContact CE2-CD1 3.84Å; I103-I111 CarbonylContact O-C 3.47Å; I103-I111 VanDerWaalsContact O-CA 3.27Å; I103-I111 WeakPolarHBondContact O-CA 3.48Å; I103-H112 HydrophobicContact CG1-CB 4.14Å; I103-H112 PolarHBondContact N-O 3.5Å; I103-H112 PolarHBondContact O-N 3.41Å; I103-T114 HydrophobicContact CB-CG2 4.27Å; I103-T114 HydrophobicContact CD1-CG2 3.61Å; I103-T114 HydrophobicContact CG1-CG2 3.64Å; I103-T114 HydrophobicContact CG2-CG2 3.72Å
104	I	93.9	Very high	91.5	Very high	30 Å²	30	46.6 Å²	46.6	15%	0.154	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.2	172.2	-165	165.7	0	0	0	109.5	L78 L93 E106 D110 I111	L78-I104 HydrophobicContact CD1-CD1 4.37Å; L93-I104 HydrophobicContact CB-CB 3.96Å; L93-I104 HydrophobicContact CB-CD1 4.45Å; L93-I104 HydrophobicContact CB-CG2 3.56Å; L93-I104 HydrophobicContact CD2-CB 4.25Å; I104-E106 PolarHBondContact O-N 3.43Å; I104-D110 WeakPolarHBondContact CA-O 3.31Å; I104-I111 HydrophobicContact CB-CG1 4.25Å; I104-I111 HydrophobicContact CD1-CD1 4.31Å; I104-I111 HydrophobicContact CD1-CG1 3.85Å; I104-I111 HydrophobicContact CG1-CG1 3.86Å
105	D	92.6	Very high	91.2	Very high	67 Å²	67	53.1 Å²	53.1	36%	0.358	30%	0.299	S	S	.	.			trans	-71	119.8	166.6	-178	-65.4	0	0	0	109.1	K107 T108 G109 D110	D105-K107 PolarHBondContact O-N 2.92Å; D105-K107 WeakPolarHBondContact OD1-CA 3.45Å; D105-K107 WeakPolarHBondContact OD1-CB 3.49Å; D105-K107 PolarHBondContact OD1-N 2.9Å; D105-T108 VanDerWaalsContact CB-OG1 3.31Å; D105-T108 WeakPolarHBondContact CB-OG1 3.27Å; D105-T108 PolarHBondContact O-N 2.75Å; D105-T108 PolarHBondContact OD1-N 2.91Å; D105-T108 PolarHBondContact OD1-OG1 3.22Å; D105-G109 WeakPolarHBondContact O-CA 3.1Å; D105-G109 PolarHBondContact O-N 3Å; D105-D110 PolarHBondContact N-O 2.55Å
106	E	92.3	Very high	91	Very high	98 Å²	98	57.1 Å²	57.1	46%	0.458	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.7	-175.3	-58.8	-165	167.4	0	0	114.2	K90 Y91 I104	K90-E106 CarbonylContact C-O 3.55Å; K90-E106 VanDerWaalsContact CA-O 3.22Å; K90-E106 WeakPolarHBondContact CA-O 3.23Å; K90-E106 HydrophobicContact CD-CB 4.43Å; K90-E106 WeakPolarHBondContact CD-OE2 3.25Å; K90-E106 WeakPolarHBondContact CE-OE1 3.45Å; K90-E106 VanDerWaalsContact CE-OE2 3.24Å; K90-E106 WeakPolarHBondContact CE-OE2 3.35Å; K90-E106 HydrophobicContact CG-CB 4.21Å; K90-E106 IonicContact NZ-OE1 3.22Å; K90-E106 PolarHBondContact NZ-OE1 3.01Å; K90-E106 IonicContact NZ-OE2 3.99Å; K90-E106 PolarHBondContact NZ-OE2 2.9Å; Y91-E106 PolarHBondContact N-O 2.86Å; I104-E106 PolarHBondContact O-N 3.43Å
107	K	89.3	Confident	91	Very high	147 Å²	147	54.1 Å²	54.1	64%	0.639	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-41.3	-176.3	-52.5	168.7	-169.1	154.9	0	112.3	D105	D105-K107 PolarHBondContact O-N 2.92Å; D105-K107 WeakPolarHBondContact OD1-CA 3.45Å; D105-K107 WeakPolarHBondContact OD1-CB 3.49Å; D105-K107 PolarHBondContact OD1-N 2.9Å
108	T	90.2	Very high	91.2	Very high	53 Å²	53	56.2 Å²	56.2	33%	0.325	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-17.6	-172.7	69.2	0	0	0	0	113.3	K77 D105 D110	K77-T108 VanDerWaalsContact CE-O 3.25Å; K77-T108 WeakPolarHBondContact CE-O 3.39Å; K77-T108 PolarHBondContact NZ-O 3.34Å; D105-T108 VanDerWaalsContact CB-OG1 3.31Å; D105-T108 WeakPolarHBondContact CB-OG1 3.27Å; D105-T108 PolarHBondContact O-N 2.75Å; D105-T108 PolarHBondContact OD1-N 2.91Å; D105-T108 PolarHBondContact OD1-OG1 3.22Å; T108-D110 VanDerWaalsContact C-N 3.25Å; T108-D110 WeakPolarHBondContact CB-OD2 3.43Å; T108-D110 PolarHBondContact O-N 2.95Å; T108-D110 VanDerWaalsContact OG1-CG 3.3Å; T108-D110 PolarHBondContact OG1-N 2.8Å; T108-D110 PolarHBondContact OG1-OD2 2.94Å
109	G	90	Very high	91.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.28	C	S	.	.			trans	73.9	10.9	-177.1	0	0	0	0	0	114.6	L78 D105	L78-G109 PolarHBondContact N-O 2.91Å; L78-G109 WeakPolarHBondContact O-CA 3.35Å; D105-G109 WeakPolarHBondContact O-CA 3.1Å; D105-G109 PolarHBondContact O-N 3Å
110	D	92.4	Very high	91.6	Very high	31 Å²	31	55.6 Å²	55.6	17%	0.166	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	124.7	178.8	-62.3	-49.6	0	0	0	110.9	Y74 K77 I104 D105 T108	Y74-D110 HydrophobicContact CE2-CB 4.06Å; K77-D110 WeakPolarHBondContact CB-OD1 3.28Å; K77-D110 WeakPolarHBondContact CD-OD1 3.49Å; K77-D110 VanDerWaalsContact CG-OD1 3.28Å; K77-D110 WeakPolarHBondContact CG-OD1 3.46Å; K77-D110 IonicContact NZ-OD1 2.73Å; K77-D110 PolarHBondContact NZ-OD1 2.93Å; K77-D110 IonicContact NZ-OD2 2.94Å; K77-D110 PolarHBondContact NZ-OD2 3.22Å; I104-D110 WeakPolarHBondContact CA-O 3.31Å; D105-D110 PolarHBondContact N-O 2.55Å; T108-D110 VanDerWaalsContact C-N 3.25Å; T108-D110 WeakPolarHBondContact CB-OD2 3.43Å; T108-D110 PolarHBondContact O-N 2.95Å; T108-D110 VanDerWaalsContact OG1-CG 3.3Å; T108-D110 PolarHBondContact OG1-N 2.8Å; T108-D110 PolarHBondContact OG1-OD2 2.94Å
111	I	93.2	Very high	91.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.5	-179.5	-57	172.6	0	0	0	109.6	V75 G76 L78 L93 F102 I103 I104 F146	V75-I111 HydrophobicContact CB-CB 4.12Å; V75-I111 HydrophobicContact CB-CG2 3.93Å; V75-I111 HydrophobicContact CG2-CB 4.39Å; V75-I111 HydrophobicContact CG2-CG2 3.78Å; V75-I111 PolarHBondContact N-O 2.8Å; G76-I111 PolarHBondContact O-N 3.36Å; L78-I111 HydrophobicContact CD1-CD1 3.77Å; L78-I111 HydrophobicContact CG-CD1 3.86Å; L93-I111 HydrophobicContact CD1-CD1 4.42Å; L93-I111 HydrophobicContact CD2-CG2 4.28Å; F102-I111 HydrophobicContact CB-CG2 4.42Å; I103-I111 CarbonylContact O-C 3.47Å; I103-I111 VanDerWaalsContact O-CA 3.27Å; I103-I111 WeakPolarHBondContact O-CA 3.48Å; I104-I111 HydrophobicContact CB-CG1 4.25Å; I104-I111 HydrophobicContact CD1-CD1 4.31Å; I104-I111 HydrophobicContact CD1-CG1 3.85Å; I104-I111 HydrophobicContact CG1-CG1 3.86Å; I111-F146 HydrophobicContact CD1-CE1 4.49Å; I111-F146 HydrophobicContact CD1-CE2 4.27Å; I111-F146 HydrophobicContact CD1-CZ 3.69Å
112	H	93.1	Very high	91.6	Very high	53 Å²	53	60.3 Å²	60.3	25%	0.245	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.7	177.7	-57.8	75.2	0	0	0	111.3	Q73 Y74 F102 I103	Q73-H112 CarbonylContact O-C 3.57Å; Q73-H112 VanDerWaalsContact O-CA 3.31Å; Q73-H112 WeakPolarHBondContact O-CA 3.49Å; Y74-H112 AromaticContact CD2-NE2 3.79Å; F102-H112 WeakPolarHBondContact CA-O 3.42Å; I103-H112 HydrophobicContact CG1-CB 4.14Å; I103-H112 PolarHBondContact N-O 3.5Å; I103-H112 PolarHBondContact O-N 3.41Å
113	A	92.7	Very high	91.4	Very high	2 Å²	2	61.4 Å²	61.4	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.2	167.3	0	0	0	0	0	110.5	L63 Y72 Q73 V75 L101 F102 I117	L63-A113 HydrophobicContact CD1-CB 4.06Å; Y72-A113 CarbonylContact C-O 3.52Å; Y72-A113 WeakPolarHBondContact CA-O 3.08Å; Y72-A113 WeakPolarHBondContact CB-O 3.35Å; Q73-A113 HydrophobicContact CB-CB 4.29Å; Q73-A113 PolarHBondContact N-O 2.65Å; Q73-A113 PolarHBondContact O-N 2.81Å; V75-A113 HydrophobicContact CG2-CB 4.45Å; L101-A113 CarbonylContact O-C 3.57Å; L101-A113 VanDerWaalsContact O-CA 3.27Å; L101-A113 WeakPolarHBondContact O-CA 3.48Å; F102-A113 HydrophobicContact CD1-CB 3.97Å; F102-A113 HydrophobicContact CE1-CB 3.9Å; A113-I117 HydrophobicContact CB-CD1 4.05Å
114	T	89.9	Confident	91.4	Very high	36 Å²	36	64.1 Å²	64.1	22%	0.221	30%	0.297	C	S	.	.			trans	-95.5	2.5	-171.3	58.5	0	0	0	0	114.6	Y72 T100 L101 I103	Y72-T114 HydrophobicContact CD1-CG2 4.22Å; Y72-T114 HydrophobicContact CD2-CG2 4.1Å; Y72-T114 HydrophobicContact CE1-CG2 4.14Å; Y72-T114 HydrophobicContact CE2-CG2 4.03Å; Y72-T114 HydrophobicContact CG-CG2 4.19Å; T100-T114 PolarHBondContact O-OG1 2.9Å; L101-T114 PolarHBondContact O-N 3.06Å; L101-T114 PolarHBondContact O-OG1 2.81Å; I103-T114 HydrophobicContact CB-CG2 4.27Å; I103-T114 HydrophobicContact CD1-CG2 3.61Å; I103-T114 HydrophobicContact CG1-CG2 3.64Å; I103-T114 HydrophobicContact CG2-CG2 3.72Å
115	R	86.7	Confident	91.4	Very high	179 Å²	179	63.2 Å²	63.2	68%	0.675	29%	0.292	S	S	*	.	S	Bend	trans	-145.2	164.2	-177.7	-77	-177.7	153.8	-150.1	-6.3	108.6	L101	L101-R115 HydrophobicContact CD2-CB 4.22Å; L101-R115 HydrophobicContact CD2-CG 4.5Å
116	R	87.3	Confident	91.4	Very high	131 Å²	131	62 Å²	62	49%	0.494	29%	0.287	S	S	.	.			trans	-63	152.5	158.4	-61	-166.5	-178.3	169.4	-0.5	109.7	E66 Y67	E66-R116 VanDerWaalsContact OE1-CB 3.26Å; E66-R116 WeakPolarHBondContact OE1-CB 3.49Å; E66-R116 WeakPolarHBondContact OE1-CD 3.49Å; E66-R116 WeakPolarHBondContact OE2-CD 3.38Å; E66-R116 IonicContact OE2-CZ 2.77Å; E66-R116 IonicContact OE2-NE 2.91Å; E66-R116 IonicContact OE2-NH1 2.78Å; E66-R116 PolarHBondContact OE2-NH1 2.71Å; Y67-R116 PolarHBondContact O-NE 2.88Å; Y67-R116 VanDerWaalsContact O-NE 3.16Å
117	I	90.7	Very high	91.5	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.026	27%	0.266	C	S	.	.			trans	-130.5	146.9	177.5	-57.6	173.9	0	0	0	105.4	L63 E65 E66 F102 A113 Y125 I150	L63-I117 HydrophobicContact CD1-CD1 4.08Å; E65-I117 WeakPolarHBondContact CA-O 3.34Å; E65-I117 VanDerWaalsContact CB-O 3.31Å; E65-I117 WeakPolarHBondContact CB-O 3.37Å; E66-I117 PolarHBondContact N-O 2.71Å; F102-I117 HydrophobicContact CE1-CD1 3.66Å; F102-I117 HydrophobicContact CZ-CD1 3.63Å; A113-I117 HydrophobicContact CB-CD1 4.05Å; I117-Y125 HydrophobicContact CG2-CE2 3.77Å; I117-I150 HydrophobicContact CB-CD1 4.33Å; I117-I150 HydrophobicContact CD1-CD1 4.1Å; I117-I150 HydrophobicContact CG2-CD1 3.62Å; I117-I150 HydrophobicContact CG2-CG1 3.73Å; I117-I150 HydrophobicContact CG2-CG2 4.2Å
118	D	92.5	Very high	91.6	Very high	63 Å²	63	55.7 Å²	55.7	34%	0.337	26%	0.255	S	S	.	.			trans	-128.6	128.9	-171.3	162.9	-25.8	0	0	0	105.6	E120 E121 K122	D118-E120 WeakPolarHBondContact OD1-CA 3.21Å; D118-E120 WeakPolarHBondContact OD1-CB 3.36Å; D118-E120 PolarHBondContact OD1-N 3.15Å; D118-E121 HydrophobicContact CB-CB 4.1Å; D118-E121 PolarHBondContact OD1-N 3.04Å; D118-K122 PolarHBondContact O-N 2.91Å
119	R	92.9	Very high	91.7	Very high	8 Å²	8	53.7 Å²	53.7	3%	0.03	24%	0.244	C	C	.	.	H	α-helix	trans	-77.7	-28.5	-173.7	-161.6	-167.8	60.7	35.7	3.3	111.4	E65 K122 A123 I150 D152 A187	E65-R119 WeakPolarHBondContact OE1-CB 3.28Å; E65-R119 WeakPolarHBondContact OE2-CB 3.01Å; E65-R119 PolarHBondContact OE2-N 2.96Å; R119-K122 CarbonylContact O-C 3.54Å; R119-A123 HydrophobicContact CG-CB 3.81Å; R119-A123 PolarHBondContact O-N 2.82Å; R119-I150 HydrophobicContact CB-CB 4.44Å; R119-I150 HydrophobicContact CB-CG2 3.91Å; R119-I150 HydrophobicContact CG-CB 4.18Å; R119-I150 HydrophobicContact CG-CG2 4.15Å; R119-D152 IonicContact CZ-OD1 2.68Å; R119-D152 VanDerWaalsContact CZ-OD1 3.24Å; R119-D152 IonicContact NE-OD1 2.93Å; R119-D152 PolarHBondContact NE-OD1 3.48Å; R119-D152 IonicContact NH2-OD1 2.62Å; R119-D152 PolarHBondContact NH2-OD1 2.96Å; R119-A187 PolarHBondContact NH2-O 2.84Å
120	E	92.5	Very high	91.7	Very high	69 Å²	69	56.4 Å²	56.4	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-70.3	-36.5	173.3	-77.3	50.8	-95.1	0	0	110.7	D118 N156 A187	D118-E120 WeakPolarHBondContact OD1-CA 3.21Å; D118-E120 WeakPolarHBondContact OD1-CB 3.36Å; D118-E120 PolarHBondContact OD1-N 3.15Å; E120-N156 PolarHBondContact OE2-ND2 3.07Å; E120-A187 HydrophobicContact CG-CB 4.07Å
121	E	91.2	Very high	91.7	Very high	156 Å²	156	55.3 Å²	55.3	73%	0.729	25%	0.252	S	S	*	.	H	α-helix	trans	-68.7	-50.4	170.4	-170.3	-177.2	-154.1	0	0	110.5	D118	D118-E121 HydrophobicContact CB-CB 4.1Å; D118-E121 PolarHBondContact OD1-N 3.04Å
122	K	91.5	Very high	91.7	Very high	77 Å²	77	56 Å²	56	34%	0.335	26%	0.256	S	S	.	.	H	α-helix	trans	-162.1	99	177.7	-173.7	156.8	172.1	168.9	0	115.5	D96 D118 R119 F124 Y125 I150	D96-K122 IonicContact OD2-NZ 2.72Å; D96-K122 PolarHBondContact OD2-NZ 2.78Å; D118-K122 PolarHBondContact O-N 2.91Å; R119-K122 CarbonylContact O-C 3.54Å; K122-F124 VanDerWaalsContact C-N 3.29Å; K122-F124 WeakPolarHBondContact CE-O 3.44Å; K122-F124 WeakPolarHBondContact CG-O 3.38Å; K122-F124 PolarHBondContact O-N 3.31Å; K122-F124 VanDerWaalsContact O-N 3.1Å; K122-Y125 HydrophobicContact CB-CE1 4.46Å; K122-Y125 HydrophobicContact CB-CE2 4.23Å; K122-Y125 HydrophobicContact CD-CD1 4.07Å; K122-Y125 HydrophobicContact CD-CE1 3.73Å; K122-Y125 HydrophobicContact CG-CD2 4.49Å; K122-Y125 HydrophobicContact CG-CE1 4.14Å; K122-Y125 HydrophobicContact CG-CE2 4.07Å; K122-Y125 WeakPolarHBondContact O-CE2 3.39Å; K122-I150 WeakPolarHBondContact O-CG1 3.44Å
123	A	91.4	Very high	91.6	Very high	24 Å²	24	55.1 Å²	55.1	20%	0.198	25%	0.253	C	S	.	.	S	Bend	trans	-57.7	-21.8	178.3	0	0	0	0	0	117.4	R119 I150	R119-A123 HydrophobicContact CG-CB 3.81Å; R119-A123 PolarHBondContact O-N 2.82Å; A123-I150 PolarHBondContact O-N 2.83Å
124	F	92.4	Very high	91.3	Very high	117 Å²	117	61.7 Å²	61.7	51%	0.513	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	153.1	176.7	68.4	-88	0	0	0	114.9	K122 V147 I148 K149	K122-F124 VanDerWaalsContact C-N 3.29Å; K122-F124 WeakPolarHBondContact CE-O 3.44Å; K122-F124 WeakPolarHBondContact CG-O 3.38Å; K122-F124 PolarHBondContact O-N 3.31Å; K122-F124 VanDerWaalsContact O-N 3.1Å; F124-V147 HydrophobicContact CB-CG1 3.95Å; F124-V147 HydrophobicContact CD2-CG1 4.21Å; F124-V147 HydrophobicContact CG-CG1 4.48Å; F124-I148 CarbonylContact C-O 3.56Å; F124-I148 VanDerWaalsContact CA-O 3.3Å; F124-I148 WeakPolarHBondContact CA-O 3.37Å; F124-K149 HydrophobicContact CB-CG 4.31Å
125	Y	93.9	Very high	91.2	Very high	12 Å²	12	70.4 Å²	70.4	5%	0.047	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.4	179.7	-60.4	-101.6	0	0	0	110.7	D96 L101 F102 I117 K122 V147 I148 I150	D96-Y125 HydrophobicContact CB-CD1 4.18Å; L101-Y125 HydrophobicContact CD1-CD1 4.35Å; L101-Y125 HydrophobicContact CD1-CE1 3.52Å; F102-Y125 AromaticContact CE2-CD1 3.74Å; F102-Y125 HydrophobicContact CE2-CD1 3.74Å; F102-Y125 AromaticContact CE2-CD2 4Å; F102-Y125 HydrophobicContact CE2-CD2 4Å; F102-Y125 HydrophobicContact CE2-CE1 4.3Å; F102-Y125 AromaticContact CE2-CG 3.57Å; F102-Y125 HydrophobicContact CE2-CG 3.57Å; F102-Y125 HydrophobicContact CZ-CD1 4.4Å; F102-Y125 AromaticContact CZ-CD2 3.88Å; F102-Y125 HydrophobicContact CZ-CD2 3.88Å; F102-Y125 HydrophobicContact CZ-CE2 4.28Å; F102-Y125 AromaticContact CZ-CG 3.95Å; F102-Y125 HydrophobicContact CZ-CG 3.95Å; I117-Y125 HydrophobicContact CG2-CE2 3.77Å; K122-Y125 HydrophobicContact CB-CE1 4.46Å; K122-Y125 HydrophobicContact CB-CE2 4.23Å; K122-Y125 HydrophobicContact CD-CD1 4.07Å; K122-Y125 HydrophobicContact CD-CE1 3.73Å; K122-Y125 HydrophobicContact CG-CD2 4.49Å; K122-Y125 HydrophobicContact CG-CE1 4.14Å; K122-Y125 HydrophobicContact CG-CE2 4.07Å; K122-Y125 WeakPolarHBondContact O-CE2 3.39Å; Y125-V147 CarbonylContact O-C 3.58Å; Y125-V147 WeakPolarHBondContact O-CA 3.27Å; Y125-I148 PolarHBondContact N-O 3.4Å; Y125-I148 PolarHBondContact O-N 3.04Å; Y125-I150 HydrophobicContact CD2-CD1 4.21Å; Y125-I150 HydrophobicContact CD2-CG1 4.25Å; Y125-I150 HydrophobicContact CE2-CD1 4.05Å; Y125-I150 HydrophobicContact CE2-CG1 3.95Å
126	T	94.2	Very high	91.3	Very high	42 Å²	42	66 Å²	66	26%	0.258	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	119	178.1	-56.9	0	0	0	0	110.8	D96 E145	D96-T126 PolarHBondContact N-O 2.93Å; T126-E145 HydrophobicContact CG2-CG 3.69Å
127	L	93.1	Very high	91.3	Very high	0 Å²	0	66 Å²	66	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	159.1	-177.1	-67.8	95.2	0	0	0	112	L93 S94 D96 A98 F102 E145 F146 I148	L93-L127 HydrophobicContact CD1-CB 4Å; L93-L127 HydrophobicContact CD1-CD2 3.72Å; L93-L127 HydrophobicContact CD2-CD2 3.78Å; L93-L127 HydrophobicContact CG-CD2 3.83Å; S94-L127 CarbonylContact O-C 3.57Å; S94-L127 WeakPolarHBondContact O-CA 3.48Å; D96-L127 WeakPolarHBondContact O-CD2 3.26Å; D96-L127 WeakPolarHBondContact O-CG 3.39Å; A98-L127 HydrophobicContact CB-CD2 4.23Å; F102-L127 HydrophobicContact CB-CD2 3.92Å; F102-L127 HydrophobicContact CD2-CD1 4.05Å; F102-L127 HydrophobicContact CD2-CD2 3.83Å; F102-L127 HydrophobicContact CE2-CD1 4.21Å; F102-L127 HydrophobicContact CG-CD2 4.12Å; L127-E145 WeakPolarHBondContact O-CA 3.42Å; L127-F146 HydrophobicContact CB-CD2 4.48Å; L127-F146 HydrophobicContact CB-CE1 3.97Å; L127-F146 HydrophobicContact CB-CE2 3.92Å; L127-F146 HydrophobicContact CB-CZ 3.64Å; L127-F146 PolarHBondContact N-O 3.04Å; L127-F146 PolarHBondContact O-N 3.36Å; L127-I148 HydrophobicContact CD1-CD1 3.68Å; L127-I148 HydrophobicContact CD1-CG1 3.96Å
128	R	92.5	Very high	91.3	Very high	112 Å²	112	74.5 Å²	74.5	42%	0.423	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.6	178.2	-68.3	-179.2	-175.8	162	5.9	110.6	L93 S94 E143 S144 E145	L93-R128 CarbonylContact C-O 3.57Å; S94-R128 PolarHBondContact N-O 3.22Å; S94-R128 PolarHBondContact O-N 3.39Å; S94-R128 WeakPolarHBondContact OG-CB 3.31Å; S94-R128 PolarHBondContact OG-O 2.97Å; R128-E143 HydrophobicContact CB-CG 3.98Å; R128-E143 WeakPolarHBondContact CB-OE1 2.86Å; R128-E143 WeakPolarHBondContact CD-OE1 3.35Å; R128-E143 HydrophobicContact CG-CG 4.49Å; R128-S144 WeakPolarHBondContact CA-O 3.27Å; R128-E145 HydrophobicContact CG-CB 4Å; R128-E145 HydrophobicContact CG-CG 4.02Å; R128-E145 IonicContact CZ-OE2 3.75Å; R128-E145 IonicContact NE-OE2 2.86Å; R128-E145 PolarHBondContact NE-OE2 2.89Å; R128-E145 IonicContact NH2-OE2 2.77Å; R128-E145 PolarHBondContact NH2-OE2 3.19Å
129	A	91.3	Very high	91.1	Very high	11 Å²	11	74.9 Å²	74.9	9%	0.091	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	151.2	178	0	0	0	0	0	112.9	L78 I92 L93 E143 S144 F146	L78-A129 HydrophobicContact CD1-CB 3.18Å; I92-A129 VanDerWaalsContact O-CA 3.23Å; I92-A129 WeakPolarHBondContact O-CA 3.36Å; L93-A129 HydrophobicContact CD1-CB 4.5Å; A129-E143 WeakPolarHBondContact O-CA 3.36Å; A129-S144 PolarHBondContact N-O 2.83Å; A129-S144 PolarHBondContact O-N 3.29Å; A129-F146 HydrophobicContact CB-CE1 3.99Å
130	Q	91.1	Very high	91	Very high	56 Å²	56	76.2 Å²	76.2	26%	0.262	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	132.2	177.8	-172.2	176	95.2	0	0	110.6	I92 I132 P139	I92-Q130 PolarHBondContact N-O 3.09Å; I92-Q130 PolarHBondContact O-N 2.64Å; Q130-I132 HydrophobicContact CG-CG2 4.05Å; Q130-P139 HydrophobicContact CG-CB 4.13Å; Q130-P139 HydrophobicContact CG-CG 4.49Å
131	A	91.5	Very high	90.6	Very high	8 Å²	8	74.9 Å²	74.9	7%	0.066	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.7	167.8	0	0	0	0	0	109.3	L89 Y91 P139 V140	L89-A131 HydrophobicContact CD1-CB 4.47Å; Y91-A131 HydrophobicContact CD1-CB 4.26Å; Y91-A131 HydrophobicContact CE1-CB 4.16Å; A131-P139 WeakPolarHBondContact O-CA 3.37Å; A131-V140 HydrophobicContact CB-CG2 3.75Å; A131-V140 WeakPolarHBondContact O-CG2 3.42Å; A131-V140 PolarHBondContact O-N 3.48Å
132	I	92.8	Very high	90.4	Very high	15 Å²	15	71.8 Å²	71.8	8%	0.077	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	149.6	175.6	66.1	159.9	0	0	0	111.2	L89 K90 I92 Q130 L137 R138	L89-I132 CarbonylContact C-O 3.49Å; L89-I132 VanDerWaalsContact CA-O 3.3Å; L89-I132 WeakPolarHBondContact CA-O 3.44Å; K90-I132 HydrophobicContact CB-CG1 3.98Å; K90-I132 HydrophobicContact CD-CD1 4.39Å; K90-I132 HydrophobicContact CG-CD1 4.43Å; K90-I132 HydrophobicContact CG-CG1 4.11Å; K90-I132 PolarHBondContact N-O 2.92Å; K90-I132 PolarHBondContact O-N 2.91Å; I92-I132 HydrophobicContact CD1-CD1 3.65Å; I92-I132 HydrophobicContact CD1-CG1 3.97Å; I92-I132 HydrophobicContact CD1-CG2 4.36Å; I92-I132 HydrophobicContact CG1-CG1 4.46Å; Q130-I132 HydrophobicContact CG-CG2 4.05Å; I132-L137 HydrophobicContact CD1-CD2 4.02Å; I132-R138 CarbonylContact C-O 3.57Å; I132-R138 WeakPolarHBondContact CA-O 3.46Å
133	N	90.9	Very high	90.3	Very high	35 Å²	35	72.8 Å²	72.8	19%	0.187	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.7	171.6	-177.5	-74.8	0	0	0	110.7	S88 L89 R135 T136 L137 R138 V140	S88-N133 CarbonylContact O-C 3.59Å; L89-N133 HydrophobicContact CD2-CB 4.25Å; N133-R135 PolarHBondContact O-N 3.13Å; N133-R135 VanDerWaalsContact O-N 3.13Å; N133-R135 WeakPolarHBondContact OD1-CB 3.4Å; N133-R135 PolarHBondContact OD1-N 2.87Å; N133-T136 WeakPolarHBondContact CB-OG1 3.44Å; N133-T136 PolarHBondContact O-N 3.48Å; N133-T136 PolarHBondContact OD1-N 2.93Å; N133-T136 PolarHBondContact OD1-OG1 2.82Å; N133-L137 WeakPolarHBondContact O-CA 3.41Å; N133-L137 PolarHBondContact O-N 2.87Å; N133-R138 PolarHBondContact N-O 2.93Å; N133-V140 HydrophobicContact CB-CG1 3.95Å
134	R	87.8	Confident	90.1	Very high	140 Å²	140	72.7 Å²	72.7	53%	0.528	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.1	-175.1	-71.6	177.1	70.8	-126.5	4.1	114.9	G87 S88 L89 K90	G87-R134 WeakPolarHBondContact O-CD 3.34Å; G87-R134 PolarHBondContact O-NH1 2.81Å; S88-R134 PolarHBondContact O-N 2.81Å; L89-R134 WeakPolarHBondContact O-CD 3.27Å; L89-R134 WeakPolarHBondContact O-CG 3.36Å; K90-R134 HydrophobicContact CB-CG 3.38Å
135	R	87.3	Confident	90	Very high	219 Å²	219	71.8 Å²	71.8	83%	0.826	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-33	177.4	-58.6	-169.8	-169.5	-167.4	6.2	113.4	N133	N133-R135 PolarHBondContact O-N 3.13Å; N133-R135 VanDerWaalsContact O-N 3.13Å; N133-R135 WeakPolarHBondContact OD1-CB 3.4Å; N133-R135 PolarHBondContact OD1-N 2.87Å
136	T	88	Confident	89.8	Confident	86 Å²	86	71.7 Å²	71.7	53%	0.528	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-12.7	-175.9	62.6	0	0	0	0	113.4	N133 R138	N133-T136 WeakPolarHBondContact CB-OG1 3.44Å; N133-T136 PolarHBondContact O-N 3.48Å; N133-T136 PolarHBondContact OD1-N 2.93Å; N133-T136 PolarHBondContact OD1-OG1 2.82Å; T136-R138 PolarHBondContact O-N 2.68Å; T136-R138 VanDerWaalsContact O-N 3.17Å
137	L	87.2	Confident	89.8	Confident	132 Å²	132	71.2 Å²	71.2	69%	0.691	34%	0.34	S	S	*	.			trans	52.1	27.5	-172.1	-58.2	177.7	0	0	0	113.6	I132 N133	I132-L137 HydrophobicContact CD1-CD2 4.02Å; N133-L137 WeakPolarHBondContact O-CA 3.41Å; N133-L137 PolarHBondContact O-N 2.87Å
138	R	90.4	Very high	89.7	Confident	183 Å²	183	71.2 Å²	71.2	69%	0.691	34%	0.34	S	S	*	.			trans	-98.1	142	174.4	-66	-174.2	177.8	-164.5	-3.5	110.3	I132 N133 T136 V140	I132-R138 CarbonylContact C-O 3.57Å; I132-R138 WeakPolarHBondContact CA-O 3.46Å; N133-R138 PolarHBondContact N-O 2.93Å; T136-R138 PolarHBondContact O-N 2.68Å; T136-R138 VanDerWaalsContact O-N 3.17Å; R138-V140 PolarHBondContact O-N 2.85Å
139	P	90.2	Very high	89.7	Confident	71 Å²	71	68.6 Å²	68.6	46%	0.461	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-54.8	137.6	165.2	-19.5	30.7	0	0	0	110.2	Q130 A131 E141	Q130-P139 HydrophobicContact CG-CB 4.13Å; Q130-P139 HydrophobicContact CG-CG 4.49Å; A131-P139 WeakPolarHBondContact O-CA 3.37Å; P139-E141 WeakPolarHBondContact CB-O 3.35Å
140	V	88.7	Confident	89.7	Confident	36 Å²	36	68.1 Å²	68.1	22%	0.218	33%	0.327	C	S	.	.	S	Bend	trans	-97	-34.4	169.5	-67.2	0	0	0	0	111.4	Q82 L89 A131 N133 R138	Q82-V140 HydrophobicContact CB-CG2 4.45Å; Q82-V140 PolarHBondContact NE2-O 3.4Å; L89-V140 HydrophobicContact CD1-CG2 3.81Å; L89-V140 HydrophobicContact CD2-CB 4.43Å; L89-V140 HydrophobicContact CD2-CG1 3.82Å; L89-V140 HydrophobicContact CD2-CG2 3.81Å; L89-V140 HydrophobicContact CG-CG2 4.47Å; A131-V140 HydrophobicContact CB-CG2 3.75Å; A131-V140 WeakPolarHBondContact O-CG2 3.42Å; A131-V140 PolarHBondContact O-N 3.48Å; N133-V140 HydrophobicContact CB-CG1 3.95Å; R138-V140 PolarHBondContact O-N 2.85Å
141	E	85	Confident	89.7	Confident	41 Å²	41	67 Å²	67	19%	0.192	32%	0.322	C	S	.	.	S	Bend	trans	-116.1	158	170.4	-67.4	-63.7	138.6	0	0	109.4	K53 S80 Q82 P139	K53-E141 IonicContact NZ-OE1 3.51Å; K53-E141 PolarHBondContact NZ-OE1 2.9Å; K53-E141 IonicContact NZ-OE2 3.64Å; K53-E141 PolarHBondContact NZ-OE2 3.35Å; S80-E141 WeakPolarHBondContact OG-CG 3.44Å; Q82-E141 PolarHBondContact NE2-OE1 3.42Å; P139-E141 WeakPolarHBondContact CB-O 3.35Å
142	P	86.8	Confident	89.6	Confident	90 Å²	90	66.7 Å²	66.7	58%	0.584	32%	0.319	S	S	*	.			trans	-63.2	156.3	171.9	28.4	-35.9	0	0	0	112	S144	P142-S144 PolarHBondContact O-N 2.88Å; P142-S144 PolarHBondContact O-OG 3.29Å
143	E	89.2	Confident	89.4	Confident	98 Å²	98	67.6 Å²	67.6	46%	0.458	32%	0.324	S	S	.	.			trans	-58.2	133.9	167	-172.4	176	-153.7	0	0	109.8	R128 A129	R128-E143 HydrophobicContact CB-CG 3.98Å; R128-E143 WeakPolarHBondContact CB-OE1 2.86Å; R128-E143 WeakPolarHBondContact CD-OE1 3.35Å; R128-E143 HydrophobicContact CG-CG 4.49Å; A129-E143 WeakPolarHBondContact O-CA 3.36Å
144	S	87.1	Confident	89.4	Confident	22 Å²	22	67.5 Å²	67.5	15%	0.154	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.4	-173.3	-62.6	0	0	0	0	110.1	W56 R128 A129 P142	W56-S144 PolarHBondContact NE1-OG 3.06Å; R128-S144 WeakPolarHBondContact CA-O 3.27Å; A129-S144 PolarHBondContact N-O 2.83Å; A129-S144 PolarHBondContact O-N 3.29Å; P142-S144 PolarHBondContact O-N 2.88Å; P142-S144 PolarHBondContact O-OG 3.29Å
145	E	91.1	Very high	89.5	Confident	98 Å²	98	64.8 Å²	64.8	46%	0.458	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.4	179.6	-169.8	170.1	92	0	0	111.2	T126 L127 R128	T126-E145 HydrophobicContact CG2-CG 3.69Å; L127-E145 WeakPolarHBondContact O-CA 3.42Å; R128-E145 HydrophobicContact CG-CB 4Å; R128-E145 HydrophobicContact CG-CG 4.02Å; R128-E145 IonicContact CZ-OE2 3.75Å; R128-E145 IonicContact NE-OE2 2.86Å; R128-E145 PolarHBondContact NE-OE2 2.89Å; R128-E145 IonicContact NH2-OE2 2.77Å; R128-E145 PolarHBondContact NH2-OE2 3.19Å
146	F	90.4	Very high	89.8	Confident	10 Å²	10	56.8 Å²	56.8	4%	0.044	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	160.2	176.5	67.4	-88.9	0	0	0	110.4	N59 F61 L78 L93 I111 L127 A129 I148	N59-F146 CarbonylContact O-C 3.53Å; N59-F146 WeakPolarHBondContact O-CA 3.3Å; N59-F146 WeakPolarHBondContact O-CB 3.45Å; F61-F146 AromaticContact CD2-CD2 3.52Å; F61-F146 HydrophobicContact CD2-CD2 3.52Å; F61-F146 AromaticContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CG 4.36Å; F61-F146 AromaticContact CE2-CD2 3.69Å; F61-F146 HydrophobicContact CE2-CD2 3.69Å; F61-F146 AromaticContact CE2-CE2 3.88Å; F61-F146 HydrophobicContact CE2-CE2 3.88Å; F61-F146 HydrophobicContact CE2-CG 4.17Å; L78-F146 HydrophobicContact CD1-CD1 4.49Å; L78-F146 HydrophobicContact CD1-CE1 3.84Å; L78-F146 HydrophobicContact CD1-CZ 4.32Å; L93-F146 HydrophobicContact CD1-CE1 3.89Å; L93-F146 HydrophobicContact CD1-CZ 3.62Å; I111-F146 HydrophobicContact CD1-CE1 4.49Å; I111-F146 HydrophobicContact CD1-CE2 4.27Å; I111-F146 HydrophobicContact CD1-CZ 3.69Å; L127-F146 HydrophobicContact CB-CD2 4.48Å; L127-F146 HydrophobicContact CB-CE1 3.97Å; L127-F146 HydrophobicContact CB-CE2 3.92Å; L127-F146 HydrophobicContact CB-CZ 3.64Å; L127-F146 PolarHBondContact N-O 3.04Å; L127-F146 PolarHBondContact O-N 3.36Å; A129-F146 HydrophobicContact CB-CE1 3.99Å; F146-I148 HydrophobicContact CD2-CG1 4.36Å; F146-I148 HydrophobicContact CE2-CD1 4.25Å; F146-I148 HydrophobicContact CE2-CG1 3.94Å
147	V	92.7	Very high	90	Very high	32 Å²	32	57.9 Å²	57.9	19%	0.194	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.4	178.8	-175.9	0	0	0	0	109.6	N59 Q60 F61 F124 Y125 K149	N59-V147 PolarHBondContact O-N 3.35Å; Q60-V147 CarbonylContact C-O 3.5Å; Q60-V147 VanDerWaalsContact CA-O 3.27Å; Q60-V147 WeakPolarHBondContact CA-O 3.36Å; Q60-V147 HydrophobicContact CG-CB 4.46Å; F61-V147 PolarHBondContact N-O 3.31Å; F124-V147 HydrophobicContact CB-CG1 3.95Å; F124-V147 HydrophobicContact CD2-CG1 4.21Å; F124-V147 HydrophobicContact CG-CG1 4.48Å; Y125-V147 CarbonylContact O-C 3.58Å; Y125-V147 WeakPolarHBondContact O-CA 3.27Å; V147-K149 HydrophobicContact CG1-CG 4.13Å
148	I	92.4	Very high	90.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	116.5	161.8	-57.8	172.9	0	0	0	106.3	F61 L63 V75 F102 F124 Y125 L127 F146 I150	F61-I148 HydrophobicContact CB-CG1 4.42Å; F61-I148 WeakPolarHBondContact O-CA 3.4Å; L63-I148 HydrophobicContact CB-CG2 4.47Å; L63-I148 HydrophobicContact CD1-CG2 3.69Å; L63-I148 HydrophobicContact CG-CG2 3.86Å; V75-I148 HydrophobicContact CG1-CD1 3.81Å; V75-I148 HydrophobicContact CG1-CG1 4.01Å; V75-I148 HydrophobicContact CG1-CG2 4.27Å; F102-I148 HydrophobicContact CD1-CD1 3.51Å; F102-I148 HydrophobicContact CD2-CD1 4.08Å; F102-I148 HydrophobicContact CE1-CD1 3.48Å; F102-I148 VanDerWaalsContact CE1-CD1 3.48Å; F102-I148 HydrophobicContact CE1-CG2 4.25Å; F102-I148 HydrophobicContact CE2-CD1 4.05Å; F102-I148 HydrophobicContact CG-CD1 3.82Å; F102-I148 HydrophobicContact CZ-CB 4.44Å; F102-I148 HydrophobicContact CZ-CD1 3.75Å; F102-I148 HydrophobicContact CZ-CG2 4.26Å; F124-I148 CarbonylContact C-O 3.56Å; F124-I148 VanDerWaalsContact CA-O 3.3Å; F124-I148 WeakPolarHBondContact CA-O 3.37Å; Y125-I148 PolarHBondContact N-O 3.4Å; Y125-I148 PolarHBondContact O-N 3.04Å; L127-I148 HydrophobicContact CD1-CD1 3.68Å; L127-I148 HydrophobicContact CD1-CG1 3.96Å; F146-I148 HydrophobicContact CD2-CG1 4.36Å; F146-I148 HydrophobicContact CE2-CD1 4.25Å; F146-I148 HydrophobicContact CE2-CG1 3.94Å; I148-I150 HydrophobicContact CG2-CD1 4.27Å
149	K	91.7	Very high	90.6	Very high	58 Å²	58	46.7 Å²	46.7	25%	0.252	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	146.8	172.4	-75.4	173.7	149.7	-156.2	0	110.2	F61 F62 L63 F124 V147 D671	F61-K149 PolarHBondContact O-N 3.2Å; F62-K149 WeakPolarHBondContact CA-O 3.29Å; F62-K149 HydrophobicContact CD1-CB 3.67Å; F62-K149 HydrophobicContact CD1-CD 4.03Å; F62-K149 HydrophobicContact CE1-CB 3.99Å; F62-K149 HydrophobicContact CE1-CD 3.44Å; F62-K149 VanDerWaalsContact CE1-CD 3.44Å; F62-K149 HydrophobicContact CE1-CG 4.36Å; F62-K149 HydrophobicContact CZ-CD 4.22Å; L63-K149 PolarHBondContact N-O 2.89Å; F124-K149 HydrophobicContact CB-CG 4.31Å; V147-K149 HydrophobicContact CG1-CG 4.13Å; K149-D671 VanDerWaalsContact CD-OD2 3.29Å; K149-D671 WeakPolarHBondContact CD-OD2 3Å; K149-D671 WeakPolarHBondContact CE-OD2 3.1Å; K149-D671 IonicContact NZ-OD2 2.68Å; K149-D671 PolarHBondContact NZ-OD2 2.85Å
150	I	92.2	Very high	90.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.6	179.9	-52.1	-53.5	0	0	0	109	L63 E65 I117 R119 K122 A123 Y125 I148	L63-I150 HydrophobicContact CB-CD1 4.11Å; L63-I150 CarbonylContact O-C 3.55Å; L63-I150 WeakPolarHBondContact O-CA 3.32Å; E65-I150 HydrophobicContact CB-CG2 3.65Å; I117-I150 HydrophobicContact CB-CD1 4.33Å; I117-I150 HydrophobicContact CD1-CD1 4.1Å; I117-I150 HydrophobicContact CG2-CD1 3.62Å; I117-I150 HydrophobicContact CG2-CG1 3.73Å; I117-I150 HydrophobicContact CG2-CG2 4.2Å; R119-I150 HydrophobicContact CB-CB 4.44Å; R119-I150 HydrophobicContact CB-CG2 3.91Å; R119-I150 HydrophobicContact CG-CB 4.18Å; R119-I150 HydrophobicContact CG-CG2 4.15Å; K122-I150 WeakPolarHBondContact O-CG1 3.44Å; A123-I150 PolarHBondContact O-N 2.83Å; Y125-I150 HydrophobicContact CD2-CD1 4.21Å; Y125-I150 HydrophobicContact CD2-CG1 4.25Å; Y125-I150 HydrophobicContact CE2-CD1 4.05Å; Y125-I150 HydrophobicContact CE2-CG1 3.95Å; I148-I150 HydrophobicContact CG2-CD1 4.27Å
151	H	90.2	Very high	91.1	Very high	33 Å²	33	47.3 Å²	47.3	15%	0.153	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.4	-171.2	-84.5	-9.5	0	0	0	112.7	F62 L63 L64 E65 D671 I672	F62-H151 WeakPolarHBondContact CB-NE2 3.44Å; F62-H151 AromaticContact CD1-CE1 3Å; F62-H151 WeakPolarHBondContact CD1-CE1 3.43Å; F62-H151 AromaticContact CD1-ND1 3.73Å; F62-H151 AromaticContact CD1-NE2 3.53Å; F62-H151 AromaticContact CE1-CE1 3.63Å; F62-H151 AromaticContact CG-CE1 3.58Å; F62-H151 AromaticContact CG-NE2 3.58Å; L63-H151 WeakPolarHBondContact O-CB 3.28Å; L63-H151 PolarHBondContact O-N 2.95Å; L64-H151 HydrophobicContact CD1-CB 4.27Å; E65-H151 PolarHBondContact N-O 3.47Å; H151-D671 WeakPolarHBondContact CA-O 3.22Å; H151-D671 PolarHBondContact ND1-O 2.77Å; H151-I672 WeakPolarHBondContact CE1-CG2 3.48Å; H151-I672 WeakPolarHBondContact ND1-CA 3.4Å
152	D	90.2	Very high	91.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-50.2	126.6	-177.5	-166.2	77.6	0	0	0	115	E65 R119 D189 Y192 S195 G673 T674	E65-D152 WeakPolarHBondContact OE1-CA 3.2Å; R119-D152 IonicContact CZ-OD1 2.68Å; R119-D152 VanDerWaalsContact CZ-OD1 3.24Å; R119-D152 IonicContact NE-OD1 2.93Å; R119-D152 PolarHBondContact NE-OD1 3.48Å; R119-D152 IonicContact NH2-OD1 2.62Å; R119-D152 PolarHBondContact NH2-OD1 2.96Å; D152-D189 HydrophobicContact CB-CB 3.87Å; D152-D189 VanDerWaalsContact CG-N 3.33Å; D152-D189 VanDerWaalsContact OD1-CB 3.27Å; D152-D189 WeakPolarHBondContact OD1-CB 3.18Å; D152-D189 PolarHBondContact OD1-N 3.21Å; D152-D189 PolarHBondContact OD2-N 2.86Å; D152-Y192 HydrophobicContact CB-CD1 4.02Å; D152-Y192 HydrophobicContact CB-CG 3.98Å; D152-S195 WeakPolarHBondContact OD2-CB 3.43Å; D152-S195 PolarHBondContact OD2-OG 2.95Å; D152-G673 WeakPolarHBondContact O-CA 3.3Å; D152-G673 PolarHBondContact O-N 2.6Å; D152-T674 PolarHBondContact O-N 2.98Å
153	I	88.4	Confident	91.7	Very high	35 Å²	35	54.1 Å²	54.1	18%	0.179	28%	0.276	C	S	.	.			trans	-111.4	153.9	158.5	69.1	179.7	0	0	0	110.3	L64 E65 E66 D155 T674	L64-I153 HydrophobicContact CD1-CG2 3.68Å; L64-I153 HydrophobicContact CG-CG2 4.06Å; E65-I153 HydrophobicContact CG-CB 4.36Å; E65-I153 HydrophobicContact CG-CD1 3.93Å; E65-I153 HydrophobicContact CG-CG1 3.65Å; E65-I153 HydrophobicContact CG-CG2 4.16Å; E65-I153 PolarHBondContact OE1-N 3.46Å; E66-I153 HydrophobicContact CB-CD1 3.96Å; I153-D155 HydrophobicContact CD1-CB 4.16Å; I153-D155 HydrophobicContact CG1-CB 4.1Å; I153-D155 PolarHBondContact O-N 2.68Å; I153-D155 VanDerWaalsContact O-N 3.15Å; I153-T674 HydrophobicContact CB-CG2 4.28Å; I153-T674 HydrophobicContact CG2-CG2 4.31Å
154	N	90.2	Very high	91.9	Very high	33 Å²	33	53.7 Å²	53.7	18%	0.176	28%	0.276	C	S	.	.	S	Bend	trans	-85.5	81.8	177.2	-168.2	129.4	0	0	0	110.1	D188 S195 D241 M242	N154-D188 WeakPolarHBondContact CA-OD2 3.44Å; N154-D188 PolarHBondContact ND2-OD2 3.16Å; N154-S195 WeakPolarHBondContact OD1-CA 3.26Å; N154-D241 PolarHBondContact ND2-OD2 2.72Å; N154-M242 WeakPolarHBondContact OD1-CG 3.31Å
155	D	90.6	Very high	92.3	Very high	82 Å²	82	53.5 Å²	53.5	44%	0.439	27%	0.272	S	S	.	.			trans	-122.5	-6.9	179.7	81	-21.2	0	0	0	115.8	I153 D188	I153-D155 HydrophobicContact CD1-CB 4.16Å; I153-D155 HydrophobicContact CG1-CB 4.1Å; I153-D155 PolarHBondContact O-N 2.68Å; I153-D155 VanDerWaalsContact O-N 3.15Å; D155-D188 PolarHBondContact N-OD1 3Å
156	N	92	Very high	92.6	Very high	52 Å²	52	54.3 Å²	54.3	28%	0.278	28%	0.283	S	S	.	.	S	Bend	trans	-90.2	138.3	165.5	-57.3	-88	0	0	0	110.5	E120 A187 D188	E120-N156 PolarHBondContact OE2-ND2 3.07Å; N156-A187 HydrophobicContact CB-CB 3.92Å; N156-D188 VanDerWaalsContact CB-OD1 3.24Å; N156-D188 WeakPolarHBondContact CB-OD1 3.12Å; N156-D188 PolarHBondContact N-OD1 2.99Å; N156-D188 PolarHBondContact ND2-OD1 2.64Å
157	E	93.4	Very high	92.9	Very high	108 Å²	108	54.6 Å²	54.6	51%	0.505	29%	0.288	S	S	.	.			trans	-95.4	148.7	174.8	71.7	177.8	175.8	0	0	112.3	T159 L249	E157-T159 WeakPolarHBondContact O-CG2 3.39Å; E157-T159 PolarHBondContact O-N 3.08Å; E157-L249 HydrophobicContact CB-CB 3.66Å; E157-L249 HydrophobicContact CB-CD1 4.23Å
158	P	95.5	Very high	93.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.304	C	S	.	.			trans	-56.1	110.4	178	-25.6	29.9	0	0	0	113.1	A184 D186 V198 A239 D241 G251	P158-A184 HydrophobicContact CB-CB 4.1Å; P158-D186 WeakPolarHBondContact CG-OD2 3.48Å; P158-V198 HydrophobicContact CB-CG2 3.91Å; P158-V198 HydrophobicContact CG-CG2 4.03Å; P158-A239 HydrophobicContact CB-CB 3.72Å; P158-D241 HydrophobicContact CG-CB 3.79Å; P158-G251 VanDerWaalsContact O-CA 3.25Å; P158-G251 WeakPolarHBondContact O-CA 3.39Å; P158-G251 PolarHBondContact O-N 3.2Å
159	T	95.2	Very high	93.3	Very high	81 Å²	81	56.9 Å²	56.9	50%	0.497	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-93.2	143.2	-179.1	55.1	0	0	0	0	111.7	E157 A184 T185	E157-T159 WeakPolarHBondContact O-CG2 3.39Å; E157-T159 PolarHBondContact O-N 3.08Å; T159-A184 CarbonylContact O-C 3.38Å; T159-A184 WeakPolarHBondContact O-CA 3.38Å; T159-A184 WeakPolarHBondContact O-CB 3.44Å; T159-T185 PolarHBondContact N-O 3.06Å; T159-T185 PolarHBondContact O-N 3.3Å; T159-T185 PolarHBondContact O-OG1 3.27Å; T159-T185 PolarHBondContact OG1-O 2.79Å; T159-T185 PolarHBondContact OG1-OG1 3.43Å
160	F	96	Very high	93.4	Very high	28 Å²	28	56.6 Å²	56.6	12%	0.123	31%	0.309	C	S	.	.			trans	-97.9	133.9	169.5	-72.1	-86.7	0	0	0	109.9	E162 Y165 V182 A184 Y200 I237 A239 T253	F160-E162 PolarHBondContact O-N 2.96Å; F160-Y165 HydrophobicContact CB-CE2 4.38Å; F160-Y165 HydrophobicContact CD1-CE2 4.06Å; F160-V182 HydrophobicContact CD1-CB 4.46Å; F160-V182 HydrophobicContact CE1-CB 4.03Å; F160-V182 HydrophobicContact CE1-CG2 3.98Å; F160-A184 HydrophobicContact CD1-CB 3.98Å; F160-A184 HydrophobicContact CD2-CB 4.34Å; F160-A184 HydrophobicContact CE1-CB 3.85Å; F160-A184 HydrophobicContact CE2-CB 4.22Å; F160-A184 HydrophobicContact CG-CB 4.24Å; F160-A184 HydrophobicContact CZ-CB 3.99Å; F160-Y200 HydrophobicContact CE1-CD1 4.44Å; F160-Y200 AromaticContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CZ-CD1 4.29Å; F160-Y200 HydrophobicContact CZ-CE1 4.14Å; F160-I237 HydrophobicContact CZ-CG2 4.08Å; F160-A239 HydrophobicContact CE1-CB 4.42Å; F160-A239 HydrophobicContact CE2-CB 3.57Å; F160-A239 HydrophobicContact CZ-CB 3.48Å; F160-A239 VanDerWaalsContact CZ-CB 3.48Å; F160-T253 HydrophobicContact CB-CG2 4.37Å; F160-T253 HydrophobicContact CD1-CG2 3.54Å; F160-T253 HydrophobicContact CD2-CG2 3.76Å; F160-T253 HydrophobicContact CE1-CG2 3.56Å; F160-T253 HydrophobicContact CE2-CG2 3.78Å; F160-T253 HydrophobicContact CG-CG2 3.62Å; F160-T253 HydrophobicContact CZ-CG2 3.67Å
161	P	93.3	Very high	93.5	Very high	91 Å²	91	56.6 Å²	56.6	59%	0.591	31%	0.309	S	S	*	.	S	Bend	trans	-60.6	-23	175	-26.8	35.7	0	0	0	114.8	T183	P161-T183 VanDerWaalsContact CD-O 3.22Å; P161-T183 WeakPolarHBondContact CD-O 3.1Å
162	E	92.4	Very high	93.5	Very high	101 Å²	101	56.4 Å²	56.4	47%	0.472	31%	0.308	S	S	.	.			trans	-122.2	128.5	175.1	-61.7	175.2	-150.3	0	0	110.8	F160 I164 Y165 T253	F160-E162 PolarHBondContact O-N 2.96Å; E162-I164 VanDerWaalsContact C-N 3.25Å; E162-I164 PolarHBondContact O-N 3.4Å; E162-Y165 HydrophobicContact CB-CD1 4.16Å; E162-Y165 HydrophobicContact CB-CD2 4.27Å; E162-Y165 HydrophobicContact CB-CE1 3.83Å; E162-Y165 HydrophobicContact CB-CE2 3.95Å; E162-Y165 HydrophobicContact CB-CG 4.37Å; E162-Y165 HydrophobicContact CG-CD1 4.42Å; E162-Y165 HydrophobicContact CG-CE1 3.97Å; E162-Y165 WeakPolarHBondContact O-CE2 3.28Å; E162-Y165 VanDerWaalsContact OE2-CD1 3.26Å; E162-Y165 WeakPolarHBondContact OE2-CD1 3.49Å; E162-T253 PolarHBondContact O-OG1 3.02Å
163	E	90.6	Very high	93.6	Very high	174 Å²	174	57.5 Å²	57.5	81%	0.813	32%	0.316	S	S	*	.	S	Bend	trans	-63.7	-33.3	172.5	-63	-177	172.6	0	0	112.1	T253 T254	E163-T253 PolarHBondContact O-OG1 3.43Å; E163-T254 PolarHBondContact O-N 2.89Å
164	I	95	Very high	93.8	Very high	89 Å²	89	61.3 Å²	61.3	46%	0.456	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	108.5	-176.6	-52.6	179.2	0	0	0	110	E162 T254 N256	E162-I164 VanDerWaalsContact C-N 3.25Å; E162-I164 PolarHBondContact O-N 3.4Å; I164-T254 CarbonylContact C-O 3.51Å; I164-T254 VanDerWaalsContact CA-O 3.29Å; I164-T254 WeakPolarHBondContact CA-O 3.13Å; I164-T254 HydrophobicContact CG2-CG2 4.46Å; I164-N256 VanDerWaalsContact CG2-ND2 3.34Å; I164-N256 WeakPolarHBondContact CG2-ND2 3.28Å
165	Y	95.7	Very high	94.1	Very high	18 Å²	18	63.1 Å²	63.1	7%	0.071	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	146.4	167.9	-65.2	-87.8	0	0	0	110.9	F160 E162 V182 T253 T254 V255 N256	F160-Y165 HydrophobicContact CB-CE2 4.38Å; F160-Y165 HydrophobicContact CD1-CE2 4.06Å; E162-Y165 HydrophobicContact CB-CD1 4.16Å; E162-Y165 HydrophobicContact CB-CD2 4.27Å; E162-Y165 HydrophobicContact CB-CE1 3.83Å; E162-Y165 HydrophobicContact CB-CE2 3.95Å; E162-Y165 HydrophobicContact CB-CG 4.37Å; E162-Y165 HydrophobicContact CG-CD1 4.42Å; E162-Y165 HydrophobicContact CG-CE1 3.97Å; E162-Y165 WeakPolarHBondContact O-CE2 3.28Å; E162-Y165 VanDerWaalsContact OE2-CD1 3.26Å; E162-Y165 WeakPolarHBondContact OE2-CD1 3.49Å; Y165-V182 HydrophobicContact CD1-CG1 4.28Å; Y165-V182 HydrophobicContact CD2-CB 4.41Å; Y165-V182 HydrophobicContact CD2-CG1 3.59Å; Y165-V182 HydrophobicContact CE1-CG1 4.48Å; Y165-V182 HydrophobicContact CE2-CB 4.16Å; Y165-V182 HydrophobicContact CE2-CG1 3.83Å; Y165-V182 HydrophobicContact CG-CG1 3.84Å; Y165-T253 HydrophobicContact CD2-CG2 3.9Å; Y165-T253 WeakPolarHBondContact CD2-OG1 3.4Å; Y165-T253 HydrophobicContact CE2-CG2 3.81Å; Y165-T253 WeakPolarHBondContact CE2-OG1 3.49Å; Y165-T254 PolarHBondContact N-O 2.82Å; Y165-V255 HydrophobicContact CD2-CG2 4.45Å; Y165-V255 WeakPolarHBondContact O-CA 3.26Å; Y165-N256 PolarHBondContact O-N 3.42Å
166	T	96.8	Very high	94.2	Very high	115 Å²	115	60.8 Å²	60.8	71%	0.706	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.3	172.4	58.4	0	0	0	0	111.4	N256	T166-N256 WeakPolarHBondContact CA-O 3.08Å
167	A	96.6	Very high	94.4	Very high	16 Å²	16	60.7 Å²	60.7	13%	0.132	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	163.9	-179.8	0	0	0	0	0	112.1	V179 V180 N256 I257 T258	A167-V179 HydrophobicContact CB-CG1 3.9Å; A167-V180 HydrophobicContact CB-CB 3.74Å; A167-V180 HydrophobicContact CB-CG1 3.87Å; A167-V180 HydrophobicContact CB-CG2 4.31Å; A167-N256 PolarHBondContact N-O 3.37Å; A167-I257 WeakPolarHBondContact O-CA 2.97Å; A167-T258 PolarHBondContact O-N 2.77Å
168	S	96.8	Very high	94.5	Very high	76 Å²	76	58.8 Å²	58.8	53%	0.531	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.3	178.3	65.1	0	0	0	0	111.5	T258	S168-T258 VanDerWaalsContact CA-O 3.25Å; S168-T258 WeakPolarHBondContact CA-O 2.78Å
169	V	96.1	Very high	94.6	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.018	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.1	179.1	62.4	0	0	0	0	109.8	E171 T177 V179 T220 I257 T258 L259 T260	V169-E171 PolarHBondContact O-N 2.8Å; V169-T177 HydrophobicContact CG2-CG2 3.98Å; V169-V179 HydrophobicContact CB-CG1 4.26Å; V169-V179 HydrophobicContact CB-CG2 4.18Å; V169-V179 HydrophobicContact CG1-CG1 4.4Å; V169-V179 HydrophobicContact CG1-CG2 4.23Å; V169-V179 HydrophobicContact CG2-CG2 4.26Å; V169-T220 HydrophobicContact CG2-CG2 4.23Å; V169-I257 HydrophobicContact CG1-CG2 3.99Å; V169-T258 PolarHBondContact N-O 3.27Å; V169-T258 VanDerWaalsContact N-O 3.15Å; V169-L259 HydrophobicContact CG1-CD2 3.73Å; V169-L259 CarbonylContact O-C 3.55Å; V169-L259 WeakPolarHBondContact O-CA 3.11Å; V169-T260 PolarHBondContact O-N 3.1Å
170	P	94.1	Very high	94.7	Very high	52 Å²	52	57.6 Å²	57.6	34%	0.338	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	138.6	174.1	-24.7	34.9	0	0	0	111.7	S173 T260 V262	P170-S173 WeakPolarHBondContact O-CB 3.2Å; P170-S173 PolarHBondContact O-OG 2.69Å; P170-T260 WeakPolarHBondContact CA-O 3.35Å; P170-T260 VanDerWaalsContact CA-OG1 3.26Å; P170-T260 WeakPolarHBondContact CA-OG1 3.04Å; P170-V262 HydrophobicContact CB-CG2 4.07Å
171	E	94	Very high	94.7	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	166.3	166.4	74.1	-174.3	110.9	0	0	111.9	V169 S173 M225 N226 R227 L259 T260 D261 V262	V169-E171 PolarHBondContact O-N 2.8Å; E171-S173 PolarHBondContact O-N 2.76Å; E171-M225 WeakPolarHBondContact CA-O 3.48Å; E171-M225 WeakPolarHBondContact CB-O 3.35Å; E171-N226 WeakPolarHBondContact OE2-CA 2.96Å; E171-R227 HydrophobicContact CB-CB 4.39Å; E171-R227 VanDerWaalsContact OE1-CB 3.3Å; E171-R227 WeakPolarHBondContact OE1-CB 3.44Å; E171-R227 IonicContact OE1-NE 3.12Å; E171-R227 WeakPolarHBondContact OE2-CB 3.28Å; E171-R227 PolarHBondContact OE2-N 3.06Å; E171-L259 HydrophobicContact CB-CB 4.36Å; E171-L259 HydrophobicContact CB-CD1 4.19Å; E171-T260 PolarHBondContact N-O 3.23Å; E171-T260 VanDerWaalsContact N-O 3.13Å; E171-D261 VanDerWaalsContact OE1-CA 3.3Å; E171-D261 WeakPolarHBondContact OE1-CA 3.22Å; E171-V262 HydrophobicContact CG-CB 3.68Å; E171-V262 HydrophobicContact CG-CG2 3.81Å; E171-V262 PolarHBondContact OE1-N 3.49Å
172	M	90.8	Very high	94.8	Very high	29 Å²	29	56.9 Å²	56.9	14%	0.143	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	13.8	-173.9	-59.3	-63.8	-77.2	0	0	114.2	N224 M225 N226 F359	M172-N224 HydrophobicContact CE-CB 4.12Å; M172-N224 VanDerWaalsContact SD-CA 3.56Å; M172-N224 HydrophobicContact SD-CB 3.85Å; M172-M225 PolarHBondContact N-O 2.88Å; M172-N226 HydrophobicContact SD-CB 4.45Å; M172-F359 HydrophobicContact CB-CE1 3.89Å; M172-F359 HydrophobicContact CB-CZ 4.35Å
173	S	92.7	Very high	94.9	Very high	24 Å²	24	55.3 Å²	55.3	17%	0.168	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-59	141.7	176.9	-82.2	0	0	0	0	112.3	P170 E171	P170-S173 WeakPolarHBondContact O-CB 3.2Å; P170-S173 PolarHBondContact O-OG 2.69Å; E171-S173 PolarHBondContact O-N 2.76Å
174	V	92.8	Very high	95.2	Very high	114 Å²	114	47.7 Å²	47.7	69%	0.691	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-59.8	141.8	176.4	-174	0	0	0	0	110.2	G176 T177 T220	V174-G176 PolarHBondContact O-N 2.94Å; V174-T177 WeakPolarHBondContact O-CB 3.4Å; V174-T177 PolarHBondContact O-N 3Å; V174-T177 PolarHBondContact O-OG1 2.68Å; V174-T220 PolarHBondContact O-OG1 3.21Å
175	V	94.9	Very high	95.1	Very high	72 Å²	72	47.1 Å²	47.1	44%	0.436	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	131.1	174.8	178.9	0	0	0	0	110.1	P223	V175-P223 HydrophobicContact CG2-CB 3.85Å; V175-P223 HydrophobicContact CG2-CG 4.35Å
176	G	94.2	Very high	95	Very high	33 Å²	33	47.7 Å²	47.7	34%	0.34	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.1	-4.8	-175.4	0	0	0	0	0	114.9	V174 S178 R219 T220	V174-G176 PolarHBondContact O-N 2.94Å; G176-S178 PolarHBondContact O-N 3.45Å; G176-R219 PolarHBondContact O-NH1 3.15Å; G176-T220 PolarHBondContact N-O 3.27Å; G176-T220 PolarHBondContact N-OG1 3.29Å
177	T	95.8	Very high	94.8	Very high	50 Å²	50	44.1 Å²	44.1	31%	0.307	28%	0.281	S	S	.	.			trans	-57.4	128.8	171.9	-70.8	0	0	0	0	110.1	V169 V174 R219 T220	V169-T177 HydrophobicContact CG2-CG2 3.98Å; V174-T177 WeakPolarHBondContact O-CB 3.4Å; V174-T177 PolarHBondContact O-N 3Å; V174-T177 PolarHBondContact O-OG1 2.68Å; T177-R219 CarbonylContact O-C 3.51Å; T177-R219 WeakPolarHBondContact O-CA 3.36Å; T177-T220 PolarHBondContact N-OG1 3.27Å; T177-T220 VanDerWaalsContact N-OG1 3.15Å; T177-T220 PolarHBondContact O-N 3Å
178	S	96.1	Very high	94.6	Very high	68 Å²	68	43.3 Å²	43.3	48%	0.476	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134.6	177.9	-164.1	0	0	0	0	110.7	G176 I217	G176-S178 PolarHBondContact O-N 3.45Å; S178-I217 WeakPolarHBondContact OG-CG2 3.37Å
179	V	96.6	Very high	94.2	Very high	23 Å²	23	39.7 Å²	39.7	14%	0.139	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-56.4	-178.6	-176.5	0	0	0	0	110.8	A167 V169 F209 I218 T220 I257	A167-V179 HydrophobicContact CB-CG1 3.9Å; V169-V179 HydrophobicContact CB-CG1 4.26Å; V169-V179 HydrophobicContact CB-CG2 4.18Å; V169-V179 HydrophobicContact CG1-CG1 4.4Å; V169-V179 HydrophobicContact CG1-CG2 4.23Å; V169-V179 HydrophobicContact CG2-CG2 4.26Å; V179-F209 HydrophobicContact CG2-CD1 4.21Å; V179-F209 HydrophobicContact CG2-CE1 4.04Å; V179-I218 PolarHBondContact N-O 3.43Å; V179-T220 HydrophobicContact CG2-CG2 4.21Å; V179-I257 HydrophobicContact CG1-CD1 4.13Å; V179-I257 HydrophobicContact CG1-CG1 4.25Å; V179-I257 HydrophobicContact CG1-CG2 3.83Å
180	V	96.6	Very high	93.6	Very high	32 Å²	32	43 Å²	43	19%	0.194	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	158.4	-179.9	65.4	0	0	0	0	109	A167 I218 V255	A167-V180 HydrophobicContact CB-CB 3.74Å; A167-V180 HydrophobicContact CB-CG1 3.87Å; A167-V180 HydrophobicContact CB-CG2 4.31Å; V180-I218 HydrophobicContact CG1-CB 4.32Å; V180-I218 HydrophobicContact CG1-CD1 3.96Å; V180-I218 HydrophobicContact CG1-CG1 4.47Å; V180-I218 PolarHBondContact O-N 3.25Å; V180-V255 HydrophobicContact CG1-CG1 3.76Å
181	Q	96.1	Very high	93	Very high	105 Å²	105	44.6 Å²	44.6	49%	0.491	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.1	169.4	-173.9	175.1	1.4	0	0	108.4	T183 T215 I217	Q181-T183 HydrophobicContact CG-CG2 4.43Å; Q181-T215 WeakPolarHBondContact CG-O 3.4Å; Q181-T215 PolarHBondContact NE2-O 3.14Å; Q181-I217 HydrophobicContact CB-CG1 4Å; Q181-I217 HydrophobicContact CG-CG1 3.72Å
182	V	96.1	Very high	92.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	29%	0.285	C	S	.	.			trans	-106.4	145.7	169	-62.7	0	0	0	0	109.8	F160 Y165 Y200 G216 I218 I237 V255	F160-V182 HydrophobicContact CD1-CB 4.46Å; F160-V182 HydrophobicContact CE1-CB 4.03Å; F160-V182 HydrophobicContact CE1-CG2 3.98Å; Y165-V182 HydrophobicContact CD1-CG1 4.28Å; Y165-V182 HydrophobicContact CD2-CB 4.41Å; Y165-V182 HydrophobicContact CD2-CG1 3.59Å; Y165-V182 HydrophobicContact CE1-CG1 4.48Å; Y165-V182 HydrophobicContact CE2-CB 4.16Å; Y165-V182 HydrophobicContact CE2-CG1 3.83Å; Y165-V182 HydrophobicContact CG-CG1 3.84Å; V182-Y200 HydrophobicContact CG2-CD1 4.48Å; V182-G216 PolarHBondContact N-O 3.24Å; V182-G216 WeakPolarHBondContact O-CA 3.38Å; V182-I218 HydrophobicContact CG1-CD1 4.38Å; V182-I237 HydrophobicContact CG2-CB 4.34Å; V182-I237 HydrophobicContact CG2-CG1 4.16Å; V182-I237 HydrophobicContact CG2-CG2 3.92Å; V182-V255 HydrophobicContact CG1-CG2 3.78Å
183	T	95.4	Very high	91.3	Very high	68 Å²	68	44.9 Å²	44.9	42%	0.417	29%	0.29	S	S	.	.			trans	-134.1	121.7	-178.1	52.3	0	0	0	0	109.4	P161 Q181	P161-T183 VanDerWaalsContact CD-O 3.22Å; P161-T183 WeakPolarHBondContact CD-O 3.1Å; Q181-T183 HydrophobicContact CG-CG2 4.43Å
184	A	95.1	Very high	90.7	Very high	13 Å²	13	47 Å²	47	11%	0.107	30%	0.299	C	S	.	.			trans	-94.7	151.9	167.4	0	0	0	0	0	110.3	P158 T159 F160 V198 Y200 A239	P158-A184 HydrophobicContact CB-CB 4.1Å; T159-A184 CarbonylContact O-C 3.38Å; T159-A184 WeakPolarHBondContact O-CA 3.38Å; T159-A184 WeakPolarHBondContact O-CB 3.44Å; F160-A184 HydrophobicContact CD1-CB 3.98Å; F160-A184 HydrophobicContact CD2-CB 4.34Å; F160-A184 HydrophobicContact CE1-CB 3.85Å; F160-A184 HydrophobicContact CE2-CB 4.22Å; F160-A184 HydrophobicContact CG-CB 4.24Å; F160-A184 HydrophobicContact CZ-CB 3.99Å; A184-V198 HydrophobicContact CB-CG1 4.41Å; A184-Y200 HydrophobicContact CB-CE1 4.13Å; A184-Y200 PolarHBondContact N-OH 3.25Å; A184-A239 HydrophobicContact CB-CB 3.42Å; A184-A239 VanDerWaalsContact CB-CB 3.42Å
185	T	93.5	Very high	90.1	Very high	78 Å²	78	41.6 Å²	41.6	48%	0.479	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-117.9	138.7	174.5	43.3	0	0	0	0	109.4	T159	T159-T185 PolarHBondContact N-O 3.06Å; T159-T185 PolarHBondContact O-N 3.3Å; T159-T185 PolarHBondContact O-OG1 3.27Å; T159-T185 PolarHBondContact OG1-O 2.79Å; T159-T185 PolarHBondContact OG1-OG1 3.43Å
186	D	93.9	Very high	89.7	Confident	30 Å²	30	39 Å²	39	16%	0.16	25%	0.253	C	S	.	.			trans	-126.1	145.8	-176.6	-165.6	-39.9	0	0	0	107.4	P158 D188 A196 V198 D241	P158-D186 WeakPolarHBondContact CG-OD2 3.48Å; D186-D188 PolarHBondContact OD1-N 3.06Å; D186-D188 VanDerWaalsContact OD1-N 3.16Å; D186-A196 HydrophobicContact CB-CB 3.78Å; D186-V198 HydrophobicContact CB-CG2 4.22Å; D186-D241 WeakPolarHBondContact OD2-CB 3.48Å
187	A	93	Very high	89.5	Confident	39 Å²	39	42.7 Å²	42.7	32%	0.322	26%	0.257	S	S	.	.			trans	-106.3	-12.4	-170.9	0	0	0	0	0	113.3	R119 E120 N156	R119-A187 PolarHBondContact NH2-O 2.84Å; E120-A187 HydrophobicContact CG-CB 4.07Å; N156-A187 HydrophobicContact CB-CB 3.92Å
188	D	92.9	Very high	89.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-67.7	-174.3	170.5	-54.3	-19.8	0	0	0	110.5	N154 D155 N156 D186 A196 F670	N154-D188 WeakPolarHBondContact CA-OD2 3.44Å; N154-D188 PolarHBondContact ND2-OD2 3.16Å; D155-D188 PolarHBondContact N-OD1 3Å; N156-D188 VanDerWaalsContact CB-OD1 3.24Å; N156-D188 WeakPolarHBondContact CB-OD1 3.12Å; N156-D188 PolarHBondContact N-OD1 2.99Å; N156-D188 PolarHBondContact ND2-OD1 2.64Å; D186-D188 PolarHBondContact OD1-N 3.06Å; D186-D188 VanDerWaalsContact OD1-N 3.16Å; D188-A196 HydrophobicContact CB-CB 4.4Å; D188-A196 VanDerWaalsContact O-CB 3.32Å; D188-A196 WeakPolarHBondContact O-CB 3.05Å; D188-F670 WeakPolarHBondContact O-CD1 3.48Å
189	D	88	Confident	89.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.234	C	C	.	.			trans	-93.5	125	-176.8	179.3	10.3	0	0	0	113	D152 S191 Y192 S195 A196 F670 D671	D152-D189 HydrophobicContact CB-CB 3.87Å; D152-D189 VanDerWaalsContact CG-N 3.33Å; D152-D189 VanDerWaalsContact OD1-CB 3.27Å; D152-D189 WeakPolarHBondContact OD1-CB 3.18Å; D152-D189 PolarHBondContact OD1-N 3.21Å; D152-D189 PolarHBondContact OD2-N 2.86Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 VanDerWaalsContact CG-OG 3.23Å; D189-S191 WeakPolarHBondContact OD1-CA 3.26Å; D189-S191 VanDerWaalsContact OD1-CB 3.32Å; D189-S191 WeakPolarHBondContact OD1-CB 3.36Å; D189-S191 PolarHBondContact OD1-N 2.96Å; D189-S191 PolarHBondContact OD1-OG 2.73Å; D189-S191 PolarHBondContact OD2-OG 2.77Å; D189-Y192 PolarHBondContact O-N 3.06Å; D189-Y192 PolarHBondContact OD1-N 2.99Å; D189-Y192 VanDerWaalsContact OD2-CB 3.23Å; D189-Y192 WeakPolarHBondContact OD2-CB 3.23Å; D189-Y192 PolarHBondContact OD2-N 2.83Å; D189-Y192 VanDerWaalsContact OD2-N 3.09Å; D189-S195 WeakPolarHBondContact O-CB 3.32Å; D189-A196 PolarHBondContact O-N 2.76Å; D189-F670 HydrophobicContact CB-CB 3.39Å; D189-F670 HydrophobicContact CB-CG 3.97Å; D189-F670 WeakPolarHBondContact OD1-CD2 3.33Å; D189-D671 WeakPolarHBondContact OD2-CA 3.44Å; D189-D671 PolarHBondContact OD2-N 3.33Å
190	P	83.9	Confident	89.4	Confident	72 Å²	72	39.6 Å²	39.6	47%	0.468	23%	0.231	S	C	.	.	S	Bend	trans	-74.1	-21.3	172.3	29.8	-35.7	0	0	0	113.8	A196 F670	P190-A196 HydrophobicContact CB-CB 4.22Å; P190-F670 VanDerWaalsContact CD-CE2 3.43Å; P190-F670 HydrophobicContact CG-CD2 4.2Å; P190-F670 HydrophobicContact CG-CE2 3.68Å; P190-F670 HydrophobicContact CG-CZ 4.03Å
191	S	79.6	Confident	89.3	Confident	86 Å²	86	40.2 Å²	40.2	60%	0.601	24%	0.237	S	C	*	.	S	Bend	trans	-84	-18.3	171.7	80.4	0	0	0	0	112.8	D189	D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 VanDerWaalsContact CG-OG 3.23Å; D189-S191 WeakPolarHBondContact OD1-CA 3.26Å; D189-S191 VanDerWaalsContact OD1-CB 3.32Å; D189-S191 WeakPolarHBondContact OD1-CB 3.36Å; D189-S191 PolarHBondContact OD1-N 2.96Å; D189-S191 PolarHBondContact OD1-OG 2.73Å; D189-S191 PolarHBondContact OD2-OG 2.77Å
192	Y	78.1	Confident	89.3	Confident	11 Å²	11	36.1 Å²	36.1	4%	0.043	22%	0.218	C	C	.	.	S	Bend	trans	-94.7	134.5	172.9	-169	-105.9	0	0	0	112.2	D152 D189 N194 S195 I672 G673 T674 L675	D152-Y192 HydrophobicContact CB-CD1 4.02Å; D152-Y192 HydrophobicContact CB-CG 3.98Å; D189-Y192 PolarHBondContact O-N 3.06Å; D189-Y192 PolarHBondContact OD1-N 2.99Å; D189-Y192 VanDerWaalsContact OD2-CB 3.23Å; D189-Y192 WeakPolarHBondContact OD2-CB 3.23Å; D189-Y192 PolarHBondContact OD2-N 2.83Å; D189-Y192 VanDerWaalsContact OD2-N 3.09Å; Y192-N194 CarbonylContact O-C 3.55Å; Y192-N194 WeakPolarHBondContact O-CA 2.93Å; Y192-N194 PolarHBondContact O-N 2.89Å; Y192-S195 PolarHBondContact O-N 3.25Å; Y192-S195 PolarHBondContact O-OG 3.1Å; Y192-I672 HydrophobicContact CD2-CB 4.04Å; Y192-I672 HydrophobicContact CD2-CG1 3.52Å; Y192-I672 VanDerWaalsContact CD2-O 3.26Å; Y192-I672 WeakPolarHBondContact CD2-O 3.32Å; Y192-I672 HydrophobicContact CE2-CG1 4.14Å; Y192-I672 WeakPolarHBondContact CE2-O 3.38Å; Y192-G673 VanDerWaalsContact CE1-C 3.46Å; Y192-G673 VanDerWaalsContact CE2-N 3.32Å; Y192-G673 PolarHBondContact OH-O 3.36Å; Y192-G673 VanDerWaalsContact OH-O 3.1Å; Y192-T674 HydrophobicContact CE1-CG2 4.09Å; Y192-T674 WeakPolarHBondContact CE1-OG1 3.49Å; Y192-T674 VanDerWaalsContact OH-CA 3.28Å; Y192-T674 WeakPolarHBondContact OH-CA 3.32Å; Y192-T674 PolarHBondContact OH-N 3.04Å; Y192-L675 VanDerWaalsContact OH-CB 3.27Å; Y192-L675 WeakPolarHBondContact OH-CB 3.26Å; Y192-L675 WeakPolarHBondContact OH-CG 3.16Å; Y192-L675 PolarHBondContact OH-N 3.47Å
193	G	71.7	Confident	89.3	Confident	24 Å²	24	40.9 Å²	40.9	25%	0.247	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-19.2	165	0	0	0	0	0	117.7
194	N	79.4	Confident	89.3	Confident	69 Å²	69	42.6 Å²	42.6	37%	0.369	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	23	-143.4	-52.8	-107.5	0	0	0	115	Y192 R197 M242	Y192-N194 CarbonylContact O-C 3.55Å; Y192-N194 WeakPolarHBondContact O-CA 2.93Å; Y192-N194 PolarHBondContact O-N 2.89Å; N194-R197 HydrophobicContact CB-CB 3.87Å; N194-R197 VanDerWaalsContact O-CB 3.24Å; N194-R197 WeakPolarHBondContact O-CB 3.27Å; N194-R197 PolarHBondContact O-N 3.37Å; N194-R197 VanDerWaalsContact O-N 3.07Å; N194-R197 WeakPolarHBondContact OD1-CD 3.47Å; N194-M242 WeakPolarHBondContact O-CA 3.39Å; N194-M242 PolarHBondContact O-N 2.85Å
195	S	81.8	Confident	89.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-73.5	-177.8	-46.2	0	0	0	0	110.4	D152 N154 D189 Y192 R197 D241 M242	D152-S195 WeakPolarHBondContact OD2-CB 3.43Å; D152-S195 PolarHBondContact OD2-OG 2.95Å; N154-S195 WeakPolarHBondContact OD1-CA 3.26Å; D189-S195 WeakPolarHBondContact O-CB 3.32Å; Y192-S195 PolarHBondContact O-N 3.25Å; Y192-S195 PolarHBondContact O-OG 3.1Å; S195-R197 PolarHBondContact O-N 3.09Å; S195-D241 VanDerWaalsContact O-CB 3.32Å; S195-D241 WeakPolarHBondContact O-CB 3.32Å; S195-M242 PolarHBondContact O-N 3.36Å
196	A	85.7	Confident	89	Confident	18 Å²	18	45.5 Å²	45.5	15%	0.149	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	16	179.3	0	0	0	0	0	115.6	D186 D188 D189 P190 V198	D186-A196 HydrophobicContact CB-CB 3.78Å; D188-A196 HydrophobicContact CB-CB 4.4Å; D188-A196 VanDerWaalsContact O-CB 3.32Å; D188-A196 WeakPolarHBondContact O-CB 3.05Å; D189-A196 PolarHBondContact O-N 2.76Å; P190-A196 HydrophobicContact CB-CB 4.22Å; A196-V198 PolarHBondContact O-N 2.75Å
197	R	90.6	Very high	89	Confident	111 Å²	111	48.1 Å²	48.1	42%	0.419	27%	0.274	S	S	.	.			trans	-86.9	88.5	176.2	-168.8	-172.2	171.9	170.2	-0.2	111.1	N194 S195 E214 D241 G243	N194-R197 HydrophobicContact CB-CB 3.87Å; N194-R197 VanDerWaalsContact O-CB 3.24Å; N194-R197 WeakPolarHBondContact O-CB 3.27Å; N194-R197 PolarHBondContact O-N 3.37Å; N194-R197 VanDerWaalsContact O-N 3.07Å; N194-R197 WeakPolarHBondContact OD1-CD 3.47Å; S195-R197 PolarHBondContact O-N 3.09Å; R197-E214 IonicContact NH2-OE1 3.77Å; R197-E214 PolarHBondContact NH2-OE1 3.34Å; R197-E214 VanDerWaalsContact NH2-OE1 3.14Å; R197-D241 CarbonylContact O-C 3.49Å; R197-G243 WeakPolarHBondContact O-CA 3.43Å; R197-G243 PolarHBondContact O-N 3.16Å
198	V	93.2	Very high	89.1	Confident	22 Å²	22	49.7 Å²	49.7	13%	0.133	27%	0.272	C	S	.	.			trans	-64.3	139.4	174.7	-177.9	0	0	0	0	113	P158 A184 D186 A196 Y200 A239 K240	P158-V198 HydrophobicContact CB-CG2 3.91Å; P158-V198 HydrophobicContact CG-CG2 4.03Å; A184-V198 HydrophobicContact CB-CG1 4.41Å; D186-V198 HydrophobicContact CB-CG2 4.22Å; A196-V198 PolarHBondContact O-N 2.75Å; V198-Y200 HydrophobicContact CG1-CD1 4.31Å; V198-Y200 HydrophobicContact CG1-CD2 4.43Å; V198-Y200 HydrophobicContact CG1-CE1 3.87Å; V198-Y200 HydrophobicContact CG1-CE2 4Å; V198-A239 HydrophobicContact CG1-CB 3.56Å; V198-K240 CarbonylContact C-O 3.06Å; V198-K240 VanDerWaalsContact CA-O 3.32Å; V198-K240 WeakPolarHBondContact CA-O 3.43Å
199	I	94.8	Very high	89.3	Confident	35 Å²	35	49.8 Å²	49.8	18%	0.179	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.5	163	-68.8	-64.5	0	0	0	109.5	P213 E214 K240 G243	I199-P213 WeakPolarHBondContact CA-O 3.35Å; I199-P213 HydrophobicContact CG2-CB 4.04Å; I199-E214 HydrophobicContact CD1-CG 4.12Å; I199-K240 PolarHBondContact N-O 3.26Å; I199-K240 PolarHBondContact O-N 2.98Å; I199-G243 VanDerWaalsContact CG1-C 3.46Å
200	Y	96.8	Very high	89.8	Confident	19 Å²	19	52 Å²	52	8%	0.075	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141	-177.7	-58.9	-83.3	0	0	0	112.7	F160 V182 A184 V198 P213 G216 I237 Q238 A239	F160-Y200 HydrophobicContact CE1-CD1 4.44Å; F160-Y200 AromaticContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CZ-CD1 4.29Å; F160-Y200 HydrophobicContact CZ-CE1 4.14Å; V182-Y200 HydrophobicContact CG2-CD1 4.48Å; A184-Y200 HydrophobicContact CB-CE1 4.13Å; A184-Y200 PolarHBondContact N-OH 3.25Å; V198-Y200 HydrophobicContact CG1-CD1 4.31Å; V198-Y200 HydrophobicContact CG1-CD2 4.43Å; V198-Y200 HydrophobicContact CG1-CE1 3.87Å; V198-Y200 HydrophobicContact CG1-CE2 4Å; Y200-P213 WeakPolarHBondContact CD2-O 3.5Å; Y200-P213 PolarHBondContact N-O 3.09Å; Y200-G216 VanDerWaalsContact CD2-N 3.34Å; Y200-I237 HydrophobicContact CD1-CG2 4.19Å; Y200-Q238 CarbonylContact C-O 3.41Å; Y200-Q238 WeakPolarHBondContact CA-O 3.18Å; Y200-A239 HydrophobicContact CD1-CB 4.23Å; Y200-A239 HydrophobicContact CE1-CB 4.07Å
201	S	96.3	Very high	90.4	Very high	44 Å²	44	49.7 Å²	49.7	31%	0.308	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	162	173.5	72.4	0	0	0	0	112.7	I237 Q238	S201-I237 WeakPolarHBondContact O-CA 3.48Å; S201-Q238 PolarHBondContact N-O 3.2Å; S201-Q238 PolarHBondContact O-N 3.07Å
202	I	96.3	Very high	91.2	Very high	19 Å²	19	49 Å²	49	10%	0.097	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.8	176.7	-70.8	164	0	0	0	109.5	Q204 Q206 F209 S210 V211 V235 I237	I202-Q204 VanDerWaalsContact CG2-C 3.47Å; I202-Q204 VanDerWaalsContact CG2-O 3.24Å; I202-Q204 WeakPolarHBondContact CG2-O 3.24Å; I202-Q206 HydrophobicContact CB-CG 4.41Å; I202-Q206 HydrophobicContact CG2-CG 4Å; I202-F209 HydrophobicContact CD1-CB 4.49Å; I202-F209 WeakPolarHBondContact CD1-O 3.42Å; I202-S210 VanDerWaalsContact CD1-C 3.49Å; I202-V211 HydrophobicContact CD1-CB 4.07Å; I202-V211 HydrophobicContact CD1-CG1 4.16Å; I202-V211 HydrophobicContact CG1-CB 4.07Å; I202-V211 HydrophobicContact CG1-CG1 3.83Å; I202-V235 HydrophobicContact CD1-CG1 4.4Å; I202-V235 HydrophobicContact CG1-CG1 4.09Å; I202-V235 HydrophobicContact CG2-CG1 4.2Å; I202-I237 HydrophobicContact CG1-CD1 3.57Å
203	L	95.1	Very high	92	Very high	100 Å²	100	51.8 Å²	51.8	52%	0.524	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-34.9	170.7	-62.1	-179.6	0	0	0	112.1	V236 Q238 T252	L203-V236 HydrophobicContact CB-CB 4.39Å; L203-V236 HydrophobicContact CB-CG1 4.26Å; L203-V236 HydrophobicContact CD1-CG1 4.27Å; L203-V236 PolarHBondContact N-O 2.82Å; L203-Q238 HydrophobicContact CD1-CB 3.95Å; L203-Q238 HydrophobicContact CD2-CB 4.25Å; L203-Q238 HydrophobicContact CG-CB 3.88Å; L203-T252 HydrophobicContact CD1-CG2 3.83Å
204	Q	95.1	Very high	93.1	Very high	104 Å²	104	57.2 Å²	57.2	49%	0.486	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	136.8	178.9	177.6	178.4	-37.3	0	0	109.1	I202 V235 V236	I202-Q204 VanDerWaalsContact CG2-C 3.47Å; I202-Q204 VanDerWaalsContact CG2-O 3.24Å; I202-Q204 WeakPolarHBondContact CG2-O 3.24Å; Q204-V235 CarbonylContact O-C 3.6Å; Q204-V235 WeakPolarHBondContact O-CA 3.33Å; Q204-V235 WeakPolarHBondContact O-CG1 3.08Å; Q204-V236 HydrophobicContact CB-CB 4.07Å; Q204-V236 HydrophobicContact CB-CG2 4.05Å; Q204-V236 PolarHBondContact O-N 2.98Å
205	G	91.5	Very high	93.8	Very high	12 Å²	12	56.2 Å²	56.2	12%	0.124	30%	0.295	C	S	.	.			trans	130.7	-18.2	-180	0	0	0	0	0	114.5	Y208 F209	G205-Y208 WeakPolarHBondContact O-CB 3.27Å; G205-Y208 PolarHBondContact O-N 2.91Å; G205-Y208 VanDerWaalsContact O-N 3.08Å; G205-F209 PolarHBondContact O-N 2.96Å
206	Q	91.6	Very high	94.4	Very high	141 Å²	141	56.2 Å²	56.2	66%	0.659	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	147.2	165.4	-66	-179	1.7	0	0	110.4	I202	I202-Q206 HydrophobicContact CB-CG 4.41Å; I202-Q206 HydrophobicContact CG2-CG 4Å
207	P	94.3	Very high	95	Very high	85 Å²	85	56.8 Å²	56.8	55%	0.552	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.1	7.5	2.6	37.7	-37.3	0	0	0	114.2	A221	P207-A221 WeakPolarHBondContact O-CB 3.1Å
208	Y	95.3	Very high	95.3	Very high	71 Å²	71	51.5 Å²	51.5	28%	0.278	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-37.1	-171.9	-58.2	-76.3	0	0	0	113.3	G205 A221 L222 M225 Y233	G205-Y208 WeakPolarHBondContact O-CB 3.27Å; G205-Y208 PolarHBondContact O-N 2.91Å; G205-Y208 VanDerWaalsContact O-N 3.08Å; Y208-A221 PolarHBondContact O-N 3.33Å; Y208-L222 HydrophobicContact CD1-CD2 3.68Å; Y208-L222 HydrophobicContact CE1-CD2 3.78Å; Y208-L222 PolarHBondContact O-N 2.7Å; Y208-M225 HydrophobicContact CD1-CE 3.98Å; Y208-M225 HydrophobicContact CD1-CG 4.42Å; Y208-M225 HydrophobicContact CD1-SD 4.26Å; Y208-M225 HydrophobicContact CG-CE 4.25Å; Y208-Y233 HydrophobicContact CD1-CD1 4.36Å; Y208-Y233 AromaticContact CD1-CE1 3.52Å; Y208-Y233 HydrophobicContact CD1-CE1 3.52Å; Y208-Y233 AromaticContact CD2-CD1 3.96Å; Y208-Y233 HydrophobicContact CD2-CD1 3.96Å; Y208-Y233 AromaticContact CD2-CE1 3.78Å; Y208-Y233 HydrophobicContact CD2-CE1 3.78Å; Y208-Y233 AromaticContact CE1-CE1 3.73Å; Y208-Y233 HydrophobicContact CE1-CE1 3.73Å; Y208-Y233 HydrophobicContact CE2-CD1 4.41Å; Y208-Y233 AromaticContact CE2-CE1 3.97Å; Y208-Y233 HydrophobicContact CE2-CE1 3.97Å; Y208-Y233 AromaticContact CG-CD1 3.93Å; Y208-Y233 HydrophobicContact CG-CD1 3.93Å; Y208-Y233 AromaticContact CG-CE1 3.54Å; Y208-Y233 HydrophobicContact CG-CE1 3.54Å; Y208-Y233 AromaticContact CZ-CE1 3.94Å
209	F	97	Very high	95.5	Very high	3 Å²	3	54 Å²	54	1%	0.013	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	154.8	-177.7	-58.1	-83.1	0	0	0	112.4	V179 I202 G205 I218 R219 T220 M225 Y233 V235 I257	V179-F209 HydrophobicContact CG2-CD1 4.21Å; V179-F209 HydrophobicContact CG2-CE1 4.04Å; I202-F209 HydrophobicContact CD1-CB 4.49Å; I202-F209 WeakPolarHBondContact CD1-O 3.42Å; G205-F209 PolarHBondContact O-N 2.96Å; F209-I218 HydrophobicContact CB-CG2 4.07Å; F209-I218 HydrophobicContact CD1-CG2 4.24Å; F209-I218 HydrophobicContact CG-CG2 4.4Å; F209-R219 VanDerWaalsContact CA-O 3.29Å; F209-R219 WeakPolarHBondContact CA-O 3.4Å; F209-T220 HydrophobicContact CE1-CG2 4.45Å; F209-M225 HydrophobicContact CE1-CE 4.37Å; F209-M225 HydrophobicContact CE2-CE 3.92Å; F209-M225 HydrophobicContact CZ-CE 3.66Å; F209-Y233 HydrophobicContact CE2-CD1 4.03Å; F209-Y233 AromaticContact CE2-CG 3.83Å; F209-Y233 HydrophobicContact CE2-CG 3.83Å; F209-Y233 HydrophobicContact CZ-CG 4.33Å; F209-V235 HydrophobicContact CB-CG2 4.29Å; F209-V235 HydrophobicContact CD2-CG2 3.48Å; F209-V235 VanDerWaalsContact CD2-CG2 3.48Å; F209-V235 HydrophobicContact CE2-CG2 4.07Å; F209-V235 HydrophobicContact CG-CG2 4.03Å; F209-I257 HydrophobicContact CD1-CD1 3.84Å; F209-I257 HydrophobicContact CD2-CD1 4.05Å; F209-I257 HydrophobicContact CE1-CD1 3.65Å; F209-I257 HydrophobicContact CE1-CG2 4.04Å; F209-I257 HydrophobicContact CE2-CD1 3.88Å; F209-I257 HydrophobicContact CG-CD1 4.03Å; F209-I257 HydrophobicContact CZ-CB 4.1Å; F209-I257 HydrophobicContact CZ-CD1 3.67Å; F209-I257 HydrophobicContact CZ-CG1 4.49Å; F209-I257 HydrophobicContact CZ-CG2 3.74Å
210	S	96.6	Very high	95.6	Very high	47 Å²	47	52.5 Å²	52.5	33%	0.329	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	158.4	168.8	56.8	0	0	0	0	109.8	I202 I218 R219	I202-S210 VanDerWaalsContact CD1-C 3.49Å; S210-I218 CarbonylContact O-C 3.22Å; S210-I218 WeakPolarHBondContact O-CA 3.41Å; S210-R219 PolarHBondContact N-O 2.76Å; S210-R219 PolarHBondContact O-N 2.65Å
211	V	97.3	Very high	95.5	Very high	23 Å²	23	53.4 Å²	53.4	14%	0.139	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.4	172.2	69.9	0	0	0	0	109.1	I202 P213 I217 I218 I237	I202-V211 HydrophobicContact CD1-CB 4.07Å; I202-V211 HydrophobicContact CD1-CG1 4.16Å; I202-V211 HydrophobicContact CG1-CB 4.07Å; I202-V211 HydrophobicContact CG1-CG1 3.83Å; V211-P213 WeakPolarHBondContact O-CD 3.45Å; V211-I217 WeakPolarHBondContact CA-O 3.28Å; V211-I218 HydrophobicContact CB-CG1 4.46Å; V211-I218 HydrophobicContact CG2-CG1 4.07Å; V211-I237 HydrophobicContact CB-CD1 4.36Å; V211-I237 HydrophobicContact CG2-CD1 4.43Å
212	E	96.4	Very high	95.4	Very high	72 Å²	72	54.4 Å²	54.4	34%	0.336	29%	0.287	S	S	.	.			trans	-82.3	114.9	175.7	-175.7	162.8	-114.4	0	0	109.6	E214 T215 G216 I217 R219	E212-E214 VanDerWaalsContact C-N 3.29Å; E212-E214 PolarHBondContact O-N 2.99Å; E212-E214 VanDerWaalsContact O-N 3.12Å; E212-T215 VanDerWaalsContact CB-OG1 3.28Å; E212-T215 WeakPolarHBondContact CB-OG1 3.32Å; E212-T215 HydrophobicContact CG-CG2 4.21Å; E212-T215 VanDerWaalsContact CG-OG1 3.22Å; E212-T215 WeakPolarHBondContact CG-OG1 3.46Å; E212-T215 PolarHBondContact O-N 3.44Å; E212-T215 PolarHBondContact OE2-OG1 2.83Å; E212-G216 PolarHBondContact O-N 3.16Å; E212-I217 HydrophobicContact CB-CB 4.29Å; E212-I217 PolarHBondContact N-O 3.26Å; E212-R219 IonicContact OE1-NH2 2.71Å; E212-R219 IonicContact OE2-NH2 3.6Å; E212-R219 PolarHBondContact OE2-NH2 2.82Å
213	P	95.8	Very high	95.1	Very high	68 Å²	68	57 Å²	57	44%	0.442	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.9	-160.7	-26.5	35.3	0	0	0	116.5	I199 Y200 V211	I199-P213 WeakPolarHBondContact CA-O 3.35Å; I199-P213 HydrophobicContact CG2-CB 4.04Å; Y200-P213 WeakPolarHBondContact CD2-O 3.5Å; Y200-P213 PolarHBondContact N-O 3.09Å; V211-P213 WeakPolarHBondContact O-CD 3.45Å
214	E	93.1	Very high	94.8	Very high	139 Å²	139	57.8 Å²	57.8	65%	0.65	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-19.5	-178.6	-59.4	-169.3	129.8	0	0	113.2	R197 I199 E212	R197-E214 IonicContact NH2-OE1 3.77Å; R197-E214 PolarHBondContact NH2-OE1 3.34Å; R197-E214 VanDerWaalsContact NH2-OE1 3.14Å; I199-E214 HydrophobicContact CD1-CG 4.12Å; E212-E214 VanDerWaalsContact C-N 3.29Å; E212-E214 PolarHBondContact O-N 2.99Å; E212-E214 VanDerWaalsContact O-N 3.12Å
215	T	94.6	Very high	94.7	Very high	48 Å²	48	53.4 Å²	53.4	29%	0.294	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-20.2	-173.2	65.9	0	0	0	0	113.6	Q181 E212 I217	Q181-T215 WeakPolarHBondContact CG-O 3.4Å; Q181-T215 PolarHBondContact NE2-O 3.14Å; E212-T215 VanDerWaalsContact CB-OG1 3.28Å; E212-T215 WeakPolarHBondContact CB-OG1 3.32Å; E212-T215 HydrophobicContact CG-CG2 4.21Å; E212-T215 VanDerWaalsContact CG-OG1 3.22Å; E212-T215 WeakPolarHBondContact CG-OG1 3.46Å; E212-T215 PolarHBondContact O-N 3.44Å; E212-T215 PolarHBondContact OE2-OG1 2.83Å; T215-I217 PolarHBondContact O-N 3.38Å; T215-I217 WeakPolarHBondContact OG1-CG1 3.48Å; T215-I217 PolarHBondContact OG1-N 3.49Å
216	G	95.1	Very high	94.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.			trans	72.9	11.1	-173.5	0	0	0	0	0	114	V182 Y200 E212 I218	V182-G216 PolarHBondContact N-O 3.24Å; V182-G216 WeakPolarHBondContact O-CA 3.38Å; Y200-G216 VanDerWaalsContact CD2-N 3.34Å; E212-G216 PolarHBondContact O-N 3.16Å; G216-I218 PolarHBondContact O-N 2.83Å
217	I	97.4	Very high	95	Very high	30 Å²	30	48.7 Å²	48.7	15%	0.154	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	117.9	178.4	-63.9	173	0	0	0	110	S178 Q181 V211 E212 T215 R219	S178-I217 WeakPolarHBondContact OG-CG2 3.37Å; Q181-I217 HydrophobicContact CB-CG1 4Å; Q181-I217 HydrophobicContact CG-CG1 3.72Å; V211-I217 WeakPolarHBondContact CA-O 3.28Å; E212-I217 HydrophobicContact CB-CB 4.29Å; E212-I217 PolarHBondContact N-O 3.26Å; T215-I217 PolarHBondContact O-N 3.38Å; T215-I217 WeakPolarHBondContact OG1-CG1 3.48Å; T215-I217 PolarHBondContact OG1-N 3.49Å; I217-R219 HydrophobicContact CG2-CG 4.12Å
218	I	97.4	Very high	95	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	133.5	175.9	-57.1	175.9	0	0	0	109.5	V179 V180 V182 F209 S210 V211 G216 I237 V255 I257	V179-I218 PolarHBondContact N-O 3.43Å; V180-I218 HydrophobicContact CG1-CB 4.32Å; V180-I218 HydrophobicContact CG1-CD1 3.96Å; V180-I218 HydrophobicContact CG1-CG1 4.47Å; V180-I218 PolarHBondContact O-N 3.25Å; V182-I218 HydrophobicContact CG1-CD1 4.38Å; F209-I218 HydrophobicContact CB-CG2 4.07Å; F209-I218 HydrophobicContact CD1-CG2 4.24Å; F209-I218 HydrophobicContact CG-CG2 4.4Å; S210-I218 CarbonylContact O-C 3.22Å; S210-I218 WeakPolarHBondContact O-CA 3.41Å; V211-I218 HydrophobicContact CB-CG1 4.46Å; V211-I218 HydrophobicContact CG2-CG1 4.07Å; G216-I218 PolarHBondContact O-N 2.83Å; I218-I237 HydrophobicContact CD1-CD1 3.75Å; I218-I237 HydrophobicContact CD1-CG1 3.81Å; I218-I237 HydrophobicContact CG1-CD1 4.15Å; I218-V255 HydrophobicContact CD1-CB 4.21Å; I218-V255 HydrophobicContact CD1-CG1 4.15Å; I218-V255 HydrophobicContact CD1-CG2 3.75Å; I218-I257 HydrophobicContact CG2-CD1 4.3Å
219	R	97.3	Very high	94.9	Very high	73 Å²	73	51.1 Å²	51.1	28%	0.275	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	155.5	-177.2	-58.8	177.8	-174.6	-87.6	-1.6	111.8	G176 T177 F209 S210 E212 I217	G176-R219 PolarHBondContact O-NH1 3.15Å; T177-R219 CarbonylContact O-C 3.51Å; T177-R219 WeakPolarHBondContact O-CA 3.36Å; F209-R219 VanDerWaalsContact CA-O 3.29Å; F209-R219 WeakPolarHBondContact CA-O 3.4Å; S210-R219 PolarHBondContact N-O 2.76Å; S210-R219 PolarHBondContact O-N 2.65Å; E212-R219 IonicContact OE1-NH2 2.71Å; E212-R219 IonicContact OE2-NH2 3.6Å; E212-R219 PolarHBondContact OE2-NH2 2.82Å; I217-R219 HydrophobicContact CG2-CG 4.12Å
220	T	96.9	Very high	94.8	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.031	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	132.5	168.4	54.6	0	0	0	0	110.4	V169 V174 G176 T177 V179 F209	V169-T220 HydrophobicContact CG2-CG2 4.23Å; V174-T220 PolarHBondContact O-OG1 3.21Å; G176-T220 PolarHBondContact N-O 3.27Å; G176-T220 PolarHBondContact N-OG1 3.29Å; T177-T220 PolarHBondContact N-OG1 3.27Å; T177-T220 VanDerWaalsContact N-OG1 3.15Å; T177-T220 PolarHBondContact O-N 3Å; V179-T220 HydrophobicContact CG2-CG2 4.21Å; F209-T220 HydrophobicContact CE1-CG2 4.45Å
221	A	95.4	Very high	94.7	Very high	38 Å²	38	57.8 Å²	57.8	31%	0.314	30%	0.297	S	S	.	.			trans	-115.6	-22.6	-179.8	0	0	0	0	0	113.5	P207 Y208	P207-A221 WeakPolarHBondContact O-CB 3.1Å; Y208-A221 PolarHBondContact O-N 3.33Å
222	L	93.6	Very high	94.6	Very high	64 Å²	64	62.6 Å²	62.6	34%	0.335	32%	0.317	S	S	.	.	S	Bend	trans	-105.9	133.2	178	-165.2	74.4	0	0	0	110.7	Y208 M225	Y208-L222 HydrophobicContact CD1-CD2 3.68Å; Y208-L222 HydrophobicContact CE1-CD2 3.78Å; Y208-L222 PolarHBondContact O-N 2.7Å; L222-M225 HydrophobicContact CB-CG 4.11Å; L222-M225 HydrophobicContact CB-SD 4.27Å; L222-M225 HydrophobicContact CD2-CG 4.37Å
223	P	90.9	Very high	94.6	Very high	75 Å²	75	60 Å²	60	49%	0.487	31%	0.305	S	S	.	.	S	Bend	trans	-73.6	159.1	170.9	32	-34.5	0	0	0	110.9	V175 M225	V175-P223 HydrophobicContact CG2-CB 3.85Å; V175-P223 HydrophobicContact CG2-CG 4.35Å; P223-M225 VanDerWaalsContact C-N 3.27Å; P223-M225 PolarHBondContact O-N 2.82Å
224	N	87.5	Confident	94.7	Very high	116 Å²	116	61 Å²	61	62%	0.62	30%	0.304	S	S	*	.			trans	53.9	39.9	174.3	-54	4	0	0	0	113.7	M172 N226	M172-N224 HydrophobicContact CE-CB 4.12Å; M172-N224 VanDerWaalsContact SD-CA 3.56Å; M172-N224 HydrophobicContact SD-CB 3.85Å; N224-N226 PolarHBondContact O-N 2.77Å
225	M	93.8	Very high	94.8	Very high	12 Å²	12	54.4 Å²	54.4	6%	0.059	27%	0.273	C	S	.	.			trans	-67.6	117.8	163.6	-67.6	-178.8	61.7	0	0	108.1	E171 M172 Y208 F209 L222 P223 Y233 L259	E171-M225 WeakPolarHBondContact CA-O 3.48Å; E171-M225 WeakPolarHBondContact CB-O 3.35Å; M172-M225 PolarHBondContact N-O 2.88Å; Y208-M225 HydrophobicContact CD1-CE 3.98Å; Y208-M225 HydrophobicContact CD1-CG 4.42Å; Y208-M225 HydrophobicContact CD1-SD 4.26Å; Y208-M225 HydrophobicContact CG-CE 4.25Å; F209-M225 HydrophobicContact CE1-CE 4.37Å; F209-M225 HydrophobicContact CE2-CE 3.92Å; F209-M225 HydrophobicContact CZ-CE 3.66Å; L222-M225 HydrophobicContact CB-CG 4.11Å; L222-M225 HydrophobicContact CB-SD 4.27Å; L222-M225 HydrophobicContact CD2-CG 4.37Å; P223-M225 VanDerWaalsContact C-N 3.27Å; P223-M225 PolarHBondContact O-N 2.82Å; M225-Y233 HydrophobicContact CE-CD1 4.23Å; M225-Y233 HydrophobicContact CE-CD2 4.11Å; M225-Y233 HydrophobicContact CE-CE1 3.79Å; M225-Y233 HydrophobicContact CE-CE2 3.66Å; M225-Y233 HydrophobicContact CE-CG 4.38Å; M225-Y233 VanDerWaalsContact CE-CZ 3.47Å; M225-L259 HydrophobicContact CB-CD1 4.14Å; M225-L259 HydrophobicContact CE-CD2 4.34Å
226	N	93.7	Very high	94.9	Very high	24 Å²	24	53.3 Å²	53.3	13%	0.128	27%	0.266	C	S	.	.			trans	-122.6	140.3	-173.1	156	-74.7	0	0	0	109.6	E171 M172 N224 E228 N229 R230 D264	E171-N226 WeakPolarHBondContact OE2-CA 2.96Å; M172-N226 HydrophobicContact SD-CB 4.45Å; N224-N226 PolarHBondContact O-N 2.77Å; N226-E228 PolarHBondContact ND2-OE2 3.03Å; N226-E228 PolarHBondContact OD1-N 3.36Å; N226-E228 PolarHBondContact OD1-OE2 3.11Å; N226-N229 PolarHBondContact OD1-N 2.81Å; N226-N229 PolarHBondContact OD1-ND2 3.16Å; N226-R230 PolarHBondContact O-N 3.14Å; N226-D264 PolarHBondContact ND2-OD1 2.63Å
227	R	95.6	Very high	95	Very high	29 Å²	29	53.3 Å²	53.3	11%	0.109	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-36.7	-166.5	-176.8	-151.3	64.8	95.7	-3.1	112.5	E171 N229 R230 E231 L259 D261 A296	E171-R227 HydrophobicContact CB-CB 4.39Å; E171-R227 VanDerWaalsContact OE1-CB 3.3Å; E171-R227 WeakPolarHBondContact OE1-CB 3.44Å; E171-R227 IonicContact OE1-NE 3.12Å; E171-R227 WeakPolarHBondContact OE2-CB 3.28Å; E171-R227 PolarHBondContact OE2-N 3.06Å; R227-N229 PolarHBondContact O-N 3.37Å; R227-R230 CarbonylContact O-C 3.53Å; R227-R230 PolarHBondContact O-N 2.82Å; R227-E231 HydrophobicContact CG-CB 3.97Å; R227-E231 HydrophobicContact CG-CG 3.96Å; R227-E231 PolarHBondContact O-N 3.01Å; R227-L259 HydrophobicContact CB-CB 4.08Å; R227-L259 HydrophobicContact CB-CD1 4.5Å; R227-L259 HydrophobicContact CG-CB 4.18Å; R227-D261 IonicContact CZ-OD1 3.48Å; R227-D261 IonicContact NE-OD1 2.74Å; R227-D261 PolarHBondContact NE-OD1 2.93Å; R227-D261 IonicContact NH1-OD1 2.72Å; R227-D261 IonicContact NH2-OD1 3.85Å; R227-D261 PolarHBondContact NH2-OD1 2.82Å; R227-A296 PolarHBondContact NH2-O 3.37Å
228	E	93.9	Very high	95	Very high	61 Å²	61	54 Å²	54	29%	0.285	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-32.3	178.5	-62.2	62.1	-123.8	0	0	110.8	N226 A296	N226-E228 PolarHBondContact ND2-OE2 3.03Å; N226-E228 PolarHBondContact OD1-N 3.36Å; N226-E228 PolarHBondContact OD1-OE2 3.11Å; E228-A296 HydrophobicContact CG-CB 4Å
229	N	93.2	Very high	95	Very high	146 Å²	146	54 Å²	54	78%	0.781	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-42.4	170.7	-77.2	-85.5	0	0	0	112.4	N226 R227	N226-N229 PolarHBondContact OD1-N 2.81Å; N226-N229 PolarHBondContact OD1-ND2 3.16Å; R227-N229 PolarHBondContact O-N 3.37Å
230	R	94.5	Very high	94.8	Very high	114 Å²	114	52.2 Å²	52.2	43%	0.43	26%	0.263	S	S	.	.			trans	-162.8	108.5	176.6	-178.2	173.6	176.2	166	6.1	112.5	N226 R227 Q232 Y233	N226-R230 PolarHBondContact O-N 3.14Å; R227-R230 CarbonylContact O-C 3.53Å; R227-R230 PolarHBondContact O-N 2.82Å; R230-Q232 PolarHBondContact NE-O 2.85Å; R230-Q232 PolarHBondContact NH2-O 2.74Å; R230-Y233 HydrophobicContact CB-CE2 4.36Å; R230-Y233 HydrophobicContact CG-CE1 4.28Å; R230-Y233 HydrophobicContact CG-CE2 3.97Å; R230-Y233 WeakPolarHBondContact O-CE2 3.2Å
231	E	95.2	Very high	94.7	Very high	77 Å²	77	52 Å²	52	36%	0.36	26%	0.261	S	S	.	.			trans	-70.5	-43.1	176.4	-174.4	-164.2	110.7	0	0	113.5	R227 T258 L259	R227-E231 HydrophobicContact CG-CB 3.97Å; R227-E231 HydrophobicContact CG-CG 3.96Å; R227-E231 PolarHBondContact O-N 3.01Å; E231-T258 HydrophobicContact CG-CG2 3.95Å; E231-L259 PolarHBondContact O-N 3.29Å
232	Q	96.3	Very high	94.4	Very high	123 Å²	123	52 Å²	52	58%	0.575	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.2	-163.9	-63.7	-179.7	10.4	0	0	113.9	R230	R230-Q232 PolarHBondContact NE-O 2.85Å; R230-Q232 PolarHBondContact NH2-O 2.74Å
233	Y	96.1	Very high	94	Very high	18 Å²	18	50.2 Å²	50.2	7%	0.071	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.1	179.4	-65.9	-95.9	0	0	0	111	Y208 F209 M225 R230 I257 L259	Y208-Y233 HydrophobicContact CD1-CD1 4.36Å; Y208-Y233 AromaticContact CD1-CE1 3.52Å; Y208-Y233 HydrophobicContact CD1-CE1 3.52Å; Y208-Y233 AromaticContact CD2-CD1 3.96Å; Y208-Y233 HydrophobicContact CD2-CD1 3.96Å; Y208-Y233 AromaticContact CD2-CE1 3.78Å; Y208-Y233 HydrophobicContact CD2-CE1 3.78Å; Y208-Y233 AromaticContact CE1-CE1 3.73Å; Y208-Y233 HydrophobicContact CE1-CE1 3.73Å; Y208-Y233 HydrophobicContact CE2-CD1 4.41Å; Y208-Y233 AromaticContact CE2-CE1 3.97Å; Y208-Y233 HydrophobicContact CE2-CE1 3.97Å; Y208-Y233 AromaticContact CG-CD1 3.93Å; Y208-Y233 HydrophobicContact CG-CD1 3.93Å; Y208-Y233 AromaticContact CG-CE1 3.54Å; Y208-Y233 HydrophobicContact CG-CE1 3.54Å; Y208-Y233 AromaticContact CZ-CE1 3.94Å; F209-Y233 HydrophobicContact CE2-CD1 4.03Å; F209-Y233 AromaticContact CE2-CG 3.83Å; F209-Y233 HydrophobicContact CE2-CG 3.83Å; F209-Y233 HydrophobicContact CZ-CG 4.33Å; M225-Y233 HydrophobicContact CE-CD1 4.23Å; M225-Y233 HydrophobicContact CE-CD2 4.11Å; M225-Y233 HydrophobicContact CE-CE1 3.79Å; M225-Y233 HydrophobicContact CE-CE2 3.66Å; M225-Y233 HydrophobicContact CE-CG 4.38Å; M225-Y233 VanDerWaalsContact CE-CZ 3.47Å; R230-Y233 HydrophobicContact CB-CE2 4.36Å; R230-Y233 HydrophobicContact CG-CE1 4.28Å; R230-Y233 HydrophobicContact CG-CE2 3.97Å; R230-Y233 WeakPolarHBondContact O-CE2 3.2Å; Y233-I257 PolarHBondContact N-O 3.07Å; Y233-I257 PolarHBondContact O-N 2.75Å; Y233-L259 HydrophobicContact CD2-CG 4.28Å; Y233-L259 HydrophobicContact CE2-CD1 3.78Å; Y233-L259 HydrophobicContact CE2-CG 3.87Å
234	Q	96.3	Very high	93.8	Very high	90 Å²	90	48.3 Å²	48.3	42%	0.421	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122	173.2	-172	-175.4	17.8	0	0	107.9	T254	Q234-T254 HydrophobicContact CG-CG2 3.69Å
235	V	96.5	Very high	93.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.4	175.5	-177	0	0	0	0	108.2	I202 Q204 F209 I237 V255 I257	I202-V235 HydrophobicContact CD1-CG1 4.4Å; I202-V235 HydrophobicContact CG1-CG1 4.09Å; I202-V235 HydrophobicContact CG2-CG1 4.2Å; Q204-V235 CarbonylContact O-C 3.6Å; Q204-V235 WeakPolarHBondContact O-CA 3.33Å; Q204-V235 WeakPolarHBondContact O-CG1 3.08Å; F209-V235 HydrophobicContact CB-CG2 4.29Å; F209-V235 HydrophobicContact CD2-CG2 3.48Å; F209-V235 VanDerWaalsContact CD2-CG2 3.48Å; F209-V235 HydrophobicContact CE2-CG2 4.07Å; F209-V235 HydrophobicContact CG-CG2 4.03Å; V235-I237 HydrophobicContact CG1-CD1 3.71Å; V235-I237 HydrophobicContact CG1-CG1 4.37Å; V235-V255 HydrophobicContact CB-CB 4.36Å; V235-V255 PolarHBondContact N-O 3.46Å; V235-V255 PolarHBondContact O-N 3.01Å; V235-I257 HydrophobicContact CB-CD1 4.44Å; V235-I257 HydrophobicContact CG2-CD1 3.65Å
236	V	97.3	Very high	93.1	Very high	25 Å²	25	56.8 Å²	56.8	15%	0.152	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.9	173.9	-179.4	0	0	0	0	107.9	L203 Q204	L203-V236 HydrophobicContact CB-CB 4.39Å; L203-V236 HydrophobicContact CB-CG1 4.26Å; L203-V236 HydrophobicContact CD1-CG1 4.27Å; L203-V236 PolarHBondContact N-O 2.82Å; Q204-V236 HydrophobicContact CB-CB 4.07Å; Q204-V236 HydrophobicContact CB-CG2 4.05Å; Q204-V236 PolarHBondContact O-N 2.98Å
237	I	97.2	Very high	92.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.3	177.2	-55.6	-61.6	0	0	0	108.9	F160 V182 Y200 S201 I202 V211 I218 V235 T252 T253 V255	F160-I237 HydrophobicContact CZ-CG2 4.08Å; V182-I237 HydrophobicContact CG2-CB 4.34Å; V182-I237 HydrophobicContact CG2-CG1 4.16Å; V182-I237 HydrophobicContact CG2-CG2 3.92Å; Y200-I237 HydrophobicContact CD1-CG2 4.19Å; S201-I237 WeakPolarHBondContact O-CA 3.48Å; I202-I237 HydrophobicContact CG1-CD1 3.57Å; V211-I237 HydrophobicContact CB-CD1 4.36Å; V211-I237 HydrophobicContact CG2-CD1 4.43Å; I218-I237 HydrophobicContact CD1-CD1 3.75Å; I218-I237 HydrophobicContact CD1-CG1 3.81Å; I218-I237 HydrophobicContact CG1-CD1 4.15Å; V235-I237 HydrophobicContact CG1-CD1 3.71Å; V235-I237 HydrophobicContact CG1-CG1 4.37Å; I237-T252 CarbonylContact O-C 3.6Å; I237-T252 WeakPolarHBondContact O-CA 3.14Å; I237-T252 WeakPolarHBondContact O-CB 3.25Å; I237-T253 HydrophobicContact CB-CG2 4.13Å; I237-T253 PolarHBondContact N-O 2.79Å; I237-T253 PolarHBondContact O-N 3.41Å; I237-V255 HydrophobicContact CG1-CG2 3.96Å
238	Q	96.3	Very high	92.2	Very high	45 Å²	45	58.6 Å²	58.6	21%	0.21	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.9	165.7	175.3	168.2	73.7	0	0	109.1	Y200 S201 L203 T252	Y200-Q238 CarbonylContact C-O 3.41Å; Y200-Q238 WeakPolarHBondContact CA-O 3.18Å; S201-Q238 PolarHBondContact N-O 3.2Å; S201-Q238 PolarHBondContact O-N 3.07Å; L203-Q238 HydrophobicContact CD1-CB 3.95Å; L203-Q238 HydrophobicContact CD2-CB 4.25Å; L203-Q238 HydrophobicContact CG-CB 3.88Å; Q238-T252 HydrophobicContact CB-CG2 4.12Å; Q238-T252 HydrophobicContact CG-CG2 4.36Å
239	A	96.6	Very high	92.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.5	160.8	0	0	0	0	0	107.4	P158 F160 A184 V198 Y200 S250 G251	P158-A239 HydrophobicContact CB-CB 3.72Å; F160-A239 HydrophobicContact CE1-CB 4.42Å; F160-A239 HydrophobicContact CE2-CB 3.57Å; F160-A239 HydrophobicContact CZ-CB 3.48Å; F160-A239 VanDerWaalsContact CZ-CB 3.48Å; A184-A239 HydrophobicContact CB-CB 3.42Å; A184-A239 VanDerWaalsContact CB-CB 3.42Å; V198-A239 HydrophobicContact CG1-CB 3.56Å; Y200-A239 HydrophobicContact CD1-CB 4.23Å; Y200-A239 HydrophobicContact CE1-CB 4.07Å; A239-S250 CarbonylContact O-C 3.53Å; A239-S250 WeakPolarHBondContact O-CA 3.29Å; A239-S250 WeakPolarHBondContact O-CB 3.32Å; A239-G251 PolarHBondContact N-O 3.01Å; A239-G251 PolarHBondContact O-N 3.2Å
240	K	94.5	Very high	92.2	Very high	35 Å²	35	53 Å²	53	15%	0.152	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.7	177.6	178.4	151.9	-150	177.7	0	111.4	V198 I199 Q245 G248 L249 S250	V198-K240 CarbonylContact C-O 3.06Å; V198-K240 VanDerWaalsContact CA-O 3.32Å; V198-K240 WeakPolarHBondContact CA-O 3.43Å; I199-K240 PolarHBondContact N-O 3.26Å; I199-K240 PolarHBondContact O-N 2.98Å; K240-Q245 WeakPolarHBondContact CE-O 3.24Å; K240-Q245 PolarHBondContact NZ-O 3.19Å; K240-G248 VanDerWaalsContact CE-CA 3.41Å; K240-G248 WeakPolarHBondContact CE-O 3.45Å; K240-G248 PolarHBondContact NZ-O 3.43Å; K240-L249 WeakPolarHBondContact CG-O 3.37Å; K240-S250 WeakPolarHBondContact CB-OG 3.28Å; K240-S250 VanDerWaalsContact CD-OG 3.22Å; K240-S250 WeakPolarHBondContact CD-OG 3.38Å; K240-S250 WeakPolarHBondContact CE-OG 3.4Å; K240-S250 VanDerWaalsContact CG-OG 3.32Å; K240-S250 WeakPolarHBondContact CG-OG 3.49Å
241	D	93.4	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-65.4	-172.2	177.3	70.2	22.4	0	0	0	112.8	N154 P158 D186 S195 R197 G243 G244 G248 L249	N154-D241 PolarHBondContact ND2-OD2 2.72Å; P158-D241 HydrophobicContact CG-CB 3.79Å; D186-D241 WeakPolarHBondContact OD2-CB 3.48Å; S195-D241 VanDerWaalsContact O-CB 3.32Å; S195-D241 WeakPolarHBondContact O-CB 3.32Å; R197-D241 CarbonylContact O-C 3.49Å; D241-G243 PolarHBondContact O-N 3.01Å; D241-G244 PolarHBondContact O-N 3.16Å; D241-G248 VanDerWaalsContact OD1-C 3.31Å; D241-G248 WeakPolarHBondContact OD1-CA 3.36Å; D241-L249 VanDerWaalsContact CG-N 3.25Å; D241-L249 PolarHBondContact N-O 2.98Å; D241-L249 PolarHBondContact OD1-N 2.88Å; D241-L249 VanDerWaalsContact OD2-CA 3.26Å; D241-L249 WeakPolarHBondContact OD2-CA 3.27Å; D241-L249 WeakPolarHBondContact OD2-CB 3.4Å; D241-L249 PolarHBondContact OD2-N 3.12Å
242	M	88.9	Confident	92.2	Very high	38 Å²	38	48.2 Å²	48.2	19%	0.187	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	55.2	26	171.7	-72.9	-74.2	-91	0	0	114.3	N154 N194 S195 G244 Q245	N154-M242 WeakPolarHBondContact OD1-CG 3.31Å; N194-M242 WeakPolarHBondContact O-CA 3.39Å; N194-M242 PolarHBondContact O-N 2.85Å; S195-M242 PolarHBondContact O-N 3.36Å; M242-G244 VanDerWaalsContact C-N 3.33Å; M242-G244 PolarHBondContact O-N 3.01Å; M242-Q245 HydrophobicContact CB-CB 4.35Å; M242-Q245 WeakPolarHBondContact O-CB 3.47Å; M242-Q245 WeakPolarHBondContact O-CG 3.31Å; M242-Q245 PolarHBondContact O-NE2 2.86Å
243	G	85.6	Confident	92.2	Very high	27 Å²	27	42.5 Å²	42.5	28%	0.278	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	65.3	30.6	-173.6	0	0	0	0	0	114	R197 I199 D241	R197-G243 WeakPolarHBondContact O-CA 3.43Å; R197-G243 PolarHBondContact O-N 3.16Å; I199-G243 VanDerWaalsContact CG1-C 3.46Å; D241-G243 PolarHBondContact O-N 3.01Å
244	G	86.5	Confident	92.3	Very high	35 Å²	35	43 Å²	43	36%	0.361	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	82	11.4	-179.9	0	0	0	0	0	114.9	D241 M242	D241-G244 PolarHBondContact O-N 3.16Å; M242-G244 VanDerWaalsContact C-N 3.33Å; M242-G244 PolarHBondContact O-N 3.01Å
245	Q	87.3	Confident	92.4	Very high	113 Å²	113	38.7 Å²	38.7	53%	0.528	24%	0.241	S	C	.	.			trans	-75	164.4	-170	-74.1	-178.9	76.8	0	0	114.1	K240 M242 G247 G248	K240-Q245 WeakPolarHBondContact CE-O 3.24Å; K240-Q245 PolarHBondContact NZ-O 3.19Å; M242-Q245 HydrophobicContact CB-CB 4.35Å; M242-Q245 WeakPolarHBondContact O-CB 3.47Å; M242-Q245 WeakPolarHBondContact O-CG 3.31Å; M242-Q245 PolarHBondContact O-NE2 2.86Å; Q245-G247 VanDerWaalsContact C-N 3.27Å; Q245-G247 PolarHBondContact O-N 3.21Å; Q245-G248 PolarHBondContact O-N 2.95Å
246	M	80.5	Confident	92.4	Very high	193 Å²	193	41.6 Å²	41.6	95%	0.951	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.5	-174.7	-71	-168	70.4	0	0	114.6
247	G	80.5	Confident	92.4	Very high	78 Å²	78	40.4 Å²	40.4	80%	0.804	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.9	179.7	0	0	0	0	0	115.3	Q245	Q245-G247 VanDerWaalsContact C-N 3.27Å; Q245-G247 PolarHBondContact O-N 3.21Å
248	G	88.4	Confident	92.4	Very high	12 Å²	12	43 Å²	43	12%	0.124	27%	0.265	C	S	.	.			trans	-75.7	160.1	-169.8	0	0	0	0	0	117.1	K240 D241 Q245	K240-G248 VanDerWaalsContact CE-CA 3.41Å; K240-G248 WeakPolarHBondContact CE-O 3.45Å; K240-G248 PolarHBondContact NZ-O 3.43Å; D241-G248 VanDerWaalsContact OD1-C 3.31Å; D241-G248 WeakPolarHBondContact OD1-CA 3.36Å; Q245-G248 PolarHBondContact O-N 2.95Å
249	L	92.9	Very high	92.4	Very high	62 Å²	62	41.1 Å²	41.1	33%	0.325	26%	0.256	S	S	.	.			trans	-83.6	168.4	169.6	-46	176.3	0	0	0	110.6	E157 K240 D241	E157-L249 HydrophobicContact CB-CB 3.66Å; E157-L249 HydrophobicContact CB-CD1 4.23Å; K240-L249 WeakPolarHBondContact CG-O 3.37Å; D241-L249 VanDerWaalsContact CG-N 3.25Å; D241-L249 PolarHBondContact N-O 2.98Å; D241-L249 PolarHBondContact OD1-N 2.88Å; D241-L249 VanDerWaalsContact OD2-CA 3.26Å; D241-L249 WeakPolarHBondContact OD2-CA 3.27Å; D241-L249 WeakPolarHBondContact OD2-CB 3.4Å; D241-L249 PolarHBondContact OD2-N 3.12Å
250	S	94.5	Very high	92.3	Very high	28 Å²	28	43.7 Å²	43.7	20%	0.196	27%	0.272	C	S	.	.			trans	-163.5	101.1	-170	-60.3	0	0	0	0	115.6	A239 K240	A239-S250 CarbonylContact O-C 3.53Å; A239-S250 WeakPolarHBondContact O-CA 3.29Å; A239-S250 WeakPolarHBondContact O-CB 3.32Å; K240-S250 WeakPolarHBondContact CB-OG 3.28Å; K240-S250 VanDerWaalsContact CD-OG 3.22Å; K240-S250 WeakPolarHBondContact CD-OG 3.38Å; K240-S250 WeakPolarHBondContact CE-OG 3.4Å; K240-S250 VanDerWaalsContact CG-OG 3.32Å; K240-S250 WeakPolarHBondContact CG-OG 3.49Å
251	G	94.8	Very high	92.3	Very high	9 Å²	9	43.6 Å²	43.6	9%	0.093	27%	0.273	C	S	.	.			trans	-73.5	163.6	166.3	0	0	0	0	0	113.8	P158 A239	P158-G251 VanDerWaalsContact O-CA 3.25Å; P158-G251 WeakPolarHBondContact O-CA 3.39Å; P158-G251 PolarHBondContact O-N 3.2Å; A239-G251 PolarHBondContact N-O 3.01Å; A239-G251 PolarHBondContact O-N 3.2Å
252	T	96.3	Very high	92.2	Very high	81 Å²	81	44 Å²	44	50%	0.497	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	150	179.5	63.1	0	0	0	0	111.7	L203 I237 Q238	L203-T252 HydrophobicContact CD1-CG2 3.83Å; I237-T252 CarbonylContact O-C 3.6Å; I237-T252 WeakPolarHBondContact O-CA 3.14Å; I237-T252 WeakPolarHBondContact O-CB 3.25Å; Q238-T252 HydrophobicContact CB-CG2 4.12Å; Q238-T252 HydrophobicContact CG-CG2 4.36Å
253	T	96.6	Very high	92.3	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156	173.3	-173.7	0	0	0	0	110.8	F160 E162 E163 Y165 I237	F160-T253 HydrophobicContact CB-CG2 4.37Å; F160-T253 HydrophobicContact CD1-CG2 3.54Å; F160-T253 HydrophobicContact CD2-CG2 3.76Å; F160-T253 HydrophobicContact CE1-CG2 3.56Å; F160-T253 HydrophobicContact CE2-CG2 3.78Å; F160-T253 HydrophobicContact CG-CG2 3.62Å; F160-T253 HydrophobicContact CZ-CG2 3.67Å; E162-T253 PolarHBondContact O-OG1 3.02Å; E163-T253 PolarHBondContact O-OG1 3.43Å; Y165-T253 HydrophobicContact CD2-CG2 3.9Å; Y165-T253 WeakPolarHBondContact CD2-OG1 3.4Å; Y165-T253 HydrophobicContact CE2-CG2 3.81Å; Y165-T253 WeakPolarHBondContact CE2-OG1 3.49Å; I237-T253 HydrophobicContact CB-CG2 4.13Å; I237-T253 PolarHBondContact N-O 2.79Å; I237-T253 PolarHBondContact O-N 3.41Å
254	T	97.4	Very high	92.4	Very high	29 Å²	29	42.1 Å²	42.1	18%	0.178	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	135	174.6	-64.3	0	0	0	0	110.5	E163 I164 Y165 Q234	E163-T254 PolarHBondContact O-N 2.89Å; I164-T254 CarbonylContact C-O 3.51Å; I164-T254 VanDerWaalsContact CA-O 3.29Å; I164-T254 WeakPolarHBondContact CA-O 3.13Å; I164-T254 HydrophobicContact CG2-CG2 4.46Å; Y165-T254 PolarHBondContact N-O 2.82Å; Q234-T254 HydrophobicContact CG-CG2 3.69Å
255	V	97.4	Very high	92.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	112.8	171.7	-170	0	0	0	0	108.8	Y165 V180 V182 I218 V235 I237 I257	Y165-V255 HydrophobicContact CD2-CG2 4.45Å; Y165-V255 WeakPolarHBondContact O-CA 3.26Å; V180-V255 HydrophobicContact CG1-CG1 3.76Å; V182-V255 HydrophobicContact CG1-CG2 3.78Å; I218-V255 HydrophobicContact CD1-CB 4.21Å; I218-V255 HydrophobicContact CD1-CG1 4.15Å; I218-V255 HydrophobicContact CD1-CG2 3.75Å; V235-V255 HydrophobicContact CB-CB 4.36Å; V235-V255 PolarHBondContact N-O 3.46Å; V235-V255 PolarHBondContact O-N 3.01Å; I237-V255 HydrophobicContact CG1-CG2 3.96Å; V255-I257 HydrophobicContact CG1-CD1 4.32Å; V255-I257 HydrophobicContact CG1-CG1 3.88Å
256	N	97.6	Very high	92.7	Very high	60 Å²	60	38.5 Å²	38.5	32%	0.321	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116	174.2	-69.9	-32.7	0	0	0	109	I164 Y165 T166 A167	I164-N256 VanDerWaalsContact CG2-ND2 3.34Å; I164-N256 WeakPolarHBondContact CG2-ND2 3.28Å; Y165-N256 PolarHBondContact O-N 3.42Å; T166-N256 WeakPolarHBondContact CA-O 3.08Å; A167-N256 PolarHBondContact N-O 3.37Å
257	I	97.3	Very high	93.4	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	120.2	-176.6	-53.5	171.8	0	0	0	109.1	A167 V169 V179 F209 I218 Y233 V235 V255	A167-I257 WeakPolarHBondContact O-CA 2.97Å; V169-I257 HydrophobicContact CG1-CG2 3.99Å; V179-I257 HydrophobicContact CG1-CD1 4.13Å; V179-I257 HydrophobicContact CG1-CG1 4.25Å; V179-I257 HydrophobicContact CG1-CG2 3.83Å; F209-I257 HydrophobicContact CD1-CD1 3.84Å; F209-I257 HydrophobicContact CD2-CD1 4.05Å; F209-I257 HydrophobicContact CE1-CD1 3.65Å; F209-I257 HydrophobicContact CE1-CG2 4.04Å; F209-I257 HydrophobicContact CE2-CD1 3.88Å; F209-I257 HydrophobicContact CG-CD1 4.03Å; F209-I257 HydrophobicContact CZ-CB 4.1Å; F209-I257 HydrophobicContact CZ-CD1 3.67Å; F209-I257 HydrophobicContact CZ-CG1 4.49Å; F209-I257 HydrophobicContact CZ-CG2 3.74Å; I218-I257 HydrophobicContact CG2-CD1 4.3Å; Y233-I257 PolarHBondContact N-O 3.07Å; Y233-I257 PolarHBondContact O-N 2.75Å; V235-I257 HydrophobicContact CB-CD1 4.44Å; V235-I257 HydrophobicContact CG2-CD1 3.65Å; V255-I257 HydrophobicContact CG1-CD1 4.32Å; V255-I257 HydrophobicContact CG1-CG1 3.88Å
258	T	97.2	Very high	94.1	Very high	55 Å²	55	31.1 Å²	31.1	34%	0.337	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.1	175.7	-54.2	0	0	0	0	110	A167 S168 V169 E231	A167-T258 PolarHBondContact O-N 2.77Å; S168-T258 VanDerWaalsContact CA-O 3.25Å; S168-T258 WeakPolarHBondContact CA-O 2.78Å; V169-T258 PolarHBondContact N-O 3.27Å; V169-T258 VanDerWaalsContact N-O 3.15Å; E231-T258 HydrophobicContact CG-CG2 3.95Å
259	L	96.5	Very high	94.4	Very high	5 Å²	5	31.2 Å²	31.2	3%	0.026	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	126.9	169.4	-66.1	-171.7	0	0	0	110	V169 E171 M225 R227 E231 Y233	V169-L259 HydrophobicContact CG1-CD2 3.73Å; V169-L259 CarbonylContact O-C 3.55Å; V169-L259 WeakPolarHBondContact O-CA 3.11Å; E171-L259 HydrophobicContact CB-CB 4.36Å; E171-L259 HydrophobicContact CB-CD1 4.19Å; M225-L259 HydrophobicContact CB-CD1 4.14Å; M225-L259 HydrophobicContact CE-CD2 4.34Å; R227-L259 HydrophobicContact CB-CB 4.08Å; R227-L259 HydrophobicContact CB-CD1 4.5Å; R227-L259 HydrophobicContact CG-CB 4.18Å; E231-L259 PolarHBondContact O-N 3.29Å; Y233-L259 HydrophobicContact CD2-CG 4.28Å; Y233-L259 HydrophobicContact CE2-CD1 3.78Å; Y233-L259 HydrophobicContact CE2-CG 3.87Å
260	T	95.1	Very high	94.5	Very high	54 Å²	54	33 Å²	33	33%	0.331	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	133.4	173.2	69.8	0	0	0	0	110.5	V169 P170 E171	V169-T260 PolarHBondContact O-N 3.1Å; P170-T260 WeakPolarHBondContact CA-O 3.35Å; P170-T260 VanDerWaalsContact CA-OG1 3.26Å; P170-T260 WeakPolarHBondContact CA-OG1 3.04Å; E171-T260 PolarHBondContact N-O 3.23Å; E171-T260 VanDerWaalsContact N-O 3.13Å
261	D	93.7	Very high	94.4	Very high	33 Å²	33	37.3 Å²	37.3	18%	0.176	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-50.6	134.8	-177.6	-156.5	97.6	0	0	0	114.3	E171 R227 T298 N301	E171-D261 VanDerWaalsContact OE1-CA 3.3Å; E171-D261 WeakPolarHBondContact OE1-CA 3.22Å; R227-D261 IonicContact CZ-OD1 3.48Å; R227-D261 IonicContact NE-OD1 2.74Å; R227-D261 PolarHBondContact NE-OD1 2.93Å; R227-D261 IonicContact NH1-OD1 2.72Å; R227-D261 IonicContact NH2-OD1 3.85Å; R227-D261 PolarHBondContact NH2-OD1 2.82Å; D261-T298 WeakPolarHBondContact OD1-CA 3.29Å; D261-T298 WeakPolarHBondContact OD1-CB 3.35Å; D261-T298 PolarHBondContact OD1-N 2.9Å; D261-T298 PolarHBondContact OD1-OG1 2.9Å; D261-T298 PolarHBondContact OD2-N 3.37Å; D261-T298 VanDerWaalsContact OD2-N 3.1Å; D261-N301 PolarHBondContact O-ND2 2.91Å; D261-N301 WeakPolarHBondContact OD2-CB 3.41Å; D261-N301 PolarHBondContact OD2-ND2 2.85Å
262	V	90.9	Very high	94.3	Very high	9 Å²	9	43.3 Å²	43.3	6%	0.055	23%	0.234	C	C	.	.			trans	-127.9	142.2	172.7	170.1	0	0	0	0	108.7	P170 E171 D264 F359	P170-V262 HydrophobicContact CB-CG2 4.07Å; E171-V262 HydrophobicContact CG-CB 3.68Å; E171-V262 HydrophobicContact CG-CG2 3.81Å; E171-V262 PolarHBondContact OE1-N 3.49Å; V262-D264 WeakPolarHBondContact O-CB 3.32Å; V262-D264 PolarHBondContact O-N 2.96Å; V262-F359 HydrophobicContact CG1-CD2 3.62Å; V262-F359 HydrophobicContact CG1-CE1 4.32Å; V262-F359 HydrophobicContact CG1-CE2 3.32Å; V262-F359 HydrophobicContact CG1-CG 4.25Å; V262-F359 HydrophobicContact CG1-CZ 3.71Å
263	N	91	Very high	94.3	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.011	22%	0.223	C	C	.	.	S	Bend	trans	-66	99.2	175.1	-165.4	-32.5	0	0	0	110.8	D297 N301 N352 H354 F365	N263-D297 VanDerWaalsContact CA-OD2 3.26Å; N263-D297 WeakPolarHBondContact CA-OD2 3.22Å; N263-N301 HydrophobicContact CB-CB 3.93Å; N263-N301 PolarHBondContact N-ND2 2.94Å; N263-N352 WeakPolarHBondContact ND2-CB 3.38Å; N263-H354 PolarHBondContact ND2-O 2.78Å; N263-F365 WeakPolarHBondContact O-CE1 3.35Å; N263-F365 WeakPolarHBondContact OD1-CD1 3.39Å; N263-F365 WeakPolarHBondContact OD1-CE1 3.43Å
264	D	88.4	Confident	94.3	Very high	23 Å²	23	42.6 Å²	42.6	12%	0.123	23%	0.228	C	C	.	.			trans	-132	-27.9	-167.8	157.2	-73	0	0	0	110.2	N226 V262 D297 L362	N226-D264 PolarHBondContact ND2-OD1 2.63Å; V262-D264 WeakPolarHBondContact O-CB 3.32Å; V262-D264 PolarHBondContact O-N 2.96Å; D264-D297 PolarHBondContact N-OD2 2.82Å; D264-L362 HydrophobicContact CB-CD1 4.27Å
265	N	89.4	Confident	94.2	Very high	47 Å²	47	47.7 Å²	47.7	25%	0.251	25%	0.25	S	C	.	.	S	Bend	trans	-107.7	127.1	175.6	-61.6	-85.9	0	0	0	112.7	A296 D297	N265-A296 HydrophobicContact CB-CB 3.97Å; N265-D297 VanDerWaalsContact CB-OD1 3.22Å; N265-D297 WeakPolarHBondContact CB-OD1 3.28Å; N265-D297 PolarHBondContact N-OD1 2.97Å; N265-D297 PolarHBondContact N-OD2 3.37Å; N265-D297 PolarHBondContact ND2-OD1 2.87Å
266	P	91.3	Very high	94.2	Very high	24 Å²	24	48.9 Å²	48.9	16%	0.156	26%	0.256	C	S	.	.			trans	-78.2	147.7	170	30.5	-34.7	0	0	0	111.9	R268	P266-R268 VanDerWaalsContact CG-CZ 3.49Å; P266-R268 PolarHBondContact O-N 2.91Å
267	P	94.7	Very high	94.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.			trans	-64.9	133.7	177.6	28	-36.7	0	0	0	109.9	A293 D295 V304 A350 N352 D367	P267-A293 HydrophobicContact CB-CB 3.85Å; P267-D295 HydrophobicContact CB-CB 4.46Å; P267-D295 WeakPolarHBondContact CD-OD2 3.22Å; P267-V304 HydrophobicContact CB-CG1 4.22Å; P267-V304 HydrophobicContact CB-CG2 3.75Å; P267-V304 HydrophobicContact CG-CG1 4.28Å; P267-V304 HydrophobicContact CG-CG2 4.25Å; P267-A350 HydrophobicContact CG-CB 4.33Å; P267-N352 WeakPolarHBondContact CD-OD1 3.42Å; P267-D367 WeakPolarHBondContact O-CB 3.17Å
268	R	94.7	Very high	94.1	Very high	117 Å²	117	54.6 Å²	54.6	44%	0.442	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-115.9	132.8	-177	-64.3	-53.1	-172.4	-169	-5.8	112.8	P266 A293 T294	P266-R268 VanDerWaalsContact CG-CZ 3.49Å; P266-R268 PolarHBondContact O-N 2.91Å; R268-A293 CarbonylContact O-C 3.59Å; R268-A293 VanDerWaalsContact O-CA 3.25Å; R268-A293 WeakPolarHBondContact O-CA 3.37Å; R268-T294 PolarHBondContact N-O 3.19Å; R268-T294 PolarHBondContact O-N 2.84Å; R268-T294 PolarHBondContact O-OG1 3.22Å
269	F	95.8	Very high	94	Very high	13 Å²	13	56 Å²	56	6%	0.057	28%	0.279	C	S	.	.			trans	-77.9	127.1	169.5	-72.8	-74.2	0	0	0	110.4	Q271 V291 A293 Y306 V348 A350 D367 T369	F269-Q271 PolarHBondContact O-N 3.43Å; F269-Q271 VanDerWaalsContact O-N 3.16Å; F269-V291 HydrophobicContact CE1-CB 4.14Å; F269-V291 HydrophobicContact CE1-CG2 4.15Å; F269-A293 HydrophobicContact CD1-CB 4.09Å; F269-A293 HydrophobicContact CE1-CB 4.08Å; F269-A293 HydrophobicContact CG-CB 4.37Å; F269-A293 HydrophobicContact CZ-CB 4.35Å; F269-Y306 HydrophobicContact CE1-CD1 4.35Å; F269-Y306 AromaticContact CE1-CE1 3.92Å; F269-Y306 HydrophobicContact CE1-CE1 3.92Å; F269-Y306 HydrophobicContact CZ-CD1 4.05Å; F269-Y306 AromaticContact CZ-CE1 3.96Å; F269-Y306 HydrophobicContact CZ-CE1 3.96Å; F269-V348 HydrophobicContact CZ-CG1 4.35Å; F269-A350 HydrophobicContact CE2-CB 3.61Å; F269-A350 HydrophobicContact CZ-CB 3.56Å; F269-D367 HydrophobicContact CD2-CB 4.2Å; F269-D367 PolarHBondContact N-OD2 2.76Å; F269-T369 HydrophobicContact CD1-CG2 3.62Å; F269-T369 HydrophobicContact CD2-CG2 3.92Å; F269-T369 HydrophobicContact CE1-CG2 3.61Å; F269-T369 HydrophobicContact CE2-CG2 3.9Å; F269-T369 HydrophobicContact CG-CG2 3.77Å; F269-T369 HydrophobicContact CZ-CG2 3.74Å
270	P	93.4	Very high	94	Very high	100 Å²	100	56.5 Å²	56.5	65%	0.649	28%	0.281	S	S	*	.	S	Bend	trans	-70.7	-8.9	177.1	30.1	-35.7	0	0	0	113	K292	P270-K292 VanDerWaalsContact CD-O 3.24Å; P270-K292 WeakPolarHBondContact CD-O 3.37Å
271	Q	93.2	Very high	94	Very high	118 Å²	118	57.6 Å²	57.6	55%	0.551	29%	0.291	S	S	*	.			trans	-141.9	124.8	177.3	-65	-175.7	-11.4	0	0	110.8	F269 T273 I274 T369	F269-Q271 PolarHBondContact O-N 3.43Å; F269-Q271 VanDerWaalsContact O-N 3.16Å; Q271-T273 PolarHBondContact O-N 3.14Å; Q271-I274 HydrophobicContact CB-CG1 4.34Å; Q271-T369 PolarHBondContact O-OG1 3.28Å
272	N	93.2	Very high	94	Very high	135 Å²	135	57 Å²	57	72%	0.722	29%	0.289	S	S	*	.	S	Bend	trans	-68.8	-12	176.6	-53.3	43.4	0	0	0	113.4	T369 I370	N272-T369 VanDerWaalsContact C-OG1 3.24Å; N272-T369 PolarHBondContact O-OG1 3.47Å; N272-I370 PolarHBondContact O-N 2.73Å
273	T	95.9	Very high	94.3	Very high	46 Å²	46	61 Å²	61	28%	0.282	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	126.8	174.8	-61	0	0	0	0	110	Q271 I370 K372	Q271-T273 PolarHBondContact O-N 3.14Å; T273-I370 CarbonylContact C-O 3.47Å; T273-I370 WeakPolarHBondContact CA-O 3.45Å; T273-I370 WeakPolarHBondContact CG2-O 3.49Å; T273-K372 HydrophobicContact CG2-CD 3.9Å; T273-K372 HydrophobicContact CG2-CG 4.33Å
274	I	95.6	Very high	94.5	Very high	24 Å²	24	65 Å²	65	12%	0.123	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.4	179.2	-62.2	172.8	0	0	0	108.1	Q271 L276 V291 T369 I370 V371 K372	Q271-I274 HydrophobicContact CB-CG1 4.34Å; I274-L276 HydrophobicContact CG2-CD2 4.29Å; I274-L276 HydrophobicContact CG2-CG 4.34Å; I274-V291 HydrophobicContact CD1-CB 3.97Å; I274-V291 HydrophobicContact CD1-CG1 3.66Å; I274-T369 HydrophobicContact CD1-CG2 4.06Å; I274-I370 PolarHBondContact N-O 2.75Å; I274-V371 WeakPolarHBondContact O-CA 3.28Å; I274-K372 PolarHBondContact O-N 3.46Å
275	H	96.6	Very high	94.8	Very high	136 Å²	136	66.4 Å²	66.4	63%	0.63	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.8	-178.8	-76.8	-93.3	0	0	0	110.6	K372	H275-K372 WeakPolarHBondContact CA-O 3.39Å
276	L	96.4	Very high	95	Very high	24 Å²	24	66.3 Å²	66.3	13%	0.126	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	157.9	179.7	-62	-178.3	0	0	0	111.1	I274 I288 I330 V371 K372 I373 S374	I274-L276 HydrophobicContact CG2-CD2 4.29Å; I274-L276 HydrophobicContact CG2-CG 4.34Å; L276-I288 HydrophobicContact CB-CG2 3.94Å; L276-I288 HydrophobicContact CD1-CG2 4.17Å; L276-I330 HydrophobicContact CD1-CD1 4.19Å; L276-V371 HydrophobicContact CD1-CG1 3.7Å; L276-V371 HydrophobicContact CG-CG1 4.02Å; L276-K372 PolarHBondContact N-O 2.88Å; L276-I373 HydrophobicContact CB-CG1 4.35Å; L276-S374 PolarHBondContact O-N 2.91Å; L276-S374 PolarHBondContact O-OG 3.12Å
277	R	96.3	Very high	95.3	Very high	174 Å²	174	68.2 Å²	68.2	66%	0.657	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	142	-179.8	-74	165.3	176.9	-124	-0.8	110.1	S374 E376	R277-S374 WeakPolarHBondContact CA-O 3.15Å; R277-S374 WeakPolarHBondContact CG-OG 3.05Å; R277-E376 HydrophobicContact CB-CG 4.48Å; R277-E376 VanDerWaalsContact CD-OE1 3.25Å; R277-E376 WeakPolarHBondContact CD-OE1 3.48Å; R277-E376 IonicContact CZ-OE1 2.97Å; R277-E376 IonicContact NE-OE1 3.51Å; R277-E376 IonicContact NH1-OE1 2.7Å; R277-E376 PolarHBondContact NH1-OE1 2.94Å
278	V	96.5	Very high	95.2	Very high	8 Å²	8	69.4 Å²	69.4	5%	0.048	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	136.2	177.8	65.4	0	0	0	0	109.3	S282 I288 V332 L336 I373 S374 I375 E376	V278-S282 WeakPolarHBondContact CG2-OG 3.26Å; V278-I288 HydrophobicContact CB-CD1 4.2Å; V278-I288 HydrophobicContact CB-CG1 4.2Å; V278-I288 HydrophobicContact CB-CG2 3.98Å; V278-I288 HydrophobicContact CG1-CD1 4.35Å; V278-I288 HydrophobicContact CG2-CD1 4.1Å; V278-I288 HydrophobicContact CG2-CG1 3.93Å; V278-V332 HydrophobicContact CG2-CG2 4.11Å; V278-L336 HydrophobicContact CB-CD1 4.4Å; V278-L336 HydrophobicContact CG1-CD1 3.56Å; V278-L336 HydrophobicContact CG2-CD1 3.9Å; V278-I373 HydrophobicContact CG1-CG2 3.66Å; V278-S374 PolarHBondContact N-O 2.86Å; V278-I375 HydrophobicContact CG1-CG1 3.88Å; V278-I375 CarbonylContact O-C 3.58Å; V278-I375 WeakPolarHBondContact O-CA 3.2Å; V278-E376 PolarHBondContact O-N 3.44Å
279	L	96.4	Very high	95.1	Very high	84 Å²	84	64.9 Å²	64.9	44%	0.44	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	140.7	171.3	-63.3	167.9	0	0	0	108.8	S281 S282 E376 V378	L279-S281 VanDerWaalsContact C-N 3.26Å; L279-S281 PolarHBondContact O-N 3Å; L279-S282 WeakPolarHBondContact O-CB 3.44Å; L279-S282 PolarHBondContact O-N 2.9Å; L279-S282 PolarHBondContact O-OG 3Å; L279-E376 WeakPolarHBondContact CA-O 3.2Å; L279-E376 HydrophobicContact CD2-CB 3.99Å; L279-V378 HydrophobicContact CB-CG2 4.06Å; L279-V378 HydrophobicContact CD2-CG2 3.73Å; L279-V378 HydrophobicContact CG-CG2 4.41Å
280	E	95.6	Very high	95.1	Very high	16 Å²	16	66.5 Å²	66.5	8%	0.075	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-34.7	179.9	69.9	-163.3	112.2	0	0	113.5	S282 L336 Y338 I375 E376 D377 V378	E280-S282 PolarHBondContact O-N 3.05Å; E280-L336 HydrophobicContact CB-CB 4.19Å; E280-Y338 VanDerWaalsContact CD-CB 3.43Å; E280-Y338 VanDerWaalsContact OE1-CB 3.27Å; E280-Y338 WeakPolarHBondContact OE1-CB 3.48Å; E280-Y338 WeakPolarHBondContact OE2-CB 3.32Å; E280-Y338 PolarHBondContact OE2-N 2.9Å; E280-I375 HydrophobicContact CB-CG2 3.71Å; E280-E376 PolarHBondContact N-O 3.34Å; E280-E376 VanDerWaalsContact N-O 3.15Å; E280-D377 WeakPolarHBondContact OE1-CA 3.22Å; E280-V378 HydrophobicContact CG-CB 4.34Å; E280-V378 HydrophobicContact CG-CG2 4.43Å; E280-V378 PolarHBondContact OE1-N 2.73Å
281	S	94.3	Very high	95.2	Very high	76 Å²	76	61.8 Å²	61.8	53%	0.531	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	5.6	174.3	53.6	0	0	0	0	114.5	L279	L279-S281 VanDerWaalsContact C-N 3.26Å; L279-S281 PolarHBondContact O-N 3Å
282	S	95	Very high	95.3	Very high	21 Å²	21	60.2 Å²	60.2	15%	0.147	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-66.1	121.9	174.6	-60.6	0	0	0	0	111.1	V278 L279 E280	V278-S282 WeakPolarHBondContact CG2-OG 3.26Å; L279-S282 WeakPolarHBondContact O-CB 3.44Å; L279-S282 PolarHBondContact O-N 2.9Å; L279-S282 PolarHBondContact O-OG 3Å; E280-S282 PolarHBondContact O-N 3.05Å
283	P	95.7	Very high	95.4	Very high	92 Å²	92	54 Å²	54	60%	0.597	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-66.3	152.6	-178.6	25.4	-33	0	0	0	112.3	G285 T286	P283-G285 PolarHBondContact O-N 2.86Å; P283-T286 VanDerWaalsContact CD-OG1 3.3Å; P283-T286 WeakPolarHBondContact CD-OG1 3.4Å; P283-T286 WeakPolarHBondContact CG-OG1 3.39Å; P283-T286 VanDerWaalsContact O-CB 3.25Å; P283-T286 WeakPolarHBondContact O-CB 3.47Å; P283-T286 PolarHBondContact O-N 2.81Å; P283-T286 PolarHBondContact O-OG1 3.24Å
284	V	95.7	Very high	95.3	Very high	86 Å²	86	55.8 Å²	55.8	52%	0.521	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	131.7	173.2	178	0	0	0	0	110	P335	V284-P335 HydrophobicContact CG2-CG 4.24Å
285	G	94.2	Very high	95.2	Very high	54 Å²	54	56.4 Å²	56.4	56%	0.557	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-7.8	-170.9	0	0	0	0	0	114.8	P283 A287 V332	P283-G285 PolarHBondContact O-N 2.86Å; G285-A287 PolarHBondContact O-N 2.8Å; G285-V332 PolarHBondContact N-O 3.28Å
286	T	95.4	Very high	95	Very high	45 Å²	45	52.2 Å²	52.2	28%	0.276	32%	0.319	S	S	.	.			trans	-64.1	128.8	176	-59.5	0	0	0	0	111	P283 T331 V332	P283-T286 VanDerWaalsContact CD-OG1 3.3Å; P283-T286 WeakPolarHBondContact CD-OG1 3.4Å; P283-T286 WeakPolarHBondContact CG-OG1 3.39Å; P283-T286 VanDerWaalsContact O-CB 3.25Å; P283-T286 WeakPolarHBondContact O-CB 3.47Å; P283-T286 PolarHBondContact O-N 2.81Å; P283-T286 PolarHBondContact O-OG1 3.24Å; T286-T331 CarbonylContact O-C 3.35Å; T286-T331 VanDerWaalsContact O-CA 3.25Å; T286-T331 WeakPolarHBondContact O-CA 3.45Å; T286-V332 PolarHBondContact O-N 3.4Å
287	A	95.8	Very high	94.9	Very high	63 Å²	63	51.5 Å²	51.5	52%	0.521	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.9	170.8	0	0	0	0	0	110.5	G285 I329 T331	G285-A287 PolarHBondContact O-N 2.8Å; A287-I329 HydrophobicContact CB-CG2 3.79Å; A287-T331 HydrophobicContact CB-CG2 4.38Å
288	I	93.5	Very high	94.7	Very high	25 Å²	25	46.3 Å²	46.3	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-32.4	-174.8	-56.9	177.3	0	0	0	111	L276 V278 F317 I330 V332 I373	L276-I288 HydrophobicContact CB-CG2 3.94Å; L276-I288 HydrophobicContact CD1-CG2 4.17Å; V278-I288 HydrophobicContact CB-CD1 4.2Å; V278-I288 HydrophobicContact CB-CG1 4.2Å; V278-I288 HydrophobicContact CB-CG2 3.98Å; V278-I288 HydrophobicContact CG1-CD1 4.35Å; V278-I288 HydrophobicContact CG2-CD1 4.1Å; V278-I288 HydrophobicContact CG2-CG1 3.93Å; I288-F317 HydrophobicContact CD1-CD1 3.41Å; I288-F317 VanDerWaalsContact CD1-CD1 3.41Å; I288-F317 HydrophobicContact CD1-CE1 3.37Å; I288-I330 HydrophobicContact CD1-CG2 4.46Å; I288-I330 PolarHBondContact N-O 3.13Å; I288-V332 HydrophobicContact CD1-CG2 3.81Å; I288-V332 HydrophobicContact CG1-CG2 3.97Å; I288-I373 HydrophobicContact CD1-CD1 4.42Å; I288-I373 HydrophobicContact CD1-CG2 4.48Å
289	G	93.6	Very high	94.4	Very high	23 Å²	23	49 Å²	49	24%	0.237	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.7	172.6	-177.7	0	0	0	0	0	110.2	I330	G289-I330 PolarHBondContact O-N 3.12Å
290	S	94.2	Very high	94.1	Very high	47 Å²	47	51.1 Å²	51.1	33%	0.329	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	156.8	175.4	61.4	0	0	0	0	112.2	E327 G328	S290-E327 WeakPolarHBondContact CB-OE2 3.37Å; S290-E327 PolarHBondContact OG-OE2 3.06Å; S290-G328 CarbonylContact C-O 3.53Å; S290-G328 WeakPolarHBondContact CA-O 3.22Å
291	V	95.7	Very high	93.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.7	159.3	-59.2	0	0	0	0	109	F269 I274 Y306 I319 G328 I330 V348 V371	F269-V291 HydrophobicContact CE1-CB 4.14Å; F269-V291 HydrophobicContact CE1-CG2 4.15Å; I274-V291 HydrophobicContact CD1-CB 3.97Å; I274-V291 HydrophobicContact CD1-CG1 3.66Å; V291-Y306 HydrophobicContact CG2-CD1 3.91Å; V291-Y306 HydrophobicContact CG2-CE1 4.15Å; V291-I319 HydrophobicContact CG2-CD1 4.02Å; V291-G328 PolarHBondContact N-O 3.31Å; V291-G328 PolarHBondContact O-N 3.25Å; V291-I330 HydrophobicContact CG1-CD1 3.88Å; V291-V348 HydrophobicContact CG2-CG1 4.16Å; V291-V371 HydrophobicContact CG1-CG2 3.71Å
292	K	95.4	Very high	93.7	Very high	84 Å²	84	49 Å²	49	37%	0.365	33%	0.325	S	S	.	.			trans	-130.5	122.7	179.1	-166.6	164.7	-144.5	153.4	0	110.4	P270 T325 E327	P270-K292 VanDerWaalsContact CD-O 3.24Å; P270-K292 WeakPolarHBondContact CD-O 3.37Å; K292-T325 WeakPolarHBondContact CE-O 3.37Å; K292-T325 PolarHBondContact NZ-O 2.88Å; K292-E327 HydrophobicContact CB-CG 4.07Å; K292-E327 HydrophobicContact CD-CG 3.67Å; K292-E327 WeakPolarHBondContact CD-OE1 3.5Å; K292-E327 WeakPolarHBondContact CE-OE1 3.42Å; K292-E327 HydrophobicContact CG-CG 3.94Å; K292-E327 IonicContact NZ-OE1 3.8Å; K292-E327 PolarHBondContact NZ-OE1 3.04Å
293	A	95.2	Very high	93.6	Very high	6 Å²	6	51.6 Å²	51.6	5%	0.05	33%	0.334	C	S	.	.			trans	-91.1	149.9	159.2	0	0	0	0	0	108.8	P267 R268 F269 Y306 A350	P267-A293 HydrophobicContact CB-CB 3.85Å; R268-A293 CarbonylContact O-C 3.59Å; R268-A293 VanDerWaalsContact O-CA 3.25Å; R268-A293 WeakPolarHBondContact O-CA 3.37Å; F269-A293 HydrophobicContact CD1-CB 4.09Å; F269-A293 HydrophobicContact CE1-CB 4.08Å; F269-A293 HydrophobicContact CG-CB 4.37Å; F269-A293 HydrophobicContact CZ-CB 4.35Å; A293-Y306 HydrophobicContact CB-CE1 4.16Å; A293-Y306 PolarHBondContact N-OH 3.15Å; A293-A350 HydrophobicContact CB-CB 3.9Å
294	T	93.8	Very high	93.5	Very high	82 Å²	82	47.5 Å²	47.5	50%	0.503	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-106.7	124.5	172.9	52.7	0	0	0	0	109	R268	R268-T294 PolarHBondContact N-O 3.19Å; R268-T294 PolarHBondContact O-N 2.84Å; R268-T294 PolarHBondContact O-OG1 3.22Å
295	D	93.9	Very high	93.5	Very high	37 Å²	37	46.8 Å²	46.8	20%	0.198	30%	0.299	C	S	.	.			trans	-100.5	160.9	169	-150.1	-60.1	0	0	0	109.7	P267 D297 A302 N352	P267-D295 HydrophobicContact CB-CB 4.46Å; P267-D295 WeakPolarHBondContact CD-OD2 3.22Å; D295-D297 PolarHBondContact OD1-N 2.97Å; D295-A302 HydrophobicContact CB-CB 3.85Å; D295-N352 PolarHBondContact OD2-ND2 3.43Å
296	A	92.8	Very high	93.6	Very high	48 Å²	48	44.4 Å²	44.4	40%	0.397	27%	0.273	S	S	.	.			trans	-109	-20.4	179	0	0	0	0	0	113	R227 E228 N265	R227-A296 PolarHBondContact NH2-O 3.37Å; E228-A296 HydrophobicContact CG-CB 4Å; N265-A296 HydrophobicContact CB-CB 3.97Å
297	D	93.5	Very high	93.6	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.048	28%	0.278	C	S	.	.	S	Bend	trans	-71.4	-177.9	179	-61.3	-2.4	0	0	0	110.6	N263 D264 N265 D295 N301 A302	N263-D297 VanDerWaalsContact CA-OD2 3.26Å; N263-D297 WeakPolarHBondContact CA-OD2 3.22Å; D264-D297 PolarHBondContact N-OD2 2.82Å; N265-D297 VanDerWaalsContact CB-OD1 3.22Å; N265-D297 WeakPolarHBondContact CB-OD1 3.28Å; N265-D297 PolarHBondContact N-OD1 2.97Å; N265-D297 PolarHBondContact N-OD2 3.37Å; N265-D297 PolarHBondContact ND2-OD1 2.87Å; D295-D297 PolarHBondContact OD1-N 2.97Å; D297-N301 HydrophobicContact CB-CB 3.83Å; D297-A302 HydrophobicContact CB-CB 4.26Å; D297-A302 WeakPolarHBondContact O-CB 3.4Å
298	T	92.1	Very high	93.6	Very high	66 Å²	66	45.9 Å²	45.9	41%	0.405	26%	0.262	S	S	.	.			trans	-133.8	161	-178.1	62.1	0	0	0	0	114.9	D261 K300 N301	D261-T298 WeakPolarHBondContact OD1-CA 3.29Å; D261-T298 WeakPolarHBondContact OD1-CB 3.35Å; D261-T298 PolarHBondContact OD1-N 2.9Å; D261-T298 PolarHBondContact OD1-OG1 2.9Å; D261-T298 PolarHBondContact OD2-N 3.37Å; D261-T298 VanDerWaalsContact OD2-N 3.1Å; T298-K300 PolarHBondContact O-N 2.76Å; T298-K300 VanDerWaalsContact O-N 3.13Å; T298-N301 PolarHBondContact O-N 2.84Å
299	G	89.8	Confident	93.7	Very high	64 Å²	64	48 Å²	48	66%	0.66	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	-118	-178.8	0	0	0	0	0	111.7
300	K	90.9	Very high	93.8	Very high	128 Å²	128	52 Å²	52	56%	0.557	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-21	-174.2	-66.9	-167.7	171.2	-168.9	0	114.9	T298 E303 H354	T298-K300 PolarHBondContact O-N 2.76Å; T298-K300 VanDerWaalsContact O-N 3.13Å; K300-E303 WeakPolarHBondContact O-CB 3.46Å; K300-E303 PolarHBondContact O-N 2.89Å; K300-H354 PolarHBondContact O-ND1 2.88Å; K300-H354 VanDerWaalsContact O-ND1 3.15Å
301	N	90.1	Very high	93.7	Very high	29 Å²	29	50.9 Å²	50.9	16%	0.155	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-43.4	-178	-64.1	-20.8	0	0	0	109.2	D261 N263 D297 T298 E303 N352	D261-N301 PolarHBondContact O-ND2 2.91Å; D261-N301 WeakPolarHBondContact OD2-CB 3.41Å; D261-N301 PolarHBondContact OD2-ND2 2.85Å; N263-N301 HydrophobicContact CB-CB 3.93Å; N263-N301 PolarHBondContact N-ND2 2.94Å; D297-N301 HydrophobicContact CB-CB 3.83Å; T298-N301 PolarHBondContact O-N 2.84Å; N301-E303 VanDerWaalsContact C-N 3.25Å; N301-E303 PolarHBondContact O-N 3.37Å; N301-N352 PolarHBondContact O-ND2 2.9Å
302	A	91.5	Very high	93.7	Very high	20 Å²	20	53.7 Å²	53.7	17%	0.165	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	11.7	169.8	0	0	0	0	0	115.8	D295 D297 V304	D295-A302 HydrophobicContact CB-CB 3.85Å; D297-A302 HydrophobicContact CB-CB 4.26Å; D297-A302 WeakPolarHBondContact O-CB 3.4Å; A302-V304 PolarHBondContact O-N 2.87Å
303	E	92.8	Very high	93.4	Very high	74 Å²	74	49.7 Å²	49.7	35%	0.346	28%	0.282	S	S	.	.			trans	-77.7	107.6	170	-81.8	178.9	-150.3	0	0	109.7	K300 N301 T353 H354	K300-E303 WeakPolarHBondContact O-CB 3.46Å; K300-E303 PolarHBondContact O-N 2.89Å; N301-E303 VanDerWaalsContact C-N 3.25Å; N301-E303 PolarHBondContact O-N 3.37Å; E303-T353 WeakPolarHBondContact CB-OG1 3.49Å; E303-T353 WeakPolarHBondContact O-CB 3.44Å; E303-T353 WeakPolarHBondContact O-CG2 3.36Å; E303-T353 PolarHBondContact O-N 2.97Å; E303-T353 PolarHBondContact O-OG1 3.28Å; E303-H354 IonicContact OE2-CE1 3.93Å; E303-H354 IonicContact OE2-ND1 2.86Å
304	V	93.6	Very high	93.3	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	133.7	-174	-178	0	0	0	0	111.2	P267 A302 Y306 T321 A350	P267-V304 HydrophobicContact CB-CG1 4.22Å; P267-V304 HydrophobicContact CB-CG2 3.75Å; P267-V304 HydrophobicContact CG-CG1 4.28Å; P267-V304 HydrophobicContact CG-CG2 4.25Å; A302-V304 PolarHBondContact O-N 2.87Å; V304-Y306 HydrophobicContact CB-CE2 4.31Å; V304-Y306 HydrophobicContact CG1-CD2 4.32Å; V304-Y306 HydrophobicContact CG1-CE1 4.16Å; V304-Y306 HydrophobicContact CG1-CE2 3.9Å; V304-T321 WeakPolarHBondContact O-CG2 3.34Å; V304-A350 HydrophobicContact CG1-CB 3.73Å
305	E	94.6	Very high	93.3	Very high	71 Å²	71	53.4 Å²	53.4	33%	0.332	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.6	166.9	-165.4	-172.2	147.1	0	0	111	R307 A350 E351 T353	E305-R307 IonicContact OE1-CZ 3.1Å; E305-R307 VanDerWaalsContact OE1-CZ 3.22Å; E305-R307 IonicContact OE1-NE 2.67Å; E305-R307 PolarHBondContact OE1-NE 2.82Å; E305-R307 IonicContact OE1-NH2 3.7Å; E305-R307 PolarHBondContact OE1-NH2 3.36Å; E305-R307 IonicContact OE2-CZ 3.72Å; E305-R307 IonicContact OE2-NE 3.17Å; E305-R307 IonicContact OE2-NH2 3.44Å; E305-R307 PolarHBondContact OE2-NH2 3.08Å; E305-A350 WeakPolarHBondContact O-CA 3.34Å; E305-E351 PolarHBondContact N-O 3.01Å; E305-E351 PolarHBondContact O-N 2.88Å; E305-T353 HydrophobicContact CB-CG2 3.94Å
306	Y	96.6	Very high	93.3	Very high	5 Å²	5	53.2 Å²	53.2	2%	0.02	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.4	176.8	-59.8	-90.5	0	0	0	112.1	F269 V291 A293 V304 T321 Q326 G328 V348 E349 A350	F269-Y306 HydrophobicContact CE1-CD1 4.35Å; F269-Y306 AromaticContact CE1-CE1 3.92Å; F269-Y306 HydrophobicContact CE1-CE1 3.92Å; F269-Y306 HydrophobicContact CZ-CD1 4.05Å; F269-Y306 AromaticContact CZ-CE1 3.96Å; F269-Y306 HydrophobicContact CZ-CE1 3.96Å; V291-Y306 HydrophobicContact CG2-CD1 3.91Å; V291-Y306 HydrophobicContact CG2-CE1 4.15Å; A293-Y306 HydrophobicContact CB-CE1 4.16Å; A293-Y306 PolarHBondContact N-OH 3.15Å; V304-Y306 HydrophobicContact CB-CE2 4.31Å; V304-Y306 HydrophobicContact CG1-CD2 4.32Å; V304-Y306 HydrophobicContact CG1-CE1 4.16Å; V304-Y306 HydrophobicContact CG1-CE2 3.9Å; Y306-T321 HydrophobicContact CD2-CG2 4.07Å; Y306-T321 HydrophobicContact CE2-CG2 4.45Å; Y306-T321 PolarHBondContact N-OG1 3.4Å; Y306-Q326 WeakPolarHBondContact CE2-O 3.29Å; Y306-Q326 PolarHBondContact OH-O 2.84Å; Y306-G328 VanDerWaalsContact CE2-N 3.31Å; Y306-V348 HydrophobicContact CD1-CG1 4.44Å; Y306-E349 WeakPolarHBondContact CA-O 3.48Å; Y306-A350 HydrophobicContact CD1-CB 3.82Å; Y306-A350 HydrophobicContact CE1-CB 3.8Å
307	R	96	Very high	93.5	Very high	102 Å²	102	50.9 Å²	50.9	39%	0.385	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	141.3	178.2	-61.1	-177	-173.9	134.1	4.2	111.9	E305 I309 V348 E349 E351	E305-R307 IonicContact OE1-CZ 3.1Å; E305-R307 VanDerWaalsContact OE1-CZ 3.22Å; E305-R307 IonicContact OE1-NE 2.67Å; E305-R307 PolarHBondContact OE1-NE 2.82Å; E305-R307 IonicContact OE1-NH2 3.7Å; E305-R307 PolarHBondContact OE1-NH2 3.36Å; E305-R307 IonicContact OE2-CZ 3.72Å; E305-R307 IonicContact OE2-NE 3.17Å; E305-R307 IonicContact OE2-NH2 3.44Å; E305-R307 PolarHBondContact OE2-NH2 3.08Å; R307-I309 HydrophobicContact CB-CG2 4.4Å; R307-I309 PolarHBondContact O-N 3.46Å; R307-V348 WeakPolarHBondContact O-CA 3.43Å; R307-E349 PolarHBondContact N-O 2.89Å; R307-E349 PolarHBondContact O-N 3.37Å; R307-E351 IonicContact CZ-OE2 2.68Å; R307-E351 IonicContact NH1-OE2 2.69Å; R307-E351 PolarHBondContact NH1-OE2 2.83Å
308	I	96.6	Very high	93.7	Very high	36 Å²	36	53.5 Å²	53.5	19%	0.185	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	115.8	167.3	-55	166.2	0	0	0	107.4	T314 I319 L346 V348	I308-T314 HydrophobicContact CG2-CG2 3.68Å; I308-I319 HydrophobicContact CD1-CB 4.25Å; I308-I319 HydrophobicContact CD1-CG2 4.32Å; I308-I319 HydrophobicContact CG1-CB 4.09Å; I308-I319 HydrophobicContact CG1-CG2 3.82Å; I308-L346 HydrophobicContact CD1-CD1 4.01Å; I308-L346 HydrophobicContact CG1-CD1 4.46Å; I308-L346 HydrophobicContact CG2-CB 4.31Å; I308-L346 HydrophobicContact CG2-CD2 4.15Å; I308-V348 HydrophobicContact CG1-CG2 4.37Å
309	I	95.3	Very high	93.9	Very high	71 Å²	71	51.3 Å²	51.3	36%	0.364	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-22.4	-173.6	55.6	159.3	0	0	0	114.2	R307 K347 E349 T368	R307-I309 HydrophobicContact CB-CG2 4.4Å; R307-I309 PolarHBondContact O-N 3.46Å; I309-K347 HydrophobicContact CD1-CD 3.72Å; I309-K347 HydrophobicContact CD1-CG 4.12Å; I309-K347 HydrophobicContact CG1-CB 4.24Å; I309-K347 HydrophobicContact CG1-CD 4.07Å; I309-K347 HydrophobicContact CG1-CG 4.08Å; I309-K347 WeakPolarHBondContact CG1-O 3.33Å; I309-K347 PolarHBondContact N-O 3.44Å; I309-E349 HydrophobicContact CD1-CB 3.95Å; I309-E349 HydrophobicContact CG1-CB 4.09Å; I309-E349 HydrophobicContact CG2-CB 3.65Å; I309-T368 HydrophobicContact CD1-CG2 3.99Å
310	D	94.3	Very high	94.2	Very high	107 Å²	107	52.3 Å²	52.3	57%	0.572	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-159.5	167	-179.4	-171.1	14.3	0	0	0	109.1	K347	D310-K347 HydrophobicContact CB-CB 4.02Å; D310-K347 HydrophobicContact CB-CD 4.41Å; D310-K347 PolarHBondContact O-N 3.07Å
311	G	93.6	Very high	94.4	Very high	22 Å²	22	48 Å²	48	23%	0.227	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.6	162.4	175.2	0	0	0	0	0	114.6	G313 T314 T345	G311-G313 VanDerWaalsContact C-N 3.31Å; G311-G313 PolarHBondContact O-N 2.64Å; G311-T314 VanDerWaalsContact O-CG2 3.26Å; G311-T314 WeakPolarHBondContact O-CG2 3.43Å; G311-T314 PolarHBondContact O-OG1 3.22Å; G311-T345 CarbonylContact C-O 3.59Å; G311-T345 WeakPolarHBondContact CA-O 3.2Å
312	D	94.1	Very high	94.5	Very high	61 Å²	61	50.8 Å²	50.8	33%	0.326	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-8.1	-172	64.1	11	0	0	0	114.5	R341 Y344 T345	D312-R341 IonicContact OD2-CZ 2.83Å; D312-R341 IonicContact OD2-NE 2.77Å; D312-R341 IonicContact OD2-NH2 3.03Å; D312-R341 PolarHBondContact OD2-NH2 2.8Å; D312-Y344 VanDerWaalsContact OD1-CA 3.31Å; D312-Y344 WeakPolarHBondContact OD1-CA 3.25Å; D312-T345 PolarHBondContact N-O 3.01Å; D312-T345 VanDerWaalsContact N-O 3.1Å; D312-T345 PolarHBondContact OD1-N 2.83Å
313	G	90.5	Very high	94.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	8.3	175.7	0	0	0	0	0	114.3	G311 D315 M316 F317	G311-G313 VanDerWaalsContact C-N 3.31Å; G311-G313 PolarHBondContact O-N 2.64Å; G313-D315 PolarHBondContact O-N 3.15Å; G313-D315 VanDerWaalsContact O-N 3.07Å; G313-M316 PolarHBondContact O-N 2.83Å; G313-F317 WeakPolarHBondContact O-CD2 3.22Å; G313-F317 PolarHBondContact O-N 2.84Å
314	T	92.5	Very high	94.3	Very high	62 Å²	62	62.3 Å²	62.3	38%	0.38	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-30.5	176.4	38.2	0	0	0	0	113.7	I308 G311	I308-T314 HydrophobicContact CG2-CG2 3.68Å; G311-T314 VanDerWaalsContact O-CG2 3.26Å; G311-T314 WeakPolarHBondContact O-CG2 3.43Å; G311-T314 PolarHBondContact O-OG1 3.22Å
315	D	93.7	Very high	94.2	Very high	104 Å²	104	64.4 Å²	64.4	56%	0.556	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-11.6	179	-124.3	-29.6	0	0	0	113.6	G313 K334	G313-D315 PolarHBondContact O-N 3.15Å; G313-D315 VanDerWaalsContact O-N 3.07Å; D315-K334 WeakPolarHBondContact O-CD 3.3Å; D315-K334 WeakPolarHBondContact O-CE 3.34Å; D315-K334 PolarHBondContact O-NZ 3.34Å; D315-K334 IonicContact OD1-NZ 3.75Å; D315-K334 PolarHBondContact OD1-NZ 2.93Å; D315-K334 IonicContact OD2-NZ 3.24Å
316	M	95.3	Very high	94.1	Very high	32 Å²	32	63.5 Å²	63.5	16%	0.158	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-22.3	-169.8	-59.5	-59.8	-65.7	0	0	113.5	G313 K333 K334 P335 L336 Y344	G313-M316 PolarHBondContact O-N 2.83Å; M316-K333 WeakPolarHBondContact O-CA 3.47Å; M316-K333 VanDerWaalsContact O-CB 3.31Å; M316-K333 WeakPolarHBondContact O-CB 3.25Å; M316-K333 PolarHBondContact O-N 3.35Å; M316-K334 HydrophobicContact CE-CB 3.94Å; M316-K334 PolarHBondContact O-N 2.92Å; M316-K334 HydrophobicContact SD-CB 4.06Å; M316-K334 HydrophobicContact SD-CD 3.96Å; M316-P335 WeakPolarHBondContact CE-O 3.3Å; M316-L336 HydrophobicContact CE-CD2 4.08Å; M316-Y344 HydrophobicContact CB-CE1 4.25Å; M316-Y344 HydrophobicContact CG-CE1 3.67Å
317	F	97	Very high	94	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.2	179.4	-54.8	-74.8	0	0	0	111.1	I288 G313 I330 T331 K333 L336 Y344 L346 I373	I288-F317 HydrophobicContact CD1-CD1 3.41Å; I288-F317 VanDerWaalsContact CD1-CD1 3.41Å; I288-F317 HydrophobicContact CD1-CE1 3.37Å; G313-F317 WeakPolarHBondContact O-CD2 3.22Å; G313-F317 PolarHBondContact O-N 2.84Å; F317-I330 HydrophobicContact CB-CG2 4.28Å; F317-T331 CarbonylContact C-O 3.47Å; F317-T331 VanDerWaalsContact CA-O 3.23Å; F317-T331 WeakPolarHBondContact CA-O 3.21Å; F317-K333 WeakPolarHBondContact O-CD 3.35Å; F317-L336 HydrophobicContact CE1-CD1 4.22Å; F317-L336 HydrophobicContact CE1-CD2 3.96Å; F317-L336 HydrophobicContact CZ-CD1 4.49Å; F317-L336 HydrophobicContact CZ-CD2 3.87Å; F317-Y344 HydrophobicContact CE2-CD1 4.12Å; F317-Y344 AromaticContact CE2-CD2 3.83Å; F317-Y344 HydrophobicContact CE2-CD2 3.83Å; F317-Y344 HydrophobicContact CE2-CE2 4.43Å; F317-Y344 AromaticContact CE2-CG 3.64Å; F317-Y344 HydrophobicContact CE2-CG 3.64Å; F317-Y344 HydrophobicContact CZ-CD2 4.04Å; F317-Y344 HydrophobicContact CZ-CG 4.31Å; F317-L346 HydrophobicContact CB-CD1 4.06Å; F317-L346 HydrophobicContact CD2-CD1 4.19Å; F317-L346 HydrophobicContact CD2-CD2 4.25Å; F317-L346 HydrophobicContact CG-CD1 4.34Å; F317-I373 HydrophobicContact CD1-CD1 3.93Å; F317-I373 HydrophobicContact CD2-CD1 3.78Å; F317-I373 HydrophobicContact CE1-CD1 3.99Å; F317-I373 HydrophobicContact CE1-CG2 4.23Å; F317-I373 HydrophobicContact CE2-CD1 3.84Å; F317-I373 HydrophobicContact CG-CD1 3.83Å; F317-I373 HydrophobicContact CZ-CB 4.42Å; F317-I373 HydrophobicContact CZ-CD1 3.95Å; F317-I373 HydrophobicContact CZ-CG2 3.96Å
318	D	96	Very high	94	Very high	63 Å²	63	60.4 Å²	60.4	34%	0.337	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	162.6	170.4	-133	-36.2	0	0	0	110.6	I330 T331 K333	D318-I330 WeakPolarHBondContact O-CA 3.48Å; D318-T331 PolarHBondContact N-O 2.78Å; D318-T331 PolarHBondContact O-N 2.58Å; D318-T331 PolarHBondContact O-OG1 3.1Å; D318-K333 HydrophobicContact CB-CB 4.38Å; D318-K333 HydrophobicContact CB-CD 4.03Å; D318-K333 HydrophobicContact CB-CG 4.45Å; D318-K333 VanDerWaalsContact CG-NZ 3.35Å; D318-K333 IonicContact OD1-NZ 2.78Å; D318-K333 WeakPolarHBondContact OD2-CD 3.49Å; D318-K333 WeakPolarHBondContact OD2-CE 3.24Å; D318-K333 IonicContact OD2-NZ 2.81Å; D318-K333 PolarHBondContact OD2-NZ 2.96Å
319	I	97	Very high	94	Very high	20 Å²	20	60.3 Å²	60.3	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.7	176.1	-164.1	165.4	0	0	0	111	V291 I308 I329 I330 V348	V291-I319 HydrophobicContact CG2-CD1 4.02Å; I308-I319 HydrophobicContact CD1-CB 4.25Å; I308-I319 HydrophobicContact CD1-CG2 4.32Å; I308-I319 HydrophobicContact CG1-CB 4.09Å; I308-I319 HydrophobicContact CG1-CG2 3.82Å; I319-I329 WeakPolarHBondContact CA-O 3.26Å; I319-I330 HydrophobicContact CD1-CD1 4.4Å; I319-I330 HydrophobicContact CD1-CG1 3.86Å; I319-I330 HydrophobicContact CG1-CG1 4.02Å; I319-V348 HydrophobicContact CD1-CG1 3.66Å; I319-V348 HydrophobicContact CD1-CG2 4.24Å
320	V	95.1	Very high	94.1	Very high	86 Å²	86	57 Å²	57	52%	0.521	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.5	178.8	-178	0	0	0	0	109	E322 I329	V320-E322 PolarHBondContact O-N 3.19Å; V320-I329 PolarHBondContact N-O 3.19Å; V320-I329 PolarHBondContact O-N 3.29Å
321	T	95.7	Very high	94.2	Very high	38 Å²	38	53.1 Å²	53.1	23%	0.233	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	117	174.6	-59.1	0	0	0	0	109.6	V304 Y306	V304-T321 WeakPolarHBondContact O-CG2 3.34Å; Y306-T321 HydrophobicContact CD2-CG2 4.07Å; Y306-T321 HydrophobicContact CE2-CG2 4.45Å; Y306-T321 PolarHBondContact N-OG1 3.4Å
322	E	93.6	Very high	94.4	Very high	87 Å²	87	52.1 Å²	52.1	41%	0.407	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.1	174	-176.7	172.4	-108.9	0	0	110.4	V320 D324 T325 Q326 E327 I329	V320-E322 PolarHBondContact O-N 3.19Å; E322-D324 PolarHBondContact O-N 3.13Å; E322-T325 WeakPolarHBondContact CB-OG1 3.25Å; E322-T325 WeakPolarHBondContact CG-OG1 3.33Å; E322-T325 WeakPolarHBondContact OE2-CB 3.21Å; E322-T325 WeakPolarHBondContact OE2-CG2 3.48Å; E322-T325 PolarHBondContact OE2-OG1 3.41Å; E322-Q326 WeakPolarHBondContact O-CA 3.39Å; E322-Q326 PolarHBondContact O-N 2.87Å; E322-E327 PolarHBondContact N-O 2.81Å; E322-I329 HydrophobicContact CB-CD1 4.45Å; E322-I329 HydrophobicContact CB-CG1 4.05Å
323	K	89.1	Confident	94.5	Very high	175 Å²	175	53.4 Å²	53.4	76%	0.761	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-36	-169.2	-63.6	-167.8	174.8	-163.3	0	114.1	Q326	K323-Q326 PolarHBondContact O-NE2 2.66Å
324	D	89.6	Confident	94.8	Very high	160 Å²	160	57.1 Å²	57.1	86%	0.856	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-26.6	-172.7	-56.9	-32	0	0	0	112.2	E322	E322-D324 PolarHBondContact O-N 3.13Å
325	T	92.5	Very high	94.9	Very high	50 Å²	50	59 Å²	59	31%	0.307	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-18	-179.5	58.4	0	0	0	0	113.4	K292 E322 E327	K292-T325 WeakPolarHBondContact CE-O 3.37Å; K292-T325 PolarHBondContact NZ-O 2.88Å; E322-T325 WeakPolarHBondContact CB-OG1 3.25Å; E322-T325 WeakPolarHBondContact CG-OG1 3.33Å; E322-T325 WeakPolarHBondContact OE2-CB 3.21Å; E322-T325 WeakPolarHBondContact OE2-CG2 3.48Å; E322-T325 PolarHBondContact OE2-OG1 3.41Å; T325-E327 VanDerWaalsContact C-N 3.31Å; T325-E327 PolarHBondContact OG1-N 2.83Å
326	Q	92	Very high	95	Very high	52 Å²	52	54.8 Å²	54.8	24%	0.243	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	40.1	-169.3	-62	-67.2	-53.1	0	0	112.6	Y306 E322 K323	Y306-Q326 WeakPolarHBondContact CE2-O 3.29Å; Y306-Q326 PolarHBondContact OH-O 2.84Å; E322-Q326 WeakPolarHBondContact O-CA 3.39Å; E322-Q326 PolarHBondContact O-N 2.87Å; K323-Q326 PolarHBondContact O-NE2 2.66Å
327	E	95	Very high	94.9	Very high	42 Å²	42	56.9 Å²	56.9	20%	0.196	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.2	180	-65.7	-172.7	-154.4	0	0	112.5	S290 K292 E322 T325 I329	S290-E327 WeakPolarHBondContact CB-OE2 3.37Å; S290-E327 PolarHBondContact OG-OE2 3.06Å; K292-E327 HydrophobicContact CB-CG 4.07Å; K292-E327 HydrophobicContact CD-CG 3.67Å; K292-E327 WeakPolarHBondContact CD-OE1 3.5Å; K292-E327 WeakPolarHBondContact CE-OE1 3.42Å; K292-E327 HydrophobicContact CG-CG 3.94Å; K292-E327 IonicContact NZ-OE1 3.8Å; K292-E327 PolarHBondContact NZ-OE1 3.04Å; E322-E327 PolarHBondContact N-O 2.81Å; T325-E327 VanDerWaalsContact C-N 3.31Å; T325-E327 PolarHBondContact OG1-N 2.83Å; E327-I329 HydrophobicContact CB-CD1 4.18Å; E327-I329 PolarHBondContact O-N 3.28Å
328	G	95.9	Very high	94.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	100.5	173.9	0	0	0	0	0	110.4	S290 V291 Y306	S290-G328 CarbonylContact C-O 3.53Å; S290-G328 WeakPolarHBondContact CA-O 3.22Å; V291-G328 PolarHBondContact N-O 3.31Å; V291-G328 PolarHBondContact O-N 3.25Å; Y306-G328 VanDerWaalsContact CE2-N 3.31Å
329	I	96.9	Very high	94.5	Very high	35 Å²	35	58.6 Å²	58.6	18%	0.179	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.5	179.7	-48.2	-53.7	0	0	0	109.4	A287 I319 V320 E322 E327 T331	A287-I329 HydrophobicContact CB-CG2 3.79Å; I319-I329 WeakPolarHBondContact CA-O 3.26Å; V320-I329 PolarHBondContact N-O 3.19Å; V320-I329 PolarHBondContact O-N 3.29Å; E322-I329 HydrophobicContact CB-CD1 4.45Å; E322-I329 HydrophobicContact CB-CG1 4.05Å; E327-I329 HydrophobicContact CB-CD1 4.18Å; E327-I329 PolarHBondContact O-N 3.28Å; I329-T331 HydrophobicContact CG2-CG2 4.28Å
330	I	97	Very high	94.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	130.5	179.1	-61.8	175.8	0	0	0	109.5	L276 I288 G289 V291 F317 D318 I319 L346 V348 V371 I373	L276-I330 HydrophobicContact CD1-CD1 4.19Å; I288-I330 HydrophobicContact CD1-CG2 4.46Å; I288-I330 PolarHBondContact N-O 3.13Å; G289-I330 PolarHBondContact O-N 3.12Å; V291-I330 HydrophobicContact CG1-CD1 3.88Å; F317-I330 HydrophobicContact CB-CG2 4.28Å; D318-I330 WeakPolarHBondContact O-CA 3.48Å; I319-I330 HydrophobicContact CD1-CD1 4.4Å; I319-I330 HydrophobicContact CD1-CG1 3.86Å; I319-I330 HydrophobicContact CG1-CG1 4.02Å; I330-L346 HydrophobicContact CG2-CD1 4.42Å; I330-V348 HydrophobicContact CD1-CG2 4.45Å; I330-V371 HydrophobicContact CD1-CB 4.29Å; I330-V371 HydrophobicContact CD1-CG1 3.9Å; I330-V371 HydrophobicContact CD1-CG2 3.95Å; I330-I373 HydrophobicContact CG2-CD1 4.13Å
331	T	97.1	Very high	94.1	Very high	26 Å²	26	62.1 Å²	62.1	16%	0.16	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	153	-172.1	59	0	0	0	0	112.9	T286 A287 F317 D318 I329	T286-T331 CarbonylContact O-C 3.35Å; T286-T331 VanDerWaalsContact O-CA 3.25Å; T286-T331 WeakPolarHBondContact O-CA 3.45Å; A287-T331 HydrophobicContact CB-CG2 4.38Å; F317-T331 CarbonylContact C-O 3.47Å; F317-T331 VanDerWaalsContact CA-O 3.23Å; F317-T331 WeakPolarHBondContact CA-O 3.21Å; D318-T331 PolarHBondContact N-O 2.78Å; D318-T331 PolarHBondContact O-N 2.58Å; D318-T331 PolarHBondContact O-OG1 3.1Å; I329-T331 HydrophobicContact CG2-CG2 4.28Å
332	V	97.1	Very high	94.1	Very high	2 Å²	2	66.1 Å²	66.1	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121.9	174.2	-179.7	0	0	0	0	110.2	V278 G285 T286 I288 K334 L336	V278-V332 HydrophobicContact CG2-CG2 4.11Å; G285-V332 PolarHBondContact N-O 3.28Å; T286-V332 PolarHBondContact O-N 3.4Å; I288-V332 HydrophobicContact CD1-CG2 3.81Å; I288-V332 HydrophobicContact CG1-CG2 3.97Å; V332-K334 WeakPolarHBondContact CG1-O 3.37Å; V332-L336 HydrophobicContact CG1-CD1 4.45Å; V332-L336 HydrophobicContact CG1-CD2 4.47Å; V332-L336 HydrophobicContact CG1-CG 4.14Å; V332-L336 HydrophobicContact CG2-CD1 4.21Å
333	K	96	Very high	94.2	Very high	88 Å²	88	66.1 Å²	66.1	38%	0.383	33%	0.327	S	S	.	.			trans	-103.1	-27	-176.5	-171.1	175	-173	150	0	113.6	M316 F317 D318	M316-K333 WeakPolarHBondContact O-CA 3.47Å; M316-K333 VanDerWaalsContact O-CB 3.31Å; M316-K333 WeakPolarHBondContact O-CB 3.25Å; M316-K333 PolarHBondContact O-N 3.35Å; F317-K333 WeakPolarHBondContact O-CD 3.35Å; D318-K333 HydrophobicContact CB-CB 4.38Å; D318-K333 HydrophobicContact CB-CD 4.03Å; D318-K333 HydrophobicContact CB-CG 4.45Å; D318-K333 VanDerWaalsContact CG-NZ 3.35Å; D318-K333 IonicContact OD1-NZ 2.78Å; D318-K333 WeakPolarHBondContact OD2-CD 3.49Å; D318-K333 WeakPolarHBondContact OD2-CE 3.24Å; D318-K333 IonicContact OD2-NZ 2.81Å; D318-K333 PolarHBondContact OD2-NZ 2.96Å
334	K	95.8	Very high	94.6	Very high	78 Å²	78	58.4 Å²	58.4	34%	0.339	29%	0.293	S	S	.	.	S	Bend	trans	-136.5	156.5	173.9	-67.5	-179.5	-171	144.2	0	109.2	D315 M316 V332	D315-K334 WeakPolarHBondContact O-CD 3.3Å; D315-K334 WeakPolarHBondContact O-CE 3.34Å; D315-K334 PolarHBondContact O-NZ 3.34Å; D315-K334 IonicContact OD1-NZ 3.75Å; D315-K334 PolarHBondContact OD1-NZ 2.93Å; D315-K334 IonicContact OD2-NZ 3.24Å; M316-K334 HydrophobicContact CE-CB 3.94Å; M316-K334 PolarHBondContact O-N 2.92Å; M316-K334 HydrophobicContact SD-CB 4.06Å; M316-K334 HydrophobicContact SD-CD 3.96Å; V332-K334 WeakPolarHBondContact CG1-O 3.37Å
335	P	95.4	Very high	94.9	Very high	100 Å²	100	52.9 Å²	52.9	65%	0.649	27%	0.265	S	S	*	.			trans	-51.8	143.9	172.5	-25.1	35.1	0	0	0	111.5	V284 M316	V284-P335 HydrophobicContact CG2-CG 4.24Å; M316-P335 WeakPolarHBondContact CE-O 3.3Å
336	L	95.1	Very high	95.1	Very high	16 Å²	16	50.6 Å²	50.6	8%	0.084	25%	0.251	C	S	.	.			trans	-99.7	161.6	178.7	-57.8	-178.1	0	0	0	110	V278 E280 M316 F317 V332 I375	V278-L336 HydrophobicContact CB-CD1 4.4Å; V278-L336 HydrophobicContact CG1-CD1 3.56Å; V278-L336 HydrophobicContact CG2-CD1 3.9Å; E280-L336 HydrophobicContact CB-CB 4.19Å; M316-L336 HydrophobicContact CE-CD2 4.08Å; F317-L336 HydrophobicContact CE1-CD1 4.22Å; F317-L336 HydrophobicContact CE1-CD2 3.96Å; F317-L336 HydrophobicContact CZ-CD1 4.49Å; F317-L336 HydrophobicContact CZ-CD2 3.87Å; V332-L336 HydrophobicContact CG1-CD1 4.45Å; V332-L336 HydrophobicContact CG1-CD2 4.47Å; V332-L336 HydrophobicContact CG1-CG 4.14Å; V332-L336 HydrophobicContact CG2-CD1 4.21Å; L336-I375 HydrophobicContact CB-CD1 4.05Å; L336-I375 HydrophobicContact CD1-CD1 4.08Å; L336-I375 HydrophobicContact CD1-CG1 4.37Å; L336-I375 HydrophobicContact CD2-CD1 4.17Å; L336-I375 HydrophobicContact CG-CD1 4.32Å
337	D	93.6	Very high	95.4	Very high	77 Å²	77	51.6 Å²	51.6	41%	0.412	26%	0.255	S	S	.	.			trans	-158.1	108.2	-169.9	168.1	-32.6	0	0	0	106.8	E339 S340 R341	D337-E339 PolarHBondContact OD1-N 2.7Å; D337-S340 WeakPolarHBondContact CB-OG 3.33Å; D337-S340 PolarHBondContact O-OG 2.92Å; D337-S340 WeakPolarHBondContact OD1-CA 3.48Å; D337-S340 WeakPolarHBondContact OD1-CB 3.4Å; D337-S340 PolarHBondContact OD1-N 3.32Å; D337-S340 PolarHBondContact OD1-OG 3.04Å; D337-R341 PolarHBondContact O-N 2.74Å
338	Y	94.2	Very high	95.5	Very high	39 Å²	39	49.6 Å²	49.6	15%	0.153	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-36.5	-173.5	177.4	-103.6	0	0	0	112.2	E280 S340 R341 R342 I375 D377	E280-Y338 VanDerWaalsContact CD-CB 3.43Å; E280-Y338 VanDerWaalsContact OE1-CB 3.27Å; E280-Y338 WeakPolarHBondContact OE1-CB 3.48Å; E280-Y338 WeakPolarHBondContact OE2-CB 3.32Å; E280-Y338 PolarHBondContact OE2-N 2.9Å; Y338-S340 VanDerWaalsContact C-N 3.31Å; Y338-S340 PolarHBondContact O-N 3.34Å; Y338-R341 PolarHBondContact O-N 3.15Å; Y338-R342 HydrophobicContact CD1-CG 4.33Å; Y338-R342 HydrophobicContact CD2-CB 4.08Å; Y338-R342 HydrophobicContact CD2-CG 3.66Å; Y338-R342 HydrophobicContact CE1-CG 4.21Å; Y338-R342 VanDerWaalsContact CE1-NE 3.26Å; Y338-R342 VanDerWaalsContact CE1-NH2 3.26Å; Y338-R342 HydrophobicContact CE2-CB 3.82Å; Y338-R342 HydrophobicContact CE2-CG 3.52Å; Y338-R342 HydrophobicContact CG-CG 4.06Å; Y338-R342 VanDerWaalsContact CZ-CD 3.41Å; Y338-R342 VanDerWaalsContact CZ-CZ 3.48Å; Y338-R342 WeakPolarHBondContact O-CG 3.26Å; Y338-R342 PolarHBondContact O-NE 3.27Å; Y338-R342 PolarHBondContact OH-NH1 3.29Å; Y338-R342 VanDerWaalsContact OH-NH1 3.07Å; Y338-I375 HydrophobicContact CD2-CB 4.27Å; Y338-I375 HydrophobicContact CD2-CG2 4Å; Y338-I375 WeakPolarHBondContact CD2-O 3.13Å; Y338-I375 WeakPolarHBondContact CE2-O 3.49Å; Y338-D377 HydrophobicContact CD1-CB 3.84Å; Y338-D377 HydrophobicContact CD2-CB 4.26Å; Y338-D377 HydrophobicContact CE1-CB 3.61Å; Y338-D377 WeakPolarHBondContact CE1-OD2 3.25Å; Y338-D377 HydrophobicContact CE2-CB 4.06Å; Y338-D377 HydrophobicContact CG-CB 4.18Å
339	E	91.1	Very high	95.5	Very high	60 Å²	60	51 Å²	51	28%	0.28	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-40.3	177	-83.7	33.3	-93.8	0	0	112.1	D337 R342 P411	D337-E339 PolarHBondContact OD1-N 2.7Å; E339-R342 IonicContact OE1-CZ 2.74Å; E339-R342 IonicContact OE1-NH2 3.14Å; E339-R342 PolarHBondContact OE1-NH2 2.85Å; E339-P411 VanDerWaalsContact CG-O 3.31Å; E339-P411 WeakPolarHBondContact CG-O 3.36Å
340	S	91.5	Very high	95.5	Very high	79 Å²	79	49.3 Å²	49.3	55%	0.552	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-43	176.1	73.6	0	0	0	0	112.2	D337 Y338	D337-S340 WeakPolarHBondContact CB-OG 3.33Å; D337-S340 PolarHBondContact O-OG 2.92Å; D337-S340 WeakPolarHBondContact OD1-CA 3.48Å; D337-S340 WeakPolarHBondContact OD1-CB 3.4Å; D337-S340 PolarHBondContact OD1-N 3.32Å; D337-S340 PolarHBondContact OD1-OG 3.04Å; Y338-S340 VanDerWaalsContact C-N 3.31Å; Y338-S340 PolarHBondContact O-N 3.34Å
341	R	93.1	Very high	95.3	Very high	101 Å²	101	51.8 Å²	51.8	38%	0.381	25%	0.254	S	S	.	.			trans	-160.3	105.4	-174.6	-163.2	163.5	-169.9	149.1	12.7	115.7	D312 D337 Y338 L343 Y344 I375	D312-R341 IonicContact OD2-CZ 2.83Å; D312-R341 IonicContact OD2-NE 2.77Å; D312-R341 IonicContact OD2-NH2 3.03Å; D312-R341 PolarHBondContact OD2-NH2 2.8Å; D337-R341 PolarHBondContact O-N 2.74Å; Y338-R341 PolarHBondContact O-N 3.15Å; R341-L343 WeakPolarHBondContact CG-O 3.43Å; R341-L343 PolarHBondContact NE-O 3.01Å; R341-L343 PolarHBondContact O-N 3.4Å; R341-Y344 HydrophobicContact CB-CE2 4.03Å; R341-Y344 HydrophobicContact CG-CD2 4.38Å; R341-Y344 HydrophobicContact CG-CE1 4.38Å; R341-Y344 HydrophobicContact CG-CE2 3.98Å; R341-I375 WeakPolarHBondContact O-CD1 3.46Å
342	R	94.5	Very high	95.1	Very high	122 Å²	122	50.9 Å²	50.9	46%	0.46	25%	0.249	S	C	.	.	S	Bend	trans	-78.5	-13.3	-177.3	-53.9	-177.6	174.9	-152.8	-4	115.6	Y338 E339 I375	Y338-R342 HydrophobicContact CD1-CG 4.33Å; Y338-R342 HydrophobicContact CD2-CB 4.08Å; Y338-R342 HydrophobicContact CD2-CG 3.66Å; Y338-R342 HydrophobicContact CE1-CG 4.21Å; Y338-R342 VanDerWaalsContact CE1-NE 3.26Å; Y338-R342 VanDerWaalsContact CE1-NH2 3.26Å; Y338-R342 HydrophobicContact CE2-CB 3.82Å; Y338-R342 HydrophobicContact CE2-CG 3.52Å; Y338-R342 HydrophobicContact CG-CG 4.06Å; Y338-R342 VanDerWaalsContact CZ-CD 3.41Å; Y338-R342 VanDerWaalsContact CZ-CZ 3.48Å; Y338-R342 WeakPolarHBondContact O-CG 3.26Å; Y338-R342 PolarHBondContact O-NE 3.27Å; Y338-R342 PolarHBondContact OH-NH1 3.29Å; Y338-R342 VanDerWaalsContact OH-NH1 3.07Å; E339-R342 IonicContact OE1-CZ 2.74Å; E339-R342 IonicContact OE1-NH2 3.14Å; E339-R342 PolarHBondContact OE1-NH2 2.85Å; R342-I375 PolarHBondContact O-N 2.75Å
343	L	96.4	Very high	94.7	Very high	87 Å²	87	53.6 Å²	53.6	46%	0.455	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	131.5	-176.9	-177.6	69.6	0	0	0	111.2	R341 K372	R341-L343 WeakPolarHBondContact CG-O 3.43Å; R341-L343 PolarHBondContact NE-O 3.01Å; R341-L343 PolarHBondContact O-N 3.4Å; L343-K372 HydrophobicContact CD1-CB 4.41Å
344	Y	96.5	Very high	94.1	Very high	13 Å²	13	53.2 Å²	53.2	5%	0.051	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.6	168.7	-72.1	-90.1	0	0	0	110.9	D312 M316 F317 R341 K372 I373 I375	D312-Y344 VanDerWaalsContact OD1-CA 3.31Å; D312-Y344 WeakPolarHBondContact OD1-CA 3.25Å; M316-Y344 HydrophobicContact CB-CE1 4.25Å; M316-Y344 HydrophobicContact CG-CE1 3.67Å; F317-Y344 HydrophobicContact CE2-CD1 4.12Å; F317-Y344 AromaticContact CE2-CD2 3.83Å; F317-Y344 HydrophobicContact CE2-CD2 3.83Å; F317-Y344 HydrophobicContact CE2-CE2 4.43Å; F317-Y344 AromaticContact CE2-CG 3.64Å; F317-Y344 HydrophobicContact CE2-CG 3.64Å; F317-Y344 HydrophobicContact CZ-CD2 4.04Å; F317-Y344 HydrophobicContact CZ-CG 4.31Å; R341-Y344 HydrophobicContact CB-CE2 4.03Å; R341-Y344 HydrophobicContact CG-CD2 4.38Å; R341-Y344 HydrophobicContact CG-CE1 4.38Å; R341-Y344 HydrophobicContact CG-CE2 3.98Å; Y344-K372 WeakPolarHBondContact O-CA 3.43Å; Y344-I373 PolarHBondContact N-O 3.43Å; Y344-I373 PolarHBondContact O-N 2.86Å; Y344-I375 HydrophobicContact CD2-CD1 3.82Å; Y344-I375 HydrophobicContact CD2-CG1 4.49Å; Y344-I375 HydrophobicContact CE2-CD1 3.58Å
345	T	97	Very high	93.5	Very high	44 Å²	44	51.6 Å²	51.6	27%	0.27	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	114.1	177.3	-55.3	0	0	0	0	109.3	G311 D312 I370 V371 K372	G311-T345 CarbonylContact C-O 3.59Å; G311-T345 WeakPolarHBondContact CA-O 3.2Å; D312-T345 PolarHBondContact N-O 3.01Å; D312-T345 VanDerWaalsContact N-O 3.1Å; D312-T345 PolarHBondContact OD1-N 2.83Å; T345-I370 HydrophobicContact CG2-CG2 3.49Å; T345-I370 VanDerWaalsContact CG2-CG2 3.49Å; T345-V371 WeakPolarHBondContact CA-O 3.14Å; T345-K372 HydrophobicContact CG2-CG 4.34Å
346	L	96.8	Very high	92.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.3	174.4	-54.6	179.1	0	0	0	109.9	I308 F317 I330 I370 V371 I373	I308-L346 HydrophobicContact CD1-CD1 4.01Å; I308-L346 HydrophobicContact CG1-CD1 4.46Å; I308-L346 HydrophobicContact CG2-CB 4.31Å; I308-L346 HydrophobicContact CG2-CD2 4.15Å; F317-L346 HydrophobicContact CB-CD1 4.06Å; F317-L346 HydrophobicContact CD2-CD1 4.19Å; F317-L346 HydrophobicContact CD2-CD2 4.25Å; F317-L346 HydrophobicContact CG-CD1 4.34Å; I330-L346 HydrophobicContact CG2-CD1 4.42Å; L346-I370 CarbonylContact O-C 3.48Å; L346-I370 WeakPolarHBondContact O-CA 3.44Å; L346-V371 HydrophobicContact CB-CB 4.33Å; L346-V371 PolarHBondContact N-O 3.06Å; L346-V371 PolarHBondContact O-N 2.9Å; L346-I373 HydrophobicContact CD1-CD1 3.71Å; L346-I373 HydrophobicContact CG-CD1 4.32Å
347	K	97.1	Very high	92.3	Very high	74 Å²	74	52.4 Å²	52.4	32%	0.322	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.6	162.4	-167.7	-173.9	178.5	-156.6	0	108.4	I309 D310 T368	I309-K347 HydrophobicContact CD1-CD 3.72Å; I309-K347 HydrophobicContact CD1-CG 4.12Å; I309-K347 HydrophobicContact CG1-CB 4.24Å; I309-K347 HydrophobicContact CG1-CD 4.07Å; I309-K347 HydrophobicContact CG1-CG 4.08Å; I309-K347 WeakPolarHBondContact CG1-O 3.33Å; I309-K347 PolarHBondContact N-O 3.44Å; D310-K347 HydrophobicContact CB-CB 4.02Å; D310-K347 HydrophobicContact CB-CD 4.41Å; D310-K347 PolarHBondContact O-N 3.07Å; K347-T368 WeakPolarHBondContact CE-OG1 2.94Å
348	V	97.1	Very high	91.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.3	178.3	-178.8	0	0	0	0	109	F269 V291 Y306 R307 I308 I319 I330 T368 T369 V371	F269-V348 HydrophobicContact CZ-CG1 4.35Å; V291-V348 HydrophobicContact CG2-CG1 4.16Å; Y306-V348 HydrophobicContact CD1-CG1 4.44Å; R307-V348 WeakPolarHBondContact O-CA 3.43Å; I308-V348 HydrophobicContact CG1-CG2 4.37Å; I319-V348 HydrophobicContact CD1-CG1 3.66Å; I319-V348 HydrophobicContact CD1-CG2 4.24Å; I330-V348 HydrophobicContact CD1-CG2 4.45Å; V348-T368 CarbonylContact O-C 3.02Å; V348-T368 WeakPolarHBondContact O-CA 3.34Å; V348-T368 WeakPolarHBondContact O-CB 3.17Å; V348-T369 HydrophobicContact CB-CG2 4.41Å; V348-T369 PolarHBondContact N-O 2.86Å; V348-T369 PolarHBondContact O-N 2.85Å; V348-V371 HydrophobicContact CB-CG2 4.46Å; V348-V371 HydrophobicContact CG2-CG2 3.74Å
349	E	96.6	Very high	91.2	Very high	29 Å²	29	54.9 Å²	54.9	14%	0.136	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	142.8	171	-171.1	162	81.3	0	0	109.3	Y306 R307 I309 K366 D367 T368	Y306-E349 WeakPolarHBondContact CA-O 3.48Å; R307-E349 PolarHBondContact N-O 2.89Å; R307-E349 PolarHBondContact O-N 3.37Å; I309-E349 HydrophobicContact CD1-CB 3.95Å; I309-E349 HydrophobicContact CG1-CB 4.09Å; I309-E349 HydrophobicContact CG2-CB 3.65Å; E349-K366 VanDerWaalsContact CD-CE 3.43Å; E349-K366 VanDerWaalsContact CD-NZ 3.3Å; E349-K366 HydrophobicContact CG-CB 4.29Å; E349-K366 HydrophobicContact CG-CD 4.06Å; E349-K366 HydrophobicContact CG-CG 4.47Å; E349-K366 WeakPolarHBondContact OE1-CE 3.4Å; E349-K366 IonicContact OE1-NZ 2.64Å; E349-K366 PolarHBondContact OE1-NZ 3.49Å; E349-K366 VanDerWaalsContact OE2-CE 3.23Å; E349-K366 WeakPolarHBondContact OE2-CE 3.46Å; E349-K366 IonicContact OE2-NZ 3.51Å; E349-K366 PolarHBondContact OE2-NZ 2.92Å; E349-D367 WeakPolarHBondContact CA-O 3.41Å; E349-T368 HydrophobicContact CB-CG2 3.95Å; E349-T368 HydrophobicContact CG-CG2 3.88Å
350	A	96.1	Very high	90.8	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	124.9	171.2	0	0	0	0	0	108	P267 F269 A293 V304 E305 Y306 K366 D367	P267-A350 HydrophobicContact CG-CB 4.33Å; F269-A350 HydrophobicContact CE2-CB 3.61Å; F269-A350 HydrophobicContact CZ-CB 3.56Å; A293-A350 HydrophobicContact CB-CB 3.9Å; V304-A350 HydrophobicContact CG1-CB 3.73Å; E305-A350 WeakPolarHBondContact O-CA 3.34Å; Y306-A350 HydrophobicContact CD1-CB 3.82Å; Y306-A350 HydrophobicContact CE1-CB 3.8Å; A350-K366 CarbonylContact O-C 3.52Å; A350-K366 WeakPolarHBondContact O-CA 3.22Å; A350-K366 WeakPolarHBondContact O-CB 3.4Å; A350-D367 PolarHBondContact N-O 3.06Å; A350-D367 PolarHBondContact O-N 3.23Å
351	E	93.6	Very high	90.5	Very high	51 Å²	51	62.6 Å²	62.6	24%	0.238	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.7	-171.2	-177.5	170.3	-116.2	0	0	110.4	E305 R307 F365 K366	E305-E351 PolarHBondContact N-O 3.01Å; E305-E351 PolarHBondContact O-N 2.88Å; R307-E351 IonicContact CZ-OE2 2.68Å; R307-E351 IonicContact NH1-OE2 2.69Å; R307-E351 PolarHBondContact NH1-OE2 2.83Å; E351-F365 WeakPolarHBondContact CA-O 2.99Å; E351-K366 HydrophobicContact CB-CB 3.93Å; E351-K366 HydrophobicContact CB-CD 4.21Å; E351-K366 HydrophobicContact CG-CB 4.21Å; E351-K366 HydrophobicContact CG-CD 3.97Å; E351-K366 WeakPolarHBondContact OE1-CD 3.1Å; E351-K366 IonicContact OE1-NZ 3.76Å; E351-K366 PolarHBondContact OE1-NZ 2.66Å
352	N	92.6	Very high	89.9	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.4	175.1	-58	89.8	0	0	0	110.3	N263 P267 D295 N301 H354 V355 F365	N263-N352 WeakPolarHBondContact ND2-CB 3.38Å; P267-N352 WeakPolarHBondContact CD-OD1 3.42Å; D295-N352 PolarHBondContact OD2-ND2 3.43Å; N301-N352 PolarHBondContact O-ND2 2.9Å; N352-H354 PolarHBondContact O-N 2.92Å; N352-V355 HydrophobicContact CB-CG2 4.01Å; N352-F365 HydrophobicContact CB-CB 4.49Å; N352-F365 PolarHBondContact N-O 2.77Å; N352-F365 WeakPolarHBondContact OD1-CB 3.43Å; N352-F365 PolarHBondContact OD1-O 2.84Å; N352-F365 VanDerWaalsContact OD1-O 3.08Å
353	T	88.7	Confident	89	Confident	60 Å²	60	56.9 Å²	56.9	37%	0.368	28%	0.278	S	S	.	.	S	Bend	trans	-73.1	-24.8	179.4	51.4	0	0	0	0	114.1	E303 E305	E303-T353 WeakPolarHBondContact CB-OG1 3.49Å; E303-T353 WeakPolarHBondContact O-CB 3.44Å; E303-T353 WeakPolarHBondContact O-CG2 3.36Å; E303-T353 PolarHBondContact O-N 2.97Å; E303-T353 PolarHBondContact O-OG1 3.28Å; E305-T353 HydrophobicContact CB-CG2 3.94Å
354	H	84.2	Confident	88.2	Confident	80 Å²	80	57.1 Å²	57.1	37%	0.37	28%	0.284	S	S	.	.	S	Bend	trans	-126.6	71.7	-173.1	-62.4	91.9	0	0	0	111.9	N263 K300 E303 N352	N263-H354 PolarHBondContact ND2-O 2.78Å; K300-H354 PolarHBondContact O-ND1 2.88Å; K300-H354 VanDerWaalsContact O-ND1 3.15Å; E303-H354 IonicContact OE2-CE1 3.93Å; E303-H354 IonicContact OE2-ND1 2.86Å; N352-H354 PolarHBondContact O-N 2.92Å
355	V	81.9	Confident	87.8	Confident	44 Å²	44	57.1 Å²	57.1	27%	0.267	29%	0.285	S	S	.	.			trans	-86.8	129.5	178.3	-166.9	0	0	0	0	111.4	N352 Y360 F365	N352-V355 HydrophobicContact CB-CG2 4.01Å; V355-Y360 HydrophobicContact CB-CE1 4.16Å; V355-Y360 HydrophobicContact CG1-CD1 3.77Å; V355-Y360 HydrophobicContact CG1-CE1 3.55Å; V355-F365 HydrophobicContact CG1-CB 4.01Å; V355-F365 HydrophobicContact CG1-CD1 4.2Å; V355-F365 HydrophobicContact CG1-CD2 3.37Å; V355-F365 HydrophobicContact CG1-CE2 3.83Å; V355-F365 HydrophobicContact CG1-CG 3.57Å; V355-F365 HydrophobicContact CG1-CZ 4.4Å; V355-F365 HydrophobicContact CG2-CB 3.64Å; V355-F365 HydrophobicContact CG2-CG 4.08Å
356	D	80.6	Confident	87.6	Confident	45 Å²	45	57.8 Å²	57.8	24%	0.241	28%	0.284	C	S	.	.			trans	-86.7	123.5	175.4	-176.5	-31.3	0	0	0	111.3	R358 F359	D356-R358 PolarHBondContact O-N 2.87Å; D356-R358 VanDerWaalsContact OD1-CB 3.25Å; D356-R358 WeakPolarHBondContact OD1-CB 3.49Å; D356-R358 VanDerWaalsContact OD1-CG 3.25Å; D356-R358 WeakPolarHBondContact OD1-CG 3.45Å; D356-R358 PolarHBondContact OD1-N 2.82Å; D356-R358 IonicContact OD1-NE 2.68Å; D356-R358 PolarHBondContact OD1-NE 3.19Å; D356-R358 IonicContact OD2-CZ 3.41Å; D356-R358 IonicContact OD2-NE 3.69Å; D356-R358 PolarHBondContact OD2-NE 3.27Å; D356-R358 IonicContact OD2-NH2 2.66Å; D356-R358 PolarHBondContact OD2-NH2 3.31Å; D356-F359 HydrophobicContact CB-CD2 4.04Å; D356-F359 PolarHBondContact O-N 3.01Å
357	P	84.4	Confident	87.5	Confident	87 Å²	87	59.7 Å²	59.7	57%	0.565	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20	179.3	-26.6	35	0	0	0	116.1	F359 Y360	P357-F359 PolarHBondContact O-N 2.77Å; P357-Y360 HydrophobicContact CB-CD2 4.14Å; P357-Y360 HydrophobicContact CB-CE2 3.7Å; P357-Y360 HydrophobicContact CG-CE2 4.17Å
358	R	82.3	Confident	87.5	Confident	155 Å²	155	58.3 Å²	58.3	59%	0.585	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-31.1	174.8	-66.7	-178.9	-68	159.2	0	112.1	D356 Y361	D356-R358 PolarHBondContact O-N 2.87Å; D356-R358 VanDerWaalsContact OD1-CB 3.25Å; D356-R358 WeakPolarHBondContact OD1-CB 3.49Å; D356-R358 VanDerWaalsContact OD1-CG 3.25Å; D356-R358 WeakPolarHBondContact OD1-CG 3.45Å; D356-R358 PolarHBondContact OD1-N 2.82Å; D356-R358 IonicContact OD1-NE 2.68Å; D356-R358 PolarHBondContact OD1-NE 3.19Å; D356-R358 IonicContact OD2-CZ 3.41Å; D356-R358 IonicContact OD2-NE 3.69Å; D356-R358 PolarHBondContact OD2-NE 3.27Å; D356-R358 IonicContact OD2-NH2 2.66Å; D356-R358 PolarHBondContact OD2-NH2 3.31Å; R358-Y361 WeakPolarHBondContact O-CD1 3.33Å; R358-Y361 WeakPolarHBondContact O-CE1 3.11Å
359	F	82.6	Confident	87.5	Confident	13 Å²	13	58.3 Å²	58.3	6%	0.057	29%	0.292	C	S	.	.	S	Bend	trans	-108.6	5.8	-169.2	-59.3	-77.8	0	0	0	114.4	M172 V262 D356 P357 Y361 L362 F365	M172-F359 HydrophobicContact CB-CE1 3.89Å; M172-F359 HydrophobicContact CB-CZ 4.35Å; V262-F359 HydrophobicContact CG1-CD2 3.62Å; V262-F359 HydrophobicContact CG1-CE1 4.32Å; V262-F359 HydrophobicContact CG1-CE2 3.32Å; V262-F359 HydrophobicContact CG1-CG 4.25Å; V262-F359 HydrophobicContact CG1-CZ 3.71Å; D356-F359 HydrophobicContact CB-CD2 4.04Å; D356-F359 PolarHBondContact O-N 3.01Å; P357-F359 PolarHBondContact O-N 2.77Å; F359-Y361 HydrophobicContact CD1-CE1 4.2Å; F359-Y361 PolarHBondContact O-N 3.23Å; F359-L362 HydrophobicContact CB-CD1 4.09Å; F359-L362 HydrophobicContact CD1-CD1 4.19Å; F359-L362 WeakPolarHBondContact O-CB 3.19Å; F359-L362 PolarHBondContact O-N 3.5Å; F359-F365 HydrophobicContact CB-CZ 4.14Å; F359-F365 WeakPolarHBondContact O-CE2 3.37Å
360	Y	83.5	Confident	87.5	Confident	146 Å²	146	60.1 Å²	60.1	57%	0.573	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-14.3	173.4	-71.8	-16.1	0	0	0	115.6	V355 P357	V355-Y360 HydrophobicContact CB-CE1 4.16Å; V355-Y360 HydrophobicContact CG1-CD1 3.77Å; V355-Y360 HydrophobicContact CG1-CE1 3.55Å; P357-Y360 HydrophobicContact CB-CD2 4.14Å; P357-Y360 HydrophobicContact CB-CE2 3.7Å; P357-Y360 HydrophobicContact CG-CE2 4.17Å
361	Y	84.7	Confident	87.6	Confident	156 Å²	156	60.1 Å²	60.1	61%	0.612	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-17	174.8	69.3	-95	0	0	0	114.1	R358 F359	R358-Y361 WeakPolarHBondContact O-CD1 3.33Å; R358-Y361 WeakPolarHBondContact O-CE1 3.11Å; F359-Y361 HydrophobicContact CD1-CE1 4.2Å; F359-Y361 PolarHBondContact O-N 3.23Å
362	L	81.2	Confident	87.7	Confident	74 Å²	74	61 Å²	61	39%	0.387	31%	0.305	S	S	.	.	S	Bend	trans	-72.1	-32.3	179.3	-67.1	178.8	0	0	0	112	D264 F359 F365	D264-L362 HydrophobicContact CB-CD1 4.27Å; F359-L362 HydrophobicContact CB-CD1 4.09Å; F359-L362 HydrophobicContact CD1-CD1 4.19Å; F359-L362 WeakPolarHBondContact O-CB 3.19Å; F359-L362 PolarHBondContact O-N 3.5Å; L362-F365 HydrophobicContact CB-CZ 4.22Å
363	G	74.8	Confident	87.9	Confident	29 Å²	29	60.7 Å²	60.7	30%	0.299	30%	0.303	S	S	.	.			trans	160.7	-171.5	170.7	0	0	0	0	0	114.1	F365	G363-F365 WeakPolarHBondContact O-CD2 3.45Å; G363-F365 PolarHBondContact O-N 2.89Å
364	P	80.8	Confident	88.3	Confident	91 Å²	91	59.6 Å²	59.6	59%	0.591	30%	0.298	S	S	*	.			trans	-66.6	123.7	160.3	30	-31.9	0	0	0	108.8	K366	P364-K366 HydrophobicContact CB-CG 4.1Å; P364-K366 PolarHBondContact O-N 2.74Å
365	F	88.1	Confident	88.9	Confident	14 Å²	14	56.1 Å²	56.1	6%	0.061	28%	0.282	C	S	.	.	S	Bend	trans	-77	50.3	177.3	-76.1	-86.3	0	0	0	112	N263 E351 N352 V355 F359 L362 G363	N263-F365 WeakPolarHBondContact O-CE1 3.35Å; N263-F365 WeakPolarHBondContact OD1-CD1 3.39Å; N263-F365 WeakPolarHBondContact OD1-CE1 3.43Å; E351-F365 WeakPolarHBondContact CA-O 2.99Å; N352-F365 HydrophobicContact CB-CB 4.49Å; N352-F365 PolarHBondContact N-O 2.77Å; N352-F365 WeakPolarHBondContact OD1-CB 3.43Å; N352-F365 PolarHBondContact OD1-O 2.84Å; N352-F365 VanDerWaalsContact OD1-O 3.08Å; V355-F365 HydrophobicContact CG1-CB 4.01Å; V355-F365 HydrophobicContact CG1-CD1 4.2Å; V355-F365 HydrophobicContact CG1-CD2 3.37Å; V355-F365 HydrophobicContact CG1-CE2 3.83Å; V355-F365 HydrophobicContact CG1-CG 3.57Å; V355-F365 HydrophobicContact CG1-CZ 4.4Å; V355-F365 HydrophobicContact CG2-CB 3.64Å; V355-F365 HydrophobicContact CG2-CG 4.08Å; F359-F365 HydrophobicContact CB-CZ 4.14Å; F359-F365 WeakPolarHBondContact O-CE2 3.37Å; L362-F365 HydrophobicContact CB-CZ 4.22Å; G363-F365 WeakPolarHBondContact O-CD2 3.45Å; G363-F365 PolarHBondContact O-N 2.89Å
366	K	92.4	Very high	89.6	Confident	58 Å²	58	57.1 Å²	57.1	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	161.7	-174	60.3	-163.3	-161.7	171	0	114.6	E349 A350 E351 P364	E349-K366 VanDerWaalsContact CD-CE 3.43Å; E349-K366 VanDerWaalsContact CD-NZ 3.3Å; E349-K366 HydrophobicContact CG-CB 4.29Å; E349-K366 HydrophobicContact CG-CD 4.06Å; E349-K366 HydrophobicContact CG-CG 4.47Å; E349-K366 WeakPolarHBondContact OE1-CE 3.4Å; E349-K366 IonicContact OE1-NZ 2.64Å; E349-K366 PolarHBondContact OE1-NZ 3.49Å; E349-K366 VanDerWaalsContact OE2-CE 3.23Å; E349-K366 WeakPolarHBondContact OE2-CE 3.46Å; E349-K366 IonicContact OE2-NZ 3.51Å; E349-K366 PolarHBondContact OE2-NZ 2.92Å; A350-K366 CarbonylContact O-C 3.52Å; A350-K366 WeakPolarHBondContact O-CA 3.22Å; A350-K366 WeakPolarHBondContact O-CB 3.4Å; E351-K366 HydrophobicContact CB-CB 3.93Å; E351-K366 HydrophobicContact CB-CD 4.21Å; E351-K366 HydrophobicContact CG-CB 4.21Å; E351-K366 HydrophobicContact CG-CD 3.97Å; E351-K366 WeakPolarHBondContact OE1-CD 3.1Å; E351-K366 IonicContact OE1-NZ 3.76Å; E351-K366 PolarHBondContact OE1-NZ 2.66Å; P364-K366 HydrophobicContact CB-CG 4.1Å; P364-K366 PolarHBondContact O-N 2.74Å
367	D	95.1	Very high	90.2	Very high	40 Å²	40	59 Å²	59	21%	0.214	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	165.7	175.8	-169.2	20.6	0	0	0	111.1	P267 F269 E349 A350	P267-D367 WeakPolarHBondContact O-CB 3.17Å; F269-D367 HydrophobicContact CD2-CB 4.2Å; F269-D367 PolarHBondContact N-OD2 2.76Å; E349-D367 WeakPolarHBondContact CA-O 3.41Å; A350-D367 PolarHBondContact N-O 3.06Å; A350-D367 PolarHBondContact O-N 3.23Å
368	T	96.1	Very high	90.5	Very high	46 Å²	46	57.4 Å²	57.4	28%	0.282	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.6	-178.7	70.4	0	0	0	0	113.7	I309 K347 V348 E349	I309-T368 HydrophobicContact CD1-CG2 3.99Å; K347-T368 WeakPolarHBondContact CE-OG1 2.94Å; V348-T368 CarbonylContact O-C 3.02Å; V348-T368 WeakPolarHBondContact O-CA 3.34Å; V348-T368 WeakPolarHBondContact O-CB 3.17Å; E349-T368 HydrophobicContact CB-CG2 3.95Å; E349-T368 HydrophobicContact CG-CG2 3.88Å
369	T	96.8	Very high	90.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	160.3	173.4	-167.8	0	0	0	0	112.2	F269 Q271 N272 I274 V348 V371	F269-T369 HydrophobicContact CD1-CG2 3.62Å; F269-T369 HydrophobicContact CD2-CG2 3.92Å; F269-T369 HydrophobicContact CE1-CG2 3.61Å; F269-T369 HydrophobicContact CE2-CG2 3.9Å; F269-T369 HydrophobicContact CG-CG2 3.77Å; F269-T369 HydrophobicContact CZ-CG2 3.74Å; Q271-T369 PolarHBondContact O-OG1 3.28Å; N272-T369 VanDerWaalsContact C-OG1 3.24Å; N272-T369 PolarHBondContact O-OG1 3.47Å; I274-T369 HydrophobicContact CD1-CG2 4.06Å; V348-T369 HydrophobicContact CB-CG2 4.41Å; V348-T369 PolarHBondContact N-O 2.86Å; V348-T369 PolarHBondContact O-N 2.85Å; T369-V371 HydrophobicContact CG2-CG2 4.36Å
370	I	97.2	Very high	91.1	Very high	67 Å²	67	57.3 Å²	57.3	34%	0.344	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	114.5	177.9	-58.5	177.3	0	0	0	109.1	N272 T273 I274 T345 L346 K372	N272-I370 PolarHBondContact O-N 2.73Å; T273-I370 CarbonylContact C-O 3.47Å; T273-I370 WeakPolarHBondContact CA-O 3.45Å; T273-I370 WeakPolarHBondContact CG2-O 3.49Å; I274-I370 PolarHBondContact N-O 2.75Å; T345-I370 HydrophobicContact CG2-CG2 3.49Å; T345-I370 VanDerWaalsContact CG2-CG2 3.49Å; L346-I370 CarbonylContact O-C 3.48Å; L346-I370 WeakPolarHBondContact O-CA 3.44Å; I370-K372 HydrophobicContact CG2-CG 4.33Å
371	V	97.3	Very high	91.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.6	176	-170.9	0	0	0	0	109.3	I274 L276 V291 I330 T345 L346 V348 T369 I373	I274-V371 WeakPolarHBondContact O-CA 3.28Å; L276-V371 HydrophobicContact CD1-CG1 3.7Å; L276-V371 HydrophobicContact CG-CG1 4.02Å; V291-V371 HydrophobicContact CG1-CG2 3.71Å; I330-V371 HydrophobicContact CD1-CB 4.29Å; I330-V371 HydrophobicContact CD1-CG1 3.9Å; I330-V371 HydrophobicContact CD1-CG2 3.95Å; T345-V371 WeakPolarHBondContact CA-O 3.14Å; L346-V371 HydrophobicContact CB-CB 4.33Å; L346-V371 PolarHBondContact N-O 3.06Å; L346-V371 PolarHBondContact O-N 2.9Å; V348-V371 HydrophobicContact CB-CG2 4.46Å; V348-V371 HydrophobicContact CG2-CG2 3.74Å; T369-V371 HydrophobicContact CG2-CG2 4.36Å; V371-I373 HydrophobicContact CG1-CG1 4.1Å
372	K	97	Very high	91.9	Very high	69 Å²	69	44.8 Å²	44.8	30%	0.3	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	111.7	176.2	-71.7	176	-178.6	171.3	0	109.3	T273 I274 H275 L276 L343 Y344 T345 I370	T273-K372 HydrophobicContact CG2-CD 3.9Å; T273-K372 HydrophobicContact CG2-CG 4.33Å; I274-K372 PolarHBondContact O-N 3.46Å; H275-K372 WeakPolarHBondContact CA-O 3.39Å; L276-K372 PolarHBondContact N-O 2.88Å; L343-K372 HydrophobicContact CD1-CB 4.41Å; Y344-K372 WeakPolarHBondContact O-CA 3.43Å; T345-K372 HydrophobicContact CG2-CG 4.34Å; I370-K372 HydrophobicContact CG2-CG 4.33Å
373	I	97.1	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	104.5	-179.7	-55.8	172.2	0	0	0	107.3	L276 V278 I288 F317 I330 Y344 L346 V371	L276-I373 HydrophobicContact CB-CG1 4.35Å; V278-I373 HydrophobicContact CG1-CG2 3.66Å; I288-I373 HydrophobicContact CD1-CD1 4.42Å; I288-I373 HydrophobicContact CD1-CG2 4.48Å; F317-I373 HydrophobicContact CD1-CD1 3.93Å; F317-I373 HydrophobicContact CD2-CD1 3.78Å; F317-I373 HydrophobicContact CE1-CD1 3.99Å; F317-I373 HydrophobicContact CE1-CG2 4.23Å; F317-I373 HydrophobicContact CE2-CD1 3.84Å; F317-I373 HydrophobicContact CG-CD1 3.83Å; F317-I373 HydrophobicContact CZ-CB 4.42Å; F317-I373 HydrophobicContact CZ-CD1 3.95Å; F317-I373 HydrophobicContact CZ-CG2 3.96Å; I330-I373 HydrophobicContact CG2-CD1 4.13Å; Y344-I373 PolarHBondContact N-O 3.43Å; Y344-I373 PolarHBondContact O-N 2.86Å; L346-I373 HydrophobicContact CD1-CD1 3.71Å; L346-I373 HydrophobicContact CG-CD1 4.32Å; V371-I373 HydrophobicContact CG1-CG1 4.1Å
374	S	96.9	Very high	93.4	Very high	38 Å²	38	44.1 Å²	44.1	27%	0.266	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.4	169.8	52.7	0	0	0	0	109.5	L276 R277 V278	L276-S374 PolarHBondContact O-N 2.91Å; L276-S374 PolarHBondContact O-OG 3.12Å; R277-S374 WeakPolarHBondContact CA-O 3.15Å; R277-S374 WeakPolarHBondContact CG-OG 3.05Å; V278-S374 PolarHBondContact N-O 2.86Å
375	I	96.6	Very high	94	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.036	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	139.4	174.2	-64.9	177.8	0	0	0	108.7	V278 E280 L336 Y338 R341 R342 Y344	V278-I375 HydrophobicContact CG1-CG1 3.88Å; V278-I375 CarbonylContact O-C 3.58Å; V278-I375 WeakPolarHBondContact O-CA 3.2Å; E280-I375 HydrophobicContact CB-CG2 3.71Å; L336-I375 HydrophobicContact CB-CD1 4.05Å; L336-I375 HydrophobicContact CD1-CD1 4.08Å; L336-I375 HydrophobicContact CD1-CG1 4.37Å; L336-I375 HydrophobicContact CD2-CD1 4.17Å; L336-I375 HydrophobicContact CG-CD1 4.32Å; Y338-I375 HydrophobicContact CD2-CB 4.27Å; Y338-I375 HydrophobicContact CD2-CG2 4Å; Y338-I375 WeakPolarHBondContact CD2-O 3.13Å; Y338-I375 WeakPolarHBondContact CE2-O 3.49Å; R341-I375 WeakPolarHBondContact O-CD1 3.46Å; R342-I375 PolarHBondContact O-N 2.75Å; Y344-I375 HydrophobicContact CD2-CD1 3.82Å; Y344-I375 HydrophobicContact CD2-CG1 4.49Å; Y344-I375 HydrophobicContact CE2-CD1 3.58Å
376	E	95.6	Very high	94.3	Very high	65 Å²	65	50.5 Å²	50.5	30%	0.304	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.5	177	-63.1	-169.7	147.9	0	0	109.9	R277 V278 L279 E280	R277-E376 HydrophobicContact CB-CG 4.48Å; R277-E376 VanDerWaalsContact CD-OE1 3.25Å; R277-E376 WeakPolarHBondContact CD-OE1 3.48Å; R277-E376 IonicContact CZ-OE1 2.97Å; R277-E376 IonicContact NE-OE1 3.51Å; R277-E376 IonicContact NH1-OE1 2.7Å; R277-E376 PolarHBondContact NH1-OE1 2.94Å; V278-E376 PolarHBondContact O-N 3.44Å; L279-E376 WeakPolarHBondContact CA-O 3.2Å; L279-E376 HydrophobicContact CD2-CB 3.99Å; E280-E376 PolarHBondContact N-O 3.34Å; E280-E376 VanDerWaalsContact N-O 3.15Å
377	D	93.5	Very high	94.4	Very high	84 Å²	84	53.4 Å²	53.4	45%	0.449	29%	0.289	S	S	.	.			trans	-64.8	132.8	-172.4	-177.1	-38.9	0	0	0	112.7	E280 Y338	E280-D377 WeakPolarHBondContact OE1-CA 3.22Å; Y338-D377 HydrophobicContact CD1-CB 3.84Å; Y338-D377 HydrophobicContact CD2-CB 4.26Å; Y338-D377 HydrophobicContact CE1-CB 3.61Å; Y338-D377 WeakPolarHBondContact CE1-OD2 3.25Å; Y338-D377 HydrophobicContact CE2-CB 4.06Å; Y338-D377 HydrophobicContact CG-CB 4.18Å
378	V	91	Very high	94.4	Very high	53 Å²	53	54.1 Å²	54.1	32%	0.321	30%	0.298	S	S	.	.			trans	-141	75.9	-178.9	-166.6	0	0	0	0	114.2	L279 E280 E380	L279-V378 HydrophobicContact CB-CG2 4.06Å; L279-V378 HydrophobicContact CD2-CG2 3.73Å; L279-V378 HydrophobicContact CG-CG2 4.41Å; E280-V378 HydrophobicContact CG-CB 4.34Å; E280-V378 HydrophobicContact CG-CG2 4.43Å; E280-V378 PolarHBondContact OE1-N 2.73Å; V378-E380 PolarHBondContact O-N 2.98Å
379	D	88.4	Confident	94.4	Very high	77 Å²	77	52.2 Å²	52.2	41%	0.412	29%	0.285	S	S	.	.			trans	14.9	84.7	155.4	-157.9	66.3	0	0	0	115.7	D412 N466	D379-D412 WeakPolarHBondContact CA-OD1 3.4Å; D379-D412 PolarHBondContact N-OD1 2.91Å; D379-N466 PolarHBondContact OD2-ND2 3.34Å
380	E	89.8	Confident	94.4	Very high	89 Å²	89	56.7 Å²	56.7	42%	0.416	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-83.9	154	-176.2	-77.5	-142.4	-56.6	0	0	114.2	V378 P411 D412	V378-E380 PolarHBondContact O-N 2.98Å; E380-P411 HydrophobicContact CB-CB 4.32Å; E380-P411 HydrophobicContact CB-CG 3.8Å; E380-P411 HydrophobicContact CG-CG 4.47Å; E380-P411 VanDerWaalsContact OE1-CG 3.28Å; E380-P411 WeakPolarHBondContact OE1-CG 3.13Å; E380-D412 PolarHBondContact N-OD1 3.05Å; E380-D412 PolarHBondContact N-OD2 2.83Å
381	P	91	Very high	94.4	Very high	40 Å²	40	55 Å²	55	26%	0.26	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-77.3	130.8	177.5	30.8	-35.7	0	0	0	113	V383 E469 T471	P381-V383 PolarHBondContact O-N 3.08Å; P381-E469 HydrophobicContact CB-CB 3.95Å; P381-T471 HydrophobicContact CB-CG2 3.77Å; P381-T471 HydrophobicContact CG-CG2 4.2Å; P381-T471 WeakPolarHBondContact O-CG2 3.36Å
382	P	93	Very high	94.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-54.3	122.5	-171.7	-5.8	-6.2	0	0	0	115.9	R409 D410 I418 E463 T471	P382-R409 CarbonylContact C-O 3.48Å; P382-D410 WeakPolarHBondContact CB-OD1 3.24Å; P382-D410 VanDerWaalsContact CG-OD1 3.3Å; P382-D410 WeakPolarHBondContact CG-OD1 3.06Å; P382-I418 HydrophobicContact CB-CD1 3.75Å; P382-I418 HydrophobicContact CB-CG1 3.96Å; P382-I418 HydrophobicContact CB-CG2 4.37Å; P382-I418 HydrophobicContact CG-CG1 4.23Å; P382-I418 HydrophobicContact CG-CG2 4.45Å; P382-E463 HydrophobicContact CG-CB 4.28Å; P382-T471 WeakPolarHBondContact O-CB 3.28Å; P382-T471 WeakPolarHBondContact O-CG2 3.49Å; P382-T471 PolarHBondContact O-OG1 3.05Å
383	V	92.8	Very high	94.2	Very high	66 Å²	66	57 Å²	57	40%	0.4	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.7	-171.1	-177.1	0	0	0	0	112.4	P381 A408 R409 P411	P381-V383 PolarHBondContact O-N 3.08Å; V383-A408 CarbonylContact O-C 3.48Å; V383-A408 WeakPolarHBondContact O-CA 3.37Å; V383-R409 PolarHBondContact N-O 3.43Å; V383-R409 PolarHBondContact O-N 2.77Å; V383-P411 HydrophobicContact CG2-CG 4.02Å
384	F	94.6	Very high	94	Very high	22 Å²	22	61.5 Å²	61.5	10%	0.096	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	145.7	174.6	-76.9	-80.7	0	0	0	113.3	R386 Y389 V406 M407 A408 F420 V459 A461 T471 V473	F384-R386 PolarHBondContact O-N 2.86Å; F384-Y389 HydrophobicContact CD1-CE2 4.31Å; F384-V406 HydrophobicContact CD1-CB 4.42Å; F384-V406 HydrophobicContact CE1-CB 4.14Å; F384-V406 HydrophobicContact CE1-CG2 4.03Å; F384-M407 CarbonylContact C-O 3.58Å; F384-M407 WeakPolarHBondContact CA-O 3.01Å; F384-A408 HydrophobicContact CD1-CB 4Å; F384-A408 HydrophobicContact CE1-CB 4.3Å; F384-A408 HydrophobicContact CG-CB 4.28Å; F384-F420 HydrophobicContact CE1-CD1 4.19Å; F384-F420 AromaticContact CE1-CE1 3.98Å; F384-F420 HydrophobicContact CE1-CE1 3.98Å; F384-V459 HydrophobicContact CE1-CG1 4.36Å; F384-V459 HydrophobicContact CZ-CG1 4.16Å; F384-A461 HydrophobicContact CE1-CB 4.12Å; F384-A461 HydrophobicContact CE2-CB 3.7Å; F384-A461 HydrophobicContact CZ-CB 3.46Å; F384-A461 VanDerWaalsContact CZ-CB 3.46Å; F384-T471 VanDerWaalsContact CD2-OG1 3.27Å; F384-T471 WeakPolarHBondContact CD2-OG1 3.13Å; F384-T471 WeakPolarHBondContact CE2-OG1 3.47Å; F384-V473 HydrophobicContact CB-CB 4.35Å; F384-V473 HydrophobicContact CB-CG2 4.47Å; F384-V473 HydrophobicContact CD1-CB 4.16Å; F384-V473 HydrophobicContact CD1-CG1 3.64Å; F384-V473 HydrophobicContact CD2-CB 3.66Å; F384-V473 HydrophobicContact CD2-CG1 3.89Å; F384-V473 HydrophobicContact CE1-CB 4.36Å; F384-V473 HydrophobicContact CE1-CG1 3.51Å; F384-V473 HydrophobicContact CE2-CB 3.87Å; F384-V473 HydrophobicContact CE2-CG1 3.74Å; F384-V473 HydrophobicContact CG-CB 3.8Å; F384-V473 HydrophobicContact CG-CG1 3.82Å; F384-V473 HydrophobicContact CG-CG2 4.4Å; F384-V473 HydrophobicContact CZ-CB 4.22Å; F384-V473 HydrophobicContact CZ-CG1 3.55Å
385	S	93.1	Very high	93.9	Very high	77 Å²	77	60.5 Å²	60.5	54%	0.538	32%	0.322	S	S	.	.	S	Bend	trans	-74.1	-8.2	-178.5	71.2	0	0	0	0	114.8	Y389 M407	S385-Y389 PolarHBondContact OG-OH 3.14Å; S385-M407 PolarHBondContact N-O 3.35Å; S385-M407 PolarHBondContact OG-O 2.81Å
386	R	95	Very high	93.7	Very high	163 Å²	163	65.7 Å²	65.7	62%	0.615	35%	0.35	S	S	*	.	S	Bend	trans	-144.4	150.7	173.4	-59.7	-174.8	-179.9	179.1	0.3	109.8	F384 S388 Y389 V473	F384-R386 PolarHBondContact O-N 2.86Å; R386-S388 VanDerWaalsContact C-N 3.28Å; R386-S388 WeakPolarHBondContact CB-O 3.4Å; R386-S388 PolarHBondContact O-N 3.04Å; R386-Y389 HydrophobicContact CB-CE1 4.17Å; R386-Y389 HydrophobicContact CB-CE2 4.1Å; R386-Y389 HydrophobicContact CG-CE1 4.06Å; R386-V473 WeakPolarHBondContact O-CG2 3.46Å
387	S	93.9	Very high	93.6	Very high	118 Å²	118	64.3 Å²	64.3	83%	0.825	34%	0.344	S	S	*	.	S	Bend	trans	-70.5	-21.7	173.3	48.9	0	0	0	0	113.8	V473	S387-V473 WeakPolarHBondContact O-CG2 3.05Å
388	S	96.2	Very high	93.6	Very high	55 Å²	55	67.9 Å²	67.9	39%	0.385	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	157.5	171	58.3	0	0	0	0	111	R386 A474	R386-S388 VanDerWaalsContact C-N 3.28Å; R386-S388 WeakPolarHBondContact CB-O 3.4Å; R386-S388 PolarHBondContact O-N 3.04Å; S388-A474 VanDerWaalsContact CA-O 3.3Å; S388-A474 WeakPolarHBondContact CA-O 3.41Å
389	Y	96.5	Very high	93.8	Very high	7 Å²	7	69.3 Å²	69.3	3%	0.027	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.1	170.3	-60.8	-99.9	0	0	0	109.9	F384 S385 R386 F391 V406 M407 V473 A474 V475 F476	F384-Y389 HydrophobicContact CD1-CE2 4.31Å; S385-Y389 PolarHBondContact OG-OH 3.14Å; R386-Y389 HydrophobicContact CB-CE1 4.17Å; R386-Y389 HydrophobicContact CB-CE2 4.1Å; R386-Y389 HydrophobicContact CG-CE1 4.06Å; Y389-F391 HydrophobicContact CD1-CZ 4.27Å; Y389-F391 HydrophobicContact CG-CZ 4.42Å; Y389-V406 HydrophobicContact CD1-CG1 4.37Å; Y389-V406 HydrophobicContact CD2-CB 4.43Å; Y389-V406 HydrophobicContact CD2-CG1 3.75Å; Y389-V406 HydrophobicContact CE1-CB 4.49Å; Y389-V406 HydrophobicContact CE1-CG1 4.49Å; Y389-V406 HydrophobicContact CE2-CB 4.03Å; Y389-V406 HydrophobicContact CE2-CG1 3.86Å; Y389-V406 HydrophobicContact CG-CG1 4.03Å; Y389-M407 PolarHBondContact OH-N 2.8Å; Y389-M407 PolarHBondContact OH-O 2.96Å; Y389-M407 VanDerWaalsContact OH-O 3.11Å; Y389-V473 HydrophobicContact CD2-CG1 4.2Å; Y389-V473 HydrophobicContact CD2-CG2 3.91Å; Y389-V473 HydrophobicContact CE2-CG1 4.11Å; Y389-V473 HydrophobicContact CE2-CG2 3.9Å; Y389-A474 PolarHBondContact N-O 2.82Å; Y389-V475 HydrophobicContact CD2-CG2 4.27Å; Y389-V475 WeakPolarHBondContact O-CA 3.19Å; Y389-F476 PolarHBondContact O-N 3.28Å
390	L	96.6	Very high	94	Very high	94 Å²	94	67.8 Å²	67.8	49%	0.492	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.3	170.2	173.6	63.9	0	0	0	107.3	W454 F476 R478	L390-W454 HydrophobicContact CD1-CH2 4.3Å; L390-W454 HydrophobicContact CD1-CZ3 3.82Å; L390-F476 WeakPolarHBondContact CA-O 3.27Å; L390-F476 HydrophobicContact CD1-CB 3.9Å; L390-R478 HydrophobicContact CD1-CB 4.45Å
391	F	96.1	Very high	94.2	Very high	30 Å²	30	66.1 Å²	66.1	13%	0.132	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.5	170.8	-55.8	-53.3	0	0	0	108.7	Y389 I403 L441 V475 F476 V477 R478	Y389-F391 HydrophobicContact CD1-CZ 4.27Å; Y389-F391 HydrophobicContact CG-CZ 4.42Å; F391-I403 HydrophobicContact CB-CG2 3.93Å; F391-L441 HydrophobicContact CD2-CD2 4.08Å; F391-L441 HydrophobicContact CE2-CD2 4.2Å; F391-V475 HydrophobicContact CD2-CG1 3.65Å; F391-V475 HydrophobicContact CE2-CG1 3.55Å; F391-F476 PolarHBondContact N-O 3.21Å; F391-V477 WeakPolarHBondContact O-CA 3.37Å; F391-R478 PolarHBondContact O-N 3Å
392	E	95.3	Very high	94.4	Very high	104 Å²	104	68.4 Å²	68.4	49%	0.486	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.3	175.6	-53.5	-167.6	120.8	0	0	108	R478 L480	E392-R478 WeakPolarHBondContact CA-O 3.05Å; E392-R478 HydrophobicContact CG-CB 4.26Å; E392-R478 WeakPolarHBondContact OE1-CD 3.38Å; E392-R478 IonicContact OE1-CZ 3.35Å; E392-R478 IonicContact OE1-NE 2.92Å; E392-R478 IonicContact OE1-NH1 3.96Å; E392-R478 PolarHBondContact OE1-NH1 2.84Å; E392-L480 HydrophobicContact CB-CD1 4.12Å; E392-L480 HydrophobicContact CB-CD2 4.44Å; E392-L480 HydrophobicContact CB-CG 4.34Å
393	V	95	Very high	94.5	Very high	8 Å²	8	69.7 Å²	69.7	5%	0.048	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	138.3	-170	72.3	0	0	0	0	110.3	I397 I403 L447 V477 R478 I479 L480	V393-I397 HydrophobicContact CG2-CB 4.23Å; V393-I397 HydrophobicContact CG2-CD1 3.37Å; V393-I397 HydrophobicContact CG2-CG1 4.4Å; V393-I397 HydrophobicContact CG2-CG2 3.96Å; V393-I403 HydrophobicContact CB-CG2 3.81Å; V393-I403 HydrophobicContact CG1-CG2 4.47Å; V393-I403 HydrophobicContact CG2-CG2 3.88Å; V393-L447 HydrophobicContact CG1-CD1 3.62Å; V393-L447 HydrophobicContact CG2-CD1 4.39Å; V393-V477 HydrophobicContact CG1-CG1 3.7Å; V393-R478 PolarHBondContact N-O 2.9Å; V393-I479 CarbonylContact O-C 3.55Å; V393-I479 VanDerWaalsContact O-CA 3.32Å; V393-I479 WeakPolarHBondContact O-CA 3.37Å; V393-L480 PolarHBondContact O-N 2.89Å
394	H	93.6	Very high	94.5	Very high	94 Å²	94	67.2 Å²	67.2	44%	0.435	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	152.2	171.2	-68.3	-85.8	0	0	0	110.8	D396 I397 V482	H394-D396 WeakPolarHBondContact CB-OD1 3.48Å; H394-I397 WeakPolarHBondContact O-CB 3.23Å; H394-I397 VanDerWaalsContact O-CG2 3.22Å; H394-I397 WeakPolarHBondContact O-CG2 3.39Å; H394-V482 HydrophobicContact CB-CG2 3.95Å
395	E	93.7	Very high	94.6	Very high	17 Å²	17	69.5 Å²	69.5	8%	0.079	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-25.2	-179.6	60.6	-155	116.5	0	0	114.7	I397 L447 R449 I479 L480 D481 V482	E395-I397 PolarHBondContact O-N 3.35Å; E395-I397 VanDerWaalsContact O-N 3.09Å; E395-L447 HydrophobicContact CB-CB 4.07Å; E395-R449 VanDerWaalsContact CD-CB 3.45Å; E395-R449 VanDerWaalsContact OE1-CB 3.31Å; E395-R449 WeakPolarHBondContact OE1-CB 3.21Å; E395-R449 WeakPolarHBondContact OE2-CB 3.26Å; E395-R449 PolarHBondContact OE2-N 2.89Å; E395-I479 HydrophobicContact CB-CG2 3.72Å; E395-L480 PolarHBondContact N-O 2.85Å; E395-D481 WeakPolarHBondContact OE1-CA 3.4Å; E395-V482 HydrophobicContact CG-CB 4.01Å; E395-V482 HydrophobicContact CG-CG2 4.11Å; E395-V482 PolarHBondContact OE1-N 3.25Å
396	D	92.6	Very high	94.7	Very high	117 Å²	117	65.9 Å²	65.9	63%	0.626	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	0.5	176.4	75.2	-26.6	0	0	0	114.3	H394 E398 V482	H394-D396 WeakPolarHBondContact CB-OD1 3.48Å; D396-E398 PolarHBondContact O-N 2.6Å; D396-V482 HydrophobicContact CB-CG1 4.37Å; D396-V482 HydrophobicContact CB-CG2 4.37Å
397	I	93.5	Very high	94.6	Very high	35 Å²	35	63.9 Å²	63.9	18%	0.179	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.3	132.5	-175	-168.2	167.2	0	0	0	113.2	V393 H394 E395 V399 T401 T443 L447	V393-I397 HydrophobicContact CG2-CB 4.23Å; V393-I397 HydrophobicContact CG2-CD1 3.37Å; V393-I397 HydrophobicContact CG2-CG1 4.4Å; V393-I397 HydrophobicContact CG2-CG2 3.96Å; H394-I397 WeakPolarHBondContact O-CB 3.23Å; H394-I397 VanDerWaalsContact O-CG2 3.22Å; H394-I397 WeakPolarHBondContact O-CG2 3.39Å; E395-I397 PolarHBondContact O-N 3.35Å; E395-I397 VanDerWaalsContact O-N 3.09Å; I397-V399 PolarHBondContact O-N 2.63Å; I397-T401 HydrophobicContact CD1-CG2 3.74Å; I397-T401 HydrophobicContact CG1-CG2 4.02Å; I397-T443 HydrophobicContact CG2-CG2 3.97Å; I397-L447 HydrophobicContact CG2-CD1 3.78Å; I397-L447 HydrophobicContact CG2-CG 4.28Å
398	E	94.5	Very high	94.6	Very high	159 Å²	159	59.3 Å²	59.3	74%	0.743	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-59.4	136.2	177.5	-67.5	-169.7	173.9	0	0	112.3	D396 G400 T401 T443	D396-E398 PolarHBondContact O-N 2.6Å; E398-G400 PolarHBondContact O-N 2.72Å; E398-T401 VanDerWaalsContact O-CB 3.31Å; E398-T401 WeakPolarHBondContact O-CB 3.41Å; E398-T401 PolarHBondContact O-N 2.85Å; E398-T401 VanDerWaalsContact O-N 3.14Å; E398-T401 PolarHBondContact O-OG1 2.94Å; E398-T443 PolarHBondContact O-OG1 3.17Å
399	V	94.2	Very high	94.3	Very high	84 Å²	84	65.3 Å²	65.3	51%	0.509	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	121.6	-179.9	-175.2	0	0	0	0	110.2	I397 T443 P446	I397-V399 PolarHBondContact O-N 2.63Å; V399-T443 WeakPolarHBondContact CA-OG1 3.39Å; V399-P446 HydrophobicContact CG2-CB 4.49Å
400	G	92.8	Very high	94	Very high	45 Å²	45	65.3 Å²	65.3	46%	0.464	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.4	-6.9	-174	0	0	0	0	0	113.7	E398 T443	E398-G400 PolarHBondContact O-N 2.72Å; G400-T443 VanDerWaalsContact CA-O 3.3Å; G400-T443 WeakPolarHBondContact CA-O 3.42Å; G400-T443 PolarHBondContact N-O 3.35Å; G400-T443 PolarHBondContact N-OG1 3.46Å
401	T	94.4	Very high	93.7	Very high	53 Å²	53	62.6 Å²	62.6	33%	0.325	33%	0.33	S	S	.	.			trans	-71.6	137.2	179.4	-53.2	0	0	0	0	111.6	I397 E398 I403 Y442 T443	I397-T401 HydrophobicContact CD1-CG2 3.74Å; I397-T401 HydrophobicContact CG1-CG2 4.02Å; E398-T401 VanDerWaalsContact O-CB 3.31Å; E398-T401 WeakPolarHBondContact O-CB 3.41Å; E398-T401 PolarHBondContact O-N 2.85Å; E398-T401 VanDerWaalsContact O-N 3.14Å; E398-T401 PolarHBondContact O-OG1 2.94Å; T401-I403 PolarHBondContact O-N 3.33Å; T401-Y442 WeakPolarHBondContact O-CA 3.5Å; T401-Y442 VanDerWaalsContact O-CB 3.29Å; T401-Y442 WeakPolarHBondContact O-CB 3.4Å; T401-T443 PolarHBondContact N-OG1 2.65Å; T401-T443 PolarHBondContact O-N 3.09Å
402	I	95.4	Very high	93.2	Very high	88 Å²	88	62.7 Å²	62.7	45%	0.451	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.3	175.9	-62.8	170.2	0	0	0	109.4	L441	I402-L441 CarbonylContact C-O 3.57Å; I402-L441 WeakPolarHBondContact CA-O 3.19Å
403	I	94.1	Very high	92.5	Very high	28 Å²	28	59.9 Å²	59.9	14%	0.144	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-32	-179.1	-39	177.2	0	0	0	111	F391 V393 T401 F432 L441 T443	F391-I403 HydrophobicContact CB-CG2 3.93Å; V393-I403 HydrophobicContact CB-CG2 3.81Å; V393-I403 HydrophobicContact CG1-CG2 4.47Å; V393-I403 HydrophobicContact CG2-CG2 3.88Å; T401-I403 PolarHBondContact O-N 3.33Å; I403-F432 HydrophobicContact CD1-CD1 3.66Å; I403-F432 HydrophobicContact CD1-CE1 3.5Å; I403-F432 VanDerWaalsContact CD1-CE1 3.5Å; I403-L441 PolarHBondContact N-O 3.38Å; I403-T443 HydrophobicContact CD1-CG2 3.79Å; I403-T443 HydrophobicContact CG1-CG2 4.2Å
404	G	94.2	Very high	91.4	Very high	14 Å²	14	67.6 Å²	67.6	14%	0.144	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.8	-178.8	-178.6	0	0	0	0	0	113.3	S440 L441	G404-S440 WeakPolarHBondContact O-CA 3.25Å; G404-L441 PolarHBondContact O-N 3.49Å
405	T	95.9	Very high	90.5	Very high	70 Å²	70	68 Å²	68	43%	0.429	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.1	177.9	49	0	0	0	0	111.4	G439 S440	T405-G439 WeakPolarHBondContact CA-O 3.25Å; T405-S440 WeakPolarHBondContact CG2-OG 3.4Å
406	V	95.6	Very high	89.7	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.006	38%	0.383	C	S	.	.			trans	-93.7	158.4	160.4	-59.6	0	0	0	0	109.7	F384 Y389 F420 I434 G439 V459 V475	F384-V406 HydrophobicContact CD1-CB 4.42Å; F384-V406 HydrophobicContact CE1-CB 4.14Å; F384-V406 HydrophobicContact CE1-CG2 4.03Å; Y389-V406 HydrophobicContact CD1-CG1 4.37Å; Y389-V406 HydrophobicContact CD2-CB 4.43Å; Y389-V406 HydrophobicContact CD2-CG1 3.75Å; Y389-V406 HydrophobicContact CE1-CB 4.49Å; Y389-V406 HydrophobicContact CE1-CG1 4.49Å; Y389-V406 HydrophobicContact CE2-CB 4.03Å; Y389-V406 HydrophobicContact CE2-CG1 3.86Å; Y389-V406 HydrophobicContact CG-CG1 4.03Å; V406-F420 HydrophobicContact CG2-CD1 3.79Å; V406-F420 HydrophobicContact CG2-CE1 4.04Å; V406-I434 HydrophobicContact CG2-CD1 4.02Å; V406-G439 PolarHBondContact N-O 3.49Å; V406-V459 HydrophobicContact CG2-CG1 3.96Å; V406-V475 HydrophobicContact CG1-CG2 3.93Å
407	M	93.7	Very high	89.4	Confident	120 Å²	120	66.4 Å²	66.4	59%	0.591	38%	0.375	S	S	*	.			trans	-138.7	138.4	174.8	-62.5	176.6	71.6	0	0	109.8	F384 S385 Y389	F384-M407 CarbonylContact C-O 3.58Å; F384-M407 WeakPolarHBondContact CA-O 3.01Å; S385-M407 PolarHBondContact N-O 3.35Å; S385-M407 PolarHBondContact OG-O 2.81Å; Y389-M407 PolarHBondContact OH-N 2.8Å; Y389-M407 PolarHBondContact OH-O 2.96Å; Y389-M407 VanDerWaalsContact OH-O 3.11Å
408	A	92.5	Very high	89.3	Confident	22 Å²	22	65.7 Å²	65.7	18%	0.182	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	165.1	170.3	0	0	0	0	0	109.8	V383 F384 I418 F420 A461	V383-A408 CarbonylContact O-C 3.48Å; V383-A408 WeakPolarHBondContact O-CA 3.37Å; F384-A408 HydrophobicContact CD1-CB 4Å; F384-A408 HydrophobicContact CE1-CB 4.3Å; F384-A408 HydrophobicContact CG-CB 4.28Å; A408-I418 HydrophobicContact CB-CD1 4.14Å; A408-I418 WeakPolarHBondContact O-CD1 3.46Å; A408-F420 HydrophobicContact CB-CE1 3.84Å; A408-F420 HydrophobicContact CB-CZ 4.08Å; A408-A461 HydrophobicContact CB-CB 4Å
409	R	91.1	Very high	89.3	Confident	182 Å²	182	64 Å²	64	69%	0.687	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	145	175	66.2	-176.4	-176.5	178.9	4.4	109.2	P382 V383	P382-R409 CarbonylContact C-O 3.48Å; V383-R409 PolarHBondContact N-O 3.43Å; V383-R409 PolarHBondContact O-N 2.77Å
410	D	90.3	Very high	89.3	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.037	34%	0.337	C	S	.	.			trans	-71.6	143.1	163.2	-84.4	24.3	0	0	0	109.1	P382 S413 S416 E463	P382-D410 WeakPolarHBondContact CB-OD1 3.24Å; P382-D410 VanDerWaalsContact CG-OD1 3.3Å; P382-D410 WeakPolarHBondContact CG-OD1 3.06Å; D410-S413 WeakPolarHBondContact CB-O 3.39Å; D410-S416 WeakPolarHBondContact OD2-CB 3.4Å; D410-S416 PolarHBondContact OD2-OG 2.73Å; D410-E463 WeakPolarHBondContact OD2-CG 3.44Å
411	P	88.9	Confident	89.4	Confident	36 Å²	36	61 Å²	61	23%	0.234	33%	0.332	C	S	.	.	S	Bend	trans	-62.7	-52.3	161.8	-22.3	35.9	0	0	0	111.5	E339 E380 V383 S413	E339-P411 VanDerWaalsContact CG-O 3.31Å; E339-P411 WeakPolarHBondContact CG-O 3.36Å; E380-P411 HydrophobicContact CB-CB 4.32Å; E380-P411 HydrophobicContact CB-CG 3.8Å; E380-P411 HydrophobicContact CG-CG 4.47Å; E380-P411 VanDerWaalsContact OE1-CG 3.28Å; E380-P411 WeakPolarHBondContact OE1-CG 3.13Å; V383-P411 HydrophobicContact CG2-CG 4.02Å; P411-S413 PolarHBondContact O-N 2.91Å
412	D	87.2	Confident	89.5	Confident	33 Å²	33	59 Å²	59	18%	0.176	32%	0.319	C	S	.	.	S	Bend	trans	-62.6	-40.4	-167.6	-34	-110.7	0	0	0	112.3	D379 E380	D379-D412 WeakPolarHBondContact CA-OD1 3.4Å; D379-D412 PolarHBondContact N-OD1 2.91Å; E380-D412 PolarHBondContact N-OD1 3.05Å; E380-D412 PolarHBondContact N-OD2 2.83Å
413	S	80.3	Confident	89.5	Confident	45 Å²	45	56.2 Å²	56.2	32%	0.315	31%	0.305	S	S	.	.			trans	-151.8	115.2	-179.9	-178	0	0	0	0	112.9	D410 P411 S415 S416	D410-S413 WeakPolarHBondContact CB-O 3.39Å; P411-S413 PolarHBondContact O-N 2.91Å; S413-S415 PolarHBondContact O-N 2.96Å; S413-S415 PolarHBondContact OG-OG 3.05Å; S413-S416 PolarHBondContact O-N 3.46Å; S413-S416 PolarHBondContact O-OG 3.39Å
414	I	71.6	Confident	89.4	Confident	169 Å²	169	59.1 Å²	59.1	87%	0.867	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-17.8	175.8	-61.3	171.1	0	0	0	112.7
415	S	75.3	Confident	89.3	Confident	104 Å²	104	66 Å²	66	73%	0.727	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	4.6	177.8	65.8	0	0	0	0	115.6	S413	S413-S415 PolarHBondContact O-N 2.96Å; S413-S415 PolarHBondContact OG-OG 3.05Å
416	S	76	Confident	89.1	Confident	30 Å²	30	65 Å²	65	21%	0.21	34%	0.336	C	S	.	.			trans	-61.8	132.1	176.7	-68.7	0	0	0	0	112	D410 S413 I418	D410-S416 WeakPolarHBondContact OD2-CB 3.4Å; D410-S416 PolarHBondContact OD2-OG 2.73Å; S413-S416 PolarHBondContact O-N 3.46Å; S413-S416 PolarHBondContact O-OG 3.39Å; S416-I418 PolarHBondContact O-N 3.5Å
417	P	86.9	Confident	88.9	Confident	69 Å²	69	65.2 Å²	65.2	45%	0.448	34%	0.337	S	S	.	.			trans	-83.3	96.9	-177.3	32.3	-32.6	0	0	0	110.9	I464	P417-I464 HydrophobicContact CB-CD1 4.26Å; P417-I464 HydrophobicContact CG-CB 4.28Å; P417-I464 VanDerWaalsContact O-CB 3.23Å; P417-I464 WeakPolarHBondContact O-CB 3.46Å; P417-I464 VanDerWaalsContact O-CD1 3.25Å; P417-I464 WeakPolarHBondContact O-CD1 3.31Å; P417-I464 WeakPolarHBondContact O-CG1 3.16Å; P417-I464 PolarHBondContact O-N 3.04Å
418	I	91.3	Very high	88.7	Confident	21 Å²	21	65.9 Å²	65.9	11%	0.108	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	141	-178.4	-61.1	164.7	0	0	0	112.1	P382 A408 S416 F420 A461	P382-I418 HydrophobicContact CB-CD1 3.75Å; P382-I418 HydrophobicContact CB-CG1 3.96Å; P382-I418 HydrophobicContact CB-CG2 4.37Å; P382-I418 HydrophobicContact CG-CG1 4.23Å; P382-I418 HydrophobicContact CG-CG2 4.45Å; A408-I418 HydrophobicContact CB-CD1 4.14Å; A408-I418 WeakPolarHBondContact O-CD1 3.46Å; S416-I418 PolarHBondContact O-N 3.5Å; I418-F420 HydrophobicContact CB-CE2 4.44Å; I418-F420 HydrophobicContact CB-CZ 4.45Å; I418-F420 HydrophobicContact CG2-CE1 4.15Å; I418-F420 HydrophobicContact CG2-CE2 4.04Å; I418-F420 HydrophobicContact CG2-CZ 3.82Å; I418-A461 HydrophobicContact CG2-CB 3.98Å
419	R	93.4	Very high	88.6	Confident	123 Å²	123	69.9 Å²	69.9	46%	0.464	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.7	170.6	-177	178.2	-63.4	168.7	6.3	111.6	S436 A462 I464	R419-S436 WeakPolarHBondContact CA-O 3.19Å; R419-A462 PolarHBondContact N-O 2.98Å; R419-A462 PolarHBondContact O-N 3.31Å; R419-I464 HydrophobicContact CB-CD1 4.26Å; R419-I464 HydrophobicContact CB-CG1 3.76Å
420	F	95.4	Very high	88.7	Confident	15 Å²	15	69.3 Å²	69.3	7%	0.066	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	144.6	172.6	-58.8	-83.1	0	0	0	111.9	F384 V406 A408 I418 I434 S436 I460 A461	F384-F420 HydrophobicContact CE1-CD1 4.19Å; F384-F420 AromaticContact CE1-CE1 3.98Å; F384-F420 HydrophobicContact CE1-CE1 3.98Å; V406-F420 HydrophobicContact CG2-CD1 3.79Å; V406-F420 HydrophobicContact CG2-CE1 4.04Å; A408-F420 HydrophobicContact CB-CE1 3.84Å; A408-F420 HydrophobicContact CB-CZ 4.08Å; I418-F420 HydrophobicContact CB-CE2 4.44Å; I418-F420 HydrophobicContact CB-CZ 4.45Å; I418-F420 HydrophobicContact CG2-CE1 4.15Å; I418-F420 HydrophobicContact CG2-CE2 4.04Å; I418-F420 HydrophobicContact CG2-CZ 3.82Å; F420-I434 HydrophobicContact CB-CD1 3.94Å; F420-I434 HydrophobicContact CB-CG1 4.31Å; F420-S436 PolarHBondContact N-O 3.1Å; F420-S436 WeakPolarHBondContact O-CA 3.3Å; F420-I460 CarbonylContact C-O 3.57Å; F420-I460 WeakPolarHBondContact CA-O 3.48Å; F420-A461 HydrophobicContact CD1-CB 4.18Å; F420-A461 HydrophobicContact CE1-CB 4.09Å
421	S	95	Very high	88.8	Confident	51 Å²	51	70.2 Å²	70.2	36%	0.357	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	161	174.3	63.5	0	0	0	0	111.9	V459 I460	S421-V459 WeakPolarHBondContact O-CG1 3.22Å; S421-I460 PolarHBondContact N-O 3.36Å; S421-I460 PolarHBondContact O-N 3.33Å
422	L	95.4	Very high	89.1	Confident	11 Å²	11	68.5 Å²	68.5	6%	0.058	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.2	180	-163.5	75.7	0	0	0	110.4	R424 D427 F432 I434 L441 L457 V459	L422-R424 PolarHBondContact O-N 3.04Å; L422-D427 HydrophobicContact CD2-CB 3.76Å; L422-D427 WeakPolarHBondContact CD2-OD2 3.45Å; L422-F432 HydrophobicContact CD2-CB 4.19Å; L422-I434 HydrophobicContact CB-CG2 4.18Å; L422-L441 HydrophobicContact CD1-CD1 4.25Å; L422-L457 HydrophobicContact CD1-CB 4.18Å; L422-L457 HydrophobicContact CD1-CD1 4.45Å; L422-V459 HydrophobicContact CD1-CG2 3.77Å
423	D	94.7	Very high	89.5	Confident	30 Å²	30	69.2 Å²	69.2	16%	0.16	36%	0.356	C	S	.	.			trans	-71.4	108.9	174.3	-164.2	-31.3	0	0	0	110.2	H425 T426 T458 I460	D423-H425 PolarHBondContact O-N 3.43Å; D423-H425 VanDerWaalsContact O-N 3.14Å; D423-H425 IonicContact OD1-CE1 2.82Å; D423-H425 IonicContact OD1-CG 2.83Å; D423-H425 PolarHBondContact OD1-N 3.23Å; D423-H425 VanDerWaalsContact OD1-N 3.08Å; D423-H425 IonicContact OD1-ND1 3.23Å; D423-H425 PolarHBondContact OD1-ND1 3.47Å; D423-T426 HydrophobicContact CB-CG2 4.45Å; D423-T426 PolarHBondContact O-N 3.33Å; D423-T426 PolarHBondContact O-OG1 3.48Å; D423-T458 HydrophobicContact CB-CG2 4.19Å; D423-T458 PolarHBondContact N-O 3.48Å; D423-I460 HydrophobicContact CB-CD1 4.06Å; D423-I460 HydrophobicContact CB-CG1 4.28Å
424	R	92.4	Very high	90.3	Very high	88 Å²	88	67.7 Å²	67.7	33%	0.332	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-3.7	-174.9	-58.7	-55.5	-179.4	173.3	-3.9	114.4	L422 T426 D427 F432 N433	L422-R424 PolarHBondContact O-N 3.04Å; R424-T426 VanDerWaalsContact C-N 3.3Å; R424-D427 IonicContact NH1-OD2 3.64Å; R424-D427 PolarHBondContact NH1-OD2 3.4Å; R424-D427 CarbonylContact O-C 3.45Å; R424-F432 PolarHBondContact NH1-O 2.93Å; R424-N433 PolarHBondContact NH2-OD1 2.68Å
425	H	92	Very high	91.4	Very high	159 Å²	159	63.6 Å²	63.6	74%	0.736	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.5	165.4	-52.7	94.2	0	0	0	112.3	D423	D423-H425 PolarHBondContact O-N 3.43Å; D423-H425 VanDerWaalsContact O-N 3.14Å; D423-H425 IonicContact OD1-CE1 2.82Å; D423-H425 IonicContact OD1-CG 2.83Å; D423-H425 PolarHBondContact OD1-N 3.23Å; D423-H425 VanDerWaalsContact OD1-N 3.08Å; D423-H425 IonicContact OD1-ND1 3.23Å; D423-H425 PolarHBondContact OD1-ND1 3.47Å
426	T	92.7	Very high	92.3	Very high	49 Å²	49	62.1 Å²	62.1	30%	0.301	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-14.9	177.2	66.2	0	0	0	0	113.9	D423 R424 T458	D423-T426 HydrophobicContact CB-CG2 4.45Å; D423-T426 PolarHBondContact O-N 3.33Å; D423-T426 PolarHBondContact O-OG1 3.48Å; R424-T426 VanDerWaalsContact C-N 3.3Å; T426-T458 PolarHBondContact OG1-N 2.81Å
427	D	91.3	Very high	93	Very high	5 Å²	5	63.9 Å²	63.9	3%	0.027	33%	0.334	C	S	.	.			trans	-136.7	72.4	176	179.7	22.4	0	0	0	109.4	L422 R424 D429 R430 I431 F432 L457	L422-D427 HydrophobicContact CD2-CB 3.76Å; L422-D427 WeakPolarHBondContact CD2-OD2 3.45Å; R424-D427 IonicContact NH1-OD2 3.64Å; R424-D427 PolarHBondContact NH1-OD2 3.4Å; R424-D427 CarbonylContact O-C 3.45Å; D427-D429 VanDerWaalsContact C-N 3.3Å; D427-D429 PolarHBondContact O-N 3.16Å; D427-R430 PolarHBondContact O-N 2.81Å; D427-R430 VanDerWaalsContact OD1-CA 3.29Å; D427-R430 WeakPolarHBondContact OD1-CA 3.34Å; D427-R430 PolarHBondContact OD1-N 3.36Å; D427-R430 VanDerWaalsContact OD2-CA 3.24Å; D427-R430 WeakPolarHBondContact OD2-CA 3.33Å; D427-I431 PolarHBondContact OD1-N 3.07Å; D427-I431 PolarHBondContact OD2-N 2.85Å; D427-F432 PolarHBondContact OD2-N 2.94Å; D427-F432 VanDerWaalsContact OD2-O 3.05Å; D427-L457 HydrophobicContact CB-CD2 3.93Å
428	L	89.4	Confident	93.2	Very high	135 Å²	135	65 Å²	65	71%	0.707	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-40	-179.2	-65.9	171.9	0	0	0	111.3	R430	L428-R430 VanDerWaalsContact C-N 3.3Å; L428-R430 PolarHBondContact O-N 2.89Å
429	D	89.8	Confident	93.3	Very high	105 Å²	105	64 Å²	64	56%	0.561	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.4	-179.8	-82	-69.6	0	0	0	114	D427 I431 K445	D427-D429 VanDerWaalsContact C-N 3.3Å; D427-D429 PolarHBondContact O-N 3.16Å; D429-I431 VanDerWaalsContact C-N 3.34Å; D429-I431 HydrophobicContact CB-CD1 4.12Å; D429-I431 HydrophobicContact CB-CG1 3.87Å; D429-K445 WeakPolarHBondContact O-CE 3.07Å; D429-K445 PolarHBondContact O-NZ 2.99Å; D429-K445 IonicContact OD1-NZ 2.72Å
430	R	92.7	Very high	93.5	Very high	171 Å²	171	58.4 Å²	58.4	65%	0.645	31%	0.311	S	S	*	.			trans	61	43.3	-179.3	-49.5	-179.2	-175.4	-164.5	-0.7	112.2	D427 L428 F432	D427-R430 PolarHBondContact O-N 2.81Å; D427-R430 VanDerWaalsContact OD1-CA 3.29Å; D427-R430 WeakPolarHBondContact OD1-CA 3.34Å; D427-R430 PolarHBondContact OD1-N 3.36Å; D427-R430 VanDerWaalsContact OD2-CA 3.24Å; D427-R430 WeakPolarHBondContact OD2-CA 3.33Å; L428-R430 VanDerWaalsContact C-N 3.3Å; L428-R430 PolarHBondContact O-N 2.89Å; R430-F432 VanDerWaalsContact C-N 3.27Å
431	I	93.8	Very high	93.5	Very high	26 Å²	26	57.8 Å²	57.8	13%	0.133	31%	0.308	C	S	.	.			trans	-69.2	-31.3	176.1	-59.6	170.9	0	0	0	109.9	D427 D429 S444 K445 L447 H455	D427-I431 PolarHBondContact OD1-N 3.07Å; D427-I431 PolarHBondContact OD2-N 2.85Å; D429-I431 VanDerWaalsContact C-N 3.34Å; D429-I431 HydrophobicContact CB-CD1 4.12Å; D429-I431 HydrophobicContact CB-CG1 3.87Å; I431-S444 PolarHBondContact O-N 3.39Å; I431-K445 HydrophobicContact CG1-CD 4.07Å; I431-K445 HydrophobicContact CG2-CB 4.47Å; I431-K445 PolarHBondContact O-N 2.85Å; I431-L447 HydrophobicContact CG2-CD2 3.46Å; I431-L447 VanDerWaalsContact CG2-CD2 3.46Å; I431-H455 VanDerWaalsContact CD1-CE1 3.48Å; I431-H455 WeakPolarHBondContact CD1-CE1 3.45Å
432	F	95.5	Very high	93.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	154.5	-175.8	-55.6	-84.3	0	0	0	112.4	I403 L422 R424 D427 R430 L441 L447 H455 L457 V477	I403-F432 HydrophobicContact CD1-CD1 3.66Å; I403-F432 HydrophobicContact CD1-CE1 3.5Å; I403-F432 VanDerWaalsContact CD1-CE1 3.5Å; L422-F432 HydrophobicContact CD2-CB 4.19Å; R424-F432 PolarHBondContact NH1-O 2.93Å; D427-F432 PolarHBondContact OD2-N 2.94Å; D427-F432 VanDerWaalsContact OD2-O 3.05Å; R430-F432 VanDerWaalsContact C-N 3.27Å; F432-L441 HydrophobicContact CB-CD1 4.15Å; F432-L447 HydrophobicContact CE1-CD2 4.22Å; F432-L447 HydrophobicContact CZ-CD2 3.89Å; F432-H455 HydrophobicContact CE2-CB 3.7Å; F432-H455 AromaticContact CE2-CD2 3.66Å; F432-H455 AromaticContact CE2-CG 3.53Å; F432-H455 HydrophobicContact CZ-CB 4.17Å; F432-H455 AromaticContact CZ-CD2 3.64Å; F432-H455 AromaticContact CZ-CG 3.96Å; F432-L457 HydrophobicContact CB-CD1 4Å; F432-L457 HydrophobicContact CD1-CD1 4.33Å; F432-L457 HydrophobicContact CD2-CD1 3.73Å; F432-L457 HydrophobicContact CD2-CD2 3.77Å; F432-L457 HydrophobicContact CD2-CG 4.32Å; F432-L457 HydrophobicContact CE2-CD1 4.32Å; F432-L457 HydrophobicContact CE2-CD2 4.32Å; F432-L457 HydrophobicContact CG-CD1 3.74Å; F432-L457 HydrophobicContact CG-CD2 4.49Å; F432-V477 HydrophobicContact CE1-CG1 4.07Å; F432-V477 HydrophobicContact CE1-CG2 4.36Å; F432-V477 HydrophobicContact CZ-CB 4.33Å; F432-V477 HydrophobicContact CZ-CG1 4.1Å; F432-V477 HydrophobicContact CZ-CG2 4.5Å
433	N	95.1	Very high	93.5	Very high	48 Å²	48	57.1 Å²	57.1	26%	0.257	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.3	173.1	-158.8	16.2	0	0	0	110.8	R424 L441 Y442 S444	R424-N433 PolarHBondContact NH2-OD1 2.68Å; N433-L441 WeakPolarHBondContact O-CA 3.23Å; N433-Y442 HydrophobicContact CB-CD2 4.43Å; N433-Y442 HydrophobicContact CB-CE1 4Å; N433-Y442 HydrophobicContact CB-CE2 3.87Å; N433-Y442 PolarHBondContact N-O 3.1Å; N433-Y442 PolarHBondContact ND2-OH 3.44Å; N433-Y442 WeakPolarHBondContact O-CD1 3.42Å; N433-Y442 PolarHBondContact O-N 3.47Å; N433-S444 VanDerWaalsContact CB-OG 3.26Å; N433-S444 WeakPolarHBondContact CB-OG 3.39Å
434	I	96.3	Very high	93.5	Very high	13 Å²	13	58 Å²	58	7%	0.067	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.1	-172.2	-170.6	165.3	0	0	0	111.3	V406 F420 L422 S436 S440 L441 V459	V406-I434 HydrophobicContact CG2-CD1 4.02Å; F420-I434 HydrophobicContact CB-CD1 3.94Å; F420-I434 HydrophobicContact CB-CG1 4.31Å; L422-I434 HydrophobicContact CB-CG2 4.18Å; I434-S436 PolarHBondContact O-N 2.95Å; I434-S440 CarbonylContact C-O 3.48Å; I434-S440 WeakPolarHBondContact CA-O 3.1Å; I434-L441 HydrophobicContact CB-CD1 4.32Å; I434-V459 HydrophobicContact CD1-CG1 3.59Å; I434-V459 HydrophobicContact CD1-CG2 4.14Å
435	H	95.6	Very high	93.5	Very high	83 Å²	83	57.7 Å²	57.7	38%	0.384	31%	0.307	S	S	.	.			trans	-73.9	114.7	173.7	-75.6	-81.3	0	0	0	110.1	G437 N438 G439 S440 Y442	H435-G437 VanDerWaalsContact C-N 3.26Å; H435-G437 PolarHBondContact O-N 2.85Å; H435-G437 VanDerWaalsContact O-N 3.12Å; H435-N438 WeakPolarHBondContact CB-OD1 3.43Å; H435-N438 PolarHBondContact O-N 2.93Å; H435-N438 PolarHBondContact O-OD1 3.5Å; H435-G439 PolarHBondContact O-N 3.14Å; H435-S440 PolarHBondContact N-O 3.33Å; H435-Y442 AromaticContact CD2-CD1 3.39Å; H435-Y442 WeakPolarHBondContact CD2-CD1 3.48Å; H435-Y442 AromaticContact CD2-CE1 3.46Å; H435-Y442 VanDerWaalsContact CD2-CE1 3.46Å; H435-Y442 WeakPolarHBondContact CD2-CE1 3.31Å; H435-Y442 AromaticContact CG-CE1 3.96Å; H435-Y442 AromaticContact NE2-CD1 3.56Å; H435-Y442 AromaticContact NE2-CE1 3.53Å
436	S	93.5	Very high	93.6	Very high	73 Å²	73	54.8 Å²	54.8	51%	0.51	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.8	-164.8	59.6	0	0	0	0	115.7	R419 F420 I434	R419-S436 WeakPolarHBondContact CA-O 3.19Å; F420-S436 PolarHBondContact N-O 3.1Å; F420-S436 WeakPolarHBondContact O-CA 3.3Å; I434-S436 PolarHBondContact O-N 2.95Å
437	G	90.6	Very high	93.7	Very high	67 Å²	67	53.3 Å²	53.3	69%	0.691	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-1.9	-177.2	0	0	0	0	0	115.8	H435	H435-G437 VanDerWaalsContact C-N 3.26Å; H435-G437 PolarHBondContact O-N 2.85Å; H435-G437 VanDerWaalsContact O-N 3.12Å
438	N	91.7	Very high	93.8	Very high	91 Å²	91	56.5 Å²	56.5	49%	0.487	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.5	-1.1	-179.2	78.2	-20.1	0	0	0	114.8	H435 S440	H435-N438 WeakPolarHBondContact CB-OD1 3.43Å; H435-N438 PolarHBondContact O-N 2.93Å; H435-N438 PolarHBondContact O-OD1 3.5Å; N438-S440 VanDerWaalsContact C-N 3.31Å; N438-S440 PolarHBondContact ND2-OG 3.27Å; N438-S440 PolarHBondContact O-N 3.29Å; N438-S440 PolarHBondContact OD1-N 3.49Å; N438-S440 VanDerWaalsContact OD1-N 3.15Å; N438-S440 PolarHBondContact OD1-OG 3.06Å
439	G	93.4	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.			trans	74.9	10.1	176	0	0	0	0	0	115.7	T405 V406 H435 L441	T405-G439 WeakPolarHBondContact CA-O 3.25Å; V406-G439 PolarHBondContact N-O 3.49Å; H435-G439 PolarHBondContact O-N 3.14Å; G439-L441 PolarHBondContact O-N 3.09Å
440	S	96.1	Very high	94.1	Very high	7 Å²	7	48 Å²	48	5%	0.049	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	117.4	176.4	-64.2	0	0	0	0	111.9	G404 T405 I434 H435 N438	G404-S440 WeakPolarHBondContact O-CA 3.25Å; T405-S440 WeakPolarHBondContact CG2-OG 3.4Å; I434-S440 CarbonylContact C-O 3.48Å; I434-S440 WeakPolarHBondContact CA-O 3.1Å; H435-S440 PolarHBondContact N-O 3.33Å; N438-S440 VanDerWaalsContact C-N 3.31Å; N438-S440 PolarHBondContact ND2-OG 3.27Å; N438-S440 PolarHBondContact O-N 3.29Å; N438-S440 PolarHBondContact OD1-N 3.49Å; N438-S440 VanDerWaalsContact OD1-N 3.15Å; N438-S440 PolarHBondContact OD1-OG 3.06Å
441	L	96.1	Very high	94.1	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133.7	174.9	-172.4	73.7	0	0	0	110	F391 I402 I403 G404 L422 F432 N433 I434 G439 L457 V475 V477	F391-L441 HydrophobicContact CD2-CD2 4.08Å; F391-L441 HydrophobicContact CE2-CD2 4.2Å; I402-L441 CarbonylContact C-O 3.57Å; I402-L441 WeakPolarHBondContact CA-O 3.19Å; I403-L441 PolarHBondContact N-O 3.38Å; G404-L441 PolarHBondContact O-N 3.49Å; L422-L441 HydrophobicContact CD1-CD1 4.25Å; F432-L441 HydrophobicContact CB-CD1 4.15Å; N433-L441 WeakPolarHBondContact O-CA 3.23Å; I434-L441 HydrophobicContact CB-CD1 4.32Å; G439-L441 PolarHBondContact O-N 3.09Å; L441-L457 HydrophobicContact CD1-CD1 4.36Å; L441-L457 HydrophobicContact CD2-CD1 3.96Å; L441-V475 HydrophobicContact CD2-CG1 4.1Å; L441-V477 HydrophobicContact CD2-CG2 4.13Å
442	Y	95.8	Very high	94	Very high	47 Å²	47	47.1 Å²	47.1	18%	0.184	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	156.3	-177.7	63.6	-84.9	0	0	0	113.2	T401 N433 H435	T401-Y442 WeakPolarHBondContact O-CA 3.5Å; T401-Y442 VanDerWaalsContact O-CB 3.29Å; T401-Y442 WeakPolarHBondContact O-CB 3.4Å; N433-Y442 HydrophobicContact CB-CD2 4.43Å; N433-Y442 HydrophobicContact CB-CE1 4Å; N433-Y442 HydrophobicContact CB-CE2 3.87Å; N433-Y442 PolarHBondContact N-O 3.1Å; N433-Y442 PolarHBondContact ND2-OH 3.44Å; N433-Y442 WeakPolarHBondContact O-CD1 3.42Å; N433-Y442 PolarHBondContact O-N 3.47Å; H435-Y442 AromaticContact CD2-CD1 3.39Å; H435-Y442 WeakPolarHBondContact CD2-CD1 3.48Å; H435-Y442 AromaticContact CD2-CE1 3.46Å; H435-Y442 VanDerWaalsContact CD2-CE1 3.46Å; H435-Y442 WeakPolarHBondContact CD2-CE1 3.31Å; H435-Y442 AromaticContact CG-CE1 3.96Å; H435-Y442 AromaticContact NE2-CD1 3.56Å; H435-Y442 AromaticContact NE2-CE1 3.53Å
443	T	95.4	Very high	93.8	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	139.3	175.4	52.2	0	0	0	0	111.5	I397 E398 V399 G400 T401 I403 L447	I397-T443 HydrophobicContact CG2-CG2 3.97Å; E398-T443 PolarHBondContact O-OG1 3.17Å; V399-T443 WeakPolarHBondContact CA-OG1 3.39Å; G400-T443 VanDerWaalsContact CA-O 3.3Å; G400-T443 WeakPolarHBondContact CA-O 3.42Å; G400-T443 PolarHBondContact N-O 3.35Å; G400-T443 PolarHBondContact N-OG1 3.46Å; T401-T443 PolarHBondContact N-OG1 2.65Å; T401-T443 PolarHBondContact O-N 3.09Å; I403-T443 HydrophobicContact CD1-CG2 3.79Å; I403-T443 HydrophobicContact CG1-CG2 4.2Å; T443-L447 HydrophobicContact CG2-CD1 4.22Å; T443-L447 HydrophobicContact CG2-CG 4.35Å
444	S	93.9	Very high	93.8	Very high	48 Å²	48	55 Å²	55	34%	0.336	30%	0.302	S	S	.	.	S	Bend	trans	-124.4	-4.9	176.1	-67.3	0	0	0	0	113.3	I431 N433	I431-S444 PolarHBondContact O-N 3.39Å; N433-S444 VanDerWaalsContact CB-OG 3.26Å; N433-S444 WeakPolarHBondContact CB-OG 3.39Å
445	K	93.5	Very high	93.7	Very high	82 Å²	82	55.6 Å²	55.6	36%	0.357	31%	0.305	S	S	.	.	S	Bend	trans	-136.6	162.5	168.8	-75.7	-179.8	163.8	-179	0	108.5	D429 I431	D429-K445 WeakPolarHBondContact O-CE 3.07Å; D429-K445 PolarHBondContact O-NZ 2.99Å; D429-K445 IonicContact OD1-NZ 2.72Å; I431-K445 HydrophobicContact CG1-CD 4.07Å; I431-K445 HydrophobicContact CG2-CB 4.47Å; I431-K445 PolarHBondContact O-N 2.85Å
446	P	93.6	Very high	93.6	Very high	98 Å²	98	56.5 Å²	56.5	64%	0.636	31%	0.312	S	S	*	.			trans	-58.2	158.2	162.2	28.5	-36.4	0	0	0	110.6	V399	V399-P446 HydrophobicContact CG2-CB 4.49Å
447	L	93.9	Very high	93.7	Very high	18 Å²	18	53.1 Å²	53.1	9%	0.094	29%	0.289	C	S	.	.			trans	-102.5	160.2	174.3	-65.8	-173.9	0	0	0	110	V393 E395 I397 I431 F432 T443 I479	V393-L447 HydrophobicContact CG1-CD1 3.62Å; V393-L447 HydrophobicContact CG2-CD1 4.39Å; E395-L447 HydrophobicContact CB-CB 4.07Å; I397-L447 HydrophobicContact CG2-CD1 3.78Å; I397-L447 HydrophobicContact CG2-CG 4.28Å; I431-L447 HydrophobicContact CG2-CD2 3.46Å; I431-L447 VanDerWaalsContact CG2-CD2 3.46Å; F432-L447 HydrophobicContact CE1-CD2 4.22Å; F432-L447 HydrophobicContact CZ-CD2 3.89Å; T443-L447 HydrophobicContact CG2-CD1 4.22Å; T443-L447 HydrophobicContact CG2-CG 4.35Å; L447-I479 HydrophobicContact CB-CD1 4.11Å; L447-I479 HydrophobicContact CD1-CD1 4.29Å; L447-I479 HydrophobicContact CD1-CG1 4.49Å; L447-I479 HydrophobicContact CD2-CD1 4.21Å; L447-I479 HydrophobicContact CG-CD1 4.43Å
448	D	93.5	Very high	94	Very high	71 Å²	71	51.5 Å²	51.5	38%	0.38	27%	0.266	S	S	.	.			trans	-157.3	109.3	-175.9	173.3	-26.3	0	0	0	106.3	E450 L451 S452	D448-E450 PolarHBondContact OD1-N 2.94Å; D448-L451 HydrophobicContact CB-CB 4.03Å; D448-L451 WeakPolarHBondContact OD1-CB 3.45Å; D448-L451 PolarHBondContact OD1-N 2.93Å; D448-S452 PolarHBondContact O-N 3.2Å; D448-S452 VanDerWaalsContact O-N 3.14Å
449	R	93.9	Very high	94.2	Very high	19 Å²	19	47.2 Å²	47.2	7%	0.072	24%	0.242	C	C	.	.	H	α-helix	trans	-79.1	-33.6	-171.7	-169.1	-134.8	64.1	137.7	-5.6	111.6	E395 L451 S452 Q453 I479 D481 K515	E395-R449 VanDerWaalsContact CD-CB 3.45Å; E395-R449 VanDerWaalsContact OE1-CB 3.31Å; E395-R449 WeakPolarHBondContact OE1-CB 3.21Å; E395-R449 WeakPolarHBondContact OE2-CB 3.26Å; E395-R449 PolarHBondContact OE2-N 2.89Å; R449-L451 PolarHBondContact O-N 2.84Å; R449-S452 CarbonylContact O-C 3.59Å; R449-S452 PolarHBondContact O-N 3.37Å; R449-Q453 HydrophobicContact CG-CG 4.08Å; R449-Q453 WeakPolarHBondContact O-CG 3.42Å; R449-Q453 PolarHBondContact O-N 2.85Å; R449-I479 HydrophobicContact CB-CB 4.25Å; R449-I479 HydrophobicContact CB-CG2 3.67Å; R449-I479 HydrophobicContact CG-CB 4.01Å; R449-I479 HydrophobicContact CG-CG2 3.85Å; R449-D481 WeakPolarHBondContact CD-OD1 3.27Å; R449-D481 IonicContact CZ-OD1 3.28Å; R449-D481 IonicContact NE-OD1 3.98Å; R449-D481 PolarHBondContact NE-OD1 3.23Å; R449-D481 IonicContact NH1-OD1 3.18Å; R449-D481 PolarHBondContact NH1-OD1 2.71Å; R449-D481 IonicContact NH2-OD1 2.66Å; R449-K515 PolarHBondContact NH2-O 3.46Å; R449-K515 VanDerWaalsContact NH2-O 3.07Å
450	E	92.6	Very high	94.3	Very high	43 Å²	43	48.3 Å²	48.3	20%	0.201	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-32.9	175.9	-73.7	56.6	-113.6	0	0	111.4	D448 K515	D448-E450 PolarHBondContact OD1-N 2.94Å; E450-K515 HydrophobicContact CB-CB 4.45Å; E450-K515 HydrophobicContact CB-CD 4.45Å; E450-K515 HydrophobicContact CG-CB 3.41Å; E450-K515 VanDerWaalsContact CG-CB 3.41Å; E450-K515 HydrophobicContact CG-CD 4.21Å; E450-K515 HydrophobicContact CG-CG 4.42Å
451	L	91.7	Very high	94.3	Very high	143 Å²	143	48 Å²	48	75%	0.749	25%	0.246	S	C	*	.	H	α-helix	trans	-77.1	-42.4	171.7	-173.8	67.9	0	0	0	112	D448 R449	D448-L451 HydrophobicContact CB-CB 4.03Å; D448-L451 WeakPolarHBondContact OD1-CB 3.45Å; D448-L451 PolarHBondContact OD1-N 2.93Å; R449-L451 PolarHBondContact O-N 2.84Å
452	S	91.7	Very high	94.1	Very high	35 Å²	35	48.4 Å²	48.4	25%	0.245	25%	0.25	C	C	.	.	H	α-helix	trans	-159.4	78.1	-172.2	-175.6	0	0	0	0	115.8	D448 R449 W454 H455 I479	D448-S452 PolarHBondContact O-N 3.2Å; D448-S452 VanDerWaalsContact O-N 3.14Å; R449-S452 CarbonylContact O-C 3.59Å; R449-S452 PolarHBondContact O-N 3.37Å; S452-W454 PolarHBondContact O-N 3.35Å; S452-W454 PolarHBondContact OG-O 3.01Å; S452-H455 PolarHBondContact OG-CE1 2.83Å; S452-I479 WeakPolarHBondContact O-CD1 3.47Å
453	Q	92.1	Very high	93.8	Very high	92 Å²	92	46.7 Å²	46.7	43%	0.43	24%	0.243	S	C	.	.	S	Bend	trans	-45.4	-26.3	174	-62.5	-178.4	-12.8	0	0	116.6	R449 I479	R449-Q453 HydrophobicContact CG-CG 4.08Å; R449-Q453 WeakPolarHBondContact O-CG 3.42Å; R449-Q453 PolarHBondContact O-N 2.85Å; Q453-I479 PolarHBondContact O-N 2.93Å
454	W	94.3	Very high	93.3	Very high	121 Å²	121	49.9 Å²	49.9	46%	0.458	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133.5	-176.7	-70.7	87.8	0	0	0	112.6	L390 S452 F476 V477 R478	L390-W454 HydrophobicContact CD1-CH2 4.3Å; L390-W454 HydrophobicContact CD1-CZ3 3.82Å; S452-W454 PolarHBondContact O-N 3.35Å; S452-W454 PolarHBondContact OG-O 3.01Å; W454-F476 HydrophobicContact CZ3-CB 4.37Å; W454-V477 WeakPolarHBondContact CA-O 3.25Å; W454-R478 HydrophobicContact CD2-CB 4.32Å; W454-R478 HydrophobicContact CD2-CG 4.29Å; W454-R478 HydrophobicContact CE3-CB 3.95Å; W454-R478 HydrophobicContact CE3-CG 4.38Å; W454-R478 HydrophobicContact CH2-CB 3.81Å; W454-R478 HydrophobicContact CH2-CG 3.83Å; W454-R478 HydrophobicContact CZ2-CB 4.17Å; W454-R478 HydrophobicContact CZ2-CG 3.7Å; W454-R478 HydrophobicContact CZ3-CB 3.69Å; W454-R478 HydrophobicContact CZ3-CG 4.17Å
455	H	94.2	Very high	92.8	Very high	26 Å²	26	53.7 Å²	53.7	12%	0.12	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123	168.5	-62.1	-79.5	0	0	0	111.2	I431 F432 S452 L457 V477	I431-H455 VanDerWaalsContact CD1-CE1 3.48Å; I431-H455 WeakPolarHBondContact CD1-CE1 3.45Å; F432-H455 HydrophobicContact CE2-CB 3.7Å; F432-H455 AromaticContact CE2-CD2 3.66Å; F432-H455 AromaticContact CE2-CG 3.53Å; F432-H455 HydrophobicContact CZ-CB 4.17Å; F432-H455 AromaticContact CZ-CD2 3.64Å; F432-H455 AromaticContact CZ-CG 3.96Å; S452-H455 PolarHBondContact OG-CE1 2.83Å; H455-L457 HydrophobicContact CB-CD2 4.36Å; H455-L457 HydrophobicContact CB-CG 4.48Å; H455-V477 HydrophobicContact CB-CB 4.34Å; H455-V477 PolarHBondContact N-O 2.86Å; H455-V477 PolarHBondContact O-N 3.07Å
456	N	94.8	Very high	92.4	Very high	102 Å²	102	51.6 Å²	51.6	55%	0.545	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	85.9	-176.8	-64.8	-17.3	0	0	0	109.7	F476	N456-F476 WeakPolarHBondContact OD1-CD1 3.33Å
457	L	95.5	Very high	91.9	Very high	3 Å²	3	51 Å²	51	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	151.1	-174.5	-52.8	176.8	0	0	0	111.5	L422 D427 F432 L441 H455 V475 V477	L422-L457 HydrophobicContact CD1-CB 4.18Å; L422-L457 HydrophobicContact CD1-CD1 4.45Å; D427-L457 HydrophobicContact CB-CD2 3.93Å; F432-L457 HydrophobicContact CB-CD1 4Å; F432-L457 HydrophobicContact CD1-CD1 4.33Å; F432-L457 HydrophobicContact CD2-CD1 3.73Å; F432-L457 HydrophobicContact CD2-CD2 3.77Å; F432-L457 HydrophobicContact CD2-CG 4.32Å; F432-L457 HydrophobicContact CE2-CD1 4.32Å; F432-L457 HydrophobicContact CE2-CD2 4.32Å; F432-L457 HydrophobicContact CG-CD1 3.74Å; F432-L457 HydrophobicContact CG-CD2 4.49Å; L441-L457 HydrophobicContact CD1-CD1 4.36Å; L441-L457 HydrophobicContact CD2-CD1 3.96Å; H455-L457 HydrophobicContact CB-CD2 4.36Å; H455-L457 HydrophobicContact CB-CG 4.48Å; L457-V475 WeakPolarHBondContact CA-O 3.15Å; L457-V475 HydrophobicContact CB-CB 4.25Å; L457-V475 WeakPolarHBondContact CB-O 3.47Å; L457-V475 PolarHBondContact N-O 2.63Å; L457-V475 PolarHBondContact O-N 2.76Å; L457-V477 HydrophobicContact CD1-CG2 3.8Å
458	T	96.6	Very high	91.6	Very high	33 Å²	33	57.8 Å²	57.8	20%	0.202	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.7	164.6	-66.9	0	0	0	0	110.1	D423 T426 R472 V473	D423-T458 HydrophobicContact CB-CG2 4.19Å; D423-T458 PolarHBondContact N-O 3.48Å; T426-T458 PolarHBondContact OG1-N 2.81Å; T458-R472 HydrophobicContact CG2-CB 3.89Å; T458-R472 HydrophobicContact CG2-CG 4.1Å; T458-V473 WeakPolarHBondContact CA-O 3.35Å
459	V	96.4	Very high	91.3	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138.2	172.6	178.3	0	0	0	0	109.1	F384 V406 S421 L422 I434 R472 V473 V475	F384-V459 HydrophobicContact CE1-CG1 4.36Å; F384-V459 HydrophobicContact CZ-CG1 4.16Å; V406-V459 HydrophobicContact CG2-CG1 3.96Å; S421-V459 WeakPolarHBondContact O-CG1 3.22Å; L422-V459 HydrophobicContact CD1-CG2 3.77Å; I434-V459 HydrophobicContact CD1-CG1 3.59Å; I434-V459 HydrophobicContact CD1-CG2 4.14Å; V459-R472 WeakPolarHBondContact O-CA 3.45Å; V459-V473 HydrophobicContact CB-CG1 4.05Å; V459-V473 PolarHBondContact N-O 3.31Å; V459-V473 PolarHBondContact O-N 3.01Å; V459-V475 HydrophobicContact CB-CG2 4.2Å; V459-V475 HydrophobicContact CG2-CB 4.4Å; V459-V475 HydrophobicContact CG2-CG2 3.65Å
460	I	95.5	Very high	91.2	Very high	23 Å²	23	59.4 Å²	59.4	12%	0.118	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130	-179.9	-43.9	-174.4	0	0	0	108.4	F420 S421 D423 T470 T471 R472	F420-I460 CarbonylContact C-O 3.57Å; F420-I460 WeakPolarHBondContact CA-O 3.48Å; S421-I460 PolarHBondContact N-O 3.36Å; S421-I460 PolarHBondContact O-N 3.33Å; D423-I460 HydrophobicContact CB-CD1 4.06Å; D423-I460 HydrophobicContact CB-CG1 4.28Å; I460-T470 HydrophobicContact CG2-CG2 4.27Å; I460-T471 VanDerWaalsContact CA-O 3.32Å; I460-T471 WeakPolarHBondContact CA-O 3.4Å; I460-T471 WeakPolarHBondContact CG2-O 3.46Å; I460-R472 HydrophobicContact CG1-CG 4.25Å
461	A	94.6	Very high	91.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.7	166.4	0	0	0	0	0	109.4	F384 A408 I418 F420 T470 T471	F384-A461 HydrophobicContact CE1-CB 4.12Å; F384-A461 HydrophobicContact CE2-CB 3.7Å; F384-A461 HydrophobicContact CZ-CB 3.46Å; F384-A461 VanDerWaalsContact CZ-CB 3.46Å; A408-A461 HydrophobicContact CB-CB 4Å; I418-A461 HydrophobicContact CG2-CB 3.98Å; F420-A461 HydrophobicContact CD1-CB 4.18Å; F420-A461 HydrophobicContact CE1-CB 4.09Å; A461-T470 VanDerWaalsContact O-CA 3.26Å; A461-T470 WeakPolarHBondContact O-CA 3.47Å; A461-T471 PolarHBondContact N-O 3.49Å; A461-T471 VanDerWaalsContact N-O 3.1Å; A461-T471 PolarHBondContact O-N 2.64Å; A461-T471 VanDerWaalsContact O-N 3.07Å
462	A	92.9	Very high	91.4	Very high	11 Å²	11	59 Å²	59	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	144.8	179.3	0	0	0	0	0	109.7	R419 T470	R419-A462 PolarHBondContact N-O 2.98Å; R419-A462 PolarHBondContact O-N 3.31Å; A462-T470 HydrophobicContact CB-CG2 3.75Å
463	E	89.4	Confident	91.7	Very high	11 Å²	11	57.6 Å²	57.6	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	148.2	169.8	-152.3	-73.6	125.7	0	0	109.3	P382 D410 N465 N466	P382-E463 HydrophobicContact CG-CB 4.28Å; D410-E463 WeakPolarHBondContact OD2-CG 3.44Å; E463-N465 PolarHBondContact OE1-ND2 3.01Å; E463-N465 WeakPolarHBondContact OE2-CA 3.13Å; E463-N465 WeakPolarHBondContact OE2-CB 3.49Å; E463-N465 PolarHBondContact OE2-N 3.46Å; E463-N465 PolarHBondContact OE2-ND2 3.3Å; E463-N466 CarbonylContact O-C 3.46Å; E463-N466 PolarHBondContact OE2-N 3.41Å
464	I	85.4	Confident	91.9	Very high	68 Å²	68	54.9 Å²	54.9	35%	0.349	28%	0.276	S	S	.	.	S	Bend	trans	-78.8	-27.5	-173.3	-84.1	177.6	0	0	0	112.9	P417 R419	P417-I464 HydrophobicContact CB-CD1 4.26Å; P417-I464 HydrophobicContact CG-CB 4.28Å; P417-I464 VanDerWaalsContact O-CB 3.23Å; P417-I464 WeakPolarHBondContact O-CB 3.46Å; P417-I464 VanDerWaalsContact O-CD1 3.25Å; P417-I464 WeakPolarHBondContact O-CD1 3.31Å; P417-I464 WeakPolarHBondContact O-CG1 3.16Å; P417-I464 PolarHBondContact O-N 3.04Å; R419-I464 HydrophobicContact CB-CD1 4.26Å; R419-I464 HydrophobicContact CB-CG1 3.76Å
465	N	83.3	Confident	92	Very high	129 Å²	129	49.1 Å²	49.1	69%	0.69	26%	0.255	S	S	*	.	S	Bend	trans	-89.7	-39.6	179.5	-47.7	-75.3	0	0	0	111.1	E463 P467	E463-N465 PolarHBondContact OE1-ND2 3.01Å; E463-N465 WeakPolarHBondContact OE2-CA 3.13Å; E463-N465 WeakPolarHBondContact OE2-CB 3.49Å; E463-N465 PolarHBondContact OE2-N 3.46Å; E463-N465 PolarHBondContact OE2-ND2 3.3Å; N465-P467 VanDerWaalsContact C-CD 3.44Å; N465-P467 WeakPolarHBondContact O-CD 3.45Å
466	N	83.9	Confident	92.1	Very high	38 Å²	38	51.3 Å²	51.3	20%	0.203	26%	0.264	C	S	.	.			trans	-110.9	77.7	170.1	-169.3	5.9	0	0	0	113.4	D379 E463 K468 E469	D379-N466 PolarHBondContact OD2-ND2 3.34Å; E463-N466 CarbonylContact O-C 3.46Å; E463-N466 PolarHBondContact OE2-N 3.41Å; N466-K468 PolarHBondContact O-N 3.38Å; N466-K468 WeakPolarHBondContact OD1-CB 3.38Å; N466-K468 PolarHBondContact OD1-N 3.07Å; N466-E469 PolarHBondContact O-N 3.03Å
467	P	84.4	Confident	92.2	Very high	84 Å²	84	46.5 Å²	46.5	55%	0.545	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	14.5	-179.6	33.3	-39.1	0	0	0	114.7	N465	N465-P467 VanDerWaalsContact C-CD 3.44Å; N465-P467 WeakPolarHBondContact O-CD 3.45Å
468	K	86.5	Confident	92.2	Very high	162 Å²	162	50.7 Å²	50.7	70%	0.704	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-41.6	169.5	-62.7	172.4	-178.2	169	0	111	N466 T470	N466-K468 PolarHBondContact O-N 3.38Å; N466-K468 WeakPolarHBondContact OD1-CB 3.38Å; N466-K468 PolarHBondContact OD1-N 3.07Å; K468-T470 PolarHBondContact O-N 3.38Å; K468-T470 PolarHBondContact O-OG1 3.05Å
469	E	86.9	Confident	92.1	Very high	74 Å²	74	49.4 Å²	49.4	35%	0.346	25%	0.246	S	C	.	.			trans	-77.9	114	-177.1	-62.4	-41.4	128.4	0	0	109.3	P381 N466	P381-E469 HydrophobicContact CB-CB 3.95Å; N466-E469 PolarHBondContact O-N 3.03Å
470	T	92.5	Very high	91.9	Very high	49 Å²	49	51.3 Å²	51.3	30%	0.301	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	123.9	-165.6	54.2	0	0	0	0	112.1	I460 A461 A462 K468	I460-T470 HydrophobicContact CG2-CG2 4.27Å; A461-T470 VanDerWaalsContact O-CA 3.26Å; A461-T470 WeakPolarHBondContact O-CA 3.47Å; A462-T470 HydrophobicContact CB-CG2 3.75Å; K468-T470 PolarHBondContact O-N 3.38Å; K468-T470 PolarHBondContact O-OG1 3.05Å
471	T	94	Very high	91.8	Very high	27 Å²	27	52.1 Å²	52.1	17%	0.166	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	160.3	170	66	0	0	0	0	110.9	P381 P382 F384 I460 A461	P381-T471 HydrophobicContact CB-CG2 3.77Å; P381-T471 HydrophobicContact CG-CG2 4.2Å; P381-T471 WeakPolarHBondContact O-CG2 3.36Å; P382-T471 WeakPolarHBondContact O-CB 3.28Å; P382-T471 WeakPolarHBondContact O-CG2 3.49Å; P382-T471 PolarHBondContact O-OG1 3.05Å; F384-T471 VanDerWaalsContact CD2-OG1 3.27Å; F384-T471 WeakPolarHBondContact CD2-OG1 3.13Å; F384-T471 WeakPolarHBondContact CE2-OG1 3.47Å; I460-T471 VanDerWaalsContact CA-O 3.32Å; I460-T471 WeakPolarHBondContact CA-O 3.4Å; I460-T471 WeakPolarHBondContact CG2-O 3.46Å; A461-T471 PolarHBondContact N-O 3.49Å; A461-T471 VanDerWaalsContact N-O 3.1Å; A461-T471 PolarHBondContact O-N 2.64Å; A461-T471 VanDerWaalsContact O-N 3.07Å
472	R	95.3	Very high	91.6	Very high	150 Å²	150	53.7 Å²	53.7	57%	0.566	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.6	178.2	-68.6	-179.3	173.6	71.6	-0	110	T458 V459 I460	T458-R472 HydrophobicContact CG2-CB 3.89Å; T458-R472 HydrophobicContact CG2-CG 4.1Å; V459-R472 WeakPolarHBondContact O-CA 3.45Å; I460-R472 HydrophobicContact CG1-CG 4.25Å
473	V	96.6	Very high	91.6	Very high	7 Å²	7	53.5 Å²	53.5	4%	0.042	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.1	173.6	71.6	0	0	0	0	111.2	F384 R386 S387 Y389 T458 V459 V475	F384-V473 HydrophobicContact CB-CB 4.35Å; F384-V473 HydrophobicContact CB-CG2 4.47Å; F384-V473 HydrophobicContact CD1-CB 4.16Å; F384-V473 HydrophobicContact CD1-CG1 3.64Å; F384-V473 HydrophobicContact CD2-CB 3.66Å; F384-V473 HydrophobicContact CD2-CG1 3.89Å; F384-V473 HydrophobicContact CE1-CB 4.36Å; F384-V473 HydrophobicContact CE1-CG1 3.51Å; F384-V473 HydrophobicContact CE2-CB 3.87Å; F384-V473 HydrophobicContact CE2-CG1 3.74Å; F384-V473 HydrophobicContact CG-CB 3.8Å; F384-V473 HydrophobicContact CG-CG1 3.82Å; F384-V473 HydrophobicContact CG-CG2 4.4Å; F384-V473 HydrophobicContact CZ-CB 4.22Å; F384-V473 HydrophobicContact CZ-CG1 3.55Å; R386-V473 WeakPolarHBondContact O-CG2 3.46Å; S387-V473 WeakPolarHBondContact O-CG2 3.05Å; Y389-V473 HydrophobicContact CD2-CG1 4.2Å; Y389-V473 HydrophobicContact CD2-CG2 3.91Å; Y389-V473 HydrophobicContact CE2-CG1 4.11Å; Y389-V473 HydrophobicContact CE2-CG2 3.9Å; T458-V473 WeakPolarHBondContact CA-O 3.35Å; V459-V473 HydrophobicContact CB-CG1 4.05Å; V459-V473 PolarHBondContact N-O 3.31Å; V459-V473 PolarHBondContact O-N 3.01Å; V473-V475 HydrophobicContact CG1-CG2 4.2Å
474	A	96.8	Very high	91.8	Very high	35 Å²	35	57.8 Å²	57.8	29%	0.289	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	130.4	173.2	0	0	0	0	0	110.5	S388 Y389 F476	S388-A474 VanDerWaalsContact CA-O 3.3Å; S388-A474 WeakPolarHBondContact CA-O 3.41Å; Y389-A474 PolarHBondContact N-O 2.82Å; A474-F476 HydrophobicContact CB-CE2 3.84Å; A474-F476 HydrophobicContact CB-CZ 3.97Å
475	V	96.9	Very high	92.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	110.7	176.2	-179.2	0	0	0	0	108.2	Y389 F391 V406 L441 L457 V459 V473	Y389-V475 HydrophobicContact CD2-CG2 4.27Å; Y389-V475 WeakPolarHBondContact O-CA 3.19Å; F391-V475 HydrophobicContact CD2-CG1 3.65Å; F391-V475 HydrophobicContact CE2-CG1 3.55Å; V406-V475 HydrophobicContact CG1-CG2 3.93Å; L441-V475 HydrophobicContact CD2-CG1 4.1Å; L457-V475 WeakPolarHBondContact CA-O 3.15Å; L457-V475 HydrophobicContact CB-CB 4.25Å; L457-V475 WeakPolarHBondContact CB-O 3.47Å; L457-V475 PolarHBondContact N-O 2.63Å; L457-V475 PolarHBondContact O-N 2.76Å; V459-V475 HydrophobicContact CB-CG2 4.2Å; V459-V475 HydrophobicContact CG2-CB 4.4Å; V459-V475 HydrophobicContact CG2-CG2 3.65Å; V473-V475 HydrophobicContact CG1-CG2 4.2Å
476	F	96.5	Very high	92.6	Very high	72 Å²	72	50.6 Å²	50.6	32%	0.316	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.9	177.7	-58.3	-81	0	0	0	108.6	Y389 L390 F391 W454 N456 A474	Y389-F476 PolarHBondContact O-N 3.28Å; L390-F476 WeakPolarHBondContact CA-O 3.27Å; L390-F476 HydrophobicContact CD1-CB 3.9Å; F391-F476 PolarHBondContact N-O 3.21Å; W454-F476 HydrophobicContact CZ3-CB 4.37Å; N456-F476 WeakPolarHBondContact OD1-CD1 3.33Å; A474-F476 HydrophobicContact CB-CE2 3.84Å; A474-F476 HydrophobicContact CB-CZ 3.97Å
477	V	95.8	Very high	93.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.7	170.1	-175.3	0	0	0	0	107.7	F391 V393 F432 L441 W454 H455 L457	F391-V477 WeakPolarHBondContact O-CA 3.37Å; V393-V477 HydrophobicContact CG1-CG1 3.7Å; F432-V477 HydrophobicContact CE1-CG1 4.07Å; F432-V477 HydrophobicContact CE1-CG2 4.36Å; F432-V477 HydrophobicContact CZ-CB 4.33Å; F432-V477 HydrophobicContact CZ-CG1 4.1Å; F432-V477 HydrophobicContact CZ-CG2 4.5Å; L441-V477 HydrophobicContact CD2-CG2 4.13Å; W454-V477 WeakPolarHBondContact CA-O 3.25Å; H455-V477 HydrophobicContact CB-CB 4.34Å; H455-V477 PolarHBondContact N-O 2.86Å; H455-V477 PolarHBondContact O-N 3.07Å; L457-V477 HydrophobicContact CD1-CG2 3.8Å
478	R	95.6	Very high	93.5	Very high	91 Å²	91	49.9 Å²	49.9	34%	0.343	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127.3	174	-176.5	-169.4	177.1	-164.5	-4.3	108.8	L390 F391 E392 V393 W454 L480	L390-R478 HydrophobicContact CD1-CB 4.45Å; F391-R478 PolarHBondContact O-N 3Å; E392-R478 WeakPolarHBondContact CA-O 3.05Å; E392-R478 HydrophobicContact CG-CB 4.26Å; E392-R478 WeakPolarHBondContact OE1-CD 3.38Å; E392-R478 IonicContact OE1-CZ 3.35Å; E392-R478 IonicContact OE1-NE 2.92Å; E392-R478 IonicContact OE1-NH1 3.96Å; E392-R478 PolarHBondContact OE1-NH1 2.84Å; V393-R478 PolarHBondContact N-O 2.9Å; W454-R478 HydrophobicContact CD2-CB 4.32Å; W454-R478 HydrophobicContact CD2-CG 4.29Å; W454-R478 HydrophobicContact CE3-CB 3.95Å; W454-R478 HydrophobicContact CE3-CG 4.38Å; W454-R478 HydrophobicContact CH2-CB 3.81Å; W454-R478 HydrophobicContact CH2-CG 3.83Å; W454-R478 HydrophobicContact CZ2-CB 4.17Å; W454-R478 HydrophobicContact CZ2-CG 3.7Å; W454-R478 HydrophobicContact CZ3-CB 3.69Å; W454-R478 HydrophobicContact CZ3-CG 4.17Å; R478-L480 HydrophobicContact CG-CD2 4.5Å
479	I	94.6	Very high	93.8	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	138.1	172.3	-51.6	-172.6	0	0	0	109.3	V393 E395 L447 R449 S452 Q453	V393-I479 CarbonylContact O-C 3.55Å; V393-I479 VanDerWaalsContact O-CA 3.32Å; V393-I479 WeakPolarHBondContact O-CA 3.37Å; E395-I479 HydrophobicContact CB-CG2 3.72Å; L447-I479 HydrophobicContact CB-CD1 4.11Å; L447-I479 HydrophobicContact CD1-CD1 4.29Å; L447-I479 HydrophobicContact CD1-CG1 4.49Å; L447-I479 HydrophobicContact CD2-CD1 4.21Å; L447-I479 HydrophobicContact CG-CD1 4.43Å; R449-I479 HydrophobicContact CB-CB 4.25Å; R449-I479 HydrophobicContact CB-CG2 3.67Å; R449-I479 HydrophobicContact CG-CB 4.01Å; R449-I479 HydrophobicContact CG-CG2 3.85Å; S452-I479 WeakPolarHBondContact O-CD1 3.47Å; Q453-I479 PolarHBondContact O-N 2.93Å
480	L	93.4	Very high	94	Very high	40 Å²	40	42.1 Å²	42.1	21%	0.209	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.2	177.7	-57.9	179.7	0	0	0	109.8	E392 V393 E395 R478	E392-L480 HydrophobicContact CB-CD1 4.12Å; E392-L480 HydrophobicContact CB-CD2 4.44Å; E392-L480 HydrophobicContact CB-CG 4.34Å; V393-L480 PolarHBondContact O-N 2.89Å; E395-L480 PolarHBondContact N-O 2.85Å; R478-L480 HydrophobicContact CG-CD2 4.5Å
481	D	91.7	Very high	94	Very high	40 Å²	40	43.9 Å²	43.9	21%	0.214	23%	0.227	C	C	.	.			trans	-48.9	133.9	179.2	-140	79.9	0	0	0	113.4	E395 R449 D517	E395-D481 WeakPolarHBondContact OE1-CA 3.4Å; R449-D481 WeakPolarHBondContact CD-OD1 3.27Å; R449-D481 IonicContact CZ-OD1 3.28Å; R449-D481 IonicContact NE-OD1 3.98Å; R449-D481 PolarHBondContact NE-OD1 3.23Å; R449-D481 IonicContact NH1-OD1 3.18Å; R449-D481 PolarHBondContact NH1-OD1 2.71Å; R449-D481 IonicContact NH2-OD1 2.66Å; D481-D517 PolarHBondContact OD1-N 2.87Å; D481-D517 VanDerWaalsContact OD2-C 3.3Å; D481-D517 PolarHBondContact OD2-N 3.07Å
482	V	92.2	Very high	93.8	Very high	33 Å²	33	50.3 Å²	50.3	20%	0.2	25%	0.253	C	S	.	.			trans	-139.5	131.4	167.2	-177.4	0	0	0	0	108.8	H394 E395 D396 D484	H394-V482 HydrophobicContact CB-CG2 3.95Å; E395-V482 HydrophobicContact CG-CB 4.01Å; E395-V482 HydrophobicContact CG-CG2 4.11Å; E395-V482 PolarHBondContact OE1-N 3.25Å; D396-V482 HydrophobicContact CB-CG1 4.37Å; D396-V482 HydrophobicContact CB-CG2 4.37Å; V482-D484 WeakPolarHBondContact O-CB 3.44Å; V482-D484 PolarHBondContact O-N 2.74Å
483	N	92.4	Very high	93.5	Very high	6 Å²	6	44.2 Å²	44.2	3%	0.032	23%	0.23	C	C	.	.			trans	-68.5	90.8	-171.8	-162	79.1	0	0	0	112.8	D516 D570 D572 P574 Q576	N483-D516 WeakPolarHBondContact CA-OD2 3.15Å; N483-D570 PolarHBondContact ND2-OD2 3.42Å; N483-D572 HydrophobicContact CB-CB 4.11Å; N483-P574 PolarHBondContact ND2-O 3.1Å; N483-Q576 WeakPolarHBondContact ND2-CG 3.49Å; N483-Q576 PolarHBondContact O-NE2 2.92Å
484	D	92.5	Very high	93.2	Very high	101 Å²	101	47.2 Å²	47.2	54%	0.54	25%	0.246	S	C	.	.			trans	-110.5	-32.5	-170.4	148.4	-77.6	0	0	0	111.3	V482 D516	V482-D484 WeakPolarHBondContact O-CB 3.44Å; V482-D484 PolarHBondContact O-N 2.74Å; D484-D516 PolarHBondContact N-OD2 3.42Å
485	N	92.7	Very high	92.9	Very high	23 Å²	23	46.1 Å²	46.1	12%	0.123	24%	0.235	C	C	.	.	S	Bend	trans	-90.6	153.2	179.8	-70.8	-87.8	0	0	0	112.5	D514 K515 D516 Q576	N485-D514 VanDerWaalsContact CB-OD1 3.27Å; N485-D514 WeakPolarHBondContact CB-OD1 3.03Å; N485-K515 HydrophobicContact CB-CB 4.43Å; N485-K515 PolarHBondContact ND2-NZ 2.8Å; N485-K515 WeakPolarHBondContact OD1-CE 3.21Å; N485-K515 PolarHBondContact OD1-NZ 3.21Å; N485-D516 VanDerWaalsContact CB-OD1 3.25Å; N485-D516 WeakPolarHBondContact CB-OD1 3.28Å; N485-D516 PolarHBondContact N-OD2 2.99Å; N485-D516 PolarHBondContact ND2-OD1 3.47Å; N485-Q576 VanDerWaalsContact O-CB 3.29Å; N485-Q576 WeakPolarHBondContact O-CB 3.18Å; N485-Q576 VanDerWaalsContact O-CG 3.27Å; N485-Q576 WeakPolarHBondContact O-CG 3.38Å
486	A	92.8	Very high	92.6	Very high	23 Å²	23	49.7 Å²	49.7	19%	0.19	25%	0.251	C	S	.	.			trans	-106.5	138.5	177.7	0	0	0	0	0	111.1	Q488 Q576	A486-Q488 PolarHBondContact O-N 3.49Å; A486-Q488 PolarHBondContact O-NE2 3.48Å; A486-Q488 VanDerWaalsContact O-NE2 3.12Å; A486-Q576 HydrophobicContact CB-CB 3.95Å
487	P	94.3	Very high	92.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.			trans	-70.2	135.2	-170.8	23.6	-33.2	0	0	0	111.6	D514 F524 I568 D570 S578	P487-D514 WeakPolarHBondContact CA-OD2 3.05Å; P487-D514 WeakPolarHBondContact CB-OD2 3.48Å; P487-D514 WeakPolarHBondContact CD-OD2 3.43Å; P487-F524 HydrophobicContact CB-CD1 3.6Å; P487-F524 HydrophobicContact CB-CE1 3.55Å; P487-F524 HydrophobicContact CB-CG 4.49Å; P487-F524 HydrophobicContact CB-CZ 4.38Å; P487-F524 HydrophobicContact CG-CD1 4.12Å; P487-F524 HydrophobicContact CG-CE1 4.38Å; P487-I568 HydrophobicContact CB-CG2 3.88Å; P487-I568 HydrophobicContact CG-CB 4.25Å; P487-I568 HydrophobicContact CG-CG2 3.88Å; P487-D570 HydrophobicContact CG-CB 4.34Å; P487-S578 VanDerWaalsContact O-CB 3.31Å; P487-S578 WeakPolarHBondContact O-CB 3.46Å; P487-S578 PolarHBondContact O-OG 3.21Å
488	Q	92.9	Very high	92.1	Very high	108 Å²	108	46.6 Å²	46.6	51%	0.505	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	159.4	-172.1	-77.1	161	73.9	0	0	111.3	A486 A490 A512 V513	A486-Q488 PolarHBondContact O-N 3.49Å; A486-Q488 PolarHBondContact O-NE2 3.48Å; A486-Q488 VanDerWaalsContact O-NE2 3.12Å; Q488-A490 PolarHBondContact O-N 3.48Å; Q488-A512 CarbonylContact O-C 3.59Å; Q488-A512 WeakPolarHBondContact O-CA 3.3Å; Q488-A512 WeakPolarHBondContact O-CB 3.47Å; Q488-V513 PolarHBondContact N-O 3.42Å; Q488-V513 PolarHBondContact O-N 3.39Å
489	F	93.2	Very high	91.8	Very high	33 Å²	33	44.6 Å²	44.6	15%	0.145	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	133.1	173.6	-73.7	-25.6	0	0	0	111.1	V491 Y493 I510 V566 I568 L582	F489-V491 WeakPolarHBondContact CB-O 3.07Å; F489-V491 PolarHBondContact O-N 2.9Å; F489-V491 VanDerWaalsContact O-N 3.14Å; F489-Y493 HydrophobicContact CB-CD2 4Å; F489-Y493 HydrophobicContact CB-CE2 3.86Å; F489-Y493 HydrophobicContact CD1-CD2 4.29Å; F489-Y493 HydrophobicContact CD1-CE2 4.18Å; F489-Y493 AromaticContact CD2-CD2 3.86Å; F489-Y493 HydrophobicContact CD2-CD2 3.86Å; F489-Y493 HydrophobicContact CD2-CE2 4.45Å; F489-Y493 HydrophobicContact CE2-CD2 4.35Å; F489-Y493 AromaticContact CG-CD2 3.82Å; F489-Y493 HydrophobicContact CG-CD2 3.82Å; F489-Y493 AromaticContact CG-CE2 3.95Å; F489-Y493 HydrophobicContact CG-CE2 3.95Å; F489-I510 HydrophobicContact CE1-CD1 3.73Å; F489-I510 HydrophobicContact CZ-CD1 4.24Å; F489-V566 HydrophobicContact CE1-CB 4.22Å; F489-V566 HydrophobicContact CE1-CG1 4.49Å; F489-V566 HydrophobicContact CZ-CB 3.95Å; F489-V566 HydrophobicContact CZ-CG2 4.2Å; F489-I568 HydrophobicContact CD1-CD1 3.49Å; F489-I568 VanDerWaalsContact CD1-CD1 3.49Å; F489-I568 HydrophobicContact CD1-CG1 4.47Å; F489-I568 HydrophobicContact CE1-CD1 3.79Å; F489-I568 HydrophobicContact CE1-CG1 4.31Å; F489-I568 HydrophobicContact CG-CD1 4.36Å; F489-L582 HydrophobicContact CE2-CB 4.48Å
490	A	91.6	Very high	91.4	Very high	39 Å²	39	49.2 Å²	49.2	32%	0.322	26%	0.257	S	S	.	.	S	Bend	trans	-59.8	-26.2	-180	0	0	0	0	0	113.8	Q488 S511 V513	Q488-A490 PolarHBondContact O-N 3.48Å; A490-S511 WeakPolarHBondContact CB-OG 3.47Å; A490-S511 PolarHBondContact N-O 3.3Å; A490-V513 HydrophobicContact CB-CG1 3.88Å
491	V	91.6	Very high	91.2	Very high	86 Å²	86	47.4 Å²	47.4	52%	0.521	25%	0.248	S	C	.	.	S	Bend	trans	-146.1	161.9	173.3	-67.1	0	0	0	0	110.3	F489 Y493	F489-V491 WeakPolarHBondContact CB-O 3.07Å; F489-V491 PolarHBondContact O-N 2.9Å; F489-V491 VanDerWaalsContact O-N 3.14Å; V491-Y493 HydrophobicContact CG2-CD1 3.78Å; V491-Y493 HydrophobicContact CG2-CD2 4.3Å; V491-Y493 HydrophobicContact CG2-CE1 3.39Å; V491-Y493 HydrophobicContact CG2-CE2 3.96Å; V491-Y493 HydrophobicContact CG2-CG 4.2Å; V491-Y493 VanDerWaalsContact CG2-CZ 3.47Å; V491-Y493 WeakPolarHBondContact O-CD2 3.46Å; V491-Y493 WeakPolarHBondContact O-CE2 3.47Å; V491-Y493 PolarHBondContact O-N 3.43Å
492	F	89.9	Confident	91.1	Very high	163 Å²	163	54.7 Å²	54.7	72%	0.715	27%	0.273	S	S	*	.			trans	-68.3	112.3	165.6	-177.6	-93.8	0	0	0	109.9	D494 T583	F492-D494 HydrophobicContact CD1-CB 4.44Å; F492-D494 HydrophobicContact CE1-CB 4.09Å; F492-T583 HydrophobicContact CZ-CG2 4.05Å
493	Y	89.8	Confident	91	Very high	21 Å²	21	56.9 Å²	56.9	8%	0.082	29%	0.288	C	S	.	.			trans	-89.7	120.7	-178.3	-66.6	-77.6	0	0	0	112.6	F489 V491 Q508 I510 S511 L582 T583	F489-Y493 HydrophobicContact CB-CD2 4Å; F489-Y493 HydrophobicContact CB-CE2 3.86Å; F489-Y493 HydrophobicContact CD1-CD2 4.29Å; F489-Y493 HydrophobicContact CD1-CE2 4.18Å; F489-Y493 AromaticContact CD2-CD2 3.86Å; F489-Y493 HydrophobicContact CD2-CD2 3.86Å; F489-Y493 HydrophobicContact CD2-CE2 4.45Å; F489-Y493 HydrophobicContact CE2-CD2 4.35Å; F489-Y493 AromaticContact CG-CD2 3.82Å; F489-Y493 HydrophobicContact CG-CD2 3.82Å; F489-Y493 AromaticContact CG-CE2 3.95Å; F489-Y493 HydrophobicContact CG-CE2 3.95Å; V491-Y493 HydrophobicContact CG2-CD1 3.78Å; V491-Y493 HydrophobicContact CG2-CD2 4.3Å; V491-Y493 HydrophobicContact CG2-CE1 3.39Å; V491-Y493 HydrophobicContact CG2-CE2 3.96Å; V491-Y493 HydrophobicContact CG2-CG 4.2Å; V491-Y493 VanDerWaalsContact CG2-CZ 3.47Å; V491-Y493 WeakPolarHBondContact O-CD2 3.46Å; V491-Y493 WeakPolarHBondContact O-CE2 3.47Å; V491-Y493 PolarHBondContact O-N 3.43Å; Y493-Q508 HydrophobicContact CD1-CG 4.18Å; Y493-I510 HydrophobicContact CD1-CG2 4.07Å; Y493-I510 HydrophobicContact CD2-CB 4.22Å; Y493-I510 HydrophobicContact CD2-CG2 3.73Å; Y493-I510 HydrophobicContact CE1-CG2 4.19Å; Y493-I510 HydrophobicContact CE2-CB 3.85Å; Y493-I510 HydrophobicContact CE2-CG2 3.86Å; Y493-I510 HydrophobicContact CG-CG2 3.86Å; Y493-S511 PolarHBondContact OH-N 2.97Å; Y493-S511 PolarHBondContact OH-O 3.32Å; Y493-S511 PolarHBondContact OH-OG 3.38Å; Y493-S511 VanDerWaalsContact OH-OG 3.11Å; Y493-L582 HydrophobicContact CG-CD1 4.34Å; Y493-T583 PolarHBondContact O-N 3.19Å; Y493-T583 PolarHBondContact O-OG1 3.37Å; Y493-T583 VanDerWaalsContact O-OG1 3.08Å
494	D	89.1	Confident	90.9	Very high	71 Å²	71	59.2 Å²	59.2	38%	0.38	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	117.5	172	-177.5	-14.9	0	0	0	108.4	F492 T583 R585	F492-D494 HydrophobicContact CD1-CB 4.44Å; F492-D494 HydrophobicContact CE1-CB 4.09Å; D494-T583 VanDerWaalsContact CA-OG1 3.24Å; D494-T583 WeakPolarHBondContact CA-OG1 3.39Å; D494-T583 WeakPolarHBondContact CB-OG1 3.31Å; D494-R585 IonicContact OD1-CZ 3.47Å; D494-R585 IonicContact OD1-NE 3.16Å; D494-R585 PolarHBondContact OD1-NE 2.88Å; D494-R585 IonicContact OD1-NH2 2.84Å; D494-R585 PolarHBondContact OD1-NH2 2.78Å; D494-R585 IonicContact OD2-CZ 3.28Å; D494-R585 IonicContact OD2-NE 2.71Å; D494-R585 IonicContact OD2-NH1 2.75Å; D494-R585 IonicContact OD2-NH2 3.8Å; D494-R585 PolarHBondContact OD2-NH2 3.41Å
495	T	90.8	Very high	90.8	Very high	11 Å²	11	57.9 Å²	57.9	7%	0.067	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	176.6	-169.6	-166.6	0	0	0	0	111	I507 Q508 L582 T583 I584 R585	T495-I507 HydrophobicContact CG2-CG2 3.58Å; T495-Q508 HydrophobicContact CG2-CB 4.03Å; T495-Q508 HydrophobicContact CG2-CG 4.49Å; T495-Q508 PolarHBondContact OG1-OE1 2.62Å; T495-L582 HydrophobicContact CG2-CD1 3.94Å; T495-L582 HydrophobicContact CG2-CG 4.46Å; T495-T583 PolarHBondContact N-O 3.09Å; T495-I584 HydrophobicContact CG2-CB 4.41Å; T495-I584 HydrophobicContact CG2-CG1 3.95Å; T495-I584 HydrophobicContact CG2-CG2 4.37Å; T495-I584 CarbonylContact O-C 3.6Å; T495-I584 WeakPolarHBondContact O-CA 3.32Å; T495-R585 PolarHBondContact O-N 2.96Å
496	F	91.3	Very high	90.7	Very high	75 Å²	75	60.7 Å²	60.7	33%	0.329	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.5	-176.9	69.7	-86.9	0	0	0	113.7	I507 R585 M595	F496-I507 WeakPolarHBondContact O-CG2 3.34Å; F496-R585 CarbonylContact C-O 3.55Å; F496-R585 WeakPolarHBondContact CA-O 3.26Å; F496-M595 HydrophobicContact CD1-CB 4.48Å; F496-M595 HydrophobicContact CD1-SD 4.15Å; F496-M595 HydrophobicContact CD2-CB 4.12Å; F496-M595 HydrophobicContact CD2-CG 4.41Å; F496-M595 HydrophobicContact CE1-CB 4.2Å; F496-M595 HydrophobicContact CE2-CB 3.82Å; F496-M595 HydrophobicContact CG-CB 4.46Å; F496-M595 HydrophobicContact CG-CG 4.49Å; F496-M595 HydrophobicContact CG-SD 4.24Å; F496-M595 HydrophobicContact CZ-CB 3.87Å
497	V	92	Very high	90.6	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.024	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131	170.1	67.1	0	0	0	0	109.4	A501 I507 T549 F554 I584 R585 V586 C587	V497-A501 HydrophobicContact CG2-CB 3.73Å; V497-I507 HydrophobicContact CB-CD1 4.26Å; V497-I507 HydrophobicContact CG2-CD1 4.2Å; V497-T549 HydrophobicContact CG2-CG2 3.69Å; V497-F554 HydrophobicContact CG1-CD1 4.01Å; V497-F554 HydrophobicContact CG1-CE1 4.34Å; V497-F554 HydrophobicContact CG1-CG 4.15Å; V497-F554 HydrophobicContact CG2-CD2 3.9Å; V497-F554 HydrophobicContact CG2-CE2 3.88Å; V497-F554 HydrophobicContact CG2-CG 4.28Å; V497-F554 HydrophobicContact CG2-CZ 4.22Å; V497-I584 HydrophobicContact CB-CG2 3.99Å; V497-I584 HydrophobicContact CG1-CG2 3.88Å; V497-R585 PolarHBondContact N-O 2.84Å; V497-V586 HydrophobicContact CG1-CB 4.5Å; V497-V586 HydrophobicContact CG1-CG2 3.89Å; V497-V586 WeakPolarHBondContact O-CA 3.3Å; V497-C587 PolarHBondContact O-N 3.33Å
498	C	89.8	Confident	90.4	Very high	4 Å²	4	63.6 Å²	63.6	3%	0.027	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	144.2	177.4	-60.5	0	0	0	0	111.3	N500 A501 C587 C589	C498-N500 WeakPolarHBondContact CB-OD1 3.5Å; C498-N500 PolarHBondContact O-N 3.15Å; C498-A501 WeakPolarHBondContact O-CB 3.45Å; C498-A501 PolarHBondContact O-N 2.77Å; C498-C587 WeakPolarHBondContact CA-O 3.11Å; C498-C589 VanDerWaalsContact CA-SG 3.53Å; C498-C589 HydrophobicContact CB-CB 3.67Å; C498-C589 WeakPolarHBondContact CB-SG 3.39Å; C498-C589 WeakPolarHBondContact SG-CB 3.26Å; C498-C589 CovalentContact SG-SG 2.04Å; C498-C589 PolarHBondContact SG-SG 2.97Å
499	E	88.4	Confident	90.5	Very high	49 Å²	49	61.1 Å²	61.1	23%	0.229	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.7	176.3	-69.8	-179.8	151.4	0	0	112.9	A501 F554 R556 V586 C587	E499-A501 VanDerWaalsContact C-N 3.31Å; E499-A501 PolarHBondContact O-N 3.01Å; E499-F554 VanDerWaalsContact CA-O 3.23Å; E499-F554 WeakPolarHBondContact CA-O 3.34Å; E499-F554 VanDerWaalsContact CB-O 3.24Å; E499-F554 WeakPolarHBondContact CB-O 3.24Å; E499-F554 WeakPolarHBondContact CG-O 3.47Å; E499-R556 WeakPolarHBondContact OE1-CB 3.37Å; E499-R556 WeakPolarHBondContact OE1-CD 3.32Å; E499-R556 WeakPolarHBondContact OE1-CG 3.17Å; E499-R556 IonicContact OE1-CZ 3.94Å; E499-R556 PolarHBondContact OE1-N 2.91Å; E499-R556 IonicContact OE1-NH1 3.8Å; E499-R556 PolarHBondContact OE1-NH1 2.86Å; E499-R556 IonicContact OE2-NH1 3.37Å; E499-R556 PolarHBondContact OE2-NH1 2.98Å; E499-V586 HydrophobicContact CG-CG1 3.67Å; E499-C587 PolarHBondContact N-O 3.12Å
500	N	87.1	Confident	90.5	Very high	103 Å²	103	59.6 Å²	59.6	55%	0.551	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	9.9	177.1	65.9	-0.1	0	0	0	114.5	C498	C498-N500 WeakPolarHBondContact CB-OD1 3.5Å; C498-N500 PolarHBondContact O-N 3.15Å
501	A	88.7	Confident	90.7	Very high	2 Å²	2	59.4 Å²	59.4	2%	0.017	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-61.2	141.1	-177.1	0	0	0	0	0	112.6	V497 C498 E499 Q505 T549 N552 F554	V497-A501 HydrophobicContact CG2-CB 3.73Å; C498-A501 WeakPolarHBondContact O-CB 3.45Å; C498-A501 PolarHBondContact O-N 2.77Å; E499-A501 VanDerWaalsContact C-N 3.31Å; E499-A501 PolarHBondContact O-N 3.01Å; A501-Q505 VanDerWaalsContact CA-OE1 3.3Å; A501-T549 HydrophobicContact CB-CG2 4.16Å; A501-N552 WeakPolarHBondContact O-CB 3.18Å; A501-F554 HydrophobicContact CB-CD2 4.25Å; A501-F554 HydrophobicContact CB-CE2 4.4Å
502	R	89.1	Confident	90.7	Very high	194 Å²	194	55.8 Å²	55.8	73%	0.732	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-95.5	151.5	-179.2	-59	-178.8	-175.4	-176.5	2.4	110.2	Q505 T549	R502-Q505 VanDerWaalsContact N-OE1 3.12Å; R502-Q505 WeakPolarHBondContact O-CB 3.27Å; R502-Q505 PolarHBondContact O-N 3.41Å; R502-T549 PolarHBondContact O-OG1 2.91Å
503	P	90.7	Very high	90.9	Very high	78 Å²	78	51.5 Å²	51.5	51%	0.506	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	143.8	172.7	-18	32.9	0	0	0	110.8	Q505 N552	P503-Q505 VanDerWaalsContact C-N 3.32Å; P503-N552 HydrophobicContact CG-CB 4.33Å
504	G	89.8	Confident	91	Very high	55 Å²	55	51.6 Å²	51.6	57%	0.567	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	4.4	-174.2	0	0	0	0	0	115.7	T549	G504-T549 PolarHBondContact N-O 2.96Å; G504-T549 PolarHBondContact N-OG1 2.62Å
505	Q	90.3	Very high	91.2	Very high	74 Å²	74	53.3 Å²	53.3	35%	0.346	28%	0.282	S	S	.	.			trans	-75.4	132.4	175.8	-178	171.6	-18.6	0	0	111.5	A501 R502 P503 L548 T549	A501-Q505 VanDerWaalsContact CA-OE1 3.3Å; R502-Q505 VanDerWaalsContact N-OE1 3.12Å; R502-Q505 WeakPolarHBondContact O-CB 3.27Å; R502-Q505 PolarHBondContact O-N 3.41Å; P503-Q505 VanDerWaalsContact C-N 3.32Å; Q505-L548 WeakPolarHBondContact O-CA 3.05Å; Q505-T549 PolarHBondContact N-OG1 2.77Å; Q505-T549 PolarHBondContact O-N 2.97Å; Q505-T549 PolarHBondContact O-OG1 3.38Å
506	L	91.9	Very high	91.3	Very high	81 Å²	81	52.8 Å²	52.8	42%	0.424	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	129.8	172.4	-179	64.7	0	0	0	110.5	R546 L548	L506-R546 HydrophobicContact CD1-CB 3.7Å; L506-R546 HydrophobicContact CD1-CG 3.86Å; L506-L548 HydrophobicContact CB-CD2 4.12Å; L506-L548 HydrophobicContact CD1-CD2 3.97Å
507	I	89.8	Confident	91.1	Very high	26 Å²	26	54 Å²	54	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-54.6	175.2	-57.9	179	0	0	0	109.4	T495 F496 V497 F535 I547 T549 I584	T495-I507 HydrophobicContact CG2-CG2 3.58Å; F496-I507 WeakPolarHBondContact O-CG2 3.34Å; V497-I507 HydrophobicContact CB-CD1 4.26Å; V497-I507 HydrophobicContact CG2-CD1 4.2Å; I507-F535 HydrophobicContact CD1-CD1 3.41Å; I507-F535 VanDerWaalsContact CD1-CD1 3.41Å; I507-F535 HydrophobicContact CD1-CE1 3.41Å; I507-F535 VanDerWaalsContact CD1-CE1 3.41Å; I507-I547 HydrophobicContact CB-CG2 4.41Å; I507-I547 WeakPolarHBondContact CB-O 3.21Å; I507-I547 HydrophobicContact CD1-CG2 4.33Å; I507-I547 PolarHBondContact N-O 2.89Å; I507-T549 HydrophobicContact CD1-CG2 3.76Å; I507-T549 HydrophobicContact CG1-CG2 3.98Å; I507-I584 HydrophobicContact CD1-CD1 4.38Å; I507-I584 HydrophobicContact CD1-CG2 4.45Å; I507-I584 HydrophobicContact CG2-CG2 4.28Å
508	Q	91.4	Very high	90.8	Very high	59 Å²	59	54.8 Å²	54.8	28%	0.276	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	142.8	-171.5	-174.7	59.7	51	0	0	109.5	Y493 T495 I510 I547	Y493-Q508 HydrophobicContact CD1-CG 4.18Å; T495-Q508 HydrophobicContact CG2-CB 4.03Å; T495-Q508 HydrophobicContact CG2-CG 4.49Å; T495-Q508 PolarHBondContact OG1-OE1 2.62Å; Q508-I510 HydrophobicContact CG-CG2 4.01Å; Q508-I547 HydrophobicContact CB-CB 4.48Å; Q508-I547 WeakPolarHBondContact O-CB 3.42Å; Q508-I547 PolarHBondContact O-N 3.19Å
509	T	94	Very high	90.4	Very high	55 Å²	55	63.5 Å²	63.5	34%	0.337	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.1	158.7	-56.2	0	0	0	0	108	A545	T509-A545 CarbonylContact C-O 3.51Å; T509-A545 WeakPolarHBondContact CA-O 3.31Å
510	I	94.3	Very high	90	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	153.6	175.9	56	163	0	0	0	109.8	F489 Y493 Q508 F526 T544 A545 I547 V566	F489-I510 HydrophobicContact CE1-CD1 3.73Å; F489-I510 HydrophobicContact CZ-CD1 4.24Å; Y493-I510 HydrophobicContact CD1-CG2 4.07Å; Y493-I510 HydrophobicContact CD2-CB 4.22Å; Y493-I510 HydrophobicContact CD2-CG2 3.73Å; Y493-I510 HydrophobicContact CE1-CG2 4.19Å; Y493-I510 HydrophobicContact CE2-CB 3.85Å; Y493-I510 HydrophobicContact CE2-CG2 3.86Å; Y493-I510 HydrophobicContact CG-CG2 3.86Å; Q508-I510 HydrophobicContact CG-CG2 4.01Å; I510-F526 HydrophobicContact CD1-CD1 4.01Å; I510-F526 HydrophobicContact CD1-CE1 4.33Å; I510-T544 CarbonylContact O-C 3.51Å; I510-T544 WeakPolarHBondContact O-CA 3.48Å; I510-T544 VanDerWaalsContact O-CB 3.26Å; I510-T544 WeakPolarHBondContact O-CB 3.36Å; I510-A545 HydrophobicContact CD1-CB 4.32Å; I510-A545 HydrophobicContact CG1-CB 4.02Å; I510-A545 WeakPolarHBondContact CG1-O 3.44Å; I510-A545 PolarHBondContact N-O 3.41Å; I510-A545 PolarHBondContact O-N 2.66Å; I510-I547 HydrophobicContact CD1-CD1 3.9Å; I510-I547 HydrophobicContact CD1-CG1 4.47Å; I510-I547 HydrophobicContact CG1-CD1 4.21Å; I510-I547 HydrophobicContact CG1-CG1 4.31Å; I510-I547 HydrophobicContact CG2-CG1 4.19Å; I510-V566 HydrophobicContact CD1-CB 4.47Å; I510-V566 HydrophobicContact CD1-CG1 3.97Å; I510-V566 HydrophobicContact CD1-CG2 4.25Å
511	S	94.5	Very high	89.9	Confident	36 Å²	36	62.4 Å²	62.4	25%	0.252	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	160.1	174.6	62.2	0	0	0	0	110.1	A490 Y493	A490-S511 WeakPolarHBondContact CB-OG 3.47Å; A490-S511 PolarHBondContact N-O 3.3Å; Y493-S511 PolarHBondContact OH-N 2.97Å; Y493-S511 PolarHBondContact OH-O 3.32Å; Y493-S511 PolarHBondContact OH-OG 3.38Å; Y493-S511 VanDerWaalsContact OH-OG 3.11Å
512	A	92.5	Very high	89.8	Confident	10 Å²	10	65.3 Å²	65.3	8%	0.083	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	165.8	177.2	0	0	0	0	0	111.8	Q488 F524 F526 I568	Q488-A512 CarbonylContact O-C 3.59Å; Q488-A512 WeakPolarHBondContact O-CA 3.3Å; Q488-A512 WeakPolarHBondContact O-CB 3.47Å; A512-F524 HydrophobicContact CB-CB 4.47Å; A512-F524 HydrophobicContact CB-CD2 3.61Å; A512-F524 HydrophobicContact CB-CE2 3.91Å; A512-F524 HydrophobicContact CB-CG 3.96Å; A512-F526 HydrophobicContact CB-CE1 3.92Å; A512-F526 HydrophobicContact CB-CZ 3.69Å; A512-I568 HydrophobicContact CB-CD1 4.13Å; A512-I568 HydrophobicContact CB-CG2 3.78Å
513	V	92.8	Very high	89.9	Confident	73 Å²	73	60 Å²	60	44%	0.442	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.9	168.7	-67.8	0	0	0	0	108.2	Q488 A490	Q488-V513 PolarHBondContact N-O 3.42Å; Q488-V513 PolarHBondContact O-N 3.39Å; A490-V513 HydrophobicContact CB-CG1 3.88Å
514	D	93.6	Very high	90	Very high	22 Å²	22	56.5 Å²	56.5	12%	0.118	34%	0.338	C	S	.	.			trans	-121.7	167.5	162.8	-132.4	-43.7	0	0	0	111.5	N485 P487 Q522 F524	N485-D514 VanDerWaalsContact CB-OD1 3.27Å; N485-D514 WeakPolarHBondContact CB-OD1 3.03Å; P487-D514 WeakPolarHBondContact CA-OD2 3.05Å; P487-D514 WeakPolarHBondContact CB-OD2 3.48Å; P487-D514 WeakPolarHBondContact CD-OD2 3.43Å; D514-Q522 VanDerWaalsContact C-NE2 3.34Å; D514-Q522 PolarHBondContact O-NE2 3.41Å; D514-F524 HydrophobicContact CB-CE1 4Å; D514-F524 HydrophobicContact CB-CZ 4.03Å
515	K	92.2	Very high	90.2	Very high	107 Å²	107	57.6 Å²	57.6	47%	0.465	33%	0.327	S	S	.	.	S	Bend	trans	-88.9	-33	174	-59.3	-157	-90.5	92.2	0	112.7	R449 E450 N485	R449-K515 PolarHBondContact NH2-O 3.46Å; R449-K515 VanDerWaalsContact NH2-O 3.07Å; E450-K515 HydrophobicContact CB-CB 4.45Å; E450-K515 HydrophobicContact CB-CD 4.45Å; E450-K515 HydrophobicContact CG-CB 3.41Å; E450-K515 VanDerWaalsContact CG-CB 3.41Å; E450-K515 HydrophobicContact CG-CD 4.21Å; E450-K515 HydrophobicContact CG-CG 4.42Å; N485-K515 HydrophobicContact CB-CB 4.43Å; N485-K515 PolarHBondContact ND2-NZ 2.8Å; N485-K515 WeakPolarHBondContact OD1-CE 3.21Å; N485-K515 PolarHBondContact OD1-NZ 3.21Å
516	D	92.9	Very high	90.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	31%	0.314	C	S	.	.			trans	-70.3	146.1	-173.9	-54.3	2	0	0	0	109.5	N483 D484 N485 P518 Q522	N483-D516 WeakPolarHBondContact CA-OD2 3.15Å; D484-D516 PolarHBondContact N-OD2 3.42Å; N485-D516 VanDerWaalsContact CB-OD1 3.25Å; N485-D516 WeakPolarHBondContact CB-OD1 3.28Å; N485-D516 PolarHBondContact N-OD2 2.99Å; N485-D516 PolarHBondContact ND2-OD1 3.47Å; D516-P518 WeakPolarHBondContact O-CD 3.43Å; D516-Q522 PolarHBondContact O-NE2 3.31Å
517	D	88.2	Confident	90.4	Very high	100 Å²	100	53.8 Å²	53.8	54%	0.535	31%	0.314	S	S	.	.			trans	-121	65.7	-170.7	-165.3	22.6	0	0	0	111.3	D481 L519	D481-D517 PolarHBondContact OD1-N 2.87Å; D481-D517 VanDerWaalsContact OD2-C 3.3Å; D481-D517 PolarHBondContact OD2-N 3.07Å; D517-L519 PolarHBondContact O-N 3.23Å
518	P	85.6	Confident	90.6	Very high	21 Å²	21	54.6 Å²	54.6	14%	0.136	32%	0.319	C	S	.	.			trans	-62.7	139	-176	26.2	-35.9	0	0	0	110.7	D516 G520 G521 Q522 D572	D516-P518 WeakPolarHBondContact O-CD 3.43Å; P518-G520 PolarHBondContact O-N 3.28Å; P518-G521 PolarHBondContact O-N 3.5Å; P518-Q522 HydrophobicContact CG-CG 4.39Å; P518-D572 WeakPolarHBondContact CB-OD2 3.39Å
519	L	80.2	Confident	90.4	Very high	187 Å²	187	54.4 Å²	54.4	98%	0.979	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-14.4	-173.5	-72.5	165.2	0	0	0	115.5	D517	D517-L519 PolarHBondContact O-N 3.23Å
520	G	80.7	Confident	90.1	Very high	84 Å²	84	55.1 Å²	55.1	87%	0.866	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-6.4	174	0	0	0	0	0	115.5	P518	P518-G520 PolarHBondContact O-N 3.28Å
521	G	84.1	Confident	89.7	Confident	45 Å²	45	61.2 Å²	61.2	46%	0.464	38%	0.376	S	S	.	.			trans	85.3	147.7	-169.4	0	0	0	0	0	113.4	P518	P518-G521 PolarHBondContact O-N 3.5Å
522	Q	87.2	Confident	89.4	Confident	63 Å²	63	60.8 Å²	60.8	29%	0.294	37%	0.371	S	S	.	.			trans	-61.5	135.7	-179.7	-63.9	175.4	-5.8	0	0	112	D514 D516 P518 F524 N543	D514-Q522 VanDerWaalsContact C-NE2 3.34Å; D514-Q522 PolarHBondContact O-NE2 3.41Å; D516-Q522 PolarHBondContact O-NE2 3.31Å; P518-Q522 HydrophobicContact CG-CG 4.39Å; Q522-F524 HydrophobicContact CB-CE1 4.19Å; Q522-F524 HydrophobicContact CB-CE2 4.32Å; Q522-F524 HydrophobicContact CB-CZ 3.75Å; Q522-F524 HydrophobicContact CG-CZ 4.3Å; Q522-N543 PolarHBondContact O-ND2 3.08Å
523	K	91.1	Very high	89.2	Confident	82 Å²	82	64.5 Å²	64.5	36%	0.357	39%	0.394	S	S	.	.			trans	-134.2	131.2	169.7	-177.6	172.8	-178.5	173.5	0	111.1	F525 N543 D570 N571	K523-F525 HydrophobicContact CD-CZ 4.48Å; K523-N543 WeakPolarHBondContact CA-OD1 3.48Å; K523-D570 CarbonylContact O-C 3.58Å; K523-D570 WeakPolarHBondContact O-CA 3Å; K523-N571 HydrophobicContact CB-CB 4.17Å; K523-N571 PolarHBondContact O-N 3.41Å
524	F	93	Very high	89.2	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.018	38%	0.38	C	S	.	.			trans	-116.4	152.8	-177.5	-50.1	-54.2	0	0	0	113	P487 A512 D514 Q522 F526 N543 I568 S569	P487-F524 HydrophobicContact CB-CD1 3.6Å; P487-F524 HydrophobicContact CB-CE1 3.55Å; P487-F524 HydrophobicContact CB-CG 4.49Å; P487-F524 HydrophobicContact CB-CZ 4.38Å; P487-F524 HydrophobicContact CG-CD1 4.12Å; P487-F524 HydrophobicContact CG-CE1 4.38Å; A512-F524 HydrophobicContact CB-CB 4.47Å; A512-F524 HydrophobicContact CB-CD2 3.61Å; A512-F524 HydrophobicContact CB-CE2 3.91Å; A512-F524 HydrophobicContact CB-CG 3.96Å; D514-F524 HydrophobicContact CB-CE1 4Å; D514-F524 HydrophobicContact CB-CZ 4.03Å; Q522-F524 HydrophobicContact CB-CE1 4.19Å; Q522-F524 HydrophobicContact CB-CE2 4.32Å; Q522-F524 HydrophobicContact CB-CZ 3.75Å; Q522-F524 HydrophobicContact CG-CZ 4.3Å; F524-F526 HydrophobicContact CB-CE2 3.97Å; F524-F526 HydrophobicContact CB-CZ 4.21Å; F524-N543 HydrophobicContact CD2-CB 3.83Å; F524-N543 HydrophobicContact CE2-CB 4.41Å; F524-N543 PolarHBondContact N-OD1 2.73Å; F524-I568 HydrophobicContact CB-CG2 4.2Å; F524-S569 CarbonylContact C-O 3.51Å; F524-S569 WeakPolarHBondContact CA-O 3.19Å
525	F	93.3	Very high	89.2	Confident	78 Å²	78	61.3 Å²	61.3	34%	0.342	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.8	168.7	-57.3	-77.1	0	0	0	110.9	K523 D539 I568 S569 D570 N571	K523-F525 HydrophobicContact CD-CZ 4.48Å; F525-D539 WeakPolarHBondContact CA-OD2 3.13Å; F525-I568 WeakPolarHBondContact O-CA 3.18Å; F525-S569 PolarHBondContact N-O 3.31Å; F525-S569 PolarHBondContact O-N 3.34Å; F525-S569 VanDerWaalsContact O-N 3.07Å; F525-D570 WeakPolarHBondContact CD2-O 3.21Å; F525-N571 HydrophobicContact CE2-CB 3.86Å; F525-N571 VanDerWaalsContact CE2-OD1 3.26Å; F525-N571 WeakPolarHBondContact CE2-OD1 3.17Å; F525-N571 WeakPolarHBondContact CZ-OD1 3.24Å
526	F	94.4	Very high	89.2	Confident	13 Å²	13	58.3 Å²	58.3	6%	0.057	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.1	-176.2	-61.7	-93.7	0	0	0	112.1	I510 A512 F524 V537 D539 N543 A545 V566 I568	I510-F526 HydrophobicContact CD1-CD1 4.01Å; I510-F526 HydrophobicContact CD1-CE1 4.33Å; A512-F526 HydrophobicContact CB-CE1 3.92Å; A512-F526 HydrophobicContact CB-CZ 3.69Å; F524-F526 HydrophobicContact CB-CE2 3.97Å; F524-F526 HydrophobicContact CB-CZ 4.21Å; F526-V537 HydrophobicContact CB-CG1 3.89Å; F526-D539 PolarHBondContact N-OD2 2.83Å; F526-N543 WeakPolarHBondContact CZ-O 3.38Å; F526-A545 HydrophobicContact CB-CB 3.57Å; F526-A545 HydrophobicContact CD1-CB 4.07Å; F526-A545 HydrophobicContact CD2-CB 3.71Å; F526-A545 HydrophobicContact CE2-CB 4.4Å; F526-A545 HydrophobicContact CG-CB 3.52Å; F526-V566 HydrophobicContact CB-CG1 4.4Å; F526-V566 HydrophobicContact CD1-CG1 4.25Å; F526-I568 HydrophobicContact CD1-CG1 4.17Å; F526-I568 HydrophobicContact CD1-CG2 4.21Å; F526-I568 HydrophobicContact CE1-CD1 4.33Å; F526-I568 HydrophobicContact CE1-CG1 4.18Å; F526-I568 HydrophobicContact CE1-CG2 3.93Å; F526-I568 HydrophobicContact CZ-CG2 4.35Å
527	S	93.4	Very high	89.2	Confident	62 Å²	62	59.6 Å²	59.6	43%	0.434	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	170.9	177.3	69.2	0	0	0	0	112.5	V566 V567	S527-V566 CarbonylContact O-C 3.5Å; S527-V566 VanDerWaalsContact O-CA 3.31Å; S527-V566 WeakPolarHBondContact O-CA 3.42Å; S527-V566 VanDerWaalsContact O-CG1 3.29Å; S527-V566 WeakPolarHBondContact O-CG1 3.48Å; S527-V567 PolarHBondContact N-O 3.25Å; S527-V567 PolarHBondContact O-N 2.91Å
528	L	92.4	Very high	89.4	Confident	44 Å²	44	59.8 Å²	59.8	23%	0.23	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.4	175.3	-77.3	176.1	0	0	0	110.8	A530 N532 V537 L564 V566	L528-A530 WeakPolarHBondContact CB-O 3.47Å; L528-A530 PolarHBondContact O-N 3.41Å; L528-A530 VanDerWaalsContact O-N 3.11Å; L528-N532 HydrophobicContact CD1-CB 3.96Å; L528-V537 HydrophobicContact CD1-CG2 4.48Å; L528-V537 HydrophobicContact CD2-CB 4.5Å; L528-V537 HydrophobicContact CD2-CG2 3.51Å; L528-V537 HydrophobicContact CG-CB 4.12Å; L528-V537 HydrophobicContact CG-CG2 3.65Å; L528-L564 HydrophobicContact CD2-CD1 3.55Å; L528-L564 HydrophobicContact CD2-CD2 4.21Å; L528-L564 HydrophobicContact CD2-CG 3.81Å; L528-V566 HydrophobicContact CD2-CG2 4.37Å
529	A	88.6	Confident	89.7	Confident	55 Å²	55	60.7 Å²	60.7	46%	0.455	37%	0.374	S	S	.	.	S	Bend	trans	-61.2	-22.7	179.1	0	0	0	0	0	113.6	P565 V567 T579	A529-P565 HydrophobicContact CB-CB 4.02Å; A529-P565 HydrophobicContact CB-CG 4.16Å; A529-P565 PolarHBondContact N-O 2.82Å; A529-V567 HydrophobicContact CB-CG2 3.71Å; A529-T579 HydrophobicContact CB-CG2 4.29Å
530	A	86.7	Confident	90.3	Very high	69 Å²	69	53.4 Å²	53.4	57%	0.57	34%	0.336	S	S	*	.	S	Bend	trans	-151.8	158.4	172	0	0	0	0	0	110.8	L528 N532	L528-A530 WeakPolarHBondContact CB-O 3.47Å; L528-A530 PolarHBondContact O-N 3.41Å; L528-A530 VanDerWaalsContact O-N 3.11Å; A530-N532 PolarHBondContact O-N 2.86Å
531	V	85.7	Confident	90.6	Very high	130 Å²	130	56.9 Å²	56.9	79%	0.788	33%	0.33	S	S	*	.			trans	-64.3	100.8	179.1	-177.2	0	0	0	0	110.6
532	N	88	Confident	90.9	Very high	27 Å²	27	59.1 Å²	59.1	14%	0.144	33%	0.331	C	S	.	.			trans	-83.5	132.6	-178.9	-162.1	-69	0	0	0	111.3	L528 A530 N534 F535 R550 L564	L528-N532 HydrophobicContact CD1-CB 3.96Å; A530-N532 PolarHBondContact O-N 2.86Å; N532-N534 WeakPolarHBondContact OD1-CA 3.5Å; N532-N534 WeakPolarHBondContact OD1-CB 3.46Å; N532-N534 PolarHBondContact OD1-N 2.86Å; N532-F535 PolarHBondContact OD1-N 2.74Å; N532-F535 VanDerWaalsContact OD1-N 3.1Å; N532-R550 WeakPolarHBondContact O-CD 3.29Å; N532-R550 PolarHBondContact O-NH1 2.82Å; N532-L564 HydrophobicContact CB-CD1 4.04Å; N532-L564 VanDerWaalsContact ND2-CD1 3.29Å; N532-L564 WeakPolarHBondContact ND2-CD1 3.37Å
533	P	89.8	Confident	91	Very high	87 Å²	87	58.2 Å²	58.2	57%	0.565	33%	0.328	S	S	*	.	S	Bend	trans	-83.5	-17.9	177.9	32.7	-35.2	0	0	0	113.4
534	N	91.1	Very high	91.1	Very high	28 Å²	28	56 Å²	56	15%	0.15	32%	0.321	C	S	.	.	S	Bend	trans	-97.5	-32.5	-173	-53.7	-58.9	0	0	0	112.7	N532 R550 K551 F554 Y562	N532-N534 WeakPolarHBondContact OD1-CA 3.5Å; N532-N534 WeakPolarHBondContact OD1-CB 3.46Å; N532-N534 PolarHBondContact OD1-N 2.86Å; N534-R550 PolarHBondContact O-N 3.32Å; N534-K551 HydrophobicContact CB-CD 4.49Å; N534-K551 WeakPolarHBondContact OD1-CD 3.36Å; N534-K551 WeakPolarHBondContact OD1-CE 3.43Å; N534-K551 PolarHBondContact OD1-NZ 2.86Å; N534-F554 HydrophobicContact CB-CE1 4.33Å; N534-Y562 HydrophobicContact CB-CE1 4.37Å; N534-Y562 WeakPolarHBondContact ND2-CE1 3.01Å
535	F	93.5	Very high	91.2	Very high	1 Å²	1	55.8 Å²	55.8	0%	0.004	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	162.5	-173.5	-50.3	-72.9	0	0	0	112.2	I507 N532 L548 F554 Y562 L564 I584	I507-F535 HydrophobicContact CD1-CD1 3.41Å; I507-F535 VanDerWaalsContact CD1-CD1 3.41Å; I507-F535 HydrophobicContact CD1-CE1 3.41Å; I507-F535 VanDerWaalsContact CD1-CE1 3.41Å; N532-F535 PolarHBondContact OD1-N 2.74Å; N532-F535 VanDerWaalsContact OD1-N 3.1Å; F535-L548 CarbonylContact C-O 3.14Å; F535-L548 VanDerWaalsContact CA-O 3.24Å; F535-L548 WeakPolarHBondContact CA-O 3.4Å; F535-F554 HydrophobicContact CD1-CZ 4.49Å; F535-F554 AromaticContact CE1-CE1 3.75Å; F535-F554 HydrophobicContact CE1-CE1 3.75Å; F535-F554 AromaticContact CE1-CZ 3.79Å; F535-F554 HydrophobicContact CE1-CZ 3.79Å; F535-F554 AromaticContact CZ-CE1 3.65Å; F535-F554 HydrophobicContact CZ-CE1 3.65Å; F535-F554 HydrophobicContact CZ-CZ 4.18Å; F535-Y562 AromaticContact CE2-CD1 3.99Å; F535-Y562 HydrophobicContact CE2-CD1 3.99Å; F535-Y562 HydrophobicContact CE2-CD2 4.06Å; F535-Y562 AromaticContact CE2-CG 3.64Å; F535-Y562 HydrophobicContact CE2-CG 3.64Å; F535-Y562 AromaticContact CZ-CD2 3.88Å; F535-Y562 HydrophobicContact CZ-CD2 3.88Å; F535-Y562 HydrophobicContact CZ-CE2 4.43Å; F535-Y562 AromaticContact CZ-CG 3.97Å; F535-Y562 HydrophobicContact CZ-CG 3.97Å; F535-L564 HydrophobicContact CB-CD1 4.16Å; F535-L564 HydrophobicContact CB-CD2 3.85Å; F535-L564 HydrophobicContact CD2-CD1 4.24Å; F535-L564 HydrophobicContact CD2-CD2 4.46Å; F535-L564 HydrophobicContact CG-CD2 4.31Å; F535-I584 HydrophobicContact CD1-CD1 4.04Å; F535-I584 HydrophobicContact CD2-CD1 4.02Å; F535-I584 HydrophobicContact CE1-CD1 3.95Å; F535-I584 HydrophobicContact CE1-CG2 4.27Å; F535-I584 HydrophobicContact CE2-CD1 3.92Å; F535-I584 HydrophobicContact CG-CD1 4.08Å; F535-I584 HydrophobicContact CZ-CB 4.43Å; F535-I584 HydrophobicContact CZ-CD1 3.88Å; F535-I584 HydrophobicContact CZ-CG2 4.1Å
536	T	93	Very high	91.2	Very high	44 Å²	44	57.2 Å²	57.2	27%	0.27	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140	171	47.1	0	0	0	0	110.4	L548 R550	T536-L548 PolarHBondContact N-O 2.84Å; T536-L548 PolarHBondContact O-N 2.96Å; T536-R550 HydrophobicContact CG2-CB 4.22Å; T536-R550 HydrophobicContact CG2-CG 4.05Å
537	V	93.1	Very high	91.2	Very high	28 Å²	28	56.6 Å²	56.6	17%	0.17	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.8	164.2	172.9	0	0	0	0	108.1	F526 L528 A545 I547 V566	F526-V537 HydrophobicContact CB-CG1 3.89Å; L528-V537 HydrophobicContact CD1-CG2 4.48Å; L528-V537 HydrophobicContact CD2-CB 4.5Å; L528-V537 HydrophobicContact CD2-CG2 3.51Å; L528-V537 HydrophobicContact CG-CB 4.12Å; L528-V537 HydrophobicContact CG-CG2 3.65Å; V537-A545 HydrophobicContact CG1-CB 4.02Å; V537-I547 HydrophobicContact CG2-CD1 3.7Å; V537-V566 HydrophobicContact CG2-CG1 4.08Å; V537-V566 HydrophobicContact CG2-CG2 3.86Å
538	Q	93.3	Very high	91.2	Very high	103 Å²	103	55 Å²	55	48%	0.481	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.4	163.1	171.4	177.9	2.7	0	0	107.8	A545 R546 L548	Q538-A545 CarbonylContact O-C 3.37Å; Q538-A545 WeakPolarHBondContact O-CA 3.32Å; Q538-A545 WeakPolarHBondContact O-CB 3.33Å; Q538-R546 HydrophobicContact CB-CB 4.42Å; Q538-R546 PolarHBondContact N-O 3.1Å; Q538-R546 PolarHBondContact O-N 3.07Å; Q538-L548 HydrophobicContact CB-CD1 4.32Å
539	D	92.1	Very high	91.2	Very high	41 Å²	41	53 Å²	53	22%	0.219	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	144.7	169.2	-153.7	-43.1	0	0	0	110.4	F525 F526 E541	F525-D539 WeakPolarHBondContact CA-OD2 3.13Å; F526-D539 PolarHBondContact N-OD2 2.83Å; D539-E541 PolarHBondContact OD1-N 2.7Å
540	N	91.1	Very high	91.3	Very high	34 Å²	34	56.4 Å²	56.4	18%	0.182	30%	0.298	C	S	.	.			trans	-102.3	-6.1	175.1	-62.9	-36.4	0	0	0	113	D542 T544 R546	N540-D542 VanDerWaalsContact CB-OD1 3.23Å; N540-D542 WeakPolarHBondContact CB-OD1 3.48Å; N540-D542 PolarHBondContact O-N 2.92Å; N540-T544 VanDerWaalsContact CB-O 3.3Å; N540-T544 WeakPolarHBondContact CB-O 2.81Å; N540-T544 PolarHBondContact N-O 2.7Å; N540-T544 VanDerWaalsContact N-O 3.1Å; N540-T544 PolarHBondContact ND2-O 3.38Å; N540-T544 PolarHBondContact ND2-OG1 2.95Å; N540-R546 WeakPolarHBondContact OD1-CD 3.12Å; N540-R546 WeakPolarHBondContact OD1-CG 3.49Å; N540-R546 PolarHBondContact OD1-NE 2.88Å
541	E	87.8	Confident	91.4	Very high	156 Å²	156	55.9 Å²	55.9	73%	0.729	28%	0.283	S	S	*	.	S	Bend	trans	63.2	12.4	-172.4	-53	-178.2	-160.2	0	0	114.7	D539	D539-E541 PolarHBondContact OD1-N 2.7Å
542	D	89.4	Confident	91.4	Very high	92 Å²	92	54.8 Å²	54.8	49%	0.492	27%	0.273	S	S	.	.	S	Bend	trans	-116.1	25.4	-176	69	9.1	0	0	0	113.8	N540 T544	N540-D542 VanDerWaalsContact CB-OD1 3.23Å; N540-D542 WeakPolarHBondContact CB-OD1 3.48Å; N540-D542 PolarHBondContact O-N 2.92Å; D542-T544 PolarHBondContact O-N 3.14Å; D542-T544 WeakPolarHBondContact OD1-CA 3.2Å; D542-T544 VanDerWaalsContact OD1-CB 3.26Å; D542-T544 WeakPolarHBondContact OD1-CB 3.15Å; D542-T544 PolarHBondContact OD1-N 3.17Å; D542-T544 PolarHBondContact OD1-OG1 2.88Å
543	N	90.4	Very high	91.2	Very high	45 Å²	45	56 Å²	56	24%	0.241	29%	0.292	C	S	.	.	S	Bend	trans	62.9	14.1	-169	-67.7	-10.4	0	0	0	114.9	Q522 K523 F524 F526	Q522-N543 PolarHBondContact O-ND2 3.08Å; K523-N543 WeakPolarHBondContact CA-OD1 3.48Å; F524-N543 HydrophobicContact CD2-CB 3.83Å; F524-N543 HydrophobicContact CE2-CB 4.41Å; F524-N543 PolarHBondContact N-OD1 2.73Å; F526-N543 WeakPolarHBondContact CZ-O 3.38Å
544	T	93.4	Very high	91.2	Very high	34 Å²	34	52.2 Å²	52.2	21%	0.209	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	159.3	169.8	82.6	0	0	0	0	112.2	I510 N540 D542	I510-T544 CarbonylContact O-C 3.51Å; I510-T544 WeakPolarHBondContact O-CA 3.48Å; I510-T544 VanDerWaalsContact O-CB 3.26Å; I510-T544 WeakPolarHBondContact O-CB 3.36Å; N540-T544 VanDerWaalsContact CB-O 3.3Å; N540-T544 WeakPolarHBondContact CB-O 2.81Å; N540-T544 PolarHBondContact N-O 2.7Å; N540-T544 VanDerWaalsContact N-O 3.1Å; N540-T544 PolarHBondContact ND2-O 3.38Å; N540-T544 PolarHBondContact ND2-OG1 2.95Å; D542-T544 PolarHBondContact O-N 3.14Å; D542-T544 WeakPolarHBondContact OD1-CA 3.2Å; D542-T544 VanDerWaalsContact OD1-CB 3.26Å; D542-T544 WeakPolarHBondContact OD1-CB 3.15Å; D542-T544 PolarHBondContact OD1-N 3.17Å; D542-T544 PolarHBondContact OD1-OG1 2.88Å
545	A	93.9	Very high	90.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.4	175	0	0	0	0	0	112.2	T509 I510 F526 V537 Q538	T509-A545 CarbonylContact C-O 3.51Å; T509-A545 WeakPolarHBondContact CA-O 3.31Å; I510-A545 HydrophobicContact CD1-CB 4.32Å; I510-A545 HydrophobicContact CG1-CB 4.02Å; I510-A545 WeakPolarHBondContact CG1-O 3.44Å; I510-A545 PolarHBondContact N-O 3.41Å; I510-A545 PolarHBondContact O-N 2.66Å; F526-A545 HydrophobicContact CB-CB 3.57Å; F526-A545 HydrophobicContact CD1-CB 4.07Å; F526-A545 HydrophobicContact CD2-CB 3.71Å; F526-A545 HydrophobicContact CE2-CB 4.4Å; F526-A545 HydrophobicContact CG-CB 3.52Å; V537-A545 HydrophobicContact CG1-CB 4.02Å; Q538-A545 CarbonylContact O-C 3.37Å; Q538-A545 WeakPolarHBondContact O-CA 3.32Å; Q538-A545 WeakPolarHBondContact O-CB 3.33Å
546	R	94.4	Very high	90.5	Very high	108 Å²	108	55.2 Å²	55.2	41%	0.408	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.6	179.5	-69.1	175.4	-152.4	-129.6	-6.3	110.8	L506 Q538 N540 L548	L506-R546 HydrophobicContact CD1-CB 3.7Å; L506-R546 HydrophobicContact CD1-CG 3.86Å; Q538-R546 HydrophobicContact CB-CB 4.42Å; Q538-R546 PolarHBondContact N-O 3.1Å; Q538-R546 PolarHBondContact O-N 3.07Å; N540-R546 WeakPolarHBondContact OD1-CD 3.12Å; N540-R546 WeakPolarHBondContact OD1-CG 3.49Å; N540-R546 PolarHBondContact OD1-NE 2.88Å; R546-L548 HydrophobicContact CB-CD2 4.2Å; R546-L548 HydrophobicContact CB-CG 4.49Å
547	I	94.1	Very high	89.9	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	113.1	173	-52.1	-64.5	0	0	0	108.1	I507 Q508 I510 V537 L564 V566 L582 I584	I507-I547 HydrophobicContact CB-CG2 4.41Å; I507-I547 WeakPolarHBondContact CB-O 3.21Å; I507-I547 HydrophobicContact CD1-CG2 4.33Å; I507-I547 PolarHBondContact N-O 2.89Å; Q508-I547 HydrophobicContact CB-CB 4.48Å; Q508-I547 WeakPolarHBondContact O-CB 3.42Å; Q508-I547 PolarHBondContact O-N 3.19Å; I510-I547 HydrophobicContact CD1-CD1 3.9Å; I510-I547 HydrophobicContact CD1-CG1 4.47Å; I510-I547 HydrophobicContact CG1-CD1 4.21Å; I510-I547 HydrophobicContact CG1-CG1 4.31Å; I510-I547 HydrophobicContact CG2-CG1 4.19Å; V537-I547 HydrophobicContact CG2-CD1 3.7Å; I547-L564 HydrophobicContact CD1-CD2 4.23Å; I547-L564 HydrophobicContact CG2-CD2 3.78Å; I547-V566 HydrophobicContact CD1-CG2 4.31Å; I547-L582 HydrophobicContact CB-CD2 4.22Å; I547-L582 HydrophobicContact CD1-CD2 4.07Å; I547-L582 HydrophobicContact CG1-CD2 3.67Å; I547-L582 HydrophobicContact CG2-CD2 3.85Å; I547-I584 HydrophobicContact CG2-CD1 4.22Å
548	L	93.7	Very high	89.5	Confident	29 Å²	29	64.4 Å²	64.4	15%	0.152	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.7	-176.9	-51.7	177.9	0	0	0	110.8	Q505 L506 F535 T536 Q538 R546	Q505-L548 WeakPolarHBondContact O-CA 3.05Å; L506-L548 HydrophobicContact CB-CD2 4.12Å; L506-L548 HydrophobicContact CD1-CD2 3.97Å; F535-L548 CarbonylContact C-O 3.14Å; F535-L548 VanDerWaalsContact CA-O 3.24Å; F535-L548 WeakPolarHBondContact CA-O 3.4Å; T536-L548 PolarHBondContact N-O 2.84Å; T536-L548 PolarHBondContact O-N 2.96Å; Q538-L548 HydrophobicContact CB-CD1 4.32Å; R546-L548 HydrophobicContact CB-CD2 4.2Å; R546-L548 HydrophobicContact CB-CG 4.49Å
549	T	92.4	Very high	89.2	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.8	166.6	49.7	0	0	0	0	111.3	V497 A501 R502 G504 Q505 I507 F554	V497-T549 HydrophobicContact CG2-CG2 3.69Å; A501-T549 HydrophobicContact CB-CG2 4.16Å; R502-T549 PolarHBondContact O-OG1 2.91Å; G504-T549 PolarHBondContact N-O 2.96Å; G504-T549 PolarHBondContact N-OG1 2.62Å; Q505-T549 PolarHBondContact N-OG1 2.77Å; Q505-T549 PolarHBondContact O-N 2.97Å; Q505-T549 PolarHBondContact O-OG1 3.38Å; I507-T549 HydrophobicContact CD1-CG2 3.76Å; I507-T549 HydrophobicContact CG1-CG2 3.98Å; T549-F554 HydrophobicContact CG2-CE2 3.79Å; T549-F554 HydrophobicContact CG2-CZ 4.02Å
550	R	91.3	Very high	89	Confident	127 Å²	127	64.2 Å²	64.2	48%	0.479	32%	0.323	S	S	.	.	S	Bend	trans	-95.3	-29.6	174.1	-163.6	-179.1	-173.8	170.2	2.9	113.1	N532 N534 T536	N532-R550 WeakPolarHBondContact O-CD 3.29Å; N532-R550 PolarHBondContact O-NH1 2.82Å; N534-R550 PolarHBondContact O-N 3.32Å; T536-R550 HydrophobicContact CG2-CB 4.22Å; T536-R550 HydrophobicContact CG2-CG 4.05Å
551	K	88.3	Confident	89	Confident	58 Å²	58	65.7 Å²	65.7	25%	0.252	33%	0.334	S	S	.	.			trans	-115	173.7	176.8	74.8	173.2	-171.4	-168.1	0	111.9	N534 F554 Y562	N534-K551 HydrophobicContact CB-CD 4.49Å; N534-K551 WeakPolarHBondContact OD1-CD 3.36Å; N534-K551 WeakPolarHBondContact OD1-CE 3.43Å; N534-K551 PolarHBondContact OD1-NZ 2.86Å; K551-F554 HydrophobicContact CD-CE1 4.43Å; K551-F554 HydrophobicContact CD-CZ 4.48Å; K551-F554 VanDerWaalsContact CE-CE1 3.47Å; K551-F554 HydrophobicContact CG-CE1 4.11Å; K551-F554 HydrophobicContact CG-CE2 4.06Å; K551-F554 HydrophobicContact CG-CZ 3.69Å; K551-F554 WeakPolarHBondContact O-CE2 3.22Å; K551-Y562 PolarHBondContact NZ-OH 3.38Å
552	N	84.8	Confident	89.2	Confident	107 Å²	107	59.3 Å²	59.3	57%	0.572	30%	0.303	S	S	*	.	S	Bend	trans	-110	-175.3	159	59.7	-11.8	0	0	0	110	A501 P503	A501-N552 WeakPolarHBondContact O-CB 3.18Å; P503-N552 HydrophobicContact CG-CB 4.33Å
553	G	85.3	Confident	89.3	Confident	53 Å²	53	60.3 Å²	60.3	55%	0.546	31%	0.308	S	S	.	.			trans	70.9	50.8	176	0	0	0	0	0	112.4
554	F	89	Confident	89.4	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.026	30%	0.296	C	S	.	.			trans	-81	136.6	167.7	-62.3	-87.9	0	0	0	108.4	V497 E499 A501 N534 F535 T549 K551 Y562 V586	V497-F554 HydrophobicContact CG1-CD1 4.01Å; V497-F554 HydrophobicContact CG1-CE1 4.34Å; V497-F554 HydrophobicContact CG1-CG 4.15Å; V497-F554 HydrophobicContact CG2-CD2 3.9Å; V497-F554 HydrophobicContact CG2-CE2 3.88Å; V497-F554 HydrophobicContact CG2-CG 4.28Å; V497-F554 HydrophobicContact CG2-CZ 4.22Å; E499-F554 VanDerWaalsContact CA-O 3.23Å; E499-F554 WeakPolarHBondContact CA-O 3.34Å; E499-F554 VanDerWaalsContact CB-O 3.24Å; E499-F554 WeakPolarHBondContact CB-O 3.24Å; E499-F554 WeakPolarHBondContact CG-O 3.47Å; A501-F554 HydrophobicContact CB-CD2 4.25Å; A501-F554 HydrophobicContact CB-CE2 4.4Å; N534-F554 HydrophobicContact CB-CE1 4.33Å; F535-F554 HydrophobicContact CD1-CZ 4.49Å; F535-F554 AromaticContact CE1-CE1 3.75Å; F535-F554 HydrophobicContact CE1-CE1 3.75Å; F535-F554 AromaticContact CE1-CZ 3.79Å; F535-F554 HydrophobicContact CE1-CZ 3.79Å; F535-F554 AromaticContact CZ-CE1 3.65Å; F535-F554 HydrophobicContact CZ-CE1 3.65Å; F535-F554 HydrophobicContact CZ-CZ 4.18Å; T549-F554 HydrophobicContact CG2-CE2 3.79Å; T549-F554 HydrophobicContact CG2-CZ 4.02Å; K551-F554 HydrophobicContact CD-CE1 4.43Å; K551-F554 HydrophobicContact CD-CZ 4.48Å; K551-F554 VanDerWaalsContact CE-CE1 3.47Å; K551-F554 HydrophobicContact CG-CE1 4.11Å; K551-F554 HydrophobicContact CG-CE2 4.06Å; K551-F554 HydrophobicContact CG-CZ 3.69Å; K551-F554 WeakPolarHBondContact O-CE2 3.22Å; F554-Y562 AromaticContact CD1-CE2 3.8Å; F554-Y562 HydrophobicContact CD1-CE2 3.8Å; F554-Y562 HydrophobicContact CE1-CE2 4.16Å; F554-V586 HydrophobicContact CB-CG1 3.86Å; F554-V586 HydrophobicContact CB-CG2 4.37Å
555	N	86	Confident	89.4	Confident	47 Å²	47	58.7 Å²	58.7	25%	0.251	30%	0.3	S	S	.	.			trans	-137.7	117.1	-178	176.7	5.4	0	0	0	109.1	H557 E558 I559	N555-H557 PolarHBondContact O-N 3.47Å; N555-H557 VanDerWaalsContact O-N 3.14Å; N555-H557 WeakPolarHBondContact OD1-CB 3.4Å; N555-H557 PolarHBondContact OD1-N 3.27Å; N555-H557 VanDerWaalsContact OD1-N 3.11Å; N555-H557 PolarHBondContact OD1-ND1 2.85Å; N555-E558 HydrophobicContact CB-CB 4.34Å; N555-E558 HydrophobicContact CB-CG 4.29Å; N555-E558 PolarHBondContact ND2-OE1 2.93Å; N555-E558 PolarHBondContact O-N 3.25Å; N555-E558 VanDerWaalsContact O-N 3.08Å; N555-I559 PolarHBondContact O-N 3.31Å; N555-I559 VanDerWaalsContact O-N 3.14Å
556	R	84.2	Confident	89.4	Confident	46 Å²	46	58.7 Å²	58.7	17%	0.174	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.8	-175.9	78	-167.1	176.1	-83.9	6.3	113.9	E499 V586 S599	E499-R556 WeakPolarHBondContact OE1-CB 3.37Å; E499-R556 WeakPolarHBondContact OE1-CD 3.32Å; E499-R556 WeakPolarHBondContact OE1-CG 3.17Å; E499-R556 IonicContact OE1-CZ 3.94Å; E499-R556 PolarHBondContact OE1-N 2.91Å; E499-R556 IonicContact OE1-NH1 3.8Å; E499-R556 PolarHBondContact OE1-NH1 2.86Å; E499-R556 IonicContact OE2-NH1 3.37Å; E499-R556 PolarHBondContact OE2-NH1 2.98Å; R556-V586 HydrophobicContact CB-CB 4.11Å; R556-V586 HydrophobicContact CB-CG1 4Å; R556-V586 WeakPolarHBondContact CB-O 3.23Å; R556-S599 PolarHBondContact NE-O 2.9Å
557	H	81.2	Confident	89.4	Confident	119 Å²	119	55 Å²	55	55%	0.551	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-17.9	176.8	-47.1	87.5	0	0	0	112.9	N555	N555-H557 PolarHBondContact O-N 3.47Å; N555-H557 VanDerWaalsContact O-N 3.14Å; N555-H557 WeakPolarHBondContact OD1-CB 3.4Å; N555-H557 PolarHBondContact OD1-N 3.27Å; N555-H557 VanDerWaalsContact OD1-N 3.11Å; N555-H557 PolarHBondContact OD1-ND1 2.85Å
558	E	84.5	Confident	89.4	Confident	146 Å²	146	55 Å²	55	68%	0.682	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-53.1	172.9	-74.7	165.5	-132.3	0	0	110.8	N555	N555-E558 HydrophobicContact CB-CB 4.34Å; N555-E558 HydrophobicContact CB-CG 4.29Å; N555-E558 PolarHBondContact ND2-OE1 2.93Å; N555-E558 PolarHBondContact O-N 3.25Å; N555-E558 VanDerWaalsContact O-N 3.08Å
559	I	86.7	Confident	89.4	Confident	75 Å²	75	55.2 Å²	55.2	39%	0.385	29%	0.294	S	S	.	.			trans	-142.5	108.2	179.1	-58.4	179.4	0	0	0	107.6	N555 T561 Y562 V586	N555-I559 PolarHBondContact O-N 3.31Å; N555-I559 VanDerWaalsContact O-N 3.14Å; I559-T561 VanDerWaalsContact CG2-O 3.27Å; I559-T561 WeakPolarHBondContact CG2-O 3.38Å; I559-Y562 HydrophobicContact CB-CE1 4.36Å; I559-Y562 HydrophobicContact CB-CE2 4.17Å; I559-Y562 HydrophobicContact CD1-CE1 3.83Å; I559-Y562 HydrophobicContact CG2-CD1 4.09Å; I559-Y562 HydrophobicContact CG2-CD2 4.05Å; I559-Y562 HydrophobicContact CG2-CE1 3.86Å; I559-Y562 HydrophobicContact CG2-CE2 3.8Å; I559-Y562 HydrophobicContact CG2-CG 4.19Å; I559-V586 WeakPolarHBondContact O-CG2 3.44Å
560	S	87.4	Confident	89.5	Confident	64 Å²	64	55.5 Å²	55.5	45%	0.448	30%	0.295	S	S	.	.	S	Bend	trans	-80.6	-24.4	179.2	53.4	0	0	0	0	113.8	R585 V586	S560-R585 CarbonylContact O-C 3.56Å; S560-R585 WeakPolarHBondContact O-CA 3.06Å; S560-V586 PolarHBondContact O-N 2.65Å
561	T	91.1	Very high	89.4	Confident	65 Å²	65	54.2 Å²	54.2	40%	0.399	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	133.3	-179.7	-53.1	0	0	0	0	110.7	I559 I584 R585	I559-T561 VanDerWaalsContact CG2-O 3.27Å; I559-T561 WeakPolarHBondContact CG2-O 3.38Å; T561-I584 CarbonylContact C-O 3.56Å; T561-I584 WeakPolarHBondContact CA-O 3.4Å; T561-R585 HydrophobicContact CG2-CG 4.25Å
562	Y	91.3	Very high	89.3	Confident	22 Å²	22	54.5 Å²	54.5	9%	0.086	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	146.8	166.7	-64.5	-93	0	0	0	110.4	N534 F535 K551 F554 I559 I584 V586	N534-Y562 HydrophobicContact CB-CE1 4.37Å; N534-Y562 WeakPolarHBondContact ND2-CE1 3.01Å; F535-Y562 AromaticContact CE2-CD1 3.99Å; F535-Y562 HydrophobicContact CE2-CD1 3.99Å; F535-Y562 HydrophobicContact CE2-CD2 4.06Å; F535-Y562 AromaticContact CE2-CG 3.64Å; F535-Y562 HydrophobicContact CE2-CG 3.64Å; F535-Y562 AromaticContact CZ-CD2 3.88Å; F535-Y562 HydrophobicContact CZ-CD2 3.88Å; F535-Y562 HydrophobicContact CZ-CE2 4.43Å; F535-Y562 AromaticContact CZ-CG 3.97Å; F535-Y562 HydrophobicContact CZ-CG 3.97Å; K551-Y562 PolarHBondContact NZ-OH 3.38Å; F554-Y562 AromaticContact CD1-CE2 3.8Å; F554-Y562 HydrophobicContact CD1-CE2 3.8Å; F554-Y562 HydrophobicContact CE1-CE2 4.16Å; I559-Y562 HydrophobicContact CB-CE1 4.36Å; I559-Y562 HydrophobicContact CB-CE2 4.17Å; I559-Y562 HydrophobicContact CD1-CE1 3.83Å; I559-Y562 HydrophobicContact CG2-CD1 4.09Å; I559-Y562 HydrophobicContact CG2-CD2 4.05Å; I559-Y562 HydrophobicContact CG2-CE1 3.86Å; I559-Y562 HydrophobicContact CG2-CE2 3.8Å; I559-Y562 HydrophobicContact CG2-CG 4.19Å; Y562-I584 PolarHBondContact N-O 2.96Å; Y562-I584 PolarHBondContact O-N 2.89Å; Y562-V586 HydrophobicContact CD2-CG2 3.92Å; Y562-V586 HydrophobicContact CE2-CG2 3.55Å
563	L	92.3	Very high	89.2	Confident	113 Å²	113	58.7 Å²	58.7	59%	0.592	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.4	170	-57.4	-179.8	0	0	0	108.1	T581 T583	L563-T581 HydrophobicContact CB-CG2 3.89Å; L563-T581 HydrophobicContact CD2-CG2 4.33Å; L563-T583 HydrophobicContact CD2-CG2 3.79Å
564	L	92.4	Very high	89.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	101.8	-178	-172.3	66.5	0	0	0	110.3	L528 N532 F535 I547 V566 L582 I584	L528-L564 HydrophobicContact CD2-CD1 3.55Å; L528-L564 HydrophobicContact CD2-CD2 4.21Å; L528-L564 HydrophobicContact CD2-CG 3.81Å; N532-L564 HydrophobicContact CB-CD1 4.04Å; N532-L564 VanDerWaalsContact ND2-CD1 3.29Å; N532-L564 WeakPolarHBondContact ND2-CD1 3.37Å; F535-L564 HydrophobicContact CB-CD1 4.16Å; F535-L564 HydrophobicContact CB-CD2 3.85Å; F535-L564 HydrophobicContact CD2-CD1 4.24Å; F535-L564 HydrophobicContact CD2-CD2 4.46Å; F535-L564 HydrophobicContact CG-CD2 4.31Å; I547-L564 HydrophobicContact CD1-CD2 4.23Å; I547-L564 HydrophobicContact CG2-CD2 3.78Å; L564-V566 HydrophobicContact CG-CG2 4.43Å; L564-V566 PolarHBondContact O-N 3.34Å; L564-L582 HydrophobicContact CB-CB 4.27Å; L564-L582 HydrophobicContact CD2-CD2 4.21Å; L564-L582 PolarHBondContact N-O 2.81Å; L564-L582 PolarHBondContact O-N 2.84Å; L564-I584 HydrophobicContact CB-CD1 4.24Å; L564-I584 HydrophobicContact CD2-CD1 4.14Å
565	P	93.9	Very high	89.6	Confident	45 Å²	45	64 Å²	64	29%	0.292	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	117.7	174.9	29.5	-32.8	0	0	0	110.7	A529 T579 G580	A529-P565 HydrophobicContact CB-CB 4.02Å; A529-P565 HydrophobicContact CB-CG 4.16Å; A529-P565 PolarHBondContact N-O 2.82Å; P565-T579 HydrophobicContact CB-CG2 3.74Å; P565-G580 WeakPolarHBondContact CA-O 3.25Å
566	V	93.4	Very high	89.9	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.8	175.8	-176.5	0	0	0	0	107.7	F489 I510 F526 S527 L528 V537 I547 L564 T579 G580	F489-V566 HydrophobicContact CE1-CB 4.22Å; F489-V566 HydrophobicContact CE1-CG1 4.49Å; F489-V566 HydrophobicContact CZ-CB 3.95Å; F489-V566 HydrophobicContact CZ-CG2 4.2Å; I510-V566 HydrophobicContact CD1-CB 4.47Å; I510-V566 HydrophobicContact CD1-CG1 3.97Å; I510-V566 HydrophobicContact CD1-CG2 4.25Å; F526-V566 HydrophobicContact CB-CG1 4.4Å; F526-V566 HydrophobicContact CD1-CG1 4.25Å; S527-V566 CarbonylContact O-C 3.5Å; S527-V566 VanDerWaalsContact O-CA 3.31Å; S527-V566 WeakPolarHBondContact O-CA 3.42Å; S527-V566 VanDerWaalsContact O-CG1 3.29Å; S527-V566 WeakPolarHBondContact O-CG1 3.48Å; L528-V566 HydrophobicContact CD2-CG2 4.37Å; V537-V566 HydrophobicContact CG2-CG1 4.08Å; V537-V566 HydrophobicContact CG2-CG2 3.86Å; I547-V566 HydrophobicContact CD1-CG2 4.31Å; L564-V566 HydrophobicContact CG-CG2 4.43Å; L564-V566 PolarHBondContact O-N 3.34Å; V566-T579 CarbonylContact O-C 3.48Å; V566-T579 WeakPolarHBondContact O-CA 3.3Å; V566-G580 PolarHBondContact N-O 3.44Å; V566-G580 PolarHBondContact O-N 2.96Å
567	V	94.5	Very high	90.4	Very high	32 Å²	32	65.9 Å²	65.9	19%	0.194	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	134.4	171	-175	0	0	0	0	108.1	S527 A529 S578	S527-V567 PolarHBondContact N-O 3.25Å; S527-V567 PolarHBondContact O-N 2.91Å; A529-V567 HydrophobicContact CB-CG2 3.71Å; V567-S578 WeakPolarHBondContact CA-O 3.23Å
568	I	94.4	Very high	91	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.3	174	-39.3	172.9	0	0	0	106.4	P487 F489 A512 F524 F525 F526 S577 S578	P487-I568 HydrophobicContact CB-CG2 3.88Å; P487-I568 HydrophobicContact CG-CB 4.25Å; P487-I568 HydrophobicContact CG-CG2 3.88Å; F489-I568 HydrophobicContact CD1-CD1 3.49Å; F489-I568 VanDerWaalsContact CD1-CD1 3.49Å; F489-I568 HydrophobicContact CD1-CG1 4.47Å; F489-I568 HydrophobicContact CE1-CD1 3.79Å; F489-I568 HydrophobicContact CE1-CG1 4.31Å; F489-I568 HydrophobicContact CG-CD1 4.36Å; A512-I568 HydrophobicContact CB-CD1 4.13Å; A512-I568 HydrophobicContact CB-CG2 3.78Å; F524-I568 HydrophobicContact CB-CG2 4.2Å; F525-I568 WeakPolarHBondContact O-CA 3.18Å; F526-I568 HydrophobicContact CD1-CG1 4.17Å; F526-I568 HydrophobicContact CD1-CG2 4.21Å; F526-I568 HydrophobicContact CE1-CD1 4.33Å; F526-I568 HydrophobicContact CE1-CG1 4.18Å; F526-I568 HydrophobicContact CE1-CG2 3.93Å; F526-I568 HydrophobicContact CZ-CG2 4.35Å; I568-S577 CarbonylContact O-C 3.51Å; I568-S577 WeakPolarHBondContact O-CA 3.11Å; I568-S577 VanDerWaalsContact O-CB 3.26Å; I568-S577 WeakPolarHBondContact O-CB 3.43Å; I568-S578 PolarHBondContact N-O 3.5Å; I568-S578 PolarHBondContact O-N 3.31Å
569	S	94.1	Very high	91.5	Very high	33 Å²	33	58.2 Å²	58.2	23%	0.231	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	153.2	169.6	65.4	0	0	0	0	110.5	F524 F525 Q576	F524-S569 CarbonylContact C-O 3.51Å; F524-S569 WeakPolarHBondContact CA-O 3.19Å; F525-S569 PolarHBondContact N-O 3.31Å; F525-S569 PolarHBondContact O-N 3.34Å; F525-S569 VanDerWaalsContact O-N 3.07Å; S569-Q576 WeakPolarHBondContact CA-O 3.26Å; S569-Q576 WeakPolarHBondContact CB-O 3.43Å
570	D	92.8	Very high	91.7	Very high	7 Å²	7	55.2 Å²	55.2	4%	0.037	31%	0.307	C	S	.	.			trans	-81.5	-161.1	173.6	64.9	58.4	0	0	0	111.9	N483 P487 K523 F525 D572 I575 Q576	N483-D570 PolarHBondContact ND2-OD2 3.42Å; P487-D570 HydrophobicContact CG-CB 4.34Å; K523-D570 CarbonylContact O-C 3.58Å; K523-D570 WeakPolarHBondContact O-CA 3Å; F525-D570 WeakPolarHBondContact CD2-O 3.21Å; D570-D572 PolarHBondContact OD1-N 3.47Å; D570-I575 WeakPolarHBondContact OD1-CA 3.14Å; D570-Q576 PolarHBondContact N-O 2.7Å; D570-Q576 VanDerWaalsContact OD2-CA 3.29Å; D570-Q576 WeakPolarHBondContact OD2-CA 3.15Å; D570-Q576 VanDerWaalsContact OD2-CB 3.24Å; D570-Q576 WeakPolarHBondContact OD2-CB 3.36Å; D570-Q576 PolarHBondContact OD2-N 2.8Å
571	N	89.5	Confident	91.9	Very high	100 Å²	100	55.3 Å²	55.3	54%	0.535	31%	0.305	S	S	.	.	S	Bend	trans	-137	22.5	174.3	-170.2	95.6	0	0	0	111.8	K523 F525	K523-N571 HydrophobicContact CB-CB 4.17Å; K523-N571 PolarHBondContact O-N 3.41Å; F525-N571 HydrophobicContact CE2-CB 3.86Å; F525-N571 VanDerWaalsContact CE2-OD1 3.26Å; F525-N571 WeakPolarHBondContact CE2-OD1 3.17Å; F525-N571 WeakPolarHBondContact CZ-OD1 3.24Å
572	D	86.2	Confident	92	Very high	64 Å²	64	52.2 Å²	52.2	34%	0.342	29%	0.286	S	S	.	.	S	Bend	trans	-109.7	-174.4	177.7	-153.3	-4.7	0	0	0	111.8	N483 P518 D570 P574 I575	N483-D572 HydrophobicContact CB-CB 4.11Å; P518-D572 WeakPolarHBondContact CB-OD2 3.39Å; D570-D572 PolarHBondContact OD1-N 3.47Å; D572-P574 CarbonylContact O-C 3.52Å; D572-I575 WeakPolarHBondContact O-CA 3.49Å; D572-I575 WeakPolarHBondContact O-CG1 3.26Å; D572-I575 PolarHBondContact O-N 3.38Å
573	Y	84.1	Confident	92	Very high	195 Å²	195	52.2 Å²	52.2	77%	0.765	29%	0.289	S	S	*	.	S	Bend	trans	-125.7	123.6	-174.6	-171.3	-90.4	0	0	0	112.7
574	P	89.7	Confident	92	Very high	57 Å²	57	46.9 Å²	46.9	37%	0.37	26%	0.26	S	S	.	.	S	Bend	cis	-74.6	139.1	0.2	31.4	-35	0	0	0	112.6	N483 D572 Q576	N483-P574 PolarHBondContact ND2-O 3.1Å; D572-P574 CarbonylContact O-C 3.52Å; P574-Q576 PolarHBondContact O-N 2.76Å
575	I	91.6	Very high	92	Very high	115 Å²	115	52 Å²	52	59%	0.59	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-63.7	118.4	-179.9	-58.1	168.4	0	0	0	109.9	D570 D572	D570-I575 WeakPolarHBondContact OD1-CA 3.14Å; D572-I575 WeakPolarHBondContact O-CA 3.49Å; D572-I575 WeakPolarHBondContact O-CG1 3.26Å; D572-I575 PolarHBondContact O-N 3.38Å
576	Q	93.5	Very high	91.9	Very high	58 Å²	58	49.9 Å²	49.9	27%	0.271	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-95.2	160.9	174.7	-54.6	-72.7	0.4	0	0	110.5	N483 N485 A486 S569 D570 P574	N483-Q576 WeakPolarHBondContact ND2-CG 3.49Å; N483-Q576 PolarHBondContact O-NE2 2.92Å; N485-Q576 VanDerWaalsContact O-CB 3.29Å; N485-Q576 WeakPolarHBondContact O-CB 3.18Å; N485-Q576 VanDerWaalsContact O-CG 3.27Å; N485-Q576 WeakPolarHBondContact O-CG 3.38Å; A486-Q576 HydrophobicContact CB-CB 3.95Å; S569-Q576 WeakPolarHBondContact CA-O 3.26Å; S569-Q576 WeakPolarHBondContact CB-O 3.43Å; D570-Q576 PolarHBondContact N-O 2.7Å; D570-Q576 VanDerWaalsContact OD2-CA 3.29Å; D570-Q576 WeakPolarHBondContact OD2-CA 3.15Å; D570-Q576 VanDerWaalsContact OD2-CB 3.24Å; D570-Q576 WeakPolarHBondContact OD2-CB 3.36Å; D570-Q576 PolarHBondContact OD2-N 2.8Å; P574-Q576 PolarHBondContact O-N 2.76Å
577	S	94	Very high	91.7	Very high	73 Å²	73	49.9 Å²	49.9	51%	0.51	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	145.5	174.9	58.5	0	0	0	0	113	I568	I568-S577 CarbonylContact O-C 3.51Å; I568-S577 WeakPolarHBondContact O-CA 3.11Å; I568-S577 VanDerWaalsContact O-CB 3.26Å; I568-S577 WeakPolarHBondContact O-CB 3.43Å
578	S	94	Very high	91.3	Very high	26 Å²	26	49.1 Å²	49.1	18%	0.182	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	169.6	175.5	96.6	0	0	0	0	111.3	P487 V567 I568	P487-S578 VanDerWaalsContact O-CB 3.31Å; P487-S578 WeakPolarHBondContact O-CB 3.46Å; P487-S578 PolarHBondContact O-OG 3.21Å; V567-S578 WeakPolarHBondContact CA-O 3.23Å; I568-S578 PolarHBondContact N-O 3.5Å; I568-S578 PolarHBondContact O-N 3.31Å
579	T	93.8	Very high	91	Very high	79 Å²	79	50 Å²	50	49%	0.485	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	100.1	174.5	-58.2	0	0	0	0	110.9	A529 P565 V566	A529-T579 HydrophobicContact CB-CG2 4.29Å; P565-T579 HydrophobicContact CB-CG2 3.74Å; V566-T579 CarbonylContact O-C 3.48Å; V566-T579 WeakPolarHBondContact O-CA 3.3Å
580	G	91.7	Very high	90.5	Very high	12 Å²	12	50.3 Å²	50.3	12%	0.124	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137.5	172.9	0	0	0	0	0	111.5	P565 V566	P565-G580 WeakPolarHBondContact CA-O 3.25Å; V566-G580 PolarHBondContact N-O 3.44Å; V566-G580 PolarHBondContact O-N 2.96Å
581	T	92.3	Very high	89.9	Confident	66 Å²	66	56.1 Å²	56.1	41%	0.405	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111	175.6	-62	0	0	0	0	110.8	L563	L563-T581 HydrophobicContact CB-CG2 3.89Å; L563-T581 HydrophobicContact CD2-CG2 4.33Å
582	L	92	Very high	89.4	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	136.1	173.6	170	68.8	0	0	0	110.4	F489 Y493 T495 I547 L564 I584	F489-L582 HydrophobicContact CE2-CB 4.48Å; Y493-L582 HydrophobicContact CG-CD1 4.34Å; T495-L582 HydrophobicContact CG2-CD1 3.94Å; T495-L582 HydrophobicContact CG2-CG 4.46Å; I547-L582 HydrophobicContact CB-CD2 4.22Å; I547-L582 HydrophobicContact CD1-CD2 4.07Å; I547-L582 HydrophobicContact CG1-CD2 3.67Å; I547-L582 HydrophobicContact CG2-CD2 3.85Å; L564-L582 HydrophobicContact CB-CB 4.27Å; L564-L582 HydrophobicContact CD2-CD2 4.21Å; L564-L582 PolarHBondContact N-O 2.81Å; L564-L582 PolarHBondContact O-N 2.84Å; L582-I584 HydrophobicContact CD2-CD1 3.9Å; L582-I584 HydrophobicContact CD2-CG1 3.95Å; L582-I584 HydrophobicContact CG-CD1 4.32Å; L582-I584 HydrophobicContact CG-CG1 3.86Å
583	T	92.5	Very high	89	Confident	22 Å²	22	57.5 Å²	57.5	14%	0.135	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127	174.1	61.2	0	0	0	0	110.8	F492 Y493 D494 T495 L563	F492-T583 HydrophobicContact CZ-CG2 4.05Å; Y493-T583 PolarHBondContact O-N 3.19Å; Y493-T583 PolarHBondContact O-OG1 3.37Å; Y493-T583 VanDerWaalsContact O-OG1 3.08Å; D494-T583 VanDerWaalsContact CA-OG1 3.24Å; D494-T583 WeakPolarHBondContact CA-OG1 3.39Å; D494-T583 WeakPolarHBondContact CB-OG1 3.31Å; T495-T583 PolarHBondContact N-O 3.09Å; L563-T583 HydrophobicContact CD2-CG2 3.79Å
584	I	92.1	Very high	88.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	110.7	-176.8	-49.4	177.3	0	0	0	109.5	T495 V497 I507 F535 I547 T561 Y562 L564 L582	T495-I584 HydrophobicContact CG2-CB 4.41Å; T495-I584 HydrophobicContact CG2-CG1 3.95Å; T495-I584 HydrophobicContact CG2-CG2 4.37Å; T495-I584 CarbonylContact O-C 3.6Å; T495-I584 WeakPolarHBondContact O-CA 3.32Å; V497-I584 HydrophobicContact CB-CG2 3.99Å; V497-I584 HydrophobicContact CG1-CG2 3.88Å; I507-I584 HydrophobicContact CD1-CD1 4.38Å; I507-I584 HydrophobicContact CD1-CG2 4.45Å; I507-I584 HydrophobicContact CG2-CG2 4.28Å; F535-I584 HydrophobicContact CD1-CD1 4.04Å; F535-I584 HydrophobicContact CD2-CD1 4.02Å; F535-I584 HydrophobicContact CE1-CD1 3.95Å; F535-I584 HydrophobicContact CE1-CG2 4.27Å; F535-I584 HydrophobicContact CE2-CD1 3.92Å; F535-I584 HydrophobicContact CG-CD1 4.08Å; F535-I584 HydrophobicContact CZ-CB 4.43Å; F535-I584 HydrophobicContact CZ-CD1 3.88Å; F535-I584 HydrophobicContact CZ-CG2 4.1Å; I547-I584 HydrophobicContact CG2-CD1 4.22Å; T561-I584 CarbonylContact C-O 3.56Å; T561-I584 WeakPolarHBondContact CA-O 3.4Å; Y562-I584 PolarHBondContact N-O 2.96Å; Y562-I584 PolarHBondContact O-N 2.89Å; L564-I584 HydrophobicContact CB-CD1 4.24Å; L564-I584 HydrophobicContact CD2-CD1 4.14Å; L582-I584 HydrophobicContact CD2-CD1 3.9Å; L582-I584 HydrophobicContact CD2-CG1 3.95Å; L582-I584 HydrophobicContact CG-CD1 4.32Å; L582-I584 HydrophobicContact CG-CG1 3.86Å
585	R	91.7	Very high	88.5	Confident	109 Å²	109	54.3 Å²	54.3	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	140.8	179.3	-70.4	-179	-79.2	-167.2	2.2	112.1	D494 T495 F496 V497 S560 T561	D494-R585 IonicContact OD1-CZ 3.47Å; D494-R585 IonicContact OD1-NE 3.16Å; D494-R585 PolarHBondContact OD1-NE 2.88Å; D494-R585 IonicContact OD1-NH2 2.84Å; D494-R585 PolarHBondContact OD1-NH2 2.78Å; D494-R585 IonicContact OD2-CZ 3.28Å; D494-R585 IonicContact OD2-NE 2.71Å; D494-R585 IonicContact OD2-NH1 2.75Å; D494-R585 IonicContact OD2-NH2 3.8Å; D494-R585 PolarHBondContact OD2-NH2 3.41Å; T495-R585 PolarHBondContact O-N 2.96Å; F496-R585 CarbonylContact C-O 3.55Å; F496-R585 WeakPolarHBondContact CA-O 3.26Å; V497-R585 PolarHBondContact N-O 2.84Å; S560-R585 CarbonylContact O-C 3.56Å; S560-R585 WeakPolarHBondContact O-CA 3.06Å; T561-R585 HydrophobicContact CG2-CG 4.25Å
586	V	91.1	Very high	88	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.1	176.1	-176.1	0	0	0	0	109.5	V497 E499 F554 R556 I559 S560 Y562	V497-V586 HydrophobicContact CG1-CB 4.5Å; V497-V586 HydrophobicContact CG1-CG2 3.89Å; V497-V586 WeakPolarHBondContact O-CA 3.3Å; E499-V586 HydrophobicContact CG-CG1 3.67Å; F554-V586 HydrophobicContact CB-CG1 3.86Å; F554-V586 HydrophobicContact CB-CG2 4.37Å; R556-V586 HydrophobicContact CB-CB 4.11Å; R556-V586 HydrophobicContact CB-CG1 4Å; R556-V586 WeakPolarHBondContact CB-O 3.23Å; I559-V586 WeakPolarHBondContact O-CG2 3.44Å; S560-V586 PolarHBondContact O-N 2.65Å; Y562-V586 HydrophobicContact CD2-CG2 3.92Å; Y562-V586 HydrophobicContact CE2-CG2 3.55Å
587	C	89.9	Confident	87.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.3	-172	-46.5	0	0	0	0	112.1	V497 C498 E499 M595 S597 C598	V497-C587 PolarHBondContact O-N 3.33Å; C498-C587 WeakPolarHBondContact CA-O 3.11Å; E499-C587 PolarHBondContact N-O 3.12Å; C587-M595 HydrophobicContact CB-CG 3.94Å; C587-S597 CarbonylContact C-O 3.53Å; C587-S597 WeakPolarHBondContact CA-O 3.45Å; C587-S597 WeakPolarHBondContact CB-O 3.43Å; C587-C598 HydrophobicContact CB-CB 3.96Å; C587-C598 WeakPolarHBondContact CB-SG 3.45Å; C587-C598 WeakPolarHBondContact SG-CB 3.39Å; C587-C598 CovalentContact SG-SG 2.03Å; C587-C598 PolarHBondContact SG-SG 3.31Å
588	A	87.1	Confident	86.9	Confident	15 Å²	15	52.6 Å²	52.6	12%	0.124	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.7	162.4	0	0	0	0	0	108.9	Q596 S597	A588-Q596 PolarHBondContact O-N 2.87Å; A588-S597 PolarHBondContact N-O 3.45Å; A588-S597 PolarHBondContact O-N 3.11Å
589	C	87.3	Confident	85.7	Confident	18 Å²	18	54.5 Å²	54.5	12%	0.122	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	156.9	179.1	-61.6	0	0	0	0	110.9	C498 N594	C498-C589 VanDerWaalsContact CA-SG 3.53Å; C498-C589 HydrophobicContact CB-CB 3.67Å; C498-C589 WeakPolarHBondContact CB-SG 3.39Å; C498-C589 WeakPolarHBondContact SG-CB 3.26Å; C498-C589 CovalentContact SG-SG 2.04Å; C498-C589 PolarHBondContact SG-SG 2.97Å; C589-N594 CarbonylContact C-O 3.45Å; C589-N594 WeakPolarHBondContact CA-O 3.13Å; C589-N594 WeakPolarHBondContact CB-O 3.37Å
590	D	84.3	Confident	84.1	Confident	41 Å²	41	53.6 Å²	53.6	22%	0.219	31%	0.312	C	S	.	.			trans	-74.3	-176.1	173.2	75.3	7.5	0	0	0	112.7	Q592 G593 N594 Q596	D590-Q592 PolarHBondContact O-N 2.91Å; D590-Q592 VanDerWaalsContact OD1-CA 3.31Å; D590-Q592 WeakPolarHBondContact OD1-CA 3.47Å; D590-Q592 WeakPolarHBondContact OD1-CB 3.19Å; D590-Q592 PolarHBondContact OD1-N 3.26Å; D590-G593 PolarHBondContact O-N 2.67Å; D590-G593 PolarHBondContact OD1-N 2.78Å; D590-N594 PolarHBondContact N-O 2.8Å; D590-N594 PolarHBondContact OD1-N 3.21Å; D590-N594 PolarHBondContact OD1-ND2 3.41Å; D590-N594 WeakPolarHBondContact OD2-CB 3.38Å; D590-N594 PolarHBondContact OD2-ND2 3.02Å; D590-Q596 HydrophobicContact CB-CG 4.26Å
591	S	80.4	Confident	82.3	Confident	128 Å²	128	60.7 Å²	60.7	90%	0.895	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-7.6	178.2	53.4	0	0	0	0	114.8
592	Q	79.1	Confident	79.7	Confident	162 Å²	162	62.5 Å²	62.5	76%	0.757	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-11.9	173.1	-60.4	-177.2	-8.1	0	0	112.1	D590 N594	D590-Q592 PolarHBondContact O-N 2.91Å; D590-Q592 VanDerWaalsContact OD1-CA 3.31Å; D590-Q592 WeakPolarHBondContact OD1-CA 3.47Å; D590-Q592 WeakPolarHBondContact OD1-CB 3.19Å; D590-Q592 PolarHBondContact OD1-N 3.26Å; Q592-N594 PolarHBondContact OE1-ND2 3.14Å
593	G	76.8	Confident	77.2	Confident	31 Å²	31	69.4 Å²	69.4	32%	0.32	40%	0.4	S	S	.	.	S	Bend	trans	96.8	6.2	-177.2	0	0	0	0	0	114.3	D590	D590-G593 PolarHBondContact O-N 2.67Å; D590-G593 PolarHBondContact OD1-N 2.78Å
594	N	80.3	Confident	74.5	Confident	85 Å²	85	76.9 Å²	76.9	46%	0.455	44%	0.438	S	S	.	.			trans	-73.7	133.6	177.2	-52.8	-59.6	0	0	0	110.3	C589 D590 Q592 Q596	C589-N594 CarbonylContact C-O 3.45Å; C589-N594 WeakPolarHBondContact CA-O 3.13Å; C589-N594 WeakPolarHBondContact CB-O 3.37Å; D590-N594 PolarHBondContact N-O 2.8Å; D590-N594 PolarHBondContact OD1-N 3.21Å; D590-N594 PolarHBondContact OD1-ND2 3.41Å; D590-N594 WeakPolarHBondContact OD2-CB 3.38Å; D590-N594 PolarHBondContact OD2-ND2 3.02Å; Q592-N594 PolarHBondContact OE1-ND2 3.14Å; N594-Q596 PolarHBondContact O-N 2.88Å
595	M	82.9	Confident	72.2	Confident	100 Å²	100	83.5 Å²	83.5	49%	0.493	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	122.9	175.9	-175.5	-172.5	116.7	0	0	111.6	F496 C587 C598	F496-M595 HydrophobicContact CD1-CB 4.48Å; F496-M595 HydrophobicContact CD1-SD 4.15Å; F496-M595 HydrophobicContact CD2-CB 4.12Å; F496-M595 HydrophobicContact CD2-CG 4.41Å; F496-M595 HydrophobicContact CE1-CB 4.2Å; F496-M595 HydrophobicContact CE2-CB 3.82Å; F496-M595 HydrophobicContact CG-CB 4.46Å; F496-M595 HydrophobicContact CG-CG 4.49Å; F496-M595 HydrophobicContact CG-SD 4.24Å; F496-M595 HydrophobicContact CZ-CB 3.87Å; C587-M595 HydrophobicContact CB-CG 3.94Å; M595-C598 PolarHBondContact SD-SG 3.21Å
596	Q	82.3	Confident	70.2	Confident	135 Å²	135	84.2 Å²	84.2	63%	0.631	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	-49.8	173.1	-68	-171.5	-17.7	0	0	111.9	A588 D590 N594	A588-Q596 PolarHBondContact O-N 2.87Å; D590-Q596 HydrophobicContact CB-CG 4.26Å; N594-Q596 PolarHBondContact O-N 2.88Å
597	S	82.3	Confident	68.2	Low	42 Å²	42	89.2 Å²	89.2	29%	0.294	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	136.5	178.2	59.8	0	0	0	0	112.7	C587 A588	C587-S597 CarbonylContact C-O 3.53Å; C587-S597 WeakPolarHBondContact CA-O 3.45Å; C587-S597 WeakPolarHBondContact CB-O 3.43Å; A588-S597 PolarHBondContact N-O 3.45Å; A588-S597 PolarHBondContact O-N 3.11Å
598	C	80.3	Confident	66.8	Low	34 Å²	34	92.6 Å²	92.6	23%	0.23	57%	0.568	C	S	.	*			trans	-102.3	-8.7	172.1	-51.8	0	0	0	0	112.7	C587 M595	C587-C598 HydrophobicContact CB-CB 3.96Å; C587-C598 WeakPolarHBondContact CB-SG 3.45Å; C587-C598 WeakPolarHBondContact SG-CB 3.39Å; C587-C598 CovalentContact SG-SG 2.03Å; C587-C598 PolarHBondContact SG-SG 3.31Å; M595-C598 PolarHBondContact SD-SG 3.21Å
599	S	69.1	Low	65.6	Low	66 Å²	66	96.9 Å²	96.9	46%	0.462	59%	0.588	S	S	.	*			trans	-78.5	137.9	176.3	61.5	0	0	0	0	110.8	R556 E601	R556-S599 PolarHBondContact NE-O 2.9Å; S599-E601 VanDerWaalsContact C-N 3.27Å; S599-E601 WeakPolarHBondContact CB-O 3.41Å; S599-E601 PolarHBondContact OG-O 2.81Å
600	A	60.2	Low	65	Low	59 Å²	59	99.8 Å²	99.8	49%	0.488	61%	0.609	S	S	.	*	S	Bend	trans	-70.3	-29.2	169.2	0	0	0	0	0	111.3
601	E	55.1	Low	64.7	Low	162 Å²	162	103 Å²	103	76%	0.757	63%	0.63	S	S	*	*	S	Bend	trans	-110.5	140.9	178.7	-61.4	-177.7	134	0	0	111.3	S599	S599-E601 VanDerWaalsContact C-N 3.27Å; S599-E601 WeakPolarHBondContact CB-O 3.41Å; S599-E601 PolarHBondContact OG-O 2.81Å
602	A	38	Very low	64.8	Low	103 Å²	103	98.9 Å²	98.9	85%	0.851	61%	0.607	S	S	*	*			trans	-110.1	82.5	176.6	0	0	0	0	0	109.7
603	L	37.4	Very low	64.8	Low	146 Å²	146	92.9 Å²	92.9	76%	0.764	59%	0.585	S	S	*	*			trans	-104.9	110.2	179.1	-154.6	77.2	0	0	0	111.2	L605	L603-L605 HydrophobicContact CD2-CD1 4.02Å; L603-L605 HydrophobicContact CD2-CG 4.38Å; L603-L605 PolarHBondContact O-N 2.78Å
604	L	36.5	Very low	65	Low	178 Å²	178	96.3 Å²	96.3	93%	0.932	60%	0.596	S	S	*	*			trans	-75	103.7	173.6	-77.9	162.8	0	0	0	110.3
605	L	44.1	Very low	65.3	Low	140 Å²	140	97.5 Å²	97.5	73%	0.733	60%	0.601	S	S	*	*			trans	-123.5	123.7	164.6	-76	171.7	0	0	0	109.4	L603 A607	L603-L605 HydrophobicContact CD2-CD1 4.02Å; L603-L605 HydrophobicContact CD2-CG 4.38Å; L603-L605 PolarHBondContact O-N 2.78Å; L605-A607 PolarHBondContact O-N 2.8Å
606	P	49.5	Very low	65.4	Low	123 Å²	123	95.3 Å²	95.3	80%	0.799	60%	0.599	S	S	*	*			trans	-71.3	127.1	178.4	28.6	-32.8	0	0	0	110.2	G608	P606-G608 VanDerWaalsContact C-N 3.28Å; P606-G608 PolarHBondContact O-N 2.03Å
607	A	49.7	Very low	65.6	Low	106 Å²	106	93.1 Å²	93.1	88%	0.876	59%	0.591	S	S	*	*			trans	-72.7	77.3	179.5	0	0	0	0	0	111.8	L605 L609	L605-A607 PolarHBondContact O-N 2.8Å; A607-L609 PolarHBondContact O-N 2.7Å
608	G	60	Low	65.9	Low	70 Å²	70	96.4 Å²	96.4	72%	0.722	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-67.6	121.3	168.7	0	0	0	0	0	110.5	P606 S610	P606-G608 VanDerWaalsContact C-N 3.28Å; P606-G608 PolarHBondContact O-N 2.03Å; G608-S610 PolarHBondContact O-N 2.97Å
609	L	61.9	Low	66.5	Low	105 Å²	105	99.3 Å²	99.3	55%	0.55	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-63.3	130.4	176.2	-140.5	83.8	0	0	0	109.7	A607 A613 L614 I617	A607-L609 PolarHBondContact O-N 2.7Å; L609-A613 HydrophobicContact CD2-CB 3.91Å; L609-A613 HydrophobicContact CG-CB 4.01Å; L609-L614 HydrophobicContact CD2-CG 4.13Å; L609-I617 HydrophobicContact CD2-CD1 3.77Å
610	S	75.6	Confident	67.6	Low	80 Å²	80	100 Å²	100	56%	0.559	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-57.1	141.4	174.7	175.9	0	0	0	0	110.6	G608 G612 A613 L614	G608-S610 PolarHBondContact O-N 2.97Å; S610-G612 PolarHBondContact O-N 3Å; S610-G612 PolarHBondContact OG-N 3.08Å; S610-A613 WeakPolarHBondContact O-CA 3.19Å; S610-A613 WeakPolarHBondContact O-CB 3.39Å; S610-A613 PolarHBondContact O-N 3.19Å; S610-L614 PolarHBondContact O-N 3.14Å; S610-L614 VanDerWaalsContact O-N 3.09Å
611	T	77.5	Confident	69.1	Low	109 Å²	109	101.4 Å²	101.4	67%	0.669	62%	0.619	S	S	*	*	H	α-helix	trans	-56.6	-33.7	176.3	48.5	0	0	0	0	112	A613 L614 I615	T611-A613 VanDerWaalsContact C-N 3.35Å; T611-A613 PolarHBondContact O-N 3.19Å; T611-L614 PolarHBondContact O-N 2.87Å; T611-I615 WeakPolarHBondContact O-CD1 3.27Å; T611-I615 VanDerWaalsContact O-CG1 3.27Å; T611-I615 WeakPolarHBondContact O-CG1 3.45Å; T611-I615 PolarHBondContact O-N 3.03Å
612	G	81.6	Confident	70.9	Confident	40 Å²	40	98 Å²	98	41%	0.412	61%	0.606	S	S	.	*	H	α-helix	trans	-63.9	-35.4	172.8	0	0	0	0	0	113.7	S610 I615 A616	S610-G612 PolarHBondContact O-N 3Å; S610-G612 PolarHBondContact OG-N 3.08Å; G612-I615 PolarHBondContact O-N 2.94Å; G612-A616 WeakPolarHBondContact O-CB 3.25Å; G612-A616 PolarHBondContact O-N 3.06Å
613	A	79.2	Confident	73.5	Confident	36 Å²	36	97.4 Å²	97.4	30%	0.298	59%	0.587	S	S	.	*	H	α-helix	trans	-71.8	-39.5	175.8	0	0	0	0	0	111.6	L609 S610 T611 I615 A616 I617	L609-A613 HydrophobicContact CD2-CB 3.91Å; L609-A613 HydrophobicContact CG-CB 4.01Å; S610-A613 WeakPolarHBondContact O-CA 3.19Å; S610-A613 WeakPolarHBondContact O-CB 3.39Å; S610-A613 PolarHBondContact O-N 3.19Å; T611-A613 VanDerWaalsContact C-N 3.35Å; T611-A613 PolarHBondContact O-N 3.19Å; A613-I615 VanDerWaalsContact C-N 3.34Å; A613-I615 PolarHBondContact O-N 2.99Å; A613-A616 PolarHBondContact O-N 3.01Å; A613-I617 VanDerWaalsContact O-CG1 3.28Å; A613-I617 WeakPolarHBondContact O-CG1 3.05Å; A613-I617 PolarHBondContact O-N 2.81Å
614	L	81.2	Confident	75.9	Confident	103 Å²	103	95.9 Å²	95.9	54%	0.539	58%	0.579	S	S	.	*	H	α-helix	trans	-59.9	-43.1	171.6	-93.8	166.7	0	0	0	112.1	L609 S610 T611 L618	L609-L614 HydrophobicContact CD2-CG 4.13Å; S610-L614 PolarHBondContact O-N 3.14Å; S610-L614 VanDerWaalsContact O-N 3.09Å; T611-L614 PolarHBondContact O-N 2.87Å; L614-L618 WeakPolarHBondContact O-CB 3.31Å; L614-L618 PolarHBondContact O-N 3.07Å
615	I	86.6	Confident	78.5	Confident	111 Å²	111	92.5 Å²	92.5	57%	0.569	56%	0.561	S	S	*	*	H	α-helix	trans	-63.3	-45.5	175.9	-68.8	163.4	0	0	0	110.8	T611 G612 A613 I617 L618 L619	T611-I615 WeakPolarHBondContact O-CD1 3.27Å; T611-I615 VanDerWaalsContact O-CG1 3.27Å; T611-I615 WeakPolarHBondContact O-CG1 3.45Å; T611-I615 PolarHBondContact O-N 3.03Å; G612-I615 PolarHBondContact O-N 2.94Å; A613-I615 VanDerWaalsContact C-N 3.34Å; A613-I615 PolarHBondContact O-N 2.99Å; I615-I617 PolarHBondContact O-N 2.89Å; I615-L618 PolarHBondContact O-N 2.9Å; I615-L619 WeakPolarHBondContact O-CB 3.38Å; I615-L619 PolarHBondContact O-N 2.04Å
616	A	85.1	Confident	80.8	Confident	54 Å²	54	90 Å²	90	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-61.7	-43.5	178.6	0	0	0	0	0	112.6	G612 A613 L619 C620	G612-A616 WeakPolarHBondContact O-CB 3.25Å; G612-A616 PolarHBondContact O-N 3.06Å; A613-A616 PolarHBondContact O-N 3.01Å; A616-L619 PolarHBondContact O-N 3.43Å; A616-C620 PolarHBondContact O-N 2.93Å
617	I	86.7	Confident	82.6	Confident	89 Å²	89	88.6 Å²	88.6	46%	0.456	54%	0.536	S	S	.	.	H	α-helix	trans	-61.8	-45.2	176.1	-69.4	164.7	0	0	0	110.8	L609 A613 I615 L619 C620 I621	L609-I617 HydrophobicContact CD2-CD1 3.77Å; A613-I617 VanDerWaalsContact O-CG1 3.28Å; A613-I617 WeakPolarHBondContact O-CG1 3.05Å; A613-I617 PolarHBondContact O-N 2.81Å; I615-I617 PolarHBondContact O-N 2.89Å; I617-L619 VanDerWaalsContact C-N 3.32Å; I617-L619 PolarHBondContact O-N 2.98Å; I617-C620 PolarHBondContact O-N 3.25Å; I617-I621 HydrophobicContact CG2-CD1 3.87Å; I617-I621 WeakPolarHBondContact O-CG1 3.39Å; I617-I621 PolarHBondContact O-N 2.91Å
618	L	89.5	Confident	84.4	Confident	110 Å²	110	88.1 Å²	88.1	58%	0.576	52%	0.522	S	S	*	.	H	α-helix	trans	-59.5	-42.6	177	-164.7	83.2	0	0	0	111.7	L614 I615 I621 I622	L614-L618 WeakPolarHBondContact O-CB 3.31Å; L614-L618 PolarHBondContact O-N 3.07Å; I615-L618 PolarHBondContact O-N 2.9Å; L618-I621 PolarHBondContact O-N 3.11Å; L618-I622 HydrophobicContact CD2-CD1 4.45Å; L618-I622 HydrophobicContact CG-CD1 4.24Å; L618-I622 WeakPolarHBondContact O-CG1 3.24Å; L618-I622 PolarHBondContact O-N 2.72Å
619	L	93.1	Very high	85.7	Confident	96 Å²	96	89.6 Å²	89.6	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-43.8	-179.5	-142.2	169.8	0	0	0	111.4	I615 A616 I617 I621 I622 I623	I615-L619 WeakPolarHBondContact O-CB 3.38Å; I615-L619 PolarHBondContact O-N 2.04Å; A616-L619 PolarHBondContact O-N 3.43Å; I617-L619 VanDerWaalsContact C-N 3.32Å; I617-L619 PolarHBondContact O-N 2.98Å; L619-I621 PolarHBondContact O-N 3.38Å; L619-I622 PolarHBondContact O-N 2.71Å; L619-I623 HydrophobicContact CD2-CD1 3.55Å; L619-I623 HydrophobicContact CD2-CG1 4.05Å; L619-I623 WeakPolarHBondContact O-CG1 3.38Å; L619-I623 PolarHBondContact O-N 2.86Å
620	C	91.8	Very high	86.8	Confident	79 Å²	79	89.8 Å²	89.8	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-61.2	-40.3	174	-73.8	0	0	0	0	113	A616 I617 I623 L624	A616-C620 PolarHBondContact O-N 2.93Å; I617-C620 PolarHBondContact O-N 3.25Å; C620-I623 PolarHBondContact O-N 2.85Å; C620-L624 PolarHBondContact O-N 2.8Å
621	I	91.3	Very high	87.1	Confident	89 Å²	89	92.9 Å²	92.9	46%	0.456	52%	0.522	S	S	.	.	H	α-helix	trans	-63.4	-41.8	176.4	-69.2	165.8	0	0	0	111	I617 L618 L619 L624 L625	I617-I621 HydrophobicContact CG2-CD1 3.87Å; I617-I621 WeakPolarHBondContact O-CG1 3.39Å; I617-I621 PolarHBondContact O-N 2.91Å; L618-I621 PolarHBondContact O-N 3.11Å; L619-I621 PolarHBondContact O-N 3.38Å; I621-L624 PolarHBondContact O-N 3.07Å; I621-L625 HydrophobicContact CG2-CD1 4.18Å; I621-L625 WeakPolarHBondContact O-CG 3.06Å; I621-L625 PolarHBondContact O-N 3.05Å; I621-L625 VanDerWaalsContact O-N 3.1Å
622	I	92.6	Very high	87.2	Confident	92 Å²	92	90.6 Å²	90.6	47%	0.472	51%	0.514	S	S	.	.	H	α-helix	trans	-63.5	-44.5	177	-69.1	164.9	0	0	0	111	L618 L619 L624 L625 V626	L618-I622 HydrophobicContact CD2-CD1 4.45Å; L618-I622 HydrophobicContact CG-CD1 4.24Å; L618-I622 WeakPolarHBondContact O-CG1 3.24Å; L618-I622 PolarHBondContact O-N 2.72Å; L619-I622 PolarHBondContact O-N 2.71Å; I622-L624 PolarHBondContact O-N 2.86Å; I622-L625 PolarHBondContact O-N 2.86Å; I622-V626 WeakPolarHBondContact O-CG2 3.16Å; I622-V626 PolarHBondContact O-N 2.83Å; I622-V626 VanDerWaalsContact O-N 3.14Å
623	I	91.9	Very high	87.1	Confident	89 Å²	89	91.5 Å²	91.5	46%	0.456	52%	0.517	S	S	.	.	H	α-helix	trans	-60.8	-46.2	178.1	-70.3	168	0	0	0	111.2	L619 C620 L625 V626 I627	L619-I623 HydrophobicContact CD2-CD1 3.55Å; L619-I623 HydrophobicContact CD2-CG1 4.05Å; L619-I623 WeakPolarHBondContact O-CG1 3.38Å; L619-I623 PolarHBondContact O-N 2.86Å; C620-I623 PolarHBondContact O-N 2.85Å; I623-L625 PolarHBondContact O-N 2.86Å; I623-V626 PolarHBondContact O-N 2.55Å; I623-I627 HydrophobicContact CG2-CD1 3.95Å; I623-I627 WeakPolarHBondContact O-CG1 3.23Å; I623-I627 PolarHBondContact O-N 2.86Å
624	L	89.3	Confident	86.9	Confident	114 Å²	114	95.2 Å²	95.2	60%	0.597	53%	0.532	S	S	*	.	H	α-helix	trans	-61.5	-41.1	178.3	-77.4	170	0	0	0	112.5	C620 I621 I622 V626 I627 V628	C620-L624 PolarHBondContact O-N 2.8Å; I621-L624 PolarHBondContact O-N 3.07Å; I622-L624 PolarHBondContact O-N 2.86Å; L624-V626 PolarHBondContact O-N 2.97Å; L624-I627 PolarHBondContact O-N 2.84Å; L624-V628 WeakPolarHBondContact O-CG2 3.36Å; L624-V628 PolarHBondContact O-N 2.8Å; L624-V628 VanDerWaalsContact O-N 3.09Å
625	L	91.4	Very high	86.4	Confident	108 Å²	108	98.6 Å²	98.6	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-62.6	-41	176.8	-78	168.4	0	0	0	112.6	I621 I622 I623 I627 V628 V629	I621-L625 HydrophobicContact CG2-CD1 4.18Å; I621-L625 WeakPolarHBondContact O-CG 3.06Å; I621-L625 PolarHBondContact O-N 3.05Å; I621-L625 VanDerWaalsContact O-N 3.1Å; I622-L625 PolarHBondContact O-N 2.86Å; I623-L625 PolarHBondContact O-N 2.86Å; L625-I627 PolarHBondContact O-N 3.47Å; L625-V628 PolarHBondContact O-N 2.75Å; L625-V629 WeakPolarHBondContact O-CG2 3.21Å; L625-V629 PolarHBondContact O-N 3.48Å; L625-V629 VanDerWaalsContact O-N 3.1Å
626	V	91.4	Very high	85.5	Confident	86 Å²	86	104 Å²	104	52%	0.521	56%	0.555	S	S	.	*	H	α-helix	trans	-62.1	-43.7	176.9	172.1	0	0	0	0	111.3	I622 I623 L624 V628 V629 L630	I622-V626 WeakPolarHBondContact O-CG2 3.16Å; I622-V626 PolarHBondContact O-N 2.83Å; I622-V626 VanDerWaalsContact O-N 3.14Å; I623-V626 PolarHBondContact O-N 2.55Å; L624-V626 PolarHBondContact O-N 2.97Å; V626-V628 PolarHBondContact O-N 3.3Å; V626-V629 PolarHBondContact O-N 3.25Å; V626-L630 PolarHBondContact O-N 2.7Å; V626-L630 VanDerWaalsContact O-N 3.09Å
627	I	87.7	Confident	84.3	Confident	95 Å²	95	109.7 Å²	109.7	49%	0.487	57%	0.572	S	S	.	*	H	α-helix	trans	-61.9	-44.7	178.5	-66.4	166.8	0	0	0	111	I623 L624 L625 V629 L630 F631	I623-I627 HydrophobicContact CG2-CD1 3.95Å; I623-I627 WeakPolarHBondContact O-CG1 3.23Å; I623-I627 PolarHBondContact O-N 2.86Å; L624-I627 PolarHBondContact O-N 2.84Å; L625-I627 PolarHBondContact O-N 3.47Å; I627-V629 PolarHBondContact O-N 3.36Å; I627-L630 PolarHBondContact O-N 2.78Å; I627-F631 PolarHBondContact O-N 3.44Å; I627-F631 VanDerWaalsContact O-N 3.07Å
628	V	87.3	Confident	82.8	Confident	96 Å²	96	116.4 Å²	116.4	58%	0.582	59%	0.592	S	S	*	*	H	α-helix	trans	-62.5	-42.1	179.1	170.6	0	0	0	0	111.9	L624 L625 V626 F631 A632	L624-V628 WeakPolarHBondContact O-CG2 3.36Å; L624-V628 PolarHBondContact O-N 2.8Å; L624-V628 VanDerWaalsContact O-N 3.09Å; L625-V628 PolarHBondContact O-N 2.75Å; V626-V628 PolarHBondContact O-N 3.3Å; V628-F631 PolarHBondContact O-N 2.82Å; V628-A632 WeakPolarHBondContact O-CB 3.33Å; V628-A632 PolarHBondContact O-N 2.76Å
629	V	87.3	Confident	80.5	Confident	101 Å²	101	120.4 Å²	120.4	61%	0.612	61%	0.605	S	S	*	*	H	α-helix	trans	-64.7	-42.9	177.8	171.6	0	0	0	0	111.5	L625 V626 I627 F631 A632 A633	L625-V629 WeakPolarHBondContact O-CG2 3.21Å; L625-V629 PolarHBondContact O-N 3.48Å; L625-V629 VanDerWaalsContact O-N 3.1Å; V626-V629 PolarHBondContact O-N 3.25Å; I627-V629 PolarHBondContact O-N 3.36Å; V629-F631 PolarHBondContact O-N 3.12Å; V629-A632 PolarHBondContact O-N 3.18Å; V629-A633 PolarHBondContact O-N 2.86Å
630	L	85	Confident	77.8	Confident	108 Å²	108	125.8 Å²	125.8	57%	0.565	62%	0.624	S	S	*	*	H	α-helix	trans	-59.3	-46.1	176.3	-110	162.6	0	0	0	112	V626 I627 A632 A633 L634	V626-L630 PolarHBondContact O-N 2.7Å; V626-L630 VanDerWaalsContact O-N 3.09Å; I627-L630 PolarHBondContact O-N 2.78Å; L630-A632 VanDerWaalsContact C-N 3.35Å; L630-A632 PolarHBondContact O-N 2.85Å; L630-A633 PolarHBondContact O-N 3.15Å; L630-L634 PolarHBondContact O-N 3.06Å
631	F	82.3	Confident	75.3	Confident	146 Å²	146	131.3 Å²	131.3	64%	0.64	64%	0.642	S	S	*	*	H	α-helix	trans	-66.7	-36.3	179.8	-142.8	-86.4	0	0	0	112.4	I627 V628 V629 K635	I627-F631 PolarHBondContact O-N 3.44Å; I627-F631 VanDerWaalsContact O-N 3.07Å; V628-F631 PolarHBondContact O-N 2.82Å; V629-F631 PolarHBondContact O-N 3.12Å; F631-K635 PolarHBondContact O-N 2.95Å
632	A	79.5	Confident	73	Confident	60 Å²	60	132.6 Å²	132.6	50%	0.496	66%	0.656	S	S	.	*	H	α-helix	trans	-67.9	-36.9	176.1	0	0	0	0	0	112.9	V628 V629 L630	V628-A632 WeakPolarHBondContact O-CB 3.33Å; V628-A632 PolarHBondContact O-N 2.76Å; V629-A632 PolarHBondContact O-N 3.18Å; L630-A632 VanDerWaalsContact C-N 3.35Å; L630-A632 PolarHBondContact O-N 2.85Å
633	A	78.4	Confident	70.3	Confident	59 Å²	59	136 Å²	136	49%	0.488	67%	0.674	S	S	.	*	H	α-helix	trans	-65.3	-51.3	177.4	0	0	0	0	0	111.8	V629 L630 K635 R636	V629-A633 PolarHBondContact O-N 2.86Å; L630-A633 PolarHBondContact O-N 3.15Å; A633-K635 VanDerWaalsContact C-N 3.26Å; A633-K635 PolarHBondContact O-N 3.35Å; A633-R636 PolarHBondContact O-N 3.38Å; A633-R636 VanDerWaalsContact O-N 3.14Å
634	L	75.1	Confident	67.9	Low	115 Å²	115	140 Å²	140	60%	0.602	70%	0.695	S	S	*	*	H	α-helix	trans	-58.6	-36	-179.9	-69.8	170	0	0	0	112.6	L630 R636	L630-L634 PolarHBondContact O-N 3.06Å; L634-R636 VanDerWaalsContact C-N 3.29Å; L634-R636 PolarHBondContact O-N 3.44Å
635	K	72	Confident	65.5	Low	174 Å²	174	142.3 Å²	142.3	76%	0.757	71%	0.707	S	S	*	*	H	α-helix	trans	-72.7	-16.1	-178.4	-155.1	169.5	-173.7	175.8	0	113.9	F631 A633	F631-K635 PolarHBondContact O-N 2.95Å; A633-K635 VanDerWaalsContact C-N 3.26Å; A633-K635 PolarHBondContact O-N 3.35Å
636	R	66.7	Low	63.1	Low	225 Å²	225	141.4 Å²	141.4	85%	0.849	71%	0.71	S	S	*	*	H	α-helix	trans	-83.8	-21.7	-178.5	-93	-173.2	171.1	-171.9	-1.4	115.3	A633 L634	A633-R636 PolarHBondContact O-N 3.38Å; A633-R636 VanDerWaalsContact O-N 3.14Å; L634-R636 VanDerWaalsContact C-N 3.29Å; L634-R636 PolarHBondContact O-N 3.44Å
637	Q	60.3	Low	60.7	Low	172 Å²	172	146.5 Å²	146.5	80%	0.804	73%	0.725	S	S	*	*	S	Bend	trans	-82.9	-12.2	-171.9	-77.4	-173.2	-32.6	0	0	115.7
638	R	55.1	Low	58.5	Low	230 Å²	230	148 Å²	148	87%	0.868	73%	0.73	S	S	*	*	S	Bend	trans	-99.7	14.5	-164	-80.1	-171	170.2	-169.2	-2.8	117.8
639	K	40.8	Very low	56.3	Low	195 Å²	195	150.5 Å²	150.5	85%	0.848	74%	0.74	S	S	*	*			trans	-151.8	110.7	177.3	-70.8	-167	175	-170	0	114.9
640	K	37.6	Very low	54.1	Low	208 Å²	208	150.8 Å²	150.8	90%	0.904	74%	0.737	S	S	*	*			trans	169.2	113.3	148	-103.3	179	176.1	-170.6	0	112.6
641	E	39.2	Very low	51.8	Low	195 Å²	195	155 Å²	155	91%	0.911	75%	0.746	S	S	*	*			trans	-162.5	130.2	149	-72.5	-155.4	149.1	0	0	109.3
642	P	41.9	Very low	49.8	Very low	116 Å²	116	154.3 Å²	154.3	75%	0.753	75%	0.748	S	S	*	*			trans	-154.6	177.8	145.3	38.8	-20.7	0	0	0	116.3
643	L	37.4	Very low	48	Very low	163 Å²	163	159.2 Å²	159.2	85%	0.853	77%	0.766	S	S	*	*			trans	91.5	129.4	159.8	-59.2	165.3	0	0	0	120.5
644	I	40.4	Very low	46.3	Very low	174 Å²	174	163.6 Å²	163.6	89%	0.892	78%	0.78	S	S	*	*			trans	175.5	153.4	155.5	-95.5	151.4	0	0	0	107
645	L	38.8	Very low	44.4	Very low	162 Å²	162	165.1 Å²	165.1	85%	0.848	79%	0.794	S	S	*	*			cis	-161.9	157.8	-43	-168.5	65.9	0	0	0	107.6
646	S	41.6	Very low	43	Very low	89 Å²	89	162 Å²	162	62%	0.622	79%	0.793	S	S	*	*			trans	-94.8	169.5	178.3	67.3	0	0	0	0	114.1	E648	S646-E648 WeakPolarHBondContact CB-OE2 3.11Å; S646-E648 PolarHBondContact OG-OE2 2.66Å
647	K	40.3	Very low	41.6	Very low	194 Å²	194	161.8 Å²	161.8	84%	0.843	79%	0.794	S	S	*	*			trans	-157.8	159.3	154.2	-134	-165.5	167	-176.6	0	116.6
648	E	41.8	Very low	40.8	Very low	127 Å²	127	161.2 Å²	161.2	59%	0.593	80%	0.797	S	S	*	*			trans	-138.9	163.5	-168.2	-40.8	74.3	22	0	0	108.1	S646	S646-E648 WeakPolarHBondContact CB-OE2 3.11Å; S646-E648 PolarHBondContact OG-OE2 2.66Å
649	D	41.1	Very low	40.1	Very low	147 Å²	147	158.4 Å²	158.4	79%	0.786	80%	0.799	S	S	*	*			cis	-173.7	-168.4	-11.1	168.8	39	0	0	0	107
650	I	41	Very low	40	Very low	108 Å²	108	158.6 Å²	158.6	55%	0.554	80%	0.803	S	S	*	*			trans	102.5	107.3	148	-62.5	178.1	0	0	0	121.5
651	R	37.1	Very low	39.8	Very low	197 Å²	197	152.6 Å²	152.6	74%	0.743	80%	0.8	S	S	*	*			trans	62.4	128.9	131.6	-64.8	-180	-119.6	164.4	4.4	126.7
652	D	40.6	Very low	39.6	Very low	131 Å²	131	147.4 Å²	147.4	70%	0.701	80%	0.799	S	S	*	*				44.1	132.8	123.3	-37.9	-29.5	0	0	0	123.8
653	N	41.3	Very low	39.3	Very low	163 Å²	163	145.7 Å²	145.7	87%	0.872	80%	0.802	S	S	*	*				-175.1	171.6	111.4	-102	-69.9	0	0	0	115.8
654	I	42.2	Very low	39.3	Very low	150 Å²	150	147 Å²	147	77%	0.769	80%	0.804	S	S	*	*			trans	-107.6	150.3	-161.6	-64	153.9	0	0	0	114.1
655	V	34.7	Very low	39.1	Very low	148 Å²	148	147.5 Å²	147.5	90%	0.897	80%	0.802	S	S	*	*			trans	-140.6	156.9	152.5	-173.7	0	0	0	0	109.3
656	S	43.4	Very low	38.9	Very low	107 Å²	107	146.9 Å²	146.9	75%	0.748	80%	0.8	S	S	*	*			trans	-128	168.1	-172.5	61.4	0	0	0	0	115.1
657	Y	36.6	Very low	38.8	Very low	221 Å²	221	148.3 Å²	148.3	87%	0.867	81%	0.805	S	S	*	*			trans	-48.5	152.2	177.5	-89.1	-115.1	0	0	0	115.6
658	N	43.7	Very low	38.8	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	81%	0.805	S	S	*	*			trans	-167	-15.8	156.3	-106.5	-4.6	0	0	0	115.3	E660	N658-E660 PolarHBondContact O-N 2.99Å
659	D	40.4	Very low	38.5	Very low	170 Å²	170	144.3 Å²	144.3	91%	0.909	80%	0.799	S	S	*	*			trans	-86.2	102.7	-176.2	-64.9	-41.6	0	0	0	112.3
660	E	38.9	Very low	38.1	Very low	200 Å²	200	141.3 Å²	141.3	94%	0.935	78%	0.779	S	S	*	*			trans	-131.4	141.9	176.8	179.5	176.8	-122.8	0	0	109	N658	N658-E660 PolarHBondContact O-N 2.99Å
661	G	33.2	Very low	38.1	Very low	81 Å²	81	137.6 Å²	137.6	84%	0.835	76%	0.76	S	S	*	*			trans	-178.2	145.4	177.8	0	0	0	0	0	114.7
662	G	35	Very low	38.5	Very low	87 Å²	87	132 Å²	132	90%	0.897	75%	0.745	S	S	*	*			trans	-176.3	166.1	177.2	0	0	0	0	0	112
663	G	35.9	Very low	38.5	Very low	79 Å²	79	126.6 Å²	126.6	81%	0.814	72%	0.719	S	S	*	*			trans	170.5	147.4	177.9	0	0	0	0	0	112.7
664	E	38	Very low	38.6	Very low	190 Å²	190	122 Å²	122	89%	0.888	70%	0.697	S	S	*	*			trans	-146.1	151.5	-178	-61.8	177.2	168.4	0	0	108.7
665	E	34.8	Very low	38.5	Very low	185 Å²	185	121.1 Å²	121.1	86%	0.864	69%	0.693	S	S	*	*			trans	-166.2	159	164.1	-117.2	158.5	-157.9	0	0	114.4
666	D	36.4	Very low	38.8	Very low	149 Å²	149	126 Å²	126	80%	0.797	70%	0.696	S	S	*	*			trans	80.8	153.2	162.8	-67.5	-16.4	0	0	0	124.7
667	T	39.6	Very low	38.6	Very low	120 Å²	120	127.6 Å²	127.6	74%	0.736	70%	0.696	S	S	*	*			trans	-161	162.2	-159.6	59.6	0	0	0	0	115.6
668	Q	38.6	Very low	38.7	Very low	181 Å²	181	120.7 Å²	120.7	85%	0.846	68%	0.678	S	S	*	*			trans	103	126.1	150.5	-67	177.6	45.7	0	0	125
669	A	37.2	Very low	38.8	Very low	56 Å²	56	117.6 Å²	117.6	46%	0.463	68%	0.675	S	S	.	*				88.2	167.2	122.6	0	0	0	0	0	124.9
670	F	32.6	Very low	38.7	Very low	83 Å²	83	113.8 Å²	113.8	36%	0.364	67%	0.667	S	S	.	*			trans	-167.9	170.3	-156.2	-11.2	-104.3	0	0	0	112.6	D188 D189 P190	D188-F670 WeakPolarHBondContact O-CD1 3.48Å; D189-F670 HydrophobicContact CB-CB 3.39Å; D189-F670 HydrophobicContact CB-CG 3.97Å; D189-F670 WeakPolarHBondContact OD1-CD2 3.33Å; P190-F670 VanDerWaalsContact CD-CE2 3.43Å; P190-F670 HydrophobicContact CG-CD2 4.2Å; P190-F670 HydrophobicContact CG-CE2 3.68Å; P190-F670 HydrophobicContact CG-CZ 4.03Å
671	D	39.4	Very low	38.6	Very low	30 Å²	30	111.3 Å²	111.3	16%	0.16	66%	0.659	C	S	.	*			trans	-176.7	106	172.2	-169.8	38.8	0	0	0	119.6	K149 H151 D189	K149-D671 VanDerWaalsContact CD-OD2 3.29Å; K149-D671 WeakPolarHBondContact CD-OD2 3Å; K149-D671 WeakPolarHBondContact CE-OD2 3.1Å; K149-D671 IonicContact NZ-OD2 2.68Å; K149-D671 PolarHBondContact NZ-OD2 2.85Å; H151-D671 WeakPolarHBondContact CA-O 3.22Å; H151-D671 PolarHBondContact ND1-O 2.77Å; D189-D671 WeakPolarHBondContact OD2-CA 3.44Å; D189-D671 PolarHBondContact OD2-N 3.33Å
672	I	45.2	Very low	38.9	Very low	81 Å²	81	116.4 Å²	116.4	42%	0.415	66%	0.661	S	S	.	*			trans	133.1	-30.4	138.7	-67.7	165.2	0	0	0	127.6	H151 Y192	H151-I672 WeakPolarHBondContact CE1-CG2 3.48Å; H151-I672 WeakPolarHBondContact ND1-CA 3.4Å; Y192-I672 HydrophobicContact CD2-CB 4.04Å; Y192-I672 HydrophobicContact CD2-CG1 3.52Å; Y192-I672 VanDerWaalsContact CD2-O 3.26Å; Y192-I672 WeakPolarHBondContact CD2-O 3.32Å; Y192-I672 HydrophobicContact CE2-CG1 4.14Å; Y192-I672 WeakPolarHBondContact CE2-O 3.38Å
673	G	42.4	Very low	39.1	Very low	16 Å²	16	119.1 Å²	119.1	17%	0.165	65%	0.65	C	S	.	*			trans	-81.1	-89.4	-144.9	0	0	0	0	0	126	D152 Y192 L675	D152-G673 WeakPolarHBondContact O-CA 3.3Å; D152-G673 PolarHBondContact O-N 2.6Å; Y192-G673 VanDerWaalsContact CE1-C 3.46Å; Y192-G673 VanDerWaalsContact CE2-N 3.32Å; Y192-G673 PolarHBondContact OH-O 3.36Å; Y192-G673 VanDerWaalsContact OH-O 3.1Å; G673-L675 PolarHBondContact O-N 2.87Å
674	T	43.2	Very low	38.9	Very low	66 Å²	66	123.1 Å²	123.1	41%	0.405	65%	0.645	S	S	.	*	S	Bend	trans	-44.4	37.7	-161.2	85.6	0	0	0	0	123.7	D152 I153 Y192	D152-T674 PolarHBondContact O-N 2.98Å; I153-T674 HydrophobicContact CB-CG2 4.28Å; I153-T674 HydrophobicContact CG2-CG2 4.31Å; Y192-T674 HydrophobicContact CE1-CG2 4.09Å; Y192-T674 WeakPolarHBondContact CE1-OG1 3.49Å; Y192-T674 VanDerWaalsContact OH-CA 3.28Å; Y192-T674 WeakPolarHBondContact OH-CA 3.32Å; Y192-T674 PolarHBondContact OH-N 3.04Å
675	L	39	Very low	38.9	Very low	133 Å²	133	124 Å²	124	70%	0.696	65%	0.646	S	S	*	*			trans	-133	81.8	-178.1	-82.2	172.7	0	0	0	114.5	Y192 G673	Y192-L675 VanDerWaalsContact OH-CB 3.27Å; Y192-L675 WeakPolarHBondContact OH-CB 3.26Å; Y192-L675 WeakPolarHBondContact OH-CG 3.16Å; Y192-L675 PolarHBondContact OH-N 3.47Å; G673-L675 PolarHBondContact O-N 2.87Å
676	R	40.3	Very low	39	Very low	249 Å²	249	123 Å²	123	94%	0.94	65%	0.646	S	S	*	*			trans	-157.8	24	165.7	-114.7	148.7	-157.9	-135.3	0.4	119.3	P678	R676-P678 VanDerWaalsContact C-CD 3.41Å; R676-P678 VanDerWaalsContact O-CD 3.26Å; R676-P678 WeakPolarHBondContact O-CD 3.33Å
677	N	40.3	Very low	38.9	Very low	142 Å²	142	126 Å²	126	76%	0.759	65%	0.646	S	S	*	*			trans	-112	84.5	172.2	-174.3	9.4	0	0	0	114.6	A679	N677-A679 PolarHBondContact OD1-N 2.84Å
678	P	39.7	Very low	39.1	Very low	75 Å²	75	131.6 Å²	131.6	49%	0.487	65%	0.653	S	S	.	*			trans	-108	34.5	164	40.1	-32.8	0	0	0	112.4	R676 A680 I681	R676-P678 VanDerWaalsContact C-CD 3.41Å; R676-P678 VanDerWaalsContact O-CD 3.26Å; R676-P678 WeakPolarHBondContact O-CD 3.33Å; P678-A680 PolarHBondContact O-N 3.11Å; P678-I681 HydrophobicContact CB-CD1 4.36Å; P678-I681 WeakPolarHBondContact O-CD1 3.33Å; P678-I681 WeakPolarHBondContact O-CG1 3.16Å
679	A	44.2	Very low	38.9	Very low	96 Å²	96	127.9 Å²	127.9	79%	0.793	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-4.3	170.7	0	0	0	0	0	113	N677	N677-A679 PolarHBondContact OD1-N 2.84Å
680	A	38.8	Very low	38.9	Very low	90 Å²	90	132.8 Å²	132.8	74%	0.744	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	29.6	178.3	0	0	0	0	0	113.8	P678 E682	P678-A680 PolarHBondContact O-N 3.11Å; A680-E682 VanDerWaalsContact C-N 3.33Å; A680-E682 PolarHBondContact O-N 3.14Å
681	I	37.8	Very low	39.3	Very low	148 Å²	148	136.3 Å²	136.3	76%	0.759	68%	0.677	S	S	*	*			trans	-75.7	85.2	172.8	-63.6	165.2	0	0	0	109.2	P678	P678-I681 HydrophobicContact CB-CD1 4.36Å; P678-I681 WeakPolarHBondContact O-CD1 3.33Å; P678-I681 WeakPolarHBondContact O-CG1 3.16Å
682	E	39	Very low	39.1	Very low	188 Å²	188	140.7 Å²	140.7	88%	0.879	71%	0.707	S	S	*	*			trans	-86.8	158.4	162.3	-91	-158.1	151.1	0	0	112.2	A680	A680-E682 VanDerWaalsContact C-N 3.33Å; A680-E682 PolarHBondContact O-N 3.14Å
683	E	38.6	Very low	38.7	Very low	145 Å²	145	145.5 Å²	145.5	68%	0.678	73%	0.728	S	S	*	*			trans	-77.1	150.8	-163.9	-59.2	-165.6	116.9	0	0	116
684	K	32.4	Very low	38.7	Very low	163 Å²	163	151.2 Å²	151.2	71%	0.709	76%	0.76	S	S	*	*			trans	52.7	80.5	144.6	-62.6	156.4	-162.9	152.8	0	117
685	K	36.9	Very low	38.4	Very low	208 Å²	208	155.7 Å²	155.7	90%	0.904	78%	0.78	S	S	*	*			trans	-126	126	147.4	-74.8	176.8	-176.9	160.6	0	110.1	R687	K685-R687 PolarHBondContact O-N 2.94Å
686	L	37.8	Very low	38.1	Very low	164 Å²	164	159 Å²	159	86%	0.859	79%	0.79	S	S	*	*			trans	-68.8	127.4	173.9	-74	81.2	0	0	0	109.2
687	R	34.8	Very low	38.1	Very low	213 Å²	213	154.5 Å²	154.5	80%	0.804	78%	0.782	S	S	*	*			trans	-71.3	142.4	162.6	-170.9	163.8	176.5	161	1.3	108.4	K685 D689	K685-R687 PolarHBondContact O-N 2.94Å; R687-D689 HydrophobicContact CG-CB 4.42Å; R687-D689 VanDerWaalsContact CG-OD1 3.28Å; R687-D689 WeakPolarHBondContact CG-OD1 3.35Å; R687-D689 IonicContact CZ-OD2 2.62Å; R687-D689 IonicContact NE-OD1 2.71Å; R687-D689 IonicContact NE-OD2 3.36Å; R687-D689 PolarHBondContact NE-OD2 2.92Å; R687-D689 IonicContact NH2-OD2 3.14Å; R687-D689 PolarHBondContact NH2-OD2 2.8Å; R687-D689 PolarHBondContact O-N 2.81Å
688	R	43.1	Very low	37.9	Very low	237 Å²	237	153.6 Å²	153.6	89%	0.894	78%	0.784	S	S	*	*	S	Bend	trans	-103.3	22.7	-154.2	-59.7	170	72.3	173	2.5	112.4
689	D	34.6	Very low	37.8	Very low	103 Å²	103	161.1 Å²	161.1	55%	0.551	80%	0.803	S	S	*	*	S	Bend	trans	-110.7	-13.2	-152.7	-52.1	19.8	0	0	0	112	R687	R687-D689 HydrophobicContact CG-CB 4.42Å; R687-D689 VanDerWaalsContact CG-OD1 3.28Å; R687-D689 WeakPolarHBondContact CG-OD1 3.35Å; R687-D689 IonicContact CZ-OD2 2.62Å; R687-D689 IonicContact NE-OD1 2.71Å; R687-D689 IonicContact NE-OD2 3.36Å; R687-D689 PolarHBondContact NE-OD2 2.92Å; R687-D689 IonicContact NH2-OD2 3.14Å; R687-D689 PolarHBondContact NH2-OD2 2.8Å; R687-D689 PolarHBondContact O-N 2.81Å
690	I	37.7	Very low	37.2	Very low	159 Å²	159	168.6 Å²	168.6	82%	0.815	81%	0.811	S	S	*	*			trans	-133.7	136.4	-178.6	-58.7	179.2	0	0	0	109.7
691	I	40.9	Very low	37.2	Very low	157 Å²	157	170.3 Å²	170.3	81%	0.805	81%	0.812	S	S	*	*			trans	-99.4	135.7	-178.7	-62.6	171.5	0	0	0	108.7
692	P	34.6	Very low	37.4	Very low	122 Å²	122	169.1 Å²	169.1	79%	0.792	81%	0.814	S	S	*	*			trans	-86	130.9	-168.8	32.1	-34.9	0	0	0	113.9
693	E	36.8	Very low	37.3	Very low	181 Å²	181	166.9 Å²	166.9	85%	0.846	81%	0.814	S	S	*	*			trans	-107	127	165	-69.2	-152.4	141.9	0	0	112.9
694	T	43.2	Very low	37.5	Very low	137 Å²	137	164 Å²	164	84%	0.84	82%	0.815	S	S	*	*			trans	65.9	128.9	168	64.3	0	0	0	0	119.6
695	L	35.4	Very low	38.2	Very low	159 Å²	159	161.8 Å²	161.8	83%	0.832	82%	0.817	S	S	*	*			trans	-78.8	127.7	175	-63.9	136	0	0	0	111.4
696	F	34.5	Very low	38.3	Very low	204 Å²	204	158.8 Å²	158.8	90%	0.895	81%	0.81	S	S	*	*			trans	-137.4	153.1	149.7	-96.2	-79.3	0	0	0	110.8
697	I	38.4	Very low	38.5	Very low	153 Å²	153	158.6 Å²	158.6	79%	0.785	81%	0.811	S	S	*	*			trans	-119.8	107.4	-163.7	-58.3	168.8	0	0	0	110.1
698	P	36.7	Very low	39.3	Very low	123 Å²	123	152.9 Å²	152.9	80%	0.799	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.7	138.7	170.1	-21.5	34.4	0	0	0	111.8
699	R	37.1	Very low	39.8	Very low	234 Å²	234	146 Å²	146	88%	0.883	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-96.7	129.8	-170.5	-155.8	176.1	-168.6	166.8	1.3	109.8	T701	R699-T701 PolarHBondContact O-N 2.9Å
700	R	31.8	Very low	40.5	Very low	252 Å²	252	145.7 Å²	145.7	95%	0.951	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.4	126.5	170.8	-74	-176.7	175.5	-178.6	-2.8	110.5
701	T	39.4	Very low	41.4	Very low	126 Å²	126	146.4 Å²	146.4	77%	0.773	77%	0.774	S	S	*	*			trans	-126.2	151.2	162.4	25	0	0	0	0	110.1	R699	R699-T701 PolarHBondContact O-N 2.9Å
702	P	41.3	Very low	42.5	Very low	123 Å²	123	142.8 Å²	142.8	80%	0.799	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-88.9	161.4	-159.7	-8.1	28.3	0	0	0	114.5	A704	P702-A704 PolarHBondContact O-N 2.94Å
703	T	38.3	Very low	43.7	Very low	142 Å²	142	142.2 Å²	142.2	87%	0.871	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-50.2	126.4	174.4	47.7	0	0	0	0	113.3
704	A	42	Very low	44.6	Very low	85 Å²	85	137.7 Å²	137.7	70%	0.702	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-75.4	159.2	160.3	0	0	0	0	0	111.1	P702	P702-A704 PolarHBondContact O-N 2.94Å
705	P	46.4	Very low	45.7	Very low	115 Å²	115	134.9 Å²	134.9	75%	0.747	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-88.2	168.8	-169.1	-7	27.3	0	0	0	114.6
706	D	40.4	Very low	47.2	Very low	145 Å²	145	132.4 Å²	132.4	78%	0.775	69%	0.687	S	S	*	*	S	Bend	trans	-51.5	152	-178.3	-51.7	-69.9	0	0	0	115.5
707	N	41.4	Very low	48.5	Very low	161 Å²	161	129 Å²	129	86%	0.861	67%	0.668	S	S	*	*			trans	82	47.7	170	-43.9	-84.4	0	0	0	117.4
708	T	51.6	Low	49.6	Very low	92 Å²	92	124.3 Å²	124.3	56%	0.564	64%	0.644	S	S	*	*			trans	-96	152	149	43.6	0	0	0	0	110.6
709	D	52.7	Low	51.1	Low	94 Å²	94	125.4 Å²	125.4	50%	0.503	64%	0.636	S	S	.	*			trans	-60.1	146.2	175.3	-173.4	-21	0	0	0	109.5	R711 D712 F713	D709-R711 HydrophobicContact CB-CB 4.26Å; D709-R711 PolarHBondContact O-N 3.42Å; D709-R711 VanDerWaalsContact O-N 3.15Å; D709-R711 WeakPolarHBondContact OD1-CB 3.46Å; D709-R711 PolarHBondContact OD1-N 2.75Å; D709-D712 HydrophobicContact CB-CB 4.29Å; D709-D712 WeakPolarHBondContact O-CA 3.3Å; D709-D712 PolarHBondContact O-N 3.12Å; D709-F713 PolarHBondContact O-N 3.49Å
710	V	49	Very low	52.5	Low	95 Å²	95	119.1 Å²	119.1	58%	0.576	62%	0.617	S	S	*	*	H	α-helix	trans	-52.6	-35.6	170.2	178.9	0	0	0	0	110	F713 I714	V710-F713 PolarHBondContact O-N 2.76Å; V710-I714 HydrophobicContact CG1-CD1 3.92Å; V710-I714 WeakPolarHBondContact O-CB 3.39Å; V710-I714 VanDerWaalsContact O-CG1 3.28Å; V710-I714 WeakPolarHBondContact O-CG1 3.29Å; V710-I714 PolarHBondContact O-N 2.96Å
711	R	56.9	Low	53.9	Low	175 Å²	175	111 Å²	111	66%	0.66	59%	0.589	S	S	*	*	H	α-helix	trans	-59.5	-42.3	171.7	-170.8	-179.1	-171.5	162.9	4	113.3	D709 N715	D709-R711 HydrophobicContact CB-CB 4.26Å; D709-R711 PolarHBondContact O-N 3.42Å; D709-R711 VanDerWaalsContact O-N 3.15Å; D709-R711 WeakPolarHBondContact OD1-CB 3.46Å; D709-R711 PolarHBondContact OD1-N 2.75Å; R711-N715 WeakPolarHBondContact O-CB 3.21Å; R711-N715 PolarHBondContact O-N 2.95Å; R711-N715 PolarHBondContact O-ND2 2.89Å
712	D	64.7	Low	55	Low	81 Å²	81	110.5 Å²	110.5	43%	0.433	58%	0.582	S	S	.	*	H	α-helix	trans	-74.2	-38.2	-179.3	-72.4	-26.9	0	0	0	111.4	D709 N715 E716	D709-D712 HydrophobicContact CB-CB 4.29Å; D709-D712 WeakPolarHBondContact O-CA 3.3Å; D709-D712 PolarHBondContact O-N 3.12Å; D712-N715 PolarHBondContact O-N 3.46Å; D712-E716 VanDerWaalsContact O-CB 3.27Å; D712-E716 WeakPolarHBondContact O-CB 3.03Å; D712-E716 PolarHBondContact O-N 2.96Å
713	F	59	Low	56.2	Low	109 Å²	109	111.4 Å²	111.4	48%	0.478	58%	0.579	S	S	.	*	H	α-helix	trans	-60.8	-43.4	171	177.4	-99.3	0	0	0	112.1	D709 V710 E716 R717	D709-F713 PolarHBondContact O-N 3.49Å; V710-F713 PolarHBondContact O-N 2.76Å; F713-E716 PolarHBondContact O-N 2.95Å; F713-R717 HydrophobicContact CE1-CG 4.27Å; F713-R717 HydrophobicContact CE2-CG 4.38Å; F713-R717 HydrophobicContact CZ-CG 4.07Å; F713-R717 WeakPolarHBondContact O-CB 3.22Å; F713-R717 PolarHBondContact O-N 3.31Å
714	I	56.1	Low	57.4	Low	86 Å²	86	108 Å²	108	44%	0.441	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-45	174.8	-72.1	169.1	0	0	0	110.9	V710 E716 R717 L718	V710-I714 HydrophobicContact CG1-CD1 3.92Å; V710-I714 WeakPolarHBondContact O-CB 3.39Å; V710-I714 VanDerWaalsContact O-CG1 3.28Å; V710-I714 WeakPolarHBondContact O-CG1 3.29Å; V710-I714 PolarHBondContact O-N 2.96Å; I714-E716 VanDerWaalsContact C-N 3.31Å; I714-E716 PolarHBondContact O-N 3.28Å; I714-R717 PolarHBondContact O-N 3.02Å; I714-L718 HydrophobicContact CG2-CD1 3.98Å; I714-L718 WeakPolarHBondContact O-CB 3.27Å; I714-L718 PolarHBondContact O-N 3.2Å
715	N	66.1	Low	58.1	Low	78 Å²	78	110 Å²	110	42%	0.417	56%	0.562	S	S	.	*	H	α-helix	trans	-62.9	-35.3	176	-71.4	-33.3	0	0	0	112.9	R711 D712 K719	R711-N715 WeakPolarHBondContact O-CB 3.21Å; R711-N715 PolarHBondContact O-N 2.95Å; R711-N715 PolarHBondContact O-ND2 2.89Å; D712-N715 PolarHBondContact O-N 3.46Å; N715-K719 WeakPolarHBondContact O-CB 3.48Å; N715-K719 PolarHBondContact O-N 2.98Å
716	E	67.7	Low	58.8	Low	108 Å²	108	110.4 Å²	110.4	51%	0.505	56%	0.562	S	S	.	*	H	α-helix	trans	-72.8	-42	178.1	-172.3	163.4	-127.2	0	0	111.1	D712 F713 I714 K719 E720	D712-E716 VanDerWaalsContact O-CB 3.27Å; D712-E716 WeakPolarHBondContact O-CB 3.03Å; D712-E716 PolarHBondContact O-N 2.96Å; F713-E716 PolarHBondContact O-N 2.95Å; I714-E716 VanDerWaalsContact C-N 3.31Å; I714-E716 PolarHBondContact O-N 3.28Å; E716-K719 WeakPolarHBondContact O-CB 3.35Å; E716-K719 PolarHBondContact O-N 2.82Å; E716-E720 PolarHBondContact O-N 2.73Å
717	R	61.6	Low	59.3	Low	133 Å²	133	105 Å²	105	50%	0.502	54%	0.538	S	S	.	.	H	α-helix	trans	-65.8	-40.2	173	-89.4	-72.6	126.6	99.2	0.3	113.6	F713 I714 E720 H721	F713-R717 HydrophobicContact CE1-CG 4.27Å; F713-R717 HydrophobicContact CE2-CG 4.38Å; F713-R717 HydrophobicContact CZ-CG 4.07Å; F713-R717 WeakPolarHBondContact O-CB 3.22Å; F713-R717 PolarHBondContact O-N 3.31Å; I714-R717 PolarHBondContact O-N 3.02Å; R717-E720 IonicContact CZ-OE2 3.46Å; R717-E720 IonicContact NE-OE2 3.01Å; R717-E720 PolarHBondContact NE-OE2 3.4Å; R717-E720 IonicContact NH2-OE2 2.73Å; R717-E720 PolarHBondContact NH2-OE2 3.1Å; R717-E720 PolarHBondContact O-N 2.87Å; R717-H721 PolarHBondContact O-N 2.86Å
718	L	61.8	Low	59.5	Low	54 Å²	54	102.4 Å²	102.4	28%	0.283	53%	0.53	S	S	.	.	H	α-helix	trans	-57	-50.7	169.7	-95.1	153.3	0	0	0	110.2	I714 E720 H721 D722	I714-L718 HydrophobicContact CG2-CD1 3.98Å; I714-L718 WeakPolarHBondContact O-CB 3.27Å; I714-L718 PolarHBondContact O-N 3.2Å; L718-E720 VanDerWaalsContact C-N 3.31Å; L718-E720 PolarHBondContact O-N 2.76Å; L718-H721 PolarHBondContact O-N 2.94Å; L718-H721 VanDerWaalsContact O-N 3.08Å; L718-D722 WeakPolarHBondContact O-CB 3.16Å; L718-D722 PolarHBondContact O-N 3.23Å
719	K	68.8	Low	59.3	Low	146 Å²	146	103.8 Å²	103.8	64%	0.635	54%	0.54	S	S	*	.	H	α-helix	trans	-57.5	-37.8	174.8	-93.9	-179.7	173.4	175.5	0	114.4	N715 E716 H721 L723	N715-K719 WeakPolarHBondContact O-CB 3.48Å; N715-K719 PolarHBondContact O-N 2.98Å; E716-K719 WeakPolarHBondContact O-CB 3.35Å; E716-K719 PolarHBondContact O-N 2.82Å; K719-H721 VanDerWaalsContact C-N 3.35Å; K719-L723 WeakPolarHBondContact O-CB 3.31Å; K719-L723 VanDerWaalsContact O-CD1 3.3Å; K719-L723 WeakPolarHBondContact O-CD1 3.14Å; K719-L723 WeakPolarHBondContact O-CG 3.5Å; K719-L723 PolarHBondContact O-N 2.96Å
720	E	65.4	Low	58.9	Low	102 Å²	102	102.7 Å²	102.7	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-70.2	-30.3	177.4	-75.7	-172.3	140.7	0	0	112.4	E716 R717 L718	E716-E720 PolarHBondContact O-N 2.73Å; R717-E720 IonicContact CZ-OE2 3.46Å; R717-E720 IonicContact NE-OE2 3.01Å; R717-E720 PolarHBondContact NE-OE2 3.4Å; R717-E720 IonicContact NH2-OE2 2.73Å; R717-E720 PolarHBondContact NH2-OE2 3.1Å; R717-E720 PolarHBondContact O-N 2.87Å; L718-E720 VanDerWaalsContact C-N 3.31Å; L718-E720 PolarHBondContact O-N 2.76Å
721	H	60.7	Low	58.3	Low	81 Å²	81	102.9 Å²	102.9	38%	0.375	53%	0.528	S	S	.	.	H	α-helix	trans	-81.5	-40	173.2	-108.2	42.3	0	0	0	113.4	R717 L718 K719 L723 D724 Y730	R717-H721 PolarHBondContact O-N 2.86Å; L718-H721 PolarHBondContact O-N 2.94Å; L718-H721 VanDerWaalsContact O-N 3.08Å; K719-H721 VanDerWaalsContact C-N 3.35Å; H721-L723 PolarHBondContact O-N 3.19Å; H721-D724 PolarHBondContact O-N 3.39Å; H721-Y730 HydrophobicContact CB-CE2 4.31Å; H721-Y730 VanDerWaalsContact CB-OH 3.28Å; H721-Y730 WeakPolarHBondContact CB-OH 3.29Å; H721-Y730 AromaticContact CD2-CZ 3.61Å; H721-Y730 PolarHBondContact CD2-OH 3.15Å
722	D	62.1	Low	57.4	Low	116 Å²	116	98.4 Å²	98.4	62%	0.62	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-12.4	172.9	-68.3	-22	0	0	0	113	L718	L718-D722 WeakPolarHBondContact O-CB 3.16Å; L718-D722 PolarHBondContact O-N 3.23Å
723	L	68.2	Low	56.1	Low	141 Å²	141	97.9 Å²	97.9	74%	0.738	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	0.5	179.2	-68.7	174	0	0	0	114.1	K719 H721 P725	K719-L723 WeakPolarHBondContact O-CB 3.31Å; K719-L723 VanDerWaalsContact O-CD1 3.3Å; K719-L723 WeakPolarHBondContact O-CD1 3.14Å; K719-L723 WeakPolarHBondContact O-CG 3.5Å; K719-L723 PolarHBondContact O-N 2.96Å; H721-L723 PolarHBondContact O-N 3.19Å; L723-P725 WeakPolarHBondContact O-CD 3.43Å
724	D	62.9	Low	55	Low	71 Å²	71	94.1 Å²	94.1	38%	0.38	51%	0.508	S	S	.	.			trans	-102.9	102	177.9	-167.8	-23.2	0	0	0	111.7	H721 T726 A727	H721-D724 PolarHBondContact O-N 3.39Å; D724-T726 PolarHBondContact O-N 2.98Å; D724-T726 WeakPolarHBondContact OD1-CA 3.4Å; D724-T726 WeakPolarHBondContact OD1-CB 3.29Å; D724-T726 PolarHBondContact OD1-N 3.09Å; D724-T726 PolarHBondContact OD1-OG1 3.4Å; D724-A727 HydrophobicContact CB-CB 4.29Å; D724-A727 PolarHBondContact O-N 3.44Å
725	P	55.9	Low	54.1	Low	128 Å²	128	95 Å²	95	83%	0.831	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	8.6	178.9	33.9	-37.5	0	0	0	113.9	L723	L723-P725 WeakPolarHBondContact O-CD 3.43Å
726	T	61.4	Low	52.5	Low	122 Å²	122	97.1 Å²	97.1	75%	0.748	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	0.2	173.4	64.7	0	0	0	0	113.8	D724	D724-T726 PolarHBondContact O-N 2.98Å; D724-T726 WeakPolarHBondContact OD1-CA 3.4Å; D724-T726 WeakPolarHBondContact OD1-CB 3.29Å; D724-T726 PolarHBondContact OD1-N 3.09Å; D724-T726 PolarHBondContact OD1-OG1 3.4Å
727	A	52.2	Low	51.2	Low	33 Å²	33	96.4 Å²	96.4	27%	0.273	53%	0.534	S	S	.	.	S	Bend	trans	-71.7	139.9	171.3	0	0	0	0	0	111.5	D724	D724-A727 HydrophobicContact CB-CB 4.29Å; D724-A727 PolarHBondContact O-N 3.44Å
728	P	45	Very low	49.9	Very low	106 Å²	106	99.2 Å²	99.2	69%	0.688	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-69.3	152.9	171.5	30.7	-34.5	0	0	0	111.1
729	P	47.2	Very low	48.8	Very low	121 Å²	121	106 Å²	106	79%	0.786	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-62.9	144.7	-179.2	26.3	-34.6	0	0	0	112.2	D731	P729-D731 PolarHBondContact O-N 3.5Å
730	Y	45.2	Very low	47.4	Very low	71 Å²	71	101.3 Å²	101.3	28%	0.278	57%	0.57	S	S	.	*	S	Bend	trans	-68.9	114.3	-174.8	-85.3	-67.6	0	0	0	113.1	H721 L733 T755	H721-Y730 HydrophobicContact CB-CE2 4.31Å; H721-Y730 VanDerWaalsContact CB-OH 3.28Å; H721-Y730 WeakPolarHBondContact CB-OH 3.29Å; H721-Y730 AromaticContact CD2-CZ 3.61Å; H721-Y730 PolarHBondContact CD2-OH 3.15Å; Y730-L733 HydrophobicContact CD1-CD1 4.29Å; Y730-L733 HydrophobicContact CD1-CG 3.83Å; Y730-L733 HydrophobicContact CE1-CD1 4.21Å; Y730-L733 HydrophobicContact CE1-CD2 4.08Å; Y730-L733 HydrophobicContact CE1-CG 3.6Å; Y730-T755 CarbonylContact O-C 3.56Å; Y730-T755 WeakPolarHBondContact O-CA 3.38Å; Y730-T755 PolarHBondContact O-N 2.8Å
731	D	35.7	Very low	45.7	Very low	99 Å²	99	103.1 Å²	103.1	53%	0.529	58%	0.583	S	S	.	*	S	Bend	trans	-134.8	23.8	154.9	-136.5	-52.6	0	0	0	110.9	P729 S753 G754 T755	P729-D731 PolarHBondContact O-N 3.5Å; D731-S753 CarbonylContact C-O 3.55Å; D731-S753 CarbonylContact O-C 3.53Å; D731-G754 VanDerWaalsContact C-N 3.34Å; D731-G754 PolarHBondContact O-N 2.75Å; D731-G754 WeakPolarHBondContact OD1-CA 3.27Å; D731-G754 PolarHBondContact OD1-N 3.06Å; D731-T755 WeakPolarHBondContact OD1-CG2 3.37Å; D731-T755 WeakPolarHBondContact OD2-CA 3.48Å
732	S	37.7	Very low	44.5	Very low	80 Å²	80	107 Å²	107	56%	0.559	61%	0.606	S	S	*	*			trans	-160.8	72.4	178.3	34.1	0	0	0	0	116.3	E752 S753	S732-E752 CarbonylContact C-O 3.53Å; S732-E752 WeakPolarHBondContact CA-O 3.42Å; S732-S753 CarbonylContact C-O 3.56Å; S732-S753 WeakPolarHBondContact CA-O 3.31Å; S732-S753 PolarHBondContact N-O 2.87Å; S732-S753 VanDerWaalsContact N-O 3.07Å
733	L	37.1	Very low	43.3	Very low	71 Å²	71	107.1 Å²	107.1	37%	0.372	62%	0.616	S	S	.	*			trans	-87.9	104.3	163.5	-104.5	170.8	0	0	0	111.9	Y730 T735 E752 S753	Y730-L733 HydrophobicContact CD1-CD1 4.29Å; Y730-L733 HydrophobicContact CD1-CG 3.83Å; Y730-L733 HydrophobicContact CE1-CD1 4.21Å; Y730-L733 HydrophobicContact CE1-CD2 4.08Å; Y730-L733 HydrophobicContact CE1-CG 3.6Å; L733-T735 PolarHBondContact O-N 2.84Å; L733-E752 CarbonylContact C-O 3.52Å; L733-E752 PolarHBondContact N-O 2.89Å; L733-E752 CarbonylContact O-C 3.55Å; L733-E752 VanDerWaalsContact O-O 3.09Å; L733-S753 PolarHBondContact N-O 3.14Å; L733-S753 WeakPolarHBondContact O-CB 3.14Å
734	A	35.6	Very low	41.5	Very low	29 Å²	29	108.5 Å²	108.5	24%	0.24	62%	0.622	C	S	.	*			trans	-73.4	109.7	-176.5	0	0	0	0	0	114.4	Y736 E752	A734-Y736 HydrophobicContact CB-CD2 4.3Å; A734-Y736 HydrophobicContact CB-CE1 3.97Å; A734-Y736 HydrophobicContact CB-CE2 3.7Å; A734-Y736 PolarHBondContact O-N 2.92Å; A734-E752 PolarHBondContact N-O 3.08Å
735	T	38.4	Very low	40.2	Very low	104 Å²	104	109.8 Å²	109.8	64%	0.638	64%	0.643	S	S	*	*			trans	-78.4	81.1	-179.2	-36.8	0	0	0	0	112.8	L733 E752	L733-T735 PolarHBondContact O-N 2.84Å; T735-E752 WeakPolarHBondContact CB-OE2 3.26Å; T735-E752 PolarHBondContact OG1-OE2 2.84Å
736	Y	31.6	Very low	39.1	Very low	123 Å²	123	112.5 Å²	112.5	48%	0.482	64%	0.644	S	S	.	*			trans	-83.7	120.3	175.2	-56.5	-51.5	0	0	0	113.4	A734 S750 L751	A734-Y736 HydrophobicContact CB-CD2 4.3Å; A734-Y736 HydrophobicContact CB-CE1 3.97Å; A734-Y736 HydrophobicContact CB-CE2 3.7Å; A734-Y736 PolarHBondContact O-N 2.92Å; Y736-S750 VanDerWaalsContact CE1-C 3.47Å; Y736-S750 VanDerWaalsContact OH-CA 3.28Å; Y736-S750 WeakPolarHBondContact OH-CA 3.33Å; Y736-L751 PolarHBondContact OH-N 2.6Å
737	A	41.8	Very low	37.8	Very low	94 Å²	94	111.8 Å²	111.8	78%	0.777	64%	0.644	S	S	*	*			trans	-151.9	131.4	156.7	0	0	0	0	0	108.1
738	Y	34	Very low	36.7	Very low	191 Å²	191	117.5 Å²	117.5	75%	0.749	67%	0.67	S	S	*	*			cis	82.2	91.8	36.7	-167.1	-93.4	0	0	0	114.2
739	E	37.8	Very low	36.1	Very low	196 Å²	196	116.3 Å²	116.3	92%	0.916	66%	0.664	S	S	*	*			trans	-124.8	121.6	155.3	-68.7	-165.7	138.2	0	0	108.9
740	G	39.7	Very low	35.3	Very low	49 Å²	49	114.6 Å²	114.6	51%	0.505	65%	0.654	S	S	.	*			trans	-90.4	175	163.1	0	0	0	0	0	110.8
741	N	30.1	Very low	34.8	Very low	140 Å²	140	117.6 Å²	117.6	75%	0.749	68%	0.675	S	S	*	*	S	Bend	cis	-130.7	-177.1	6	-76.6	-34.3	0	0	0	110.3
742	D	34.1	Very low	34.8	Very low	162 Å²	162	118 Å²	118	87%	0.866	67%	0.674	S	S	*	*	S	Bend	trans	77.3	24.5	167.8	-54.8	-13.3	0	0	0	117.8
743	S	37.7	Very low	34.6	Very low	118 Å²	118	117 Å²	117	83%	0.825	67%	0.666	S	S	*	*			trans	-123.6	138.2	161.5	-161.8	0	0	0	0	111.6
744	I	31.5	Very low	34.6	Very low	170 Å²	170	114.7 Å²	114.7	87%	0.872	66%	0.659	S	S	*	*			trans	-118.2	78.8	-157.9	-51	173.1	0	0	0	111
745	A	35.7	Very low	34.5	Very low	98 Å²	98	117.7 Å²	117.7	81%	0.81	68%	0.675	S	S	*	*			trans	-159	157.8	168.7	0	0	0	0	0	110.6
746	E	32.5	Very low	34.7	Very low	185 Å²	185	118 Å²	118	86%	0.864	68%	0.677	S	S	*	*			trans	-110.3	142.7	-163.1	-62.2	174.5	107	0	0	115.4
747	S	33	Very low	34.9	Very low	107 Å²	107	121 Å²	121	75%	0.748	70%	0.695	S	S	*	*			trans	61.6	125.4	166.8	54.4	0	0	0	0	118.6
748	L	30.4	Very low	34.9	Very low	154 Å²	154	120 Å²	120	81%	0.806	69%	0.694	S	S	*	*				75.2	136.3	51.6	-64.7	173.7	0	0	0	115.1
749	S	32.4	Very low	35.4	Very low	81 Å²	81	118 Å²	118	57%	0.566	70%	0.696	S	S	*	*			cis	-177.6	161.4	-30.1	-97	0	0	0	0	109.4
750	S	30.3	Very low	35.9	Very low	84 Å²	84	117.2 Å²	117.2	59%	0.587	69%	0.692	S	S	*	*			trans	-146.4	129.6	-178.9	64.9	0	0	0	0	118.2	Y736	Y736-S750 VanDerWaalsContact CE1-C 3.47Å; Y736-S750 VanDerWaalsContact OH-CA 3.28Å; Y736-S750 WeakPolarHBondContact OH-CA 3.33Å
751	L	33.6	Very low	36.8	Very low	135 Å²	135	119.1 Å²	119.1	71%	0.707	69%	0.691	S	S	*	*			trans	61.6	141.8	151.1	-78.8	167.3	0	0	0	123	Y736	Y736-L751 PolarHBondContact OH-N 2.6Å
752	E	35.5	Very low	38.4	Very low	108 Å²	108	116.3 Å²	116.3	51%	0.505	67%	0.671	S	S	.	*			trans	-173.1	171.9	161.4	-140.6	-176.6	-145.7	0	0	114.1	S732 L733 A734 T735	S732-E752 CarbonylContact C-O 3.53Å; S732-E752 WeakPolarHBondContact CA-O 3.42Å; L733-E752 CarbonylContact C-O 3.52Å; L733-E752 PolarHBondContact N-O 2.89Å; L733-E752 CarbonylContact O-C 3.55Å; L733-E752 VanDerWaalsContact O-O 3.09Å; A734-E752 PolarHBondContact N-O 3.08Å; T735-E752 WeakPolarHBondContact CB-OE2 3.26Å; T735-E752 PolarHBondContact OG1-OE2 2.84Å
753	S	34.7	Very low	40	Very low	58 Å²	58	111.8 Å²	111.8	41%	0.406	65%	0.646	S	S	.	*			trans	60.1	111.3	146.1	161.4	0	0	0	0	125.2	D731 S732 L733	D731-S753 CarbonylContact C-O 3.55Å; D731-S753 CarbonylContact O-C 3.53Å; S732-S753 CarbonylContact C-O 3.56Å; S732-S753 WeakPolarHBondContact CA-O 3.31Å; S732-S753 PolarHBondContact N-O 2.87Å; S732-S753 VanDerWaalsContact N-O 3.07Å; L733-S753 PolarHBondContact N-O 3.14Å; L733-S753 WeakPolarHBondContact O-CB 3.14Å
754	G	37.3	Very low	41.7	Very low	22 Å²	22	111.5 Å²	111.5	23%	0.227	63%	0.628	C	S	.	*				39.9	150	121.7	0	0	0	0	0	123.7	D731	D731-G754 VanDerWaalsContact C-N 3.34Å; D731-G754 PolarHBondContact O-N 2.75Å; D731-G754 WeakPolarHBondContact OD1-CA 3.27Å; D731-G754 PolarHBondContact OD1-N 3.06Å
755	T	33.4	Very low	43.4	Very low	92 Å²	92	104.1 Å²	104.1	56%	0.564	59%	0.59	S	S	*	*			cis	180	145.9	-13.2	29.4	0	0	0	0	105.9	Y730 D731	Y730-T755 CarbonylContact O-C 3.56Å; Y730-T755 WeakPolarHBondContact O-CA 3.38Å; Y730-T755 PolarHBondContact O-N 2.8Å; D731-T755 WeakPolarHBondContact OD1-CG2 3.37Å; D731-T755 WeakPolarHBondContact OD2-CA 3.48Å
756	T	41.2	Very low	45.3	Very low	111 Å²	111	105.6 Å²	105.6	68%	0.681	58%	0.575	S	S	*	*			trans	179.8	128.4	135.6	36.6	0	0	0	0	115.9
757	E	35.8	Very low	47.2	Very low	186 Å²	186	104.9 Å²	104.9	87%	0.869	57%	0.572	S	S	*	*			trans	5.5	111.8	137.9	-55.2	-178.9	135.7	0	0	118.1
758	G	43	Very low	48.8	Very low	72 Å²	72	107.1 Å²	107.1	74%	0.742	56%	0.564	S	S	*	*			trans	-146	-42.4	175.5	0	0	0	0	0	115.8
759	D	43.7	Very low	50.9	Low	151 Å²	151	101 Å²	101	81%	0.807	54%	0.537	S	S	*	.			trans	-127.7	89.8	-171.2	-78.9	-63.6	0	0	0	113.4
760	Q	48.6	Very low	53	Low	178 Å²	178	102.8 Å²	102.8	83%	0.832	55%	0.547	S	S	*	.			trans	-101.4	40.1	165	-69.6	-168.3	5.9	0	0	112.1
761	N	58	Low	55.2	Low	89 Å²	89	109.3 Å²	109.3	48%	0.476	56%	0.559	S	S	.	*			trans	-118.9	115.3	168.3	-170.5	-0.9	0	0	0	111.5	D763 Y764	N761-D763 PolarHBondContact ND2-OD2 3.42Å; N761-D763 WeakPolarHBondContact OD1-CB 3.24Å; N761-D763 PolarHBondContact OD1-N 2.93Å; N761-D763 PolarHBondContact OD1-OD2 2.81Å; N761-Y764 VanDerWaalsContact O-CD1 3.28Å; N761-Y764 WeakPolarHBondContact O-CD1 3.35Å; N761-Y764 WeakPolarHBondContact O-CE1 3.24Å
762	Y	64.5	Low	56.9	Low	82 Å²	82	106.2 Å²	106.2	32%	0.322	54%	0.54	S	S	.	.			trans	-91.8	6.6	-177.9	-64.8	-79.6	0	0	0	114.3	Y764 L765 Y779	Y762-Y764 HydrophobicContact CD1-CE1 4.38Å; Y762-Y764 PolarHBondContact O-N 2.9Å; Y762-Y764 VanDerWaalsContact O-N 3.14Å; Y762-L765 HydrophobicContact CD1-CD1 4.09Å; Y762-L765 VanDerWaalsContact O-CB 3.31Å; Y762-L765 WeakPolarHBondContact O-CB 3.35Å; Y762-L765 WeakPolarHBondContact O-CG 3.46Å; Y762-L765 PolarHBondContact O-N 2.85Å; Y762-Y779 HydrophobicContact CD1-CG 4.46Å; Y762-Y779 WeakPolarHBondContact CD2-O 3.29Å; Y762-Y779 VanDerWaalsContact CG-CB 3.48Å
763	D	68.1	Low	58.7	Low	67 Å²	67	104.5 Å²	104.5	36%	0.358	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-57.6	-26.7	179.1	-86.7	-36.9	0	0	0	113.8	N761 L765 R766	N761-D763 PolarHBondContact ND2-OD2 3.42Å; N761-D763 WeakPolarHBondContact OD1-CB 3.24Å; N761-D763 PolarHBondContact OD1-N 2.93Å; N761-D763 PolarHBondContact OD1-OD2 2.81Å; D763-L765 PolarHBondContact O-N 2.87Å; D763-L765 VanDerWaalsContact O-N 3.16Å; D763-R766 VanDerWaalsContact O-CB 3.28Å; D763-R766 WeakPolarHBondContact O-CB 3.42Å; D763-R766 VanDerWaalsContact O-CG 3.29Å; D763-R766 WeakPolarHBondContact O-CG 3.02Å; D763-R766 PolarHBondContact O-N 2.8Å; D763-R766 IonicContact OD1-CZ 3.68Å; D763-R766 VanDerWaalsContact OD1-CZ 3.23Å; D763-R766 IonicContact OD1-NE 2.63Å; D763-R766 PolarHBondContact OD1-NE 3.33Å; D763-R766 IonicContact OD1-NH2 2.65Å; D763-R766 PolarHBondContact OD1-NH2 2.92Å
764	Y	73.1	Confident	60.5	Low	112 Å²	112	108.7 Å²	108.7	44%	0.439	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-60.6	-23.1	175.4	71.8	-92.6	0	0	0	113	N761 Y762 R766 E767 W768	N761-Y764 VanDerWaalsContact O-CD1 3.28Å; N761-Y764 WeakPolarHBondContact O-CD1 3.35Å; N761-Y764 WeakPolarHBondContact O-CE1 3.24Å; Y762-Y764 HydrophobicContact CD1-CE1 4.38Å; Y762-Y764 PolarHBondContact O-N 2.9Å; Y762-Y764 VanDerWaalsContact O-N 3.14Å; Y764-R766 PolarHBondContact O-N 2.75Å; Y764-E767 WeakPolarHBondContact O-CB 3.29Å; Y764-E767 PolarHBondContact O-N 2.92Å; Y764-W768 AromaticContact CD2-CZ2 3.97Å; Y764-W768 HydrophobicContact CD2-CZ2 3.97Å; Y764-W768 HydrophobicContact CE2-CH2 4.13Å; Y764-W768 AromaticContact CE2-CZ2 3.71Å; Y764-W768 HydrophobicContact CE2-CZ2 3.71Å
765	L	67.3	Low	61.9	Low	15 Å²	15	110.7 Å²	110.7	8%	0.079	55%	0.55	C	S	.	*	G	3₁₀ helix	trans	-65.7	-15.4	174.4	-62.8	177.3	0	0	0	112.7	Y762 D763 E767 W768 F772 L775 A776	Y762-L765 HydrophobicContact CD1-CD1 4.09Å; Y762-L765 VanDerWaalsContact O-CB 3.31Å; Y762-L765 WeakPolarHBondContact O-CB 3.35Å; Y762-L765 WeakPolarHBondContact O-CG 3.46Å; Y762-L765 PolarHBondContact O-N 2.85Å; D763-L765 PolarHBondContact O-N 2.87Å; D763-L765 VanDerWaalsContact O-N 3.16Å; L765-E767 VanDerWaalsContact C-N 3.33Å; L765-W768 HydrophobicContact CD2-CD2 4.28Å; L765-W768 HydrophobicContact CD2-CE3 3.95Å; L765-W768 HydrophobicContact CD2-CH2 4.3Å; L765-W768 HydrophobicContact CD2-CZ3 3.96Å; L765-F772 CarbonylContact O-C 3.54Å; L765-F772 WeakPolarHBondContact O-CB 3.35Å; L765-L775 HydrophobicContact CD1-CB 4.11Å; L765-A776 HydrophobicContact CB-CB 3.89Å
766	R	74.5	Confident	63.7	Low	129 Å²	129	106.3 Å²	106.3	49%	0.487	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-71.1	-29	170.5	-57.2	178.2	-164.2	-99.3	2.6	112.2	D763 Y764 W768 A776	D763-R766 VanDerWaalsContact O-CB 3.28Å; D763-R766 WeakPolarHBondContact O-CB 3.42Å; D763-R766 VanDerWaalsContact O-CG 3.29Å; D763-R766 WeakPolarHBondContact O-CG 3.02Å; D763-R766 PolarHBondContact O-N 2.8Å; D763-R766 IonicContact OD1-CZ 3.68Å; D763-R766 VanDerWaalsContact OD1-CZ 3.23Å; D763-R766 IonicContact OD1-NE 2.63Å; D763-R766 PolarHBondContact OD1-NE 3.33Å; D763-R766 IonicContact OD1-NH2 2.65Å; D763-R766 PolarHBondContact OD1-NH2 2.92Å; Y764-R766 PolarHBondContact O-N 2.75Å; R766-W768 VanDerWaalsContact C-N 3.34Å; R766-A776 HydrophobicContact CG-CB 3.72Å
767	E	73.5	Confident	65.2	Low	170 Å²	170	107.5 Å²	107.5	79%	0.794	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.8	-176.3	-55.8	-164	147.8	0	0	112.8	Y764 L765 G769	Y764-E767 WeakPolarHBondContact O-CB 3.29Å; Y764-E767 PolarHBondContact O-N 2.92Å; L765-E767 VanDerWaalsContact C-N 3.33Å; E767-G769 PolarHBondContact O-N 2.81Å; E767-G769 VanDerWaalsContact O-N 3.12Å
768	W	66.5	Low	66.6	Low	154 Å²	154	104.5 Å²	104.5	58%	0.583	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	0.9	-179.8	-64.2	10	0	0	0	113.2	Y764 L765 R766 F772	Y764-W768 AromaticContact CD2-CZ2 3.97Å; Y764-W768 HydrophobicContact CD2-CZ2 3.97Å; Y764-W768 HydrophobicContact CE2-CH2 4.13Å; Y764-W768 AromaticContact CE2-CZ2 3.71Å; Y764-W768 HydrophobicContact CE2-CZ2 3.71Å; L765-W768 HydrophobicContact CD2-CD2 4.28Å; L765-W768 HydrophobicContact CD2-CE3 3.95Å; L765-W768 HydrophobicContact CD2-CH2 4.3Å; L765-W768 HydrophobicContact CD2-CZ3 3.96Å; R766-W768 VanDerWaalsContact C-N 3.34Å; W768-F772 HydrophobicContact CB-CB 4.05Å; W768-F772 HydrophobicContact CB-CD1 4.32Å; W768-F772 HydrophobicContact CB-CD2 3.65Å; W768-F772 HydrophobicContact CB-CE2 4.13Å; W768-F772 HydrophobicContact CB-CG 3.76Å; W768-F772 HydrophobicContact CE3-CD1 4.02Å; W768-F772 HydrophobicContact CE3-CE1 4.02Å; W768-F772 WeakPolarHBondContact O-CD2 3.4Å; W768-F772 WeakPolarHBondContact O-CE2 3.26Å
769	G	74.1	Confident	67.6	Low	24 Å²	24	107.7 Å²	107.7	25%	0.247	50%	0.499	C	S	.	.			trans	104.4	172.1	172.1	0	0	0	0	0	114	E767 R771 F772	E767-G769 PolarHBondContact O-N 2.81Å; E767-G769 VanDerWaalsContact O-N 3.12Å; G769-R771 PolarHBondContact O-N 3.07Å; G769-F772 PolarHBondContact O-N 2.86Å
770	P	77.5	Confident	68.4	Low	120 Å²	120	101.9 Å²	101.9	78%	0.779	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-13	-163.8	23.8	-35	0	0	0	115.5
771	R	75.5	Confident	68.4	Low	220 Å²	220	96.8 Å²	96.8	83%	0.83	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-22.2	172.5	-66.2	-173.2	66.9	-161.1	-2.1	113.4	G769	G769-R771 PolarHBondContact O-N 3.07Å
772	F	69.1	Low	67.8	Low	71 Å²	71	96 Å²	96	31%	0.311	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-11.8	-173.9	-62.8	-91	0	0	0	113.5	L765 W768 G769 K774 L775 A776	L765-F772 CarbonylContact O-C 3.54Å; L765-F772 WeakPolarHBondContact O-CB 3.35Å; W768-F772 HydrophobicContact CB-CB 4.05Å; W768-F772 HydrophobicContact CB-CD1 4.32Å; W768-F772 HydrophobicContact CB-CD2 3.65Å; W768-F772 HydrophobicContact CB-CE2 4.13Å; W768-F772 HydrophobicContact CB-CG 3.76Å; W768-F772 HydrophobicContact CE3-CD1 4.02Å; W768-F772 HydrophobicContact CE3-CE1 4.02Å; W768-F772 WeakPolarHBondContact O-CD2 3.4Å; W768-F772 WeakPolarHBondContact O-CE2 3.26Å; G769-F772 PolarHBondContact O-N 2.86Å; F772-K774 PolarHBondContact O-N 2.85Å; F772-K774 VanDerWaalsContact O-N 3.12Å; F772-L775 HydrophobicContact CD1-CD1 3.78Å; F772-L775 HydrophobicContact CE1-CD1 4.42Å; F772-L775 WeakPolarHBondContact O-CA 3.15Å; F772-L775 WeakPolarHBondContact O-CB 3.33Å; F772-L775 PolarHBondContact O-N 3.29Å; F772-A776 PolarHBondContact O-N 3.14Å
773	N	74.5	Confident	66.7	Low	72 Å²	72	102 Å²	102	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-48.9	-40	170.9	-81.1	-8.6	0	0	0	112.8	L775 A776 E777	N773-L775 VanDerWaalsContact C-N 3.31Å; N773-L775 PolarHBondContact O-N 3.01Å; N773-A776 CarbonylContact O-C 3.54Å; N773-A776 WeakPolarHBondContact O-CB 3.49Å; N773-A776 PolarHBondContact O-N 3.02Å; N773-E777 WeakPolarHBondContact O-CG 3.31Å; N773-E777 PolarHBondContact O-N 2.85Å
774	K	71.1	Confident	65.4	Low	146 Å²	146	103.4 Å²	103.4	64%	0.635	53%	0.53	S	S	*	.	H	α-helix	trans	-71.9	-23.6	179.5	-159.5	172.7	-174.6	-179.6	0	113.4	F772 M778	F772-K774 PolarHBondContact O-N 2.85Å; F772-K774 VanDerWaalsContact O-N 3.12Å; K774-M778 WeakPolarHBondContact O-CE 3.46Å; K774-M778 VanDerWaalsContact O-CG 3.27Å; K774-M778 WeakPolarHBondContact O-CG 3.4Å; K774-M778 PolarHBondContact O-N 3.1Å; K774-M778 VanDerWaalsContact O-N 3.16Å
775	L	66.6	Low	63.8	Low	63 Å²	63	105 Å²	105	33%	0.33	55%	0.546	S	S	.	.	H	α-helix	trans	-76.8	-40.4	169.1	-74.4	156.5	0	0	0	110.3	L765 F772 N773 E777 M778 Y779	L765-L775 HydrophobicContact CD1-CB 4.11Å; F772-L775 HydrophobicContact CD1-CD1 3.78Å; F772-L775 HydrophobicContact CE1-CD1 4.42Å; F772-L775 WeakPolarHBondContact O-CA 3.15Å; F772-L775 WeakPolarHBondContact O-CB 3.33Å; F772-L775 PolarHBondContact O-N 3.29Å; N773-L775 VanDerWaalsContact C-N 3.31Å; N773-L775 PolarHBondContact O-N 3.01Å; L775-E777 VanDerWaalsContact C-N 3.26Å; L775-E777 PolarHBondContact O-N 3.5Å; L775-M778 HydrophobicContact CD2-CE 3.85Å; L775-M778 HydrophobicContact CG-CE 4.24Å; L775-M778 PolarHBondContact O-N 2.74Å; L775-M778 VanDerWaalsContact O-N 3.16Å; L775-Y779 HydrophobicContact CD2-CD2 4.43Å; L775-Y779 HydrophobicContact CD2-CE2 3.95Å; L775-Y779 WeakPolarHBondContact O-CD2 3.34Å; L775-Y779 PolarHBondContact O-N 3.27Å
776	A	71.7	Confident	62.6	Low	1 Å²	1	114 Å²	114	1%	0.008	59%	0.585	C	S	.	*	H	α-helix	trans	-58.5	-37.1	170.8	0	0	0	0	0	112.2	L765 R766 F772 N773 G780	L765-A776 HydrophobicContact CB-CB 3.89Å; R766-A776 HydrophobicContact CG-CB 3.72Å; F772-A776 PolarHBondContact O-N 3.14Å; N773-A776 CarbonylContact O-C 3.54Å; N773-A776 WeakPolarHBondContact O-CB 3.49Å; N773-A776 PolarHBondContact O-N 3.02Å; A776-G780 WeakPolarHBondContact O-CA 3.49Å; A776-G780 PolarHBondContact O-N 3.11Å
777	E	72.2	Confident	60.9	Low	135 Å²	135	115 Å²	115	63%	0.631	60%	0.6	S	S	*	*	H	α-helix	trans	-74.4	-28.1	174.6	-72	173.9	150.5	0	0	114.1	N773 L775	N773-E777 WeakPolarHBondContact O-CG 3.31Å; N773-E777 PolarHBondContact O-N 2.85Å; L775-E777 VanDerWaalsContact C-N 3.26Å; L775-E777 PolarHBondContact O-N 3.5Å
778	M	65.5	Low	59	Low	123 Å²	123	115.8 Å²	115.8	61%	0.606	62%	0.624	S	S	*	*	H	α-helix	trans	-81.9	-29.3	178.8	-77.3	-174.8	-59.5	0	0	113.3	K774 L775	K774-M778 WeakPolarHBondContact O-CE 3.46Å; K774-M778 VanDerWaalsContact O-CG 3.27Å; K774-M778 WeakPolarHBondContact O-CG 3.4Å; K774-M778 PolarHBondContact O-N 3.1Å; K774-M778 VanDerWaalsContact O-N 3.16Å; L775-M778 HydrophobicContact CD2-CE 3.85Å; L775-M778 HydrophobicContact CG-CE 4.24Å; L775-M778 PolarHBondContact O-N 2.74Å; L775-M778 VanDerWaalsContact O-N 3.16Å
779	Y	64	Low	58.6	Low	139 Å²	139	113.9 Å²	113.9	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-105.6	-25.5	179.2	-66.8	-76.1	0	0	0	113.4	Y762 L775 G781	Y762-Y779 HydrophobicContact CD1-CG 4.46Å; Y762-Y779 WeakPolarHBondContact CD2-O 3.29Å; Y762-Y779 VanDerWaalsContact CG-CB 3.48Å; L775-Y779 HydrophobicContact CD2-CD2 4.43Å; L775-Y779 HydrophobicContact CD2-CE2 3.95Å; L775-Y779 WeakPolarHBondContact O-CD2 3.34Å; L775-Y779 PolarHBondContact O-N 3.27Å; Y779-G781 VanDerWaalsContact C-N 3.33Å; Y779-G781 PolarHBondContact O-N 3.18Å; Y779-G781 VanDerWaalsContact O-N 3.09Å
780	G	61.1	Low	57.8	Low	30 Å²	30	118.6 Å²	118.6	31%	0.309	65%	0.646	S	S	.	*	S	Bend	trans	-81.1	74.1	169	0	0	0	0	0	111.6	A776 G782	A776-G780 WeakPolarHBondContact O-CA 3.49Å; A776-G780 PolarHBondContact O-N 3.11Å; G780-G782 PolarHBondContact O-N 3.19Å; G780-G782 VanDerWaalsContact O-N 3.11Å
781	G	49	Very low	56.7	Low	71 Å²	71	118.6 Å²	118.6	73%	0.732	64%	0.638	S	S	*	*			trans	-62	108.1	-177.8	0	0	0	0	0	113	Y779 E783	Y779-G781 VanDerWaalsContact C-N 3.33Å; Y779-G781 PolarHBondContact O-N 3.18Å; Y779-G781 VanDerWaalsContact O-N 3.09Å; G781-E783 PolarHBondContact O-N 2.92Å
782	G	44.9	Very low	55.6	Low	73 Å²	73	112.6 Å²	112.6	75%	0.753	63%	0.627	S	S	*	*			trans	-78	111.2	178.6	0	0	0	0	0	113	G780 S784	G780-G782 PolarHBondContact O-N 3.19Å; G780-G782 VanDerWaalsContact O-N 3.11Å; G782-S784 PolarHBondContact O-N 2.81Å; G782-S784 VanDerWaalsContact O-N 3.14Å
783	E	41.3	Very low	54.7	Low	206 Å²	206	115.2 Å²	115.2	96%	0.963	65%	0.647	S	S	*	*			trans	-72.5	98.2	161.5	-74.5	-162	132.6	0	0	110.2	G781	G781-E783 PolarHBondContact O-N 2.92Å
784	S	40.5	Very low	53.4	Low	98 Å²	98	118.1 Å²	118.1	69%	0.685	66%	0.664	S	S	*	*			trans	-105.4	141.1	159.8	56.7	0	0	0	0	110.2	G782	G782-S784 PolarHBondContact O-N 2.81Å; G782-S784 VanDerWaalsContact O-N 3.14Å
785	D	40.2	Very low	52.2	Low	145 Å²	145	116.1 Å²	116.1	78%	0.775	67%	0.667	S	S	*	*			trans	84.6	73.3	171.2	-55	-9.2	0	0	0	118.6
786	K	42.4	Very low	51.1	Low	205 Å²	205	120.2 Å²	120.2	89%	0.891	69%	0.692	S	S	*	*				-175.2	107.2	109.8	-99	153.1	-169.6	154.3	0	115
787	D	37.6	Very low	49.3	Very low	150 Å²	150	130.1 Å²	130.1	80%	0.802	75%	0.749	S	S	*	*			trans	-114.1	149.2	144.6	-144	-26.7	0	0	0	107.6
788	S	33.5	Very low	47.3	Very low	186 Å²	186	129.6 Å²	129.6	100%	1.301	76%	0.76	S	S	*	*			trans	43	0	166.2	-58.7	0	0	0	0	119.6

Retrieved 788 of 788 residues in 1536.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).