A0A087X1D5_HUMAN Loading...

Atrial natriuretic peptide-converting enzyme

AlphaFold DB , UniProt , Accession A0A087X1D5, Species HUMAN (Homo sapiens, Human), Gene CORIN, Length 938 aa.

						>A0A087X1D5_HUMAN|A0A087X1D5|CORIN
MKQSPALAPEERCRRAGSPKPVLRADDNNMGNGCSQKLATANLLRFLLLVLIPCICALVLLLVILLSYVGACMNITHSQCQMLPYHATLTPLLSVVRNMEMEKFLKFFTYLHRLSCYQHIMLFGCTLAFPECIIDGDDSHGLLPCRSFCEAAKEGCESVLGMVNYSWPDFLRCSQFRNQTESSNVSRICFSPQQENGKQLLCGRGENFLCASGICIPGKLQCNGYNDCDDWSDEAHCNCSENLFHCHTGKCLNYSLVCDGYDDCGDLSDEQNCACHSQGLVECRNGQCIPSTFQCDGDEDCKDGSDEENCSVIQTSCQEGDQRCLYNPCLDSCGGSSLCDPNNSLNNCSQCEPITLELCMNLPYNSTSYPNYFGHRTQKEASISWESSLFPALVQTNCYKYLMFFSCTILVPKCDVNTGEHIPPCRALCEHSKERCESVLGIVGLQWPEDTDCSQFPEENSDNQTCLMPDEYVEECSPSHFKCRSGQCVLASRRCDGQADCDDDSDEENCGCKERDLWECPSNKQCLKHTVICDGFPDCPDYMDEKNCSFCQDDELECANHACVSRDLWCDGEADCSDSSDEWDCVTLSINVNSSSFLMVHRAATEHHVCADGWQEILSQLACKQMGLGEPSVTKLIQEQEKEPRWLTLHSNWESLNGTTLHELLVNGQSCESRSKISLLCTKQDCGRRPAARMNKRILGGRTSRPGRWPWQCSLQSEPSGHICGCVLIAKKWVLTVAHCFEGRENAAVWKVVLGINNLDHPSVFMQTRFVKTIILHPRYSRAVVDYDISIVELSEDISETGYVRPVCLPNPEQWLEPDTYCYITGWGHMGNKMPFKLQEGEVRIISLEHCQSYFDMKTITTRMICAGYESGTVDSCMGDSGGPLVCEKPGGRWTLFGLTSWGSVCFSKVLGPGVYSNVSYFVEWIKRQIYIQTFLLN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	31.5	Very low	245 Å²	245	144.5 Å²	144.5	100%	1.207	80%	0.799	S	S	*	*				0	127.2	0	-86.9	169.5	160.5	0	0	107.8
2	K	29.7	Very low	31.1	Very low	190 Å²	190	150.3 Å²	150.3	83%	0.826	80%	0.8	S	S	*	*			trans	17.5	144.2	151.7	-75.8	-173.8	175.2	-178.1	0	119.4
3	Q	26.9	Very low	30.6	Very low	166 Å²	166	146.8 Å²	146.8	78%	0.776	79%	0.793	S	S	*	*			cis	179.6	141.5	-7.8	-139.7	164.6	-16.4	0	0	104.7
4	S	29.3	Very low	30.3	Very low	109 Å²	109	150.4 Å²	150.4	76%	0.762	79%	0.79	S	S	*	*			trans	-69.6	-168.5	162.3	-27.4	0	0	0	0	110.3
5	P	51.9	Low	30.1	Very low	122 Å²	122	154.7 Å²	154.7	79%	0.792	79%	0.791	S	S	*	*			cis	-141.9	-165.7	20.5	37.7	-11.9	0	0	0	112.7
6	A	29.2	Very low	29.8	Very low	75 Å²	75	151.8 Å²	151.8	62%	0.62	80%	0.797	S	S	*	*			cis	-162.8	139.3	20.7	0	0	0	0	0	110
7	L	29.3	Very low	29.5	Very low	165 Å²	165	147.1 Å²	147.1	86%	0.864	79%	0.794	S	S	*	*				62.3	135.3	114	-83	97.9	0	0	0	117.2
8	A	26.7	Very low	29.4	Very low	85 Å²	85	145.7 Å²	145.7	70%	0.702	80%	0.798	S	S	*	*			cis	-166.6	-171.2	44.2	0	0	0	0	0	111.1
9	P	39	Very low	30.1	Very low	124 Å²	124	143.9 Å²	143.9	81%	0.805	79%	0.794	S	S	*	*				-133.5	178.6	-61.9	37.2	-19.5	0	0	0	115.1
10	E	27.6	Very low	30.1	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	80%	0.797	S	S	*	*			trans	-61.4	171.5	177.9	-56.6	-177.5	128.3	0	0	115
11	E	27.3	Very low	30.8	Very low	134 Å²	134	144.8 Å²	144.8	63%	0.626	79%	0.792	S	S	*	*				-174.8	147.1	56	-141.3	-172.8	159.8	0	0	114.2
12	R	25.7	Very low	30.8	Very low	215 Å²	215	139.2 Å²	139.2	81%	0.811	77%	0.772	S	S	*	*			trans	82.2	145.6	137.9	-124.7	172.7	-120.6	-157.3	2.7	121.4
13	C	24.7	Very low	30.7	Very low	105 Å²	105	137.2 Å²	137.2	71%	0.709	77%	0.769	S	S	*	*			cis	176.3	129.8	-38.3	-156.3	0	0	0	0	107.5
14	R	26.6	Very low	30.6	Very low	197 Å²	197	140.2 Å²	140.2	74%	0.743	77%	0.774	S	S	*	*				148.3	121.8	121.9	-83.6	-170.7	178.6	172.5	2.4	117.5
15	R	27.2	Very low	30.4	Very low	215 Å²	215	138.9 Å²	138.9	81%	0.811	77%	0.769	S	S	*	*			trans	66.1	133.7	133.4	-63.7	179.7	-179	-176	-1.5	118.1
16	A	25.1	Very low	29.2	Very low	107 Å²	107	140 Å²	140	88%	0.884	77%	0.768	S	S	*	*			cis	-135.7	141.5	39.8	0	0	0	0	0	114.3
17	G	25.9	Very low	29.3	Very low	72 Å²	72	142.9 Å²	142.9	74%	0.742	77%	0.774	S	S	*	*			trans	-136.2	159.9	156.4	0	0	0	0	0	108.2
18	S	27.9	Very low	29.3	Very low	123 Å²	123	142.3 Å²	142.3	86%	0.86	77%	0.771	S	S	*	*				-166.3	153.6	129	44.8	0	0	0	0	113
19	P	42.3	Very low	29.5	Very low	112 Å²	112	144.4 Å²	144.4	73%	0.727	77%	0.771	S	S	*	*			trans	-125.4	163.9	-172.2	36	-16.7	0	0	0	115.9
20	K	28.8	Very low	29	Very low	199 Å²	199	146.8 Å²	146.8	87%	0.865	77%	0.773	S	S	*	*			trans	62.8	171.2	152	-77.4	-177.8	-177.1	-179.4	0	118.5
21	P	44.7	Very low	29.1	Very low	106 Å²	106	141.8 Å²	141.8	69%	0.688	77%	0.768	S	S	*	*			cis	-142.4	171	-30.6	34.6	-13.5	0	0	0	116.8
22	V	30.1	Very low	29.2	Very low	129 Å²	129	143.5 Å²	143.5	78%	0.782	78%	0.782	S	S	*	*			trans	71.1	136.4	135.2	172.3	0	0	0	0	124.5
23	L	27.8	Very low	29.5	Very low	147 Å²	147	137 Å²	137	77%	0.77	78%	0.783	S	S	*	*			trans	94.3	120.4	152.8	-85.7	160.4	0	0	0	122.7
24	R	24.8	Very low	29.9	Very low	229 Å²	229	138.3 Å²	138.3	86%	0.864	79%	0.791	S	S	*	*			trans	81.5	126	140	-95.2	179.7	-174.7	177.1	1.6	122.8
25	A	26.5	Very low	30.9	Very low	82 Å²	82	134.2 Å²	134.2	68%	0.678	79%	0.792	S	S	*	*			trans	78.2	118.7	132.3	0	0	0	0	0	120.9
26	D	26.9	Very low	31.6	Very low	144 Å²	144	132.8 Å²	132.8	77%	0.77	80%	0.795	S	S	*	*			trans	57.7	129.2	137.8	-62.2	-18.3	0	0	0	123
27	D	30.1	Very low	32.4	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	79%	0.791	S	S	*	*			trans	53.8	113.3	144	-67.5	-24.8	0	0	0	119.4
28	N	30.6	Very low	33.1	Very low	153 Å²	153	140.3 Å²	140.3	82%	0.818	79%	0.794	S	S	*	*				179.9	111.8	108.4	-90.1	-50.3	0	0	0	113.3
29	N	29.1	Very low	34	Very low	130 Å²	130	138.6 Å²	138.6	70%	0.695	79%	0.787	S	S	*	*				59.9	131.8	120.1	-134.1	4.3	0	0	0	122.9
30	M	29.2	Very low	34.4	Very low	173 Å²	173	137.9 Å²	137.9	85%	0.852	78%	0.781	S	S	*	*			trans	71.5	120.3	154.9	-76.5	148.5	156	0	0	118.3
31	G	28.8	Very low	35.4	Very low	69 Å²	69	131 Å²	131	71%	0.711	76%	0.761	S	S	*	*			cis	177.6	174.7	6.2	0	0	0	0	0	113.9
32	N	31.1	Very low	35.8	Very low	170 Å²	170	131.6 Å²	131.6	91%	0.909	76%	0.758	S	S	*	*			trans	83.4	92.3	163.6	-65.5	-5.9	0	0	0	119.8
33	G	30.5	Very low	36.9	Very low	80 Å²	80	131.2 Å²	131.2	83%	0.825	75%	0.752	S	S	*	*				65	138.9	125	0	0	0	0	0	118.7
34	C	34.2	Very low	38.3	Very low	132 Å²	132	129.5 Å²	129.5	89%	0.892	74%	0.742	S	S	*	*			cis	-166.6	141.2	7.1	-153.1	0	0	0	0	108.2
35	S	47.1	Very low	39.9	Very low	110 Å²	110	127 Å²	127	77%	0.769	73%	0.733	S	S	*	*			trans	-56.9	130.2	170.3	-67.3	0	0	0	0	112.9
36	Q	42.1	Very low	41.5	Very low	186 Å²	186	130.3 Å²	130.3	87%	0.869	73%	0.732	S	S	*	*			trans	-173.4	-1.9	143.7	-113	165.8	-5.9	0	0	117.7
37	K	41.7	Very low	42.9	Very low	185 Å²	185	127.4 Å²	127.4	80%	0.804	72%	0.716	S	S	*	*	S	Bend	trans	-106.8	0.1	-172.7	-75.6	-169.9	176.6	-177.9	0	117.6	T40	K37-T40 PolarHBondContact O-OG1 2.95Å
38	L	41.6	Very low	44.3	Very low	151 Å²	151	125.2 Å²	125.2	79%	0.791	70%	0.704	S	S	*	*	H	α-helix	trans	-93.6	-13.7	-171.9	-142.4	74	0	0	0	115.2
39	A	45.5	Very low	45.8	Very low	87 Å²	87	124 Å²	124	72%	0.719	70%	0.697	S	S	*	*	H	α-helix	trans	-86.9	-21.7	179.2	0	0	0	0	0	113.8
40	T	50.2	Low	47.4	Very low	97 Å²	97	121.1 Å²	121.1	60%	0.595	68%	0.684	S	S	*	*	H	α-helix	trans	-82.8	-29.7	-179.6	49.1	0	0	0	0	112.9	K37 L44	K37-T40 PolarHBondContact O-OG1 2.95Å; T40-L44 WeakPolarHBondContact O-CB 3.27Å; T40-L44 PolarHBondContact O-N 2.53Å; T40-L44 VanDerWaalsContact O-N 3.16Å
41	A	51.7	Low	48.9	Very low	55 Å²	55	117 Å²	117	46%	0.455	67%	0.665	S	S	.	*	H	α-helix	trans	-70.5	-37.4	-177.9	0	0	0	0	0	113.3	R45	A41-R45 WeakPolarHBondContact O-CB 3.47Å; A41-R45 PolarHBondContact O-N 3.27Å
42	N	51.5	Low	50.7	Low	118 Å²	118	117.8 Å²	117.8	63%	0.631	65%	0.652	S	S	*	*	H	α-helix	trans	-75.8	-31.9	-180	-80.2	-12.6	0	0	0	112.9	F46	N42-F46 WeakPolarHBondContact O-CB 3.15Å; N42-F46 PolarHBondContact O-N 3.07Å; N42-F46 VanDerWaalsContact O-N 3.13Å
43	L	54.9	Low	52.3	Low	122 Å²	122	113.2 Å²	113.2	64%	0.639	63%	0.631	S	S	*	*	H	α-helix	trans	-70.4	-39.5	174.1	-152.5	81.2	0	0	0	111.1	F46 L47	L43-F46 PolarHBondContact O-N 3.07Å; L43-L47 HydrophobicContact CG-CD1 4.38Å; L43-L47 WeakPolarHBondContact O-CB 3.31Å; L43-L47 WeakPolarHBondContact O-CD1 3.43Å; L43-L47 WeakPolarHBondContact O-CG 3.4Å; L43-L47 PolarHBondContact O-N 3.31Å
44	L	55.2	Low	53.8	Low	110 Å²	110	112.6 Å²	112.6	58%	0.576	61%	0.614	S	S	*	*	H	α-helix	trans	-66.7	-39.4	176.8	-138.8	89	0	0	0	112	T40 L47 L48	T40-L44 WeakPolarHBondContact O-CB 3.27Å; T40-L44 PolarHBondContact O-N 2.53Å; T40-L44 VanDerWaalsContact O-N 3.16Å; L44-L47 PolarHBondContact O-N 3.06Å; L44-L48 HydrophobicContact CD2-CD1 4.43Å; L44-L48 WeakPolarHBondContact O-CB 3.36Å; L44-L48 WeakPolarHBondContact O-CD1 3.1Å; L44-L48 VanDerWaalsContact O-CG 3.26Å; L44-L48 WeakPolarHBondContact O-CG 3.48Å; L44-L48 PolarHBondContact O-N 3.2Å
45	R	58.7	Low	55.5	Low	178 Å²	178	110.7 Å²	110.7	67%	0.672	59%	0.594	S	S	*	*	H	α-helix	trans	-66.5	-37.7	176.1	-116.3	-179.4	176.9	-161.3	-1.8	112.6	A41 L49	A41-R45 WeakPolarHBondContact O-CB 3.47Å; A41-R45 PolarHBondContact O-N 3.27Å; R45-L49 WeakPolarHBondContact O-CB 2.95Å; R45-L49 WeakPolarHBondContact O-CG 3.25Å; R45-L49 PolarHBondContact O-N 2.96Å
46	F	60.3	Low	56.3	Low	151 Å²	151	108.7 Å²	108.7	66%	0.662	58%	0.579	S	S	*	*	H	α-helix	trans	-72.1	-39.3	177.1	-155.1	-89.4	0	0	0	111.7	N42 L43 L49 V50	N42-F46 WeakPolarHBondContact O-CB 3.15Å; N42-F46 PolarHBondContact O-N 3.07Å; N42-F46 VanDerWaalsContact O-N 3.13Å; L43-F46 PolarHBondContact O-N 3.07Å; F46-L49 PolarHBondContact O-N 2.99Å; F46-V50 HydrophobicContact CD1-CG2 4.21Å; F46-V50 HydrophobicContact CE1-CG2 4Å; F46-V50 HydrophobicContact CZ-CG2 4.38Å; F46-V50 PolarHBondContact O-N 2.78Å
47	L	56.6	Low	57.7	Low	83 Å²	83	102.5 Å²	102.5	44%	0.435	56%	0.56	S	S	.	*	H	α-helix	trans	-61.4	-44.6	171.4	-78.3	160.9	0	0	0	111.1	L43 L44 L51	L43-L47 HydrophobicContact CG-CD1 4.38Å; L43-L47 WeakPolarHBondContact O-CB 3.31Å; L43-L47 WeakPolarHBondContact O-CD1 3.43Å; L43-L47 WeakPolarHBondContact O-CG 3.4Å; L43-L47 PolarHBondContact O-N 3.31Å; L44-L47 PolarHBondContact O-N 3.06Å; L47-L51 HydrophobicContact CB-CD1 4.15Å; L47-L51 HydrophobicContact CD2-CD1 3.31Å; L47-L51 HydrophobicContact CD2-CG 4.25Å; L47-L51 HydrophobicContact CG-CD1 4.34Å; L47-L51 WeakPolarHBondContact O-CA 3.38Å; L47-L51 WeakPolarHBondContact O-CB 3.25Å; L47-L51 WeakPolarHBondContact O-CG 3.32Å; L47-L51 PolarHBondContact O-N 2.79Å
48	L	60.6	Low	58.8	Low	89 Å²	89	99.1 Å²	99.1	47%	0.466	55%	0.55	S	S	.	.	H	α-helix	trans	-66.5	-41.2	177.8	-75.1	162.9	0	0	0	112.9	L44 V50 I52	L44-L48 HydrophobicContact CD2-CD1 4.43Å; L44-L48 WeakPolarHBondContact O-CB 3.36Å; L44-L48 WeakPolarHBondContact O-CD1 3.1Å; L44-L48 VanDerWaalsContact O-CG 3.26Å; L44-L48 WeakPolarHBondContact O-CG 3.48Å; L44-L48 PolarHBondContact O-N 3.2Å; L48-V50 PolarHBondContact O-N 2.81Å; L48-I52 HydrophobicContact CB-CD1 4.17Å; L48-I52 HydrophobicContact CD2-CD1 3.48Å; L48-I52 VanDerWaalsContact CD2-CD1 3.48Å; L48-I52 HydrophobicContact CD2-CG1 4.29Å; L48-I52 HydrophobicContact CG-CD1 4.45Å; L48-I52 WeakPolarHBondContact O-CB 3.28Å; L48-I52 WeakPolarHBondContact O-CD1 3.27Å; L48-I52 WeakPolarHBondContact O-CG1 3.12Å; L48-I52 PolarHBondContact O-N 2.79Å
49	L	62	Low	60.1	Low	127 Å²	127	95.9 Å²	95.9	67%	0.665	54%	0.536	S	S	*	.	H	α-helix	trans	-75.7	-21.6	-176.6	-78.3	165.1	0	0	0	114.3	R45 F46 P53	R45-L49 WeakPolarHBondContact O-CB 2.95Å; R45-L49 WeakPolarHBondContact O-CG 3.25Å; R45-L49 PolarHBondContact O-N 2.96Å; F46-L49 PolarHBondContact O-N 2.99Å; L49-P53 VanDerWaalsContact O-CD 3.25Å; L49-P53 WeakPolarHBondContact O-CD 3.03Å; L49-P53 WeakPolarHBondContact O-CG 3.11Å
50	V	62.5	Low	61	Low	71 Å²	71	96.9 Å²	96.9	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-108.3	-40.2	-178.8	-177.4	0	0	0	0	112	F46 L48 C54	F46-V50 HydrophobicContact CD1-CG2 4.21Å; F46-V50 HydrophobicContact CE1-CG2 4Å; F46-V50 HydrophobicContact CZ-CG2 4.38Å; F46-V50 PolarHBondContact O-N 2.78Å; L48-V50 PolarHBondContact O-N 2.81Å; V50-C54 WeakPolarHBondContact O-CB 3.21Å; V50-C54 PolarHBondContact O-N 3.01Å
51	L	60.1	Low	61.5	Low	85 Å²	85	97 Å²	97	45%	0.445	53%	0.525	S	S	.	.	H	α-helix	trans	-74.3	-36.2	179.1	-68.6	168.4	0	0	0	112.3	L47 C54 I55	L47-L51 HydrophobicContact CB-CD1 4.15Å; L47-L51 HydrophobicContact CD2-CD1 3.31Å; L47-L51 HydrophobicContact CD2-CG 4.25Å; L47-L51 HydrophobicContact CG-CD1 4.34Å; L47-L51 WeakPolarHBondContact O-CA 3.38Å; L47-L51 WeakPolarHBondContact O-CB 3.25Å; L47-L51 WeakPolarHBondContact O-CG 3.32Å; L47-L51 PolarHBondContact O-N 2.79Å; L51-C54 PolarHBondContact O-N 3.1Å; L51-I55 HydrophobicContact CB-CD1 4.04Å; L51-I55 WeakPolarHBondContact O-CB 3.46Å; L51-I55 WeakPolarHBondContact O-CD1 2.99Å; L51-I55 WeakPolarHBondContact O-CG1 3.36Å; L51-I55 PolarHBondContact O-N 3.03Å
52	I	66	Low	61.6	Low	86 Å²	86	99 Å²	99	44%	0.441	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-50.1	178.6	-64.3	175.3	0	0	0	111.5	L48 C54 I55 C56	L48-I52 HydrophobicContact CB-CD1 4.17Å; L48-I52 HydrophobicContact CD2-CD1 3.48Å; L48-I52 VanDerWaalsContact CD2-CD1 3.48Å; L48-I52 HydrophobicContact CD2-CG1 4.29Å; L48-I52 HydrophobicContact CG-CD1 4.45Å; L48-I52 WeakPolarHBondContact O-CB 3.28Å; L48-I52 WeakPolarHBondContact O-CD1 3.27Å; L48-I52 WeakPolarHBondContact O-CG1 3.12Å; L48-I52 PolarHBondContact O-N 2.79Å; I52-C54 VanDerWaalsContact C-N 3.34Å; I52-C54 PolarHBondContact O-N 2.79Å; I52-I55 PolarHBondContact O-N 2.04Å; I52-C56 VanDerWaalsContact O-CB 3.26Å; I52-C56 WeakPolarHBondContact O-CB 3.34Å; I52-C56 PolarHBondContact O-N 3.17Å; I52-C56 PolarHBondContact O-SG 3.43Å
53	P	65.4	Low	62	Low	74 Å²	74	97.3 Å²	97.3	48%	0.481	52%	0.522	S	S	.	.	H	α-helix	trans	-67.9	-31.5	176.6	22	-29.2	0	0	0	112.9	L49 A57	L49-P53 VanDerWaalsContact O-CD 3.25Å; L49-P53 WeakPolarHBondContact O-CD 3.03Å; L49-P53 WeakPolarHBondContact O-CG 3.11Å; P53-A57 WeakPolarHBondContact O-CB 3.5Å; P53-A57 PolarHBondContact O-N 3.42Å
54	C	62.7	Low	62	Low	68 Å²	68	95.6 Å²	95.6	46%	0.459	51%	0.512	S	S	.	.	H	α-helix	trans	-69.1	-38.6	172.7	-86.3	0	0	0	0	113	V50 L51 I52 A57 L58	V50-C54 WeakPolarHBondContact O-CB 3.21Å; V50-C54 PolarHBondContact O-N 3.01Å; L51-C54 PolarHBondContact O-N 3.1Å; I52-C54 VanDerWaalsContact C-N 3.34Å; I52-C54 PolarHBondContact O-N 2.79Å; C54-A57 PolarHBondContact O-N 3.38Å; C54-L58 VanDerWaalsContact O-CB 3.27Å; C54-L58 WeakPolarHBondContact O-CB 3.44Å; C54-L58 PolarHBondContact O-N 2.88Å
55	I	70.2	Confident	61.7	Low	92 Å²	92	95.7 Å²	95.7	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-71.6	-41.9	176.1	-68.8	164.2	0	0	0	109.3	L51 I52 A57 L58 V59	L51-I55 HydrophobicContact CB-CD1 4.04Å; L51-I55 WeakPolarHBondContact O-CB 3.46Å; L51-I55 WeakPolarHBondContact O-CD1 2.99Å; L51-I55 WeakPolarHBondContact O-CG1 3.36Å; L51-I55 PolarHBondContact O-N 3.03Å; I52-I55 PolarHBondContact O-N 2.04Å; I55-A57 VanDerWaalsContact C-N 3.33Å; I55-A57 PolarHBondContact O-N 3.27Å; I55-L58 PolarHBondContact O-N 3.5Å; I55-V59 HydrophobicContact CG2-CG2 4.15Å; I55-V59 VanDerWaalsContact O-CB 3.25Å; I55-V59 WeakPolarHBondContact O-CB 3.41Å; I55-V59 WeakPolarHBondContact O-CG2 3.4Å; I55-V59 PolarHBondContact O-N 3.34Å
56	C	63.8	Low	61.1	Low	68 Å²	68	92.6 Å²	92.6	46%	0.459	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-39.2	173.1	-72.4	0	0	0	0	111.3	I52 L60	I52-C56 VanDerWaalsContact O-CB 3.26Å; I52-C56 WeakPolarHBondContact O-CB 3.34Å; I52-C56 PolarHBondContact O-N 3.17Å; I52-C56 PolarHBondContact O-SG 3.43Å; C56-L60 VanDerWaalsContact O-CB 3.29Å; C56-L60 WeakPolarHBondContact O-CB 3.32Å; C56-L60 PolarHBondContact O-N 2.99Å
57	A	69.6	Low	60.5	Low	55 Å²	55	89.4 Å²	89.4	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-68.6	-41.1	174.7	0	0	0	0	0	111.6	P53 C54 I55 L60 L61	P53-A57 WeakPolarHBondContact O-CB 3.5Å; P53-A57 PolarHBondContact O-N 3.42Å; C54-A57 PolarHBondContact O-N 3.38Å; I55-A57 VanDerWaalsContact C-N 3.33Å; I55-A57 PolarHBondContact O-N 3.27Å; A57-L60 PolarHBondContact O-N 3.31Å; A57-L61 VanDerWaalsContact O-CB 3.28Å; A57-L61 WeakPolarHBondContact O-CB 3.41Å; A57-L61 PolarHBondContact O-N 3.38Å
58	L	66.3	Low	60	Low	115 Å²	115	94.9 Å²	94.9	60%	0.602	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-40.9	173.8	-98.9	156.7	0	0	0	111.8	C54 I55 L61 L62	C54-L58 VanDerWaalsContact O-CB 3.27Å; C54-L58 WeakPolarHBondContact O-CB 3.44Å; C54-L58 PolarHBondContact O-N 2.88Å; I55-L58 PolarHBondContact O-N 3.5Å; L58-L61 CarbonylContact O-C 3.57Å; L58-L61 PolarHBondContact O-N 3.03Å; L58-L62 WeakPolarHBondContact O-CA 3.37Å; L58-L62 WeakPolarHBondContact O-CB 3.27Å; L58-L62 PolarHBondContact O-N 3.25Å
59	V	67.6	Low	59.4	Low	82 Å²	82	95.5 Å²	95.5	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-67.4	-38.9	174.2	170.6	0	0	0	0	109.9	I55 L62 V63	I55-V59 HydrophobicContact CG2-CG2 4.15Å; I55-V59 VanDerWaalsContact O-CB 3.25Å; I55-V59 WeakPolarHBondContact O-CB 3.41Å; I55-V59 WeakPolarHBondContact O-CG2 3.4Å; I55-V59 PolarHBondContact O-N 3.34Å; V59-L62 PolarHBondContact O-N 3.04Å; V59-V63 HydrophobicContact CG1-CG2 4.19Å; V59-V63 WeakPolarHBondContact O-CB 3.15Å; V59-V63 WeakPolarHBondContact O-CG2 3.02Å; V59-V63 PolarHBondContact O-N 3.29Å
60	L	64.2	Low	59	Low	109 Å²	109	90.8 Å²	90.8	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-64.4	-43.4	171.1	-111.7	116.7	0	0	0	111.3	C56 A57 L62 V63 I64	C56-L60 VanDerWaalsContact O-CB 3.29Å; C56-L60 WeakPolarHBondContact O-CB 3.32Å; C56-L60 PolarHBondContact O-N 2.99Å; A57-L60 PolarHBondContact O-N 3.31Å; L60-L62 VanDerWaalsContact C-N 3.3Å; L60-L62 PolarHBondContact O-N 3.37Å; L60-V63 CarbonylContact O-C 3.6Å; L60-V63 PolarHBondContact O-N 3.43Å; L60-I64 HydrophobicContact CD2-CD1 4.08Å; L60-I64 WeakPolarHBondContact O-CB 3.06Å; L60-I64 WeakPolarHBondContact O-CD1 2.81Å; L60-I64 WeakPolarHBondContact O-CG1 3.46Å; L60-I64 PolarHBondContact O-N 2.01Å
61	L	60.6	Low	58.8	Low	99 Å²	99	90.7 Å²	90.7	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-67.5	-34.6	178.5	-131.3	151	0	0	0	110.9	A57 L58 I64 L65	A57-L61 VanDerWaalsContact O-CB 3.28Å; A57-L61 WeakPolarHBondContact O-CB 3.41Å; A57-L61 PolarHBondContact O-N 3.38Å; L58-L61 CarbonylContact O-C 3.57Å; L58-L61 PolarHBondContact O-N 3.03Å; L61-I64 PolarHBondContact O-N 3.34Å; L61-L65 HydrophobicContact CD2-CD1 3.59Å; L61-L65 HydrophobicContact CD2-CG 4.2Å; L61-L65 WeakPolarHBondContact O-CB 2.91Å; L61-L65 WeakPolarHBondContact O-CD1 3.39Å; L61-L65 WeakPolarHBondContact O-CG 3.4Å; L61-L65 PolarHBondContact O-N 3.29Å
62	L	55.2	Low	58.9	Low	97 Å²	97	88.9 Å²	88.9	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-78.2	-32.3	177.5	-153.8	150.8	0	0	0	110.8	L58 V59 L60 L66	L58-L62 WeakPolarHBondContact O-CA 3.37Å; L58-L62 WeakPolarHBondContact O-CB 3.27Å; L58-L62 PolarHBondContact O-N 3.25Å; V59-L62 PolarHBondContact O-N 3.04Å; L60-L62 VanDerWaalsContact C-N 3.3Å; L60-L62 PolarHBondContact O-N 3.37Å; L62-L66 HydrophobicContact CD2-CD1 3.47Å; L62-L66 VanDerWaalsContact CD2-CD1 3.47Å; L62-L66 HydrophobicContact CD2-CG 4Å; L62-L66 WeakPolarHBondContact O-CA 3.44Å; L62-L66 WeakPolarHBondContact O-CB 3.35Å; L62-L66 WeakPolarHBondContact O-CG 3.46Å; L62-L66 PolarHBondContact O-N 3.4Å
63	V	59.3	Low	58.9	Low	83 Å²	83	90.3 Å²	90.3	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-71.7	-35.7	168	168.5	0	0	0	0	111	V59 L60 S67	V59-V63 HydrophobicContact CG1-CG2 4.19Å; V59-V63 WeakPolarHBondContact O-CB 3.15Å; V59-V63 WeakPolarHBondContact O-CG2 3.02Å; V59-V63 PolarHBondContact O-N 3.29Å; L60-V63 CarbonylContact O-C 3.6Å; L60-V63 PolarHBondContact O-N 3.43Å; V63-S67 WeakPolarHBondContact O-CB 2.89Å; V63-S67 PolarHBondContact O-N 2.82Å; V63-S67 PolarHBondContact O-OG 2.92Å
64	I	55.3	Low	58.8	Low	85 Å²	85	92.7 Å²	92.7	44%	0.436	53%	0.526	S	S	.	.	H	α-helix	trans	-70	-40.8	173.5	-70.7	163.1	0	0	0	110.1	L60 L61 S67 Y68	L60-I64 HydrophobicContact CD2-CD1 4.08Å; L60-I64 WeakPolarHBondContact O-CB 3.06Å; L60-I64 WeakPolarHBondContact O-CD1 2.81Å; L60-I64 WeakPolarHBondContact O-CG1 3.46Å; L60-I64 PolarHBondContact O-N 2.01Å; L61-I64 PolarHBondContact O-N 3.34Å; I64-S67 VanDerWaalsContact CA-OG 3.25Å; I64-S67 WeakPolarHBondContact CA-OG 3.04Å; I64-S67 PolarHBondContact O-N 2.87Å; I64-S67 PolarHBondContact O-OG 3.27Å; I64-Y68 PolarHBondContact O-N 3.1Å
65	L	48	Very low	58.9	Low	113 Å²	113	90.8 Å²	90.8	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-69.9	-37.5	173.9	-80.4	159.2	0	0	0	111.9	L61 Y68	L61-L65 HydrophobicContact CD2-CD1 3.59Å; L61-L65 HydrophobicContact CD2-CG 4.2Å; L61-L65 WeakPolarHBondContact O-CB 2.91Å; L61-L65 WeakPolarHBondContact O-CD1 3.39Å; L61-L65 WeakPolarHBondContact O-CG 3.4Å; L61-L65 PolarHBondContact O-N 3.29Å; L65-Y68 PolarHBondContact O-N 3.03Å
66	L	46.8	Very low	58.4	Low	112 Å²	112	92.9 Å²	92.9	59%	0.586	53%	0.528	S	S	*	.	H	α-helix	trans	-75.7	-22.7	174.6	-74.9	172.8	0	0	0	113	L62 Y68	L62-L66 HydrophobicContact CD2-CD1 3.47Å; L62-L66 VanDerWaalsContact CD2-CD1 3.47Å; L62-L66 HydrophobicContact CD2-CG 4Å; L62-L66 WeakPolarHBondContact O-CA 3.44Å; L62-L66 WeakPolarHBondContact O-CB 3.35Å; L62-L66 WeakPolarHBondContact O-CG 3.46Å; L62-L66 PolarHBondContact O-N 3.4Å; L66-Y68 VanDerWaalsContact C-N 3.33Å
67	S	48.5	Very low	58.5	Low	85 Å²	85	92.3 Å²	92.3	59%	0.594	52%	0.519	S	S	*	.	H	α-helix	trans	-84	-9	172.5	52.6	0	0	0	0	113.3	V63 I64 V69	V63-S67 WeakPolarHBondContact O-CB 2.89Å; V63-S67 PolarHBondContact O-N 2.82Å; V63-S67 PolarHBondContact O-OG 2.92Å; I64-S67 VanDerWaalsContact CA-OG 3.25Å; I64-S67 WeakPolarHBondContact CA-OG 3.04Å; I64-S67 PolarHBondContact O-N 2.87Å; I64-S67 PolarHBondContact O-OG 3.27Å; S67-V69 VanDerWaalsContact C-N 3.34Å
68	Y	44.9	Very low	58.2	Low	198 Å²	198	93.9 Å²	93.9	78%	0.776	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-5	168.7	-105.8	-90.4	0	0	0	113.5	I64 L65 L66	I64-Y68 PolarHBondContact O-N 3.1Å; L65-Y68 PolarHBondContact O-N 3.03Å; L66-Y68 VanDerWaalsContact C-N 3.33Å
69	V	47.8	Very low	57.9	Low	101 Å²	101	92.5 Å²	92.5	61%	0.612	52%	0.517	S	S	*	.	S	Bend	trans	-104.8	101.2	170	-175.2	0	0	0	0	106.9	S67 A71	S67-V69 VanDerWaalsContact C-N 3.34Å; V69-A71 PolarHBondContact O-N 3.23Å
70	G	54.1	Low	57.8	Low	28 Å²	28	88.6 Å²	88.6	29%	0.289	49%	0.493	S	S	.	.			trans	-64.4	91.6	179.3	0	0	0	0	0	111.2	C72 S139	G70-C72 PolarHBondContact O-N 2.68Å; G70-S139 VanDerWaalsContact C-OG 3.29Å; G70-S139 WeakPolarHBondContact CA-OG 3.3Å; G70-S139 WeakPolarHBondContact O-CB 3.43Å; G70-S139 PolarHBondContact O-OG 2.9Å
71	A	57.5	Low	57.8	Low	69 Å²	69	90.3 Å²	90.3	57%	0.57	50%	0.499	S	S	*	.			trans	-75.8	126.8	174.7	0	0	0	0	0	109.7	V69 M73	V69-A71 PolarHBondContact O-N 3.23Å; A71-M73 PolarHBondContact O-N 3.13Å
72	C	63.7	Low	57.9	Low	47 Å²	47	90.5 Å²	90.5	32%	0.318	50%	0.498	S	S	.	.			trans	-65.4	132.2	170.9	-53.6	0	0	0	0	109.6	G70 A87 T88 C132	G70-C72 PolarHBondContact O-N 2.68Å; C72-A87 HydrophobicContact CB-CB 4.18Å; C72-T88 CarbonylContact C-O 3.59Å; C72-T88 WeakPolarHBondContact CA-O 3.5Å; C72-C132 VanDerWaalsContact CA-SG 3.59Å; C72-C132 HydrophobicContact CB-CB 3.69Å; C72-C132 WeakPolarHBondContact CB-SG 3.34Å; C72-C132 WeakPolarHBondContact SG-CB 3.46Å; C72-C132 CovalentContact SG-SG 2.04Å; C72-C132 PolarHBondContact SG-SG 3.24Å
73	M	66.1	Low	58.5	Low	117 Å²	117	86.2 Å²	86.2	58%	0.576	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.5	177.4	-63.2	-173.9	72.4	0	0	110.6	A71 A87 T88 T90	A71-M73 PolarHBondContact O-N 3.13Å; M73-A87 CarbonylContact O-C 3.56Å; M73-A87 VanDerWaalsContact O-CA 3.29Å; M73-A87 WeakPolarHBondContact O-CA 3.47Å; M73-T88 PolarHBondContact N-O 3.38Å; M73-T88 PolarHBondContact O-N 3.46Å; M73-T88 PolarHBondContact O-OG1 2.66Å; M73-T90 HydrophobicContact SD-CG2 4.4Å
74	N	62	Low	58.7	Low	123 Å²	123	86.2 Å²	86.2	66%	0.658	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	145.7	175.6	-80	-10.1	0	0	0	112	T76 H86	N74-T76 PolarHBondContact O-N 3.4Å; N74-H86 VanDerWaalsContact CA-O 3.29Å; N74-H86 WeakPolarHBondContact CA-O 2.91Å; N74-H86 PolarHBondContact OD1-O 3.06Å
75	I	64.8	Low	59.3	Low	29 Å²	29	83 Å²	83	15%	0.149	46%	0.46	C	S	.	.			trans	-73.2	115.6	175.6	-55.2	174.5	0	0	0	109.5	L83 Y85 H86 T88	I75-L83 HydrophobicContact CD1-CB 4.37Å; I75-L83 HydrophobicContact CD1-CD1 3.78Å; I75-Y85 HydrophobicContact CD1-CD2 4.09Å; I75-Y85 HydrophobicContact CD1-CE2 4.16Å; I75-Y85 VanDerWaalsContact CD1-O 3.31Å; I75-Y85 WeakPolarHBondContact CD1-O 3.38Å; I75-H86 PolarHBondContact N-O 3.16Å; I75-T88 HydrophobicContact CD1-CG2 3.61Å; I75-T88 HydrophobicContact CG1-CG2 3.36Å
76	T	60.9	Low	60.1	Low	135 Å²	135	84.7 Å²	84.7	83%	0.828	46%	0.464	S	S	*	.			trans	-104.5	-5.7	-179.7	53.9	0	0	0	0	114	N74	N74-T76 PolarHBondContact O-N 3.4Å
77	H	64.6	Low	61.2	Low	57 Å²	57	81 Å²	81	26%	0.264	45%	0.45	S	S	.	.			trans	-88	120.6	-175.3	-155.7	-84.7	0	0	0	111.8	Q79 C80 F129	H77-Q79 VanDerWaalsContact C-N 3.3Å; H77-Q79 PolarHBondContact O-N 2.76Å; H77-C80 PolarHBondContact O-N 3.26Å; H77-F129 HydrophobicContact CB-CE2 4.11Å; H77-F129 HydrophobicContact CB-CZ 3.99Å
78	S	64.8	Low	62.2	Low	87 Å²	87	77.4 Å²	77.4	61%	0.608	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-59.3	-35.2	-173.5	56.3	0	0	0	0	114	C80	S78-C80 VanDerWaalsContact C-N 3.26Å; S78-C80 PolarHBondContact O-N 3.13Å
79	Q	58.9	Low	63.3	Low	86 Å²	86	68.6 Å²	68.6	40%	0.402	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-68.7	-18.7	-178.8	-62.8	179.8	-15.7	0	0	114.4	H77	H77-Q79 VanDerWaalsContact C-N 3.3Å; H77-Q79 PolarHBondContact O-N 2.76Å
80	C	64.9	Low	63.8	Low	0 Å²	0	68 Å²	68	0%	0	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-113.6	22	-177.3	-66.7	0	0	0	0	113.3	H77 S78 M82 L83 C125 F129	H77-C80 PolarHBondContact O-N 3.26Å; S78-C80 VanDerWaalsContact C-N 3.26Å; S78-C80 PolarHBondContact O-N 3.13Å; C80-M82 PolarHBondContact O-N 2.58Å; C80-L83 HydrophobicContact CB-CD1 4.18Å; C80-L83 PolarHBondContact O-N 2.97Å; C80-C125 WeakPolarHBondContact CA-SG 3.43Å; C80-C125 HydrophobicContact CB-CB 3.73Å; C80-C125 WeakPolarHBondContact CB-SG 3.22Å; C80-C125 WeakPolarHBondContact SG-CB 3.12Å; C80-C125 CovalentContact SG-SG 2.05Å; C80-C125 PolarHBondContact SG-SG 3.22Å; C80-F129 HydrophobicContact CB-CD2 3.83Å; C80-F129 HydrophobicContact CB-CE2 4.11Å
81	Q	65.2	Low	63.8	Low	146 Å²	146	69.1 Å²	69.1	68%	0.682	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.2	173.8	-71.1	-179.1	-12.6	0	0	113.9	L83	Q81-L83 PolarHBondContact O-N 3.29Å
82	M	63.4	Low	63.4	Low	102 Å²	102	72 Å²	72	50%	0.502	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-4.5	175.8	68	-179.1	71.4	0	0	114.4	C80 M121 L122	C80-M82 PolarHBondContact O-N 2.58Å; M82-M121 HydrophobicContact CE-CB 4.31Å; M82-M121 HydrophobicContact CE-CG 3.49Å; M82-M121 VanDerWaalsContact CE-CG 3.49Å; M82-M121 HydrophobicContact SD-CB 4.26Å; M82-M121 HydrophobicContact SD-CG 3.84Å; M82-L122 HydrophobicContact CG-CD1 4.34Å; M82-L122 HydrophobicContact SD-CB 4.41Å
83	L	66.8	Low	62.8	Low	7 Å²	7	72.4 Å²	72.4	4%	0.037	39%	0.393	C	S	.	.	S	Bend	trans	-72.1	139.6	178.3	-69.1	168.5	0	0	0	110.3	I75 C80 Q81 Y85 L122 C125 T126 F129	I75-L83 HydrophobicContact CD1-CB 4.37Å; I75-L83 HydrophobicContact CD1-CD1 3.78Å; C80-L83 HydrophobicContact CB-CD1 4.18Å; C80-L83 PolarHBondContact O-N 2.97Å; Q81-L83 PolarHBondContact O-N 3.29Å; L83-Y85 HydrophobicContact CB-CD2 4.49Å; L83-Y85 HydrophobicContact CB-CE1 4.4Å; L83-Y85 HydrophobicContact CB-CE2 4.26Å; L83-Y85 HydrophobicContact CD1-CE2 4.01Å; L83-Y85 HydrophobicContact CD2-CE1 4.25Å; L83-Y85 PolarHBondContact O-N 3.04Å; L83-L122 HydrophobicContact CD2-CD1 3.89Å; L83-C125 HydrophobicContact CD1-CB 4.11Å; L83-C125 HydrophobicContact CD2-CB 4.12Å; L83-C125 HydrophobicContact CG-CB 4.18Å; L83-T126 HydrophobicContact CD2-CG2 3.5Å; L83-F129 HydrophobicContact CD1-CB 3.85Å
84	P	64.5	Low	61.9	Low	83 Å²	83	71.1 Å²	71.1	54%	0.539	40%	0.396	S	S	.	.	S	Bend	trans	-73.1	3.2	-178.4	29.4	-33.6	0	0	0	113.7	F190	P84-F190 HydrophobicContact CG-CE2 3.68Å; P84-F190 HydrophobicContact CG-CZ 3.95Å
85	Y	66.5	Low	61.2	Low	19 Å²	19	67.4 Å²	67.4	8%	0.075	38%	0.378	C	S	.	.			trans	-132.9	151.9	-179.7	51.7	-96.9	0	0	0	110.6	I75 L83 T88 F129 E131 F190	I75-Y85 HydrophobicContact CD1-CD2 4.09Å; I75-Y85 HydrophobicContact CD1-CE2 4.16Å; I75-Y85 VanDerWaalsContact CD1-O 3.31Å; I75-Y85 WeakPolarHBondContact CD1-O 3.38Å; L83-Y85 HydrophobicContact CB-CD2 4.49Å; L83-Y85 HydrophobicContact CB-CE1 4.4Å; L83-Y85 HydrophobicContact CB-CE2 4.26Å; L83-Y85 HydrophobicContact CD1-CE2 4.01Å; L83-Y85 HydrophobicContact CD2-CE1 4.25Å; L83-Y85 PolarHBondContact O-N 3.04Å; Y85-T88 HydrophobicContact CE2-CG2 4.19Å; Y85-F129 VanDerWaalsContact CE2-O 3.25Å; Y85-F129 WeakPolarHBondContact CE2-O 3.34Å; Y85-F129 PolarHBondContact OH-O 3.23Å; Y85-E131 HydrophobicContact CD1-CB 3.7Å; Y85-E131 HydrophobicContact CD1-CG 3.72Å; Y85-E131 HydrophobicContact CD2-CB 4.04Å; Y85-E131 HydrophobicContact CD2-CG 4.19Å; Y85-E131 HydrophobicContact CE1-CB 3.65Å; Y85-E131 HydrophobicContact CE1-CG 4.22Å; Y85-E131 HydrophobicContact CE2-CB 3.98Å; Y85-E131 HydrophobicContact CG-CB 3.9Å; Y85-E131 HydrophobicContact CG-CG 3.71Å; Y85-E131 PolarHBondContact OH-N 2.88Å; Y85-F190 HydrophobicContact CE1-CD2 4.38Å; Y85-F190 HydrophobicContact CE1-CE2 4.23Å
86	H	66.3	Low	60.5	Low	147 Å²	147	66.6 Å²	66.6	68%	0.681	37%	0.374	S	S	*	.	S	Bend	trans	-106.4	-7.5	-176	-62.6	-57.5	0	0	0	114.2	N74 I75	N74-H86 VanDerWaalsContact CA-O 3.29Å; N74-H86 WeakPolarHBondContact CA-O 2.91Å; N74-H86 PolarHBondContact OD1-O 3.06Å; I75-H86 PolarHBondContact N-O 3.16Å
87	A	68.6	Low	60	Low	34 Å²	34	70.2 Å²	70.2	28%	0.281	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.6	-174.3	0	0	0	0	0	112.2	C72 M73 C132	C72-A87 HydrophobicContact CB-CB 4.18Å; M73-A87 CarbonylContact O-C 3.56Å; M73-A87 VanDerWaalsContact O-CA 3.29Å; M73-A87 WeakPolarHBondContact O-CA 3.47Å; A87-C132 PolarHBondContact O-N 2.83Å
88	T	70.8	Confident	59.1	Low	11 Å²	11	74.5 Å²	74.5	7%	0.067	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.4	-175.8	60.2	0	0	0	0	112.2	C72 M73 I75 Y85 F129 P130	C72-T88 CarbonylContact C-O 3.59Å; C72-T88 WeakPolarHBondContact CA-O 3.5Å; M73-T88 PolarHBondContact N-O 3.38Å; M73-T88 PolarHBondContact O-N 3.46Å; M73-T88 PolarHBondContact O-OG1 2.66Å; I75-T88 HydrophobicContact CD1-CG2 3.61Å; I75-T88 HydrophobicContact CG1-CG2 3.36Å; Y85-T88 HydrophobicContact CE2-CG2 4.19Å; T88-F129 HydrophobicContact CG2-CB 3.66Å; T88-F129 HydrophobicContact CG2-CD1 4.25Å; T88-F129 HydrophobicContact CG2-CG 4.38Å; T88-P130 WeakPolarHBondContact CA-O 3.4Å; T88-P130 WeakPolarHBondContact CB-O 3.49Å
89	L	66.3	Low	58.5	Low	13 Å²	13	74.4 Å²	74.4	7%	0.068	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-91.2	148.4	168.8	-154.2	81.8	0	0	0	109.4	L92 C132 S139	L89-L92 HydrophobicContact CD2-CD1 3.72Å; L89-C132 VanDerWaalsContact CD1-SG 3.55Å; L89-S139 WeakPolarHBondContact CD1-OG 3.25Å
90	T	58.8	Low	58.6	Low	87 Å²	87	76.1 Å²	76.1	53%	0.534	40%	0.396	S	S	.	.	S	Bend	trans	-51.7	143.1	171.9	49.2	0	0	0	0	110.7	M73 L92	M73-T90 HydrophobicContact SD-CG2 4.4Å; T90-L92 PolarHBondContact O-N 3.28Å; T90-L92 VanDerWaalsContact O-N 3.07Å
91	P	54.5	Low	58.6	Low	52 Å²	52	78.9 Å²	78.9	34%	0.338	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-64.5	117.5	-162.6	23	-31.9	0	0	0	111.3	L93 V96	P91-L93 VanDerWaalsContact C-N 3.35Å; P91-V96 HydrophobicContact CB-CB 4.2Å; P91-V96 HydrophobicContact CB-CG1 3.94Å; P91-V96 HydrophobicContact CG-CG1 4.09Å
92	L	49.4	Very low	58.5	Low	130 Å²	130	77.7 Å²	77.7	68%	0.681	40%	0.404	S	S	*	.			trans	-80	-14.5	179.1	-108.1	156.5	0	0	0	113.2	L89 T90 S94	L89-L92 HydrophobicContact CD2-CD1 3.72Å; T90-L92 PolarHBondContact O-N 3.28Å; T90-L92 VanDerWaalsContact O-N 3.07Å; L92-S94 PolarHBondContact O-N 3.41Å
93	L	51.6	Low	58.8	Low	55 Å²	55	78.7 Å²	78.7	29%	0.288	41%	0.406	S	S	.	.			trans	-78.6	115.2	177	-84.4	153.9	0	0	0	110	P91 V95 V96 L127 L143	P91-L93 VanDerWaalsContact C-N 3.35Å; L93-V95 PolarHBondContact O-N 2.73Å; L93-V96 HydrophobicContact CB-CG2 4.41Å; L93-V96 PolarHBondContact O-N 2.94Å; L93-V96 VanDerWaalsContact O-N 3.12Å; L93-L127 HydrophobicContact CD1-CD2 4.21Å; L93-L143 HydrophobicContact CD1-CD2 3.86Å
94	S	45.9	Very low	59	Low	90 Å²	90	78.9 Å²	78.9	63%	0.629	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-16.3	175.5	58.6	0	0	0	0	114.4	L92	L92-S94 PolarHBondContact O-N 3.41Å
95	V	46.9	Very low	59.4	Low	46 Å²	46	75 Å²	75	28%	0.279	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-40.5	180	-177.6	0	0	0	0	112.2	L93 R97 N98 M99 F170	L93-V95 PolarHBondContact O-N 2.73Å; V95-R97 PolarHBondContact O-N 3.48Å; V95-N98 PolarHBondContact O-N 2.02Å; V95-N98 VanDerWaalsContact O-N 3.16Å; V95-M99 PolarHBondContact O-N 3.29Å; V95-F170 HydrophobicContact CG1-CB 4.31Å; V95-F170 HydrophobicContact CG1-CD2 4.02Å; V95-F170 HydrophobicContact CG1-CG 4.25Å; V95-F170 HydrophobicContact CG2-CB 4.48Å
96	V	51.2	Low	59.7	Low	12 Å²	12	80.3 Å²	80.3	7%	0.073	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-20.2	177.4	175.2	0	0	0	0	111.6	P91 L93 N98 M99 M101	P91-V96 HydrophobicContact CB-CB 4.2Å; P91-V96 HydrophobicContact CB-CG1 3.94Å; P91-V96 HydrophobicContact CG-CG1 4.09Å; L93-V96 HydrophobicContact CB-CG2 4.41Å; L93-V96 PolarHBondContact O-N 2.94Å; L93-V96 VanDerWaalsContact O-N 3.12Å; V96-N98 VanDerWaalsContact C-N 3.3Å; V96-N98 PolarHBondContact O-N 3.12Å; V96-M99 VanDerWaalsContact O-O 3.12Å; V96-M101 HydrophobicContact CG1-CE 3.77Å; V96-M101 HydrophobicContact CG1-CG 3.9Å; V96-M101 HydrophobicContact CG1-SD 3.23Å; V96-M101 WeakPolarHBondContact CG1-SD 3.45Å
97	R	49.4	Very low	60.2	Low	211 Å²	211	76.2 Å²	76.2	80%	0.796	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.9	173.3	-115.8	-179.1	180	-178.1	1.6	114	V95	V95-R97 PolarHBondContact O-N 3.48Å
98	N	47.5	Very low	60.6	Low	146 Å²	146	74.6 Å²	74.6	78%	0.781	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-2.2	-172.8	-73.4	-9.7	0	0	0	114	V95 V96	V95-N98 PolarHBondContact O-N 2.02Å; V95-N98 VanDerWaalsContact O-N 3.16Å; V96-N98 VanDerWaalsContact C-N 3.3Å; V96-N98 PolarHBondContact O-N 3.12Å
99	M	51.3	Low	60.7	Low	86 Å²	86	75.4 Å²	75.4	42%	0.424	38%	0.377	S	S	.	.	S	Bend	trans	-124.7	139.8	172.9	-70.4	179	66	0	0	109.2	V95 V96 M101	V95-M99 PolarHBondContact O-N 3.29Å; V96-M99 VanDerWaalsContact O-O 3.12Å; M99-M101 PolarHBondContact O-N 3.33Å
100	E	61.8	Low	61	Low	122 Å²	122	80.7 Å²	80.7	57%	0.57	40%	0.396	S	S	*	.			trans	-57	125.8	172.1	-74.2	168.3	169.6	0	0	109.9	E102 K103 F104	E100-E102 PolarHBondContact O-N 3.44Å; E100-E102 VanDerWaalsContact O-N 3.09Å; E100-K103 HydrophobicContact CB-CD 4.28Å; E100-K103 HydrophobicContact CB-CG 4.34Å; E100-K103 WeakPolarHBondContact O-CB 3.07Å; E100-K103 PolarHBondContact O-N 3.25Å; E100-K103 WeakPolarHBondContact OE2-CD 3.48Å; E100-K103 WeakPolarHBondContact OE2-CE 3.36Å; E100-K103 IonicContact OE2-NZ 2.68Å; E100-K103 PolarHBondContact OE2-NZ 3.19Å; E100-F104 PolarHBondContact O-N 3.13Å
101	M	63.3	Low	61.5	Low	57 Å²	57	76.5 Å²	76.5	28%	0.281	37%	0.371	S	S	.	.	H	α-helix	trans	-50.8	-34.9	-179	-89.4	-70.9	-124.8	0	0	113.2	V96 M99 F104 L105 A128 F129	V96-M101 HydrophobicContact CG1-CE 3.77Å; V96-M101 HydrophobicContact CG1-CG 3.9Å; V96-M101 HydrophobicContact CG1-SD 3.23Å; V96-M101 WeakPolarHBondContact CG1-SD 3.45Å; M99-M101 PolarHBondContact O-N 3.33Å; M101-F104 PolarHBondContact O-N 2.98Å; M101-L105 PolarHBondContact O-N 2.91Å; M101-A128 HydrophobicContact CE-CB 4.03Å; M101-A128 WeakPolarHBondContact CE-O 3.24Å; M101-A128 HydrophobicContact SD-CB 4.29Å; M101-F129 HydrophobicContact CE-CE1 4.21Å; M101-F129 HydrophobicContact CE-CZ 4.22Å
102	E	64.6	Low	62.3	Low	121 Å²	121	78.4 Å²	78.4	57%	0.565	38%	0.375	S	S	*	.	H	α-helix	trans	-65.2	-38.6	175.8	-69.1	-171.2	-178	0	0	113.3	E100 F104 K106	E100-E102 PolarHBondContact O-N 3.44Å; E100-E102 VanDerWaalsContact O-N 3.09Å; E102-F104 VanDerWaalsContact C-N 3.33Å; E102-K106 VanDerWaalsContact O-CB 3.24Å; E102-K106 WeakPolarHBondContact O-CB 3.43Å; E102-K106 WeakPolarHBondContact O-CG 3.49Å; E102-K106 PolarHBondContact O-N 2.91Å
103	K	69	Low	63.2	Low	123 Å²	123	81.4 Å²	81.4	54%	0.535	38%	0.377	S	S	.	.	H	α-helix	trans	-68.3	-37.3	177.5	-72.4	176.5	173.5	145.4	0	110.9	E100 F107	E100-K103 HydrophobicContact CB-CD 4.28Å; E100-K103 HydrophobicContact CB-CG 4.34Å; E100-K103 WeakPolarHBondContact O-CB 3.07Å; E100-K103 PolarHBondContact O-N 3.25Å; E100-K103 WeakPolarHBondContact OE2-CD 3.48Å; E100-K103 WeakPolarHBondContact OE2-CE 3.36Å; E100-K103 IonicContact OE2-NZ 2.68Å; E100-K103 PolarHBondContact OE2-NZ 3.19Å; K103-F107 PolarHBondContact O-N 3.29Å; K103-F107 VanDerWaalsContact O-N 3.12Å
104	F	70.9	Confident	63.9	Low	11 Å²	11	82.2 Å²	82.2	5%	0.048	38%	0.382	C	S	.	.	H	α-helix	trans	-64.6	-47.9	175.2	-176.8	-95.9	0	0	0	111.9	E100 M101 E102 F107 F108 L127 A128 F170	E100-F104 PolarHBondContact O-N 3.13Å; M101-F104 PolarHBondContact O-N 2.98Å; E102-F104 VanDerWaalsContact C-N 3.33Å; F104-F107 WeakPolarHBondContact O-CB 3.19Å; F104-F107 PolarHBondContact O-N 3.35Å; F104-F108 HydrophobicContact CD1-CD2 4.29Å; F104-F108 HydrophobicContact CD1-CE2 4.24Å; F104-F108 HydrophobicContact CD2-CE2 4.3Å; F104-F108 HydrophobicContact CE1-CD2 4.01Å; F104-F108 AromaticContact CE1-CE2 3.66Å; F104-F108 HydrophobicContact CE1-CE2 3.66Å; F104-F108 AromaticContact CE2-CE2 3.74Å; F104-F108 HydrophobicContact CE2-CE2 3.74Å; F104-F108 HydrophobicContact CZ-CD2 4.21Å; F104-F108 AromaticContact CZ-CE2 3.4Å; F104-F108 HydrophobicContact CZ-CE2 3.4Å; F104-F108 HydrophobicContact CZ-CZ 4.2Å; F104-F108 WeakPolarHBondContact O-CD2 3.01Å; F104-F108 PolarHBondContact O-N 3.46Å; F104-L127 HydrophobicContact CE1-CB 4.35Å; F104-L127 HydrophobicContact CZ-CB 4.13Å; F104-L127 HydrophobicContact CZ-CD1 4.42Å; F104-A128 HydrophobicContact CD1-CB 4.39Å; F104-A128 HydrophobicContact CE1-CB 4.2Å; F104-F170 HydrophobicContact CE2-CE2 4.19Å
105	L	73.7	Confident	64.9	Low	2 Å²	2	82.9 Å²	82.9	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-69.2	-33.7	177.6	-68.2	175.1	0	0	0	112.5	M101 F107 F108 T109 A128 F129	M101-L105 PolarHBondContact O-N 2.91Å; L105-F107 VanDerWaalsContact C-N 3.3Å; L105-F107 PolarHBondContact O-N 3.48Å; L105-F108 PolarHBondContact O-N 3.33Å; L105-T109 WeakPolarHBondContact O-CB 3.46Å; L105-T109 PolarHBondContact O-N 2.9Å; L105-T109 PolarHBondContact O-OG1 3.07Å; L105-A128 HydrophobicContact CD2-CB 3.97Å; L105-F129 HydrophobicContact CD1-CE2 4.26Å
106	K	71.8	Confident	66.3	Low	130 Å²	130	81.5 Å²	81.5	57%	0.565	38%	0.378	S	S	*	.	H	α-helix	trans	-61	-37	172.5	-80.5	171.6	180	170.2	0	112.2	E102 T109 Y110	E102-K106 VanDerWaalsContact O-CB 3.24Å; E102-K106 WeakPolarHBondContact O-CB 3.43Å; E102-K106 WeakPolarHBondContact O-CG 3.49Å; E102-K106 PolarHBondContact O-N 2.91Å; K106-T109 WeakPolarHBondContact O-CB 3.47Å; K106-T109 PolarHBondContact O-N 2.96Å; K106-Y110 WeakPolarHBondContact O-CB 3.07Å; K106-Y110 PolarHBondContact O-N 1.98Å
107	F	77.2	Confident	67.5	Low	61 Å²	61	83.3 Å²	83.3	27%	0.268	38%	0.384	S	S	.	.	H	α-helix	trans	-61	-48.9	174.3	172.4	-100.5	0	0	0	112.3	K103 F104 L105 T109 Y110 L111 P168 L171	K103-F107 PolarHBondContact O-N 3.29Å; K103-F107 VanDerWaalsContact O-N 3.12Å; F104-F107 WeakPolarHBondContact O-CB 3.19Å; F104-F107 PolarHBondContact O-N 3.35Å; L105-F107 VanDerWaalsContact C-N 3.3Å; L105-F107 PolarHBondContact O-N 3.48Å; F107-T109 VanDerWaalsContact C-N 3.32Å; F107-T109 PolarHBondContact O-N 2.93Å; F107-Y110 WeakPolarHBondContact O-CB 3.37Å; F107-Y110 PolarHBondContact O-N 2.73Å; F107-L111 HydrophobicContact CD1-CD1 4.27Å; F107-L111 HydrophobicContact CE1-CD1 3.6Å; F107-L111 HydrophobicContact CE1-CG 4.5Å; F107-L111 HydrophobicContact CE2-CD1 4.37Å; F107-L111 HydrophobicContact CZ-CD1 3.66Å; F107-L111 HydrophobicContact CZ-CG 4.35Å; F107-L111 PolarHBondContact O-N 3.12Å; F107-L111 VanDerWaalsContact O-N 3.08Å; F107-P168 HydrophobicContact CE1-CG 4.32Å; F107-P168 HydrophobicContact CZ-CG 3.8Å; F107-L171 HydrophobicContact CE1-CD1 4.4Å
108	F	76.8	Confident	68.2	Low	0 Å²	0	79.1 Å²	79.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-70.2	-28.1	176.6	-72.4	-80	0	0	0	113.1	F104 L105 Y110 L111 H112 I120 F123 L127 L171	F104-F108 HydrophobicContact CD1-CD2 4.29Å; F104-F108 HydrophobicContact CD1-CE2 4.24Å; F104-F108 HydrophobicContact CD2-CE2 4.3Å; F104-F108 HydrophobicContact CE1-CD2 4.01Å; F104-F108 AromaticContact CE1-CE2 3.66Å; F104-F108 HydrophobicContact CE1-CE2 3.66Å; F104-F108 AromaticContact CE2-CE2 3.74Å; F104-F108 HydrophobicContact CE2-CE2 3.74Å; F104-F108 HydrophobicContact CZ-CD2 4.21Å; F104-F108 AromaticContact CZ-CE2 3.4Å; F104-F108 HydrophobicContact CZ-CE2 3.4Å; F104-F108 HydrophobicContact CZ-CZ 4.2Å; F104-F108 WeakPolarHBondContact O-CD2 3.01Å; F104-F108 PolarHBondContact O-N 3.46Å; L105-F108 PolarHBondContact O-N 3.33Å; F108-Y110 VanDerWaalsContact C-N 3.35Å; F108-L111 HydrophobicContact CD1-CD1 4.49Å; F108-L111 PolarHBondContact O-N 3.14Å; F108-H112 WeakPolarHBondContact O-CB 3.07Å; F108-H112 PolarHBondContact O-N 3.46Å; F108-I120 HydrophobicContact CD1-CD1 4.27Å; F108-I120 HydrophobicContact CD1-CG1 4.18Å; F108-I120 HydrophobicContact CE1-CD1 4.34Å; F108-F123 AromaticContact CE1-CD1 3.93Å; F108-F123 HydrophobicContact CE1-CD1 3.93Å; F108-F123 HydrophobicContact CE1-CE1 4.34Å; F108-F123 HydrophobicContact CZ-CD1 4.48Å; F108-L127 HydrophobicContact CZ-CD1 4.3Å; F108-L171 HydrophobicContact CE1-CD1 4.35Å; F108-L171 HydrophobicContact CZ-CD1 3.67Å; F108-L171 HydrophobicContact CZ-CD2 4.38Å
109	T	72.6	Confident	69.6	Low	29 Å²	29	75.1 Å²	75.1	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-64.6	-39.9	170.8	-53.6	0	0	0	0	111.7	L105 K106 F107 H112 R113 M121	L105-T109 WeakPolarHBondContact O-CB 3.46Å; L105-T109 PolarHBondContact O-N 2.9Å; L105-T109 PolarHBondContact O-OG1 3.07Å; K106-T109 WeakPolarHBondContact O-CB 3.47Å; K106-T109 PolarHBondContact O-N 2.96Å; F107-T109 VanDerWaalsContact C-N 3.32Å; F107-T109 PolarHBondContact O-N 2.93Å; T109-H112 PolarHBondContact O-N 2.92Å; T109-R113 WeakPolarHBondContact O-CG 3.26Å; T109-R113 PolarHBondContact O-N 3.08Å; T109-M121 HydrophobicContact CG2-CE 4.36Å
110	Y	71.8	Confident	70.9	Confident	123 Å²	123	71 Å²	71	48%	0.482	33%	0.33	S	S	.	.	H	α-helix	trans	-65.5	-46.5	175.2	-176.5	-101.6	0	0	0	111.5	K106 F107 F108 H112 R113 L114	K106-Y110 WeakPolarHBondContact O-CB 3.07Å; K106-Y110 PolarHBondContact O-N 1.98Å; F107-Y110 WeakPolarHBondContact O-CB 3.37Å; F107-Y110 PolarHBondContact O-N 2.73Å; F108-Y110 VanDerWaalsContact C-N 3.35Å; Y110-H112 VanDerWaalsContact C-N 3.32Å; Y110-H112 PolarHBondContact O-N 2.89Å; Y110-R113 WeakPolarHBondContact O-CB 3.39Å; Y110-R113 PolarHBondContact O-N 2.74Å; Y110-R113 VanDerWaalsContact O-N 3.16Å; Y110-L114 HydrophobicContact CD1-CD1 3.91Å; Y110-L114 HydrophobicContact CE1-CD1 3.43Å; Y110-L114 VanDerWaalsContact CE1-CD1 3.43Å; Y110-L114 HydrophobicContact CE1-CG 4.39Å; Y110-L114 PolarHBondContact O-N 2.86Å
111	L	70.8	Confident	71.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-37.2	175.7	-69.6	-179.9	0	0	0	113.1	F107 F108 L114 S115 C116 I120 L160	F107-L111 HydrophobicContact CD1-CD1 4.27Å; F107-L111 HydrophobicContact CE1-CD1 3.6Å; F107-L111 HydrophobicContact CE1-CG 4.5Å; F107-L111 HydrophobicContact CE2-CD1 4.37Å; F107-L111 HydrophobicContact CZ-CD1 3.66Å; F107-L111 HydrophobicContact CZ-CG 4.35Å; F107-L111 PolarHBondContact O-N 3.12Å; F107-L111 VanDerWaalsContact O-N 3.08Å; F108-L111 HydrophobicContact CD1-CD1 4.49Å; F108-L111 PolarHBondContact O-N 3.14Å; L111-L114 PolarHBondContact O-N 2.79Å; L111-S115 PolarHBondContact O-N 2.94Å; L111-C116 PolarHBondContact O-SG 3.13Å; L111-C116 VanDerWaalsContact O-SG 3.38Å; L111-I120 HydrophobicContact CB-CG1 4.04Å; L111-I120 HydrophobicContact CD1-CG1 4.37Å; L111-L160 HydrophobicContact CD2-CD2 4.01Å; L111-L160 HydrophobicContact CD2-CG 4.27Å
112	H	70.6	Confident	72.4	Confident	91 Å²	91	64.2 Å²	64.2	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-39.8	174.1	-179.6	58.8	0	0	0	112.4	F108 T109 Y110 L114 S115 I120 M121	F108-H112 WeakPolarHBondContact O-CB 3.07Å; F108-H112 PolarHBondContact O-N 3.46Å; T109-H112 PolarHBondContact O-N 2.92Å; Y110-H112 VanDerWaalsContact C-N 3.32Å; Y110-H112 PolarHBondContact O-N 2.89Å; H112-L114 PolarHBondContact O-N 3.47Å; H112-S115 PolarHBondContact O-N 2.95Å; H112-I120 HydrophobicContact CB-CG2 3.78Å; H112-M121 HydrophobicContact CB-CB 4.37Å; H112-M121 HydrophobicContact CB-CE 4.01Å
113	R	68.4	Low	73.3	Confident	194 Å²	194	58.5 Å²	58.5	73%	0.732	27%	0.271	S	S	*	.	H	α-helix	trans	-62.8	-30.5	174.8	-75.2	179.4	-178.2	-167.5	0.3	113	T109 Y110 S115	T109-R113 WeakPolarHBondContact O-CG 3.26Å; T109-R113 PolarHBondContact O-N 3.08Å; Y110-R113 WeakPolarHBondContact O-CB 3.39Å; Y110-R113 PolarHBondContact O-N 2.74Å; Y110-R113 VanDerWaalsContact O-N 3.16Å; R113-S115 PolarHBondContact O-N 2.99Å
114	L	67.4	Low	73.8	Confident	72 Å²	72	52.6 Å²	52.6	38%	0.377	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	2	175.3	-62.9	173.6	0	0	0	113.1	Y110 L111 H112 C116 V159	Y110-L114 HydrophobicContact CD1-CD1 3.91Å; Y110-L114 HydrophobicContact CE1-CD1 3.43Å; Y110-L114 VanDerWaalsContact CE1-CD1 3.43Å; Y110-L114 HydrophobicContact CE1-CG 4.39Å; Y110-L114 PolarHBondContact O-N 2.86Å; L111-L114 PolarHBondContact O-N 2.79Å; H112-L114 PolarHBondContact O-N 3.47Å; L114-C116 PolarHBondContact O-N 3.14Å; L114-C116 VanDerWaalsContact O-N 3.08Å; L114-V159 HydrophobicContact CB-CG1 3.89Å; L114-V159 HydrophobicContact CD1-CG1 3.68Å; L114-V159 HydrophobicContact CG-CG1 4.31Å
115	S	65.3	Low	74.1	Confident	104 Å²	104	52.1 Å²	52.1	73%	0.727	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	30.8	177	-58.9	0	0	0	0	114.7	L111 H112 R113 Y117	L111-S115 PolarHBondContact O-N 2.94Å; H112-S115 PolarHBondContact O-N 2.95Å; R113-S115 PolarHBondContact O-N 2.99Å; S115-Y117 PolarHBondContact O-N 3.27Å
116	C	77.3	Confident	74.3	Confident	16 Å²	16	52 Å²	52	11%	0.108	24%	0.243	C	C	.	.	S	Bend	trans	-73.8	-26.7	-173.4	65.4	0	0	0	0	113.8	L111 L114 G155 C156 V159	L111-C116 PolarHBondContact O-SG 3.13Å; L111-C116 VanDerWaalsContact O-SG 3.38Å; L114-C116 PolarHBondContact O-N 3.14Å; L114-C116 VanDerWaalsContact O-N 3.08Å; C116-G155 WeakPolarHBondContact CB-O 3.24Å; C116-G155 CarbonylContact O-C 3.44Å; C116-G155 VanDerWaalsContact O-CA 3.24Å; C116-G155 WeakPolarHBondContact O-CA 3.27Å; C116-C156 HydrophobicContact CB-CB 3.75Å; C116-C156 WeakPolarHBondContact CB-SG 3.32Å; C116-C156 WeakPolarHBondContact SG-CB 3.48Å; C116-C156 CovalentContact SG-SG 2.04Å; C116-C156 PolarHBondContact SG-SG 3.15Å; C116-V159 HydrophobicContact CB-CB 4.2Å; C116-V159 HydrophobicContact CB-CG2 3.81Å
117	Y	75.5	Confident	74.6	Confident	51 Å²	51	46.1 Å²	46.1	20%	0.2	22%	0.218	C	C	.	.			trans	-155.1	130.6	172.5	176.8	-121.7	0	0	0	111.4	S115 H119 I120 F148 A151 A152	S115-Y117 PolarHBondContact O-N 3.27Å; Y117-H119 HydrophobicContact CD1-CB 4.32Å; Y117-H119 HydrophobicContact CE1-CB 3.75Å; Y117-H119 PolarHBondContact O-N 3.19Å; Y117-H119 VanDerWaalsContact O-N 3.08Å; Y117-I120 HydrophobicContact CD1-CB 4.2Å; Y117-I120 WeakPolarHBondContact O-CB 2.88Å; Y117-I120 WeakPolarHBondContact O-CG2 3.5Å; Y117-I120 PolarHBondContact O-N 3.15Å; Y117-F148 HydrophobicContact CE1-CD2 4.22Å; Y117-F148 AromaticContact CE1-CE2 3.77Å; Y117-F148 HydrophobicContact CE1-CE2 3.77Å; Y117-A151 HydrophobicContact CE2-CB 4.18Å; Y117-A152 HydrophobicContact CD1-CB 3.81Å; Y117-A152 HydrophobicContact CE1-CB 3.98Å
118	Q	65.1	Low	74.4	Confident	123 Å²	123	43.3 Å²	43.3	58%	0.575	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.5	-172.8	-174.7	179.9	-9	0	0	113.6	A211	Q118-A211 PolarHBondContact NE2-O 3.33Å
119	H	76	Confident	74.3	Confident	61 Å²	61	44.9 Å²	44.9	28%	0.282	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	19.3	-178.1	-57.8	-53.9	0	0	0	113.6	Y117 M121 L122 F123 F148	Y117-H119 HydrophobicContact CD1-CB 4.32Å; Y117-H119 HydrophobicContact CE1-CB 3.75Å; Y117-H119 PolarHBondContact O-N 3.19Å; Y117-H119 VanDerWaalsContact O-N 3.08Å; H119-M121 VanDerWaalsContact C-N 3.33Å; H119-M121 PolarHBondContact O-N 3.36Å; H119-L122 HydrophobicContact CB-CB 4.35Å; H119-L122 HydrophobicContact CB-CD2 4.49Å; H119-L122 WeakPolarHBondContact O-CB 3.2Å; H119-L122 PolarHBondContact O-N 2.62Å; H119-F123 PolarHBondContact O-N 3.35Å; H119-F148 HydrophobicContact CB-CE2 3.79Å; H119-F148 HydrophobicContact CB-CZ 4.05Å
120	I	79.1	Confident	74.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-36	-176.5	-165.3	59.2	0	0	0	113	F108 L111 H112 Y117 F123 G124 A152 W167	F108-I120 HydrophobicContact CD1-CD1 4.27Å; F108-I120 HydrophobicContact CD1-CG1 4.18Å; F108-I120 HydrophobicContact CE1-CD1 4.34Å; L111-I120 HydrophobicContact CB-CG1 4.04Å; L111-I120 HydrophobicContact CD1-CG1 4.37Å; H112-I120 HydrophobicContact CB-CG2 3.78Å; Y117-I120 HydrophobicContact CD1-CB 4.2Å; Y117-I120 WeakPolarHBondContact O-CB 2.88Å; Y117-I120 WeakPolarHBondContact O-CG2 3.5Å; Y117-I120 PolarHBondContact O-N 3.15Å; I120-F123 HydrophobicContact CD1-CD1 4.49Å; I120-F123 PolarHBondContact O-N 3.05Å; I120-G124 PolarHBondContact O-N 3.2Å; I120-A152 HydrophobicContact CD1-CB 3.86Å; I120-W167 HydrophobicContact CD1-CH2 4.2Å
121	M	79.4	Confident	74.5	Confident	13 Å²	13	39.4 Å²	39.4	6%	0.064	19%	0.19	C	C	.	.	H	α-helix	trans	-69.8	-41.7	175.4	-176.7	56.8	69.5	0	0	111.3	M82 T109 H112 H119 F123 G124 C125	M82-M121 HydrophobicContact CE-CB 4.31Å; M82-M121 HydrophobicContact CE-CG 3.49Å; M82-M121 VanDerWaalsContact CE-CG 3.49Å; M82-M121 HydrophobicContact SD-CB 4.26Å; M82-M121 HydrophobicContact SD-CG 3.84Å; T109-M121 HydrophobicContact CG2-CE 4.36Å; H112-M121 HydrophobicContact CB-CB 4.37Å; H112-M121 HydrophobicContact CB-CE 4.01Å; H119-M121 VanDerWaalsContact C-N 3.33Å; H119-M121 PolarHBondContact O-N 3.36Å; M121-F123 VanDerWaalsContact C-N 3.29Å; M121-F123 PolarHBondContact O-N 3Å; M121-G124 PolarHBondContact O-N 3.21Å; M121-C125 WeakPolarHBondContact O-CB 2.98Å; M121-C125 PolarHBondContact O-N 2.74Å
122	L	78.3	Confident	74.6	Confident	24 Å²	24	40.3 Å²	40.3	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-43.7	174	-177.6	66.2	0	0	0	110.5	M82 L83 H119 C125 T126 F148 F190 P192	M82-L122 HydrophobicContact CG-CD1 4.34Å; M82-L122 HydrophobicContact SD-CB 4.41Å; L83-L122 HydrophobicContact CD2-CD1 3.89Å; H119-L122 HydrophobicContact CB-CB 4.35Å; H119-L122 HydrophobicContact CB-CD2 4.49Å; H119-L122 WeakPolarHBondContact O-CB 3.2Å; H119-L122 PolarHBondContact O-N 2.62Å; L122-C125 PolarHBondContact O-N 3.09Å; L122-T126 HydrophobicContact CD1-CG2 4.47Å; L122-T126 VanDerWaalsContact O-CG2 3.23Å; L122-T126 WeakPolarHBondContact O-CG2 3.32Å; L122-T126 PolarHBondContact O-N 2.74Å; L122-T126 PolarHBondContact O-OG1 2.91Å; L122-F148 HydrophobicContact CD2-CZ 4.36Å; L122-F148 HydrophobicContact CG-CZ 4.38Å; L122-F190 HydrophobicContact CD2-CE1 4.34Å; L122-F190 HydrophobicContact CG-CE1 4.4Å; L122-P192 HydrophobicContact CD2-CB 4.48Å
123	F	81.9	Confident	74.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-50.2	174.9	-178.4	-105.9	0	0	0	112.1	F108 H119 I120 M121 C125 T126 L127 P144 F148 C149 A152 W167 F176	F108-F123 AromaticContact CE1-CD1 3.93Å; F108-F123 HydrophobicContact CE1-CD1 3.93Å; F108-F123 HydrophobicContact CE1-CE1 4.34Å; F108-F123 HydrophobicContact CZ-CD1 4.48Å; H119-F123 PolarHBondContact O-N 3.35Å; I120-F123 HydrophobicContact CD1-CD1 4.49Å; I120-F123 PolarHBondContact O-N 3.05Å; M121-F123 VanDerWaalsContact C-N 3.29Å; M121-F123 PolarHBondContact O-N 3Å; F123-C125 PolarHBondContact O-N 2.86Å; F123-T126 WeakPolarHBondContact CA-OG1 3.43Å; F123-T126 PolarHBondContact O-N 2.85Å; F123-T126 PolarHBondContact O-OG1 3.02Å; F123-L127 HydrophobicContact CD1-CD1 4.03Å; F123-L127 HydrophobicContact CE1-CD1 3.57Å; F123-L127 HydrophobicContact CE2-CD1 4.45Å; F123-L127 HydrophobicContact CZ-CD1 3.81Å; F123-L127 WeakPolarHBondContact O-CG 3.18Å; F123-L127 PolarHBondContact O-N 3.27Å; F123-L127 VanDerWaalsContact O-N 3.17Å; F123-P144 HydrophobicContact CD2-CB 4.05Å; F123-P144 HydrophobicContact CD2-CG 4.26Å; F123-P144 HydrophobicContact CE2-CB 3.75Å; F123-P144 HydrophobicContact CE2-CG 4.11Å; F123-F148 HydrophobicContact CB-CE1 3.89Å; F123-F148 HydrophobicContact CB-CE2 4.3Å; F123-F148 HydrophobicContact CB-CZ 3.69Å; F123-F148 AromaticContact CD2-CD1 3.69Å; F123-F148 HydrophobicContact CD2-CD1 3.69Å; F123-F148 AromaticContact CD2-CE1 3.76Å; F123-F148 HydrophobicContact CD2-CE1 3.76Å; F123-F148 HydrophobicContact CD2-CG 4.07Å; F123-F148 HydrophobicContact CD2-CZ 4.24Å; F123-F148 HydrophobicContact CE2-CD1 4.46Å; F123-F148 HydrophobicContact CG-CE1 4.33Å; F123-F148 HydrophobicContact CG-CZ 4.47Å; F123-C149 HydrophobicContact CE2-CB 3.85Å; F123-C149 HydrophobicContact CZ-CB 3.77Å; F123-A152 HydrophobicContact CD1-CB 4.29Å; F123-A152 HydrophobicContact CG-CB 4.4Å; F123-W167 HydrophobicContact CE1-CZ2 4.42Å; F123-F176 HydrophobicContact CZ-CE2 4.37Å; F123-F176 HydrophobicContact CZ-CZ 4.46Å
124	G	79.8	Confident	74.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-43	176.4	0	0	0	0	0	113.5	I120 M121 L127 A128	I120-G124 PolarHBondContact O-N 3.2Å; M121-G124 PolarHBondContact O-N 3.21Å; G124-L127 PolarHBondContact O-N 3.29Å; G124-A128 PolarHBondContact O-N 3.35Å
125	C	77.1	Confident	73.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.1	-38.8	176.9	-76.4	0	0	0	0	112.5	C80 L83 M121 L122 F123 L127 A128 F129	C80-C125 WeakPolarHBondContact CA-SG 3.43Å; C80-C125 HydrophobicContact CB-CB 3.73Å; C80-C125 WeakPolarHBondContact CB-SG 3.22Å; C80-C125 WeakPolarHBondContact SG-CB 3.12Å; C80-C125 CovalentContact SG-SG 2.05Å; C80-C125 PolarHBondContact SG-SG 3.22Å; L83-C125 HydrophobicContact CD1-CB 4.11Å; L83-C125 HydrophobicContact CD2-CB 4.12Å; L83-C125 HydrophobicContact CG-CB 4.18Å; M121-C125 WeakPolarHBondContact O-CB 2.98Å; M121-C125 PolarHBondContact O-N 2.74Å; L122-C125 PolarHBondContact O-N 3.09Å; F123-C125 PolarHBondContact O-N 2.86Å; C125-L127 PolarHBondContact O-N 3.28Å; C125-A128 PolarHBondContact O-N 3.23Å; C125-F129 WeakPolarHBondContact O-CA 3.29Å; C125-F129 WeakPolarHBondContact O-CB 3.2Å; C125-F129 PolarHBondContact O-N 3.11Å
126	T	78.2	Confident	73.8	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-25	175.5	55.3	0	0	0	0	113.4	L83 L122 F123 P144 F190	L83-T126 HydrophobicContact CD2-CG2 3.5Å; L122-T126 HydrophobicContact CD1-CG2 4.47Å; L122-T126 VanDerWaalsContact O-CG2 3.23Å; L122-T126 WeakPolarHBondContact O-CG2 3.32Å; L122-T126 PolarHBondContact O-N 2.74Å; L122-T126 PolarHBondContact O-OG1 2.91Å; F123-T126 WeakPolarHBondContact CA-OG1 3.43Å; F123-T126 PolarHBondContact O-N 2.85Å; F123-T126 PolarHBondContact O-OG1 3.02Å; T126-P144 VanDerWaalsContact OG1-CG 3.29Å; T126-P144 WeakPolarHBondContact OG1-CG 3.22Å; T126-F190 HydrophobicContact CG2-CD1 3.59Å; T126-F190 HydrophobicContact CG2-CE1 3.56Å; T126-F190 HydrophobicContact CG2-CG 4.29Å; T126-F190 HydrophobicContact CG2-CZ 4.23Å
127	L	77.6	Confident	72.4	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-80.1	-39.7	173.5	-69.6	172.4	0	0	0	112.6	L93 F104 F108 F123 G124 C125 P144 L171 F176	L93-L127 HydrophobicContact CD1-CD2 4.21Å; F104-L127 HydrophobicContact CE1-CB 4.35Å; F104-L127 HydrophobicContact CZ-CB 4.13Å; F104-L127 HydrophobicContact CZ-CD1 4.42Å; F108-L127 HydrophobicContact CZ-CD1 4.3Å; F123-L127 HydrophobicContact CD1-CD1 4.03Å; F123-L127 HydrophobicContact CE1-CD1 3.57Å; F123-L127 HydrophobicContact CE2-CD1 4.45Å; F123-L127 HydrophobicContact CZ-CD1 3.81Å; F123-L127 WeakPolarHBondContact O-CG 3.18Å; F123-L127 PolarHBondContact O-N 3.27Å; F123-L127 VanDerWaalsContact O-N 3.17Å; G124-L127 PolarHBondContact O-N 3.29Å; C125-L127 PolarHBondContact O-N 3.28Å; L127-P144 HydrophobicContact CD2-CG 3.72Å; L127-P144 HydrophobicContact CG-CG 4.04Å; L127-L171 HydrophobicContact CD1-CD2 3.63Å; L127-F176 HydrophobicContact CD2-CE1 3.67Å; L127-F176 HydrophobicContact CD2-CZ 3.66Å
128	A	73.1	Confident	71.4	Confident	2 Å²	2	45 Å²	45	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-71.5	-35.9	177.1	0	0	0	0	0	111.9	M101 F104 L105 G124 C125	M101-A128 HydrophobicContact CE-CB 4.03Å; M101-A128 WeakPolarHBondContact CE-O 3.24Å; M101-A128 HydrophobicContact SD-CB 4.29Å; F104-A128 HydrophobicContact CD1-CB 4.39Å; F104-A128 HydrophobicContact CE1-CB 4.2Å; L105-A128 HydrophobicContact CD2-CB 3.97Å; G124-A128 PolarHBondContact O-N 3.35Å; C125-A128 PolarHBondContact O-N 3.23Å
129	F	75	Confident	71.4	Confident	34 Å²	34	40.5 Å²	40.5	15%	0.149	23%	0.23	C	C	.	.	S	Bend	trans	-135.8	75.8	-169.9	-65.7	-62.9	0	0	0	110.2	H77 C80 L83 Y85 T88 M101 L105 C125	H77-F129 HydrophobicContact CB-CE2 4.11Å; H77-F129 HydrophobicContact CB-CZ 3.99Å; C80-F129 HydrophobicContact CB-CD2 3.83Å; C80-F129 HydrophobicContact CB-CE2 4.11Å; L83-F129 HydrophobicContact CD1-CB 3.85Å; Y85-F129 VanDerWaalsContact CE2-O 3.25Å; Y85-F129 WeakPolarHBondContact CE2-O 3.34Å; Y85-F129 PolarHBondContact OH-O 3.23Å; T88-F129 HydrophobicContact CG2-CB 3.66Å; T88-F129 HydrophobicContact CG2-CD1 4.25Å; T88-F129 HydrophobicContact CG2-CG 4.38Å; M101-F129 HydrophobicContact CE-CE1 4.21Å; M101-F129 HydrophobicContact CE-CZ 4.22Å; L105-F129 HydrophobicContact CD1-CE2 4.26Å; C125-F129 WeakPolarHBondContact O-CA 3.29Å; C125-F129 WeakPolarHBondContact O-CB 3.2Å; C125-F129 PolarHBondContact O-N 3.11Å
130	P	74.7	Confident	71	Confident	5 Å²	5	41.2 Å²	41.2	3%	0.032	23%	0.234	C	C	.	.			trans	-70.2	147.8	179.7	28.8	-34.5	0	0	0	111.9	T88 C132 L142	T88-P130 WeakPolarHBondContact CA-O 3.4Å; T88-P130 WeakPolarHBondContact CB-O 3.49Å; P130-C132 PolarHBondContact O-N 3.3Å; P130-L142 VanDerWaalsContact CB-O 3.29Å; P130-L142 WeakPolarHBondContact CB-O 3.41Å
131	E	74.2	Confident	70.4	Confident	32 Å²	32	42 Å²	42	15%	0.15	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	128.5	177.5	-171	178.5	175.6	0	0	110.3	Y85 I133 G141 L142 R187	Y85-E131 HydrophobicContact CD1-CB 3.7Å; Y85-E131 HydrophobicContact CD1-CG 3.72Å; Y85-E131 HydrophobicContact CD2-CB 4.04Å; Y85-E131 HydrophobicContact CD2-CG 4.19Å; Y85-E131 HydrophobicContact CE1-CB 3.65Å; Y85-E131 HydrophobicContact CE1-CG 4.22Å; Y85-E131 HydrophobicContact CE2-CB 3.98Å; Y85-E131 HydrophobicContact CG-CB 3.9Å; Y85-E131 HydrophobicContact CG-CG 3.71Å; Y85-E131 PolarHBondContact OH-N 2.88Å; E131-I133 PolarHBondContact O-N 2.04Å; E131-G141 CarbonylContact O-C 3.6Å; E131-G141 VanDerWaalsContact O-CA 3.31Å; E131-G141 WeakPolarHBondContact O-CA 3.44Å; E131-L142 HydrophobicContact CB-CB 3.98Å; E131-L142 PolarHBondContact O-N 3.18Å; E131-R187 IonicContact OE1-NH1 2.65Å; E131-R187 PolarHBondContact OE1-NH1 3.24Å; E131-R187 IonicContact OE2-NH1 3.6Å
132	C	72.3	Confident	70.2	Confident	18 Å²	18	41.8 Å²	41.8	12%	0.122	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112.2	176.6	-162.3	0	0	0	0	110.5	C72 A87 L89 P130	C72-C132 VanDerWaalsContact CA-SG 3.59Å; C72-C132 HydrophobicContact CB-CB 3.69Å; C72-C132 WeakPolarHBondContact CB-SG 3.34Å; C72-C132 WeakPolarHBondContact SG-CB 3.46Å; C72-C132 CovalentContact SG-SG 2.04Å; C72-C132 PolarHBondContact SG-SG 3.24Å; A87-C132 PolarHBondContact O-N 2.83Å; L89-C132 VanDerWaalsContact CD1-SG 3.55Å; P130-C132 PolarHBondContact O-N 3.3Å
133	I	70.4	Confident	70	Confident	35 Å²	35	43.7 Å²	43.7	18%	0.179	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.8	174	-57.2	-179.8	0	0	0	108.9	E131 S139 H140 L142 R187	E131-I133 PolarHBondContact O-N 2.04Å; I133-S139 WeakPolarHBondContact O-CA 3.46Å; I133-H140 PolarHBondContact N-O 2.85Å; I133-H140 PolarHBondContact O-N 2.85Å; I133-L142 HydrophobicContact CD1-CB 4.16Å; I133-L142 HydrophobicContact CD1-CD1 4Å; I133-L142 HydrophobicContact CD1-CD2 4.3Å; I133-L142 HydrophobicContact CD1-CG 4.38Å; I133-R187 HydrophobicContact CD1-CB 4.4Å
134	I	62.9	Low	69.9	Low	122 Å²	122	43.8 Å²	43.8	63%	0.626	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.8	177.3	-54.5	172.1	0	0	0	107.4
135	D	58.1	Low	69.9	Low	101 Å²	101	43.8 Å²	43.8	54%	0.54	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	86.1	-178.8	-135.3	-6	0	0	0	108.7	D138	D135-D138 PolarHBondContact N-O 3.5Å; D135-D138 VanDerWaalsContact N-O 3.09Å
136	G	63.4	Low	70	Confident	69 Å²	69	47.9 Å²	47.9	71%	0.711	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-128.1	-172.7	0	0	0	0	0	113.1
137	D	48.9	Very low	69.9	Low	172 Å²	172	50.5 Å²	50.5	92%	0.92	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-3.3	-177.6	-133.7	10.5	0	0	0	112.8
138	D	54.9	Low	70.1	Confident	127 Å²	127	50.6 Å²	50.6	68%	0.679	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	136.4	-179	-74.6	-35.7	0	0	0	111.5	D135	D135-D138 PolarHBondContact N-O 3.5Å; D135-D138 VanDerWaalsContact N-O 3.09Å
139	S	64.4	Low	70.4	Confident	30 Å²	30	50.5 Å²	50.5	21%	0.21	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.1	175.3	57.1	0	0	0	0	111.1	G70 L89 I133	G70-S139 VanDerWaalsContact C-OG 3.29Å; G70-S139 WeakPolarHBondContact CA-OG 3.3Å; G70-S139 WeakPolarHBondContact O-CB 3.43Å; G70-S139 PolarHBondContact O-OG 2.9Å; L89-S139 WeakPolarHBondContact CD1-OG 3.25Å; I133-S139 WeakPolarHBondContact O-CA 3.46Å
140	H	67.1	Low	70.7	Confident	76 Å²	76	52.6 Å²	52.6	35%	0.352	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.2	179.2	63.7	-84.8	0	0	0	112.2	I133	I133-H140 PolarHBondContact N-O 2.85Å; I133-H140 PolarHBondContact O-N 2.85Å
141	G	67.5	Low	70.9	Confident	17 Å²	17	54 Å²	54	18%	0.175	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129	179	0	0	0	0	0	112.2	E131	E131-G141 CarbonylContact O-C 3.6Å; E131-G141 VanDerWaalsContact O-CA 3.31Å; E131-G141 WeakPolarHBondContact O-CA 3.44Å
142	L	75.4	Confident	71.1	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	119.5	175.8	-163.8	72.6	0	0	0	110.8	P130 E131 I133 R187 I188 F190	P130-L142 VanDerWaalsContact CB-O 3.29Å; P130-L142 WeakPolarHBondContact CB-O 3.41Å; E131-L142 HydrophobicContact CB-CB 3.98Å; E131-L142 PolarHBondContact O-N 3.18Å; I133-L142 HydrophobicContact CD1-CB 4.16Å; I133-L142 HydrophobicContact CD1-CD1 4Å; I133-L142 HydrophobicContact CD1-CD2 4.3Å; I133-L142 HydrophobicContact CD1-CG 4.38Å; L142-R187 HydrophobicContact CD1-CB 4.44Å; L142-R187 WeakPolarHBondContact CD1-O 3.28Å; L142-R187 HydrophobicContact CD2-CB 4.23Å; L142-I188 VanDerWaalsContact CD1-C 3.47Å; L142-F190 HydrophobicContact CD2-CB 4.12Å
143	L	74.3	Confident	71.5	Confident	64 Å²	64	54.7 Å²	54.7	34%	0.335	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-93.4	160.1	178.3	-72.6	172.5	0	0	0	112.5	L93 C189 F190	L93-L143 HydrophobicContact CD1-CD2 3.86Å; L143-C189 CarbonylContact O-C 3.5Å; L143-C189 VanDerWaalsContact O-CA 3.25Å; L143-C189 WeakPolarHBondContact O-CA 3.38Å; L143-C189 WeakPolarHBondContact O-CB 3.45Å; L143-F190 PolarHBondContact O-N 2.89Å
144	P	78.3	Confident	71.9	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-58.3	146.9	175.6	-27.5	38.2	0	0	0	113.5	F123 T126 L127 F148 F176	F123-P144 HydrophobicContact CD2-CB 4.05Å; F123-P144 HydrophobicContact CD2-CG 4.26Å; F123-P144 HydrophobicContact CE2-CB 3.75Å; F123-P144 HydrophobicContact CE2-CG 4.11Å; T126-P144 VanDerWaalsContact OG1-CG 3.29Å; T126-P144 WeakPolarHBondContact OG1-CG 3.22Å; L127-P144 HydrophobicContact CD2-CG 3.72Å; L127-P144 HydrophobicContact CG-CG 4.04Å; P144-F148 HydrophobicContact CB-CD1 4.06Å; P144-F176 VanDerWaalsContact O-CD1 3.25Å; P144-F176 WeakPolarHBondContact O-CD1 3.31Å
145	C	80.4	Confident	72.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-69.6	152.3	172.2	-61.5	0	0	0	0	111.9	S147 F148 C149 Q179 C189 F190	C145-S147 VanDerWaalsContact C-N 3.31Å; C145-S147 PolarHBondContact O-N 2.81Å; C145-F148 WeakPolarHBondContact O-CB 3.04Å; C145-F148 PolarHBondContact O-N 3.42Å; C145-C149 PolarHBondContact O-N 3.09Å; C145-Q179 PolarHBondContact SG-NE2 2.79Å; C145-Q179 VanDerWaalsContact SG-NE2 3.37Å; C145-C189 WeakPolarHBondContact CA-SG 3.15Å; C145-C189 HydrophobicContact CB-CB 3.94Å; C145-C189 WeakPolarHBondContact CB-SG 3.33Å; C145-C189 WeakPolarHBondContact SG-CB 3.15Å; C145-C189 PolarHBondContact SG-O 1.96Å; C145-C189 VanDerWaalsContact SG-O 3.4Å; C145-C189 CovalentContact SG-SG 2.04Å; C145-C189 PolarHBondContact SG-SG 2.83Å; C145-F190 PolarHBondContact N-O 2.85Å; C145-F190 PolarHBondContact SG-O 2Å; C145-F190 VanDerWaalsContact SG-O 3.4Å
146	R	79.5	Confident	73.3	Confident	87 Å²	87	51 Å²	51	33%	0.328	29%	0.289	S	S	.	.	H	α-helix	trans	-59.2	-39.6	176.5	171.7	168.8	179.1	-178.9	-0	113.5	F148 C149 E150 C173 F176 R177 N178	R146-F148 PolarHBondContact O-N 3.11Å; R146-C149 PolarHBondContact O-N 3.16Å; R146-E150 HydrophobicContact CG-CG 4.32Å; R146-E150 IonicContact CZ-OE1 3.43Å; R146-E150 IonicContact NE-OE1 2.79Å; R146-E150 PolarHBondContact NE-OE1 2.89Å; R146-E150 IonicContact NH2-OE1 3.2Å; R146-E150 PolarHBondContact NH2-OE1 3.32Å; R146-E150 VanDerWaalsContact NH2-OE1 3.15Å; R146-E150 WeakPolarHBondContact O-CG 2.89Å; R146-E150 PolarHBondContact O-N 2.96Å; R146-C173 WeakPolarHBondContact CD-O 3.48Å; R146-C173 WeakPolarHBondContact CG-O 3.03Å; R146-F176 HydrophobicContact CB-CB 3.83Å; R146-R177 PolarHBondContact N-O 2.91Å; R146-N178 WeakPolarHBondContact CB-OD1 3.43Å
147	S	76.7	Confident	74	Confident	55 Å²	55	51.9 Å²	51.9	39%	0.385	28%	0.275	S	S	.	.	H	α-helix	trans	-58.6	-34.3	173.6	49.8	0	0	0	0	112.9	C145 A151	C145-S147 VanDerWaalsContact C-N 3.31Å; C145-S147 PolarHBondContact O-N 2.81Å; S147-A151 PolarHBondContact O-N 2.79Å; S147-A151 VanDerWaalsContact O-N 3.16Å
148	F	80.5	Confident	74.9	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-73.1	-36.5	178.1	-172.6	-153.3	0	0	0	111.7	Y117 H119 L122 F123 P144 C145 R146 A152 F190 P192	Y117-F148 HydrophobicContact CE1-CD2 4.22Å; Y117-F148 AromaticContact CE1-CE2 3.77Å; Y117-F148 HydrophobicContact CE1-CE2 3.77Å; H119-F148 HydrophobicContact CB-CE2 3.79Å; H119-F148 HydrophobicContact CB-CZ 4.05Å; L122-F148 HydrophobicContact CD2-CZ 4.36Å; L122-F148 HydrophobicContact CG-CZ 4.38Å; F123-F148 HydrophobicContact CB-CE1 3.89Å; F123-F148 HydrophobicContact CB-CE2 4.3Å; F123-F148 HydrophobicContact CB-CZ 3.69Å; F123-F148 AromaticContact CD2-CD1 3.69Å; F123-F148 HydrophobicContact CD2-CD1 3.69Å; F123-F148 AromaticContact CD2-CE1 3.76Å; F123-F148 HydrophobicContact CD2-CE1 3.76Å; F123-F148 HydrophobicContact CD2-CG 4.07Å; F123-F148 HydrophobicContact CD2-CZ 4.24Å; F123-F148 HydrophobicContact CE2-CD1 4.46Å; F123-F148 HydrophobicContact CG-CE1 4.33Å; F123-F148 HydrophobicContact CG-CZ 4.47Å; P144-F148 HydrophobicContact CB-CD1 4.06Å; C145-F148 WeakPolarHBondContact O-CB 3.04Å; C145-F148 PolarHBondContact O-N 3.42Å; R146-F148 PolarHBondContact O-N 3.11Å; F148-A152 PolarHBondContact O-N 3.31Å; F148-F190 HydrophobicContact CE1-CD1 4.32Å; F148-F190 HydrophobicContact CE1-CE1 4.39Å; F148-P192 HydrophobicContact CD2-CG 4.42Å; F148-P192 HydrophobicContact CE2-CG 4.2Å
149	C	80.6	Confident	75.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-43.2	172	-179.8	0	0	0	0	112.3	F123 C145 R146 A151 A152 K153 C173 F176	F123-C149 HydrophobicContact CE2-CB 3.85Å; F123-C149 HydrophobicContact CZ-CB 3.77Å; C145-C149 PolarHBondContact O-N 3.09Å; R146-C149 PolarHBondContact O-N 3.16Å; C149-A151 VanDerWaalsContact C-N 3.35Å; C149-A151 PolarHBondContact O-N 2.86Å; C149-A152 PolarHBondContact O-N 3.43Å; C149-K153 WeakPolarHBondContact O-CB 3.33Å; C149-K153 PolarHBondContact O-N 2.88Å; C149-C173 HydrophobicContact CB-CB 3.71Å; C149-C173 WeakPolarHBondContact CB-SG 3.19Å; C149-C173 PolarHBondContact O-SG 3.16Å; C149-C173 WeakPolarHBondContact SG-CA 3.27Å; C149-C173 WeakPolarHBondContact SG-CB 3.47Å; C149-C173 CovalentContact SG-SG 2.05Å; C149-C173 PolarHBondContact SG-SG 3.46Å; C149-F176 HydrophobicContact CB-CD2 3.72Å; C149-F176 HydrophobicContact CB-CE2 3.97Å
150	E	80.9	Confident	75.9	Confident	79 Å²	79	42 Å²	42	37%	0.369	23%	0.227	S	C	.	.	H	α-helix	trans	-63.4	-40.6	-179	-73.6	174	172.4	0	0	111.3	R146 K153 E154 C173	R146-E150 HydrophobicContact CG-CG 4.32Å; R146-E150 IonicContact CZ-OE1 3.43Å; R146-E150 IonicContact NE-OE1 2.79Å; R146-E150 PolarHBondContact NE-OE1 2.89Å; R146-E150 IonicContact NH2-OE1 3.2Å; R146-E150 PolarHBondContact NH2-OE1 3.32Å; R146-E150 VanDerWaalsContact NH2-OE1 3.15Å; R146-E150 WeakPolarHBondContact O-CG 2.89Å; R146-E150 PolarHBondContact O-N 2.96Å; E150-K153 PolarHBondContact O-N 3.46Å; E150-E154 PolarHBondContact O-N 3.3Å; E150-C173 HydrophobicContact CG-CB 3.74Å
151	A	77.4	Confident	75.8	Confident	33 Å²	33	40.6 Å²	40.6	27%	0.273	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-40.2	173.5	0	0	0	0	0	113.2	Y117 S147 C149 G155	Y117-A151 HydrophobicContact CE2-CB 4.18Å; S147-A151 PolarHBondContact O-N 2.79Å; S147-A151 VanDerWaalsContact O-N 3.16Å; C149-A151 VanDerWaalsContact C-N 3.35Å; C149-A151 PolarHBondContact O-N 2.86Å; A151-G155 PolarHBondContact O-N 3.28Å
152	A	78.3	Confident	75.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-37.4	176.4	0	0	0	0	0	112.4	Y117 I120 F123 F148 C149 C156 W167	Y117-A152 HydrophobicContact CD1-CB 3.81Å; Y117-A152 HydrophobicContact CE1-CB 3.98Å; I120-A152 HydrophobicContact CD1-CB 3.86Å; F123-A152 HydrophobicContact CD1-CB 4.29Å; F123-A152 HydrophobicContact CG-CB 4.4Å; F148-A152 PolarHBondContact O-N 3.31Å; C149-A152 PolarHBondContact O-N 3.43Å; A152-C156 WeakPolarHBondContact O-CB 3.14Å; A152-C156 PolarHBondContact O-N 3Å; A152-C156 PolarHBondContact O-SG 2.89Å; A152-W167 HydrophobicContact CB-CH2 4.28Å
153	K	81.1	Confident	74.6	Confident	65 Å²	65	50.6 Å²	50.6	28%	0.283	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-51.6	175.3	-176.1	-178.7	-175.3	-117.1	0	110.7	C149 E150 G155 C156 E157 W167	C149-K153 WeakPolarHBondContact O-CB 3.33Å; C149-K153 PolarHBondContact O-N 2.88Å; E150-K153 PolarHBondContact O-N 3.46Å; K153-G155 VanDerWaalsContact C-N 3.3Å; K153-G155 PolarHBondContact O-N 2.89Å; K153-C156 PolarHBondContact O-N 3.35Å; K153-C156 VanDerWaalsContact O-N 3.15Å; K153-E157 VanDerWaalsContact CE-OE1 3.24Å; K153-E157 WeakPolarHBondContact CE-OE1 3.17Å; K153-E157 WeakPolarHBondContact CE-OE2 3.2Å; K153-E157 IonicContact NZ-OE1 3.47Å; K153-E157 PolarHBondContact NZ-OE1 3.08Å; K153-E157 IonicContact NZ-OE2 2.74Å; K153-E157 PolarHBondContact NZ-OE2 3.03Å; K153-E157 VanDerWaalsContact O-CB 3.23Å; K153-E157 WeakPolarHBondContact O-CB 3.1Å; K153-E157 PolarHBondContact O-N 3.41Å; K153-W167 HydrophobicContact CB-CD2 4.12Å; K153-W167 HydrophobicContact CB-CG 4.43Å; K153-W167 HydrophobicContact CB-CZ2 4.43Å; K153-W167 HydrophobicContact CD-CB 4.36Å; K153-W167 HydrophobicContact CD-CG 4.07Å; K153-W167 HydrophobicContact CG-CB 4.12Å; K153-W167 HydrophobicContact CG-CD2 3.87Å; K153-W167 HydrophobicContact CG-CE3 4.38Å; K153-W167 HydrophobicContact CG-CG 3.74Å
154	E	78.6	Confident	74.2	Confident	158 Å²	158	55.1 Å²	55.1	74%	0.738	31%	0.306	S	S	*	.	H	α-helix	trans	-58.5	-40.7	-177.2	-171.8	173.6	-173.5	0	0	112.3	E150	E150-E154 PolarHBondContact O-N 3.3Å
155	G	74.2	Confident	73.6	Confident	23 Å²	23	63.5 Å²	63.5	24%	0.237	34%	0.338	C	S	.	.	H	α-helix	trans	-68.4	-32.5	177.3	0	0	0	0	0	114.6	C116 A151 K153	C116-G155 WeakPolarHBondContact CB-O 3.24Å; C116-G155 CarbonylContact O-C 3.44Å; C116-G155 VanDerWaalsContact O-CA 3.24Å; C116-G155 WeakPolarHBondContact O-CA 3.27Å; A151-G155 PolarHBondContact O-N 3.28Å; K153-G155 VanDerWaalsContact C-N 3.3Å; K153-G155 PolarHBondContact O-N 2.89Å
156	C	76.9	Confident	73.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-106.4	-7.8	-171.5	-58.6	0	0	0	0	115.1	C116 A152 K153 V159 L160 W167	C116-C156 HydrophobicContact CB-CB 3.75Å; C116-C156 WeakPolarHBondContact CB-SG 3.32Å; C116-C156 WeakPolarHBondContact SG-CB 3.48Å; C116-C156 CovalentContact SG-SG 2.04Å; C116-C156 PolarHBondContact SG-SG 3.15Å; A152-C156 WeakPolarHBondContact O-CB 3.14Å; A152-C156 PolarHBondContact O-N 3Å; A152-C156 PolarHBondContact O-SG 2.89Å; K153-C156 PolarHBondContact O-N 3.35Å; K153-C156 VanDerWaalsContact O-N 3.15Å; C156-V159 PolarHBondContact O-N 2.95Å; C156-L160 WeakPolarHBondContact O-CB 3.28Å; C156-L160 WeakPolarHBondContact O-CG 3.5Å; C156-L160 PolarHBondContact O-N 3.16Å; C156-W167 HydrophobicContact CB-CE3 4.4Å; C156-W167 HydrophobicContact CB-CZ3 3.83Å
157	E	77.7	Confident	73.4	Confident	88 Å²	88	64.7 Å²	64.7	41%	0.411	36%	0.358	S	S	.	.	H	α-helix	trans	-68.7	-37.1	-179.3	-170.1	158.8	-148.4	0	0	112.5	K153 G161	K153-E157 VanDerWaalsContact CE-OE1 3.24Å; K153-E157 WeakPolarHBondContact CE-OE1 3.17Å; K153-E157 WeakPolarHBondContact CE-OE2 3.2Å; K153-E157 IonicContact NZ-OE1 3.47Å; K153-E157 PolarHBondContact NZ-OE1 3.08Å; K153-E157 IonicContact NZ-OE2 2.74Å; K153-E157 PolarHBondContact NZ-OE2 3.03Å; K153-E157 VanDerWaalsContact O-CB 3.23Å; K153-E157 WeakPolarHBondContact O-CB 3.1Å; K153-E157 PolarHBondContact O-N 3.41Å; E157-G161 PolarHBondContact O-N 3.43Å; E157-G161 VanDerWaalsContact O-N 3.13Å
158	S	68.2	Low	73.4	Confident	78 Å²	78	63 Å²	63	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-67.4	-39.9	175.7	56.6	0	0	0	0	112.7	G161 M162	S158-G161 PolarHBondContact O-N 3.06Å; S158-M162 PolarHBondContact O-N 2.89Å
159	V	70.7	Confident	72.9	Confident	31 Å²	31	67.8 Å²	67.8	19%	0.188	37%	0.372	C	S	.	.	H	α-helix	trans	-71	-40.1	-179.9	177.4	0	0	0	0	111.4	L114 C116 C156 G161 M162	L114-V159 HydrophobicContact CB-CG1 3.89Å; L114-V159 HydrophobicContact CD1-CG1 3.68Å; L114-V159 HydrophobicContact CG-CG1 4.31Å; C116-V159 HydrophobicContact CB-CB 4.2Å; C116-V159 HydrophobicContact CB-CG2 3.81Å; C156-V159 PolarHBondContact O-N 2.95Å; V159-G161 VanDerWaalsContact C-N 3.28Å; V159-G161 PolarHBondContact O-N 3.42Å; V159-M162 PolarHBondContact O-N 2.8Å
160	L	69.7	Low	72.3	Confident	13 Å²	13	71.5 Å²	71.5	7%	0.068	39%	0.388	C	S	.	.	H	α-helix	trans	-66.4	-31.8	173.6	-73.2	170.2	0	0	0	112.2	L111 C156 M162 V163 N164 Y165 W167	L111-L160 HydrophobicContact CD2-CD2 4.01Å; L111-L160 HydrophobicContact CD2-CG 4.27Å; C156-L160 WeakPolarHBondContact O-CB 3.28Å; C156-L160 WeakPolarHBondContact O-CG 3.5Å; C156-L160 PolarHBondContact O-N 3.16Å; L160-M162 VanDerWaalsContact C-N 3.29Å; L160-M162 PolarHBondContact O-N 3.35Å; L160-V163 WeakPolarHBondContact O-CG2 3.4Å; L160-V163 PolarHBondContact O-N 3.45Å; L160-N164 PolarHBondContact O-N 3.19Å; L160-Y165 CarbonylContact C-O 3.51Å; L160-Y165 PolarHBondContact O-N 2.98Å; L160-W167 HydrophobicContact CD1-CE3 3.94Å
161	G	65.1	Low	71.9	Confident	45 Å²	45	68 Å²	68	46%	0.464	37%	0.372	S	S	.	.	H	α-helix	trans	-62.2	-31.9	174.4	0	0	0	0	0	114	E157 S158 V159 V163 N164	E157-G161 PolarHBondContact O-N 3.43Å; E157-G161 VanDerWaalsContact O-N 3.13Å; S158-G161 PolarHBondContact O-N 3.06Å; V159-G161 VanDerWaalsContact C-N 3.28Å; V159-G161 PolarHBondContact O-N 3.42Å; G161-V163 PolarHBondContact O-N 3.49Å; G161-N164 PolarHBondContact O-N 3.27Å
162	M	59.1	Low	71.8	Confident	164 Å²	164	72.9 Å²	72.9	81%	0.808	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-22.6	177.9	-64.8	-178.7	179.3	0	0	113.4	S158 V159 L160	S158-M162 PolarHBondContact O-N 2.89Å; V159-M162 PolarHBondContact O-N 2.8Å; L160-M162 VanDerWaalsContact C-N 3.29Å; L160-M162 PolarHBondContact O-N 3.35Å
163	V	59.5	Low	71.8	Confident	72 Å²	72	73.4 Å²	73.4	44%	0.436	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	12.9	177.2	-67.4	0	0	0	0	112.8	L160 G161 Y165	L160-V163 WeakPolarHBondContact O-CG2 3.4Å; L160-V163 PolarHBondContact O-N 3.45Å; G161-V163 PolarHBondContact O-N 3.49Å; V163-Y165 VanDerWaalsContact C-N 3.3Å; V163-Y165 HydrophobicContact CB-CD2 4.41Å; V163-Y165 HydrophobicContact CG2-CD2 4.11Å; V163-Y165 WeakPolarHBondContact O-CD2 3.42Å; V163-Y165 PolarHBondContact O-N 2.82Å
164	N	63.9	Low	71.5	Confident	158 Å²	158	74.4 Å²	74.4	85%	0.845	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	31.9	-179.1	-147.6	22.7	0	0	0	114.4	L160 G161	L160-N164 PolarHBondContact O-N 3.19Å; G161-N164 PolarHBondContact O-N 3.27Å
165	Y	67.4	Low	71.1	Confident	177 Å²	177	72.9 Å²	72.9	69%	0.694	40%	0.395	S	S	*	.			trans	-115.4	158.3	173.8	-79.7	-90	0	0	0	111.2	L160 V163	L160-Y165 CarbonylContact C-O 3.51Å; L160-Y165 PolarHBondContact O-N 2.98Å; V163-Y165 VanDerWaalsContact C-N 3.3Å; V163-Y165 HydrophobicContact CB-CD2 4.41Å; V163-Y165 HydrophobicContact CG2-CD2 4.11Å; V163-Y165 WeakPolarHBondContact O-CD2 3.42Å; V163-Y165 PolarHBondContact O-N 2.82Å
166	S	76.4	Confident	71.2	Confident	97 Å²	97	72.8 Å²	72.8	68%	0.678	39%	0.388	S	S	*	.			trans	-118.7	161	177.3	56.4	0	0	0	0	111.5
167	W	77.7	Confident	71.1	Confident	15 Å²	15	81.8 Å²	81.8	6%	0.057	42%	0.422	C	S	.	.			trans	-54.4	127.2	177.9	-173	-98.8	0	0	0	110.4	I120 F123 A152 K153 C156 L160 D169 L171	I120-W167 HydrophobicContact CD1-CH2 4.2Å; F123-W167 HydrophobicContact CE1-CZ2 4.42Å; A152-W167 HydrophobicContact CB-CH2 4.28Å; K153-W167 HydrophobicContact CB-CD2 4.12Å; K153-W167 HydrophobicContact CB-CG 4.43Å; K153-W167 HydrophobicContact CB-CZ2 4.43Å; K153-W167 HydrophobicContact CD-CB 4.36Å; K153-W167 HydrophobicContact CD-CG 4.07Å; K153-W167 HydrophobicContact CG-CB 4.12Å; K153-W167 HydrophobicContact CG-CD2 3.87Å; K153-W167 HydrophobicContact CG-CE3 4.38Å; K153-W167 HydrophobicContact CG-CG 3.74Å; C156-W167 HydrophobicContact CB-CE3 4.4Å; C156-W167 HydrophobicContact CB-CZ3 3.83Å; L160-W167 HydrophobicContact CD1-CE3 3.94Å; W167-D169 PolarHBondContact O-N 3.34Å; W167-L171 HydrophobicContact CZ2-CB 4.19Å; W167-L171 HydrophobicContact CZ2-CD1 4.13Å; W167-L171 PolarHBondContact NE1-O 3.37Å
168	P	76.8	Confident	70.3	Confident	20 Å²	20	81.6 Å²	81.6	13%	0.13	42%	0.424	C	S	.	.			trans	-61.7	136.4	-168.2	-22.7	31	0	0	0	113.6	F107 F170 L171	F107-P168 HydrophobicContact CE1-CG 4.32Å; F107-P168 HydrophobicContact CZ-CG 3.8Å; P168-F170 HydrophobicContact CB-CD1 3.59Å; P168-F170 HydrophobicContact CB-CE1 3.21Å; P168-F170 HydrophobicContact CB-CE2 4.3Å; P168-F170 HydrophobicContact CB-CG 4.29Å; P168-F170 HydrophobicContact CB-CZ 3.59Å; P168-F170 HydrophobicContact CG-CE1 4.02Å; P168-F170 HydrophobicContact CG-CZ 4.04Å; P168-F170 PolarHBondContact O-N 3.16Å; P168-F170 VanDerWaalsContact O-N 3.11Å; P168-L171 HydrophobicContact CG-CD1 4.28Å; P168-L171 PolarHBondContact O-N 2.9Å
169	D	70.6	Confident	69.9	Low	108 Å²	108	81.6 Å²	81.6	58%	0.578	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-61.3	-23.1	-178.5	-86.8	-32	0	0	0	114.1	W167 L171 R172	W167-D169 PolarHBondContact O-N 3.34Å; D169-L171 VanDerWaalsContact C-N 3.31Å; D169-R172 VanDerWaalsContact CG-NH2 3.27Å; D169-R172 VanDerWaalsContact O-CD 3.3Å; D169-R172 WeakPolarHBondContact O-CD 3.37Å; D169-R172 WeakPolarHBondContact O-CG 2.97Å; D169-R172 IonicContact OD1-CZ 2.99Å; D169-R172 IonicContact OD1-NE 2.88Å; D169-R172 PolarHBondContact OD1-NE 3.19Å; D169-R172 IonicContact OD1-NH2 3.19Å; D169-R172 PolarHBondContact OD1-NH2 2.96Å; D169-R172 IonicContact OD2-NH2 3.72Å
170	F	67.5	Low	68.9	Low	77 Å²	77	85.7 Å²	85.7	34%	0.338	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-80.7	-8.9	176	66.9	-96.7	0	0	0	113.8	V95 F104 P168 Q175	V95-F170 HydrophobicContact CG1-CB 4.31Å; V95-F170 HydrophobicContact CG1-CD2 4.02Å; V95-F170 HydrophobicContact CG1-CG 4.25Å; V95-F170 HydrophobicContact CG2-CB 4.48Å; F104-F170 HydrophobicContact CE2-CE2 4.19Å; P168-F170 HydrophobicContact CB-CD1 3.59Å; P168-F170 HydrophobicContact CB-CE1 3.21Å; P168-F170 HydrophobicContact CB-CE2 4.3Å; P168-F170 HydrophobicContact CB-CG 4.29Å; P168-F170 HydrophobicContact CB-CZ 3.59Å; P168-F170 HydrophobicContact CG-CE1 4.02Å; P168-F170 HydrophobicContact CG-CZ 4.04Å; P168-F170 PolarHBondContact O-N 3.16Å; P168-F170 VanDerWaalsContact O-N 3.11Å; F170-Q175 PolarHBondContact O-OE1 2.93Å
171	L	73	Confident	67.5	Low	6 Å²	6	93.7 Å²	93.7	3%	0.031	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-109.4	29.6	173.5	-66.6	170.8	0	0	0	111.2	F107 F108 L127 W167 P168 D169 C173	F107-L171 HydrophobicContact CE1-CD1 4.4Å; F108-L171 HydrophobicContact CE1-CD1 4.35Å; F108-L171 HydrophobicContact CZ-CD1 3.67Å; F108-L171 HydrophobicContact CZ-CD2 4.38Å; L127-L171 HydrophobicContact CD1-CD2 3.63Å; W167-L171 HydrophobicContact CZ2-CB 4.19Å; W167-L171 HydrophobicContact CZ2-CD1 4.13Å; W167-L171 PolarHBondContact NE1-O 3.37Å; P168-L171 HydrophobicContact CG-CD1 4.28Å; P168-L171 PolarHBondContact O-N 2.9Å; D169-L171 VanDerWaalsContact C-N 3.31Å; L171-C173 PolarHBondContact O-N 3.11Å; L171-C173 VanDerWaalsContact O-N 3.14Å
172	R	75.6	Confident	66.4	Low	135 Å²	135	97 Å²	97	51%	0.509	49%	0.493	S	S	.	.			trans	-62.8	117.8	179.1	-83.5	172.2	-178	-160.9	5.3	109.7	D169 S174 Q175	D169-R172 VanDerWaalsContact CG-NH2 3.27Å; D169-R172 VanDerWaalsContact O-CD 3.3Å; D169-R172 WeakPolarHBondContact O-CD 3.37Å; D169-R172 WeakPolarHBondContact O-CG 2.97Å; D169-R172 IonicContact OD1-CZ 2.99Å; D169-R172 IonicContact OD1-NE 2.88Å; D169-R172 PolarHBondContact OD1-NE 3.19Å; D169-R172 IonicContact OD1-NH2 3.19Å; D169-R172 PolarHBondContact OD1-NH2 2.96Å; D169-R172 IonicContact OD2-NH2 3.72Å; R172-S174 PolarHBondContact O-N 3.29Å; R172-Q175 HydrophobicContact CB-CG 4.45Å; R172-Q175 WeakPolarHBondContact O-CB 3.32Å; R172-Q175 WeakPolarHBondContact O-CG 2.88Å; R172-Q175 PolarHBondContact O-N 3.28Å; R172-Q175 PolarHBondContact O-OE1 2.04Å
173	C	79	Confident	65.4	Low	12 Å²	12	94.5 Å²	94.5	8%	0.081	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-62.3	-15.7	-173.7	-57.4	0	0	0	0	114.7	R146 C149 E150 L171 Q175 F176	R146-C173 WeakPolarHBondContact CD-O 3.48Å; R146-C173 WeakPolarHBondContact CG-O 3.03Å; C149-C173 HydrophobicContact CB-CB 3.71Å; C149-C173 WeakPolarHBondContact CB-SG 3.19Å; C149-C173 PolarHBondContact O-SG 3.16Å; C149-C173 WeakPolarHBondContact SG-CA 3.27Å; C149-C173 WeakPolarHBondContact SG-CB 3.47Å; C149-C173 CovalentContact SG-SG 2.05Å; C149-C173 PolarHBondContact SG-SG 3.46Å; E150-C173 HydrophobicContact CG-CB 3.74Å; L171-C173 PolarHBondContact O-N 3.11Å; L171-C173 VanDerWaalsContact O-N 3.14Å; C173-Q175 PolarHBondContact O-N 3.36Å; C173-F176 PolarHBondContact O-N 2.82Å
174	S	74.3	Confident	64.9	Low	86 Å²	86	98.7 Å²	98.7	60%	0.601	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-62.4	-15.5	169.8	58.3	0	0	0	0	114.5	R172	R172-S174 PolarHBondContact O-N 3.29Å
175	Q	71	Confident	64.2	Low	125 Å²	125	97.9 Å²	97.9	58%	0.584	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-80.6	-15.4	178.6	-62.9	176.9	-64.5	0	0	113	F170 R172 C173	F170-Q175 PolarHBondContact O-OE1 2.93Å; R172-Q175 HydrophobicContact CB-CG 4.45Å; R172-Q175 WeakPolarHBondContact O-CB 3.32Å; R172-Q175 WeakPolarHBondContact O-CG 2.88Å; R172-Q175 PolarHBondContact O-N 3.28Å; R172-Q175 PolarHBondContact O-OE1 2.04Å; C173-Q175 PolarHBondContact O-N 3.36Å
176	F	76.3	Confident	63.3	Low	21 Å²	21	93.4 Å²	93.4	9%	0.092	51%	0.507	C	S	.	.	S	Bend	trans	-97.8	155.2	-179.2	-58.7	-73.9	0	0	0	111.9	F123 L127 P144 R146 C149 C173	F123-F176 HydrophobicContact CZ-CE2 4.37Å; F123-F176 HydrophobicContact CZ-CZ 4.46Å; L127-F176 HydrophobicContact CD2-CE1 3.67Å; L127-F176 HydrophobicContact CD2-CZ 3.66Å; P144-F176 VanDerWaalsContact O-CD1 3.25Å; P144-F176 WeakPolarHBondContact O-CD1 3.31Å; R146-F176 HydrophobicContact CB-CB 3.83Å; C149-F176 HydrophobicContact CB-CD2 3.72Å; C149-F176 HydrophobicContact CB-CE2 3.97Å; C173-F176 PolarHBondContact O-N 2.82Å
177	R	73.1	Confident	62.5	Low	190 Å²	190	95.3 Å²	95.3	72%	0.717	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-88.2	151.4	-179.4	-66.7	-178.5	179.4	178.6	0.5	111.7	R146	R146-R177 PolarHBondContact N-O 2.91Å
178	N	61.3	Low	61.9	Low	84 Å²	84	99.4 Å²	99.4	45%	0.449	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-93.8	149.9	176.5	-97.3	-11.8	0	0	0	112	R146 T180	R146-N178 WeakPolarHBondContact CB-OD1 3.43Å; N178-T180 VanDerWaalsContact C-N 3.32Å; N178-T180 PolarHBondContact O-N 3.29Å; N178-T180 VanDerWaalsContact O-N 3.08Å
179	Q	60.2	Low	61.4	Low	78 Å²	78	98.9 Å²	98.9	36%	0.364	52%	0.518	S	S	.	.	S	Bend	trans	-80.6	68.5	175.1	-72.3	-176	-8.9	0	0	112	C145 S191	C145-Q179 PolarHBondContact SG-NE2 2.79Å; C145-Q179 VanDerWaalsContact SG-NE2 3.37Å; Q179-S191 PolarHBondContact NE2-OG 3.06Å
180	T	49	Very low	61.4	Low	116 Å²	116	95 Å²	95	71%	0.712	50%	0.496	S	S	*	.			trans	-152.8	98.6	165	48.8	0	0	0	0	110.6	N178	N178-T180 VanDerWaalsContact C-N 3.32Å; N178-T180 PolarHBondContact O-N 3.29Å; N178-T180 VanDerWaalsContact O-N 3.08Å
181	E	40.8	Very low	61.3	Low	182 Å²	182	92 Å²	92	85%	0.85	48%	0.484	S	S	*	.				-177.6	147	117.4	-96.5	178.1	-174	0	0	110.4
182	S	42.9	Very low	60.6	Low	114 Å²	114	94.3 Å²	94.3	80%	0.797	50%	0.5	S	S	*	.			trans	-55.1	135.4	-163.3	62.1	0	0	0	0	116.9
183	S	37.5	Very low	59.6	Low	112 Å²	112	96.5 Å²	96.5	78%	0.783	52%	0.516	S	S	*	.				163.5	149.6	113.3	51.8	0	0	0	0	109.7	V185	S183-V185 PolarHBondContact O-N 3.17Å
184	N	48.3	Very low	58.1	Low	160 Å²	160	101.9 Å²	101.9	86%	0.856	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	126.4	-178.7	-74.7	-27.5	0	0	0	112.5
185	V	49.8	Very low	56.3	Low	140 Å²	140	104.5 Å²	104.5	85%	0.848	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.1	-12	144.3	179.8	0	0	0	0	116.9	S183	S183-V185 PolarHBondContact O-N 3.17Å
186	S	47.9	Very low	54.6	Low	83 Å²	83	106 Å²	106	58%	0.58	55%	0.554	S	S	*	*			trans	-125.1	117.9	179.4	-45.7	0	0	0	0	113.6	I188	S186-I188 WeakPolarHBondContact O-CG1 3.05Å; S186-I188 PolarHBondContact O-N 3.39Å
187	R	60.5	Low	52.5	Low	137 Å²	137	107 Å²	107	52%	0.517	57%	0.571	S	S	.	*			trans	-63.4	116.5	168.3	-70.8	177.5	175.1	180	-6.3	108.1	E131 I133 L142 E195	E131-R187 IonicContact OE1-NH1 2.65Å; E131-R187 PolarHBondContact OE1-NH1 3.24Å; E131-R187 IonicContact OE2-NH1 3.6Å; I133-R187 HydrophobicContact CD1-CB 4.4Å; L142-R187 HydrophobicContact CD1-CB 4.44Å; L142-R187 WeakPolarHBondContact CD1-O 3.28Å; L142-R187 HydrophobicContact CD2-CB 4.23Å; R187-E195 IonicContact NH2-OE1 3.58Å
188	I	65.2	Low	51	Low	102 Å²	102	107.1 Å²	107.1	52%	0.523	58%	0.577	S	S	.	*			trans	-92.3	-32.3	-174	-57.9	173.4	0	0	0	112.5	L142 S186	L142-I188 VanDerWaalsContact CD1-C 3.47Å; S186-I188 WeakPolarHBondContact O-CG1 3.05Å; S186-I188 PolarHBondContact O-N 3.39Å
189	C	66.4	Low	50.1	Low	9 Å²	9	111.9 Å²	111.9	6%	0.061	60%	0.596	C	S	.	*	S	Bend	trans	-155.7	157.5	176.8	61.4	0	0	0	0	110.9	L143 C145	L143-C189 CarbonylContact O-C 3.5Å; L143-C189 VanDerWaalsContact O-CA 3.25Å; L143-C189 WeakPolarHBondContact O-CA 3.38Å; L143-C189 WeakPolarHBondContact O-CB 3.45Å; C145-C189 WeakPolarHBondContact CA-SG 3.15Å; C145-C189 HydrophobicContact CB-CB 3.94Å; C145-C189 WeakPolarHBondContact CB-SG 3.33Å; C145-C189 WeakPolarHBondContact SG-CB 3.15Å; C145-C189 PolarHBondContact SG-O 1.96Å; C145-C189 VanDerWaalsContact SG-O 3.4Å; C145-C189 CovalentContact SG-SG 2.04Å; C145-C189 PolarHBondContact SG-SG 2.83Å
190	F	70.1	Confident	49.2	Very low	25 Å²	25	115.9 Å²	115.9	11%	0.11	62%	0.619	C	S	.	*	B	Isolated β-bridge	trans	-85.7	130.8	-178.1	-178.4	-92.4	0	0	0	112.3	P84 Y85 L122 T126 L142 L143 C145 F148	P84-F190 HydrophobicContact CG-CE2 3.68Å; P84-F190 HydrophobicContact CG-CZ 3.95Å; Y85-F190 HydrophobicContact CE1-CD2 4.38Å; Y85-F190 HydrophobicContact CE1-CE2 4.23Å; L122-F190 HydrophobicContact CD2-CE1 4.34Å; L122-F190 HydrophobicContact CG-CE1 4.4Å; T126-F190 HydrophobicContact CG2-CD1 3.59Å; T126-F190 HydrophobicContact CG2-CE1 3.56Å; T126-F190 HydrophobicContact CG2-CG 4.29Å; T126-F190 HydrophobicContact CG2-CZ 4.23Å; L142-F190 HydrophobicContact CD2-CB 4.12Å; L143-F190 PolarHBondContact O-N 2.89Å; C145-F190 PolarHBondContact N-O 2.85Å; C145-F190 PolarHBondContact SG-O 2Å; C145-F190 VanDerWaalsContact SG-O 3.4Å; F148-F190 HydrophobicContact CE1-CD1 4.32Å; F148-F190 HydrophobicContact CE1-CE1 4.39Å
191	S	64.3	Low	49.3	Very low	14 Å²	14	117.8 Å²	117.8	10%	0.098	62%	0.624	C	S	.	*			trans	-145.3	140.4	171.1	71.6	0	0	0	0	111.5	Q179 Q193	Q179-S191 PolarHBondContact NE2-OG 3.06Å; S191-Q193 PolarHBondContact O-N 2.68Å; S191-Q193 VanDerWaalsContact O-N 3.14Å
192	P	58.8	Low	49.7	Very low	56 Å²	56	110.7 Å²	110.7	36%	0.364	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-66.5	-14.1	-177.1	22.5	-30.8	0	0	0	115	L122 F148 Q194	L122-P192 HydrophobicContact CD2-CB 4.48Å; F148-P192 HydrophobicContact CD2-CG 4.42Å; F148-P192 HydrophobicContact CE2-CG 4.2Å; P192-Q194 PolarHBondContact O-N 2.67Å
193	Q	54.7	Low	49.5	Very low	180 Å²	180	108 Å²	108	84%	0.841	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-83.5	-2.1	-175.1	-67.8	172.6	-12.3	0	0	114.7	S191	S191-Q193 PolarHBondContact O-N 2.68Å; S191-Q193 VanDerWaalsContact O-N 3.14Å
194	Q	48.4	Very low	49.8	Very low	126 Å²	126	115.3 Å²	115.3	59%	0.589	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-105.1	7	-166.2	-117.1	174.2	5.1	0	0	117.3	P192	P192-Q194 PolarHBondContact O-N 2.67Å
195	E	36.3	Very low	49.9	Very low	141 Å²	141	110.2 Å²	110.2	66%	0.659	58%	0.58	S	S	*	*			trans	-103.4	86.6	164.7	-69.6	-153.3	158.4	0	0	111	R187 G197	R187-E195 IonicContact NH2-OE1 3.58Å; E195-G197 PolarHBondContact O-N 3.04Å
196	N	35	Very low	50.3	Low	155 Å²	155	112.3 Å²	112.3	83%	0.829	58%	0.581	S	S	*	*			trans	-68.5	79.3	157.1	-112.2	-17.5	0	0	0	108.5
197	G	31.3	Very low	51	Low	43 Å²	43	111.9 Å²	111.9	44%	0.443	57%	0.572	S	S	.	*			trans	-125.4	51.1	170.4	0	0	0	0	0	110.3	E195 Q199	E195-G197 PolarHBondContact O-N 3.04Å; G197-Q199 PolarHBondContact O-N 3.27Å
198	K	43.2	Very low	51.4	Low	192 Å²	192	108 Å²	108	84%	0.835	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	71.5	169.3	-71.2	-176.5	177.1	-176.6	0	110.5
199	Q	40.7	Very low	51.4	Low	185 Å²	185	107.8 Å²	107.8	86%	0.864	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.8	19.1	154.6	-113.7	163.8	-14.3	0	0	116.8	G197	G197-Q199 PolarHBondContact O-N 3.27Å
200	L	41.8	Very low	51.6	Low	162 Å²	162	107.5 Å²	107.5	85%	0.848	56%	0.557	S	S	*	*	S	Bend	trans	-132.4	-1.3	-174.2	-92.9	128.5	0	0	0	118.2
201	L	50.8	Low	51.2	Low	155 Å²	155	109.8 Å²	109.8	81%	0.812	58%	0.58	S	S	*	*	S	Bend	trans	-98.3	-7.2	-174.4	-80.5	153.6	0	0	0	115.7
202	C	49	Very low	50.6	Low	33 Å²	33	111.1 Å²	111.1	22%	0.223	59%	0.589	C	S	.	*	S	Bend	trans	-123.8	113.7	171.1	-116.2	0	0	0	0	105.3	N207 C215	C202-N207 HydrophobicContact CB-CB 4.2Å; C202-N207 VanDerWaalsContact SG-CB 3.59Å; C202-C215 VanDerWaalsContact CA-SG 3.58Å; C202-C215 HydrophobicContact CB-CB 4.41Å; C202-C215 WeakPolarHBondContact CB-SG 3.27Å; C202-C215 WeakPolarHBondContact SG-CB 3.06Å; C202-C215 CovalentContact SG-SG 2.01Å; C202-C215 PolarHBondContact SG-SG 3.49Å
203	G	39.7	Very low	50.6	Low	58 Å²	58	111 Å²	111	60%	0.598	60%	0.598	S	S	*	*			trans	-48.1	141.8	-175.8	0	0	0	0	0	112.5	G205	G203-G205 PolarHBondContact O-N 2.99Å
204	R	43.6	Very low	51.1	Low	265 Å²	265	105.3 Å²	105.3	100%	1	57%	0.573	S	S	*	*	S	Bend	trans	-46.8	96.9	-174.1	-157.7	177.8	-167.7	174.6	3.3	112.3
205	G	51.1	Low	52.1	Low	53 Å²	53	101.8 Å²	101.8	55%	0.546	56%	0.562	S	S	.	*	S	Bend	trans	168.6	155.5	-178.4	0	0	0	0	0	109.5	G203 N207	G203-G205 PolarHBondContact O-N 2.99Å; G205-N207 VanDerWaalsContact C-N 3.29Å; G205-N207 PolarHBondContact O-N 2.79Å
206	E	56.7	Low	53.8	Low	184 Å²	184	95.5 Å²	95.5	86%	0.86	53%	0.533	S	S	*	.	S	Bend	trans	-57.4	76	-173.1	-61.2	176.5	164.7	0	0	113.7	G218	E206-G218 PolarHBondContact O-N 2.66Å
207	N	63.2	Low	55.6	Low	75 Å²	75	90.4 Å²	90.4	40%	0.401	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.3	-179	-63.6	-10	0	0	0	110.2	C202 G205 I216	C202-N207 HydrophobicContact CB-CB 4.2Å; C202-N207 VanDerWaalsContact SG-CB 3.59Å; G205-N207 VanDerWaalsContact C-N 3.29Å; G205-N207 PolarHBondContact O-N 2.79Å; N207-I216 CarbonylContact C-O 3.2Å; N207-I216 WeakPolarHBondContact CA-O 3.32Å; N207-I216 WeakPolarHBondContact CB-O 3.39Å
208	F	69.4	Low	57.2	Low	54 Å²	54	89.8 Å²	89.8	24%	0.237	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	139.8	174.7	176.7	-99.5	0	0	0	110.2	I216 D233	F208-I216 HydrophobicContact CB-CG1 3.95Å; F208-I216 HydrophobicContact CD1-CD1 3.87Å; F208-I216 HydrophobicContact CD1-CG1 3.87Å; F208-I216 HydrophobicContact CG-CG1 4.42Å; F208-I216 PolarHBondContact N-O 3.31Å; F208-I216 PolarHBondContact O-N 3.09Å; F208-D233 HydrophobicContact CE1-CB 4.31Å
209	L	65.6	Low	58.3	Low	99 Å²	99	88.8 Å²	88.8	52%	0.518	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.7	177.8	-178.4	74.1	0	0	0	108.7	I214	L209-I214 WeakPolarHBondContact CA-O 3.31Å
210	C	70.9	Confident	59.5	Low	3 Å²	3	82.1 Å²	82.1	2%	0.02	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-65.1	154.3	174.7	-50.4	0	0	0	0	111.2	S212 G213 I214 C228	C210-S212 WeakPolarHBondContact CB-OG 3.25Å; C210-S212 PolarHBondContact O-N 2.87Å; C210-G213 PolarHBondContact O-N 3.39Å; C210-I214 HydrophobicContact CB-CB 4.13Å; C210-I214 WeakPolarHBondContact CB-O 3.4Å; C210-I214 PolarHBondContact N-O 3.18Å; C210-I214 PolarHBondContact SG-O 2.99Å; C210-C228 VanDerWaalsContact CA-SG 3.58Å; C210-C228 HydrophobicContact CB-CB 3.45Å; C210-C228 VanDerWaalsContact CB-CB 3.45Å; C210-C228 WeakPolarHBondContact CB-SG 3.18Å; C210-C228 WeakPolarHBondContact SG-CA 3.45Å; C210-C228 WeakPolarHBondContact SG-CB 3.33Å; C210-C228 CovalentContact SG-SG 2Å; C210-C228 PolarHBondContact SG-SG 2.91Å
211	A	60.9	Low	60.8	Low	72 Å²	72	78.4 Å²	78.4	60%	0.595	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.7	175.4	0	0	0	0	0	112.4	Q118 G213 D230 S232	Q118-A211 PolarHBondContact NE2-O 3.33Å; A211-G213 PolarHBondContact O-N 3.44Å; A211-D230 VanDerWaalsContact C-OD2 3.23Å; A211-D230 WeakPolarHBondContact CA-OD2 3.45Å; A211-D230 VanDerWaalsContact CB-OD2 3.32Å; A211-D230 WeakPolarHBondContact CB-OD2 3.45Å; A211-D230 PolarHBondContact N-OD2 2.96Å; A211-S232 WeakPolarHBondContact CB-OG 3.39Å; A211-S232 PolarHBondContact N-OG 3.1Å; A211-S232 VanDerWaalsContact N-OG 3.13Å
212	S	52.2	Low	61.6	Low	42 Å²	42	73.9 Å²	73.9	29%	0.294	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.3	170	59.4	0	0	0	0	113.5	C210 C228 D230	C210-S212 WeakPolarHBondContact CB-OG 3.25Å; C210-S212 PolarHBondContact O-N 2.87Å; S212-C228 PolarHBondContact OG-O 3.42Å; S212-D230 WeakPolarHBondContact CB-OD2 3.07Å; S212-D230 PolarHBondContact N-OD2 3.41Å
213	G	59	Low	62.3	Low	53 Å²	53	75 Å²	75	55%	0.546	43%	0.43	S	S	.	.	S	Bend	trans	92.9	5.7	-177.8	0	0	0	0	0	114.7	C210 A211	C210-G213 PolarHBondContact O-N 3.39Å; A211-G213 PolarHBondContact O-N 3.44Å
214	I	64.9	Low	63.1	Low	61 Å²	61	74.7 Å²	74.7	31%	0.313	43%	0.427	S	S	.	.			trans	-81.7	143.8	177.5	-59.9	173.2	0	0	0	110.4	L209 C210 I216 D229	L209-I214 WeakPolarHBondContact CA-O 3.31Å; C210-I214 HydrophobicContact CB-CB 4.13Å; C210-I214 WeakPolarHBondContact CB-O 3.4Å; C210-I214 PolarHBondContact N-O 3.18Å; C210-I214 PolarHBondContact SG-O 2.99Å; I214-I216 HydrophobicContact CG2-CG2 4.18Å; I214-D229 HydrophobicContact CD1-CB 4.12Å; I214-D229 VanDerWaalsContact CD1-OD2 3.23Å; I214-D229 WeakPolarHBondContact CD1-OD2 3.43Å
215	C	69.6	Low	63.8	Low	53 Å²	53	69.8 Å²	69.8	36%	0.358	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	105.4	-178.6	-95	0	0	0	0	110.1	C202	C202-C215 VanDerWaalsContact CA-SG 3.58Å; C202-C215 HydrophobicContact CB-CB 4.41Å; C202-C215 WeakPolarHBondContact CB-SG 3.27Å; C202-C215 WeakPolarHBondContact SG-CB 3.06Å; C202-C215 CovalentContact SG-SG 2.01Å; C202-C215 PolarHBondContact SG-SG 3.49Å
216	I	71.7	Confident	64.1	Low	9 Å²	9	69.7 Å²	69.7	5%	0.046	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	150.9	178.1	65.1	167.4	0	0	0	111.4	N207 F208 I214 L220 D227 C228 D233	N207-I216 CarbonylContact C-O 3.2Å; N207-I216 WeakPolarHBondContact CA-O 3.32Å; N207-I216 WeakPolarHBondContact CB-O 3.39Å; F208-I216 HydrophobicContact CB-CG1 3.95Å; F208-I216 HydrophobicContact CD1-CD1 3.87Å; F208-I216 HydrophobicContact CD1-CG1 3.87Å; F208-I216 HydrophobicContact CG-CG1 4.42Å; F208-I216 PolarHBondContact N-O 3.31Å; F208-I216 PolarHBondContact O-N 3.09Å; I214-I216 HydrophobicContact CG2-CG2 4.18Å; I216-L220 HydrophobicContact CD1-CB 4.1Å; I216-D227 HydrophobicContact CD1-CB 4.27Å; I216-D227 HydrophobicContact CG2-CB 4.22Å; I216-D227 WeakPolarHBondContact CG2-O 3.35Å; I216-C228 VanDerWaalsContact CD1-SG 3.58Å; I216-D233 HydrophobicContact CD1-CB 3.6Å
217	P	72.8	Confident	64.9	Low	47 Å²	47	63.6 Å²	63.6	31%	0.305	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	138.1	168.9	-24.6	34.6	0	0	0	111.9	K219 L220	P217-K219 HydrophobicContact CB-CD 4.4Å; P217-K219 HydrophobicContact CB-CG 3.85Å; P217-K219 PolarHBondContact O-N 3.24Å; P217-L220 HydrophobicContact CB-CG 4.44Å; P217-L220 HydrophobicContact CG-CD1 4.32Å; P217-L220 VanDerWaalsContact O-CB 3.31Å; P217-L220 WeakPolarHBondContact O-CB 3.28Å; P217-L220 PolarHBondContact O-N 2.76Å
218	G	63.8	Low	64.9	Low	30 Å²	30	60 Å²	60	31%	0.309	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-61.3	-17.3	-176.2	0	0	0	0	0	115.3	E206 L220 Q221	E206-G218 PolarHBondContact O-N 2.66Å; G218-L220 PolarHBondContact O-N 3.14Å; G218-Q221 WeakPolarHBondContact O-CB 3.39Å; G218-Q221 PolarHBondContact O-N 3.16Å
219	K	67	Low	64.5	Low	171 Å²	171	63.3 Å²	63.3	74%	0.743	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-68.2	-15.6	169.7	61.5	175.7	-179.4	177.3	0	114.2	P217	P217-K219 HydrophobicContact CB-CD 4.4Å; P217-K219 HydrophobicContact CB-CG 3.85Å; P217-K219 PolarHBondContact O-N 3.24Å
220	L	65.7	Low	64.2	Low	46 Å²	46	61.5 Å²	61.5	24%	0.241	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-94.8	-1.1	177.4	-59.6	-172.9	0	0	0	111.8	I216 P217 G218 N223 D227	I216-L220 HydrophobicContact CD1-CB 4.1Å; P217-L220 HydrophobicContact CB-CG 4.44Å; P217-L220 HydrophobicContact CG-CD1 4.32Å; P217-L220 VanDerWaalsContact O-CB 3.31Å; P217-L220 WeakPolarHBondContact O-CB 3.28Å; P217-L220 PolarHBondContact O-N 2.76Å; G218-L220 PolarHBondContact O-N 3.14Å; L220-N223 WeakPolarHBondContact CD2-ND2 3.22Å; L220-D227 HydrophobicContact CB-CB 4.33Å; L220-D227 WeakPolarHBondContact CB-OD2 3.34Å; L220-D227 HydrophobicContact CD1-CB 4.34Å
221	Q	70.3	Confident	63.6	Low	84 Å²	84	66.8 Å²	66.8	39%	0.393	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	130.7	169.1	-168.9	178	24.5	0	0	109.2	G218 N223 D233	G218-Q221 WeakPolarHBondContact O-CB 3.39Å; G218-Q221 PolarHBondContact O-N 3.16Å; Q221-N223 PolarHBondContact O-N 2.92Å; Q221-D233 WeakPolarHBondContact CG-O 3.47Å
222	C	65.9	Low	64	Low	60 Å²	60	64.8 Å²	64.8	41%	0.405	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	38.2	178.2	-58	0	0	0	0	114.6	D233 E234 C237	C222-D233 PolarHBondContact N-O 3.16Å; C222-D233 VanDerWaalsContact N-O 3.17Å; C222-E234 VanDerWaalsContact C-OE1 3.23Å; C222-E234 WeakPolarHBondContact CA-OE1 3.33Å; C222-E234 WeakPolarHBondContact CA-OE2 3.49Å; C222-E234 PolarHBondContact N-OE1 3.08Å; C222-C237 WeakPolarHBondContact CA-SG 3.31Å; C222-C237 HydrophobicContact CB-CB 3.67Å; C222-C237 WeakPolarHBondContact CB-SG 3.01Å; C222-C237 WeakPolarHBondContact SG-CA 3.44Å; C222-C237 WeakPolarHBondContact SG-CB 2.92Å; C222-C237 CovalentContact SG-SG 2.02Å; C222-C237 PolarHBondContact SG-SG 2.9Å
223	N	64.4	Low	64.8	Low	55 Å²	55	62.8 Å²	62.8	29%	0.294	35%	0.349	S	S	.	.	S	Bend	trans	-98.3	-1.9	175.8	73.7	3.2	0	0	0	113.1	L220 Q221 Y225 D227 E234	L220-N223 WeakPolarHBondContact CD2-ND2 3.22Å; Q221-N223 PolarHBondContact O-N 2.92Å; N223-Y225 WeakPolarHBondContact O-CD2 3.48Å; N223-Y225 WeakPolarHBondContact OD1-CB 3.08Å; N223-Y225 PolarHBondContact OD1-N 3.18Å; N223-Y225 PolarHBondContact OD1-O 2.78Å; N223-D227 PolarHBondContact ND2-OD2 3.09Å; N223-D227 PolarHBondContact OD1-OD2 2.84Å; N223-E234 PolarHBondContact N-OE1 2.63Å; N223-E234 PolarHBondContact OD1-OE1 2.89Å
224	G	57.3	Low	65.4	Low	52 Å²	52	61.1 Å²	61.1	54%	0.536	33%	0.327	S	S	.	.	S	Bend	trans	84.5	11.8	179.8	0	0	0	0	0	114.9	E234	G224-E234 WeakPolarHBondContact CA-OE2 3.08Å; G224-E234 PolarHBondContact N-OE1 3.32Å; G224-E234 VanDerWaalsContact N-OE1 3.07Å; G224-E234 PolarHBondContact N-OE2 2.68Å
225	Y	56.8	Low	65.3	Low	162 Å²	162	60.6 Å²	60.6	64%	0.635	33%	0.332	S	S	*	.	S	Bend	trans	-122.9	146	177.9	-63.7	-82.5	0	0	0	110.2	N223 D227 D233 E234	N223-Y225 WeakPolarHBondContact O-CD2 3.48Å; N223-Y225 WeakPolarHBondContact OD1-CB 3.08Å; N223-Y225 PolarHBondContact OD1-N 3.18Å; N223-Y225 PolarHBondContact OD1-O 2.78Å; Y225-D227 PolarHBondContact O-N 3.05Å; Y225-D227 VanDerWaalsContact O-N 3.11Å; Y225-D233 VanDerWaalsContact O-OD2 3.12Å; Y225-E234 VanDerWaalsContact O-CG 3.28Å; Y225-E234 WeakPolarHBondContact O-CG 3.09Å
226	N	59.1	Low	64.8	Low	51 Å²	51	66.5 Å²	66.5	27%	0.273	35%	0.354	S	S	.	.			trans	-81.7	83.4	173.3	179.3	23.8	0	0	0	109.4	C228 D229 D230 W231	N226-C228 VanDerWaalsContact C-N 3.33Å; N226-D229 VanDerWaalsContact ND2-C 3.33Å; N226-D229 PolarHBondContact ND2-O 2.87Å; N226-D229 VanDerWaalsContact OD1-C 3.32Å; N226-D229 WeakPolarHBondContact OD1-CA 3.37Å; N226-D229 PolarHBondContact OD1-N 3.04Å; N226-D229 VanDerWaalsContact OD1-N 3.08Å; N226-D230 PolarHBondContact OD1-N 2.88Å; N226-W231 HydrophobicContact CB-CD2 3.93Å; N226-W231 HydrophobicContact CB-CG 4.15Å; N226-W231 HydrophobicContact CB-CZ2 4.17Å; N226-W231 VanDerWaalsContact CG-CD1 3.44Å; N226-W231 PolarHBondContact ND2-NE1 3.19Å; N226-W231 WeakPolarHBondContact OD1-CA 3.18Å; N226-W231 PolarHBondContact OD1-N 3.02Å
227	D	71.9	Confident	64.5	Low	57 Å²	57	67.3 Å²	67.3	31%	0.305	36%	0.36	S	S	.	.	S	Bend	trans	-83	-13.1	174.4	-66.7	-62.7	0	0	0	111.9	I216 L220 N223 Y225 D233	I216-D227 HydrophobicContact CD1-CB 4.27Å; I216-D227 HydrophobicContact CG2-CB 4.22Å; I216-D227 WeakPolarHBondContact CG2-O 3.35Å; L220-D227 HydrophobicContact CB-CB 4.33Å; L220-D227 WeakPolarHBondContact CB-OD2 3.34Å; L220-D227 HydrophobicContact CD1-CB 4.34Å; N223-D227 PolarHBondContact ND2-OD2 3.09Å; N223-D227 PolarHBondContact OD1-OD2 2.84Å; Y225-D227 PolarHBondContact O-N 3.05Å; Y225-D227 VanDerWaalsContact O-N 3.11Å; D227-D233 VanDerWaalsContact CA-OD2 3.29Å; D227-D233 WeakPolarHBondContact CA-OD2 3.25Å; D227-D233 VanDerWaalsContact CB-OD2 3.24Å; D227-D233 WeakPolarHBondContact CB-OD2 3.44Å; D227-D233 PolarHBondContact N-OD2 3.19Å
228	C	64.1	Low	63.9	Low	0 Å²	0	73.1 Å²	73.1	0%	0	39%	0.388	C	S	.	.	S	Bend	trans	-95.5	2.5	-178.7	-86.4	0	0	0	0	116	C210 S212 I216 N226 D230 D233	C210-C228 VanDerWaalsContact CA-SG 3.58Å; C210-C228 HydrophobicContact CB-CB 3.45Å; C210-C228 VanDerWaalsContact CB-CB 3.45Å; C210-C228 WeakPolarHBondContact CB-SG 3.18Å; C210-C228 WeakPolarHBondContact SG-CA 3.45Å; C210-C228 WeakPolarHBondContact SG-CB 3.33Å; C210-C228 CovalentContact SG-SG 2Å; C210-C228 PolarHBondContact SG-SG 2.91Å; S212-C228 PolarHBondContact OG-O 3.42Å; I216-C228 VanDerWaalsContact CD1-SG 3.58Å; N226-C228 VanDerWaalsContact C-N 3.33Å; C228-D230 VanDerWaalsContact CB-OD1 3.29Å; C228-D230 WeakPolarHBondContact CB-OD1 2.97Å; C228-D230 PolarHBondContact O-N 3.4Å; C228-D233 HydrophobicContact CB-CB 4.14Å; C228-D233 WeakPolarHBondContact CB-OD1 3.12Å; C228-D233 PolarHBondContact N-OD2 3.28Å; C228-D233 VanDerWaalsContact SG-CB 3.57Å
229	D	60.7	Low	63.8	Low	123 Å²	123	73.7 Å²	73.7	66%	0.658	39%	0.387	S	S	*	.	S	Bend	trans	58.8	-27.1	-169	-69	-31.4	0	0	0	115	I214 N226	I214-D229 HydrophobicContact CD1-CB 4.12Å; I214-D229 VanDerWaalsContact CD1-OD2 3.23Å; I214-D229 WeakPolarHBondContact CD1-OD2 3.43Å; N226-D229 VanDerWaalsContact ND2-C 3.33Å; N226-D229 PolarHBondContact ND2-O 2.87Å; N226-D229 VanDerWaalsContact OD1-C 3.32Å; N226-D229 WeakPolarHBondContact OD1-CA 3.37Å; N226-D229 PolarHBondContact OD1-N 3.04Å; N226-D229 VanDerWaalsContact OD1-N 3.08Å
230	D	59.4	Low	63.6	Low	61 Å²	61	69.7 Å²	69.7	33%	0.326	38%	0.38	S	S	.	.	S	Bend	trans	-110.2	12.3	-178.2	73.4	-8.9	0	0	0	114.4	A211 S212 N226 C228 S232	A211-D230 VanDerWaalsContact C-OD2 3.23Å; A211-D230 WeakPolarHBondContact CA-OD2 3.45Å; A211-D230 VanDerWaalsContact CB-OD2 3.32Å; A211-D230 WeakPolarHBondContact CB-OD2 3.45Å; A211-D230 PolarHBondContact N-OD2 2.96Å; S212-D230 WeakPolarHBondContact CB-OD2 3.07Å; S212-D230 PolarHBondContact N-OD2 3.41Å; N226-D230 PolarHBondContact OD1-N 2.88Å; C228-D230 VanDerWaalsContact CB-OD1 3.29Å; C228-D230 WeakPolarHBondContact CB-OD1 2.97Å; C228-D230 PolarHBondContact O-N 3.4Å; D230-S232 PolarHBondContact O-N 3.09Å; D230-S232 WeakPolarHBondContact OD1-CB 3.48Å; D230-S232 PolarHBondContact OD1-N 3.11Å; D230-S232 PolarHBondContact OD1-OG 3.44Å; D230-S232 PolarHBondContact OD2-OG 3.03Å
231	W	58.4	Low	63.2	Low	113 Å²	113	76.4 Å²	76.4	43%	0.428	41%	0.411	S	S	.	.	S	Bend	trans	61.5	13.2	-178.3	-70.4	76.6	0	0	0	115.5	N226 D233 E234 A235 K250	N226-W231 HydrophobicContact CB-CD2 3.93Å; N226-W231 HydrophobicContact CB-CG 4.15Å; N226-W231 HydrophobicContact CB-CZ2 4.17Å; N226-W231 VanDerWaalsContact CG-CD1 3.44Å; N226-W231 PolarHBondContact ND2-NE1 3.19Å; N226-W231 WeakPolarHBondContact OD1-CA 3.18Å; N226-W231 PolarHBondContact OD1-N 3.02Å; W231-D233 PolarHBondContact O-N 3.23Å; W231-E234 HydrophobicContact CE3-CB 4.07Å; W231-E234 HydrophobicContact CE3-CG 4.49Å; W231-E234 PolarHBondContact O-N 2.82Å; W231-E234 VanDerWaalsContact O-N 3.16Å; W231-A235 PolarHBondContact O-N 3Å; W231-K250 HydrophobicContact CZ3-CD 4.07Å
232	S	69.3	Low	62.7	Low	30 Å²	30	78.7 Å²	78.7	21%	0.21	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.8	-178.4	-71	0	0	0	0	114.3	A211 D230	A211-S232 WeakPolarHBondContact CB-OG 3.39Å; A211-S232 PolarHBondContact N-OG 3.1Å; A211-S232 VanDerWaalsContact N-OG 3.13Å; D230-S232 PolarHBondContact O-N 3.09Å; D230-S232 WeakPolarHBondContact OD1-CB 3.48Å; D230-S232 PolarHBondContact OD1-N 3.11Å; D230-S232 PolarHBondContact OD1-OG 3.44Å; D230-S232 PolarHBondContact OD2-OG 3.03Å
233	D	68.6	Low	63	Low	1 Å²	1	79.2 Å²	79.2	1%	0.005	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-24.6	176.6	49.4	-18.8	0	0	0	114.2	F208 I216 Q221 C222 Y225 D227 C228 W231	F208-D233 HydrophobicContact CE1-CB 4.31Å; I216-D233 HydrophobicContact CD1-CB 3.6Å; Q221-D233 WeakPolarHBondContact CG-O 3.47Å; C222-D233 PolarHBondContact N-O 3.16Å; C222-D233 VanDerWaalsContact N-O 3.17Å; Y225-D233 VanDerWaalsContact O-OD2 3.12Å; D227-D233 VanDerWaalsContact CA-OD2 3.29Å; D227-D233 WeakPolarHBondContact CA-OD2 3.25Å; D227-D233 VanDerWaalsContact CB-OD2 3.24Å; D227-D233 WeakPolarHBondContact CB-OD2 3.44Å; D227-D233 PolarHBondContact N-OD2 3.19Å; C228-D233 HydrophobicContact CB-CB 4.14Å; C228-D233 WeakPolarHBondContact CB-OD1 3.12Å; C228-D233 PolarHBondContact N-OD2 3.28Å; C228-D233 VanDerWaalsContact SG-CB 3.57Å; W231-D233 PolarHBondContact O-N 3.23Å
234	E	72.9	Confident	63.2	Low	18 Å²	18	78.8 Å²	78.8	8%	0.084	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-8.5	-175.4	-65.4	-60.1	135.9	0	0	113.6	C222 N223 G224 Y225 W231 H236 C237	C222-E234 VanDerWaalsContact C-OE1 3.23Å; C222-E234 WeakPolarHBondContact CA-OE1 3.33Å; C222-E234 WeakPolarHBondContact CA-OE2 3.49Å; C222-E234 PolarHBondContact N-OE1 3.08Å; N223-E234 PolarHBondContact N-OE1 2.63Å; N223-E234 PolarHBondContact OD1-OE1 2.89Å; G224-E234 WeakPolarHBondContact CA-OE2 3.08Å; G224-E234 PolarHBondContact N-OE1 3.32Å; G224-E234 VanDerWaalsContact N-OE1 3.07Å; G224-E234 PolarHBondContact N-OE2 2.68Å; Y225-E234 VanDerWaalsContact O-CG 3.28Å; Y225-E234 WeakPolarHBondContact O-CG 3.09Å; W231-E234 HydrophobicContact CE3-CB 4.07Å; W231-E234 HydrophobicContact CE3-CG 4.49Å; W231-E234 PolarHBondContact O-N 2.82Å; W231-E234 VanDerWaalsContact O-N 3.16Å; E234-H236 VanDerWaalsContact C-N 3.26Å; E234-H236 PolarHBondContact O-N 3.31Å; E234-C237 PolarHBondContact O-SG 3.3Å
235	A	62.5	Low	63.9	Low	50 Å²	50	81.7 Å²	81.7	41%	0.413	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.9	-171.7	0	0	0	0	0	115.3	W231	W231-A235 PolarHBondContact O-N 3Å
236	H	59.2	Low	64.8	Low	177 Å²	177	74 Å²	74	82%	0.819	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.8	53.7	-173.8	-75.8	73.3	0	0	0	112.9	E234	E234-H236 VanDerWaalsContact C-N 3.26Å; E234-H236 PolarHBondContact O-N 3.31Å
237	C	65.3	Low	65.2	Low	25 Å²	25	79.6 Å²	79.6	17%	0.169	41%	0.413	C	S	.	.			trans	-103.6	142.5	-175.5	-58.8	0	0	0	0	112.8	C222 E234	C222-C237 WeakPolarHBondContact CA-SG 3.31Å; C222-C237 HydrophobicContact CB-CB 3.67Å; C222-C237 WeakPolarHBondContact CB-SG 3.01Å; C222-C237 WeakPolarHBondContact SG-CA 3.44Å; C222-C237 WeakPolarHBondContact SG-CB 2.92Å; C222-C237 CovalentContact SG-SG 2.02Å; C222-C237 PolarHBondContact SG-SG 2.9Å; E234-C237 PolarHBondContact O-SG 3.3Å
238	N	60.5	Low	64.7	Low	170 Å²	170	80.1 Å²	80.1	91%	0.909	42%	0.418	S	S	*	.			trans	-99.2	115.1	178.4	-164.8	20.4	0	0	0	109.8
239	C	61.3	Low	64.6	Low	41 Å²	41	81 Å²	81	28%	0.277	43%	0.428	S	S	.	.			trans	-95.9	146.3	-164.8	-58.4	0	0	0	0	114.3	C251	C239-C251 HydrophobicContact CB-CB 3.77Å; C239-C251 WeakPolarHBondContact CB-SG 2.73Å; C239-C251 WeakPolarHBondContact SG-CB 3.45Å; C239-C251 CovalentContact SG-SG 1.96Å; C239-C251 PolarHBondContact SG-SG 3.07Å
240	S	61.4	Low	64.9	Low	87 Å²	87	77.6 Å²	77.6	61%	0.608	41%	0.407	S	S	*	.			trans	-77.7	150.4	179.1	-163.9	0	0	0	0	111	N242 L243	S240-N242 PolarHBondContact O-N 2.99Å; S240-L243 PolarHBondContact O-N 3.24Å
241	E	57	Low	65.5	Low	187 Å²	187	76.6 Å²	76.6	87%	0.874	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-3.4	-169.4	-66.8	-157.7	156.1	0	0	116.8
242	N	61.7	Low	65.9	Low	133 Å²	133	72.2 Å²	72.2	71%	0.711	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	11.6	-178.7	-67.3	-31.6	0	0	0	114.2	S240	S240-N242 PolarHBondContact O-N 2.99Å
243	L	70.3	Confident	65.9	Low	70 Å²	70	75 Å²	75	37%	0.366	40%	0.402	S	S	.	.	S	Bend	trans	-119.7	142.8	180	-69.3	156.2	0	0	0	109.7	S240 C251 L252 N253	S240-L243 PolarHBondContact O-N 3.24Å; L243-C251 HydrophobicContact CB-CB 4.32Å; L243-L252 CarbonylContact C-O 3.04Å; L243-L252 WeakPolarHBondContact CA-O 3.05Å; L243-L252 WeakPolarHBondContact CD2-O 3.45Å; L243-N253 HydrophobicContact CD2-CB 4.49Å
244	F	69.9	Low	65.7	Low	46 Å²	46	81.9 Å²	81.9	20%	0.202	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	128.4	174.4	-179.5	-98.9	0	0	0	110	C251 L252 Y254 V257 S268 D269	F244-C251 CarbonylContact O-C 3.48Å; F244-C251 WeakPolarHBondContact O-CA 3.05Å; F244-L252 HydrophobicContact CB-CB 4.45Å; F244-L252 HydrophobicContact CD1-CB 4.49Å; F244-L252 PolarHBondContact N-O 2.88Å; F244-L252 PolarHBondContact O-N 3.42Å; F244-Y254 HydrophobicContact CB-CD1 4.4Å; F244-Y254 HydrophobicContact CB-CE1 4.34Å; F244-Y254 HydrophobicContact CD2-CE1 4.2Å; F244-V257 HydrophobicContact CB-CG2 3.61Å; F244-V257 HydrophobicContact CD1-CG2 3.76Å; F244-V257 HydrophobicContact CD2-CG1 4.41Å; F244-V257 HydrophobicContact CD2-CG2 4.03Å; F244-V257 HydrophobicContact CE1-CG2 4.42Å; F244-V257 HydrophobicContact CE2-CG1 4.4Å; F244-V257 HydrophobicContact CG-CG2 3.52Å; F244-S268 WeakPolarHBondContact CZ-O 3.24Å; F244-D269 HydrophobicContact CE1-CB 4.13Å
245	H	72.1	Confident	65.1	Low	113 Å²	113	85 Å²	85	52%	0.523	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	112	-176.4	179.2	-81.2	0	0	0	110.5
246	C	74.4	Confident	65.1	Low	0 Å²	0	85.7 Å²	85.7	0%	0	45%	0.449	C	S	.	.			trans	-64.8	152.3	173.9	-83.4	0	0	0	0	113	T248 G249 K250 L252 C264	C246-T248 WeakPolarHBondContact CB-OG1 3.3Å; C246-T248 PolarHBondContact O-N 3.5Å; C246-G249 PolarHBondContact O-N 3.24Å; C246-K250 HydrophobicContact CB-CB 3.86Å; C246-K250 WeakPolarHBondContact CB-O 3.42Å; C246-K250 PolarHBondContact N-O 2.72Å; C246-L252 VanDerWaalsContact SG-CD1 3.52Å; C246-C264 WeakPolarHBondContact CA-SG 3.49Å; C246-C264 HydrophobicContact CB-CB 4.31Å; C246-C264 WeakPolarHBondContact CB-SG 3.4Å; C246-C264 VanDerWaalsContact SG-CA 3.51Å; C246-C264 WeakPolarHBondContact SG-CB 3.43Å; C246-C264 CovalentContact SG-SG 2.01Å; C246-C264 PolarHBondContact SG-SG 3.47Å
247	H	67.8	Low	65.4	Low	169 Å²	169	78.7 Å²	78.7	78%	0.782	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-25.7	171.4	-96	76.6	0	0	0	112.6	G249 D266 S268	H247-G249 PolarHBondContact O-N 2.02Å; H247-D266 WeakPolarHBondContact CB-OD2 3.31Å; H247-S268 WeakPolarHBondContact CB-OG 3.11Å
248	T	61.8	Low	65.2	Low	68 Å²	68	78.8 Å²	78.8	42%	0.417	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-6.5	170.1	52.6	0	0	0	0	114.5	C246 C264 D266	C246-T248 WeakPolarHBondContact CB-OG1 3.3Å; C246-T248 PolarHBondContact O-N 3.5Å; T248-C264 PolarHBondContact OG1-O 2.96Å; T248-D266 HydrophobicContact CG2-CB 3.69Å; T248-D266 VanDerWaalsContact CG2-OD2 3.26Å; T248-D266 WeakPolarHBondContact CG2-OD2 3.49Å; T248-D266 PolarHBondContact N-OD2 3.17Å; T248-D266 VanDerWaalsContact N-OD2 3.13Å
249	G	62.7	Low	65	Low	19 Å²	19	73.7 Å²	73.7	20%	0.196	39%	0.392	C	S	.	.	S	Bend	trans	86	3.7	-178.1	0	0	0	0	0	114.9	C246 H247	C246-G249 PolarHBondContact O-N 3.24Å; H247-G249 PolarHBondContact O-N 2.02Å
250	K	65.6	Low	64.7	Low	51 Å²	51	74.5 Å²	74.5	22%	0.222	41%	0.407	C	S	.	.			trans	-74.1	157.4	170.1	-65.6	-177.1	-178.4	178.8	0	111.7	W231 C246	W231-K250 HydrophobicContact CZ3-CD 4.07Å; C246-K250 HydrophobicContact CB-CB 3.86Å; C246-K250 WeakPolarHBondContact CB-O 3.42Å; C246-K250 PolarHBondContact N-O 2.72Å
251	C	72.4	Confident	64.4	Low	41 Å²	41	78.2 Å²	78.2	28%	0.277	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	114.7	179.2	-67.2	0	0	0	0	112.1	C239 L243 F244	C239-C251 HydrophobicContact CB-CB 3.77Å; C239-C251 WeakPolarHBondContact CB-SG 2.73Å; C239-C251 WeakPolarHBondContact SG-CB 3.45Å; C239-C251 CovalentContact SG-SG 1.96Å; C239-C251 PolarHBondContact SG-SG 3.07Å; L243-C251 HydrophobicContact CB-CB 4.32Å; F244-C251 CarbonylContact O-C 3.48Å; F244-C251 WeakPolarHBondContact O-CA 3.05Å
252	L	67.2	Low	64.8	Low	21 Å²	21	72.6 Å²	72.6	11%	0.11	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	155.1	-174.7	-62.9	174.9	0	0	0	110.3	L243 F244 C246 D263 C264 D269	L243-L252 CarbonylContact C-O 3.04Å; L243-L252 WeakPolarHBondContact CA-O 3.05Å; L243-L252 WeakPolarHBondContact CD2-O 3.45Å; F244-L252 HydrophobicContact CB-CB 4.45Å; F244-L252 HydrophobicContact CD1-CB 4.49Å; F244-L252 PolarHBondContact N-O 2.88Å; F244-L252 PolarHBondContact O-N 3.42Å; C246-L252 VanDerWaalsContact SG-CD1 3.52Å; L252-D263 HydrophobicContact CD1-CB 3.94Å; L252-D263 HydrophobicContact CD2-CB 4.04Å; L252-C264 HydrophobicContact CD1-CB 4.03Å; L252-D269 HydrophobicContact CD1-CB 3.82Å
253	N	68.5	Low	65.3	Low	88 Å²	88	69.1 Å²	69.1	47%	0.471	37%	0.366	S	S	.	.			trans	-77.2	144	168.3	-166.9	-21.5	0	0	0	108.7	L243 S255 L256	L243-N253 HydrophobicContact CD2-CB 4.49Å; N253-S255 PolarHBondContact O-N 3.44Å; N253-L256 WeakPolarHBondContact O-CB 3.29Å; N253-L256 PolarHBondContact O-N 2.74Å
254	Y	64.6	Low	65.3	Low	146 Å²	146	65.8 Å²	65.8	57%	0.573	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-56.4	-14.1	175.6	-80.7	-75.2	0	0	0	114.3	F244 L256	F244-Y254 HydrophobicContact CB-CD1 4.4Å; F244-Y254 HydrophobicContact CB-CE1 4.34Å; F244-Y254 HydrophobicContact CD2-CE1 4.2Å; Y254-L256 VanDerWaalsContact C-N 3.31Å
255	S	61.3	Low	65	Low	82 Å²	82	66.1 Å²	66.1	57%	0.573	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-75.6	-16	171.9	60.4	0	0	0	0	115	N253	N253-S255 PolarHBondContact O-N 3.44Å
256	L	62	Low	64.8	Low	66 Å²	66	63.2 Å²	63.2	35%	0.346	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-108.6	25.9	179	-60.3	173.1	0	0	0	110.1	N253 Y254	N253-L256 WeakPolarHBondContact O-CB 3.29Å; N253-L256 PolarHBondContact O-N 2.74Å; Y254-L256 VanDerWaalsContact C-N 3.31Å
257	V	66.6	Low	64.3	Low	30 Å²	30	67.6 Å²	67.6	18%	0.182	38%	0.376	C	S	.	.	S	Bend	trans	-117.9	124.9	176.8	178.5	0	0	0	0	104.6	F244 D269	F244-V257 HydrophobicContact CB-CG2 3.61Å; F244-V257 HydrophobicContact CD1-CG2 3.76Å; F244-V257 HydrophobicContact CD2-CG1 4.41Å; F244-V257 HydrophobicContact CD2-CG2 4.03Å; F244-V257 HydrophobicContact CE1-CG2 4.42Å; F244-V257 HydrophobicContact CE2-CG1 4.4Å; F244-V257 HydrophobicContact CG-CG2 3.52Å; V257-D269 WeakPolarHBondContact CG1-O 3.4Å
258	C	60.5	Low	64.7	Low	26 Å²	26	60.4 Å²	60.4	18%	0.176	35%	0.345	C	S	.	.	S	Bend	trans	64.8	35.4	-175.3	-53.7	0	0	0	0	114.5	D269 E270 C273 Q278	C258-D269 PolarHBondContact N-O 2.71Å; C258-E270 VanDerWaalsContact C-OE1 3.31Å; C258-E270 WeakPolarHBondContact CA-OE1 3.29Å; C258-E270 PolarHBondContact N-OE1 3.06Å; C258-E270 VanDerWaalsContact N-OE1 3.16Å; C258-C273 WeakPolarHBondContact CA-SG 3.24Å; C258-C273 HydrophobicContact CB-CB 3.56Å; C258-C273 WeakPolarHBondContact CB-SG 3.35Å; C258-C273 VanDerWaalsContact SG-CA 3.59Å; C258-C273 WeakPolarHBondContact SG-CB 3.49Å; C258-C273 CovalentContact SG-SG 2Å; C258-C273 PolarHBondContact SG-SG 2.99Å; C258-Q278 PolarHBondContact O-NE2 2.68Å
259	D	56.5	Low	65.2	Low	64 Å²	64	57.1 Å²	57.1	34%	0.342	33%	0.325	S	S	.	.	S	Bend	trans	-97	1.2	176.6	81.2	-6.8	0	0	0	113.2	Y261 E270	D259-Y261 PolarHBondContact OD1-N 2.03Å; D259-Y261 VanDerWaalsContact OD1-N 3.09Å; D259-E270 PolarHBondContact N-OE1 2.83Å
260	G	55	Low	65.7	Low	57 Å²	57	58.5 Å²	58.5	59%	0.588	33%	0.326	S	S	*	.	S	Bend	trans	90	6.9	176.4	0	0	0	0	0	113.8	E270	G260-E270 WeakPolarHBondContact CA-OE2 3.19Å; G260-E270 VanDerWaalsContact N-CD 3.3Å; G260-E270 PolarHBondContact N-OE1 3.08Å; G260-E270 PolarHBondContact N-OE2 2.64Å
261	Y	53.9	Low	65.8	Low	166 Å²	166	62.5 Å²	62.5	65%	0.651	35%	0.345	S	S	*	.	S	Bend	trans	-120.3	142.3	177.5	-63.9	-83.2	0	0	0	111	D259 D263 E270	D259-Y261 PolarHBondContact OD1-N 2.03Å; D259-Y261 VanDerWaalsContact OD1-N 3.09Å; Y261-D263 VanDerWaalsContact C-N 3.31Å; Y261-D263 PolarHBondContact O-N 3.47Å; Y261-D263 VanDerWaalsContact O-N 3.07Å; Y261-E270 VanDerWaalsContact O-CG 3.25Å; Y261-E270 WeakPolarHBondContact O-CG 3.24Å
262	D	66.6	Low	65.1	Low	69 Å²	69	68.7 Å²	68.7	37%	0.369	38%	0.376	S	S	.	.			trans	-82	76.7	174.5	-177.7	16.4	0	0	0	110	G265 D266 L267	D262-G265 VanDerWaalsContact OD1-CA 3.25Å; D262-G265 WeakPolarHBondContact OD1-CA 3.47Å; D262-G265 PolarHBondContact OD1-N 3.21Å; D262-G265 VanDerWaalsContact OD2-C 3.29Å; D262-G265 WeakPolarHBondContact OD2-CA 3.29Å; D262-D266 PolarHBondContact OD1-N 3.35Å; D262-D266 VanDerWaalsContact OD1-N 3.14Å; D262-L267 HydrophobicContact CB-CD2 3.74Å; D262-L267 HydrophobicContact CB-CG 4.21Å; D262-L267 WeakPolarHBondContact OD1-CA 3.18Å; D262-L267 PolarHBondContact OD1-N 3.37Å
263	D	71.8	Confident	64.9	Low	59 Å²	59	70 Å²	70	32%	0.316	39%	0.387	S	S	.	.	S	Bend	trans	-73	-22.9	176.6	-68.4	-43.1	0	0	0	111.4	L252 Y261 D269	L252-D263 HydrophobicContact CD1-CB 3.94Å; L252-D263 HydrophobicContact CD2-CB 4.04Å; Y261-D263 VanDerWaalsContact C-N 3.31Å; Y261-D263 PolarHBondContact O-N 3.47Å; Y261-D263 VanDerWaalsContact O-N 3.07Å; D263-D269 WeakPolarHBondContact CA-OD2 3.37Å; D263-D269 VanDerWaalsContact CB-OD2 3.27Å; D263-D269 WeakPolarHBondContact CB-OD2 3.47Å; D263-D269 PolarHBondContact N-OD2 2.83Å
264	C	70.7	Confident	64.3	Low	0 Å²	0	69.7 Å²	69.7	0%	0	40%	0.396	C	S	.	.	S	Bend	trans	-78.5	-26	179.5	-156.8	0	0	0	0	113.1	C246 T248 L252 D266 D269	C246-C264 WeakPolarHBondContact CA-SG 3.49Å; C246-C264 HydrophobicContact CB-CB 4.31Å; C246-C264 WeakPolarHBondContact CB-SG 3.4Å; C246-C264 VanDerWaalsContact SG-CA 3.51Å; C246-C264 WeakPolarHBondContact SG-CB 3.43Å; C246-C264 CovalentContact SG-SG 2.01Å; C246-C264 PolarHBondContact SG-SG 3.47Å; T248-C264 PolarHBondContact OG1-O 2.96Å; L252-C264 HydrophobicContact CD1-CB 4.03Å; C264-D266 PolarHBondContact O-N 2.96Å; C264-D266 PolarHBondContact SG-OD1 3.06Å; C264-D269 HydrophobicContact CB-CB 4.04Å; C264-D269 VanDerWaalsContact CB-CG 3.45Å; C264-D269 VanDerWaalsContact CB-OD1 3.24Å; C264-D269 WeakPolarHBondContact CB-OD1 3.08Å; C264-D269 PolarHBondContact N-OD2 2.96Å
265	G	62.5	Low	63.9	Low	53 Å²	53	64 Å²	64	55%	0.546	38%	0.377	S	S	.	.	S	Bend	trans	77.4	0.1	-175.6	0	0	0	0	0	114.5	D262	D262-G265 VanDerWaalsContact OD1-CA 3.25Å; D262-G265 WeakPolarHBondContact OD1-CA 3.47Å; D262-G265 PolarHBondContact OD1-N 3.21Å; D262-G265 VanDerWaalsContact OD2-C 3.29Å; D262-G265 WeakPolarHBondContact OD2-CA 3.29Å
266	D	69.4	Low	63	Low	52 Å²	52	68.9 Å²	68.9	28%	0.278	39%	0.39	S	S	.	.	S	Bend	trans	-131.3	10.9	176.7	71.6	-0.1	0	0	0	113.1	H247 T248 D262 C264 S268	H247-D266 WeakPolarHBondContact CB-OD2 3.31Å; T248-D266 HydrophobicContact CG2-CB 3.69Å; T248-D266 VanDerWaalsContact CG2-OD2 3.26Å; T248-D266 WeakPolarHBondContact CG2-OD2 3.49Å; T248-D266 PolarHBondContact N-OD2 3.17Å; T248-D266 VanDerWaalsContact N-OD2 3.13Å; D262-D266 PolarHBondContact OD1-N 3.35Å; D262-D266 VanDerWaalsContact OD1-N 3.14Å; C264-D266 PolarHBondContact O-N 2.96Å; C264-D266 PolarHBondContact SG-OD1 3.06Å; D266-S268 PolarHBondContact O-N 2.01Å; D266-S268 WeakPolarHBondContact OD1-CB 3.26Å; D266-S268 PolarHBondContact OD1-N 3.17Å; D266-S268 PolarHBondContact OD1-OG 3.22Å; D266-S268 PolarHBondContact OD2-OG 2.86Å; D266-S268 VanDerWaalsContact OD2-OG 3.08Å
267	L	62.9	Low	62.4	Low	93 Å²	93	70.9 Å²	70.9	49%	0.487	41%	0.41	S	S	.	.	S	Bend	trans	60.5	18.7	-176.9	-65.4	155.6	0	0	0	114.8	D262 D269 E270 Q271	D262-L267 HydrophobicContact CB-CD2 3.74Å; D262-L267 HydrophobicContact CB-CG 4.21Å; D262-L267 WeakPolarHBondContact OD1-CA 3.18Å; D262-L267 PolarHBondContact OD1-N 3.37Å; L267-D269 VanDerWaalsContact C-N 3.31Å; L267-D269 PolarHBondContact O-N 2.81Å; L267-E270 HydrophobicContact CD2-CB 4.39Å; L267-E270 PolarHBondContact O-N 3.12Å; L267-Q271 WeakPolarHBondContact O-CG 3.43Å; L267-Q271 PolarHBondContact O-N 3.01Å; L267-Q271 PolarHBondContact O-NE2 3.13Å
268	S	76.3	Confident	61.5	Low	17 Å²	17	74.5 Å²	74.5	12%	0.119	43%	0.425	C	S	.	.	S	Bend	trans	-70.2	-28.6	-179.7	-61.5	0	0	0	0	113.5	F244 H247 D266 E270	F244-S268 WeakPolarHBondContact CZ-O 3.24Å; H247-S268 WeakPolarHBondContact CB-OG 3.11Å; D266-S268 PolarHBondContact O-N 2.01Å; D266-S268 WeakPolarHBondContact OD1-CB 3.26Å; D266-S268 PolarHBondContact OD1-N 3.17Å; D266-S268 PolarHBondContact OD1-OG 3.22Å; D266-S268 PolarHBondContact OD2-OG 2.86Å; D266-S268 VanDerWaalsContact OD2-OG 3.08Å; S268-E270 VanDerWaalsContact C-N 3.34Å
269	D	72.4	Confident	61.1	Low	0 Å²	0	76.4 Å²	76.4	0%	0	45%	0.449	C	S	.	.	S	Bend	trans	-74.4	-21.5	175.6	53.6	-21.9	0	0	0	113.7	F244 L252 V257 C258 D263 C264 L267	F244-D269 HydrophobicContact CE1-CB 4.13Å; L252-D269 HydrophobicContact CD1-CB 3.82Å; V257-D269 WeakPolarHBondContact CG1-O 3.4Å; C258-D269 PolarHBondContact N-O 2.71Å; D263-D269 WeakPolarHBondContact CA-OD2 3.37Å; D263-D269 VanDerWaalsContact CB-OD2 3.27Å; D263-D269 WeakPolarHBondContact CB-OD2 3.47Å; D263-D269 PolarHBondContact N-OD2 2.83Å; C264-D269 HydrophobicContact CB-CB 4.04Å; C264-D269 VanDerWaalsContact CB-CG 3.45Å; C264-D269 VanDerWaalsContact CB-OD1 3.24Å; C264-D269 WeakPolarHBondContact CB-OD1 3.08Å; C264-D269 PolarHBondContact N-OD2 2.96Å; L267-D269 VanDerWaalsContact C-N 3.31Å; L267-D269 PolarHBondContact O-N 2.81Å
270	E	73.9	Confident	61.2	Low	48 Å²	48	75.7 Å²	75.7	22%	0.224	45%	0.445	C	S	.	.	S	Bend	trans	-103.7	7	179.5	-67	-60.2	136.1	0	0	113.2	C258 D259 G260 Y261 L267 S268	C258-E270 VanDerWaalsContact C-OE1 3.31Å; C258-E270 WeakPolarHBondContact CA-OE1 3.29Å; C258-E270 PolarHBondContact N-OE1 3.06Å; C258-E270 VanDerWaalsContact N-OE1 3.16Å; D259-E270 PolarHBondContact N-OE1 2.83Å; G260-E270 WeakPolarHBondContact CA-OE2 3.19Å; G260-E270 VanDerWaalsContact N-CD 3.3Å; G260-E270 PolarHBondContact N-OE1 3.08Å; G260-E270 PolarHBondContact N-OE2 2.64Å; Y261-E270 VanDerWaalsContact O-CG 3.25Å; Y261-E270 WeakPolarHBondContact O-CG 3.24Å; L267-E270 HydrophobicContact CD2-CB 4.39Å; L267-E270 PolarHBondContact O-N 3.12Å; S268-E270 VanDerWaalsContact C-N 3.34Å
271	Q	66	Low	61.4	Low	134 Å²	134	75 Å²	75	63%	0.626	43%	0.429	S	S	*	.	S	Bend	trans	-93	130.7	174.7	-83.8	173.6	46.6	0	0	111.5	L267	L267-Q271 WeakPolarHBondContact O-CG 3.43Å; L267-Q271 PolarHBondContact O-N 3.01Å; L267-Q271 PolarHBondContact O-NE2 3.13Å
272	N	59.6	Low	61.7	Low	171 Å²	171	73.3 Å²	73.3	91%	0.914	43%	0.427	S	S	*	.	S	Bend	trans	78	40.7	170.8	-152.8	34.6	0	0	0	116.3
273	C	62.5	Low	61.8	Low	50 Å²	50	70.4 Å²	70.4	34%	0.338	41%	0.412	S	S	.	.			trans	-90	126.1	178.1	-50.3	0	0	0	0	111.8	C258	C258-C273 WeakPolarHBondContact CA-SG 3.24Å; C258-C273 HydrophobicContact CB-CB 3.56Å; C258-C273 WeakPolarHBondContact CB-SG 3.35Å; C258-C273 VanDerWaalsContact SG-CA 3.59Å; C258-C273 WeakPolarHBondContact SG-CB 3.49Å; C258-C273 CovalentContact SG-SG 2Å; C258-C273 PolarHBondContact SG-SG 2.99Å
274	A	55.8	Low	61.5	Low	80 Å²	80	77.1 Å²	77.1	66%	0.661	43%	0.433	S	S	*	.			trans	-102.1	128.3	177.4	0	0	0	0	0	111.4	H276 S277	A274-H276 VanDerWaalsContact C-N 3.32Å; A274-H276 PolarHBondContact O-N 3.49Å; A274-H276 VanDerWaalsContact O-N 3.17Å; A274-S277 PolarHBondContact O-OG 3.23Å
275	C	55.7	Low	60.9	Low	27 Å²	27	80.9 Å²	80.9	18%	0.182	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-72.2	-13.2	-161.7	-63.1	0	0	0	0	117.2	S277 Q278 C288	C275-S277 VanDerWaalsContact C-N 3.26Å; C275-S277 PolarHBondContact O-N 3.36Å; C275-Q278 PolarHBondContact O-N 2.75Å; C275-C288 HydrophobicContact CB-CB 3.69Å; C275-C288 WeakPolarHBondContact CB-SG 3.06Å; C275-C288 WeakPolarHBondContact SG-CB 3.29Å; C275-C288 CovalentContact SG-SG 1.98Å; C275-C288 PolarHBondContact SG-SG 2.82Å
276	H	43.6	Very low	60.7	Low	184 Å²	184	80.2 Å²	80.2	85%	0.852	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-70.3	-19.4	-175.4	-155.5	64	0	0	0	113.9	A274 Q278	A274-H276 VanDerWaalsContact C-N 3.32Å; A274-H276 PolarHBondContact O-N 3.49Å; A274-H276 VanDerWaalsContact O-N 3.17Å; H276-Q278 VanDerWaalsContact C-N 3.32Å; H276-Q278 PolarHBondContact O-N 3.07Å
277	S	48.3	Very low	60.2	Low	108 Å²	108	80.9 Å²	80.9	76%	0.755	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-81.9	-6.3	178.7	51.3	0	0	0	0	114.5	A274 C275	A274-S277 PolarHBondContact O-OG 3.23Å; C275-S277 VanDerWaalsContact C-N 3.26Å; C275-S277 PolarHBondContact O-N 3.36Å
278	Q	47.7	Very low	60.3	Low	106 Å²	106	78.2 Å²	78.2	50%	0.495	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-111.6	0.9	-175.2	-65.3	-172.7	-6.2	0	0	114.3	C258 C275 H276 L280	C258-Q278 PolarHBondContact O-NE2 2.68Å; C275-Q278 PolarHBondContact O-N 2.75Å; H276-Q278 VanDerWaalsContact C-N 3.32Å; H276-Q278 PolarHBondContact O-N 3.07Å; Q278-L280 VanDerWaalsContact C-N 3.28Å; Q278-L280 HydrophobicContact CB-CD1 3.74Å; Q278-L280 HydrophobicContact CB-CG 4.3Å; Q278-L280 PolarHBondContact O-N 2.89Å
279	G	52	Low	59.6	Low	66 Å²	66	77.9 Å²	77.9	68%	0.68	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	19.1	179.3	0	0	0	0	0	114.7
280	L	58	Low	59	Low	50 Å²	50	80.2 Å²	80.2	26%	0.262	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-97.3	155.3	178	-64.1	155.7	0	0	0	110.4	Q278 C288 P290	Q278-L280 VanDerWaalsContact C-N 3.28Å; Q278-L280 HydrophobicContact CB-CD1 3.74Å; Q278-L280 HydrophobicContact CB-CG 4.3Å; Q278-L280 PolarHBondContact O-N 2.89Å; L280-C288 HydrophobicContact CB-CB 4.37Å; L280-P290 HydrophobicContact CD2-CB 4.29Å; L280-P290 HydrophobicContact CD2-CG 3.93Å
281	V	60.5	Low	58.2	Low	43 Å²	43	81.7 Å²	81.7	26%	0.261	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135	177.4	-179	0	0	0	0	109.4	C288 I289	V281-C288 WeakPolarHBondContact O-CA 3.05Å; V281-I289 HydrophobicContact CB-CG1 4.46Å; V281-I289 PolarHBondContact N-O 3.2Å; V281-I289 PolarHBondContact O-N 2.96Å
282	E	60.2	Low	57.7	Low	130 Å²	130	80 Å²	80	61%	0.607	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	116.4	-179	-168.1	178.6	169.1	0	0	110	Q287	E282-Q287 CarbonylContact C-O 3.51Å
283	C	68.3	Low	57.8	Low	7 Å²	7	75.9 Å²	75.9	5%	0.047	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-59.1	159.6	168.2	-57.1	0	0	0	0	109.9	N285 G286 Q287 C301	C283-N285 WeakPolarHBondContact CB-OD1 3.36Å; C283-N285 PolarHBondContact O-N 2.9Å; C283-N285 VanDerWaalsContact O-N 3.08Å; C283-G286 PolarHBondContact O-N 3.26Å; C283-Q287 HydrophobicContact CB-CB 4.1Å; C283-Q287 VanDerWaalsContact CB-O 3.27Å; C283-Q287 WeakPolarHBondContact CB-O 3.4Å; C283-Q287 PolarHBondContact N-O 2.88Å; C283-Q287 PolarHBondContact SG-O 3.3Å; C283-Q287 VanDerWaalsContact SG-O 3.37Å; C283-C301 HydrophobicContact CB-CB 3.9Å; C283-C301 WeakPolarHBondContact CB-SG 3.28Å; C283-C301 WeakPolarHBondContact SG-CB 3.33Å; C283-C301 CovalentContact SG-SG 2.04Å; C283-C301 PolarHBondContact SG-SG 2.92Å
284	R	66	Low	57.8	Low	201 Å²	201	78.1 Å²	78.1	76%	0.758	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.7	-177.7	-172.8	-179.2	-87.2	159.6	-1.1	113.1	S305 E308	R284-S305 PolarHBondContact N-OG 3.29Å; R284-E308 IonicContact NH1-OE2 3.93Å
285	N	56.9	Low	58.1	Low	79 Å²	79	77.2 Å²	77.2	42%	0.422	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	2.5	175.3	69	6.7	0	0	0	114.9	C283 Q287 D303	C283-N285 WeakPolarHBondContact CB-OD1 3.36Å; C283-N285 PolarHBondContact O-N 2.9Å; C283-N285 VanDerWaalsContact O-N 3.08Å; N285-Q287 WeakPolarHBondContact OD1-CB 3.25Å; N285-Q287 PolarHBondContact OD1-N 2.8Å; N285-D303 PolarHBondContact N-OD2 3.31Å
286	G	59.1	Low	58.2	Low	39 Å²	39	79.4 Å²	79.4	40%	0.402	44%	0.441	S	S	.	.	S	Bend	trans	83.6	6.3	-177.7	0	0	0	0	0	114.9	C283	C283-G286 PolarHBondContact O-N 3.26Å
287	Q	58	Low	58.8	Low	66 Å²	66	73.3 Å²	73.3	31%	0.308	43%	0.428	S	S	.	.			trans	-75.8	145.4	169.2	-175.4	-179.7	-18.3	0	0	109.8	E282 C283 N285	E282-Q287 CarbonylContact C-O 3.51Å; C283-Q287 HydrophobicContact CB-CB 4.1Å; C283-Q287 VanDerWaalsContact CB-O 3.27Å; C283-Q287 WeakPolarHBondContact CB-O 3.4Å; C283-Q287 PolarHBondContact N-O 2.88Å; C283-Q287 PolarHBondContact SG-O 3.3Å; C283-Q287 VanDerWaalsContact SG-O 3.37Å; N285-Q287 WeakPolarHBondContact OD1-CB 3.25Å; N285-Q287 PolarHBondContact OD1-N 2.8Å
288	C	65	Low	59.1	Low	37 Å²	37	73.3 Å²	73.3	25%	0.25	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	120.5	-172.4	-57.7	0	0	0	0	110.8	C275 L280 V281	C275-C288 HydrophobicContact CB-CB 3.69Å; C275-C288 WeakPolarHBondContact CB-SG 3.06Å; C275-C288 WeakPolarHBondContact SG-CB 3.29Å; C275-C288 CovalentContact SG-SG 1.98Å; C275-C288 PolarHBondContact SG-SG 2.82Å; L280-C288 HydrophobicContact CB-CB 4.37Å; V281-C288 WeakPolarHBondContact O-CA 3.05Å
289	I	62.3	Low	59.7	Low	9 Å²	9	76.2 Å²	76.2	5%	0.046	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	148.2	-175	56	157.9	0	0	0	110.6	V281 F293 C301 D306	V281-I289 HydrophobicContact CB-CG1 4.46Å; V281-I289 PolarHBondContact N-O 3.2Å; V281-I289 PolarHBondContact O-N 2.96Å; I289-F293 WeakPolarHBondContact CD1-O 3.43Å; I289-C301 VanDerWaalsContact CD1-SG 3.51Å; I289-D306 HydrophobicContact CD1-CB 3.68Å
290	P	59.5	Low	60.5	Low	50 Å²	50	76.2 Å²	76.2	33%	0.325	42%	0.417	S	S	.	.			trans	-55.8	142.3	169.7	-26	34.1	0	0	0	112.9	L280 T292 F293	L280-P290 HydrophobicContact CD2-CB 4.29Å; L280-P290 HydrophobicContact CD2-CG 3.93Å; P290-T292 PolarHBondContact O-N 3.22Å; P290-F293 HydrophobicContact CB-CD2 4.01Å; P290-F293 HydrophobicContact CB-CE2 4.25Å; P290-F293 HydrophobicContact CB-CG 4.49Å; P290-F293 HydrophobicContact CG-CD2 3.77Å; P290-F293 HydrophobicContact CG-CE2 3.78Å; P290-F293 PolarHBondContact O-N 3.48Å
291	S	56.4	Low	61	Low	79 Å²	79	73.9 Å²	73.9	55%	0.552	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-8.3	179.6	65.1	0	0	0	0	114.8
292	T	57.1	Low	61.1	Low	98 Å²	98	80.9 Å²	80.9	60%	0.601	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-18.2	175.6	48.3	0	0	0	0	113.4	P290 Q294	P290-T292 PolarHBondContact O-N 3.22Å; T292-Q294 VanDerWaalsContact C-N 3.28Å
293	F	61	Low	61.3	Low	85 Å²	85	77.9 Å²	77.9	37%	0.373	42%	0.42	S	S	.	.	S	Bend	trans	-99.7	34.4	179.1	-58.4	-27.5	0	0	0	110.8	I289 P290 D296 D300	I289-F293 WeakPolarHBondContact CD1-O 3.43Å; P290-F293 HydrophobicContact CB-CD2 4.01Å; P290-F293 HydrophobicContact CB-CE2 4.25Å; P290-F293 HydrophobicContact CB-CG 4.49Å; P290-F293 HydrophobicContact CG-CD2 3.77Å; P290-F293 HydrophobicContact CG-CE2 3.78Å; P290-F293 PolarHBondContact O-N 3.48Å; F293-D296 WeakPolarHBondContact CD1-OD2 3.34Å; F293-D300 HydrophobicContact CB-CB 4.3Å; F293-D300 WeakPolarHBondContact CB-OD2 3.25Å
294	Q	62.6	Low	61.1	Low	96 Å²	96	78 Å²	78	45%	0.449	42%	0.422	S	S	.	.	S	Bend	trans	-119.2	116.2	174.1	-178.9	167.6	50.8	0	0	106	T292	T292-Q294 VanDerWaalsContact C-N 3.28Å
295	C	61.4	Low	61.4	Low	62 Å²	62	69.4 Å²	69.4	42%	0.419	39%	0.393	S	S	.	.	S	Bend	trans	67	37.4	-176.8	-53.2	0	0	0	0	114.4	D306 E307 C310	C295-D306 PolarHBondContact N-O 3Å; C295-E307 VanDerWaalsContact C-OE1 3.28Å; C295-E307 WeakPolarHBondContact CA-OE1 3.38Å; C295-E307 PolarHBondContact N-OE1 2.9Å; C295-C310 WeakPolarHBondContact CA-SG 3.11Å; C295-C310 HydrophobicContact CB-CB 3.67Å; C295-C310 WeakPolarHBondContact CB-SG 3Å; C295-C310 VanDerWaalsContact SG-CA 3.53Å; C295-C310 WeakPolarHBondContact SG-CB 3.46Å; C295-C310 CovalentContact SG-SG 2.01Å; C295-C310 PolarHBondContact SG-SG 2.91Å
296	D	57.9	Low	62.1	Low	72 Å²	72	65.8 Å²	65.8	39%	0.385	37%	0.374	S	S	.	.	S	Bend	trans	-99	-3.8	174	68.7	-8.3	0	0	0	113.5	F293 E307	F293-D296 WeakPolarHBondContact CD1-OD2 3.34Å; D296-E307 PolarHBondContact N-OE1 3.42Å
297	G	55.9	Low	62.9	Low	57 Å²	57	66.6 Å²	66.6	59%	0.588	37%	0.367	S	S	*	.	S	Bend	trans	96.4	2.8	168.9	0	0	0	0	0	114.5	E307	G297-E307 VanDerWaalsContact N-CD 3.33Å; G297-E307 PolarHBondContact N-OE1 2.82Å; G297-E307 PolarHBondContact N-OE2 3.22Å
298	D	54.2	Low	63.3	Low	107 Å²	107	69 Å²	69	57%	0.572	38%	0.379	S	S	*	.	S	Bend	trans	-112.1	146.6	173.8	-70.5	-40	0	0	0	109.8	D300 E307	D298-D300 PolarHBondContact O-N 2.68Å; D298-E307 VanDerWaalsContact O-CG 3.32Å; D298-E307 WeakPolarHBondContact O-CG 3.07Å
299	E	60.4	Low	62.9	Low	168 Å²	168	75 Å²	75	79%	0.785	41%	0.408	S	S	*	.			trans	-83.6	85.3	178.3	-70.9	-176.9	176.6	0	0	110.4
300	D	69.3	Low	63.1	Low	65 Å²	65	76.6 Å²	76.6	35%	0.348	42%	0.419	S	S	.	.			trans	-87.6	-30.5	-179	-72.1	-55.8	0	0	0	113.1	F293 D298 D306	F293-D300 HydrophobicContact CB-CB 4.3Å; F293-D300 WeakPolarHBondContact CB-OD2 3.25Å; D298-D300 PolarHBondContact O-N 2.68Å; D300-D306 VanDerWaalsContact CA-OD2 3.28Å; D300-D306 WeakPolarHBondContact CA-OD2 3.5Å; D300-D306 VanDerWaalsContact CB-OD2 3.24Å; D300-D306 WeakPolarHBondContact CB-OD2 3.1Å; D300-D306 PolarHBondContact N-OD2 3.12Å
301	C	68.1	Low	62.7	Low	1 Å²	1	79.9 Å²	79.9	1%	0.007	44%	0.444	C	S	.	.	S	Bend	trans	-75.8	133	162.7	-64.7	0	0	0	0	109	C283 I289 D303 G304 D306	C283-C301 HydrophobicContact CB-CB 3.9Å; C283-C301 WeakPolarHBondContact CB-SG 3.28Å; C283-C301 WeakPolarHBondContact SG-CB 3.33Å; C283-C301 CovalentContact SG-SG 2.04Å; C283-C301 PolarHBondContact SG-SG 2.92Å; I289-C301 VanDerWaalsContact CD1-SG 3.51Å; C301-D303 WeakPolarHBondContact CB-OD1 3.36Å; C301-D303 PolarHBondContact O-N 3.46Å; C301-G304 PolarHBondContact O-N 3.02Å; C301-D306 HydrophobicContact CB-CB 4.23Å; C301-D306 VanDerWaalsContact CB-OD1 3.27Å; C301-D306 WeakPolarHBondContact CB-OD1 3.49Å; C301-D306 VanDerWaalsContact N-CG 3.3Å; C301-D306 PolarHBondContact N-OD1 3.21Å; C301-D306 PolarHBondContact N-OD2 3.21Å; C301-D306 VanDerWaalsContact SG-CB 3.57Å
302	K	63.9	Low	62	Low	190 Å²	190	81.3 Å²	81.3	83%	0.826	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.9	177.5	-75.7	-176.3	178.1	177.5	0	114.6
303	D	63.9	Low	61	Low	67 Å²	67	84.6 Å²	84.6	36%	0.358	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	5.1	175.6	64	-10.1	0	0	0	113.5	N285 C301 S305	N285-D303 PolarHBondContact N-OD2 3.31Å; C301-D303 WeakPolarHBondContact CB-OD1 3.36Å; C301-D303 PolarHBondContact O-N 3.46Å; D303-S305 PolarHBondContact O-N 3.29Å; D303-S305 WeakPolarHBondContact OD1-CB 2.94Å; D303-S305 PolarHBondContact OD1-N 3.45Å; D303-S305 PolarHBondContact OD1-OG 2.99Å; D303-S305 PolarHBondContact OD2-OG 3.45Å
304	G	64.5	Low	59.8	Low	9 Å²	9	87.6 Å²	87.6	9%	0.093	48%	0.476	C	S	.	.	S	Bend	trans	64.7	15.1	-179.3	0	0	0	0	0	114.4	C301 D306 E307	C301-G304 PolarHBondContact O-N 3.02Å; G304-D306 VanDerWaalsContact C-N 3.26Å; G304-D306 WeakPolarHBondContact CA-OD1 3.15Å; G304-D306 PolarHBondContact O-N 3.25Å; G304-E307 PolarHBondContact O-N 3.23Å
305	S	71.3	Confident	58.2	Low	22 Å²	22	89.7 Å²	89.7	15%	0.154	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-13.6	-171	58.7	0	0	0	0	114.6	R284 D303	R284-S305 PolarHBondContact N-OG 3.29Å; D303-S305 PolarHBondContact O-N 3.29Å; D303-S305 WeakPolarHBondContact OD1-CB 2.94Å; D303-S305 PolarHBondContact OD1-N 3.45Å; D303-S305 PolarHBondContact OD1-OG 2.99Å; D303-S305 PolarHBondContact OD2-OG 3.45Å
306	D	71.8	Confident	56.7	Low	2 Å²	2	90.8 Å²	90.8	1%	0.011	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-28	169.4	48.5	-27.8	0	0	0	114.1	I289 C295 D300 C301 G304	I289-D306 HydrophobicContact CD1-CB 3.68Å; C295-D306 PolarHBondContact N-O 3Å; D300-D306 VanDerWaalsContact CA-OD2 3.28Å; D300-D306 WeakPolarHBondContact CA-OD2 3.5Å; D300-D306 VanDerWaalsContact CB-OD2 3.24Å; D300-D306 WeakPolarHBondContact CB-OD2 3.1Å; D300-D306 PolarHBondContact N-OD2 3.12Å; C301-D306 HydrophobicContact CB-CB 4.23Å; C301-D306 VanDerWaalsContact CB-OD1 3.27Å; C301-D306 WeakPolarHBondContact CB-OD1 3.49Å; C301-D306 VanDerWaalsContact N-CG 3.3Å; C301-D306 PolarHBondContact N-OD1 3.21Å; C301-D306 PolarHBondContact N-OD2 3.21Å; C301-D306 VanDerWaalsContact SG-CB 3.57Å; G304-D306 VanDerWaalsContact C-N 3.26Å; G304-D306 WeakPolarHBondContact CA-OD1 3.15Å; G304-D306 PolarHBondContact O-N 3.25Å
307	E	76.8	Confident	55.1	Low	56 Å²	56	93.8 Å²	93.8	26%	0.262	53%	0.529	S	S	.	.	S	Bend	trans	-99.8	-3.5	179.5	-68	-59.6	133.3	0	0	113.1	C295 D296 G297 D298 G304	C295-E307 VanDerWaalsContact C-OE1 3.28Å; C295-E307 WeakPolarHBondContact CA-OE1 3.38Å; C295-E307 PolarHBondContact N-OE1 2.9Å; D296-E307 PolarHBondContact N-OE1 3.42Å; G297-E307 VanDerWaalsContact N-CD 3.33Å; G297-E307 PolarHBondContact N-OE1 2.82Å; G297-E307 PolarHBondContact N-OE2 3.22Å; D298-E307 VanDerWaalsContact O-CG 3.32Å; D298-E307 WeakPolarHBondContact O-CG 3.07Å; G304-E307 PolarHBondContact O-N 3.23Å
308	E	65.3	Low	53.8	Low	118 Å²	118	99.6 Å²	99.6	55%	0.551	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	125.8	175.8	-69.2	-163.9	155.1	0	0	111.4	R284	R284-E308 IonicContact NH1-OE2 3.93Å
309	N	57.7	Low	52.9	Low	162 Å²	162	104.4 Å²	104.4	87%	0.866	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	77	32.1	173.5	-157.1	32.1	0	0	0	116.2
310	C	65.5	Low	52.1	Low	42 Å²	42	100 Å²	100	28%	0.284	56%	0.56	S	S	.	*			trans	-69.8	125.1	168.2	-54.3	0	0	0	0	110.9	C295 V312	C295-C310 WeakPolarHBondContact CA-SG 3.11Å; C295-C310 HydrophobicContact CB-CB 3.67Å; C295-C310 WeakPolarHBondContact CB-SG 3Å; C295-C310 VanDerWaalsContact SG-CA 3.53Å; C295-C310 WeakPolarHBondContact SG-CB 3.46Å; C295-C310 CovalentContact SG-SG 2.01Å; C295-C310 PolarHBondContact SG-SG 2.91Å; C310-V312 PolarHBondContact O-N 2.93Å
311	S	50.9	Low	50	Low	119 Å²	119	104.7 Å²	104.7	83%	0.832	59%	0.585	S	S	*	*			trans	-69.8	105	177.9	-64.5	0	0	0	0	109.8	I313	S311-I313 PolarHBondContact O-N 3.49Å
312	V	43.2	Very low	48.9	Very low	110 Å²	110	113.3 Å²	113.3	67%	0.667	63%	0.625	S	S	*	*			trans	-50.3	108.7	-179.9	-179.7	0	0	0	0	111.7	C310 Q314	C310-V312 PolarHBondContact O-N 2.93Å; V312-Q314 HydrophobicContact CG1-CB 3.66Å; V312-Q314 HydrophobicContact CG1-CG 3.44Å; V312-Q314 VanDerWaalsContact CG1-CG 3.44Å
313	I	36.2	Very low	47.5	Very low	167 Å²	167	116.2 Å²	116.2	86%	0.856	63%	0.631	S	S	*	*			trans	-99.1	93.5	147.9	-61.9	-179.9	0	0	0	105.9	S311 T315	S311-I313 PolarHBondContact O-N 3.49Å; I313-T315 PolarHBondContact O-N 3.48Å
314	Q	35.4	Very low	45.7	Very low	148 Å²	148	119.3 Å²	119.3	69%	0.692	66%	0.657	S	S	*	*			trans	-68.9	117	-178.9	-119.9	165.7	2.7	0	0	110.3	V312	V312-Q314 HydrophobicContact CG1-CB 3.66Å; V312-Q314 HydrophobicContact CG1-CG 3.44Å; V312-Q314 VanDerWaalsContact CG1-CG 3.44Å
315	T	28.9	Very low	44	Very low	139 Å²	139	126.7 Å²	126.7	85%	0.853	69%	0.693	S	S	*	*			trans	-129.1	74.1	140.9	13.1	0	0	0	0	108.3	I313	I313-T315 PolarHBondContact O-N 3.48Å
316	S	29.5	Very low	42	Very low	85 Å²	85	136.1 Å²	136.1	59%	0.594	73%	0.727	S	S	*	*			trans	-78.8	116.1	159.8	55.2	0	0	0	0	108.3	Q318	S316-Q318 PolarHBondContact O-N 3.47Å
317	C	24.3	Very low	39.9	Very low	135 Å²	135	143.7 Å²	143.7	91%	0.912	77%	0.767	S	S	*	*			trans	-73.9	109.9	167.6	-70.8	0	0	0	0	109
318	Q	29.1	Very low	38.2	Very low	179 Å²	179	146.3 Å²	146.3	84%	0.836	79%	0.789	S	S	*	*			trans	-88.2	153	161.4	-79.2	-159.4	-41.7	0	0	110.6	S316 G320	S316-Q318 PolarHBondContact O-N 3.47Å; Q318-G320 PolarHBondContact O-N 2.81Å
319	E	34.3	Very low	36.5	Very low	208 Å²	208	146.7 Å²	146.7	97%	0.972	80%	0.803	S	S	*	*	S	Bend	trans	-39.7	120.6	-178.8	-75.4	173.8	128.5	0	0	113.7
320	G	43.4	Very low	35.1	Very low	76 Å²	76	146.5 Å²	146.5	78%	0.784	80%	0.802	S	S	*	*			trans	121	21	159.6	0	0	0	0	0	118.2	Q318	Q318-G320 PolarHBondContact O-N 2.81Å
321	D	26.6	Very low	33.3	Very low	163 Å²	163	151 Å²	151	87%	0.872	82%	0.822	S	S	*	*			trans	-126.8	127	168.4	-108.8	-29.3	0	0	0	114.2	R323	D321-R323 PolarHBondContact O-N 2.03Å
322	Q	44.4	Very low	32.1	Very low	183 Å²	183	151 Å²	151	86%	0.855	82%	0.823	S	S	*	*			trans	-77.1	101.8	-166.9	-74.2	162.9	-51.4	0	0	112
323	R	33.6	Very low	31.6	Very low	250 Å²	250	152 Å²	152	94%	0.943	83%	0.833	S	S	*	*			trans	-174.1	60.8	147.2	-101.6	163.5	-161.3	-152.3	6.6	111.4	D321	D321-R323 PolarHBondContact O-N 2.03Å
324	C	26.3	Very low	31.3	Very low	133 Å²	133	148.1 Å²	148.1	90%	0.899	83%	0.834	S	S	*	*			trans	-148.4	93.4	155.1	-84	0	0	0	0	105.8
325	L	29.3	Very low	31	Very low	163 Å²	163	144.4 Å²	144.4	85%	0.853	84%	0.836	S	S	*	*			trans	-114	101.9	161.9	-97.6	160.4	0	0	0	104.9
326	Y	28.5	Very low	31.1	Very low	221 Å²	221	143.4 Å²	143.4	87%	0.867	83%	0.834	S	S	*	*				-178.4	90	123.2	-97.2	-74	0	0	0	107
327	N	27.8	Very low	31.6	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	84%	0.843	S	S	*	*			trans	-89.3	135	155.3	-128.7	1	0	0	0	106.7	C329	N327-C329 PolarHBondContact O-N 3.24Å
328	P	42.7	Very low	32.4	Very low	111 Å²	111	145.4 Å²	145.4	72%	0.721	84%	0.837	S	S	*	*			trans	-84.8	114.1	-169	31.7	-30.1	0	0	0	110.4
329	C	29.3	Very low	32.6	Very low	127 Å²	127	142 Å²	142	86%	0.858	83%	0.832	S	S	*	*			trans	-157.2	136.6	144.7	-93.1	0	0	0	0	109.2	N327	N327-C329 PolarHBondContact O-N 3.24Å
330	L	28.5	Very low	32.4	Very low	158 Å²	158	139.5 Å²	139.5	83%	0.827	83%	0.825	S	S	*	*			trans	92.3	112.8	155.2	-140.5	68.6	0	0	0	118.9
331	D	26.6	Very low	32.4	Very low	135 Å²	135	141.7 Å²	141.7	72%	0.722	83%	0.826	S	S	*	*			trans	67.5	105.2	154.4	-67.1	-11.4	0	0	0	122
332	S	26.7	Very low	33.1	Very low	121 Å²	121	141.3 Å²	141.3	85%	0.846	82%	0.824	S	S	*	*				-166.9	116.3	107.3	-90.8	0	0	0	0	112
333	C	33.2	Very low	32.6	Very low	131 Å²	131	139.7 Å²	139.7	89%	0.885	82%	0.821	S	S	*	*			trans	-59.5	141.4	165.2	-63.7	0	0	0	0	111.8
334	G	28.9	Very low	33.2	Very low	85 Å²	85	133 Å²	133	88%	0.876	81%	0.813	S	S	*	*			trans	-155.6	106.5	160.7	0	0	0	0	0	109
335	G	30.1	Very low	33.7	Very low	70 Å²	70	134.5 Å²	134.5	72%	0.722	81%	0.811	S	S	*	*	S	Bend	cis	-164.6	140	0.3	0	0	0	0	0	111.6
336	S	30.7	Very low	34.5	Very low	117 Å²	117	134.3 Å²	134.3	82%	0.818	81%	0.811	S	S	*	*			trans	-140.4	127.1	138.9	-77.4	0	0	0	0	105.7	L338	S336-L338 PolarHBondContact O-N 2.88Å
337	S	39.6	Very low	34.9	Very low	112 Å²	112	130 Å²	130	78%	0.783	80%	0.803	S	S	*	*			trans	-62.7	123.4	-175.3	49.3	0	0	0	0	112.1
338	L	41.3	Very low	35.7	Very low	151 Å²	151	128.1 Å²	128.1	79%	0.791	80%	0.801	S	S	*	*			trans	147.9	90.9	143.5	-82.8	154.1	0	0	0	110.7	S336	S336-L338 PolarHBondContact O-N 2.88Å
339	C	32	Very low	36.2	Very low	107 Å²	107	125.2 Å²	125.2	72%	0.723	78%	0.783	S	S	*	*			trans	-157.1	117.2	147	-89.2	0	0	0	0	108.3
340	D	32	Very low	37.8	Very low	156 Å²	156	125.5 Å²	125.5	83%	0.834	77%	0.772	S	S	*	*			trans	-84	132.1	-176.6	-134.6	-29.4	0	0	0	109.7	N342	D340-N342 VanDerWaalsContact C-N 3.28Å; D340-N342 PolarHBondContact O-N 2.81Å
341	P	41.7	Very low	39.9	Very low	122 Å²	122	119.6 Å²	119.6	79%	0.792	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	29.3	-162.9	30.1	-26.9	0	0	0	115
342	N	42.5	Very low	42.3	Very low	155 Å²	155	116.9 Å²	116.9	83%	0.829	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	22.5	-172.7	-113.5	-1.5	0	0	0	116.2	D340	D340-N342 VanDerWaalsContact C-N 3.28Å; D340-N342 PolarHBondContact O-N 2.81Å
343	N	34	Very low	44.7	Very low	148 Å²	148	115.4 Å²	115.4	79%	0.791	71%	0.714	S	S	*	*			trans	-142.7	114.3	167.8	-124.7	-8.5	0	0	0	112.5	L345	N343-L345 PolarHBondContact O-N 2.87Å; N343-L345 VanDerWaalsContact O-N 3.12Å
344	S	44.6	Very low	46.9	Very low	111 Å²	111	110.1 Å²	110.1	78%	0.776	68%	0.676	S	S	*	*			trans	-67.7	95.6	168.8	44.4	0	0	0	0	110.5
345	L	37.2	Very low	49.2	Very low	163 Å²	163	110.3 Å²	110.3	85%	0.853	66%	0.66	S	S	*	*			trans	-167.9	127.5	155.1	-97.6	133.9	0	0	0	110.2	N343 N347	N343-L345 PolarHBondContact O-N 2.87Å; N343-L345 VanDerWaalsContact O-N 3.12Å; L345-N347 PolarHBondContact O-N 3.05Å
346	N	46.9	Very low	51.2	Low	159 Å²	159	107.6 Å²	107.6	85%	0.85	63%	0.629	S	S	*	*			trans	-37.1	119.7	176.3	-59.4	-23.1	0	0	0	115.4
347	N	35.8	Very low	53	Low	131 Å²	131	109.7 Å²	109.7	70%	0.701	63%	0.626	S	S	*	*			trans	-177.6	100.6	138.6	-112.5	-1.5	0	0	0	111.5	L345	L345-N347 PolarHBondContact O-N 3.05Å
348	C	44.7	Very low	54.5	Low	121 Å²	121	107.1 Å²	107.1	82%	0.818	60%	0.603	S	S	*	*			trans	-105	61.2	157.1	-87.3	0	0	0	0	108.9	Q350	C348-Q350 PolarHBondContact O-N 3.46Å
349	S	54.1	Low	56.2	Low	49 Å²	49	100 Å²	100	34%	0.343	57%	0.567	S	S	.	*			trans	-90.1	80.5	167.3	53.9	0	0	0	0	108.1
350	Q	62.5	Low	57.9	Low	134 Å²	134	99.6 Å²	99.6	63%	0.626	56%	0.555	S	S	*	*			trans	-111.5	91.2	173.9	-81.1	-178.1	-12.2	0	0	109	C348 E352	C348-Q350 PolarHBondContact O-N 3.46Å; Q350-E352 PolarHBondContact O-N 3.08Å
351	C	73.2	Confident	59.3	Low	34 Å²	34	95.8 Å²	95.8	23%	0.23	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-57.4	130	161.9	-50.8	0	0	0	0	108.5	T367 C414	C351-T367 CarbonylContact C-O 3.12Å; C351-T367 WeakPolarHBondContact CA-O 3.1Å; C351-C414 VanDerWaalsContact CA-SG 3.58Å; C351-C414 HydrophobicContact CB-CB 3.55Å; C351-C414 WeakPolarHBondContact CB-SG 3.18Å; C351-C414 WeakPolarHBondContact SG-CB 3.29Å; C351-C414 CovalentContact SG-SG 2.03Å; C351-C414 PolarHBondContact SG-SG 3.01Å
352	E	76.5	Confident	60.9	Low	78 Å²	78	90.9 Å²	90.9	36%	0.364	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	153.7	176.8	56.7	172	-158.3	0	0	111	Q350 S366 T367 Q378	Q350-E352 PolarHBondContact O-N 3.08Å; E352-S366 CarbonylContact O-C 3.49Å; E352-S366 WeakPolarHBondContact O-CA 3.24Å; E352-T367 HydrophobicContact CG-CG2 4.06Å; E352-T367 PolarHBondContact N-O 3Å; E352-T367 PolarHBondContact O-N 3.41Å; E352-Q378 VanDerWaalsContact CD-NE2 3.29Å; E352-Q378 WeakPolarHBondContact OE1-CG 3.29Å; E352-Q378 PolarHBondContact OE1-NE2 3.08Å
353	P	77.6	Confident	62.2	Low	89 Å²	89	88.3 Å²	88.3	58%	0.578	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	149.6	176.7	28.5	-34.5	0	0	0	111.6	T355 N365 Q378	P353-T355 PolarHBondContact O-N 3.49Å; P353-N365 WeakPolarHBondContact CA-O 3.17Å; P353-Q378 PolarHBondContact O-NE2 3.44Å
354	I	79.1	Confident	64.1	Low	21 Å²	21	81.9 Å²	81.9	11%	0.108	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-70	122	175.7	-58.3	172.1	0	0	0	109.6	L356 L362 Y364 N365 T367 V411	I354-L356 HydrophobicContact CG2-CB 4.46Å; I354-L362 HydrophobicContact CD1-CD1 4.29Å; I354-Y364 HydrophobicContact CD1-CD2 3.91Å; I354-Y364 HydrophobicContact CD1-CE2 3.87Å; I354-Y364 VanDerWaalsContact CD1-O 3.25Å; I354-Y364 WeakPolarHBondContact CD1-O 3.25Å; I354-N365 PolarHBondContact N-O 3.24Å; I354-N365 VanDerWaalsContact N-O 3.16Å; I354-T367 HydrophobicContact CG1-CG2 4.07Å; I354-V411 HydrophobicContact CG2-CG1 4.43Å; I354-V411 HydrophobicContact CG2-CG2 4.47Å
355	T	76.3	Confident	65.7	Low	88 Å²	88	82.4 Å²	82.4	54%	0.54	45%	0.452	S	S	.	.			trans	-113.9	-10.5	177.4	55	0	0	0	0	112.5	P353 E357 M360 Q378	P353-T355 PolarHBondContact O-N 3.49Å; T355-E357 PolarHBondContact O-N 3.13Å; T355-M360 WeakPolarHBondContact O-CE 3.42Å; T355-Q378 PolarHBondContact OG1-OE1 3.05Å
356	L	73.9	Confident	67.7	Low	13 Å²	13	76.6 Å²	76.6	7%	0.068	43%	0.425	C	S	.	.			trans	-71.3	108.6	175.9	-175.3	65.9	0	0	0	110.6	I354 L358 C359 M360 L410 V411	I354-L356 HydrophobicContact CG2-CB 4.46Å; L356-L358 VanDerWaalsContact C-N 3.27Å; L356-L358 HydrophobicContact CG-CB 4.4Å; L356-L358 PolarHBondContact O-N 3.36Å; L356-C359 HydrophobicContact CD2-CB 4.29Å; L356-C359 PolarHBondContact O-N 2.96Å; L356-M360 WeakPolarHBondContact O-CG 3.5Å; L356-M360 PolarHBondContact O-N 2.02Å; L356-L410 HydrophobicContact CD2-CB 4.35Å; L356-V411 HydrophobicContact CB-CG1 4.06Å; L356-V411 HydrophobicContact CD2-CG1 3.88Å
357	E	67.8	Low	69.5	Low	161 Å²	161	69 Å²	69	75%	0.752	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-53.1	-40.1	-175.1	-68.3	-175.7	172.6	0	0	113.5	T355 C359 M360	T355-E357 PolarHBondContact O-N 3.13Å; E357-C359 PolarHBondContact O-N 3.17Å; E357-C359 VanDerWaalsContact O-N 3.13Å; E357-M360 HydrophobicContact CG-CE 4.47Å
358	L	70.1	Confident	71.7	Confident	58 Å²	58	64.1 Å²	64.1	30%	0.304	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-57	-29.1	177.9	-175.4	66	0	0	0	113	L356 P391 M403	L356-L358 VanDerWaalsContact C-N 3.27Å; L356-L358 HydrophobicContact CG-CB 4.4Å; L356-L358 PolarHBondContact O-N 3.36Å; L358-P391 HydrophobicContact CD1-CG 3.84Å; L358-P391 HydrophobicContact CD2-CG 3.84Å; L358-M403 HydrophobicContact CD1-CE 3.74Å; L358-M403 HydrophobicContact CD1-SD 3.94Å; L358-M403 HydrophobicContact CD2-SD 4.37Å; L358-M403 HydrophobicContact CG-SD 4.08Å
359	C	77.6	Confident	73.4	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.02	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-123.3	16.1	-167.7	-58.9	0	0	0	0	114	L356 E357 N361 L362 C407 V411	L356-C359 HydrophobicContact CD2-CB 4.29Å; L356-C359 PolarHBondContact O-N 2.96Å; E357-C359 PolarHBondContact O-N 3.17Å; E357-C359 VanDerWaalsContact O-N 3.13Å; C359-N361 PolarHBondContact O-N 3.42Å; C359-N361 VanDerWaalsContact O-N 3.15Å; C359-L362 HydrophobicContact CB-CD1 4.15Å; C359-L362 WeakPolarHBondContact O-CG 3.41Å; C359-C407 VanDerWaalsContact CA-SG 3.51Å; C359-C407 HydrophobicContact CB-CB 3.71Å; C359-C407 WeakPolarHBondContact CB-SG 3.27Å; C359-C407 WeakPolarHBondContact SG-CA 3.39Å; C359-C407 WeakPolarHBondContact SG-CB 3.18Å; C359-C407 CovalentContact SG-SG 2.05Å; C359-C407 PolarHBondContact SG-SG 3.4Å; C359-V411 HydrophobicContact CB-CG2 3.37Å
360	M	68.2	Low	74.6	Confident	98 Å²	98	61.6 Å²	61.6	48%	0.483	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.7	-178	-79.6	-166.5	173.2	0	0	115.1	T355 L356 E357	T355-M360 WeakPolarHBondContact O-CE 3.42Å; L356-M360 WeakPolarHBondContact O-CG 3.5Å; L356-M360 PolarHBondContact O-N 2.02Å; E357-M360 HydrophobicContact CG-CE 4.47Å
361	N	60.9	Low	75.5	Confident	76 Å²	76	55.7 Å²	55.7	41%	0.406	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	24.4	-175	-54.8	-70.2	0	0	0	114.2	C359 S479	C359-N361 PolarHBondContact O-N 3.42Å; C359-N361 VanDerWaalsContact O-N 3.15Å; N361-S479 VanDerWaalsContact CG-OG 3.24Å; N361-S479 PolarHBondContact ND2-OG 3.45Å; N361-S479 PolarHBondContact OD1-OG 3.3Å; N361-S479 VanDerWaalsContact OD1-OG 3.06Å
362	L	74.6	Confident	75.8	Confident	19 Å²	19	57.1 Å²	57.1	10%	0.099	31%	0.311	C	S	.	.	S	Bend	trans	-69	159.2	174.5	-71	175.4	0	0	0	111.4	I354 C359 Y364 F404 C407 V411	I354-L362 HydrophobicContact CD1-CD1 4.29Å; C359-L362 HydrophobicContact CB-CD1 4.15Å; C359-L362 WeakPolarHBondContact O-CG 3.41Å; L362-Y364 HydrophobicContact CB-CD1 4.13Å; L362-Y364 HydrophobicContact CB-CE1 3.97Å; L362-Y364 HydrophobicContact CB-CE2 4.49Å; L362-Y364 HydrophobicContact CB-CG 4.48Å; L362-Y364 HydrophobicContact CD1-CE1 3.94Å; L362-Y364 HydrophobicContact CD1-CE2 3.9Å; L362-Y364 VanDerWaalsContact CD1-CZ 3.44Å; L362-Y364 VanDerWaalsContact CD1-OH 3.31Å; L362-Y364 WeakPolarHBondContact CD1-OH 3.46Å; L362-Y364 HydrophobicContact CG-CE1 4.41Å; L362-Y364 PolarHBondContact O-N 3.04Å; L362-F404 HydrophobicContact CD2-CD2 4.06Å; L362-F404 HydrophobicContact CD2-CE2 4.33Å; L362-C407 HydrophobicContact CD1-CB 3.88Å; L362-C407 HydrophobicContact CD2-CB 3.83Å; L362-C407 HydrophobicContact CG-CB 4.2Å; L362-V411 HydrophobicContact CD1-CG2 3.68Å
363	P	70.8	Confident	75.9	Confident	100 Å²	100	54.5 Å²	54.5	65%	0.649	30%	0.298	S	S	*	.	S	Bend	trans	-68.7	9.4	177.1	29.1	-35.5	0	0	0	113.6	F404	P363-F404 HydrophobicContact CG-CE2 3.84Å; P363-F404 HydrophobicContact CG-CZ 4.35Å
364	Y	74.5	Confident	75.8	Confident	14 Å²	14	52.5 Å²	52.5	6%	0.055	29%	0.294	C	S	.	.			trans	-143.2	148.6	176.2	58.5	-90.3	0	0	0	109.6	I354 L362 S366 T408 V411 K413 L467	I354-Y364 HydrophobicContact CD1-CD2 3.91Å; I354-Y364 HydrophobicContact CD1-CE2 3.87Å; I354-Y364 VanDerWaalsContact CD1-O 3.25Å; I354-Y364 WeakPolarHBondContact CD1-O 3.25Å; L362-Y364 HydrophobicContact CB-CD1 4.13Å; L362-Y364 HydrophobicContact CB-CE1 3.97Å; L362-Y364 HydrophobicContact CB-CE2 4.49Å; L362-Y364 HydrophobicContact CB-CG 4.48Å; L362-Y364 HydrophobicContact CD1-CE1 3.94Å; L362-Y364 HydrophobicContact CD1-CE2 3.9Å; L362-Y364 VanDerWaalsContact CD1-CZ 3.44Å; L362-Y364 VanDerWaalsContact CD1-OH 3.31Å; L362-Y364 WeakPolarHBondContact CD1-OH 3.46Å; L362-Y364 HydrophobicContact CG-CE1 4.41Å; L362-Y364 PolarHBondContact O-N 3.04Å; Y364-S366 WeakPolarHBondContact CD2-O 3.36Å; Y364-T408 HydrophobicContact CE1-CG2 4.28Å; Y364-V411 VanDerWaalsContact CE2-O 3.31Å; Y364-V411 WeakPolarHBondContact CE2-O 3.4Å; Y364-V411 PolarHBondContact OH-O 3.27Å; Y364-K413 HydrophobicContact CD1-CB 3.84Å; Y364-K413 HydrophobicContact CD1-CD 3.92Å; Y364-K413 HydrophobicContact CD1-CG 3.99Å; Y364-K413 HydrophobicContact CD2-CB 3.69Å; Y364-K413 HydrophobicContact CD2-CG 3.82Å; Y364-K413 HydrophobicContact CE1-CB 3.81Å; Y364-K413 HydrophobicContact CE1-CG 4.47Å; Y364-K413 VanDerWaalsContact CE2-CA 3.41Å; Y364-K413 HydrophobicContact CE2-CB 3.66Å; Y364-K413 HydrophobicContact CE2-CG 4.33Å; Y364-K413 HydrophobicContact CG-CB 3.77Å; Y364-K413 HydrophobicContact CG-CD 3.89Å; Y364-K413 HydrophobicContact CG-CG 3.62Å; Y364-L467 HydrophobicContact CE1-CD1 3.83Å
365	N	76.6	Confident	75.8	Confident	121 Å²	121	52.5 Å²	52.5	65%	0.647	29%	0.294	S	S	*	.			trans	-111	0.7	-173.5	-62.5	3.9	0	0	0	113.1	P353 I354	P353-N365 WeakPolarHBondContact CA-O 3.17Å; I354-N365 PolarHBondContact N-O 3.24Å; I354-N365 VanDerWaalsContact N-O 3.16Å
366	S	80.4	Confident	75.7	Confident	41 Å²	41	57.9 Å²	57.9	29%	0.287	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.1	-173.1	-57.8	0	0	0	0	111.2	E352 Y364 C414	E352-S366 CarbonylContact O-C 3.49Å; E352-S366 WeakPolarHBondContact O-CA 3.24Å; Y364-S366 WeakPolarHBondContact CD2-O 3.36Å; S366-C414 PolarHBondContact O-N 3.31Å; S366-C414 VanDerWaalsContact O-N 3.1Å
367	T	84.7	Confident	75.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	165.5	-178.4	-168.5	0	0	0	0	111.4	C351 E352 I354 Y369 Q378 P412	C351-T367 CarbonylContact C-O 3.12Å; C351-T367 WeakPolarHBondContact CA-O 3.1Å; E352-T367 HydrophobicContact CG-CG2 4.06Å; E352-T367 PolarHBondContact N-O 3Å; E352-T367 PolarHBondContact O-N 3.41Å; I354-T367 HydrophobicContact CG1-CG2 4.07Å; T367-Y369 HydrophobicContact CG2-CD2 4.43Å; T367-Y369 HydrophobicContact CG2-CE2 4.06Å; T367-Q378 HydrophobicContact CG2-CG 4.21Å; T367-P412 VanDerWaalsContact CA-O 3.29Å; T367-P412 WeakPolarHBondContact CA-O 3.49Å; T367-P412 WeakPolarHBondContact CB-O 3.26Å; T367-P412 PolarHBondContact OG1-O 3.37Å
368	S	82.1	Confident	76.3	Confident	29 Å²	29	53.2 Å²	53.2	20%	0.203	29%	0.287	C	S	.	.			trans	-141.6	144.1	178.6	-179.4	0	0	0	0	108.8	P412	S368-P412 WeakPolarHBondContact O-CG 3.27Å
369	Y	79.1	Confident	76.2	Confident	36 Å²	36	58.5 Å²	58.5	14%	0.141	31%	0.307	C	S	.	.	S	Bend	trans	-118.6	148.4	-178.1	-86.2	-105	0	0	0	110.3	T367 N371 H375 R376 T377 Q378 A381 L410 V411	T367-Y369 HydrophobicContact CG2-CD2 4.43Å; T367-Y369 HydrophobicContact CG2-CE2 4.06Å; Y369-N371 HydrophobicContact CD1-CB 4.27Å; Y369-N371 HydrophobicContact CE1-CB 3.91Å; Y369-H375 VanDerWaalsContact CD1-O 3.25Å; Y369-H375 WeakPolarHBondContact CD1-O 3.24Å; Y369-H375 HydrophobicContact CE1-CB 4.22Å; Y369-R376 WeakPolarHBondContact CB-O 3.28Å; Y369-R376 VanDerWaalsContact CD1-C 3.47Å; Y369-T377 VanDerWaalsContact CD1-C 3.43Å; Y369-T377 VanDerWaalsContact CD1-N 3.29Å; Y369-T377 WeakPolarHBondContact CE1-O 3.17Å; Y369-Q378 HydrophobicContact CD2-CG 3.95Å; Y369-Q378 HydrophobicContact CE2-CB 4.22Å; Y369-Q378 HydrophobicContact CE2-CG 3.14Å; Y369-Q378 VanDerWaalsContact CZ-CG 3.48Å; Y369-Q378 WeakPolarHBondContact OH-CA 3.07Å; Y369-Q378 WeakPolarHBondContact OH-CG 3.48Å; Y369-A381 HydrophobicContact CE1-CB 4.1Å; Y369-A381 WeakPolarHBondContact OH-CB 3.49Å; Y369-L410 PolarHBondContact OH-O 2.89Å; Y369-V411 HydrophobicContact CE2-CG1 4.42Å; Y369-V411 WeakPolarHBondContact OH-CG1 3.4Å
370	P	79.3	Confident	76.1	Confident	81 Å²	81	62 Å²	62	53%	0.526	32%	0.323	S	S	.	.	S	Bend	cis	-77.2	151.8	12.7	30.5	-35.2	0	0	0	114.9	H375	P370-H375 CarbonylContact C-O 3.6Å; P370-H375 WeakPolarHBondContact CA-O 3.46Å; P370-H375 WeakPolarHBondContact CB-O 3.32Å
371	N	81.9	Confident	76.5	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.048	30%	0.3	C	S	.	.			trans	-80.6	176.4	175.8	72	15.1	0	0	0	112	Y369 F373 G374 H375 A381 L410 P412	Y369-N371 HydrophobicContact CD1-CB 4.27Å; Y369-N371 HydrophobicContact CE1-CB 3.91Å; N371-F373 PolarHBondContact O-N 3.23Å; N371-F373 PolarHBondContact OD1-N 2.81Å; N371-G374 WeakPolarHBondContact O-CA 3.31Å; N371-G374 PolarHBondContact O-N 2.94Å; N371-G374 PolarHBondContact OD1-N 3.28Å; N371-H375 PolarHBondContact N-O 3Å; N371-H375 PolarHBondContact ND2-ND1 3.13Å; N371-H375 VanDerWaalsContact ND2-ND1 3.14Å; N371-H375 VanDerWaalsContact OD1-CB 3.31Å; N371-H375 WeakPolarHBondContact OD1-CB 3.29Å; N371-H375 PolarHBondContact OD1-N 2.85Å; N371-H375 PolarHBondContact OD1-ND1 3.48Å; N371-H375 VanDerWaalsContact OD1-ND1 3.09Å; N371-A381 WeakPolarHBondContact ND2-CB 3.48Å; N371-L410 VanDerWaalsContact CB-O 3.28Å; N371-L410 WeakPolarHBondContact CB-O 3.42Å; N371-L410 PolarHBondContact ND2-O 2.91Å; N371-P412 HydrophobicContact CB-CG 4.34Å
372	Y	80.5	Confident	77	Confident	64 Å²	64	56.1 Å²	56.1	25%	0.251	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.8	-174.7	-72.8	-77.5	0	0	0	114.2	G374 I409 P412 H421 P423	Y372-G374 VanDerWaalsContact C-N 3.31Å; Y372-I409 PolarHBondContact N-O 2.88Å; Y372-P412 HydrophobicContact CD2-CB 4.04Å; Y372-P412 HydrophobicContact CD2-CG 4.49Å; Y372-P412 HydrophobicContact CE2-CB 3.63Å; Y372-P412 HydrophobicContact CE2-CG 4.42Å; Y372-H421 AromaticContact CE1-ND1 3.75Å; Y372-H421 AromaticContact CZ-ND1 3.41Å; Y372-H421 PolarHBondContact OH-ND1 2.94Å; Y372-H421 PolarHBondContact OH-O 2.9Å; Y372-P423 HydrophobicContact CE1-CB 4.37Å; Y372-P423 HydrophobicContact CE2-CB 4.41Å; Y372-P423 WeakPolarHBondContact OH-CA 3.5Å; Y372-P423 VanDerWaalsContact OH-CB 3.23Å; Y372-P423 WeakPolarHBondContact OH-CB 3.47Å; Y372-P423 WeakPolarHBondContact OH-CD 3.37Å; Y372-P423 VanDerWaalsContact OH-N 3.16Å
373	F	77.4	Confident	76.6	Confident	23 Å²	23	61.7 Å²	61.7	10%	0.101	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3.4	170.2	-69.6	-67	0	0	0	112.9	N371 H375 E386 F390 I409 L410 P448 D450 T451	N371-F373 PolarHBondContact O-N 3.23Å; N371-F373 PolarHBondContact OD1-N 2.81Å; F373-H375 VanDerWaalsContact C-N 3.34Å; F373-H375 PolarHBondContact O-N 2.93Å; F373-E386 HydrophobicContact CD1-CG 4.19Å; F373-E386 HydrophobicContact CD2-CG 4.38Å; F373-E386 HydrophobicContact CE1-CG 3.97Å; F373-E386 HydrophobicContact CE2-CB 4.31Å; F373-E386 HydrophobicContact CE2-CG 4.15Å; F373-E386 HydrophobicContact CG-CG 4.4Å; F373-E386 HydrophobicContact CZ-CB 4.48Å; F373-E386 HydrophobicContact CZ-CG 3.95Å; F373-F390 AromaticContact CE2-CE2 3.99Å; F373-F390 HydrophobicContact CE2-CE2 3.99Å; F373-F390 AromaticContact CZ-CE2 3.94Å; F373-F390 HydrophobicContact CZ-CE2 3.94Å; F373-F390 HydrophobicContact CZ-CZ 4.11Å; F373-I409 HydrophobicContact CD2-CG2 3.57Å; F373-I409 HydrophobicContact CE2-CB 4.15Å; F373-I409 HydrophobicContact CE2-CG2 3.21Å; F373-I409 HydrophobicContact CG-CG2 4.39Å; F373-I409 HydrophobicContact CZ-CG2 3.78Å; F373-L410 HydrophobicContact CD2-CD2 3.87Å; F373-L410 HydrophobicContact CE2-CD2 4.11Å; F373-L410 HydrophobicContact CE2-CG 4.4Å; F373-P448 HydrophobicContact CE1-CB 4.26Å; F373-D450 HydrophobicContact CD1-CB 4Å; F373-D450 HydrophobicContact CE1-CB 4.28Å; F373-T451 HydrophobicContact CE1-CG2 3.55Å; F373-T451 HydrophobicContact CZ-CG2 3.5Å; F373-T451 VanDerWaalsContact CZ-CG2 3.5Å
374	G	75.3	Confident	76.7	Confident	48 Å²	48	57.5 Å²	57.5	50%	0.495	30%	0.299	S	S	.	.			trans	82.8	3.7	177.7	0	0	0	0	0	115.3	N371 Y372	N371-G374 WeakPolarHBondContact O-CA 3.31Å; N371-G374 PolarHBondContact O-N 2.94Å; N371-G374 PolarHBondContact OD1-N 3.28Å; Y372-G374 VanDerWaalsContact C-N 3.31Å
375	H	79.4	Confident	76.4	Confident	21 Å²	21	63.6 Å²	63.6	10%	0.097	32%	0.322	C	S	.	.			trans	-63.8	142.2	173.7	-54.7	115.1	0	0	0	109.9	Y369 P370 N371 F373 E380 A381 S384	Y369-H375 VanDerWaalsContact CD1-O 3.25Å; Y369-H375 WeakPolarHBondContact CD1-O 3.24Å; Y369-H375 HydrophobicContact CE1-CB 4.22Å; P370-H375 CarbonylContact C-O 3.6Å; P370-H375 WeakPolarHBondContact CA-O 3.46Å; P370-H375 WeakPolarHBondContact CB-O 3.32Å; N371-H375 PolarHBondContact N-O 3Å; N371-H375 PolarHBondContact ND2-ND1 3.13Å; N371-H375 VanDerWaalsContact ND2-ND1 3.14Å; N371-H375 VanDerWaalsContact OD1-CB 3.31Å; N371-H375 WeakPolarHBondContact OD1-CB 3.29Å; N371-H375 PolarHBondContact OD1-N 2.85Å; N371-H375 PolarHBondContact OD1-ND1 3.48Å; N371-H375 VanDerWaalsContact OD1-ND1 3.09Å; F373-H375 VanDerWaalsContact C-N 3.34Å; F373-H375 PolarHBondContact O-N 2.93Å; H375-E380 HydrophobicContact CB-CB 4.31Å; H375-E380 HydrophobicContact CB-CG 4.24Å; H375-A381 HydrophobicContact CB-CB 4.25Å; H375-S384 VanDerWaalsContact CE1-CB 3.43Å; H375-S384 WeakPolarHBondContact CE1-CB 3.28Å; H375-S384 VanDerWaalsContact NE2-CB 3.28Å; H375-S384 WeakPolarHBondContact NE2-CB 3.42Å
376	R	75.3	Confident	76.2	Confident	200 Å²	200	58.4 Å²	58.4	76%	0.755	29%	0.294	S	S	*	.	S	Bend	trans	-97.4	-13.6	-174.6	-59.2	-178.4	-178.7	-167.3	0.8	113.8	Y369 E380	Y369-R376 WeakPolarHBondContact CB-O 3.28Å; Y369-R376 VanDerWaalsContact CD1-C 3.47Å; R376-E380 PolarHBondContact N-OE2 3.09Å
377	T	78.5	Confident	75.7	Confident	68 Å²	68	57.2 Å²	57.2	42%	0.417	29%	0.286	S	S	.	.	S	Bend	trans	-145.5	157.3	177.5	66.1	0	0	0	0	112.1	Y369 K379 E380 A381	Y369-T377 VanDerWaalsContact CD1-C 3.43Å; Y369-T377 VanDerWaalsContact CD1-N 3.29Å; Y369-T377 WeakPolarHBondContact CE1-O 3.17Å; T377-K379 PolarHBondContact O-N 3.3Å; T377-E380 WeakPolarHBondContact O-CB 3.19Å; T377-E380 PolarHBondContact O-N 3.23Å; T377-E380 VanDerWaalsContact O-N 3.1Å; T377-E380 WeakPolarHBondContact OG1-CB 3.43Å; T377-E380 PolarHBondContact OG1-N 2.9Å; T377-A381 PolarHBondContact O-N 2.98Å; T377-A381 VanDerWaalsContact O-N 3.09Å
378	Q	75.1	Confident	75.1	Confident	9 Å²	9	61.3 Å²	61.3	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-58.4	-30.6	173	-69.6	-176.7	73.2	0	0	113.7	E352 P353 T355 T367 Y369 A381 S382 V411	E352-Q378 VanDerWaalsContact CD-NE2 3.29Å; E352-Q378 WeakPolarHBondContact OE1-CG 3.29Å; E352-Q378 PolarHBondContact OE1-NE2 3.08Å; P353-Q378 PolarHBondContact O-NE2 3.44Å; T355-Q378 PolarHBondContact OG1-OE1 3.05Å; T367-Q378 HydrophobicContact CG2-CG 4.21Å; Y369-Q378 HydrophobicContact CD2-CG 3.95Å; Y369-Q378 HydrophobicContact CE2-CB 4.22Å; Y369-Q378 HydrophobicContact CE2-CG 3.14Å; Y369-Q378 VanDerWaalsContact CZ-CG 3.48Å; Y369-Q378 WeakPolarHBondContact OH-CA 3.07Å; Y369-Q378 WeakPolarHBondContact OH-CG 3.48Å; Q378-A381 PolarHBondContact O-N 2.75Å; Q378-S382 PolarHBondContact O-N 2.88Å; Q378-V411 HydrophobicContact CG-CG1 4.37Å
379	K	69.2	Low	74.8	Confident	168 Å²	168	60.9 Å²	60.9	73%	0.73	31%	0.31	S	S	*	.	H	α-helix	trans	-71.3	-32.5	176.6	-173.5	178.4	-179.7	-178.6	0	112.8	T377 S382 I383	T377-K379 PolarHBondContact O-N 3.3Å; K379-S382 PolarHBondContact O-OG 2.9Å; K379-I383 WeakPolarHBondContact O-CG1 3.44Å
380	E	74.3	Confident	74.5	Confident	76 Å²	76	59.2 Å²	59.2	36%	0.355	30%	0.304	S	S	.	.	H	α-helix	trans	-74.1	-40.1	174.6	-169.9	-177.9	-178	0	0	110.5	H375 R376 T377 S382 I383 S384	H375-E380 HydrophobicContact CB-CB 4.31Å; H375-E380 HydrophobicContact CB-CG 4.24Å; R376-E380 PolarHBondContact N-OE2 3.09Å; T377-E380 WeakPolarHBondContact O-CB 3.19Å; T377-E380 PolarHBondContact O-N 3.23Å; T377-E380 VanDerWaalsContact O-N 3.1Å; T377-E380 WeakPolarHBondContact OG1-CB 3.43Å; T377-E380 PolarHBondContact OG1-N 2.9Å; E380-S382 VanDerWaalsContact C-N 3.33Å; E380-S382 PolarHBondContact O-N 2.82Å; E380-I383 VanDerWaalsContact O-CG1 3.24Å; E380-I383 WeakPolarHBondContact O-CG1 3.48Å; E380-I383 PolarHBondContact O-N 2.83Å; E380-S384 PolarHBondContact O-N 3.38Å
381	A	75.8	Confident	73.9	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-34.6	174.5	0	0	0	0	0	112.7	Y369 N371 H375 T377 Q378 I383 S384 S387 L410	Y369-A381 HydrophobicContact CE1-CB 4.1Å; Y369-A381 WeakPolarHBondContact OH-CB 3.49Å; N371-A381 WeakPolarHBondContact ND2-CB 3.48Å; H375-A381 HydrophobicContact CB-CB 4.25Å; T377-A381 PolarHBondContact O-N 2.98Å; T377-A381 VanDerWaalsContact O-N 3.09Å; Q378-A381 PolarHBondContact O-N 2.75Å; A381-I383 VanDerWaalsContact C-N 3.3Å; A381-I383 PolarHBondContact O-N 3.27Å; A381-S384 WeakPolarHBondContact O-CB 3.25Å; A381-S384 PolarHBondContact O-N 2.88Å; A381-S384 PolarHBondContact O-OG 2.72Å; A381-S387 VanDerWaalsContact O-CB 3.31Å; A381-S387 WeakPolarHBondContact O-CB 3.22Å; A381-L410 HydrophobicContact CB-CD2 4.5Å
382	S	71.6	Confident	73.2	Confident	52 Å²	52	59 Å²	59	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-68.2	-25.9	180	72.9	0	0	0	0	114.1	Q378 K379 E380 S387	Q378-S382 PolarHBondContact O-N 2.88Å; K379-S382 PolarHBondContact O-OG 2.9Å; E380-S382 VanDerWaalsContact C-N 3.33Å; E380-S382 PolarHBondContact O-N 2.82Å; S382-S387 PolarHBondContact O-OG 3.37Å
383	I	67.9	Low	72.6	Confident	136 Å²	136	56.4 Å²	56.4	70%	0.697	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	3.1	-179.2	64.1	175.6	0	0	0	113.4	K379 E380 A381	K379-I383 WeakPolarHBondContact O-CG1 3.44Å; E380-I383 VanDerWaalsContact O-CG1 3.24Å; E380-I383 WeakPolarHBondContact O-CG1 3.48Å; E380-I383 PolarHBondContact O-N 2.83Å; A381-I383 VanDerWaalsContact C-N 3.3Å; A381-I383 PolarHBondContact O-N 3.27Å
384	S	71.1	Confident	72.3	Confident	11 Å²	11	57.3 Å²	57.3	8%	0.077	30%	0.304	C	S	.	.	S	Bend	trans	-69.5	155.8	179.3	71.2	0	0	0	0	111.5	H375 E380 A381 E386 S387	H375-S384 VanDerWaalsContact CE1-CB 3.43Å; H375-S384 WeakPolarHBondContact CE1-CB 3.28Å; H375-S384 VanDerWaalsContact NE2-CB 3.28Å; H375-S384 WeakPolarHBondContact NE2-CB 3.42Å; E380-S384 PolarHBondContact O-N 3.38Å; A381-S384 WeakPolarHBondContact O-CB 3.25Å; A381-S384 PolarHBondContact O-N 2.88Å; A381-S384 PolarHBondContact O-OG 2.72Å; S384-E386 WeakPolarHBondContact CB-OE2 3.49Å; S384-E386 PolarHBondContact O-N 3.48Å; S384-E386 PolarHBondContact OG-OE2 3.27Å; S384-S387 PolarHBondContact O-N 3.03Å; S384-S387 PolarHBondContact O-OG 2.85Å; S384-S387 PolarHBondContact OG-N 3.43Å
385	W	67.9	Low	71.6	Confident	142 Å²	142	61.1 Å²	61.1	54%	0.538	31%	0.309	S	S	.	.	H	α-helix	trans	-68.8	-26.9	178.4	71.5	-78.9	0	0	0	110.8	S388 L389 P448	W385-S388 PolarHBondContact O-N 2.85Å; W385-L389 HydrophobicContact CE3-CB 4.41Å; W385-L389 HydrophobicContact CE3-CD2 4.35Å; W385-L389 HydrophobicContact CH2-CD2 4.16Å; W385-L389 HydrophobicContact CZ3-CB 4.49Å; W385-L389 HydrophobicContact CZ3-CD1 4.43Å; W385-L389 HydrophobicContact CZ3-CD2 3.64Å; W385-L389 HydrophobicContact CZ3-CG 4.4Å; W385-L389 WeakPolarHBondContact O-CB 3.33Å; W385-L389 PolarHBondContact O-N 3.18Å; W385-P448 HydrophobicContact CH2-CB 4.41Å; W385-P448 HydrophobicContact CH2-CG 3.93Å; W385-P448 HydrophobicContact CZ2-CB 4.46Å; W385-P448 HydrophobicContact CZ2-CG 4.37Å
386	E	74.4	Confident	71.2	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.056	32%	0.324	C	S	.	.	H	α-helix	trans	-63.2	-39.5	174	-61.5	87.7	165.9	0	0	112.1	F373 S384 S388 L389 F390 L410	F373-E386 HydrophobicContact CD1-CG 4.19Å; F373-E386 HydrophobicContact CD2-CG 4.38Å; F373-E386 HydrophobicContact CE1-CG 3.97Å; F373-E386 HydrophobicContact CE2-CB 4.31Å; F373-E386 HydrophobicContact CE2-CG 4.15Å; F373-E386 HydrophobicContact CG-CG 4.4Å; F373-E386 HydrophobicContact CZ-CB 4.48Å; F373-E386 HydrophobicContact CZ-CG 3.95Å; S384-E386 WeakPolarHBondContact CB-OE2 3.49Å; S384-E386 PolarHBondContact O-N 3.48Å; S384-E386 PolarHBondContact OG-OE2 3.27Å; E386-S388 PolarHBondContact O-N 3Å; E386-L389 PolarHBondContact O-N 3.22Å; E386-F390 HydrophobicContact CB-CD2 4.2Å; E386-F390 HydrophobicContact CB-CE2 3.95Å; E386-F390 WeakPolarHBondContact O-CD2 3.37Å; E386-F390 PolarHBondContact O-N 2.77Å; E386-L410 HydrophobicContact CB-CD2 4.42Å
387	S	69.6	Low	70.8	Confident	16 Å²	16	59.3 Å²	59.3	11%	0.112	32%	0.318	C	S	.	.	H	α-helix	trans	-66.2	-21.6	176.9	75.5	0	0	0	0	113	A381 S382 S384 P391	A381-S387 VanDerWaalsContact O-CB 3.31Å; A381-S387 WeakPolarHBondContact O-CB 3.22Å; S382-S387 PolarHBondContact O-OG 3.37Å; S384-S387 PolarHBondContact O-N 3.03Å; S384-S387 PolarHBondContact O-OG 2.85Å; S384-S387 PolarHBondContact OG-N 3.43Å; S387-P391 WeakPolarHBondContact O-CD 3.08Å; S387-P391 WeakPolarHBondContact O-CG 3.36Å
388	S	70.4	Confident	70.7	Confident	86 Å²	86	57.2 Å²	57.2	60%	0.601	31%	0.306	S	S	*	.	H	α-helix	trans	-91.4	-32.7	173.3	-59.3	0	0	0	0	112.3	W385 E386	W385-S388 PolarHBondContact O-N 2.85Å; E386-S388 PolarHBondContact O-N 3Å
389	L	75.8	Confident	71	Confident	21 Å²	21	57.9 Å²	57.9	11%	0.11	31%	0.308	C	S	.	.	H	α-helix	trans	-67.3	-51.8	179.4	-176.1	73.8	0	0	0	112.2	W385 E386 A392 L393 L440 L445 P448	W385-L389 HydrophobicContact CE3-CB 4.41Å; W385-L389 HydrophobicContact CE3-CD2 4.35Å; W385-L389 HydrophobicContact CH2-CD2 4.16Å; W385-L389 HydrophobicContact CZ3-CB 4.49Å; W385-L389 HydrophobicContact CZ3-CD1 4.43Å; W385-L389 HydrophobicContact CZ3-CD2 3.64Å; W385-L389 HydrophobicContact CZ3-CG 4.4Å; W385-L389 WeakPolarHBondContact O-CB 3.33Å; W385-L389 PolarHBondContact O-N 3.18Å; E386-L389 PolarHBondContact O-N 3.22Å; L389-A392 PolarHBondContact O-N 3.3Å; L389-L393 PolarHBondContact O-N 3.18Å; L389-L440 HydrophobicContact CD1-CD2 3.89Å; L389-L445 HydrophobicContact CD1-CD1 4.27Å; L389-P448 HydrophobicContact CD2-CG 4.36Å
390	F	74.6	Confident	71.2	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-41.4	-171.8	-72.3	-63.1	0	0	0	113.6	F373 E386 A392 L393 V394 L410	F373-F390 AromaticContact CE2-CE2 3.99Å; F373-F390 HydrophobicContact CE2-CE2 3.99Å; F373-F390 AromaticContact CZ-CE2 3.94Å; F373-F390 HydrophobicContact CZ-CE2 3.94Å; F373-F390 HydrophobicContact CZ-CZ 4.11Å; E386-F390 HydrophobicContact CB-CD2 4.2Å; E386-F390 HydrophobicContact CB-CE2 3.95Å; E386-F390 WeakPolarHBondContact O-CD2 3.37Å; E386-F390 PolarHBondContact O-N 2.77Å; F390-A392 PolarHBondContact O-N 2.9Å; F390-L393 PolarHBondContact O-N 3.16Å; F390-V394 WeakPolarHBondContact O-CG2 3.21Å; F390-V394 PolarHBondContact O-N 2.72Å; F390-L410 HydrophobicContact CD2-CD1 4.29Å
391	P	66.8	Low	71.4	Confident	35 Å²	35	55.6 Å²	55.6	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-42.3	172.2	-24.9	35.6	0	0	0	113.2	L358 S387 L393 V394 Q395	L358-P391 HydrophobicContact CD1-CG 3.84Å; L358-P391 HydrophobicContact CD2-CG 3.84Å; S387-P391 WeakPolarHBondContact O-CD 3.08Å; S387-P391 WeakPolarHBondContact O-CG 3.36Å; P391-L393 VanDerWaalsContact C-N 3.29Å; P391-L393 PolarHBondContact O-N 3.11Å; P391-V394 PolarHBondContact O-N 3.26Å; P391-Q395 WeakPolarHBondContact O-CG 3.36Å; P391-Q395 PolarHBondContact O-N 2.98Å; P391-Q395 VanDerWaalsContact O-N 3.15Å
392	A	66.4	Low	71.8	Confident	49 Å²	49	55.6 Å²	55.6	41%	0.405	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-35.3	176.2	0	0	0	0	0	111.9	L389 F390	L389-A392 PolarHBondContact O-N 3.3Å; F390-A392 PolarHBondContact O-N 2.9Å
393	L	68.8	Low	72.2	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.052	29%	0.292	C	S	.	.	H	α-helix	trans	-73	-35.9	176.2	-135.7	77.1	0	0	0	112.5	L389 F390 P391 Q395 T396 L402 C436 L440 W447	L389-L393 PolarHBondContact O-N 3.18Å; F390-L393 PolarHBondContact O-N 3.16Å; P391-L393 VanDerWaalsContact C-N 3.29Å; P391-L393 PolarHBondContact O-N 3.11Å; L393-Q395 VanDerWaalsContact C-N 3.28Å; L393-Q395 PolarHBondContact O-N 2.95Å; L393-T396 WeakPolarHBondContact O-CB 3.44Å; L393-T396 PolarHBondContact O-N 2.92Å; L393-T396 VanDerWaalsContact O-N 3.1Å; L393-T396 PolarHBondContact O-OG1 3.1Å; L393-L402 HydrophobicContact CB-CD2 3.86Å; L393-L402 HydrophobicContact CD2-CD2 3.98Å; L393-L402 HydrophobicContact CG-CD2 4.21Å; L393-C436 HydrophobicContact CD2-CB 3.73Å; L393-L440 HydrophobicContact CD1-CD2 3.31Å; L393-L440 HydrophobicContact CD1-CG 3.76Å; L393-L440 HydrophobicContact CD2-CD1 4.36Å; L393-L440 HydrophobicContact CD2-CD2 4.49Å; L393-L440 HydrophobicContact CD2-CG 4.29Å; L393-W447 HydrophobicContact CD2-CZ3 4.01Å
394	V	69.9	Low	72.9	Confident	42 Å²	42	50.9 Å²	50.9	26%	0.255	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-34.7	175.8	169.9	0	0	0	0	111.2	F390 P391 T396 N397 L402 M403	F390-V394 WeakPolarHBondContact O-CG2 3.21Å; F390-V394 PolarHBondContact O-N 2.72Å; P391-V394 PolarHBondContact O-N 3.26Å; V394-T396 PolarHBondContact O-N 3.35Å; V394-N397 PolarHBondContact O-N 3.14Å; V394-L402 HydrophobicContact CG2-CB 4.13Å; V394-L402 HydrophobicContact CG2-CD2 3.85Å; V394-L402 HydrophobicContact CG2-CG 4.05Å; V394-M403 HydrophobicContact CB-CE 4.09Å; V394-M403 HydrophobicContact CG1-CE 4.15Å; V394-M403 HydrophobicContact CG2-CB 3.95Å; V394-M403 HydrophobicContact CG2-CE 3.82Å; V394-M403 HydrophobicContact CG2-SD 4.41Å
395	Q	61.7	Low	73.6	Confident	128 Å²	128	50.4 Å²	50.4	60%	0.598	26%	0.262	S	S	*	.	H	α-helix	trans	-59.7	-26.2	173.6	-71.1	172.2	-11.3	0	0	113.1	P391 L393 N397	P391-Q395 WeakPolarHBondContact O-CG 3.36Å; P391-Q395 PolarHBondContact O-N 2.98Å; P391-Q395 VanDerWaalsContact O-N 3.15Å; L393-Q395 VanDerWaalsContact C-N 3.28Å; L393-Q395 PolarHBondContact O-N 2.95Å; Q395-N397 PolarHBondContact O-N 2.84Å
396	T	69.3	Low	74.3	Confident	67 Å²	67	43.6 Å²	43.6	41%	0.411	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-5.9	177.1	74.4	0	0	0	0	113.5	L393 V394 C398 V439	L393-T396 WeakPolarHBondContact O-CB 3.44Å; L393-T396 PolarHBondContact O-N 2.92Å; L393-T396 VanDerWaalsContact O-N 3.1Å; L393-T396 PolarHBondContact O-OG1 3.1Å; V394-T396 PolarHBondContact O-N 3.35Å; T396-C398 PolarHBondContact O-N 3.07Å; T396-C398 VanDerWaalsContact O-N 3.08Å; T396-V439 HydrophobicContact CG2-CG1 3.86Å
397	N	66.9	Low	74.8	Confident	117 Å²	117	43.2 Å²	43.2	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	27.4	-177.8	-84.2	-38.9	0	0	0	114.3	V394 Q395 Y399	V394-N397 PolarHBondContact O-N 3.14Å; Q395-N397 PolarHBondContact O-N 2.84Å; N397-Y399 VanDerWaalsContact C-N 3.3Å; N397-Y399 PolarHBondContact O-N 2.94Å
398	C	77.3	Confident	75.5	Confident	23 Å²	23	42.4 Å²	42.4	16%	0.155	23%	0.229	C	C	.	.	S	Bend	trans	-63.6	-33.2	-178.2	60.8	0	0	0	0	112.8	T396 R435 C436 V439	T396-C398 PolarHBondContact O-N 3.07Å; T396-C398 VanDerWaalsContact O-N 3.08Å; C398-R435 WeakPolarHBondContact O-CB 3.39Å; C398-C436 HydrophobicContact CB-CB 3.88Å; C398-C436 WeakPolarHBondContact CB-SG 3.37Å; C398-C436 WeakPolarHBondContact SG-CB 3.35Å; C398-C436 CovalentContact SG-SG 2.03Å; C398-C436 PolarHBondContact SG-SG 3.12Å; C398-V439 HydrophobicContact CB-CG2 4.11Å
399	Y	81.6	Confident	76.2	Confident	24 Å²	24	38.4 Å²	38.4	9%	0.094	20%	0.201	C	C	.	.			trans	-152	131.2	173.8	-175.3	-127.6	0	0	0	113.4	N397 Y401 L402 L428 H431 S432	N397-Y399 VanDerWaalsContact C-N 3.3Å; N397-Y399 PolarHBondContact O-N 2.94Å; Y399-Y401 VanDerWaalsContact C-N 3.27Å; Y399-Y401 HydrophobicContact CE1-CD2 4.41Å; Y399-Y401 AromaticContact CZ-CD2 3.96Å; Y399-Y401 PolarHBondContact O-N 3.06Å; Y399-L402 VanDerWaalsContact O-CB 3.3Å; Y399-L402 WeakPolarHBondContact O-CB 3.43Å; Y399-L402 PolarHBondContact O-N 3.32Å; Y399-L428 HydrophobicContact CE1-CD1 4.06Å; Y399-H431 HydrophobicContact CE1-CB 4.25Å; Y399-H431 HydrophobicContact CE2-CB 4.32Å; Y399-S432 WeakPolarHBondContact CD1-OG 3.3Å; Y399-S432 WeakPolarHBondContact CE1-OG 3.41Å
400	K	72.7	Confident	76.6	Confident	156 Å²	156	37.4 Å²	37.4	68%	0.678	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.3	-174.6	60.2	163.2	171.2	161.2	0	115.9
401	Y	80	Confident	77.1	Confident	39 Å²	39	37.3 Å²	37.3	15%	0.153	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	14.7	-178.6	-59.1	-56.8	0	0	0	113.2	Y399 M403 F404 F405 P469	Y399-Y401 VanDerWaalsContact C-N 3.27Å; Y399-Y401 HydrophobicContact CE1-CD2 4.41Å; Y399-Y401 AromaticContact CZ-CD2 3.96Å; Y399-Y401 PolarHBondContact O-N 3.06Å; Y401-M403 VanDerWaalsContact C-N 3.35Å; Y401-M403 PolarHBondContact O-N 3.11Å; Y401-F404 WeakPolarHBondContact O-CB 3.5Å; Y401-F404 PolarHBondContact O-N 2.72Å; Y401-F405 PolarHBondContact O-N 3.2Å; Y401-P469 HydrophobicContact CD1-CB 3.57Å; Y401-P469 HydrophobicContact CD1-CG 3.57Å; Y401-P469 HydrophobicContact CD2-CG 3.66Å; Y401-P469 HydrophobicContact CE1-CB 3.69Å; Y401-P469 HydrophobicContact CE1-CG 3.85Å; Y401-P469 HydrophobicContact CE2-CG 3.91Å; Y401-P469 HydrophobicContact CG-CB 4.04Å; Y401-P469 HydrophobicContact CG-CG 3.48Å; Y401-P469 VanDerWaalsContact CG-CG 3.48Å
402	L	83.1	Confident	78	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-42.3	-178.9	-176.6	67.4	0	0	0	112.2	L393 V394 Y399 F404 F405 S406 W447	L393-L402 HydrophobicContact CB-CD2 3.86Å; L393-L402 HydrophobicContact CD2-CD2 3.98Å; L393-L402 HydrophobicContact CG-CD2 4.21Å; V394-L402 HydrophobicContact CG2-CB 4.13Å; V394-L402 HydrophobicContact CG2-CD2 3.85Å; V394-L402 HydrophobicContact CG2-CG 4.05Å; Y399-L402 VanDerWaalsContact O-CB 3.3Å; Y399-L402 WeakPolarHBondContact O-CB 3.43Å; Y399-L402 PolarHBondContact O-N 3.32Å; L402-F404 VanDerWaalsContact C-N 3.28Å; L402-F404 PolarHBondContact O-N 3.05Å; L402-F405 HydrophobicContact CD1-CD1 4.48Å; L402-F405 WeakPolarHBondContact O-CB 3.47Å; L402-F405 PolarHBondContact O-N 3.22Å; L402-S406 PolarHBondContact O-N 3.41Å; L402-S406 PolarHBondContact O-OG 3.4Å; L402-W447 HydrophobicContact CD1-CH2 4.21Å
403	M	80.8	Confident	78.8	Confident	57 Å²	57	35.5 Å²	35.5	28%	0.281	18%	0.175	S	C	.	.	H	α-helix	trans	-63.9	-35.9	178	-171.3	59.6	83.3	0	0	112.1	L358 V394 Y401 S406 C407	L358-M403 HydrophobicContact CD1-CE 3.74Å; L358-M403 HydrophobicContact CD1-SD 3.94Å; L358-M403 HydrophobicContact CD2-SD 4.37Å; L358-M403 HydrophobicContact CG-SD 4.08Å; V394-M403 HydrophobicContact CB-CE 4.09Å; V394-M403 HydrophobicContact CG1-CE 4.15Å; V394-M403 HydrophobicContact CG2-CB 3.95Å; V394-M403 HydrophobicContact CG2-CE 3.82Å; V394-M403 HydrophobicContact CG2-SD 4.41Å; Y401-M403 VanDerWaalsContact C-N 3.35Å; Y401-M403 PolarHBondContact O-N 3.11Å; M403-S406 WeakPolarHBondContact CA-OG 3.25Å; M403-S406 PolarHBondContact O-OG 2.84Å; M403-C407 VanDerWaalsContact O-CB 3.24Å; M403-C407 WeakPolarHBondContact O-CB 3.23Å; M403-C407 PolarHBondContact O-N 3.22Å
404	F	82.3	Confident	79.5	Confident	33 Å²	33	35.2 Å²	35.2	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-42.7	175.5	-176.9	-94.3	0	0	0	110.9	L362 P363 Y401 L402 T408 L428 L467 P469	L362-F404 HydrophobicContact CD2-CD2 4.06Å; L362-F404 HydrophobicContact CD2-CE2 4.33Å; P363-F404 HydrophobicContact CG-CE2 3.84Å; P363-F404 HydrophobicContact CG-CZ 4.35Å; Y401-F404 WeakPolarHBondContact O-CB 3.5Å; Y401-F404 PolarHBondContact O-N 2.72Å; L402-F404 VanDerWaalsContact C-N 3.28Å; L402-F404 PolarHBondContact O-N 3.05Å; F404-T408 HydrophobicContact CD1-CG2 4.35Å; F404-T408 HydrophobicContact CE1-CG2 4.05Å; F404-T408 HydrophobicContact CZ-CG2 4.16Å; F404-T408 WeakPolarHBondContact O-CB 3.34Å; F404-T408 VanDerWaalsContact O-CG2 3.22Å; F404-T408 WeakPolarHBondContact O-CG2 3.4Å; F404-T408 PolarHBondContact O-N 2.84Å; F404-T408 PolarHBondContact O-OG1 3.18Å; F404-L428 HydrophobicContact CD1-CD2 3.74Å; F404-L428 HydrophobicContact CE1-CD2 4.04Å; F404-L467 HydrophobicContact CE1-CB 4.45Å; F404-L467 HydrophobicContact CZ-CB 4.47Å; F404-P469 HydrophobicContact CD1-CB 4.03Å; F404-P469 HydrophobicContact CD1-CG 4.25Å; F404-P469 HydrophobicContact CE1-CB 4.2Å; F404-P469 HydrophobicContact CE1-CG 4.5Å; F404-P469 HydrophobicContact CG-CB 4.21Å
405	F	84.7	Confident	79.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-48.5	174.2	175.3	-107.4	0	0	0	112.4	Y401 L402 C407 T408 I409 P424 L428 C429 W447 F456	Y401-F405 PolarHBondContact O-N 3.2Å; L402-F405 HydrophobicContact CD1-CD1 4.48Å; L402-F405 WeakPolarHBondContact O-CB 3.47Å; L402-F405 PolarHBondContact O-N 3.22Å; F405-C407 PolarHBondContact O-N 2.95Å; F405-T408 PolarHBondContact O-N 2.94Å; F405-T408 PolarHBondContact O-OG1 3.07Å; F405-I409 HydrophobicContact CD1-CD1 4.3Å; F405-I409 HydrophobicContact CD2-CD1 4.11Å; F405-I409 HydrophobicContact CE1-CD1 3.67Å; F405-I409 HydrophobicContact CE2-CD1 3.45Å; F405-I409 VanDerWaalsContact CE2-CD1 3.45Å; F405-I409 HydrophobicContact CE2-CG1 4.32Å; F405-I409 HydrophobicContact CZ-CD1 3.21Å; F405-I409 HydrophobicContact CZ-CG1 4.46Å; F405-I409 WeakPolarHBondContact O-CG1 3.43Å; F405-I409 PolarHBondContact O-N 2.77Å; F405-P424 HydrophobicContact CD2-CB 4.14Å; F405-P424 HydrophobicContact CD2-CG 4.26Å; F405-P424 HydrophobicContact CE2-CB 4.39Å; F405-P424 HydrophobicContact CE2-CG 4.09Å; F405-L428 HydrophobicContact CB-CD1 4.48Å; F405-L428 HydrophobicContact CB-CD2 4.03Å; F405-L428 HydrophobicContact CB-CG 4Å; F405-L428 HydrophobicContact CD2-CD2 4.1Å; F405-L428 HydrophobicContact CD2-CG 3.97Å; F405-L428 HydrophobicContact CG-CG 4.37Å; F405-C429 HydrophobicContact CD2-CB 4.43Å; F405-C429 VanDerWaalsContact CE2-CA 3.47Å; F405-C429 HydrophobicContact CE2-CB 3.49Å; F405-C429 VanDerWaalsContact CE2-CB 3.49Å; F405-C429 HydrophobicContact CZ-CB 3.82Å; F405-W447 HydrophobicContact CE1-CZ2 4.01Å; F405-F456 HydrophobicContact CE2-CE2 4.36Å
406	S	83.8	Confident	80.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-43.9	-179.9	57.6	0	0	0	0	112.5	L402 M403 T408 I409 L410	L402-S406 PolarHBondContact O-N 3.41Å; L402-S406 PolarHBondContact O-OG 3.4Å; M403-S406 WeakPolarHBondContact CA-OG 3.25Å; M403-S406 PolarHBondContact O-OG 2.84Å; S406-T408 PolarHBondContact O-N 3.32Å; S406-I409 PolarHBondContact O-N 3.15Å; S406-L410 WeakPolarHBondContact O-CB 3.34Å; S406-L410 WeakPolarHBondContact O-CG 3.13Å; S406-L410 PolarHBondContact O-N 3.1Å
407	C	84.6	Confident	80	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.02	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-33.5	179	-82	0	0	0	0	113	C359 L362 M403 F405 I409 L410 V411	C359-C407 VanDerWaalsContact CA-SG 3.51Å; C359-C407 HydrophobicContact CB-CB 3.71Å; C359-C407 WeakPolarHBondContact CB-SG 3.27Å; C359-C407 WeakPolarHBondContact SG-CA 3.39Å; C359-C407 WeakPolarHBondContact SG-CB 3.18Å; C359-C407 CovalentContact SG-SG 2.05Å; C359-C407 PolarHBondContact SG-SG 3.4Å; L362-C407 HydrophobicContact CD1-CB 3.88Å; L362-C407 HydrophobicContact CD2-CB 3.83Å; L362-C407 HydrophobicContact CG-CB 4.2Å; M403-C407 VanDerWaalsContact O-CB 3.24Å; M403-C407 WeakPolarHBondContact O-CB 3.23Å; M403-C407 PolarHBondContact O-N 3.22Å; F405-C407 PolarHBondContact O-N 2.95Å; C407-I409 VanDerWaalsContact C-N 3.26Å; C407-I409 PolarHBondContact O-N 2.83Å; C407-L410 PolarHBondContact O-N 3.23Å; C407-V411 CarbonylContact O-C 3.55Å; C407-V411 WeakPolarHBondContact O-CG2 3.28Å; C407-V411 PolarHBondContact O-N 3.35Å
408	T	84.8	Confident	80.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-70.6	-21.6	175.7	51.1	0	0	0	0	113.6	Y364 F404 F405 S406 P412 L467	Y364-T408 HydrophobicContact CE1-CG2 4.28Å; F404-T408 HydrophobicContact CD1-CG2 4.35Å; F404-T408 HydrophobicContact CE1-CG2 4.05Å; F404-T408 HydrophobicContact CZ-CG2 4.16Å; F404-T408 WeakPolarHBondContact O-CB 3.34Å; F404-T408 VanDerWaalsContact O-CG2 3.22Å; F404-T408 WeakPolarHBondContact O-CG2 3.4Å; F404-T408 PolarHBondContact O-N 2.84Å; F404-T408 PolarHBondContact O-OG1 3.18Å; F405-T408 PolarHBondContact O-N 2.94Å; F405-T408 PolarHBondContact O-OG1 3.07Å; S406-T408 PolarHBondContact O-N 3.32Å; T408-P412 WeakPolarHBondContact O-CA 3.25Å; T408-L467 HydrophobicContact CG2-CB 4.35Å; T408-L467 HydrophobicContact CG2-CD1 3.76Å
409	I	84.9	Confident	79.5	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-85.9	-41	173.6	-63.6	-179.8	0	0	0	111.1	Y372 F373 F405 S406 C407 P424 T451 F456	Y372-I409 PolarHBondContact N-O 2.88Å; F373-I409 HydrophobicContact CD2-CG2 3.57Å; F373-I409 HydrophobicContact CE2-CB 4.15Å; F373-I409 HydrophobicContact CE2-CG2 3.21Å; F373-I409 HydrophobicContact CG-CG2 4.39Å; F373-I409 HydrophobicContact CZ-CG2 3.78Å; F405-I409 HydrophobicContact CD1-CD1 4.3Å; F405-I409 HydrophobicContact CD2-CD1 4.11Å; F405-I409 HydrophobicContact CE1-CD1 3.67Å; F405-I409 HydrophobicContact CE2-CD1 3.45Å; F405-I409 VanDerWaalsContact CE2-CD1 3.45Å; F405-I409 HydrophobicContact CE2-CG1 4.32Å; F405-I409 HydrophobicContact CZ-CD1 3.21Å; F405-I409 HydrophobicContact CZ-CG1 4.46Å; F405-I409 WeakPolarHBondContact O-CG1 3.43Å; F405-I409 PolarHBondContact O-N 2.77Å; S406-I409 PolarHBondContact O-N 3.15Å; C407-I409 VanDerWaalsContact C-N 3.26Å; C407-I409 PolarHBondContact O-N 2.83Å; I409-P424 HydrophobicContact CD1-CG 4.42Å; I409-P424 HydrophobicContact CG1-CG 3.95Å; I409-T451 HydrophobicContact CD1-CG2 4.12Å; I409-F456 HydrophobicContact CD1-CZ 4.15Å
410	L	83	Confident	78.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-73.9	-42.5	-179	-73.1	168.7	0	0	0	113.2	L356 Y369 N371 F373 A381 E386 F390 S406 C407	L356-L410 HydrophobicContact CD2-CB 4.35Å; Y369-L410 PolarHBondContact OH-O 2.89Å; N371-L410 VanDerWaalsContact CB-O 3.28Å; N371-L410 WeakPolarHBondContact CB-O 3.42Å; N371-L410 PolarHBondContact ND2-O 2.91Å; F373-L410 HydrophobicContact CD2-CD2 3.87Å; F373-L410 HydrophobicContact CE2-CD2 4.11Å; F373-L410 HydrophobicContact CE2-CG 4.4Å; A381-L410 HydrophobicContact CB-CD2 4.5Å; E386-L410 HydrophobicContact CB-CD2 4.42Å; F390-L410 HydrophobicContact CD2-CD1 4.29Å; S406-L410 WeakPolarHBondContact O-CB 3.34Å; S406-L410 WeakPolarHBondContact O-CG 3.13Å; S406-L410 PolarHBondContact O-N 3.1Å; C407-L410 PolarHBondContact O-N 3.23Å
411	V	85.5	Confident	79.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-125.5	77.3	176.8	-77.2	0	0	0	0	109.4	I354 L356 C359 L362 Y364 Y369 Q378 C407	I354-V411 HydrophobicContact CG2-CG1 4.43Å; I354-V411 HydrophobicContact CG2-CG2 4.47Å; L356-V411 HydrophobicContact CB-CG1 4.06Å; L356-V411 HydrophobicContact CD2-CG1 3.88Å; C359-V411 HydrophobicContact CB-CG2 3.37Å; L362-V411 HydrophobicContact CD1-CG2 3.68Å; Y364-V411 VanDerWaalsContact CE2-O 3.31Å; Y364-V411 WeakPolarHBondContact CE2-O 3.4Å; Y364-V411 PolarHBondContact OH-O 3.27Å; Y369-V411 HydrophobicContact CE2-CG1 4.42Å; Y369-V411 WeakPolarHBondContact OH-CG1 3.4Å; Q378-V411 HydrophobicContact CG-CG1 4.37Å; C407-V411 CarbonylContact O-C 3.55Å; C407-V411 WeakPolarHBondContact O-CG2 3.28Å; C407-V411 PolarHBondContact O-N 3.35Å
412	P	85.5	Confident	79.2	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-64.7	146	-174.7	29.5	-36.7	0	0	0	111.4	T367 S368 N371 Y372 T408 C414 H421	T367-P412 VanDerWaalsContact CA-O 3.29Å; T367-P412 WeakPolarHBondContact CA-O 3.49Å; T367-P412 WeakPolarHBondContact CB-O 3.26Å; T367-P412 PolarHBondContact OG1-O 3.37Å; S368-P412 WeakPolarHBondContact O-CG 3.27Å; N371-P412 HydrophobicContact CB-CG 4.34Å; Y372-P412 HydrophobicContact CD2-CB 4.04Å; Y372-P412 HydrophobicContact CD2-CG 4.49Å; Y372-P412 HydrophobicContact CE2-CB 3.63Å; Y372-P412 HydrophobicContact CE2-CG 4.42Å; T408-P412 WeakPolarHBondContact O-CA 3.25Å; P412-C414 PolarHBondContact O-N 3.2Å; P412-H421 HydrophobicContact CB-CB 4.1Å; P412-H421 HydrophobicContact CG-CB 4.32Å
413	K	83.9	Confident	79.1	Confident	45 Å²	45	39.4 Å²	39.4	20%	0.196	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	127.9	178.5	-179.1	178.9	174.3	-170.5	0	109.8	Y364 H421 I422 Q464 L467	Y364-K413 HydrophobicContact CD1-CB 3.84Å; Y364-K413 HydrophobicContact CD1-CD 3.92Å; Y364-K413 HydrophobicContact CD1-CG 3.99Å; Y364-K413 HydrophobicContact CD2-CB 3.69Å; Y364-K413 HydrophobicContact CD2-CG 3.82Å; Y364-K413 HydrophobicContact CE1-CB 3.81Å; Y364-K413 HydrophobicContact CE1-CG 4.47Å; Y364-K413 VanDerWaalsContact CE2-CA 3.41Å; Y364-K413 HydrophobicContact CE2-CB 3.66Å; Y364-K413 HydrophobicContact CE2-CG 4.33Å; Y364-K413 HydrophobicContact CG-CB 3.77Å; Y364-K413 HydrophobicContact CG-CD 3.89Å; Y364-K413 HydrophobicContact CG-CG 3.62Å; K413-H421 CarbonylContact O-C 3.54Å; K413-H421 WeakPolarHBondContact O-CA 3.43Å; K413-I422 HydrophobicContact CB-CB 4.35Å; K413-I422 HydrophobicContact CD-CD1 4.04Å; K413-I422 HydrophobicContact CG-CD1 4.39Å; K413-I422 PolarHBondContact O-N 3.33Å; K413-Q464 VanDerWaalsContact NZ-NE2 3.17Å; K413-L467 HydrophobicContact CB-CD1 3.86Å; K413-L467 HydrophobicContact CD-CD2 3.95Å
414	C	83.4	Confident	79.3	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.027	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.6	171	-174.3	0	0	0	0	110.1	C351 S366 P412 V416	C351-C414 VanDerWaalsContact CA-SG 3.58Å; C351-C414 HydrophobicContact CB-CB 3.55Å; C351-C414 WeakPolarHBondContact CB-SG 3.18Å; C351-C414 WeakPolarHBondContact SG-CB 3.29Å; C351-C414 CovalentContact SG-SG 2.03Å; C351-C414 PolarHBondContact SG-SG 3.01Å; S366-C414 PolarHBondContact O-N 3.31Å; S366-C414 VanDerWaalsContact O-N 3.1Å; P412-C414 PolarHBondContact O-N 3.2Å; C414-V416 PolarHBondContact O-N 3.48Å
415	D	77.2	Confident	79.5	Confident	46 Å²	46	35.2 Å²	35.2	25%	0.246	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-75.5	120.3	167.5	-170.6	-31.7	0	0	0	109.3	N417 T418 G419 E420 I422	D415-N417 PolarHBondContact O-N 3.07Å; D415-N417 WeakPolarHBondContact OD1-CB 3.35Å; D415-N417 PolarHBondContact OD1-N 2.98Å; D415-N417 PolarHBondContact OD1-ND2 2.89Å; D415-T418 WeakPolarHBondContact CB-OG1 3.43Å; D415-T418 PolarHBondContact O-N 3.41Å; D415-G419 VanDerWaalsContact O-CA 3.31Å; D415-G419 WeakPolarHBondContact O-CA 3.13Å; D415-G419 PolarHBondContact O-N 3.46Å; D415-E420 PolarHBondContact N-O 2.73Å; D415-I422 HydrophobicContact CB-CD1 4.3Å
416	V	66.4	Low	79.5	Confident	107 Å²	107	38.9 Å²	38.9	65%	0.648	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.8	-176.8	-170.2	0	0	0	0	112.1	C414	C414-V416 PolarHBondContact O-N 3.48Å
417	N	68.1	Low	79.5	Confident	148 Å²	148	40.4 Å²	40.4	79%	0.791	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-33.5	-177.8	-57	-56.3	0	0	0	113.4	D415	D415-N417 PolarHBondContact O-N 3.07Å; D415-N417 WeakPolarHBondContact OD1-CB 3.35Å; D415-N417 PolarHBondContact OD1-N 2.98Å; D415-N417 PolarHBondContact OD1-ND2 2.89Å
418	T	69.3	Low	79.4	Confident	82 Å²	82	40.3 Å²	40.3	50%	0.503	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-19	-176.7	62.8	0	0	0	0	113.4	D415 E420	D415-T418 WeakPolarHBondContact CB-OG1 3.43Å; D415-T418 PolarHBondContact O-N 3.41Å; T418-E420 PolarHBondContact O-N 3.02Å; T418-E420 PolarHBondContact OG1-N 2.85Å
419	G	64.1	Low	79.5	Confident	20 Å²	20	40.3 Å²	40.3	21%	0.206	22%	0.217	C	C	.	.			trans	71.8	4.5	-174.5	0	0	0	0	0	114.1	D415	D415-G419 VanDerWaalsContact O-CA 3.31Å; D415-G419 WeakPolarHBondContact O-CA 3.13Å; D415-G419 PolarHBondContact O-N 3.46Å
420	E	68.7	Low	79.5	Confident	138 Å²	138	44.1 Å²	44.1	65%	0.645	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-87.4	151.1	-178.8	-66.7	-173.4	153.5	0	0	111.8	D415 T418	D415-E420 PolarHBondContact N-O 2.73Å; T418-E420 PolarHBondContact O-N 3.02Å; T418-E420 PolarHBondContact OG1-N 2.85Å
421	H	76.8	Confident	79.6	Confident	99 Å²	99	47.9 Å²	47.9	46%	0.458	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129	178.3	49.6	82.3	0	0	0	111.1	Y372 P412 K413 P423	Y372-H421 AromaticContact CE1-ND1 3.75Å; Y372-H421 AromaticContact CZ-ND1 3.41Å; Y372-H421 PolarHBondContact OH-ND1 2.94Å; Y372-H421 PolarHBondContact OH-O 2.9Å; P412-H421 HydrophobicContact CB-CB 4.1Å; P412-H421 HydrophobicContact CG-CB 4.32Å; K413-H421 CarbonylContact O-C 3.54Å; K413-H421 WeakPolarHBondContact O-CA 3.43Å; H421-P423 WeakPolarHBondContact O-CD 3.42Å
422	I	82.1	Confident	79.6	Confident	18 Å²	18	47.9 Å²	47.9	9%	0.092	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	118.8	178.8	-56.1	175.4	0	0	0	109.3	K413 D415 L467	K413-I422 HydrophobicContact CB-CB 4.35Å; K413-I422 HydrophobicContact CD-CD1 4.04Å; K413-I422 HydrophobicContact CG-CD1 4.39Å; K413-I422 PolarHBondContact O-N 3.33Å; D415-I422 HydrophobicContact CB-CD1 4.3Å; I422-L467 HydrophobicContact CG2-CD2 4.32Å; I422-L467 HydrophobicContact CG2-CG 4.01Å
423	P	80.3	Confident	79.5	Confident	25 Å²	25	50.9 Å²	50.9	16%	0.162	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-75.8	161.6	-179.1	26.6	-31.6	0	0	0	113.8	Y372 H421 F456 P457 C466 L467	Y372-P423 HydrophobicContact CE1-CB 4.37Å; Y372-P423 HydrophobicContact CE2-CB 4.41Å; Y372-P423 WeakPolarHBondContact OH-CA 3.5Å; Y372-P423 VanDerWaalsContact OH-CB 3.23Å; Y372-P423 WeakPolarHBondContact OH-CB 3.47Å; Y372-P423 WeakPolarHBondContact OH-CD 3.37Å; Y372-P423 VanDerWaalsContact OH-N 3.16Å; H421-P423 WeakPolarHBondContact O-CD 3.42Å; P423-F456 HydrophobicContact CB-CD1 3.81Å; P423-F456 HydrophobicContact CB-CE1 4.22Å; P423-P457 HydrophobicContact CG-CG 4.01Å; P423-C466 CarbonylContact O-C 3.41Å; P423-C466 WeakPolarHBondContact O-CA 3.14Å; P423-C466 VanDerWaalsContact O-CB 3.31Å; P423-C466 WeakPolarHBondContact O-CB 3.09Å; P423-L467 PolarHBondContact O-N 3.02Å
424	P	85.6	Confident	79.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-65.4	154.8	163.6	29.2	-34.1	0	0	0	111.6	F405 I409 L428 F456	F405-P424 HydrophobicContact CD2-CB 4.14Å; F405-P424 HydrophobicContact CD2-CG 4.26Å; F405-P424 HydrophobicContact CE2-CB 4.39Å; F405-P424 HydrophobicContact CE2-CG 4.09Å; I409-P424 HydrophobicContact CD1-CG 4.42Å; I409-P424 HydrophobicContact CG1-CG 3.95Å; P424-L428 HydrophobicContact CB-CD2 4.13Å; P424-F456 HydrophobicContact CG-CD1 4.09Å; P424-F456 HydrophobicContact CG-CE1 3.85Å; P424-F456 HydrophobicContact CG-CE2 4.36Å; P424-F456 HydrophobicContact CG-CG 4.45Å; P424-F456 HydrophobicContact CG-CZ 4Å; P424-F456 WeakPolarHBondContact O-CB 3.43Å
425	C	86.6	Confident	79.4	Confident	3 Å²	3	62 Å²	62	2%	0.02	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-73.3	148.5	177	-64.2	0	0	0	0	112	A427 L428 C429 C466 L467 M468	C425-A427 VanDerWaalsContact C-N 3.3Å; C425-A427 PolarHBondContact O-N 3.15Å; C425-L428 WeakPolarHBondContact O-CB 3.31Å; C425-L428 PolarHBondContact O-N 2.72Å; C425-C429 PolarHBondContact O-N 2.84Å; C425-C466 WeakPolarHBondContact CA-SG 2.98Å; C425-C466 HydrophobicContact CB-CB 3.88Å; C425-C466 WeakPolarHBondContact CB-SG 2.95Å; C425-C466 WeakPolarHBondContact SG-CB 3.44Å; C425-C466 CovalentContact SG-SG 2.03Å; C425-C466 PolarHBondContact SG-SG 3.11Å; C425-L467 PolarHBondContact N-O 2.93Å; C425-L467 VanDerWaalsContact N-O 3.11Å; C425-M468 HydrophobicContact CB-CG 3.83Å; C425-M468 HydrophobicContact CB-SD 3.84Å; C425-M468 WeakPolarHBondContact SG-CG 3.29Å
426	R	85.6	Confident	79.6	Confident	77 Å²	77	59.8 Å²	59.8	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-54.4	-42.6	179.8	180	166.7	177.5	178.5	5.8	113.8	L428 C429 E430 C453 F456 P457 E458	R426-L428 VanDerWaalsContact C-N 3.25Å; R426-L428 PolarHBondContact O-N 3.16Å; R426-C429 WeakPolarHBondContact O-CB 3.35Å; R426-C429 PolarHBondContact O-N 2.7Å; R426-C429 VanDerWaalsContact O-N 3.13Å; R426-E430 HydrophobicContact CG-CG 4.25Å; R426-E430 IonicContact CZ-OE1 2.71Å; R426-E430 IonicContact NE-OE1 2.85Å; R426-E430 PolarHBondContact NE-OE1 3.23Å; R426-E430 IonicContact NH2-OE1 3.51Å; R426-E430 PolarHBondContact NH2-OE1 2Å; R426-E430 PolarHBondContact O-N 2.86Å; R426-C453 WeakPolarHBondContact CG-O 3.44Å; R426-F456 HydrophobicContact CB-CB 4.11Å; R426-P457 WeakPolarHBondContact CB-O 3.4Å; R426-P457 PolarHBondContact N-O 3.21Å; R426-E458 IonicContact NH1-OE1 3.65Å
427	A	82.8	Confident	80.2	Confident	32 Å²	32	58.7 Å²	58.7	26%	0.264	29%	0.288	S	S	.	.	H	α-helix	trans	-60	-34.7	177.9	0	0	0	0	0	112.7	C425 H431	C425-A427 VanDerWaalsContact C-N 3.3Å; C425-A427 PolarHBondContact O-N 3.15Å; A427-H431 WeakPolarHBondContact O-CB 3.42Å; A427-H431 PolarHBondContact O-N 2.73Å; A427-H431 VanDerWaalsContact O-N 3.1Å; A427-H431 PolarHBondContact O-ND1 3.09Å
428	L	83.7	Confident	80.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68	-40.6	176.6	-177.3	65	0	0	0	111.5	Y399 F404 F405 P424 C425 R426 S432 M468 P469	Y399-L428 HydrophobicContact CE1-CD1 4.06Å; F404-L428 HydrophobicContact CD1-CD2 3.74Å; F404-L428 HydrophobicContact CE1-CD2 4.04Å; F405-L428 HydrophobicContact CB-CD1 4.48Å; F405-L428 HydrophobicContact CB-CD2 4.03Å; F405-L428 HydrophobicContact CB-CG 4Å; F405-L428 HydrophobicContact CD2-CD2 4.1Å; F405-L428 HydrophobicContact CD2-CG 3.97Å; F405-L428 HydrophobicContact CG-CG 4.37Å; P424-L428 HydrophobicContact CB-CD2 4.13Å; C425-L428 WeakPolarHBondContact O-CB 3.31Å; C425-L428 PolarHBondContact O-N 2.72Å; R426-L428 VanDerWaalsContact C-N 3.25Å; R426-L428 PolarHBondContact O-N 3.16Å; L428-S432 VanDerWaalsContact O-CB 3.31Å; L428-S432 WeakPolarHBondContact O-CB 3.25Å; L428-S432 PolarHBondContact O-N 2.77Å; L428-S432 VanDerWaalsContact O-N 3.13Å; L428-S432 PolarHBondContact O-OG 3.17Å; L428-M468 HydrophobicContact CB-SD 3.78Å; L428-P469 HydrophobicContact CD1-CG 4.39Å
429	C	85.4	Confident	80.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-50.4	175.5	-176.4	0	0	0	0	111.6	F405 C425 R426 H431 S432 K433 C453 F456	F405-C429 HydrophobicContact CD2-CB 4.43Å; F405-C429 VanDerWaalsContact CE2-CA 3.47Å; F405-C429 HydrophobicContact CE2-CB 3.49Å; F405-C429 VanDerWaalsContact CE2-CB 3.49Å; F405-C429 HydrophobicContact CZ-CB 3.82Å; C425-C429 PolarHBondContact O-N 2.84Å; R426-C429 WeakPolarHBondContact O-CB 3.35Å; R426-C429 PolarHBondContact O-N 2.7Å; R426-C429 VanDerWaalsContact O-N 3.13Å; C429-H431 PolarHBondContact O-N 3.4Å; C429-S432 PolarHBondContact O-N 2.83Å; C429-K433 WeakPolarHBondContact O-CB 3.35Å; C429-K433 PolarHBondContact O-N 2.87Å; C429-C453 HydrophobicContact CB-CB 3.67Å; C429-C453 WeakPolarHBondContact CB-SG 3.47Å; C429-C453 WeakPolarHBondContact SG-CA 3.49Å; C429-C453 WeakPolarHBondContact SG-CB 3.32Å; C429-C453 CovalentContact SG-SG 2.04Å; C429-C453 PolarHBondContact SG-SG 2.87Å; C429-F456 HydrophobicContact CB-CD2 3.72Å; C429-F456 HydrophobicContact CB-CE2 4.05Å
430	E	86.3	Confident	81.1	Confident	81 Å²	81	52.7 Å²	52.7	38%	0.379	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-43.9	-177.1	-71.4	179.4	169.9	0	0	111.6	R426 S432 K433 E434 C453	R426-E430 HydrophobicContact CG-CG 4.25Å; R426-E430 IonicContact CZ-OE1 2.71Å; R426-E430 IonicContact NE-OE1 2.85Å; R426-E430 PolarHBondContact NE-OE1 3.23Å; R426-E430 IonicContact NH2-OE1 3.51Å; R426-E430 PolarHBondContact NH2-OE1 2Å; R426-E430 PolarHBondContact O-N 2.86Å; E430-S432 PolarHBondContact O-N 2.99Å; E430-K433 PolarHBondContact O-N 3.43Å; E430-E434 WeakPolarHBondContact O-CB 3.1Å; E430-E434 PolarHBondContact O-N 2.96Å; E430-C453 HydrophobicContact CG-CB 3.74Å; E430-C453 PolarHBondContact N-SG 3.39Å
431	H	84	Confident	80.9	Confident	79 Å²	79	48.6 Å²	48.6	37%	0.366	25%	0.251	S	S	.	.	H	α-helix	trans	-67.3	-34.6	176.6	-67.4	169.1	0	0	0	113.4	Y399 A427 C429 R435	Y399-H431 HydrophobicContact CE1-CB 4.25Å; Y399-H431 HydrophobicContact CE2-CB 4.32Å; A427-H431 WeakPolarHBondContact O-CB 3.42Å; A427-H431 PolarHBondContact O-N 2.73Å; A427-H431 VanDerWaalsContact O-N 3.1Å; A427-H431 PolarHBondContact O-ND1 3.09Å; C429-H431 PolarHBondContact O-N 3.4Å; H431-R435 WeakPolarHBondContact O-CB 3.41Å; H431-R435 WeakPolarHBondContact O-CG 3.14Å; H431-R435 PolarHBondContact O-N 3.14Å
432	S	85	Confident	80.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-43.9	176.6	-60.4	0	0	0	0	110.7	Y399 L428 C429 E430 C436	Y399-S432 WeakPolarHBondContact CD1-OG 3.3Å; Y399-S432 WeakPolarHBondContact CE1-OG 3.41Å; L428-S432 VanDerWaalsContact O-CB 3.31Å; L428-S432 WeakPolarHBondContact O-CB 3.25Å; L428-S432 PolarHBondContact O-N 2.77Å; L428-S432 VanDerWaalsContact O-N 3.13Å; L428-S432 PolarHBondContact O-OG 3.17Å; C429-S432 PolarHBondContact O-N 2.83Å; E430-S432 PolarHBondContact O-N 2.99Å; S432-C436 VanDerWaalsContact O-CB 3.24Å; S432-C436 WeakPolarHBondContact O-CB 3.06Å; S432-C436 PolarHBondContact O-N 2.87Å; S432-C436 VanDerWaalsContact O-N 3.16Å
433	K	84.9	Confident	78.8	Confident	64 Å²	64	54.8 Å²	54.8	28%	0.278	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-54.1	177.3	-175.3	173.9	179.7	173.9	0	111.7	C429 E430 R435 C436 E437 W447	C429-K433 WeakPolarHBondContact O-CB 3.35Å; C429-K433 PolarHBondContact O-N 2.87Å; E430-K433 PolarHBondContact O-N 3.43Å; K433-R435 PolarHBondContact O-N 2.79Å; K433-R435 VanDerWaalsContact O-N 3.16Å; K433-C436 PolarHBondContact O-N 3.08Å; K433-E437 VanDerWaalsContact CE-OE1 3.31Å; K433-E437 WeakPolarHBondContact CE-OE1 3.34Å; K433-E437 HydrophobicContact CG-CB 4.33Å; K433-E437 WeakPolarHBondContact O-CB 3.49Å; K433-E437 PolarHBondContact O-N 3.23Å; K433-W447 HydrophobicContact CB-CD2 4.36Å; K433-W447 HydrophobicContact CB-CZ2 4.17Å; K433-W447 HydrophobicContact CD-CG 4.31Å; K433-W447 HydrophobicContact CG-CD2 4Å; K433-W447 HydrophobicContact CG-CG 4.1Å
434	E	84	Confident	77.3	Confident	146 Å²	146	56.9 Å²	56.9	68%	0.682	32%	0.315	S	S	*	.	H	α-helix	trans	-55.7	-39.3	-176.5	-174.1	-175.3	-168.1	0	0	112.7	E430	E430-E434 WeakPolarHBondContact O-CB 3.1Å; E430-E434 PolarHBondContact O-N 2.96Å
435	R	80.6	Confident	76.3	Confident	136 Å²	136	61 Å²	61	51%	0.513	34%	0.337	S	S	.	.	H	α-helix	trans	-86.3	-26.4	-174.8	-64.4	-177.8	-176.2	-154	4.8	114.1	C398 H431 K433	C398-R435 WeakPolarHBondContact O-CB 3.39Å; H431-R435 WeakPolarHBondContact O-CB 3.41Å; H431-R435 WeakPolarHBondContact O-CG 3.14Å; H431-R435 PolarHBondContact O-N 3.14Å; K433-R435 PolarHBondContact O-N 2.79Å; K433-R435 VanDerWaalsContact O-N 3.16Å
436	C	80.7	Confident	75.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-111.3	-17.6	-172.8	-60.4	0	0	0	0	114.2	L393 C398 S432 K433 S438 V439 L440 W447	L393-C436 HydrophobicContact CD2-CB 3.73Å; C398-C436 HydrophobicContact CB-CB 3.88Å; C398-C436 WeakPolarHBondContact CB-SG 3.37Å; C398-C436 WeakPolarHBondContact SG-CB 3.35Å; C398-C436 CovalentContact SG-SG 2.03Å; C398-C436 PolarHBondContact SG-SG 3.12Å; S432-C436 VanDerWaalsContact O-CB 3.24Å; S432-C436 WeakPolarHBondContact O-CB 3.06Å; S432-C436 PolarHBondContact O-N 2.87Å; S432-C436 VanDerWaalsContact O-N 3.16Å; K433-C436 PolarHBondContact O-N 3.08Å; C436-S438 VanDerWaalsContact C-N 3.32Å; C436-S438 PolarHBondContact O-N 3.07Å; C436-V439 WeakPolarHBondContact O-CB 3.04Å; C436-V439 PolarHBondContact O-N 3.25Å; C436-V439 VanDerWaalsContact O-N 3.12Å; C436-L440 PolarHBondContact O-N 3.05Å; C436-W447 HydrophobicContact CB-CH2 4.47Å; C436-W447 HydrophobicContact CB-CZ3 3.86Å
437	E	80.8	Confident	75	Confident	84 Å²	84	65.8 Å²	65.8	39%	0.393	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-38.6	178.4	179.1	172.6	-140.3	0	0	112.3	K433 V439 L440 G441 W447	K433-E437 VanDerWaalsContact CE-OE1 3.31Å; K433-E437 WeakPolarHBondContact CE-OE1 3.34Å; K433-E437 HydrophobicContact CG-CB 4.33Å; K433-E437 WeakPolarHBondContact O-CB 3.49Å; K433-E437 PolarHBondContact O-N 3.23Å; E437-V439 PolarHBondContact O-N 3.29Å; E437-L440 PolarHBondContact O-N 2.77Å; E437-G441 PolarHBondContact O-N 2.78Å; E437-G441 VanDerWaalsContact O-N 3.11Å; E437-W447 HydrophobicContact CB-CE3 4.31Å; E437-W447 HydrophobicContact CG-CB 4.41Å
438	S	76.2	Confident	74.7	Confident	80 Å²	80	64.8 Å²	64.8	56%	0.559	35%	0.352	S	S	*	.	H	α-helix	trans	-61.8	-29.5	176.3	64.6	0	0	0	0	113.2	C436 I442	C436-S438 VanDerWaalsContact C-N 3.32Å; C436-S438 PolarHBondContact O-N 3.07Å; S438-I442 WeakPolarHBondContact O-CG1 3.29Å
439	V	74.4	Confident	73.9	Confident	40 Å²	40	72.8 Å²	72.8	24%	0.242	39%	0.39	C	S	.	.	H	α-helix	trans	-73.7	-39.2	178.6	-176.9	0	0	0	0	110.8	T396 C398 C436 E437 G441 I442	T396-V439 HydrophobicContact CG2-CG1 3.86Å; C398-V439 HydrophobicContact CB-CG2 4.11Å; C436-V439 WeakPolarHBondContact O-CB 3.04Å; C436-V439 PolarHBondContact O-N 3.25Å; C436-V439 VanDerWaalsContact O-N 3.12Å; E437-V439 PolarHBondContact O-N 3.29Å; V439-G441 VanDerWaalsContact C-N 3.33Å; V439-G441 PolarHBondContact O-N 3.13Å; V439-I442 PolarHBondContact O-N 3.17Å
440	L	68.1	Low	73	Confident	4 Å²	4	77.6 Å²	77.6	2%	0.021	42%	0.415	C	S	.	.	H	α-helix	trans	-64.5	-36.6	173.4	-70.9	175.3	0	0	0	112.4	L389 L393 C436 E437 I442 V443 G444 L445 W447	L389-L440 HydrophobicContact CD1-CD2 3.89Å; L393-L440 HydrophobicContact CD1-CD2 3.31Å; L393-L440 HydrophobicContact CD1-CG 3.76Å; L393-L440 HydrophobicContact CD2-CD1 4.36Å; L393-L440 HydrophobicContact CD2-CD2 4.49Å; L393-L440 HydrophobicContact CD2-CG 4.29Å; C436-L440 PolarHBondContact O-N 3.05Å; E437-L440 PolarHBondContact O-N 2.77Å; L440-I442 VanDerWaalsContact C-N 3.25Å; L440-I442 PolarHBondContact O-N 3.18Å; L440-V443 WeakPolarHBondContact O-CG2 3.07Å; L440-V443 PolarHBondContact O-N 2.83Å; L440-G444 PolarHBondContact O-N 3.45Å; L440-L445 CarbonylContact C-O 3.55Å; L440-L445 VanDerWaalsContact C-O 3.29Å; L440-L445 HydrophobicContact CB-CB 4.4Å; L440-L445 HydrophobicContact CD2-CB 4.21Å; L440-L445 HydrophobicContact CD2-CD1 4.48Å; L440-L445 PolarHBondContact O-N 2.79Å; L440-W447 HydrophobicContact CD1-CE3 3.65Å; L440-W447 HydrophobicContact CD1-CZ3 4.24Å
441	G	64.9	Low	72.2	Confident	53 Å²	53	73.8 Å²	73.8	55%	0.546	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-28.2	177.4	0	0	0	0	0	114.2	E437 V439 V443 G444	E437-G441 PolarHBondContact O-N 2.78Å; E437-G441 VanDerWaalsContact O-N 3.11Å; V439-G441 VanDerWaalsContact C-N 3.33Å; V439-G441 PolarHBondContact O-N 3.13Å; G441-V443 VanDerWaalsContact C-N 3.28Å; G441-V443 PolarHBondContact O-N 3.38Å; G441-G444 PolarHBondContact O-N 3.17Å
442	I	62.6	Low	71.8	Confident	145 Å²	145	73.5 Å²	73.5	74%	0.744	40%	0.399	S	S	*	.	H	α-helix	trans	-67.6	-31	178.1	-65.7	167.3	0	0	0	111.5	S438 V439 L440	S438-I442 WeakPolarHBondContact O-CG1 3.29Å; V439-I442 PolarHBondContact O-N 3.17Å; L440-I442 VanDerWaalsContact C-N 3.25Å; L440-I442 PolarHBondContact O-N 3.18Å
443	V	51.6	Low	71.5	Confident	102 Å²	102	73.9 Å²	73.9	62%	0.618	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	5.2	-179.4	-64.2	0	0	0	0	113.2	L440 G441 L445	L440-V443 WeakPolarHBondContact O-CG2 3.07Å; L440-V443 PolarHBondContact O-N 2.83Å; G441-V443 VanDerWaalsContact C-N 3.28Å; G441-V443 PolarHBondContact O-N 3.38Å; V443-L445 HydrophobicContact CG2-CB 4.24Å; V443-L445 HydrophobicContact CG2-CD1 4.04Å; V443-L445 HydrophobicContact CG2-CG 4.1Å
444	G	49.6	Very low	71.1	Confident	68 Å²	68	74 Å²	74	70%	0.701	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	18.9	178.5	0	0	0	0	0	114.7	L440 G441	L440-G444 PolarHBondContact O-N 3.45Å; G441-G444 PolarHBondContact O-N 3.17Å
445	L	64.1	Low	70.8	Confident	88 Å²	88	73.5 Å²	73.5	46%	0.461	41%	0.408	S	S	.	.			trans	-101.5	149.6	175.9	-64.9	176.2	0	0	0	110.9	L389 L440 V443	L389-L445 HydrophobicContact CD1-CD1 4.27Å; L440-L445 CarbonylContact C-O 3.55Å; L440-L445 VanDerWaalsContact C-O 3.29Å; L440-L445 HydrophobicContact CB-CB 4.4Å; L440-L445 HydrophobicContact CD2-CB 4.21Å; L440-L445 HydrophobicContact CD2-CD1 4.48Å; L440-L445 PolarHBondContact O-N 2.79Å; V443-L445 HydrophobicContact CG2-CB 4.24Å; V443-L445 HydrophobicContact CG2-CD1 4.04Å; V443-L445 HydrophobicContact CG2-CG 4.1Å
446	Q	68.5	Low	70.8	Confident	161 Å²	161	67.7 Å²	67.7	75%	0.752	39%	0.386	S	S	*	.			trans	-105	151	176.9	-69.1	-177	-17.7	0	0	110.9
447	W	77.7	Confident	70.8	Confident	19 Å²	19	69.8 Å²	69.8	7%	0.072	40%	0.4	C	S	.	.			trans	-63.3	135.8	175.3	-169.7	-86.6	0	0	0	110	L393 L402 F405 K433 C436 E437 L440 E449 T451	L393-W447 HydrophobicContact CD2-CZ3 4.01Å; L402-W447 HydrophobicContact CD1-CH2 4.21Å; F405-W447 HydrophobicContact CE1-CZ2 4.01Å; K433-W447 HydrophobicContact CB-CD2 4.36Å; K433-W447 HydrophobicContact CB-CZ2 4.17Å; K433-W447 HydrophobicContact CD-CG 4.31Å; K433-W447 HydrophobicContact CG-CD2 4Å; K433-W447 HydrophobicContact CG-CG 4.1Å; C436-W447 HydrophobicContact CB-CH2 4.47Å; C436-W447 HydrophobicContact CB-CZ3 3.86Å; E437-W447 HydrophobicContact CB-CE3 4.31Å; E437-W447 HydrophobicContact CG-CB 4.41Å; L440-W447 HydrophobicContact CD1-CE3 3.65Å; L440-W447 HydrophobicContact CD1-CZ3 4.24Å; W447-E449 PolarHBondContact O-N 3.38Å; W447-T451 PolarHBondContact NE1-OG1 3.2Å
448	P	75.1	Confident	70.5	Confident	10 Å²	10	71.9 Å²	71.9	7%	0.065	41%	0.41	C	S	.	.			trans	-55.4	130.2	-173.7	-23.8	31	0	0	0	113.3	F373 W385 L389 D450 T451	F373-P448 HydrophobicContact CE1-CB 4.26Å; W385-P448 HydrophobicContact CH2-CB 4.41Å; W385-P448 HydrophobicContact CH2-CG 3.93Å; W385-P448 HydrophobicContact CZ2-CB 4.46Å; W385-P448 HydrophobicContact CZ2-CG 4.37Å; L389-P448 HydrophobicContact CD2-CG 4.36Å; P448-D450 VanDerWaalsContact C-N 3.27Å; P448-D450 PolarHBondContact O-N 3.47Å; P448-T451 HydrophobicContact CB-CG2 4.32Å; P448-T451 PolarHBondContact O-N 3.29Å; P448-T451 PolarHBondContact O-OG1 2.83Å
449	E	67.4	Low	69.9	Low	169 Å²	169	74.5 Å²	74.5	79%	0.79	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-64.6	-31.1	-178.1	-65.9	-170.7	167.1	0	0	112.5	W447 T451	W447-E449 PolarHBondContact O-N 3.38Å; E449-T451 PolarHBondContact O-N 2.81Å; E449-T451 VanDerWaalsContact O-N 3.13Å
450	D	66	Low	69.2	Low	101 Å²	101	78.1 Å²	78.1	54%	0.54	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-72.8	2.3	178	-59.2	-53.7	0	0	0	114.2	F373 P448	F373-D450 HydrophobicContact CD1-CB 4Å; F373-D450 HydrophobicContact CE1-CB 4.28Å; P448-D450 VanDerWaalsContact C-N 3.27Å; P448-D450 PolarHBondContact O-N 3.47Å
451	T	68.9	Low	68.5	Low	1 Å²	1	83.6 Å²	83.6	1%	0.006	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-114.3	41.2	177	60.7	0	0	0	0	112.4	F373 I409 W447 P448 E449 C453	F373-T451 HydrophobicContact CE1-CG2 3.55Å; F373-T451 HydrophobicContact CZ-CG2 3.5Å; F373-T451 VanDerWaalsContact CZ-CG2 3.5Å; I409-T451 HydrophobicContact CD1-CG2 4.12Å; W447-T451 PolarHBondContact NE1-OG1 3.2Å; P448-T451 HydrophobicContact CB-CG2 4.32Å; P448-T451 PolarHBondContact O-N 3.29Å; P448-T451 PolarHBondContact O-OG1 2.83Å; E449-T451 PolarHBondContact O-N 2.81Å; E449-T451 VanDerWaalsContact O-N 3.13Å; T451-C453 PolarHBondContact O-N 2.66Å; T451-C453 VanDerWaalsContact O-N 3.08Å
452	D	76.3	Confident	67.7	Low	73 Å²	73	87.6 Å²	87.6	39%	0.39	48%	0.479	S	S	.	.			trans	-65.3	110.5	173.5	-177.2	12.9	0	0	0	110.7	S454 Q455	D452-S454 PolarHBondContact O-N 2.89Å; D452-S454 PolarHBondContact OD1-N 2.98Å; D452-S454 PolarHBondContact OD1-OG 2.83Å; D452-S454 PolarHBondContact OD2-OG 2.97Å; D452-Q455 HydrophobicContact CB-CG 4.3Å; D452-Q455 WeakPolarHBondContact O-CB 3.16Å; D452-Q455 WeakPolarHBondContact O-CG 3.41Å; D452-Q455 PolarHBondContact O-N 2.86Å
453	C	79.9	Confident	67.3	Low	8 Å²	8	88.3 Å²	88.3	5%	0.054	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-60.1	-16.8	-177.5	-55.2	0	0	0	0	113.7	R426 C429 E430 T451 Q455 F456	R426-C453 WeakPolarHBondContact CG-O 3.44Å; C429-C453 HydrophobicContact CB-CB 3.67Å; C429-C453 WeakPolarHBondContact CB-SG 3.47Å; C429-C453 WeakPolarHBondContact SG-CA 3.49Å; C429-C453 WeakPolarHBondContact SG-CB 3.32Å; C429-C453 CovalentContact SG-SG 2.04Å; C429-C453 PolarHBondContact SG-SG 2.87Å; E430-C453 HydrophobicContact CG-CB 3.74Å; E430-C453 PolarHBondContact N-SG 3.39Å; T451-C453 PolarHBondContact O-N 2.66Å; T451-C453 VanDerWaalsContact O-N 3.08Å; C453-Q455 PolarHBondContact O-N 3.14Å; C453-F456 PolarHBondContact O-N 2.81Å
454	S	76.7	Confident	67.7	Low	67 Å²	67	89.6 Å²	89.6	47%	0.469	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-64.5	-19.6	174.1	84.7	0	0	0	0	113.6	D452	D452-S454 PolarHBondContact O-N 2.89Å; D452-S454 PolarHBondContact OD1-N 2.98Å; D452-S454 PolarHBondContact OD1-OG 2.83Å; D452-S454 PolarHBondContact OD2-OG 2.97Å
455	Q	75.7	Confident	68.4	Low	135 Å²	135	89.7 Å²	89.7	63%	0.631	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-82.7	-12.5	-179.3	-60.2	-178.4	-29.1	0	0	113.4	D452 C453	D452-Q455 HydrophobicContact CB-CG 4.3Å; D452-Q455 WeakPolarHBondContact O-CB 3.16Å; D452-Q455 WeakPolarHBondContact O-CG 3.41Å; D452-Q455 PolarHBondContact O-N 2.86Å; C453-Q455 PolarHBondContact O-N 3.14Å
456	F	81.3	Confident	68.9	Low	14 Å²	14	86.4 Å²	86.4	6%	0.061	45%	0.454	C	S	.	.	S	Bend	trans	-96.2	146.6	-177.7	-61.6	-52.7	0	0	0	112.4	F405 I409 P423 P424 R426 C429 C453	F405-F456 HydrophobicContact CE2-CE2 4.36Å; I409-F456 HydrophobicContact CD1-CZ 4.15Å; P423-F456 HydrophobicContact CB-CD1 3.81Å; P423-F456 HydrophobicContact CB-CE1 4.22Å; P424-F456 HydrophobicContact CG-CD1 4.09Å; P424-F456 HydrophobicContact CG-CE1 3.85Å; P424-F456 HydrophobicContact CG-CE2 4.36Å; P424-F456 HydrophobicContact CG-CG 4.45Å; P424-F456 HydrophobicContact CG-CZ 4Å; P424-F456 WeakPolarHBondContact O-CB 3.43Å; R426-F456 HydrophobicContact CB-CB 4.11Å; C429-F456 HydrophobicContact CB-CD2 3.72Å; C429-F456 HydrophobicContact CB-CE2 4.05Å; C453-F456 PolarHBondContact O-N 2.81Å
457	P	81	Confident	69.4	Low	44 Å²	44	79.4 Å²	79.4	29%	0.286	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-75.4	155.2	-179.7	32.8	-37.6	0	0	0	112.6	P423 R426 C466	P423-P457 HydrophobicContact CG-CG 4.01Å; R426-P457 WeakPolarHBondContact CB-O 3.4Å; R426-P457 PolarHBondContact N-O 3.21Å; P457-C466 HydrophobicContact CG-CB 3.68Å
458	E	73.9	Confident	69.3	Low	128 Å²	128	82 Å²	82	60%	0.598	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-80.9	152.1	174.2	-70.5	-179.2	-177.5	0	0	111.8	R426 N460	R426-E458 IonicContact NH1-OE1 3.65Å; E458-N460 PolarHBondContact O-N 2.91Å; E458-N460 VanDerWaalsContact O-N 3.11Å
459	E	65	Low	69	Low	134 Å²	134	82.7 Å²	82.7	63%	0.626	44%	0.44	S	S	*	.			trans	-68.7	105.1	-178.9	-170.8	177.6	-171.7	0	0	110.6
460	N	58.5	Low	68.9	Low	117 Å²	117	80.6 Å²	80.6	63%	0.626	44%	0.435	S	S	*	.			trans	-99.6	136.4	172.6	-79.5	-32.4	0	0	0	110.7	E458 D462	E458-N460 PolarHBondContact O-N 2.91Å; E458-N460 VanDerWaalsContact O-N 3.11Å; N460-D462 PolarHBondContact O-N 2.73Å
461	S	52.9	Low	68.2	Low	119 Å²	119	84.1 Å²	84.1	83%	0.832	45%	0.448	S	S	*	.	S	Bend	trans	-65.5	0.9	-169.4	51.2	0	0	0	0	116.7
462	D	49.8	Very low	67.3	Low	136 Å²	136	94.4 Å²	94.4	73%	0.727	49%	0.488	S	S	*	.	S	Bend	trans	-131.2	109.8	-179.7	-70.6	-56.1	0	0	0	111	N460	N460-D462 PolarHBondContact O-N 2.73Å
463	N	53.6	Low	65.9	Low	160 Å²	160	95.8 Å²	95.8	86%	0.856	50%	0.499	S	S	*	.	S	Bend	trans	40	93.1	165.4	-69.4	-15.8	0	0	0	118.3
464	Q	59.8	Low	64.4	Low	129 Å²	129	103.7 Å²	103.7	60%	0.603	54%	0.535	S	S	*	.			trans	66.8	65.4	139.3	-143.8	161	24.1	0	0	117	K413	K413-Q464 VanDerWaalsContact NZ-NE2 3.17Å
465	T	64.8	Low	63.3	Low	71 Å²	71	107.8 Å²	107.8	44%	0.436	55%	0.547	S	S	.	.	S	Bend	trans	-101.9	-21.1	165.1	35.8	0	0	0	0	113.6
466	C	74.1	Confident	62.4	Low	18 Å²	18	102.8 Å²	102.8	12%	0.122	53%	0.526	C	S	.	.	S	Bend	trans	-156.3	165.7	177.3	55.8	0	0	0	0	113.6	P423 C425 P457	P423-C466 CarbonylContact O-C 3.41Å; P423-C466 WeakPolarHBondContact O-CA 3.14Å; P423-C466 VanDerWaalsContact O-CB 3.31Å; P423-C466 WeakPolarHBondContact O-CB 3.09Å; C425-C466 WeakPolarHBondContact CA-SG 2.98Å; C425-C466 HydrophobicContact CB-CB 3.88Å; C425-C466 WeakPolarHBondContact CB-SG 2.95Å; C425-C466 WeakPolarHBondContact SG-CB 3.44Å; C425-C466 CovalentContact SG-SG 2.03Å; C425-C466 PolarHBondContact SG-SG 3.11Å; P457-C466 HydrophobicContact CG-CB 3.68Å
467	L	79.1	Confident	61.1	Low	15 Å²	15	104.3 Å²	104.3	8%	0.079	54%	0.539	C	S	.	.	B	Isolated β-bridge	trans	-93.5	130.3	-175.9	-61.8	171.2	0	0	0	112.2	Y364 F404 T408 K413 I422 P423 C425	Y364-L467 HydrophobicContact CE1-CD1 3.83Å; F404-L467 HydrophobicContact CE1-CB 4.45Å; F404-L467 HydrophobicContact CZ-CB 4.47Å; T408-L467 HydrophobicContact CG2-CB 4.35Å; T408-L467 HydrophobicContact CG2-CD1 3.76Å; K413-L467 HydrophobicContact CB-CD1 3.86Å; K413-L467 HydrophobicContact CD-CD2 3.95Å; I422-L467 HydrophobicContact CG2-CD2 4.32Å; I422-L467 HydrophobicContact CG2-CG 4.01Å; P423-L467 PolarHBondContact O-N 3.02Å; C425-L467 PolarHBondContact N-O 2.93Å; C425-L467 VanDerWaalsContact N-O 3.11Å
468	M	75.8	Confident	59.7	Low	74 Å²	74	109 Å²	109	37%	0.365	57%	0.569	S	S	.	*			trans	-129.8	150.7	170.9	-79.1	-69.2	-74.3	0	0	110.3	C425 L428	C425-M468 HydrophobicContact CB-CG 3.83Å; C425-M468 HydrophobicContact CB-SD 3.84Å; C425-M468 WeakPolarHBondContact SG-CG 3.29Å; L428-M468 HydrophobicContact CB-SD 3.78Å
469	P	69.3	Low	58.5	Low	23 Å²	23	104.8 Å²	104.8	15%	0.149	55%	0.554	C	S	.	*			trans	-76.7	142.9	175.3	30.3	-32.7	0	0	0	112	Y401 F404 L428	Y401-P469 HydrophobicContact CD1-CB 3.57Å; Y401-P469 HydrophobicContact CD1-CG 3.57Å; Y401-P469 HydrophobicContact CD2-CG 3.66Å; Y401-P469 HydrophobicContact CE1-CB 3.69Å; Y401-P469 HydrophobicContact CE1-CG 3.85Å; Y401-P469 HydrophobicContact CE2-CG 3.91Å; Y401-P469 HydrophobicContact CG-CB 4.04Å; Y401-P469 HydrophobicContact CG-CG 3.48Å; Y401-P469 VanDerWaalsContact CG-CG 3.48Å; F404-P469 HydrophobicContact CD1-CB 4.03Å; F404-P469 HydrophobicContact CD1-CG 4.25Å; F404-P469 HydrophobicContact CE1-CB 4.2Å; F404-P469 HydrophobicContact CE1-CG 4.5Å; F404-P469 HydrophobicContact CG-CB 4.21Å; L428-P469 HydrophobicContact CD1-CG 4.39Å
470	D	64	Low	58.4	Low	126 Å²	126	101.2 Å²	101.2	67%	0.674	54%	0.537	S	S	*	.			trans	-69.3	141	176.8	-90.7	-41.4	0	0	0	112.5	Y472 V473	D470-Y472 PolarHBondContact O-N 2.89Å; D470-Y472 VanDerWaalsContact O-N 3.08Å; D470-V473 HydrophobicContact CB-CG2 3.92Å
471	E	52.4	Low	59	Low	174 Å²	174	98.1 Å²	98.1	81%	0.813	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.8	-176.1	-76.2	-166.2	141.9	0	0	115
472	Y	49.8	Very low	59.8	Low	217 Å²	217	97.1 Å²	97.1	85%	0.851	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	17.6	-175.6	-69	-82.1	0	0	0	115.1	D470 E474	D470-Y472 PolarHBondContact O-N 2.89Å; D470-Y472 VanDerWaalsContact O-N 3.08Å; Y472-E474 PolarHBondContact O-N 3.03Å
473	V	46.2	Very low	61	Low	102 Å²	102	90.7 Å²	90.7	62%	0.618	47%	0.465	S	S	*	.			trans	-76.4	115.1	174.7	-177.6	0	0	0	0	109.5	D470	D470-V473 HydrophobicContact CB-CG2 3.92Å
474	E	48.4	Very low	61.9	Low	174 Å²	174	91.9 Å²	91.9	81%	0.813	46%	0.457	S	S	*	.			trans	-56.5	143	169.3	-79	-171.4	153.2	0	0	110.7	Y472 C476	Y472-E474 PolarHBondContact O-N 3.03Å; E474-C476 PolarHBondContact O-N 2.03Å
475	E	54	Low	62.2	Low	153 Å²	153	88.6 Å²	88.6	72%	0.715	45%	0.448	S	S	*	.	S	Bend	trans	-59.8	-7	-162.8	-71	168	159.3	0	0	116.9	K482 C488	E475-K482 IonicContact OE2-NZ 2.73Å; E475-K482 PolarHBondContact OE2-NZ 3.43Å; E475-C488 PolarHBondContact O-SG 2.86Å
476	C	57.4	Low	62.1	Low	30 Å²	30	86.5 Å²	86.5	20%	0.203	44%	0.441	C	S	.	.	S	Bend	trans	-136.1	142.2	172.8	-55.8	0	0	0	0	111.5	E474 H480 C488	E474-C476 PolarHBondContact O-N 2.03Å; C476-H480 HydrophobicContact CB-CB 4.26Å; C476-C488 VanDerWaalsContact CA-SG 3.56Å; C476-C488 HydrophobicContact CB-CB 3.87Å; C476-C488 WeakPolarHBondContact CB-SG 2.97Å; C476-C488 WeakPolarHBondContact SG-CB 3.35Å; C476-C488 CovalentContact SG-SG 2.03Å; C476-C488 PolarHBondContact SG-SG 3.08Å
477	S	54.2	Low	61.5	Low	47 Å²	47	87 Å²	87	33%	0.329	44%	0.442	S	S	.	.			trans	-64.1	156.2	175.3	-55	0	0	0	0	112.2	S479 H480	S477-S479 PolarHBondContact O-N 2.85Å; S477-H480 PolarHBondContact O-N 2.74Å
478	P	50.8	Low	61.1	Low	141 Å²	141	88.6 Å²	88.6	92%	0.916	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-14.1	-179.4	-23.7	33.2	0	0	0	115.9
479	S	49.4	Very low	60.9	Low	41 Å²	41	85.6 Å²	85.6	29%	0.287	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	7.3	177.6	46.9	0	0	0	0	113.4	N361 S477 A491	N361-S479 VanDerWaalsContact CG-OG 3.24Å; N361-S479 PolarHBondContact ND2-OG 3.45Å; N361-S479 PolarHBondContact OD1-OG 3.3Å; N361-S479 VanDerWaalsContact OD1-OG 3.06Å; S477-S479 PolarHBondContact O-N 2.85Å; S479-A491 VanDerWaalsContact O-CB 3.26Å; S479-A491 WeakPolarHBondContact O-CB 3.34Å; S479-A491 PolarHBondContact O-N 3.32Å
480	H	62.6	Low	60.5	Low	59 Å²	59	87.8 Å²	87.8	27%	0.273	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.1	-179.2	-72.5	67	0	0	0	111.3	C476 S477 C488 V489	C476-H480 HydrophobicContact CB-CB 4.26Å; S477-H480 PolarHBondContact O-N 2.74Å; H480-C488 HydrophobicContact CB-CB 4.24Å; H480-V489 CarbonylContact C-O 3.53Å; H480-V489 VanDerWaalsContact C-O 3.29Å; H480-V489 WeakPolarHBondContact CA-O 3.05Å; H480-V489 WeakPolarHBondContact CB-O 3.45Å; H480-V489 PolarHBondContact CD2-O 2.88Å
481	F	70.2	Confident	60.3	Low	51 Å²	51	84.5 Å²	84.5	22%	0.224	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.1	170.3	175.6	-103.3	0	0	0	110	C488 V489 R494 D506	F481-C488 WeakPolarHBondContact O-CA 3.21Å; F481-V489 HydrophobicContact CB-CG2 3.96Å; F481-V489 HydrophobicContact CD1-CG2 3.81Å; F481-V489 HydrophobicContact CG-CG2 4.39Å; F481-V489 PolarHBondContact N-O 2.99Å; F481-V489 PolarHBondContact O-N 3.34Å; F481-R494 HydrophobicContact CB-CB 4.32Å; F481-R494 HydrophobicContact CD1-CG 4.24Å; F481-R494 VanDerWaalsContact CD2-CD 3.46Å; F481-R494 HydrophobicContact CD2-CG 4.2Å; F481-R494 HydrophobicContact CE1-CG 4.49Å; F481-R494 HydrophobicContact CE2-CG 4.43Å; F481-R494 VanDerWaalsContact CE2-NE 3.32Å; F481-R494 HydrophobicContact CG-CB 4.33Å; F481-R494 HydrophobicContact CG-CG 4.09Å; F481-D506 HydrophobicContact CD1-CB 4.13Å; F481-D506 HydrophobicContact CE1-CB 4.09Å
482	K	70.6	Confident	60.7	Low	98 Å²	98	80.6 Å²	80.6	43%	0.426	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	113.7	177.4	-173.4	171.8	-172.9	168	0	109.5	E475	E475-K482 IonicContact OE2-NZ 2.73Å; E475-K482 PolarHBondContact OE2-NZ 3.43Å
483	C	74.4	Confident	61.5	Low	2 Å²	2	75.2 Å²	75.2	1%	0.014	41%	0.41	C	S	.	.			trans	-59.2	153.2	168.8	-52.8	0	0	0	0	110.1	S485 G486 Q487 C501	C483-S485 WeakPolarHBondContact CB-OG 3.3Å; C483-S485 PolarHBondContact O-N 3.43Å; C483-G486 PolarHBondContact O-N 2.7Å; C483-Q487 HydrophobicContact CB-CB 4.05Å; C483-Q487 VanDerWaalsContact CB-O 3.28Å; C483-Q487 WeakPolarHBondContact CB-O 3.32Å; C483-Q487 PolarHBondContact N-O 2.03Å; C483-Q487 PolarHBondContact SG-O 2.78Å; C483-C501 HydrophobicContact CB-CB 3.7Å; C483-C501 WeakPolarHBondContact CB-SG 3.4Å; C483-C501 VanDerWaalsContact SG-CA 3.59Å; C483-C501 WeakPolarHBondContact SG-CB 3.15Å; C483-C501 CovalentContact SG-SG 2.01Å; C483-C501 PolarHBondContact SG-SG 2.95Å
484	R	73.4	Confident	62.7	Low	184 Å²	184	75.1 Å²	75.1	69%	0.694	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.9	176.6	-177.6	-171.4	-63.9	151	5.3	111.3	G486 D503 S505 E508	R484-G486 PolarHBondContact O-N 2.76Å; R484-D503 VanDerWaalsContact CB-OD2 3.3Å; R484-D503 WeakPolarHBondContact CB-OD2 3.23Å; R484-S505 WeakPolarHBondContact CB-OG 3.44Å; R484-S505 PolarHBondContact N-OG 3.2Å; R484-E508 IonicContact CZ-OE2 3.23Å; R484-E508 VanDerWaalsContact CZ-OE2 3.23Å; R484-E508 IonicContact NH1-OE1 3.73Å; R484-E508 IonicContact NH1-OE2 3.05Å; R484-E508 PolarHBondContact NH1-OE2 3.29Å; R484-E508 IonicContact NH2-OE2 2.66Å; R484-E508 PolarHBondContact NH2-OE2 2.89Å
485	S	64.3	Low	63.5	Low	60 Å²	60	67.2 Å²	67.2	42%	0.42	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.8	171.2	66.2	0	0	0	0	114.1	C483 Q487 D503	C483-S485 WeakPolarHBondContact CB-OG 3.3Å; C483-S485 PolarHBondContact O-N 3.43Å; S485-Q487 PolarHBondContact OG-N 2.68Å; S485-D503 WeakPolarHBondContact CB-OD2 3.16Å; S485-D503 PolarHBondContact N-OD2 3.13Å
486	G	62.9	Low	64	Low	28 Å²	28	63.5 Å²	63.5	29%	0.289	35%	0.347	S	S	.	.	S	Bend	trans	94.6	-3.2	-176.3	0	0	0	0	0	114.7	C483 R484	C483-G486 PolarHBondContact O-N 2.7Å; R484-G486 PolarHBondContact O-N 2.76Å
487	Q	62.6	Low	64.3	Low	28 Å²	28	64.7 Å²	64.7	13%	0.131	37%	0.365	C	S	.	.			trans	-70.6	145.9	171.9	-174	-175	-4.8	0	0	111	C483 S485 D500 D502	C483-Q487 HydrophobicContact CB-CB 4.05Å; C483-Q487 VanDerWaalsContact CB-O 3.28Å; C483-Q487 WeakPolarHBondContact CB-O 3.32Å; C483-Q487 PolarHBondContact N-O 2.03Å; C483-Q487 PolarHBondContact SG-O 2.78Å; S485-Q487 PolarHBondContact OG-N 2.68Å; Q487-D500 PolarHBondContact NE2-O 3.33Å; Q487-D502 PolarHBondContact OE1-OD2 2.68Å
488	C	70.2	Confident	64.7	Low	48 Å²	48	67.3 Å²	67.3	32%	0.324	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.3	176.1	-51.7	0	0	0	0	109.7	E475 C476 H480 F481	E475-C488 PolarHBondContact O-SG 2.86Å; C476-C488 VanDerWaalsContact CA-SG 3.56Å; C476-C488 HydrophobicContact CB-CB 3.87Å; C476-C488 WeakPolarHBondContact CB-SG 2.97Å; C476-C488 WeakPolarHBondContact SG-CB 3.35Å; C476-C488 CovalentContact SG-SG 2.03Å; C476-C488 PolarHBondContact SG-SG 3.08Å; H480-C488 HydrophobicContact CB-CB 4.24Å; F481-C488 WeakPolarHBondContact O-CA 3.21Å
489	V	71.6	Confident	65.5	Low	11 Å²	11	63.4 Å²	63.4	7%	0.067	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	157.4	172.8	-63.5	0	0	0	0	109.6	H480 F481 R493 D500 D506	H480-V489 CarbonylContact C-O 3.53Å; H480-V489 VanDerWaalsContact C-O 3.29Å; H480-V489 WeakPolarHBondContact CA-O 3.05Å; H480-V489 WeakPolarHBondContact CB-O 3.45Å; H480-V489 PolarHBondContact CD2-O 2.88Å; F481-V489 HydrophobicContact CB-CG2 3.96Å; F481-V489 HydrophobicContact CD1-CG2 3.81Å; F481-V489 HydrophobicContact CG-CG2 4.39Å; F481-V489 PolarHBondContact N-O 2.99Å; F481-V489 PolarHBondContact O-N 3.34Å; V489-R493 HydrophobicContact CB-CB 4.45Å; V489-D500 HydrophobicContact CB-CB 4.44Å; V489-D500 HydrophobicContact CG1-CB 3.93Å; V489-D500 WeakPolarHBondContact CG1-O 3.42Å; V489-D506 HydrophobicContact CG2-CB 4.25Å
490	L	61.3	Low	66.7	Low	69 Å²	69	62.7 Å²	62.7	36%	0.361	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	145.2	177.4	-74.4	158.4	0	0	0	110.4	S492 R493	L490-S492 PolarHBondContact O-N 3.23Å; L490-S492 VanDerWaalsContact O-N 3.12Å; L490-R493 HydrophobicContact CB-CB 4.4Å; L490-R493 HydrophobicContact CB-CG 3.82Å; L490-R493 WeakPolarHBondContact O-CB 3.5Å; L490-R493 PolarHBondContact O-N 3.31Å
491	A	58.8	Low	67.2	Low	57 Å²	57	60.1 Å²	60.1	47%	0.471	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-62.4	-21.6	179	0	0	0	0	0	113.2	S479	S479-A491 VanDerWaalsContact O-CB 3.26Å; S479-A491 WeakPolarHBondContact O-CB 3.34Å; S479-A491 PolarHBondContact O-N 3.32Å
492	S	61.4	Low	67.3	Low	93 Å²	93	64.1 Å²	64.1	65%	0.65	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-77.4	-16.9	172.4	53.7	0	0	0	0	114.4	L490 R494	L490-S492 PolarHBondContact O-N 3.23Å; L490-S492 VanDerWaalsContact O-N 3.12Å; S492-R494 VanDerWaalsContact C-N 3.34Å
493	R	66.8	Low	67.3	Low	104 Å²	104	61.8 Å²	61.8	39%	0.392	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-89.6	-2.6	176.8	-63.7	-83.4	-173.4	130.6	-2.5	112.4	V489 L490 D496 D500	V489-R493 HydrophobicContact CB-CB 4.45Å; L490-R493 HydrophobicContact CB-CB 4.4Å; L490-R493 HydrophobicContact CB-CG 3.82Å; L490-R493 WeakPolarHBondContact O-CB 3.5Å; L490-R493 PolarHBondContact O-N 3.31Å; R493-D496 WeakPolarHBondContact CD-OD2 3.1Å; R493-D500 HydrophobicContact CB-CB 4.37Å; R493-D500 WeakPolarHBondContact CB-OD2 3.19Å; R493-D500 VanDerWaalsContact CD-OD2 3.26Å; R493-D500 WeakPolarHBondContact CD-OD2 2.86Å; R493-D500 IonicContact NH1-OD1 3.86Å; R493-D500 PolarHBondContact NH1-OD1 3.19Å; R493-D500 IonicContact NH1-OD2 2.7Å
494	R	71.5	Confident	67.1	Low	100 Å²	100	65.9 Å²	65.9	38%	0.377	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	124.4	174.5	-171.9	-171.7	179.6	-128.6	-12.6	108.3	F481 S492 D496	F481-R494 HydrophobicContact CB-CB 4.32Å; F481-R494 HydrophobicContact CD1-CG 4.24Å; F481-R494 VanDerWaalsContact CD2-CD 3.46Å; F481-R494 HydrophobicContact CD2-CG 4.2Å; F481-R494 HydrophobicContact CE1-CG 4.49Å; F481-R494 HydrophobicContact CE2-CG 4.43Å; F481-R494 VanDerWaalsContact CE2-NE 3.32Å; F481-R494 HydrophobicContact CG-CB 4.33Å; F481-R494 HydrophobicContact CG-CG 4.09Å; S492-R494 VanDerWaalsContact C-N 3.34Å; R494-D496 VanDerWaalsContact C-N 3.31Å
495	C	65.7	Low	67.2	Low	8 Å²	8	57.6 Å²	57.6	5%	0.054	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	26.5	179.5	-50.6	0	0	0	0	114.3	G497 D506 E507 C510 R515	C495-G497 VanDerWaalsContact C-N 3.27Å; C495-D506 PolarHBondContact N-O 3.41Å; C495-E507 WeakPolarHBondContact CA-OE1 3.48Å; C495-E507 PolarHBondContact N-OE1 3.29Å; C495-C510 WeakPolarHBondContact CA-SG 3.3Å; C495-C510 HydrophobicContact CB-CB 3.53Å; C495-C510 WeakPolarHBondContact CB-SG 3.4Å; C495-C510 WeakPolarHBondContact SG-CB 3.37Å; C495-C510 CovalentContact SG-SG 2.01Å; C495-C510 PolarHBondContact SG-SG 3.04Å; C495-R515 HydrophobicContact CB-CG 4Å; C495-R515 WeakPolarHBondContact O-CD 3.14Å; C495-R515 WeakPolarHBondContact O-CG 3.25Å; C495-R515 PolarHBondContact O-NE 2.01Å
496	D	64.3	Low	67.8	Low	74 Å²	74	54.7 Å²	54.7	40%	0.396	32%	0.321	S	S	.	.	S	Bend	trans	-86.4	-2.2	178.1	75	0.2	0	0	0	112.9	R493 R494 Q498 E507	R493-D496 WeakPolarHBondContact CD-OD2 3.1Å; R494-D496 VanDerWaalsContact C-N 3.31Å; D496-Q498 WeakPolarHBondContact OD1-CB 3.4Å; D496-Q498 PolarHBondContact OD1-N 3.2Å; D496-E507 PolarHBondContact N-OE1 2Å
497	G	62.8	Low	68.6	Low	56 Å²	56	55 Å²	55	58%	0.577	32%	0.315	S	S	*	.	S	Bend	trans	87.4	6.5	178.9	0	0	0	0	0	113.6	C495 E507	C495-G497 VanDerWaalsContact C-N 3.27Å; G497-E507 VanDerWaalsContact CA-OE2 3.32Å; G497-E507 WeakPolarHBondContact CA-OE2 3.12Å; G497-E507 PolarHBondContact N-OE1 2.75Å; G497-E507 VanDerWaalsContact N-OE1 3.12Å; G497-E507 PolarHBondContact N-OE2 3.37Å
498	Q	63.1	Low	68.8	Low	102 Å²	102	57.9 Å²	57.9	48%	0.477	33%	0.328	S	S	.	.	S	Bend	trans	-111.6	141.4	172.5	-173.5	169.8	-30.5	0	0	109.7	D496 D500 E507	D496-Q498 WeakPolarHBondContact OD1-CB 3.4Å; D496-Q498 PolarHBondContact OD1-N 3.2Å; Q498-D500 PolarHBondContact O-N 3.04Å; Q498-D500 VanDerWaalsContact O-N 3.13Å; Q498-E507 WeakPolarHBondContact O-CG 3.39Å
499	A	68.4	Low	68.6	Low	59 Å²	59	63 Å²	63	49%	0.488	35%	0.353	S	S	.	.			trans	-78.2	90.9	170.9	0	0	0	0	0	109.2	D504	A499-D504 WeakPolarHBondContact CB-OD1 3.19Å
500	D	73.9	Confident	68.3	Low	26 Å²	26	63.7 Å²	63.7	14%	0.139	36%	0.358	C	S	.	.			trans	-90.9	-20.1	174.3	-65.6	-70.6	0	0	0	112.1	Q487 V489 R493 Q498 D506	Q487-D500 PolarHBondContact NE2-O 3.33Å; V489-D500 HydrophobicContact CB-CB 4.44Å; V489-D500 HydrophobicContact CG1-CB 3.93Å; V489-D500 WeakPolarHBondContact CG1-O 3.42Å; R493-D500 HydrophobicContact CB-CB 4.37Å; R493-D500 WeakPolarHBondContact CB-OD2 3.19Å; R493-D500 VanDerWaalsContact CD-OD2 3.26Å; R493-D500 WeakPolarHBondContact CD-OD2 2.86Å; R493-D500 IonicContact NH1-OD1 3.86Å; R493-D500 PolarHBondContact NH1-OD1 3.19Å; R493-D500 IonicContact NH1-OD2 2.7Å; Q498-D500 PolarHBondContact O-N 3.04Å; Q498-D500 VanDerWaalsContact O-N 3.13Å; D500-D506 VanDerWaalsContact CA-OD2 3.25Å; D500-D506 WeakPolarHBondContact CA-OD2 3.35Å; D500-D506 VanDerWaalsContact CB-OD2 3.23Å; D500-D506 WeakPolarHBondContact CB-OD2 3.05Å; D500-D506 PolarHBondContact N-OD2 2.01Å
501	C	73.6	Confident	68.3	Low	4 Å²	4	62.2 Å²	62.2	3%	0.027	36%	0.359	C	S	.	.	S	Bend	trans	-85	139.7	165.6	-66.3	0	0	0	0	111.6	C483 D503 D504 D506	C483-C501 HydrophobicContact CB-CB 3.7Å; C483-C501 WeakPolarHBondContact CB-SG 3.4Å; C483-C501 VanDerWaalsContact SG-CA 3.59Å; C483-C501 WeakPolarHBondContact SG-CB 3.15Å; C483-C501 CovalentContact SG-SG 2.01Å; C483-C501 PolarHBondContact SG-SG 2.95Å; C501-D503 WeakPolarHBondContact CB-OD1 3.14Å; C501-D503 PolarHBondContact O-N 3.41Å; C501-D504 PolarHBondContact O-N 2.79Å; C501-D504 VanDerWaalsContact O-N 3.07Å; C501-D506 HydrophobicContact CB-CB 4.35Å; C501-D506 WeakPolarHBondContact CB-OD1 3.48Å; C501-D506 PolarHBondContact N-OD1 2.83Å; C501-D506 PolarHBondContact N-OD2 3.41Å; C501-D506 WeakPolarHBondContact SG-CB 3.32Å; C501-D506 PolarHBondContact SG-OD1 3.24Å
502	D	72.1	Confident	68.4	Low	136 Å²	136	59.9 Å²	59.9	73%	0.727	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-16.9	172.8	-69.6	-26.1	0	0	0	114.2	Q487	Q487-D502 PolarHBondContact OE1-OD2 2.68Å
503	D	70.4	Confident	68.2	Low	49 Å²	49	64.6 Å²	64.6	26%	0.262	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	17.2	-178.5	69.5	-7.7	0	0	0	113.9	R484 S485 C501 S505	R484-D503 VanDerWaalsContact CB-OD2 3.3Å; R484-D503 WeakPolarHBondContact CB-OD2 3.23Å; S485-D503 WeakPolarHBondContact CB-OD2 3.16Å; S485-D503 PolarHBondContact N-OD2 3.13Å; C501-D503 WeakPolarHBondContact CB-OD1 3.14Å; C501-D503 PolarHBondContact O-N 3.41Å; D503-S505 PolarHBondContact O-N 3.24Å; D503-S505 WeakPolarHBondContact OD1-CB 3.4Å; D503-S505 PolarHBondContact OD1-N 3.46Å; D503-S505 PolarHBondContact OD1-OG 3.34Å; D503-S505 PolarHBondContact OD2-OG 3.49Å
504	D	70.5	Confident	67.7	Low	88 Å²	88	66 Å²	66	47%	0.471	36%	0.359	S	S	.	.	S	Bend	trans	55.6	15.1	-179.8	-55.2	-31.6	0	0	0	114.6	A499 C501 D506 E507 E508	A499-D504 WeakPolarHBondContact CB-OD1 3.19Å; C501-D504 PolarHBondContact O-N 2.79Å; C501-D504 VanDerWaalsContact O-N 3.07Å; D504-D506 VanDerWaalsContact C-OD1 3.24Å; D504-D506 PolarHBondContact O-N 2.94Å; D504-E507 PolarHBondContact O-N 2.63Å; D504-E508 PolarHBondContact O-N 2.83Å
505	S	75.6	Confident	67	Low	9 Å²	9	64.7 Å²	64.7	6%	0.063	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.6	-173.9	-68.9	0	0	0	0	114.3	R484 D503 E507	R484-S505 WeakPolarHBondContact CB-OG 3.44Å; R484-S505 PolarHBondContact N-OG 3.2Å; D503-S505 PolarHBondContact O-N 3.24Å; D503-S505 WeakPolarHBondContact OD1-CB 3.4Å; D503-S505 PolarHBondContact OD1-N 3.46Å; D503-S505 PolarHBondContact OD1-OG 3.34Å; D503-S505 PolarHBondContact OD2-OG 3.49Å; S505-E507 VanDerWaalsContact C-N 3.26Å
506	D	76	Confident	66.6	Low	0 Å²	0	71 Å²	71	0%	0	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.9	173.4	51.8	-27.3	0	0	0	113.1	F481 V489 C495 D500 C501 D504 C510	F481-D506 HydrophobicContact CD1-CB 4.13Å; F481-D506 HydrophobicContact CE1-CB 4.09Å; V489-D506 HydrophobicContact CG2-CB 4.25Å; C495-D506 PolarHBondContact N-O 3.41Å; D500-D506 VanDerWaalsContact CA-OD2 3.25Å; D500-D506 WeakPolarHBondContact CA-OD2 3.35Å; D500-D506 VanDerWaalsContact CB-OD2 3.23Å; D500-D506 WeakPolarHBondContact CB-OD2 3.05Å; D500-D506 PolarHBondContact N-OD2 2.01Å; C501-D506 HydrophobicContact CB-CB 4.35Å; C501-D506 WeakPolarHBondContact CB-OD1 3.48Å; C501-D506 PolarHBondContact N-OD1 2.83Å; C501-D506 PolarHBondContact N-OD2 3.41Å; C501-D506 WeakPolarHBondContact SG-CB 3.32Å; C501-D506 PolarHBondContact SG-OD1 3.24Å; D504-D506 VanDerWaalsContact C-OD1 3.24Å; D504-D506 PolarHBondContact O-N 2.94Å; D506-C510 PolarHBondContact O-SG 3.33Å; D506-C510 VanDerWaalsContact O-SG 3.41Å
507	E	79.1	Confident	66.6	Low	34 Å²	34	69.4 Å²	69.4	16%	0.159	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-5.8	-179.9	-66.2	-59.5	126.6	0	0	113.2	C495 D496 G497 Q498 D504 S505 R515	C495-E507 WeakPolarHBondContact CA-OE1 3.48Å; C495-E507 PolarHBondContact N-OE1 3.29Å; D496-E507 PolarHBondContact N-OE1 2Å; G497-E507 VanDerWaalsContact CA-OE2 3.32Å; G497-E507 WeakPolarHBondContact CA-OE2 3.12Å; G497-E507 PolarHBondContact N-OE1 2.75Å; G497-E507 VanDerWaalsContact N-OE1 3.12Å; G497-E507 PolarHBondContact N-OE2 3.37Å; Q498-E507 WeakPolarHBondContact O-CG 3.39Å; D504-E507 PolarHBondContact O-N 2.63Å; S505-E507 VanDerWaalsContact C-N 3.26Å; E507-R515 PolarHBondContact O-NH2 3.11Å; E507-R515 IonicContact OE2-CZ 3.88Å; E507-R515 IonicContact OE2-NE 2.66Å; E507-R515 IonicContact OE2-NH1 3.97Å; E507-R515 IonicContact OE2-NH2 3.38Å; E507-R515 PolarHBondContact OE2-NH2 2.81Å
508	E	68.8	Low	66.7	Low	89 Å²	89	70.5 Å²	70.5	42%	0.416	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	133.7	175.1	-72.3	-168.6	163.6	0	0	112	R484 D504 C510	R484-E508 IonicContact CZ-OE2 3.23Å; R484-E508 VanDerWaalsContact CZ-OE2 3.23Å; R484-E508 IonicContact NH1-OE1 3.73Å; R484-E508 IonicContact NH1-OE2 3.05Å; R484-E508 PolarHBondContact NH1-OE2 3.29Å; R484-E508 IonicContact NH2-OE2 2.66Å; R484-E508 PolarHBondContact NH2-OE2 2.89Å; D504-E508 PolarHBondContact O-N 2.83Å; E508-C510 PolarHBondContact O-N 3.42Å
509	N	64	Low	67.1	Low	155 Å²	155	69.5 Å²	69.5	83%	0.829	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	32.3	174.9	-162.6	58.3	0	0	0	115
510	C	67.3	Low	67.3	Low	26 Å²	26	66.7 Å²	66.7	18%	0.176	34%	0.337	C	S	.	.			trans	-90.1	126	171.5	-59.5	0	0	0	0	111.2	C495 D506 E508 R515	C495-C510 WeakPolarHBondContact CA-SG 3.3Å; C495-C510 HydrophobicContact CB-CB 3.53Å; C495-C510 WeakPolarHBondContact CB-SG 3.4Å; C495-C510 WeakPolarHBondContact SG-CB 3.37Å; C495-C510 CovalentContact SG-SG 2.01Å; C495-C510 PolarHBondContact SG-SG 3.04Å; D506-C510 PolarHBondContact O-SG 3.33Å; D506-C510 VanDerWaalsContact O-SG 3.41Å; E508-C510 PolarHBondContact O-N 3.42Å; C510-R515 VanDerWaalsContact CB-NH2 3.32Å
511	G	60.4	Low	67.1	Low	37 Å²	37	69.7 Å²	69.7	38%	0.381	36%	0.358	S	S	.	.			trans	-86.6	152.1	172.3	0	0	0	0	0	112.3	K513 E514 R515	G511-K513 PolarHBondContact O-N 3.15Å; G511-K513 VanDerWaalsContact O-N 3.07Å; G511-E514 PolarHBondContact O-N 3.47Å; G511-R515 PolarHBondContact O-N 3.31Å
512	C	61	Low	66.5	Low	9 Å²	9	72.3 Å²	72.3	6%	0.061	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.1	178.8	-60	0	0	0	0	113.1	R515 D516 L517 E519 C526	C512-R515 PolarHBondContact O-N 3.26Å; C512-D516 PolarHBondContact O-N 2.97Å; C512-L517 CarbonylContact C-O 3.6Å; C512-L517 PolarHBondContact O-N 3.14Å; C512-L517 VanDerWaalsContact O-O 3.07Å; C512-E519 HydrophobicContact CB-CB 4Å; C512-E519 HydrophobicContact CB-CG 4.49Å; C512-C526 WeakPolarHBondContact CA-SG 3.27Å; C512-C526 HydrophobicContact CB-CB 3.82Å; C512-C526 WeakPolarHBondContact CB-SG 3.3Å; C512-C526 VanDerWaalsContact SG-CA 3.59Å; C512-C526 WeakPolarHBondContact SG-CB 2.86Å; C512-C526 CovalentContact SG-SG 2.04Å; C512-C526 PolarHBondContact SG-SG 2.57Å
513	K	56.4	Low	66.3	Low	191 Å²	191	69.2 Å²	69.2	83%	0.83	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.6	178.3	-161.9	177.2	-177.8	-178.6	0	114.4	G511 R515	G511-K513 PolarHBondContact O-N 3.15Å; G511-K513 VanDerWaalsContact O-N 3.07Å; K513-R515 VanDerWaalsContact C-N 3.33Å
514	E	56.6	Low	66	Low	134 Å²	134	74.1 Å²	74.1	63%	0.626	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-17.6	174.9	-68.3	179.3	172.7	0	0	111.7	G511	G511-E514 PolarHBondContact O-N 3.47Å
515	R	57.4	Low	65.6	Low	73 Å²	73	74 Å²	74	28%	0.275	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	1.6	174.3	-54.5	-160.3	173.6	163.4	0.6	114.1	C495 E507 C510 G511 C512 K513 L517	C495-R515 HydrophobicContact CB-CG 4Å; C495-R515 WeakPolarHBondContact O-CD 3.14Å; C495-R515 WeakPolarHBondContact O-CG 3.25Å; C495-R515 PolarHBondContact O-NE 2.01Å; E507-R515 PolarHBondContact O-NH2 3.11Å; E507-R515 IonicContact OE2-CZ 3.88Å; E507-R515 IonicContact OE2-NE 2.66Å; E507-R515 IonicContact OE2-NH1 3.97Å; E507-R515 IonicContact OE2-NH2 3.38Å; E507-R515 PolarHBondContact OE2-NH2 2.81Å; C510-R515 VanDerWaalsContact CB-NH2 3.32Å; G511-R515 PolarHBondContact O-N 3.31Å; C512-R515 PolarHBondContact O-N 3.26Å; K513-R515 VanDerWaalsContact C-N 3.33Å; R515-L517 VanDerWaalsContact C-N 3.25Å; R515-L517 HydrophobicContact CB-CB 4.39Å; R515-L517 HydrophobicContact CB-CD1 3.68Å; R515-L517 HydrophobicContact CB-CG 3.92Å; R515-L517 WeakPolarHBondContact O-CG 3.42Å; R515-L517 PolarHBondContact O-N 3.43Å
516	D	57.3	Low	65.4	Low	140 Å²	140	75.6 Å²	75.6	75%	0.749	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	36.4	-172.1	-131.6	12.5	0	0	0	113.2	C512	C512-D516 PolarHBondContact O-N 2.97Å
517	L	64.4	Low	64.9	Low	41 Å²	41	76.3 Å²	76.3	22%	0.215	39%	0.39	C	S	.	.			trans	-118.2	149.4	-177.2	-63	171	0	0	0	111.5	C512 R515 C526 L527 K528	C512-L517 CarbonylContact C-O 3.6Å; C512-L517 PolarHBondContact O-N 3.14Å; C512-L517 VanDerWaalsContact O-O 3.07Å; R515-L517 VanDerWaalsContact C-N 3.25Å; R515-L517 HydrophobicContact CB-CB 4.39Å; R515-L517 HydrophobicContact CB-CD1 3.68Å; R515-L517 HydrophobicContact CB-CG 3.92Å; R515-L517 WeakPolarHBondContact O-CG 3.42Å; R515-L517 PolarHBondContact O-N 3.43Å; L517-C526 HydrophobicContact CB-CB 3.78Å; L517-C526 HydrophobicContact CD1-CB 3.75Å; L517-C526 HydrophobicContact CG-CB 4.4Å; L517-L527 CarbonylContact C-O 3.57Å; L517-L527 WeakPolarHBondContact CA-O 3.18Å; L517-L527 WeakPolarHBondContact CB-O 3.31Å; L517-K528 HydrophobicContact CD2-CB 4.14Å; L517-K528 HydrophobicContact CD2-CG 3.43Å; L517-K528 VanDerWaalsContact CD2-CG 3.43Å
518	W	63.8	Low	64	Low	78 Å²	78	81.3 Å²	81.3	30%	0.295	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	139	176.6	-173.9	88	0	0	0	111.5	P521 C526 L527 I532	W518-P521 HydrophobicContact CH2-CG 4.26Å; W518-C526 CarbonylContact O-C 3.29Å; W518-C526 WeakPolarHBondContact O-CA 3.18Å; W518-L527 HydrophobicContact CE3-CB 4.41Å; W518-L527 HydrophobicContact CE3-CD1 4.2Å; W518-L527 HydrophobicContact CZ3-CD1 4.22Å; W518-L527 PolarHBondContact N-O 3.47Å; W518-L527 PolarHBondContact O-N 3.12Å; W518-I532 HydrophobicContact CB-CD1 3.64Å; W518-I532 HydrophobicContact CD2-CD1 3.77Å; W518-I532 HydrophobicContact CD2-CG1 4.43Å; W518-I532 HydrophobicContact CE3-CD1 4.23Å; W518-I532 HydrophobicContact CE3-CG1 4.41Å; W518-I532 HydrophobicContact CG-CD1 3.5Å; W518-I532 VanDerWaalsContact CG-CD1 3.5Å
519	E	72.9	Confident	63.5	Low	82 Å²	82	83 Å²	83	38%	0.383	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.7	-173.7	-173.3	176.5	168.4	0	0	111.5	C512 K524	C512-E519 HydrophobicContact CB-CB 4Å; C512-E519 HydrophobicContact CB-CG 4.49Å; E519-K524 HydrophobicContact CG-CB 4.1Å; E519-K524 WeakPolarHBondContact OE1-CB 3.44Å; E519-K524 WeakPolarHBondContact OE1-CD 3.48Å; E519-K524 WeakPolarHBondContact OE1-CG 3Å
520	C	72.3	Confident	63.3	Low	0 Å²	0	81 Å²	81	0%	0	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-57.7	125.9	172.7	-74.7	0	0	0	0	109.6	S522 N523 K524 Q525 L527 C539	C520-S522 PolarHBondContact O-N 3.49Å; C520-N523 WeakPolarHBondContact CB-OD1 3.26Å; C520-K524 WeakPolarHBondContact O-CA 2.95Å; C520-K524 PolarHBondContact O-N 2.65Å; C520-Q525 HydrophobicContact CB-CB 4.19Å; C520-Q525 PolarHBondContact N-O 2.91Å; C520-L527 VanDerWaalsContact SG-CD1 3.52Å; C520-C539 HydrophobicContact CB-CB 4.2Å; C520-C539 WeakPolarHBondContact CB-SG 3.22Å; C520-C539 WeakPolarHBondContact SG-CB 3.45Å; C520-C539 CovalentContact SG-SG 2.06Å; C520-C539 PolarHBondContact SG-SG 2.04Å
521	P	68.3	Low	63.2	Low	88 Å²	88	81 Å²	81	57%	0.571	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.7	-173	-26.8	33.5	0	0	0	115.9	W518 M543	W518-P521 HydrophobicContact CH2-CG 4.26Å; P521-M543 HydrophobicContact CG-CE 4.44Å
522	S	62.6	Low	63.4	Low	60 Å²	60	81.4 Å²	81.4	42%	0.42	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-40.2	-171.6	51.9	0	0	0	0	114.6	C520 D541	C520-S522 PolarHBondContact O-N 3.49Å; S522-D541 WeakPolarHBondContact CB-OD2 3.26Å; S522-D541 PolarHBondContact OG-OD2 3.29Å
523	N	67.3	Low	63.5	Low	70 Å²	70	82.2 Å²	82.2	37%	0.374	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-0.3	-174.9	70.5	-11	0	0	0	114	C520 Q525 P540	C520-N523 WeakPolarHBondContact CB-OD1 3.26Å; N523-Q525 WeakPolarHBondContact ND2-CB 3.32Å; N523-Q525 PolarHBondContact ND2-OE1 2.99Å; N523-Q525 PolarHBondContact O-N 3.38Å; N523-Q525 WeakPolarHBondContact OD1-CB 2.88Å; N523-Q525 PolarHBondContact OD1-N 3.36Å; N523-P540 VanDerWaalsContact ND2-CG 3.33Å; N523-P540 WeakPolarHBondContact ND2-CG 3.05Å
524	K	63.1	Low	63.6	Low	153 Å²	153	74.3 Å²	74.3	67%	0.665	38%	0.377	S	S	*	.			trans	60.6	23.4	-175.7	-53.2	-164.9	163.5	-156.8	0	114.9	E519 C520	E519-K524 HydrophobicContact CG-CB 4.1Å; E519-K524 WeakPolarHBondContact OE1-CB 3.44Å; E519-K524 WeakPolarHBondContact OE1-CD 3.48Å; E519-K524 WeakPolarHBondContact OE1-CG 3Å; C520-K524 WeakPolarHBondContact O-CA 2.95Å; C520-K524 PolarHBondContact O-N 2.65Å
525	Q	64	Low	63.8	Low	84 Å²	84	69.3 Å²	69.3	39%	0.393	36%	0.362	S	S	.	.			trans	-70.2	132.4	174.2	-177.5	173.8	-0.8	0	0	109.8	C520 N523	C520-Q525 HydrophobicContact CB-CB 4.19Å; C520-Q525 PolarHBondContact N-O 2.91Å; N523-Q525 WeakPolarHBondContact ND2-CB 3.32Å; N523-Q525 PolarHBondContact ND2-OE1 2.99Å; N523-Q525 PolarHBondContact O-N 3.38Å; N523-Q525 WeakPolarHBondContact OD1-CB 2.88Å; N523-Q525 PolarHBondContact OD1-N 3.36Å
526	C	70.1	Confident	63.8	Low	43 Å²	43	70 Å²	70	29%	0.291	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.8	179.5	-46.7	0	0	0	0	110.3	C512 L517 W518	C512-C526 WeakPolarHBondContact CA-SG 3.27Å; C512-C526 HydrophobicContact CB-CB 3.82Å; C512-C526 WeakPolarHBondContact CB-SG 3.3Å; C512-C526 VanDerWaalsContact SG-CA 3.59Å; C512-C526 WeakPolarHBondContact SG-CB 2.86Å; C512-C526 CovalentContact SG-SG 2.04Å; C512-C526 PolarHBondContact SG-SG 2.57Å; L517-C526 HydrophobicContact CB-CB 3.78Å; L517-C526 HydrophobicContact CD1-CB 3.75Å; L517-C526 HydrophobicContact CG-CB 4.4Å; W518-C526 CarbonylContact O-C 3.29Å; W518-C526 WeakPolarHBondContact O-CA 3.18Å
527	L	65.1	Low	64.2	Low	15 Å²	15	66.6 Å²	66.6	8%	0.079	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	147.8	178.9	-66.3	-176.5	0	0	0	110.5	L517 W518 C520 V531 D538 C539 D544	L517-L527 CarbonylContact C-O 3.57Å; L517-L527 WeakPolarHBondContact CA-O 3.18Å; L517-L527 WeakPolarHBondContact CB-O 3.31Å; W518-L527 HydrophobicContact CE3-CB 4.41Å; W518-L527 HydrophobicContact CE3-CD1 4.2Å; W518-L527 HydrophobicContact CZ3-CD1 4.22Å; W518-L527 PolarHBondContact N-O 3.47Å; W518-L527 PolarHBondContact O-N 3.12Å; C520-L527 VanDerWaalsContact SG-CD1 3.52Å; L527-V531 HydrophobicContact CB-CG2 3.87Å; L527-V531 HydrophobicContact CD2-CG2 4.26Å; L527-V531 HydrophobicContact CG-CG2 4.48Å; L527-D538 HydrophobicContact CD1-CB 4.17Å; L527-D538 HydrophobicContact CD2-CB 4.12Å; L527-C539 VanDerWaalsContact CD1-SG 3.53Å; L527-D544 HydrophobicContact CD1-CB 4.26Å
528	K	60.9	Low	64.5	Low	140 Å²	140	67.1 Å²	67.1	61%	0.609	36%	0.355	S	S	*	.			trans	-69.9	146.4	170.3	-74	-178	177.8	-176.8	0	109.3	L517 T530 V531	L517-K528 HydrophobicContact CD2-CB 4.14Å; L517-K528 HydrophobicContact CD2-CG 3.43Å; L517-K528 VanDerWaalsContact CD2-CG 3.43Å; K528-T530 PolarHBondContact O-N 2.74Å; K528-V531 HydrophobicContact CB-CG2 4.27Å; K528-V531 WeakPolarHBondContact O-CG2 3.29Å; K528-V531 PolarHBondContact O-N 3.01Å
529	H	58.8	Low	64.9	Low	123 Å²	123	63.6 Å²	63.6	57%	0.569	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-58.9	-19.4	177	-81.3	-88.1	0	0	0	113.8
530	T	59.2	Low	64.5	Low	114 Å²	114	64 Å²	64	70%	0.699	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-80.6	-10.2	178	58	0	0	0	0	114.6	K528	K528-T530 PolarHBondContact O-N 2.74Å
531	V	65.6	Low	64.2	Low	27 Å²	27	67.9 Å²	67.9	16%	0.164	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-112	24.7	-179	-58.4	0	0	0	0	111.4	L527 K528	L527-V531 HydrophobicContact CB-CG2 3.87Å; L527-V531 HydrophobicContact CD2-CG2 4.26Å; L527-V531 HydrophobicContact CG-CG2 4.48Å; K528-V531 HydrophobicContact CB-CG2 4.27Å; K528-V531 WeakPolarHBondContact O-CG2 3.29Å; K528-V531 PolarHBondContact O-N 3.01Å
532	I	64.3	Low	64.2	Low	45 Å²	45	69.1 Å²	69.1	23%	0.231	37%	0.367	C	S	.	.	S	Bend	trans	-106.5	126.4	173.2	-55	172	0	0	0	105.7	W518	W518-I532 HydrophobicContact CB-CD1 3.64Å; W518-I532 HydrophobicContact CD2-CD1 3.77Å; W518-I532 HydrophobicContact CD2-CG1 4.43Å; W518-I532 HydrophobicContact CE3-CD1 4.23Å; W518-I532 HydrophobicContact CE3-CG1 4.41Å; W518-I532 HydrophobicContact CG-CD1 3.5Å; W518-I532 VanDerWaalsContact CG-CD1 3.5Å
533	C	62.7	Low	64.4	Low	26 Å²	26	69.7 Å²	69.7	18%	0.176	36%	0.364	C	S	.	.	S	Bend	trans	62.7	43	-177.5	-58.9	0	0	0	0	113.2	D544 E545 C548 H561	C533-D544 PolarHBondContact N-O 3.12Å; C533-D544 PolarHBondContact SG-O 2.96Å; C533-E545 WeakPolarHBondContact CA-OE1 3.24Å; C533-E545 PolarHBondContact N-OE1 3.34Å; C533-E545 VanDerWaalsContact N-OE1 3.13Å; C533-C548 WeakPolarHBondContact CA-SG 3.39Å; C533-C548 HydrophobicContact CB-CB 3.66Å; C533-C548 WeakPolarHBondContact CB-SG 3.25Å; C533-C548 WeakPolarHBondContact SG-CA 3.33Å; C533-C548 WeakPolarHBondContact SG-CB 3.36Å; C533-C548 CovalentContact SG-SG 2.01Å; C533-C548 PolarHBondContact SG-SG 2.79Å; C533-H561 WeakPolarHBondContact O-CB 2.96Å; C533-H561 PolarHBondContact O-CD2 3.13Å
534	D	59.6	Low	64.5	Low	24 Å²	24	66.5 Å²	66.5	13%	0.128	35%	0.347	C	S	.	.	S	Bend	trans	-103.5	7.5	179.4	77.7	7.7	0	0	0	113	F536 E545 H561 R779	D534-F536 VanDerWaalsContact C-N 3.28Å; D534-F536 VanDerWaalsContact O-CD2 3.29Å; D534-F536 WeakPolarHBondContact O-CD2 3.14Å; D534-F536 PolarHBondContact O-N 2.8Å; D534-F536 WeakPolarHBondContact OD1-CB 3.48Å; D534-F536 PolarHBondContact OD1-N 3.39Å; D534-E545 PolarHBondContact N-OE1 2.77Å; D534-H561 VanDerWaalsContact C-CD2 3.41Å; D534-H561 VanDerWaalsContact C-NE2 3.33Å; D534-H561 PolarHBondContact O-NE2 3.38Å; D534-R779 VanDerWaalsContact CG-NH1 3.29Å; D534-R779 IonicContact OD1-NH1 3.15Å; D534-R779 IonicContact OD2-CZ 3.85Å; D534-R779 IonicContact OD2-NH1 2.97Å; D534-R779 PolarHBondContact OD2-NH1 3.4Å; D534-R779 IonicContact OD2-NH2 3.29Å; D534-R779 PolarHBondContact OD2-NH2 2.6Å
535	G	59.2	Low	65	Low	30 Å²	30	60.4 Å²	60.4	31%	0.309	32%	0.321	S	S	.	.	S	Bend	trans	83.8	-0.9	179	0	0	0	0	0	113.8	E545 H561	G535-E545 WeakPolarHBondContact CA-OE2 3.48Å; G535-E545 PolarHBondContact N-OE1 3.19Å; G535-E545 PolarHBondContact N-OE2 3.41Å; G535-E545 VanDerWaalsContact N-OE2 3.14Å; G535-H561 PolarHBondContact N-NE2 2.85Å
536	F	58.5	Low	65	Low	86 Å²	86	62.4 Å²	62.4	38%	0.377	33%	0.328	S	S	.	.	S	Bend	trans	-114.7	136.3	177.6	-63	-91.3	0	0	0	111.1	D534 D538 E545 R779	D534-F536 VanDerWaalsContact C-N 3.28Å; D534-F536 VanDerWaalsContact O-CD2 3.29Å; D534-F536 WeakPolarHBondContact O-CD2 3.14Å; D534-F536 PolarHBondContact O-N 2.8Å; D534-F536 WeakPolarHBondContact OD1-CB 3.48Å; D534-F536 PolarHBondContact OD1-N 3.39Å; F536-D538 PolarHBondContact O-N 3.21Å; F536-E545 WeakPolarHBondContact O-CG 3.43Å; F536-R779 VanDerWaalsContact CD2-NH1 3.26Å
537	P	65.6	Low	64.6	Low	69 Å²	69	67.4 Å²	67.4	45%	0.448	35%	0.352	S	S	.	.			trans	-75.6	94.1	173.1	29.4	-33.6	0	0	0	111.5	Y542	P537-Y542 HydrophobicContact CB-CD2 3.36Å; P537-Y542 HydrophobicContact CB-CE2 3.39Å; P537-Y542 HydrophobicContact CB-CG 4.09Å; P537-Y542 HydrophobicContact CG-CD2 3.96Å; P537-Y542 HydrophobicContact CG-CE2 3.5Å; P537-Y542 VanDerWaalsContact CG-CE2 3.5Å
538	D	70	Confident	64.5	Low	53 Å²	53	68 Å²	68	28%	0.283	36%	0.357	S	S	.	.			trans	-86.7	-23.6	172.3	-72.7	-51.4	0	0	0	111.8	L527 F536 D544 R779	L527-D538 HydrophobicContact CD1-CB 4.17Å; L527-D538 HydrophobicContact CD2-CB 4.12Å; F536-D538 PolarHBondContact O-N 3.21Å; D538-D544 VanDerWaalsContact CA-OD2 3.31Å; D538-D544 WeakPolarHBondContact CA-OD2 3.24Å; D538-D544 WeakPolarHBondContact CB-OD2 3.23Å; D538-D544 PolarHBondContact N-OD2 3.05Å; D538-R779 IonicContact OD1-NH2 3.7Å; D538-R779 IonicContact OD2-NH2 3.76Å; D538-R779 PolarHBondContact OD2-NH2 3.2Å
539	C	73	Confident	64.3	Low	3 Å²	3	65.8 Å²	65.8	2%	0.02	36%	0.359	C	S	.	.	S	Bend	trans	-91.5	143.8	164.8	-63.9	0	0	0	0	112	C520 L527 D541 Y542 D544	C520-C539 HydrophobicContact CB-CB 4.2Å; C520-C539 WeakPolarHBondContact CB-SG 3.22Å; C520-C539 WeakPolarHBondContact SG-CB 3.45Å; C520-C539 CovalentContact SG-SG 2.06Å; C520-C539 PolarHBondContact SG-SG 2.04Å; L527-C539 VanDerWaalsContact CD1-SG 3.53Å; C539-D541 PolarHBondContact O-N 3.4Å; C539-Y542 PolarHBondContact O-N 3.17Å; C539-D544 HydrophobicContact CB-CB 4.37Å; C539-D544 WeakPolarHBondContact CB-OD1 3.14Å; C539-D544 PolarHBondContact N-OD1 3.16Å; C539-D544 PolarHBondContact N-OD2 2.79Å
540	P	65.3	Low	64.3	Low	92 Å²	92	68.8 Å²	68.8	60%	0.597	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.7	178.9	-19.7	27.4	0	0	0	114.9	N523	N523-P540 VanDerWaalsContact ND2-CG 3.33Å; N523-P540 WeakPolarHBondContact ND2-CG 3.05Å
541	D	66	Low	64.6	Low	81 Å²	81	64.9 Å²	64.9	43%	0.433	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	10.7	-177.8	-66.8	-56.8	0	0	0	113.8	S522 C539 M543 K546	S522-D541 WeakPolarHBondContact CB-OD2 3.26Å; S522-D541 PolarHBondContact OG-OD2 3.29Å; C539-D541 PolarHBondContact O-N 3.4Å; D541-M543 HydrophobicContact CB-CG 3.87Å; D541-M543 PolarHBondContact O-N 3.01Å; D541-K546 PolarHBondContact O-NZ 3.08Å
542	Y	66.7	Low	64.8	Low	114 Å²	114	69.5 Å²	69.5	45%	0.447	37%	0.368	S	S	.	.	S	Bend	trans	61.2	23.9	-179.9	-135.4	-84.2	0	0	0	112.2	P537 C539 D544 E545 K546	P537-Y542 HydrophobicContact CB-CD2 3.36Å; P537-Y542 HydrophobicContact CB-CE2 3.39Å; P537-Y542 HydrophobicContact CB-CG 4.09Å; P537-Y542 HydrophobicContact CG-CD2 3.96Å; P537-Y542 HydrophobicContact CG-CE2 3.5Å; P537-Y542 VanDerWaalsContact CG-CE2 3.5Å; C539-Y542 PolarHBondContact O-N 3.17Å; Y542-D544 WeakPolarHBondContact CA-OD1 3.04Å; Y542-E545 HydrophobicContact CD1-CB 3.44Å; Y542-E545 VanDerWaalsContact CD1-CB 3.44Å; Y542-E545 HydrophobicContact CD1-CG 4.2Å; Y542-E545 HydrophobicContact CE1-CB 3.44Å; Y542-E545 VanDerWaalsContact CE1-CB 3.44Å; Y542-E545 HydrophobicContact CE1-CG 3.95Å; Y542-E545 HydrophobicContact CG-CB 4.44Å; Y542-E545 PolarHBondContact O-N 3.35Å; Y542-K546 WeakPolarHBondContact O-CB 3.43Å; Y542-K546 WeakPolarHBondContact O-CD 3.48Å; Y542-K546 WeakPolarHBondContact O-CG 3.46Å; Y542-K546 PolarHBondContact O-N 3.33Å; Y542-K546 VanDerWaalsContact O-N 3.13Å
543	M	67.1	Low	64.8	Low	72 Å²	72	75.5 Å²	75.5	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-80.6	-31.4	-169.9	-82.7	-63.1	-56	0	0	113.2	P521 D541 E545 K546	P521-M543 HydrophobicContact CG-CE 4.44Å; D541-M543 HydrophobicContact CB-CG 3.87Å; D541-M543 PolarHBondContact O-N 3.01Å; M543-E545 PolarHBondContact O-N 3.41Å; M543-K546 PolarHBondContact O-N 3.12Å; M543-K546 HydrophobicContact SD-CB 4.48Å; M543-K546 HydrophobicContact SD-CD 3.82Å
544	D	68.9	Low	65.4	Low	2 Å²	2	78.7 Å²	78.7	1%	0.011	42%	0.416	C	S	.	.	H	α-helix	trans	-53.2	-32.1	164	51.2	-33.1	0	0	0	112.9	L527 C533 D538 C539 Y542 C548	L527-D544 HydrophobicContact CD1-CB 4.26Å; C533-D544 PolarHBondContact N-O 3.12Å; C533-D544 PolarHBondContact SG-O 2.96Å; D538-D544 VanDerWaalsContact CA-OD2 3.31Å; D538-D544 WeakPolarHBondContact CA-OD2 3.24Å; D538-D544 WeakPolarHBondContact CB-OD2 3.23Å; D538-D544 PolarHBondContact N-OD2 3.05Å; C539-D544 HydrophobicContact CB-CB 4.37Å; C539-D544 WeakPolarHBondContact CB-OD1 3.14Å; C539-D544 PolarHBondContact N-OD1 3.16Å; C539-D544 PolarHBondContact N-OD2 2.79Å; Y542-D544 WeakPolarHBondContact CA-OD1 3.04Å; D544-C548 PolarHBondContact O-SG 3.13Å
545	E	74.4	Confident	66.3	Low	26 Å²	26	80.3 Å²	80.3	12%	0.121	42%	0.423	C	S	.	.	H	α-helix	trans	-103.6	-9.5	-177	-67.1	-59.9	130.1	0	0	114.1	C533 D534 G535 F536 Y542 M543 C548	C533-E545 WeakPolarHBondContact CA-OE1 3.24Å; C533-E545 PolarHBondContact N-OE1 3.34Å; C533-E545 VanDerWaalsContact N-OE1 3.13Å; D534-E545 PolarHBondContact N-OE1 2.77Å; G535-E545 WeakPolarHBondContact CA-OE2 3.48Å; G535-E545 PolarHBondContact N-OE1 3.19Å; G535-E545 PolarHBondContact N-OE2 3.41Å; G535-E545 VanDerWaalsContact N-OE2 3.14Å; F536-E545 WeakPolarHBondContact O-CG 3.43Å; Y542-E545 HydrophobicContact CD1-CB 3.44Å; Y542-E545 VanDerWaalsContact CD1-CB 3.44Å; Y542-E545 HydrophobicContact CD1-CG 4.2Å; Y542-E545 HydrophobicContact CE1-CB 3.44Å; Y542-E545 VanDerWaalsContact CE1-CB 3.44Å; Y542-E545 HydrophobicContact CE1-CG 3.95Å; Y542-E545 HydrophobicContact CG-CB 4.44Å; Y542-E545 PolarHBondContact O-N 3.35Å; M543-E545 PolarHBondContact O-N 3.41Å; E545-C548 VanDerWaalsContact CA-SG 3.58Å; E545-C548 PolarHBondContact O-SG 3.04Å
546	K	64.6	Low	67.1	Low	125 Å²	125	80.8 Å²	80.8	54%	0.543	42%	0.418	S	S	.	.	H	α-helix	trans	-84.4	-18.4	-174.6	-90.2	166.8	-177.9	164.2	0	114.6	D541 Y542 M543	D541-K546 PolarHBondContact O-NZ 3.08Å; Y542-K546 WeakPolarHBondContact O-CB 3.43Å; Y542-K546 WeakPolarHBondContact O-CD 3.48Å; Y542-K546 WeakPolarHBondContact O-CG 3.46Å; Y542-K546 PolarHBondContact O-N 3.33Å; Y542-K546 VanDerWaalsContact O-N 3.13Å; M543-K546 PolarHBondContact O-N 3.12Å; M543-K546 HydrophobicContact SD-CB 4.48Å; M543-K546 HydrophobicContact SD-CD 3.82Å
547	N	60.8	Low	67.9	Low	148 Å²	148	82 Å²	82	79%	0.791	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	36.2	-177	-164.1	53	0	0	0	111.8
548	C	62.8	Low	68.4	Low	27 Å²	27	78.9 Å²	78.9	18%	0.182	40%	0.404	C	S	.	.			trans	-82.2	136.7	170.9	-52.5	0	0	0	0	108.8	C533 D544 E545 F550	C533-C548 WeakPolarHBondContact CA-SG 3.39Å; C533-C548 HydrophobicContact CB-CB 3.66Å; C533-C548 WeakPolarHBondContact CB-SG 3.25Å; C533-C548 WeakPolarHBondContact SG-CA 3.33Å; C533-C548 WeakPolarHBondContact SG-CB 3.36Å; C533-C548 CovalentContact SG-SG 2.01Å; C533-C548 PolarHBondContact SG-SG 2.79Å; D544-C548 PolarHBondContact O-SG 3.13Å; E545-C548 VanDerWaalsContact CA-SG 3.58Å; E545-C548 PolarHBondContact O-SG 3.04Å; C548-F550 PolarHBondContact O-N 3.4Å
549	S	56.4	Low	68.3	Low	94 Å²	94	79.3 Å²	79.3	66%	0.657	42%	0.415	S	S	*	.			trans	-60.5	110.8	173.3	36.4	0	0	0	0	108.9	C551	S549-C551 PolarHBondContact O-N 3.12Å
550	F	59.3	Low	67.9	Low	186 Å²	186	81.7 Å²	81.7	82%	0.816	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-66.4	124.6	165.1	-67.2	-84.7	0	0	0	107.9	C548	C548-F550 PolarHBondContact O-N 3.4Å
551	C	65.8	Low	68	Low	33 Å²	33	79.9 Å²	79.9	22%	0.223	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-58.8	143.7	175.5	-53.7	0	0	0	0	110.3	S549 E555 C563	S549-C551 PolarHBondContact O-N 3.12Å; C551-E555 HydrophobicContact CB-CB 3.82Å; C551-C563 WeakPolarHBondContact CA-SG 3.2Å; C551-C563 HydrophobicContact CB-CB 3.77Å; C551-C563 WeakPolarHBondContact CB-SG 3.28Å; C551-C563 VanDerWaalsContact SG-CA 3.5Å; C551-C563 WeakPolarHBondContact SG-CB 3.25Å; C551-C563 CovalentContact SG-SG 2.04Å; C551-C563 PolarHBondContact SG-SG 3.44Å
552	Q	69.1	Low	68.3	Low	123 Å²	123	77.8 Å²	77.8	58%	0.575	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-67.7	164.4	176	-66.5	178.9	77.7	0	0	111	D554 E555	Q552-D554 WeakPolarHBondContact CB-OD1 3.41Å; Q552-D554 PolarHBondContact O-N 3.03Å; Q552-E555 HydrophobicContact CB-CG 4.3Å; Q552-E555 PolarHBondContact N-OE2 3.27Å; Q552-E555 PolarHBondContact NE2-OE1 3.29Å; Q552-E555 PolarHBondContact O-N 3.18Å
553	D	65.3	Low	68.9	Low	172 Å²	172	74.3 Å²	74.3	92%	0.92	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.5	-178.9	-74.3	-32.9	0	0	0	113.4
554	D	74.8	Confident	69.6	Low	92 Å²	92	71.5 Å²	71.5	49%	0.492	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	4.1	176.2	61.4	-36.9	0	0	0	114.5	Q552 R566	Q552-D554 WeakPolarHBondContact CB-OD1 3.41Å; Q552-D554 PolarHBondContact O-N 3.03Å; D554-R566 VanDerWaalsContact O-CG 3.25Å; D554-R566 WeakPolarHBondContact O-CG 3.44Å; D554-R566 PolarHBondContact O-N 3.35Å
555	E	79.3	Confident	70.3	Confident	58 Å²	58	73.4 Å²	73.4	27%	0.271	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.1	178.3	-66.4	168.3	173.3	0	0	110.4	C551 Q552 C563 V564	C551-E555 HydrophobicContact CB-CB 3.82Å; Q552-E555 HydrophobicContact CB-CG 4.3Å; Q552-E555 PolarHBondContact N-OE2 3.27Å; Q552-E555 PolarHBondContact NE2-OE1 3.29Å; Q552-E555 PolarHBondContact O-N 3.18Å; E555-C563 HydrophobicContact CB-CB 4.24Å; E555-V564 CarbonylContact C-O 3.59Å; E555-V564 VanDerWaalsContact CA-O 3.32Å; E555-V564 WeakPolarHBondContact CA-O 3.35Å
556	L	75.8	Confident	70.6	Confident	40 Å²	40	76.4 Å²	76.4	21%	0.209	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.8	175.9	-73.5	165.3	0	0	0	110.1	C563 V564 R566 W569 A604	L556-C563 WeakPolarHBondContact O-CA 3.34Å; L556-V564 PolarHBondContact N-O 3.08Å; L556-V564 PolarHBondContact O-N 3.32Å; L556-R566 HydrophobicContact CD1-CB 4.45Å; L556-R566 HydrophobicContact CD1-CG 3.93Å; L556-R566 HydrophobicContact CG-CG 3.84Å; L556-W569 HydrophobicContact CB-CD2 4.38Å; L556-W569 HydrophobicContact CB-CE3 3.52Å; L556-W569 HydrophobicContact CB-CH2 4.44Å; L556-W569 HydrophobicContact CB-CZ3 3.55Å; L556-W569 HydrophobicContact CD1-CB 4Å; L556-W569 HydrophobicContact CD1-CD2 3.69Å; L556-W569 HydrophobicContact CD1-CE3 3.64Å; L556-W569 HydrophobicContact CD1-CG 3.86Å; L556-W569 HydrophobicContact CD1-CZ3 4.37Å; L556-W569 HydrophobicContact CG-CE3 4.22Å; L556-A604 HydrophobicContact CD1-CB 3.32Å
557	E	75.9	Confident	71.4	Confident	113 Å²	113	76.2 Å²	76.2	53%	0.528	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	116.3	179.8	-170.5	171.3	-149.7	0	0	109.8	H561	E557-H561 HydrophobicContact CG-CB 4.5Å; E557-H561 IonicContact OE1-CE1 3.71Å; E557-H561 IonicContact OE1-CG 3.94Å; E557-H561 IonicContact OE1-ND1 2.78Å; E557-H561 PolarHBondContact OE1-ND1 2.83Å
558	C	76.2	Confident	72.4	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.014	39%	0.391	C	S	.	.			trans	-63.5	161.9	165.8	-56.8	0	0	0	0	109.7	N560 H561 A562 V564 C576	C558-N560 WeakPolarHBondContact CB-OD1 3.13Å; C558-N560 PolarHBondContact O-N 2.91Å; C558-N560 VanDerWaalsContact O-N 3.14Å; C558-H561 WeakPolarHBondContact O-CA 3.36Å; C558-H561 PolarHBondContact O-N 3.21Å; C558-A562 HydrophobicContact CB-CB 4.22Å; C558-A562 WeakPolarHBondContact CB-O 3.36Å; C558-A562 PolarHBondContact N-O 3.34Å; C558-A562 PolarHBondContact SG-O 3.32Å; C558-A562 VanDerWaalsContact SG-O 3.33Å; C558-V564 WeakPolarHBondContact SG-CG2 3.43Å; C558-C576 HydrophobicContact CB-CB 3.87Å; C558-C576 WeakPolarHBondContact CB-SG 3.5Å; C558-C576 WeakPolarHBondContact SG-CB 3.16Å; C558-C576 CovalentContact SG-SG 2.03Å; C558-C576 PolarHBondContact SG-SG 3.42Å
559	A	67.1	Low	73.4	Confident	62 Å²	62	73.2 Å²	73.2	51%	0.512	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.4	179.2	0	0	0	0	0	114.2	H561 S580 R928	A559-H561 VanDerWaalsContact C-N 3.32Å; A559-S580 WeakPolarHBondContact CB-OG 2.86Å; A559-S580 PolarHBondContact N-OG 2.66Å; A559-R928 VanDerWaalsContact CB-NH1 3.25Å
560	N	64.8	Low	74.5	Confident	54 Å²	54	68.9 Å²	68.9	29%	0.289	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	14.2	169	68.5	-5	0	0	0	113	C558 A562 S577 D578	C558-N560 WeakPolarHBondContact CB-OD1 3.13Å; C558-N560 PolarHBondContact O-N 2.91Å; C558-N560 VanDerWaalsContact O-N 3.14Å; N560-A562 PolarHBondContact O-N 2.95Å; N560-A562 VanDerWaalsContact O-N 3.16Å; N560-A562 VanDerWaalsContact OD1-CB 3.23Å; N560-A562 WeakPolarHBondContact OD1-CB 3.29Å; N560-A562 PolarHBondContact OD1-N 3.23Å; N560-S577 PolarHBondContact ND2-OG 3.14Å; N560-D578 HydrophobicContact CB-CB 4.33Å; N560-D578 PolarHBondContact N-OD2 3.02Å; N560-D578 VanDerWaalsContact N-OD2 3.17Å
561	H	67.5	Low	75.2	Confident	54 Å²	54	62.3 Å²	62.3	25%	0.25	33%	0.334	C	S	.	.	S	Bend	trans	61.3	16	-178.2	-57.2	-85.9	0	0	0	115.4	C533 D534 G535 E557 C558 A559	C533-H561 WeakPolarHBondContact O-CB 2.96Å; C533-H561 PolarHBondContact O-CD2 3.13Å; D534-H561 VanDerWaalsContact C-CD2 3.41Å; D534-H561 VanDerWaalsContact C-NE2 3.33Å; D534-H561 PolarHBondContact O-NE2 3.38Å; G535-H561 PolarHBondContact N-NE2 2.85Å; E557-H561 HydrophobicContact CG-CB 4.5Å; E557-H561 IonicContact OE1-CE1 3.71Å; E557-H561 IonicContact OE1-CG 3.94Å; E557-H561 IonicContact OE1-ND1 2.78Å; E557-H561 PolarHBondContact OE1-ND1 2.83Å; C558-H561 WeakPolarHBondContact O-CA 3.36Å; C558-H561 PolarHBondContact O-N 3.21Å; A559-H561 VanDerWaalsContact C-N 3.32Å
562	A	71.9	Confident	75.5	Confident	37 Å²	37	61.6 Å²	61.6	31%	0.306	33%	0.332	S	S	.	.			trans	-72.7	148.5	164.7	0	0	0	0	0	110.2	C558 N560	C558-A562 HydrophobicContact CB-CB 4.22Å; C558-A562 WeakPolarHBondContact CB-O 3.36Å; C558-A562 PolarHBondContact N-O 3.34Å; C558-A562 PolarHBondContact SG-O 3.32Å; C558-A562 VanDerWaalsContact SG-O 3.33Å; N560-A562 PolarHBondContact O-N 2.95Å; N560-A562 VanDerWaalsContact O-N 3.16Å; N560-A562 VanDerWaalsContact OD1-CB 3.23Å; N560-A562 WeakPolarHBondContact OD1-CB 3.29Å; N560-A562 PolarHBondContact OD1-N 3.23Å
563	C	79.1	Confident	75.8	Confident	41 Å²	41	62.3 Å²	62.3	28%	0.277	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.2	177.9	-58.7	0	0	0	0	110.2	C551 E555 L556	C551-C563 WeakPolarHBondContact CA-SG 3.2Å; C551-C563 HydrophobicContact CB-CB 3.77Å; C551-C563 WeakPolarHBondContact CB-SG 3.28Å; C551-C563 VanDerWaalsContact SG-CA 3.5Å; C551-C563 WeakPolarHBondContact SG-CB 3.25Å; C551-C563 CovalentContact SG-SG 2.04Å; C551-C563 PolarHBondContact SG-SG 3.44Å; E555-C563 HydrophobicContact CB-CB 4.24Å; L556-C563 WeakPolarHBondContact O-CA 3.34Å
564	V	82.1	Confident	76.4	Confident	12 Å²	12	57.1 Å²	57.1	7%	0.073	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.5	176.2	170.1	0	0	0	0	109	E555 L556 C558 L568 D575	E555-V564 CarbonylContact C-O 3.59Å; E555-V564 VanDerWaalsContact CA-O 3.32Å; E555-V564 WeakPolarHBondContact CA-O 3.35Å; L556-V564 PolarHBondContact N-O 3.08Å; L556-V564 PolarHBondContact O-N 3.32Å; C558-V564 WeakPolarHBondContact SG-CG2 3.43Å; V564-L568 HydrophobicContact CG1-CB 3.6Å; V564-L568 HydrophobicContact CG1-CD1 4.14Å; V564-L568 HydrophobicContact CG1-CG 4.5Å; V564-D575 HydrophobicContact CG1-CB 4.03Å; V564-D575 HydrophobicContact CG2-CB 4.33Å
565	S	82.9	Confident	76.7	Confident	42 Å²	42	56 Å²	56	29%	0.294	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	142.9	179.1	175.1	0	0	0	0	111.2	D567 L568	S565-D567 PolarHBondContact O-N 3.45Å; S565-D567 VanDerWaalsContact O-N 3.07Å; S565-D567 PolarHBondContact OG-N 3.39Å; S565-L568 PolarHBondContact O-N 2.88Å
566	R	81.3	Confident	76.6	Confident	89 Å²	89	53.4 Å²	53.4	34%	0.336	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-53.9	-30	175.6	-74.2	176.9	71.8	76	13.9	113.7	D554 L556 L568 W569 A603 A604	D554-R566 VanDerWaalsContact O-CG 3.25Å; D554-R566 WeakPolarHBondContact O-CG 3.44Å; D554-R566 PolarHBondContact O-N 3.35Å; L556-R566 HydrophobicContact CD1-CB 4.45Å; L556-R566 HydrophobicContact CD1-CG 3.93Å; L556-R566 HydrophobicContact CG-CG 3.84Å; R566-L568 VanDerWaalsContact C-N 3.32Å; R566-W569 PolarHBondContact O-N 2.68Å; R566-A603 CarbonylContact O-C 3.47Å; R566-A603 WeakPolarHBondContact O-CA 3.17Å; R566-A604 PolarHBondContact NH2-O 3Å
567	D	81.2	Confident	76.5	Confident	121 Å²	121	56.8 Å²	56.8	65%	0.647	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-74.5	-22.9	-178.8	-69.7	-31.7	0	0	0	113.5	S565 W569	S565-D567 PolarHBondContact O-N 3.45Å; S565-D567 VanDerWaalsContact O-N 3.07Å; S565-D567 PolarHBondContact OG-N 3.39Å; D567-W569 VanDerWaalsContact C-N 3.33Å
568	L	82.4	Confident	76.1	Confident	64 Å²	64	53.1 Å²	53.1	34%	0.335	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-89.2	0.4	178.7	-62.9	177	0	0	0	112.3	V564 S565 R566 D575	V564-L568 HydrophobicContact CG1-CB 3.6Å; V564-L568 HydrophobicContact CG1-CD1 4.14Å; V564-L568 HydrophobicContact CG1-CG 4.5Å; S565-L568 PolarHBondContact O-N 2.88Å; R566-L568 VanDerWaalsContact C-N 3.32Å; L568-D575 WeakPolarHBondContact CB-OD2 3.38Å
569	W	82.6	Confident	76.1	Confident	49 Å²	49	53.9 Å²	53.9	19%	0.186	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	122.8	179.3	-159.2	-76.9	0	0	0	111.2	L556 R566 D567 D581 A603 A604	L556-W569 HydrophobicContact CB-CD2 4.38Å; L556-W569 HydrophobicContact CB-CE3 3.52Å; L556-W569 HydrophobicContact CB-CH2 4.44Å; L556-W569 HydrophobicContact CB-CZ3 3.55Å; L556-W569 HydrophobicContact CD1-CB 4Å; L556-W569 HydrophobicContact CD1-CD2 3.69Å; L556-W569 HydrophobicContact CD1-CE3 3.64Å; L556-W569 HydrophobicContact CD1-CG 3.86Å; L556-W569 HydrophobicContact CD1-CZ3 4.37Å; L556-W569 HydrophobicContact CG-CE3 4.22Å; R566-W569 PolarHBondContact O-N 2.68Å; D567-W569 VanDerWaalsContact C-N 3.33Å; W569-D581 HydrophobicContact CD2-CB 4.41Å; W569-D581 HydrophobicContact CE3-CB 4.18Å; W569-D581 HydrophobicContact CZ3-CB 4.47Å; W569-A603 PolarHBondContact O-N 3.06Å; W569-A604 HydrophobicContact CB-CB 4.28Å; W569-A604 HydrophobicContact CG-CB 4.4Å
570	C	80.1	Confident	76.6	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.014	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	45.3	-175.8	-65.1	0	0	0	0	112.8	D581 E582 C585 H601 H662	C570-D581 PolarHBondContact N-O 3.04Å; C570-D581 PolarHBondContact SG-O 3.36Å; C570-E582 VanDerWaalsContact C-OE1 3.26Å; C570-E582 WeakPolarHBondContact CA-OE1 3.31Å; C570-E582 PolarHBondContact N-OE1 3.32Å; C570-C585 WeakPolarHBondContact CA-SG 3.1Å; C570-C585 HydrophobicContact CB-CB 3.63Å; C570-C585 WeakPolarHBondContact CB-SG 3.08Å; C570-C585 WeakPolarHBondContact SG-CA 3.49Å; C570-C585 WeakPolarHBondContact SG-CB 3.24Å; C570-C585 CovalentContact SG-SG 2.02Å; C570-C585 PolarHBondContact SG-SG 3.25Å; C570-H601 WeakPolarHBondContact CB-O 3.45Å; C570-H662 PolarHBondContact O-CD2 2.67Å
571	D	74.9	Confident	77.3	Confident	48 Å²	48	48.8 Å²	48.8	26%	0.257	28%	0.28	S	S	.	.	S	Bend	trans	-96.7	-13	178.1	82.2	-10.1	0	0	0	113.5	E573 E582	D571-E573 PolarHBondContact OD1-N 3.29Å; D571-E582 PolarHBondContact N-OE1 3.09Å
572	G	71.6	Confident	77.9	Confident	19 Å²	19	46.2 Å²	46.2	20%	0.196	27%	0.268	C	S	.	.	S	Bend	trans	102.9	-5.9	178.4	0	0	0	0	0	114.5	E582	G572-E582 VanDerWaalsContact CA-OE2 3.26Å; G572-E582 WeakPolarHBondContact CA-OE2 3.49Å; G572-E582 PolarHBondContact N-OE1 3.14Å; G572-E582 PolarHBondContact N-OE2 3.01Å; G572-E582 VanDerWaalsContact N-OE2 3.09Å
573	E	76.1	Confident	78.1	Confident	138 Å²	138	47.2 Å²	47.2	65%	0.645	26%	0.264	S	S	*	.	S	Bend	trans	-108.9	150.6	176.5	-63.9	-172	-173.4	0	0	110.6	D571 D575 E582	D571-E573 PolarHBondContact OD1-N 3.29Å; E573-D575 PolarHBondContact O-N 2.82Å; E573-E582 WeakPolarHBondContact O-CG 3.34Å
574	A	76.7	Confident	77.9	Confident	62 Å²	62	49.9 Å²	49.9	51%	0.512	28%	0.275	S	S	.	.			trans	-88.5	93.7	177.4	0	0	0	0	0	109.9
575	D	80.6	Confident	77.8	Confident	68 Å²	68	49.3 Å²	49.3	36%	0.364	27%	0.272	S	S	.	.			trans	-89.8	-33	175.6	-70.8	-61.2	0	0	0	112.2	V564 L568 E573 D581	V564-D575 HydrophobicContact CG1-CB 4.03Å; V564-D575 HydrophobicContact CG2-CB 4.33Å; L568-D575 WeakPolarHBondContact CB-OD2 3.38Å; E573-D575 PolarHBondContact O-N 2.82Å; D575-D581 VanDerWaalsContact CA-OD2 3.29Å; D575-D581 WeakPolarHBondContact CA-OD2 3.22Å; D575-D581 VanDerWaalsContact CB-OD2 3.27Å; D575-D581 WeakPolarHBondContact CB-OD2 3.34Å; D575-D581 PolarHBondContact N-OD2 3.42Å
576	C	77	Confident	77.6	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.027	26%	0.26	C	S	.	.	S	Bend	trans	-73.9	136.4	166.4	-60.8	0	0	0	0	109.8	C558 D578 S579 D581	C558-C576 HydrophobicContact CB-CB 3.87Å; C558-C576 WeakPolarHBondContact CB-SG 3.5Å; C558-C576 WeakPolarHBondContact SG-CB 3.16Å; C558-C576 CovalentContact SG-SG 2.03Å; C558-C576 PolarHBondContact SG-SG 3.42Å; C576-D578 VanDerWaalsContact CB-OD1 3.25Å; C576-D578 WeakPolarHBondContact CB-OD1 3.15Å; C576-D578 PolarHBondContact O-N 3.23Å; C576-D578 VanDerWaalsContact O-N 3.08Å; C576-S579 WeakPolarHBondContact O-CA 3.02Å; C576-S579 PolarHBondContact O-N 2.71Å; C576-D581 HydrophobicContact CB-CB 4.41Å; C576-D581 WeakPolarHBondContact CB-OD1 3.35Å; C576-D581 PolarHBondContact N-OD2 3.03Å; C576-D581 VanDerWaalsContact SG-CB 3.55Å; C576-D581 VanDerWaalsContact SG-CG 3.58Å
577	S	73.9	Confident	77.6	Confident	111 Å²	111	44.7 Å²	44.7	78%	0.776	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.3	175.9	61.2	0	0	0	0	114.1	N560	N560-S577 PolarHBondContact ND2-OG 3.14Å
578	D	68.8	Low	77.3	Confident	37 Å²	37	41 Å²	41	20%	0.198	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	2.9	172.7	72.2	-13.4	0	0	0	113.2	N560 C576 S580 R928	N560-D578 HydrophobicContact CB-CB 4.33Å; N560-D578 PolarHBondContact N-OD2 3.02Å; N560-D578 VanDerWaalsContact N-OD2 3.17Å; C576-D578 VanDerWaalsContact CB-OD1 3.25Å; C576-D578 WeakPolarHBondContact CB-OD1 3.15Å; C576-D578 PolarHBondContact O-N 3.23Å; C576-D578 VanDerWaalsContact O-N 3.08Å; D578-S580 VanDerWaalsContact C-N 3.25Å; D578-S580 PolarHBondContact O-N 3.42Å; D578-S580 WeakPolarHBondContact OD1-CB 3.25Å; D578-S580 PolarHBondContact OD1-N 3.36Å; D578-S580 PolarHBondContact OD1-OG 3.39Å; D578-S580 PolarHBondContact OD2-OG 2.98Å; D578-R928 VanDerWaalsContact CB-NH2 3.34Å; D578-R928 PolarHBondContact O-NH2 2.79Å; D578-R928 IonicContact OD1-NH2 2.85Å; D578-R928 PolarHBondContact OD1-NH2 3.48Å; D578-R928 IonicContact OD2-CZ 3.63Å; D578-R928 IonicContact OD2-NH1 3.82Å; D578-R928 IonicContact OD2-NH2 3.52Å; D578-R928 PolarHBondContact OD2-NH2 2.8Å
579	S	76.2	Confident	77	Confident	18 Å²	18	40.3 Å²	40.3	13%	0.126	23%	0.232	C	C	.	.			trans	56.5	33.1	-178.1	-44.5	0	0	0	0	113.9	C576 D581	C576-S579 WeakPolarHBondContact O-CA 3.02Å; C576-S579 PolarHBondContact O-N 2.71Å; S579-D581 VanDerWaalsContact CA-OD1 3.25Å; S579-D581 WeakPolarHBondContact CA-OD1 3.47Å
580	S	76.3	Confident	76.3	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.063	26%	0.257	C	S	.	.			trans	-67.2	-35.3	176.9	-66.2	0	0	0	0	114.2	A559 D578 E582 W583 R928	A559-S580 WeakPolarHBondContact CB-OG 2.86Å; A559-S580 PolarHBondContact N-OG 2.66Å; D578-S580 VanDerWaalsContact C-N 3.25Å; D578-S580 PolarHBondContact O-N 3.42Å; D578-S580 WeakPolarHBondContact OD1-CB 3.25Å; D578-S580 PolarHBondContact OD1-N 3.36Å; D578-S580 PolarHBondContact OD1-OG 3.39Å; D578-S580 PolarHBondContact OD2-OG 2.98Å; S580-E582 PolarHBondContact O-N 3.38Å; S580-W583 WeakPolarHBondContact O-CB 3.46Å; S580-W583 PolarHBondContact O-N 3.5Å; S580-W583 VanDerWaalsContact O-N 3.17Å; S580-R928 VanDerWaalsContact OG-CZ 3.27Å; S580-R928 PolarHBondContact OG-NH1 3.48Å; S580-R928 PolarHBondContact OG-NH2 2.77Å
581	D	79.9	Confident	75.7	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.2	178.4	46.9	-21.3	0	0	0	113.6	W569 C570 D575 C576 S579	W569-D581 HydrophobicContact CD2-CB 4.41Å; W569-D581 HydrophobicContact CE3-CB 4.18Å; W569-D581 HydrophobicContact CZ3-CB 4.47Å; C570-D581 PolarHBondContact N-O 3.04Å; C570-D581 PolarHBondContact SG-O 3.36Å; D575-D581 VanDerWaalsContact CA-OD2 3.29Å; D575-D581 WeakPolarHBondContact CA-OD2 3.22Å; D575-D581 VanDerWaalsContact CB-OD2 3.27Å; D575-D581 WeakPolarHBondContact CB-OD2 3.34Å; D575-D581 PolarHBondContact N-OD2 3.42Å; C576-D581 HydrophobicContact CB-CB 4.41Å; C576-D581 WeakPolarHBondContact CB-OD1 3.35Å; C576-D581 PolarHBondContact N-OD2 3.03Å; C576-D581 VanDerWaalsContact SG-CB 3.55Å; C576-D581 VanDerWaalsContact SG-CG 3.58Å; S579-D581 VanDerWaalsContact CA-OD1 3.25Å; S579-D581 WeakPolarHBondContact CA-OD1 3.47Å
582	E	81.5	Confident	74.8	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	6.2	-178.2	-67.8	-58.3	128	0	0	114.1	C570 D571 G572 E573 S580 C585 H662 Y931 L936	C570-E582 VanDerWaalsContact C-OE1 3.26Å; C570-E582 WeakPolarHBondContact CA-OE1 3.31Å; C570-E582 PolarHBondContact N-OE1 3.32Å; D571-E582 PolarHBondContact N-OE1 3.09Å; G572-E582 VanDerWaalsContact CA-OE2 3.26Å; G572-E582 WeakPolarHBondContact CA-OE2 3.49Å; G572-E582 PolarHBondContact N-OE1 3.14Å; G572-E582 PolarHBondContact N-OE2 3.01Å; G572-E582 VanDerWaalsContact N-OE2 3.09Å; E573-E582 WeakPolarHBondContact O-CG 3.34Å; S580-E582 PolarHBondContact O-N 3.38Å; E582-C585 PolarHBondContact O-SG 3.47Å; E582-H662 IonicContact OE2-CD2 2.96Å; E582-H662 IonicContact OE2-CE1 2.67Å; E582-H662 PolarHBondContact OE2-CE1 3.35Å; E582-H662 VanDerWaalsContact OE2-CE1 3.31Å; E582-H662 IonicContact OE2-NE2 2.68Å; E582-H662 PolarHBondContact OE2-NE2 3.31Å; E582-Y931 WeakPolarHBondContact O-CE1 3.36Å; E582-Y931 PolarHBondContact O-OH 3.5Å; E582-L936 HydrophobicContact CB-CD1 3.77Å; E582-L936 HydrophobicContact CB-CD2 4.07Å; E582-L936 HydrophobicContact CG-CD1 4.46Å; E582-L936 HydrophobicContact CG-CD2 4.28Å
583	W	74.9	Confident	74.1	Confident	58 Å²	58	59.1 Å²	59.1	22%	0.22	34%	0.335	C	S	.	.	S	Bend	trans	-92.9	141.2	-179.5	-178.2	-112.3	0	0	0	111.8	S580 C585 K927 R928 Y931	S580-W583 WeakPolarHBondContact O-CB 3.46Å; S580-W583 PolarHBondContact O-N 3.5Å; S580-W583 VanDerWaalsContact O-N 3.17Å; W583-C585 PolarHBondContact O-N 3.09Å; W583-K927 HydrophobicContact CH2-CB 3.78Å; W583-K927 WeakPolarHBondContact CH2-O 3.15Å; W583-K927 HydrophobicContact CZ2-CB 3.97Å; W583-R928 HydrophobicContact CD2-CB 4.02Å; W583-R928 HydrophobicContact CD2-CG 3.92Å; W583-R928 HydrophobicContact CE3-CB 4.29Å; W583-R928 HydrophobicContact CE3-CG 4.23Å; W583-R928 HydrophobicContact CG-CG 4.2Å; W583-R928 HydrophobicContact CH2-CB 4.24Å; W583-R928 HydrophobicContact CZ2-CB 3.9Å; W583-R928 HydrophobicContact CZ3-CB 4.46Å; W583-Y931 AromaticContact CE3-CD1 3.53Å; W583-Y931 HydrophobicContact CE3-CD1 3.53Å; W583-Y931 HydrophobicContact CE3-CD2 4.19Å; W583-Y931 HydrophobicContact CE3-CE1 4.15Å; W583-Y931 AromaticContact CE3-CG 3.56Å; W583-Y931 HydrophobicContact CE3-CG 3.56Å; W583-Y931 AromaticContact CZ3-CD1 3.85Å; W583-Y931 HydrophobicContact CZ3-CD1 3.85Å; W583-Y931 AromaticContact CZ3-CD2 3.8Å; W583-Y931 HydrophobicContact CZ3-CD2 3.8Å; W583-Y931 AromaticContact CZ3-CG 3.34Å; W583-Y931 HydrophobicContact CZ3-CG 3.34Å
584	D	75.1	Confident	73.3	Confident	96 Å²	96	57.6 Å²	57.6	51%	0.513	34%	0.34	S	S	.	.	S	Bend	trans	59	26.9	178.8	-154.3	35.6	0	0	0	115.6	V586 T587	D584-V586 PolarHBondContact O-N 2.89Å; D584-T587 WeakPolarHBondContact OD1-CG2 3.39Å
585	C	79.7	Confident	72.6	Confident	1 Å²	1	56 Å²	56	1%	0.007	32%	0.324	C	S	.	.			trans	-65.6	-17.7	177.6	-59.5	0	0	0	0	114.1	C570 E582 W583 V600 H601	C570-C585 WeakPolarHBondContact CA-SG 3.1Å; C570-C585 HydrophobicContact CB-CB 3.63Å; C570-C585 WeakPolarHBondContact CB-SG 3.08Å; C570-C585 WeakPolarHBondContact SG-CA 3.49Å; C570-C585 WeakPolarHBondContact SG-CB 3.24Å; C570-C585 CovalentContact SG-SG 2.02Å; C570-C585 PolarHBondContact SG-SG 3.25Å; E582-C585 PolarHBondContact O-SG 3.47Å; W583-C585 PolarHBondContact O-N 3.09Å; C585-V600 CarbonylContact O-C 3.6Å; C585-V600 WeakPolarHBondContact O-CA 3.06Å; C585-H601 PolarHBondContact O-N 3.1Å
586	V	79.4	Confident	72.3	Confident	6 Å²	6	53.5 Å²	53.5	4%	0.036	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.7	-178.7	-176.1	0	0	0	0	108.5	D584 L598 M599 V600 M626 L661	D584-V586 PolarHBondContact O-N 2.89Å; V586-L598 HydrophobicContact CG1-CD1 3.41Å; V586-L598 VanDerWaalsContact CG1-CD1 3.41Å; V586-M599 WeakPolarHBondContact CA-O 3.27Å; V586-V600 HydrophobicContact CG1-CG2 4.42Å; V586-V600 HydrophobicContact CG2-CG2 4.3Å; V586-M626 HydrophobicContact CB-CG 4.43Å; V586-M626 HydrophobicContact CG1-CG 4.26Å; V586-M626 HydrophobicContact CG1-SD 4.21Å; V586-M626 VanDerWaalsContact O-CG 3.24Å; V586-M626 WeakPolarHBondContact O-CG 3.38Å; V586-L661 HydrophobicContact CG1-CD2 3.97Å; V586-L661 HydrophobicContact CG2-CB 4.22Å; V586-L661 HydrophobicContact CG2-CD2 4.28Å
587	T	80.2	Confident	72.4	Confident	28 Å²	28	54.6 Å²	54.6	17%	0.172	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	161.7	-175	55.9	0	0	0	0	112.3	D584 M599 H601	D584-T587 WeakPolarHBondContact OD1-CG2 3.39Å; T587-M599 PolarHBondContact N-O 3.4Å; T587-M599 PolarHBondContact O-N 2.97Å; T587-H601 PolarHBondContact OG1-NE2 2.9Å
588	L	75.4	Confident	72.7	Confident	43 Å²	43	49.5 Å²	49.5	23%	0.225	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.4	171.7	-69.1	171.7	0	0	0	110.4	F597 L598 M626 L628 L679	L588-F597 CarbonylContact C-O 3.59Å; L588-F597 WeakPolarHBondContact CA-O 3.46Å; L588-L598 HydrophobicContact CD2-CD1 4.36Å; L588-M626 HydrophobicContact CD1-CE 3.9Å; L588-M626 HydrophobicContact CD1-SD 4.11Å; L588-M626 HydrophobicContact CD2-CE 4.08Å; L588-M626 HydrophobicContact CD2-SD 4.36Å; L588-M626 HydrophobicContact CG-CE 3.78Å; L588-M626 HydrophobicContact CG-SD 3.63Å; L588-L628 HydrophobicContact CD1-CD1 3.67Å; L588-L679 HydrophobicContact CD2-CB 3.95Å
589	S	75.5	Confident	73.3	Confident	49 Å²	49	48.1 Å²	48.1	34%	0.343	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.7	169.7	61.7	0	0	0	0	110.1	S596 F597	S589-S596 CarbonylContact O-C 3.45Å; S589-S596 WeakPolarHBondContact O-CA 3.31Å; S589-F597 PolarHBondContact N-O 3.14Å; S589-F597 PolarHBondContact O-N 2.81Å; S589-F597 PolarHBondContact OG-O 3.08Å
590	I	69.3	Low	73.6	Confident	138 Å²	138	47.3 Å²	47.3	71%	0.708	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	120.7	179.5	-57.2	173.4	0	0	0	108.5
591	N	67.3	Low	73.8	Confident	96 Å²	96	48.8 Å²	48.8	51%	0.513	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-96	167	175.3	-152	-13.5	0	0	0	111.5	N593 S594 S595 F597	N591-N593 PolarHBondContact O-N 3.41Å; N591-S594 PolarHBondContact O-N 2.86Å; N591-S595 PolarHBondContact N-O 3.45Å; N591-F597 HydrophobicContact CB-CD2 4.26Å; N591-F597 HydrophobicContact CB-CE2 3.71Å
592	V	55.2	Low	73.6	Confident	133 Å²	133	52.4 Å²	52.4	81%	0.806	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-22.4	-173	-176.3	0	0	0	0	113.8
593	N	56.8	Low	73.4	Confident	146 Å²	146	53.7 Å²	53.7	78%	0.781	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	14	176.5	-70.1	-8.5	0	0	0	114.6	N591 S595	N591-N593 PolarHBondContact O-N 3.41Å; N593-S595 PolarHBondContact O-N 3.46Å
594	S	60.2	Low	73.1	Confident	107 Å²	107	52.2 Å²	52.2	75%	0.748	30%	0.298	S	S	*	.	S	Bend	trans	62.9	17	-178.8	-43	0	0	0	0	115.2	N591	N591-S594 PolarHBondContact O-N 2.86Å
595	S	61.7	Low	73.2	Confident	27 Å²	27	49.8 Å²	49.8	19%	0.189	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-86.8	119.8	169.8	54.4	0	0	0	0	109.6	N591 N593 F597	N591-S595 PolarHBondContact N-O 3.45Å; N593-S595 PolarHBondContact O-N 3.46Å; S595-F597 WeakPolarHBondContact O-CD2 3.38Å; S595-F597 WeakPolarHBondContact O-CE2 3.43Å; S595-F597 WeakPolarHBondContact OG-CE2 3.41Å; S595-F597 VanDerWaalsContact OG-CZ 3.25Å; S595-F597 WeakPolarHBondContact OG-CZ 3.1Å
596	S	73.6	Confident	73.2	Confident	17 Å²	17	55.9 Å²	55.9	12%	0.119	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.1	173.6	35.8	0	0	0	0	109.8	S589 S678 L679	S589-S596 CarbonylContact O-C 3.45Å; S589-S596 WeakPolarHBondContact O-CA 3.31Å; S596-S678 CarbonylContact O-C 3.33Å; S596-S678 WeakPolarHBondContact O-CA 3.22Å; S596-S678 WeakPolarHBondContact O-CB 3.46Å; S596-S678 PolarHBondContact O-OG 3.46Å; S596-L679 WeakPolarHBondContact CB-O 3Å; S596-L679 PolarHBondContact O-N 2.73Å; S596-L679 PolarHBondContact OG-O 3.2Å
597	F	78.9	Confident	73.3	Confident	27 Å²	27	56.3 Å²	56.3	12%	0.118	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.8	180	-60.5	-82.9	0	0	0	110.9	L588 S589 N591 S595 I637 K676	L588-F597 CarbonylContact C-O 3.59Å; L588-F597 WeakPolarHBondContact CA-O 3.46Å; S589-F597 PolarHBondContact N-O 3.14Å; S589-F597 PolarHBondContact O-N 2.81Å; S589-F597 PolarHBondContact OG-O 3.08Å; N591-F597 HydrophobicContact CB-CD2 4.26Å; N591-F597 HydrophobicContact CB-CE2 3.71Å; S595-F597 WeakPolarHBondContact O-CD2 3.38Å; S595-F597 WeakPolarHBondContact O-CE2 3.43Å; S595-F597 WeakPolarHBondContact OG-CE2 3.41Å; S595-F597 VanDerWaalsContact OG-CZ 3.25Å; S595-F597 WeakPolarHBondContact OG-CZ 3.1Å; F597-I637 HydrophobicContact CE1-CB 4.16Å; F597-I637 HydrophobicContact CE1-CD1 3.58Å; F597-I637 HydrophobicContact CE1-CG1 4.38Å; F597-I637 HydrophobicContact CE1-CG2 4.29Å; F597-I637 HydrophobicContact CZ-CD1 3.96Å; F597-K676 HydrophobicContact CD1-CB 4.26Å
598	L	81.7	Confident	73.3	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	125.9	177.7	-174.4	64.7	0	0	0	111.2	V586 L588 V609 W614 A622 M626 L661 I677 L679	V586-L598 HydrophobicContact CG1-CD1 3.41Å; V586-L598 VanDerWaalsContact CG1-CD1 3.41Å; L588-L598 HydrophobicContact CD2-CD1 4.36Å; L598-V609 HydrophobicContact CD2-CB 4.33Å; L598-V609 HydrophobicContact CD2-CG2 3.96Å; L598-V609 HydrophobicContact CG-CG2 4.14Å; L598-W614 HydrophobicContact CD2-CH2 3.77Å; L598-W614 HydrophobicContact CD2-CZ2 3.88Å; L598-A622 HydrophobicContact CD1-CB 4.28Å; L598-M626 HydrophobicContact CD1-CE 4.29Å; L598-L661 HydrophobicContact CD2-CD2 3.99Å; L598-I677 PolarHBondContact N-O 3.13Å; L598-L679 HydrophobicContact CB-CD1 4.1Å; L598-L679 HydrophobicContact CD1-CD1 3.96Å; L598-L679 HydrophobicContact CD2-CD1 3.89Å; L598-L679 HydrophobicContact CG-CD1 4.2Å
599	M	80.1	Confident	73.6	Confident	8 Å²	8	55 Å²	55	4%	0.039	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.4	174.9	-61.2	-57.9	-65.6	0	0	109.4	V586 T587 E606 H608	V586-M599 WeakPolarHBondContact CA-O 3.27Å; T587-M599 PolarHBondContact N-O 3.4Å; T587-M599 PolarHBondContact O-N 2.97Å; M599-E606 HydrophobicContact CE-CB 3.89Å; M599-H608 VanDerWaalsContact CE-CE1 3.48Å; M599-H608 WeakPolarHBondContact CE-CE1 3.48Å; M599-H608 PolarHBondContact SD-CE1 3.05Å; M599-H608 PolarHBondContact SD-ND1 3.16Å
600	V	83	Confident	73.9	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.7	174.7	177.9	0	0	0	0	108.8	C585 V586 H607 V609 L647 H662 L665	C585-V600 CarbonylContact O-C 3.6Å; C585-V600 WeakPolarHBondContact O-CA 3.06Å; V586-V600 HydrophobicContact CG1-CG2 4.42Å; V586-V600 HydrophobicContact CG2-CG2 4.3Å; V600-H607 PolarHBondContact N-O 2.93Å; V600-H607 WeakPolarHBondContact O-CB 3.4Å; V600-H607 PolarHBondContact O-N 3.41Å; V600-V609 HydrophobicContact CB-CG2 4.39Å; V600-V609 HydrophobicContact CG2-CG2 3.59Å; V600-L647 HydrophobicContact CB-CD1 3.94Å; V600-L647 HydrophobicContact CG1-CD1 3.97Å; V600-H662 HydrophobicContact CG1-CB 3.63Å; V600-L665 HydrophobicContact CB-CD1 4.37Å; V600-L665 HydrophobicContact CG1-CD1 4.37Å; V600-L665 HydrophobicContact CG2-CD1 3.75Å
601	H	79.8	Confident	74.5	Confident	39 Å²	39	46.6 Å²	46.6	18%	0.181	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.6	174.9	-63.2	-77.5	0	0	0	108.8	C570 C585 T587 T605 E606	C570-H601 WeakPolarHBondContact CB-O 3.45Å; C585-H601 PolarHBondContact O-N 3.1Å; T587-H601 PolarHBondContact OG1-NE2 2.9Å; H601-T605 WeakPolarHBondContact CA-O 3.05Å; H601-E606 WeakPolarHBondContact CE1-CG 3.11Å; H601-E606 IonicContact CE1-OE1 3.09Å; H601-E606 WeakPolarHBondContact ND1-CG 3.31Å
602	R	77.3	Confident	75.1	Confident	76 Å²	76	45 Å²	45	29%	0.287	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.1	172.8	-170.2	175.3	-174.2	156.9	8.9	109.1	A604 T605 L665	R602-A604 PolarHBondContact O-N 3.46Å; R602-T605 PolarHBondContact N-O 2.04Å; R602-T605 PolarHBondContact O-N 3.35Å; R602-T605 PolarHBondContact O-OG1 3.08Å; R602-L665 PolarHBondContact NH1-O 2.73Å
603	A	75.5	Confident	76	Confident	28 Å²	28	41.6 Å²	41.6	23%	0.231	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	39.7	-172	0	0	0	0	0	112.1	R566 W569 T605	R566-A603 CarbonylContact O-C 3.47Å; R566-A603 WeakPolarHBondContact O-CA 3.17Å; W569-A603 PolarHBondContact O-N 3.06Å; A603-T605 PolarHBondContact O-N 3.33Å; A603-T605 VanDerWaalsContact O-N 3.12Å
604	A	70.1	Confident	77.1	Confident	27 Å²	27	36.5 Å²	36.5	22%	0.223	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	34.8	-174.4	0	0	0	0	0	115.4	L556 R566 W569 R602	L556-A604 HydrophobicContact CD1-CB 3.32Å; R566-A604 PolarHBondContact NH2-O 3Å; W569-A604 HydrophobicContact CB-CB 4.28Å; W569-A604 HydrophobicContact CG-CB 4.4Å; R602-A604 PolarHBondContact O-N 3.46Å
605	T	77.3	Confident	78	Confident	45 Å²	45	35.2 Å²	35.2	28%	0.276	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.7	172.3	56.3	0	0	0	0	111.7	H601 R602 A603 H607	H601-T605 WeakPolarHBondContact CA-O 3.05Å; R602-T605 PolarHBondContact N-O 2.04Å; R602-T605 PolarHBondContact O-N 3.35Å; R602-T605 PolarHBondContact O-OG1 3.08Å; A603-T605 PolarHBondContact O-N 3.33Å; A603-T605 VanDerWaalsContact O-N 3.12Å; T605-H607 PolarHBondContact O-ND1 3.38Å; T605-H607 PolarHBondContact OG1-CE1 3.45Å
606	E	79.8	Confident	78.7	Confident	129 Å²	129	39.9 Å²	39.9	60%	0.603	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.9	-179.5	-74.1	-178.8	177.3	0	0	111.9	M599 H601	M599-E606 HydrophobicContact CE-CB 3.89Å; H601-E606 WeakPolarHBondContact CE1-CG 3.11Å; H601-E606 IonicContact CE1-OE1 3.09Å; H601-E606 WeakPolarHBondContact ND1-CG 3.31Å
607	H	80.6	Confident	79	Confident	15 Å²	15	44 Å²	44	7%	0.069	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146	176.5	-66.3	82.7	0	0	0	111.7	V600 T605 L647	V600-H607 PolarHBondContact N-O 2.93Å; V600-H607 WeakPolarHBondContact O-CB 3.4Å; V600-H607 PolarHBondContact O-N 3.41Å; T605-H607 PolarHBondContact O-ND1 3.38Å; T605-H607 PolarHBondContact OG1-CE1 3.45Å; H607-L647 HydrophobicContact CB-CD1 3.46Å; H607-L647 VanDerWaalsContact CB-CD1 3.46Å; H607-L647 HydrophobicContact CB-CG 3.7Å
608	H	79.4	Confident	79	Confident	40 Å²	40	42.9 Å²	42.9	19%	0.185	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.7	173.2	-68.9	-72.9	0	0	0	111	M599 P644 R645 W646 L647 K676	M599-H608 VanDerWaalsContact CE-CE1 3.48Å; M599-H608 WeakPolarHBondContact CE-CE1 3.48Å; M599-H608 PolarHBondContact SD-CE1 3.05Å; M599-H608 PolarHBondContact SD-ND1 3.16Å; H608-P644 HydrophobicContact CB-CB 4.45Å; H608-R645 PolarHBondContact N-O 3.3Å; H608-R645 VanDerWaalsContact N-O 3.08Å; H608-W646 HydrophobicContact CB-CE3 4.27Å; H608-W646 HydrophobicContact CB-CZ3 4.4Å; H608-W646 WeakPolarHBondContact O-CA 3.28Å; H608-L647 PolarHBondContact O-N 3.17Å; H608-K676 PolarHBondContact CE1-NZ 3.23Å; H608-K676 VanDerWaalsContact CG-CE 3.47Å; H608-K676 VanDerWaalsContact ND1-CE 3.32Å; H608-K676 WeakPolarHBondContact ND1-CE 3.42Å; H608-K676 PolarHBondContact ND1-NZ 2.91Å; H608-K676 PolarHBondContact NE2-NZ 2.87Å
609	V	82.4	Confident	78.9	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.2	177.6	-169.7	0	0	0	0	110.3	L598 V600 W614 L665 I677	L598-V609 HydrophobicContact CD2-CB 4.33Å; L598-V609 HydrophobicContact CD2-CG2 3.96Å; L598-V609 HydrophobicContact CG-CG2 4.14Å; V600-V609 HydrophobicContact CB-CG2 4.39Å; V600-V609 HydrophobicContact CG2-CG2 3.59Å; V609-W614 HydrophobicContact CG1-CE3 4.07Å; V609-W614 HydrophobicContact CG1-CH2 3.97Å; V609-W614 HydrophobicContact CG1-CZ3 3.44Å; V609-W614 VanDerWaalsContact CG1-CZ3 3.44Å; V609-L665 HydrophobicContact CG1-CD1 4.15Å; V609-L665 HydrophobicContact CG1-CD2 3.83Å; V609-L665 HydrophobicContact CG2-CD1 3.87Å; V609-I677 HydrophobicContact CB-CD1 3.98Å; V609-I677 HydrophobicContact CG1-CD1 3.62Å
610	C	82.8	Confident	78.8	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.02	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-72.4	136.8	175.9	-177	0	0	0	0	110.9	D612 W646 L647 T648 C671	C610-D612 PolarHBondContact O-N 3.37Å; C610-D612 PolarHBondContact SG-OD2 3.21Å; C610-W646 HydrophobicContact CB-CE3 4.15Å; C610-L647 WeakPolarHBondContact CB-O 3.49Å; C610-L647 PolarHBondContact N-O 3.37Å; C610-T648 HydrophobicContact CB-CG2 4.15Å; C610-C671 HydrophobicContact CB-CB 3.76Å; C610-C671 WeakPolarHBondContact CB-SG 3.44Å; C610-C671 VanDerWaalsContact SG-CA 3.53Å; C610-C671 WeakPolarHBondContact SG-CB 3.43Å; C610-C671 CovalentContact SG-SG 2.04Å; C610-C671 PolarHBondContact SG-SG 3.45Å
611	A	80.7	Confident	78.6	Confident	9 Å²	9	46.9 Å²	46.9	7%	0.074	25%	0.25	C	S	.	.			trans	-73.8	-8.4	179	0	0	0	0	0	115.1	G613 W614 L636 S675 I677	A611-G613 PolarHBondContact O-N 3Å; A611-W614 WeakPolarHBondContact O-CB 3.45Å; A611-W614 PolarHBondContact O-N 2.68Å; A611-L636 HydrophobicContact CB-CD2 3.56Å; A611-S675 VanDerWaalsContact CB-O 3.27Å; A611-S675 WeakPolarHBondContact CB-O 3.34Å; A611-S675 PolarHBondContact N-O 3.48Å; A611-I677 HydrophobicContact CB-CG1 4.08Å
612	D	80.3	Confident	78.5	Confident	62 Å²	62	45 Å²	45	33%	0.332	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	121	-173.8	-65.8	-18.7	0	0	0	110.8	C610 W614 E672 S673	C610-D612 PolarHBondContact O-N 3.37Å; C610-D612 PolarHBondContact SG-OD2 3.21Å; D612-W614 VanDerWaalsContact C-N 3.29Å; D612-W614 PolarHBondContact O-N 3.38Å; D612-E672 PolarHBondContact OD2-N 3.01Å; D612-S673 WeakPolarHBondContact OD1-CB 3.5Å; D612-S673 PolarHBondContact OD1-OG 2.9Å; D612-S673 PolarHBondContact OD2-N 3.19Å
613	G	73.2	Confident	78.5	Confident	62 Å²	62	41.4 Å²	41.4	64%	0.639	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.3	11	-178.6	0	0	0	0	0	115.3	A611	A611-G613 PolarHBondContact O-N 3Å
614	W	80.6	Confident	78.5	Confident	38 Å²	38	45.5 Å²	45.5	14%	0.144	24%	0.241	C	C	.	.			trans	-71.4	134.6	-177.4	-165.7	-97.4	0	0	0	113.4	L598 V609 A611 D612 L618 S619 L649 L661 I677	L598-W614 HydrophobicContact CD2-CH2 3.77Å; L598-W614 HydrophobicContact CD2-CZ2 3.88Å; V609-W614 HydrophobicContact CG1-CE3 4.07Å; V609-W614 HydrophobicContact CG1-CH2 3.97Å; V609-W614 HydrophobicContact CG1-CZ3 3.44Å; V609-W614 VanDerWaalsContact CG1-CZ3 3.44Å; A611-W614 WeakPolarHBondContact O-CB 3.45Å; A611-W614 PolarHBondContact O-N 2.68Å; D612-W614 VanDerWaalsContact C-N 3.29Å; D612-W614 PolarHBondContact O-N 3.38Å; W614-L618 HydrophobicContact CD2-CB 4.23Å; W614-L618 HydrophobicContact CD2-CD1 4.08Å; W614-L618 HydrophobicContact CE3-CB 4.47Å; W614-L618 HydrophobicContact CE3-CD1 3.86Å; W614-L618 HydrophobicContact CH2-CB 4Å; W614-L618 HydrophobicContact CZ2-CB 3.67Å; W614-L618 HydrophobicContact CZ3-CB 4.35Å; W614-L618 HydrophobicContact CZ3-CD1 4.11Å; W614-S619 PolarHBondContact NE1-OG 3.47Å; W614-L649 HydrophobicContact CZ3-CD1 4.39Å; W614-L661 HydrophobicContact CH2-CD1 3.79Å; W614-L661 HydrophobicContact CH2-CD2 4.19Å; W614-L661 HydrophobicContact CH2-CG 4.45Å; W614-L661 HydrophobicContact CZ3-CD1 4.43Å; W614-I677 HydrophobicContact CB-CD1 4.33Å; W614-I677 HydrophobicContact CD2-CD1 3.27Å; W614-I677 HydrophobicContact CD2-CG1 4.22Å; W614-I677 HydrophobicContact CE3-CD1 3.38Å; W614-I677 HydrophobicContact CG-CD1 3.73Å; W614-I677 HydrophobicContact CG-CG1 4.22Å; W614-I677 HydrophobicContact CH2-CD1 4.01Å; W614-I677 HydrophobicContact CZ2-CD1 3.96Å; W614-I677 HydrophobicContact CZ3-CD1 3.76Å
615	Q	79.8	Confident	78.7	Confident	80 Å²	80	44.7 Å²	44.7	37%	0.374	23%	0.232	S	C	.	.			trans	-112.7	161	177.5	-62.6	-167.4	4.8	0	0	112.7	I617 L618 S619 W653	Q615-I617 VanDerWaalsContact C-N 3.28Å; Q615-I617 PolarHBondContact O-N 3.39Å; Q615-L618 PolarHBondContact O-N 3.13Å; Q615-S619 PolarHBondContact O-OG 3.47Å; Q615-W653 HydrophobicContact CG-CH2 4.45Å; Q615-W653 HydrophobicContact CG-CZ2 4.33Å; Q615-W653 VanDerWaalsContact OE1-CH2 3.3Å
616	E	76.7	Confident	78.5	Confident	125 Å²	125	44.3 Å²	44.3	58%	0.584	23%	0.228	S	C	*	.	H	α-helix	trans	-65	-30.6	178.5	-164.6	173.5	176.2	0	0	112.5	L618 S619 Q620	E616-L618 VanDerWaalsContact C-N 3.3Å; E616-L618 PolarHBondContact O-N 3.45Å; E616-S619 WeakPolarHBondContact O-CA 3.49Å; E616-S619 WeakPolarHBondContact O-CB 3.48Å; E616-S619 PolarHBondContact O-N 3.46Å; E616-Q620 PolarHBondContact O-N 3.49Å
617	I	78.7	Confident	77.8	Confident	104 Å²	104	40.5 Å²	40.5	53%	0.533	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-39	176.9	-60.2	169.1	0	0	0	111.5	Q615 S619 Q620 L621	Q615-I617 VanDerWaalsContact C-N 3.28Å; Q615-I617 PolarHBondContact O-N 3.39Å; I617-S619 VanDerWaalsContact C-N 3.29Å; I617-S619 PolarHBondContact O-N 3.43Å; I617-Q620 WeakPolarHBondContact O-CB 3.42Å; I617-Q620 PolarHBondContact O-N 2.01Å; I617-L621 WeakPolarHBondContact O-CB 3.36Å; I617-L621 PolarHBondContact O-N 3.22Å
618	L	79.9	Confident	77	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-69.9	-30.3	176.8	-62.1	170.3	0	0	0	111.9	W614 Q615 E616 L621 A622 L649 W653 L661 L664	W614-L618 HydrophobicContact CD2-CB 4.23Å; W614-L618 HydrophobicContact CD2-CD1 4.08Å; W614-L618 HydrophobicContact CE3-CB 4.47Å; W614-L618 HydrophobicContact CE3-CD1 3.86Å; W614-L618 HydrophobicContact CH2-CB 4Å; W614-L618 HydrophobicContact CZ2-CB 3.67Å; W614-L618 HydrophobicContact CZ3-CB 4.35Å; W614-L618 HydrophobicContact CZ3-CD1 4.11Å; Q615-L618 PolarHBondContact O-N 3.13Å; E616-L618 VanDerWaalsContact C-N 3.3Å; E616-L618 PolarHBondContact O-N 3.45Å; L618-L621 PolarHBondContact O-N 2.9Å; L618-A622 WeakPolarHBondContact O-CB 3.37Å; L618-A622 PolarHBondContact O-N 3.35Å; L618-L649 HydrophobicContact CD1-CD1 3.45Å; L618-L649 VanDerWaalsContact CD1-CD1 3.45Å; L618-L649 HydrophobicContact CD1-CD2 4.01Å; L618-L649 HydrophobicContact CD1-CG 4.41Å; L618-L649 HydrophobicContact CD2-CD1 4.35Å; L618-W653 HydrophobicContact CD2-CE3 4.33Å; L618-L661 HydrophobicContact CB-CD1 4.39Å; L618-L661 HydrophobicContact CD2-CD1 4.25Å; L618-L664 HydrophobicContact CD2-CD1 3.94Å
619	S	79.6	Confident	76.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-69.7	-39.1	175.4	-52.9	0	0	0	0	111.2	W614 Q615 E616 I617 C623 S632 T634 L679	W614-S619 PolarHBondContact NE1-OG 3.47Å; Q615-S619 PolarHBondContact O-OG 3.47Å; E616-S619 WeakPolarHBondContact O-CA 3.49Å; E616-S619 WeakPolarHBondContact O-CB 3.48Å; E616-S619 PolarHBondContact O-N 3.46Å; I617-S619 VanDerWaalsContact C-N 3.29Å; I617-S619 PolarHBondContact O-N 3.43Å; S619-C623 PolarHBondContact O-N 3.34Å; S619-C623 VanDerWaalsContact O-N 3.14Å; S619-C623 PolarHBondContact O-SG 3.05Å; S619-S632 PolarHBondContact O-OG 3.33Å; S619-T634 WeakPolarHBondContact CB-OG1 3.48Å; S619-T634 PolarHBondContact OG-OG1 2.87Å; S619-L679 VanDerWaalsContact CB-CD2 3.43Å
620	Q	77.4	Confident	75.4	Confident	59 Å²	59	45.8 Å²	45.8	28%	0.276	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-46.6	172	-74.7	173.7	-2.2	0	0	111.1	E616 I617 A622 C623 K624 E630 S632	E616-Q620 PolarHBondContact O-N 3.49Å; I617-Q620 WeakPolarHBondContact O-CB 3.42Å; I617-Q620 PolarHBondContact O-N 2.01Å; Q620-A622 PolarHBondContact O-N 3.03Å; Q620-C623 PolarHBondContact O-N 3.01Å; Q620-K624 WeakPolarHBondContact O-CB 3.48Å; Q620-K624 PolarHBondContact O-N 3.06Å; Q620-E630 HydrophobicContact CB-CG 4.32Å; Q620-E630 WeakPolarHBondContact CB-OE1 3.4Å; Q620-E630 HydrophobicContact CG-CG 4.23Å; Q620-S632 PolarHBondContact N-OG 2.74Å
621	L	78.5	Confident	74.2	Confident	38 Å²	38	50 Å²	50	20%	0.199	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-48.4	175.1	-177.9	62.4	0	0	0	111.9	I617 L618 C623 K624 Q625 L661 L664 F935	I617-L621 WeakPolarHBondContact O-CB 3.36Å; I617-L621 PolarHBondContact O-N 3.22Å; L618-L621 PolarHBondContact O-N 2.9Å; L621-C623 PolarHBondContact O-N 3.26Å; L621-K624 WeakPolarHBondContact O-CB 3.34Å; L621-K624 PolarHBondContact O-N 2.76Å; L621-K624 VanDerWaalsContact O-N 3.16Å; L621-Q625 HydrophobicContact CD1-CG 4.44Å; L621-Q625 WeakPolarHBondContact O-CG 3.38Å; L621-Q625 PolarHBondContact O-N 3.22Å; L621-L661 HydrophobicContact CD2-CD1 4.46Å; L621-L664 HydrophobicContact CD2-CD1 4.03Å; L621-F935 HydrophobicContact CD1-CE1 3.89Å
622	A	78.1	Confident	73.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.3	-48	177.3	0	0	0	0	0	111.9	L598 L618 Q620 K624 Q625 M626 L661 L679	L598-A622 HydrophobicContact CD1-CB 4.28Å; L618-A622 WeakPolarHBondContact O-CB 3.37Å; L618-A622 PolarHBondContact O-N 3.35Å; Q620-A622 PolarHBondContact O-N 3.03Å; A622-K624 VanDerWaalsContact C-N 3.3Å; A622-K624 PolarHBondContact O-N 3.36Å; A622-Q625 PolarHBondContact O-N 3.13Å; A622-M626 HydrophobicContact CB-CE 4.24Å; A622-M626 VanDerWaalsContact O-CE 3.22Å; A622-M626 WeakPolarHBondContact O-CE 3.31Å; A622-M626 WeakPolarHBondContact O-CG 3.06Å; A622-M626 PolarHBondContact O-N 3.21Å; A622-M626 VanDerWaalsContact O-N 3.09Å; A622-L661 HydrophobicContact CB-CD2 3.7Å; A622-L679 HydrophobicContact CB-CD1 3.85Å
623	C	76.6	Confident	72.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66	-32.4	178.3	-68.4	0	0	0	0	113.1	S619 Q620 L621 G627 L628 G629 S632 C681	S619-C623 PolarHBondContact O-N 3.34Å; S619-C623 VanDerWaalsContact O-N 3.14Å; S619-C623 PolarHBondContact O-SG 3.05Å; Q620-C623 PolarHBondContact O-N 3.01Å; L621-C623 PolarHBondContact O-N 3.26Å; C623-G627 PolarHBondContact O-N 3.21Å; C623-L628 PolarHBondContact O-N 2.85Å; C623-G629 WeakPolarHBondContact CB-O 3.45Å; C623-G629 PolarHBondContact O-N 3.3Å; C623-S632 WeakPolarHBondContact SG-CB 3.41Å; C623-C681 VanDerWaalsContact CA-SG 3.52Å; C623-C681 HydrophobicContact CB-CB 3.64Å; C623-C681 WeakPolarHBondContact CB-SG 3.49Å; C623-C681 WeakPolarHBondContact SG-CB 3.48Å; C623-C681 CovalentContact SG-SG 2.02Å; C623-C681 PolarHBondContact SG-SG 3.24Å
624	K	75.6	Confident	72.8	Confident	114 Å²	114	50 Å²	50	50%	0.496	27%	0.269	S	S	.	.	H	α-helix	trans	-68.7	-44	174.8	-168.3	-175.6	175.8	-173.3	0	111.6	Q620 L621 A622 G627 F935	Q620-K624 WeakPolarHBondContact O-CB 3.48Å; Q620-K624 PolarHBondContact O-N 3.06Å; L621-K624 WeakPolarHBondContact O-CB 3.34Å; L621-K624 PolarHBondContact O-N 2.76Å; L621-K624 VanDerWaalsContact O-N 3.16Å; A622-K624 VanDerWaalsContact C-N 3.3Å; A622-K624 PolarHBondContact O-N 3.36Å; K624-G627 PolarHBondContact O-N 3.22Å; K624-G627 VanDerWaalsContact O-N 3.08Å; K624-F935 HydrophobicContact CB-CZ 4.46Å; K624-F935 HydrophobicContact CD-CZ 4.07Å; K624-F935 HydrophobicContact CG-CZ 4.01Å
625	Q	75.5	Confident	72.6	Confident	10 Å²	10	54.7 Å²	54.7	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-41.4	177.5	-75.3	-171.5	-57.8	0	0	112.7	L621 A622 G627 Y931 F935	L621-Q625 HydrophobicContact CD1-CG 4.44Å; L621-Q625 WeakPolarHBondContact O-CG 3.38Å; L621-Q625 PolarHBondContact O-N 3.22Å; A622-Q625 PolarHBondContact O-N 3.13Å; Q625-G627 PolarHBondContact O-N 2.9Å; Q625-G627 VanDerWaalsContact O-N 3.16Å; Q625-Y931 HydrophobicContact CB-CE2 4.15Å; Q625-Y931 HydrophobicContact CG-CE2 4.29Å; Q625-F935 HydrophobicContact CB-CZ 4.47Å; Q625-F935 HydrophobicContact CG-CD1 4.35Å; Q625-F935 HydrophobicContact CG-CD2 4.45Å; Q625-F935 HydrophobicContact CG-CE1 3.86Å; Q625-F935 HydrophobicContact CG-CE2 3.99Å; Q625-F935 HydrophobicContact CG-CZ 3.66Å
626	M	72.3	Confident	72.6	Confident	37 Å²	37	56 Å²	56	18%	0.182	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-2.1	175.7	-66.1	-176.9	-74.1	0	0	113.5	V586 L588 L598 A622 L628	V586-M626 HydrophobicContact CB-CG 4.43Å; V586-M626 HydrophobicContact CG1-CG 4.26Å; V586-M626 HydrophobicContact CG1-SD 4.21Å; V586-M626 VanDerWaalsContact O-CG 3.24Å; V586-M626 WeakPolarHBondContact O-CG 3.38Å; L588-M626 HydrophobicContact CD1-CE 3.9Å; L588-M626 HydrophobicContact CD1-SD 4.11Å; L588-M626 HydrophobicContact CD2-CE 4.08Å; L588-M626 HydrophobicContact CD2-SD 4.36Å; L588-M626 HydrophobicContact CG-CE 3.78Å; L588-M626 HydrophobicContact CG-SD 3.63Å; L598-M626 HydrophobicContact CD1-CE 4.29Å; A622-M626 HydrophobicContact CB-CE 4.24Å; A622-M626 VanDerWaalsContact O-CE 3.22Å; A622-M626 WeakPolarHBondContact O-CE 3.31Å; A622-M626 WeakPolarHBondContact O-CG 3.06Å; A622-M626 PolarHBondContact O-N 3.21Å; A622-M626 VanDerWaalsContact O-N 3.09Å; M626-L628 HydrophobicContact CB-CB 4.46Å; M626-L628 HydrophobicContact CB-CD1 3.92Å; M626-L628 HydrophobicContact CB-CG 3.91Å; M626-L628 HydrophobicContact CE-CD1 4.43Å; M626-L628 PolarHBondContact O-N 3.49Å; M626-L628 HydrophobicContact SD-CD1 4.34Å
627	G	65.8	Low	72.5	Confident	49 Å²	49	53.1 Å²	53.1	51%	0.505	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	21.8	-175.3	0	0	0	0	0	113.9	C623 K624 Q625	C623-G627 PolarHBondContact O-N 3.21Å; K624-G627 PolarHBondContact O-N 3.22Å; K624-G627 VanDerWaalsContact O-N 3.08Å; Q625-G627 PolarHBondContact O-N 2.9Å; Q625-G627 VanDerWaalsContact O-N 3.16Å
628	L	64	Low	72.3	Confident	66 Å²	66	55.6 Å²	55.6	35%	0.346	30%	0.297	S	S	.	.			trans	-97.5	1.4	-175.9	-63.4	176.6	0	0	0	114.1	L588 C623 M626 C681 T682 K683	L588-L628 HydrophobicContact CD1-CD1 3.67Å; C623-L628 PolarHBondContact O-N 2.85Å; M626-L628 HydrophobicContact CB-CB 4.46Å; M626-L628 HydrophobicContact CB-CD1 3.92Å; M626-L628 HydrophobicContact CB-CG 3.91Å; M626-L628 HydrophobicContact CE-CD1 4.43Å; M626-L628 PolarHBondContact O-N 3.49Å; M626-L628 HydrophobicContact SD-CD1 4.34Å; L628-C681 HydrophobicContact CB-CB 3.45Å; L628-C681 VanDerWaalsContact CB-CB 3.45Å; L628-C681 HydrophobicContact CD1-CB 4.25Å; L628-C681 HydrophobicContact CG-CB 4.5Å; L628-T682 CarbonylContact O-C 3.51Å; L628-K683 VanDerWaalsContact O-CA 3.26Å; L628-K683 WeakPolarHBondContact O-CA 3.36Å; L628-K683 PolarHBondContact O-N 3.19Å; L628-K683 VanDerWaalsContact O-N 3.13Å
629	G	60.2	Low	71.7	Confident	12 Å²	12	58.2 Å²	58.2	12%	0.124	31%	0.309	C	S	.	.			trans	79.9	-170.9	169	0	0	0	0	0	115.9	C623 T682	C623-G629 WeakPolarHBondContact CB-O 3.45Å; C623-G629 PolarHBondContact O-N 3.3Å; G629-T682 CarbonylContact C-O 3.56Å
630	E	68.3	Low	70.6	Confident	90 Å²	90	67.5 Å²	67.5	42%	0.421	35%	0.353	S	S	.	.	S	Bend	trans	-133.3	147.6	177.1	-75.3	-176.1	-166	0	0	110.2	Q620 T682	Q620-E630 HydrophobicContact CB-CG 4.32Å; Q620-E630 WeakPolarHBondContact CB-OE1 3.4Å; Q620-E630 HydrophobicContact CG-CG 4.23Å; E630-T682 PolarHBondContact N-O 3.04Å
631	P	56.7	Low	69.6	Low	92 Å²	92	72.5 Å²	72.5	60%	0.597	38%	0.376	S	S	*	.			cis	-89.4	156.7	10.6	32.3	-36.5	0	0	0	116.3	T682	P631-T682 VanDerWaalsContact CD-OG1 3.25Å; P631-T682 WeakPolarHBondContact CD-OG1 3.46Å; P631-T682 PolarHBondContact O-N 3.39Å; P631-T682 PolarHBondContact O-OG1 3.15Å; P631-T682 VanDerWaalsContact O-OG1 3.1Å
632	S	60.7	Low	68.3	Low	5 Å²	5	79.7 Å²	79.7	4%	0.035	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.9	179.4	56.7	0	0	0	0	111.6	S619 Q620 C623 L680	S619-S632 PolarHBondContact O-OG 3.33Å; Q620-S632 PolarHBondContact N-OG 2.74Å; C623-S632 WeakPolarHBondContact SG-CB 3.41Å; S632-L680 VanDerWaalsContact CA-O 3.31Å; S632-L680 WeakPolarHBondContact CA-O 3.44Å
633	V	67.4	Low	67.3	Low	83 Å²	83	88.8 Å²	88.8	50%	0.503	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	115	170.8	-179.4	0	0	0	0	108.5	L680	V633-L680 HydrophobicContact CB-CB 4.33Å; V633-L680 PolarHBondContact N-O 3.31Å; V633-L680 PolarHBondContact O-N 3.43Å
634	T	75.7	Confident	66.5	Low	45 Å²	45	90 Å²	90	28%	0.276	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.5	179.2	-48	0	0	0	0	110.7	S619 I677 S678 L679	S619-T634 WeakPolarHBondContact CB-OG1 3.48Å; S619-T634 PolarHBondContact OG-OG1 2.87Å; T634-I677 HydrophobicContact CG2-CG2 3.75Å; T634-S678 CarbonylContact C-O 3.56Å; T634-S678 WeakPolarHBondContact CA-O 3.43Å; T634-L679 HydrophobicContact CG2-CD2 3.91Å; T634-L679 VanDerWaalsContact OG1-CD2 3.28Å; T634-L679 WeakPolarHBondContact OG1-CD2 3.42Å
635	K	77.2	Confident	66.2	Low	136 Å²	136	92.5 Å²	92.5	59%	0.591	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.2	173.5	-68	-178.2	-178	175.8	0	109.9	S678	K635-S678 PolarHBondContact N-O 3.31Å; K635-S678 WeakPolarHBondContact O-CA 3.07Å; K635-S678 WeakPolarHBondContact O-CB 3.1Å; K635-S678 PolarHBondContact O-N 3.05Å
636	L	78.8	Confident	66.1	Low	109 Å²	109	93.8 Å²	93.8	57%	0.571	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.2	176.9	-58	178.7	0	0	0	109.4	A611 I677	A611-L636 HydrophobicContact CB-CD2 3.56Å; L636-I677 HydrophobicContact CD2-CG1 4.27Å
637	I	76.3	Confident	66.4	Low	63 Å²	63	92.1 Å²	92.1	32%	0.323	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.2	-177.5	-60.1	177.2	0	0	0	109.1	F597 S675 K676	F597-I637 HydrophobicContact CE1-CB 4.16Å; F597-I637 HydrophobicContact CE1-CD1 3.58Å; F597-I637 HydrophobicContact CE1-CG1 4.38Å; F597-I637 HydrophobicContact CE1-CG2 4.29Å; F597-I637 HydrophobicContact CZ-CD1 3.96Å; I637-S675 CarbonylContact O-C 3.46Å; I637-S675 WeakPolarHBondContact O-CA 3.48Å; I637-K676 PolarHBondContact N-O 2.84Å; I637-K676 PolarHBondContact O-N 2.81Å
638	Q	73.8	Confident	67	Low	157 Å²	157	91.3 Å²	91.3	73%	0.734	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.9	176.4	-82.3	-177.8	-25.7	0	0	111.6	S675	Q638-S675 VanDerWaalsContact CG-OG 3.27Å; Q638-S675 WeakPolarHBondContact CG-OG 3.33Å
639	E	66.3	Low	67.7	Low	58 Å²	58	89.7 Å²	89.7	27%	0.271	44%	0.435	S	S	.	.			trans	-103.2	138.7	178.6	-165.9	157.9	-112.7	0	0	113	P644 R674 K676	E639-P644 WeakPolarHBondContact OE2-CG 3.23Å; E639-R674 PolarHBondContact N-O 3.39Å; E639-K676 VanDerWaalsContact CD-CE 3.4Å; E639-K676 WeakPolarHBondContact OE1-CE 3.37Å; E639-K676 IonicContact OE1-NZ 3.32Å; E639-K676 PolarHBondContact OE1-NZ 3.38Å; E639-K676 WeakPolarHBondContact OE2-CE 3.13Å; E639-K676 IonicContact OE2-NZ 3.26Å; E639-K676 PolarHBondContact OE2-NZ 2.06Å
640	Q	56.6	Low	68.4	Low	195 Å²	195	92.3 Å²	92.3	91%	0.911	44%	0.444	S	S	*	.			trans	-99.2	-13.2	-178.1	-70.7	-176.4	-9.5	0	0	113.7
641	E	56.9	Low	68.3	Low	163 Å²	163	93.1 Å²	93.1	76%	0.762	46%	0.46	S	S	*	.	S	Bend	trans	-87.8	149.1	-177.8	-71.1	-167.3	158.8	0	0	113.3
642	K	52.7	Low	68.8	Low	190 Å²	190	93.5 Å²	93.5	83%	0.826	46%	0.457	S	S	*	.	S	Bend	trans	-92.5	126.7	179.7	-87.5	-179.2	172.5	-178.8	0	109.4
643	E	55.5	Low	69.2	Low	191 Å²	191	95.3 Å²	95.3	89%	0.893	46%	0.463	S	S	*	.			trans	96	70.7	172	-55.6	-169.3	179.8	0	0	118.1
644	P	59.9	Low	69.1	Low	26 Å²	26	97.6 Å²	97.6	17%	0.169	47%	0.468	C	S	.	.			trans	-98.3	141.8	149.9	-3.2	23.8	0	0	0	111	H608 E639 W646	H608-P644 HydrophobicContact CB-CB 4.45Å; E639-P644 WeakPolarHBondContact OE2-CG 3.23Å; P644-W646 HydrophobicContact CB-CD2 4.41Å; P644-W646 HydrophobicContact CB-CZ2 4.01Å; P644-W646 HydrophobicContact CG-CH2 4.14Å; P644-W646 HydrophobicContact CG-CZ2 3.47Å; P644-W646 VanDerWaalsContact CG-CZ2 3.47Å; P644-W646 PolarHBondContact O-NE1 2.93Å; P644-W646 VanDerWaalsContact O-NE1 3.12Å
645	R	68.9	Low	68.3	Low	166 Å²	166	99.9 Å²	99.9	63%	0.626	49%	0.486	S	S	*	.			trans	-74.5	121.8	162.7	-64.1	-179.2	-179.9	177.9	0.1	107.7	H608	H608-R645 PolarHBondContact N-O 3.3Å; H608-R645 VanDerWaalsContact N-O 3.08Å
646	W	74.4	Confident	67.5	Low	37 Å²	37	96.4 Å²	96.4	14%	0.14	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	138.4	-172.9	-59.2	92.5	0	0	0	111.9	H608 C610 P644 C671 K676	H608-W646 HydrophobicContact CB-CE3 4.27Å; H608-W646 HydrophobicContact CB-CZ3 4.4Å; H608-W646 WeakPolarHBondContact O-CA 3.28Å; C610-W646 HydrophobicContact CB-CE3 4.15Å; P644-W646 HydrophobicContact CB-CD2 4.41Å; P644-W646 HydrophobicContact CB-CZ2 4.01Å; P644-W646 HydrophobicContact CG-CH2 4.14Å; P644-W646 HydrophobicContact CG-CZ2 3.47Å; P644-W646 VanDerWaalsContact CG-CZ2 3.47Å; P644-W646 PolarHBondContact O-NE1 2.93Å; P644-W646 VanDerWaalsContact O-NE1 3.12Å; W646-C671 HydrophobicContact CB-CB 4.48Å; W646-C671 HydrophobicContact CD2-CB 3.57Å; W646-C671 HydrophobicContact CE3-CB 3.75Å; W646-C671 HydrophobicContact CG-CB 3.91Å; W646-C671 HydrophobicContact CZ2-CB 4.36Å; W646-C671 HydrophobicContact CZ3-CB 4.22Å; W646-K676 HydrophobicContact CH2-CG 4.16Å; W646-K676 HydrophobicContact CZ3-CG 4.06Å
647	L	78.1	Confident	66.3	Low	1 Å²	1	98.5 Å²	98.5	1%	0.005	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.5	162.6	-67.4	168	0	0	0	109.7	V600 H607 H608 C610 L665 N667	V600-L647 HydrophobicContact CB-CD1 3.94Å; V600-L647 HydrophobicContact CG1-CD1 3.97Å; H607-L647 HydrophobicContact CB-CD1 3.46Å; H607-L647 VanDerWaalsContact CB-CD1 3.46Å; H607-L647 HydrophobicContact CB-CG 3.7Å; H608-L647 PolarHBondContact O-N 3.17Å; C610-L647 WeakPolarHBondContact CB-O 3.49Å; C610-L647 PolarHBondContact N-O 3.37Å; L647-L665 HydrophobicContact CB-CB 4.11Å; L647-L665 HydrophobicContact CB-CD1 4.48Å; L647-L665 HydrophobicContact CB-CD2 4.38Å; L647-L665 HydrophobicContact CD1-CB 4.35Å; L647-L665 HydrophobicContact CD1-CD1 4.42Å; L647-N667 VanDerWaalsContact CD2-OD1 3.25Å; L647-N667 WeakPolarHBondContact CD2-OD1 3.45Å
648	T	79.8	Confident	65.3	Low	33 Å²	33	98.5 Å²	98.5	20%	0.202	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.8	178.1	57.1	0	0	0	0	110.3	C610 V666 G668	C610-T648 HydrophobicContact CB-CG2 4.15Å; T648-V666 PolarHBondContact N-O 3.06Å; T648-V666 WeakPolarHBondContact O-CG2 3.18Å; T648-V666 PolarHBondContact O-N 3.41Å; T648-V666 PolarHBondContact OG1-O 3.46Å; T648-G668 VanDerWaalsContact OG1-CA 3.22Å; T648-G668 WeakPolarHBondContact OG1-CA 3.44Å
649	L	77.7	Confident	64.9	Low	31 Å²	31	92.4 Å²	92.4	16%	0.162	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	137.3	178.1	-154.5	82.1	0	0	0	111.4	W614 L618 W653 L665	W614-L649 HydrophobicContact CZ3-CD1 4.39Å; L618-L649 HydrophobicContact CD1-CD1 3.45Å; L618-L649 VanDerWaalsContact CD1-CD1 3.45Å; L618-L649 HydrophobicContact CD1-CD2 4.01Å; L618-L649 HydrophobicContact CD1-CG 4.41Å; L618-L649 HydrophobicContact CD2-CD1 4.35Å; L649-W653 HydrophobicContact CD2-CB 4.14Å; L649-W653 HydrophobicContact CD2-CD2 3.85Å; L649-W653 HydrophobicContact CD2-CG 3.46Å; L649-W653 VanDerWaalsContact CD2-CG 3.46Å; L649-W653 HydrophobicContact CG-CB 4.19Å; L649-W653 HydrophobicContact CG-CG 4.04Å; L649-L665 HydrophobicContact CD1-CD2 4.37Å
650	H	74.7	Confident	65.1	Low	67 Å²	67	89.8 Å²	89.8	31%	0.31	46%	0.462	S	S	.	.			trans	-62.5	140.4	173.8	-168.3	-99.2	0	0	0	111.1	N652 W653 L664 V666	H650-N652 PolarHBondContact ND1-N 3.28Å; H650-N652 PolarHBondContact O-N 3.18Å; H650-N652 VanDerWaalsContact O-N 3.15Å; H650-W653 PolarHBondContact O-N 3.31Å; H650-L664 WeakPolarHBondContact CB-O 3.16Å; H650-L664 PolarHBondContact N-O 3.25Å; H650-V666 HydrophobicContact CB-CG1 4.48Å
651	S	67.4	Low	66	Low	107 Å²	107	80.5 Å²	80.5	75%	0.748	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.4	-175.7	46.6	0	0	0	0	114.6
652	N	67.1	Low	66.9	Low	100 Å²	100	73 Å²	73	54%	0.535	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	26	179.6	-65.3	-14.7	0	0	0	113.7	H650 E654 S655	H650-N652 PolarHBondContact ND1-N 3.28Å; H650-N652 PolarHBondContact O-N 3.18Å; H650-N652 VanDerWaalsContact O-N 3.15Å; N652-E654 PolarHBondContact O-N 3.2Å; N652-E654 VanDerWaalsContact O-N 3.14Å; N652-S655 PolarHBondContact O-N 2.9Å; N652-S655 VanDerWaalsContact O-N 3.09Å; N652-S655 PolarHBondContact O-OG 3.43Å
653	W	67.7	Low	67.8	Low	43 Å²	43	67.7 Å²	67.7	16%	0.163	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-55.8	-30.4	-175.2	70.8	-83.9	0	0	0	114.4	Q615 L618 L649 H650 S655 L656 L664	Q615-W653 HydrophobicContact CG-CH2 4.45Å; Q615-W653 HydrophobicContact CG-CZ2 4.33Å; Q615-W653 VanDerWaalsContact OE1-CH2 3.3Å; L618-W653 HydrophobicContact CD2-CE3 4.33Å; L649-W653 HydrophobicContact CD2-CB 4.14Å; L649-W653 HydrophobicContact CD2-CD2 3.85Å; L649-W653 HydrophobicContact CD2-CG 3.46Å; L649-W653 VanDerWaalsContact CD2-CG 3.46Å; L649-W653 HydrophobicContact CG-CB 4.19Å; L649-W653 HydrophobicContact CG-CG 4.04Å; H650-W653 PolarHBondContact O-N 3.31Å; W653-S655 PolarHBondContact O-N 3.03Å; W653-S655 VanDerWaalsContact O-N 3.15Å; W653-L656 PolarHBondContact O-N 3.16Å; W653-L656 VanDerWaalsContact O-N 3.13Å; W653-L664 HydrophobicContact CB-CD2 4.3Å
654	E	65.4	Low	68.8	Low	132 Å²	132	58.9 Å²	58.9	62%	0.617	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-63.9	-18.7	178.9	-63	-179.1	174.6	0	0	113.8	N652	N652-E654 PolarHBondContact O-N 3.2Å; N652-E654 VanDerWaalsContact O-N 3.14Å
655	S	58.8	Low	69.7	Low	92 Å²	92	57.6 Å²	57.6	64%	0.643	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-90.8	-12.7	178.4	65	0	0	0	0	114	N652 W653 N657	N652-S655 PolarHBondContact O-N 2.9Å; N652-S655 VanDerWaalsContact O-N 3.09Å; N652-S655 PolarHBondContact O-OG 3.43Å; W653-S655 PolarHBondContact O-N 3.03Å; W653-S655 VanDerWaalsContact O-N 3.15Å; S655-N657 PolarHBondContact O-N 3.23Å
656	L	60.4	Low	70.1	Confident	63 Å²	63	52 Å²	52	33%	0.33	30%	0.297	S	S	.	.			trans	-98.4	58.6	-179.4	-67.1	164.9	0	0	0	109.9	W653 G658 T659 L664	W653-L656 PolarHBondContact O-N 3.16Å; W653-L656 VanDerWaalsContact O-N 3.13Å; L656-G658 PolarHBondContact O-N 3.39Å; L656-G658 VanDerWaalsContact O-N 3.16Å; L656-T659 PolarHBondContact O-OG1 3.42Å; L656-L664 HydrophobicContact CB-CD2 3.7Å; L656-L664 HydrophobicContact CD1-CD2 3.94Å; L656-L664 HydrophobicContact CG-CD2 4.49Å
657	N	53.4	Low	69.9	Low	154 Å²	154	55.8 Å²	55.8	82%	0.824	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	106.7	177.3	-86.2	-22	0	0	0	110	S655	S655-N657 PolarHBondContact O-N 3.23Å
658	G	55	Low	69.1	Low	62 Å²	62	56.9 Å²	56.9	64%	0.639	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	131.5	-8.7	168.8	0	0	0	0	0	115.8	L656	L656-G658 PolarHBondContact O-N 3.39Å; L656-G658 VanDerWaalsContact O-N 3.16Å
659	T	65.6	Low	68.2	Low	30 Å²	30	64.5 Å²	64.5	18%	0.184	36%	0.364	C	S	.	.			trans	-88.9	167.5	-171.8	54.1	0	0	0	0	114	L656 E663	L656-T659 PolarHBondContact O-OG1 3.42Å; T659-E663 WeakPolarHBondContact CB-OE2 3.22Å; T659-E663 WeakPolarHBondContact CG2-OE2 3.32Å
660	T	70.6	Confident	67.5	Low	3 Å²	3	67.5 Å²	67.5	2%	0.018	39%	0.388	C	S	.	.			trans	-68.7	152	177.2	56.5	0	0	0	0	111.4	H662 E663 L664 F935 L936	T660-H662 VanDerWaalsContact C-N 3.25Å; T660-H662 WeakPolarHBondContact CB-CE1 3.47Å; T660-H662 VanDerWaalsContact CB-ND1 3.33Å; T660-H662 WeakPolarHBondContact CB-ND1 3.34Å; T660-H662 PolarHBondContact O-N 2.88Å; T660-H662 PolarHBondContact OG1-CE1 2.88Å; T660-H662 PolarHBondContact OG1-ND1 2.99Å; T660-H662 PolarHBondContact OG1-NE2 3.48Å; T660-E663 PolarHBondContact O-N 3.28Å; T660-L664 PolarHBondContact O-N 3.23Å; T660-F935 HydrophobicContact CG2-CB 3.93Å; T660-L936 HydrophobicContact CG2-CD2 4.44Å
661	L	76.6	Confident	67.3	Low	0 Å²	0	64.8 Å²	64.8	0%	0	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-33.2	-179	-175.9	72	0	0	0	113	V586 L598 W614 L618 L621 A622 E663 L664 L665	V586-L661 HydrophobicContact CG1-CD2 3.97Å; V586-L661 HydrophobicContact CG2-CB 4.22Å; V586-L661 HydrophobicContact CG2-CD2 4.28Å; L598-L661 HydrophobicContact CD2-CD2 3.99Å; W614-L661 HydrophobicContact CH2-CD1 3.79Å; W614-L661 HydrophobicContact CH2-CD2 4.19Å; W614-L661 HydrophobicContact CH2-CG 4.45Å; W614-L661 HydrophobicContact CZ3-CD1 4.43Å; L618-L661 HydrophobicContact CB-CD1 4.39Å; L618-L661 HydrophobicContact CD2-CD1 4.25Å; L621-L661 HydrophobicContact CD2-CD1 4.46Å; A622-L661 HydrophobicContact CB-CD2 3.7Å; L661-E663 VanDerWaalsContact C-N 3.31Å; L661-E663 PolarHBondContact O-N 3.47Å; L661-L664 PolarHBondContact O-N 3.21Å; L661-L665 HydrophobicContact CG-CD1 4.23Å; L661-L665 VanDerWaalsContact O-CG 3.3Å; L661-L665 WeakPolarHBondContact O-CG 3.32Å
662	H	74.6	Confident	67.6	Low	4 Å²	4	68.2 Å²	68.2	2%	0.019	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-28.8	179.1	60.2	-86.6	0	0	0	113	C570 E582 V600 T660 L665	C570-H662 PolarHBondContact O-CD2 2.67Å; E582-H662 IonicContact OE2-CD2 2.96Å; E582-H662 IonicContact OE2-CE1 2.67Å; E582-H662 PolarHBondContact OE2-CE1 3.35Å; E582-H662 VanDerWaalsContact OE2-CE1 3.31Å; E582-H662 IonicContact OE2-NE2 2.68Å; E582-H662 PolarHBondContact OE2-NE2 3.31Å; V600-H662 HydrophobicContact CG1-CB 3.63Å; T660-H662 VanDerWaalsContact C-N 3.25Å; T660-H662 WeakPolarHBondContact CB-CE1 3.47Å; T660-H662 VanDerWaalsContact CB-ND1 3.33Å; T660-H662 WeakPolarHBondContact CB-ND1 3.34Å; T660-H662 PolarHBondContact O-N 2.88Å; T660-H662 PolarHBondContact OG1-CE1 2.88Å; T660-H662 PolarHBondContact OG1-ND1 2.99Å; T660-H662 PolarHBondContact OG1-NE2 3.48Å; H662-L665 PolarHBondContact O-N 2.92Å
663	E	73.2	Confident	67.8	Low	79 Å²	79	65.3 Å²	65.3	37%	0.369	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-36.4	174.1	-165.3	-170.8	146.8	0	0	112	T659 T660 L661 L665	T659-E663 WeakPolarHBondContact CB-OE2 3.22Å; T659-E663 WeakPolarHBondContact CG2-OE2 3.32Å; T660-E663 PolarHBondContact O-N 3.28Å; L661-E663 VanDerWaalsContact C-N 3.31Å; L661-E663 PolarHBondContact O-N 3.47Å; E663-L665 PolarHBondContact O-N 3.47Å; E663-L665 VanDerWaalsContact O-N 3.16Å
664	L	75.9	Confident	68.1	Low	6 Å²	6	70.5 Å²	70.5	3%	0.031	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-10.9	176.7	-62	176.9	0	0	0	113.3	L618 L621 H650 W653 L656 T660 L661	L618-L664 HydrophobicContact CD2-CD1 3.94Å; L621-L664 HydrophobicContact CD2-CD1 4.03Å; H650-L664 WeakPolarHBondContact CB-O 3.16Å; H650-L664 PolarHBondContact N-O 3.25Å; W653-L664 HydrophobicContact CB-CD2 4.3Å; L656-L664 HydrophobicContact CB-CD2 3.7Å; L656-L664 HydrophobicContact CD1-CD2 3.94Å; L656-L664 HydrophobicContact CG-CD2 4.49Å; T660-L664 PolarHBondContact O-N 3.23Å; L661-L664 PolarHBondContact O-N 3.21Å
665	L	78.1	Confident	68.7	Low	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.2	-174.7	-72.2	174.5	0	0	0	111	V600 R602 V609 L647 L649 L661 H662 E663	V600-L665 HydrophobicContact CB-CD1 4.37Å; V600-L665 HydrophobicContact CG1-CD1 4.37Å; V600-L665 HydrophobicContact CG2-CD1 3.75Å; R602-L665 PolarHBondContact NH1-O 2.73Å; V609-L665 HydrophobicContact CG1-CD1 4.15Å; V609-L665 HydrophobicContact CG1-CD2 3.83Å; V609-L665 HydrophobicContact CG2-CD1 3.87Å; L647-L665 HydrophobicContact CB-CB 4.11Å; L647-L665 HydrophobicContact CB-CD1 4.48Å; L647-L665 HydrophobicContact CB-CD2 4.38Å; L647-L665 HydrophobicContact CD1-CB 4.35Å; L647-L665 HydrophobicContact CD1-CD1 4.42Å; L649-L665 HydrophobicContact CD1-CD2 4.37Å; L661-L665 HydrophobicContact CG-CD1 4.23Å; L661-L665 VanDerWaalsContact O-CG 3.3Å; L661-L665 WeakPolarHBondContact O-CG 3.32Å; H662-L665 PolarHBondContact O-N 2.92Å; E663-L665 PolarHBondContact O-N 3.47Å; E663-L665 VanDerWaalsContact O-N 3.16Å
666	V	76.8	Confident	69.8	Low	49 Å²	49	61.3 Å²	61.3	30%	0.297	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	155.2	178.6	-68.4	0	0	0	0	111.7	T648 H650 G668	T648-V666 PolarHBondContact N-O 3.06Å; T648-V666 WeakPolarHBondContact O-CG2 3.18Å; T648-V666 PolarHBondContact O-N 3.41Å; T648-V666 PolarHBondContact OG1-O 3.46Å; H650-V666 HydrophobicContact CB-CG1 4.48Å; V666-G668 PolarHBondContact O-N 2.88Å
667	N	70.4	Confident	70.8	Confident	116 Å²	116	58.4 Å²	58.4	62%	0.62	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	101.4	171.3	-80.4	-19.1	0	0	0	109.6	L647	L647-N667 VanDerWaalsContact CD2-OD1 3.25Å; L647-N667 WeakPolarHBondContact CD2-OD1 3.45Å
668	G	61.8	Low	72.2	Confident	23 Å²	23	51.5 Å²	51.5	24%	0.237	28%	0.284	C	S	.	.			trans	-95.5	149.1	-176.3	0	0	0	0	0	114	T648 V666 S670	T648-G668 VanDerWaalsContact OG1-CA 3.22Å; T648-G668 WeakPolarHBondContact OG1-CA 3.44Å; V666-G668 PolarHBondContact O-N 2.88Å; G668-S670 PolarHBondContact O-N 3.33Å; G668-S670 VanDerWaalsContact O-N 3.07Å
669	Q	61.2	Low	73.3	Confident	193 Å²	193	48.5 Å²	48.5	90%	0.902	25%	0.253	S	S	*	.	S	Bend	trans	-75.9	89.6	171.7	-67	-172.2	-17.2	0	0	110.2
670	S	63.3	Low	73.7	Confident	95 Å²	95	52 Å²	52	66%	0.664	27%	0.27	S	S	*	.			trans	60.2	124.6	171.1	62.4	0	0	0	0	117.8	G668 E672	G668-S670 PolarHBondContact O-N 3.33Å; G668-S670 VanDerWaalsContact O-N 3.07Å; S670-E672 PolarHBondContact O-N 3.03Å
671	C	70.3	Confident	73.7	Confident	9 Å²	9	53 Å²	53	6%	0.061	28%	0.277	C	S	.	.			trans	-70.5	116.5	172	-169.8	0	0	0	0	110.6	C610 W646	C610-C671 HydrophobicContact CB-CB 3.76Å; C610-C671 WeakPolarHBondContact CB-SG 3.44Å; C610-C671 VanDerWaalsContact SG-CA 3.53Å; C610-C671 WeakPolarHBondContact SG-CB 3.43Å; C610-C671 CovalentContact SG-SG 2.04Å; C610-C671 PolarHBondContact SG-SG 3.45Å; W646-C671 HydrophobicContact CB-CB 4.48Å; W646-C671 HydrophobicContact CD2-CB 3.57Å; W646-C671 HydrophobicContact CE3-CB 3.75Å; W646-C671 HydrophobicContact CG-CB 3.91Å; W646-C671 HydrophobicContact CZ2-CB 4.36Å; W646-C671 HydrophobicContact CZ3-CB 4.22Å
672	E	72.6	Confident	73.1	Confident	180 Å²	180	56.1 Å²	56.1	84%	0.841	30%	0.296	S	S	*	.	S	Bend	trans	-69.9	-39.4	-174.9	-69.3	-169.5	168.3	0	0	111.3	D612 S670	D612-E672 PolarHBondContact OD2-N 3.01Å; S670-E672 PolarHBondContact O-N 3.03Å
673	S	72	Confident	72.6	Confident	38 Å²	38	61 Å²	61	27%	0.266	32%	0.318	S	S	.	.	S	Bend	trans	-80.4	-13.8	-179.8	68.3	0	0	0	0	115	D612 S675	D612-S673 WeakPolarHBondContact OD1-CB 3.5Å; D612-S673 PolarHBondContact OD1-OG 2.9Å; D612-S673 PolarHBondContact OD2-N 3.19Å; S673-S675 PolarHBondContact O-N 2.77Å; S673-S675 PolarHBondContact O-OG 3.08Å; S673-S675 VanDerWaalsContact O-OG 3.07Å; S673-S675 WeakPolarHBondContact OG-CB 3.26Å; S673-S675 PolarHBondContact OG-N 3.15Å
674	R	74.1	Confident	72.3	Confident	153 Å²	153	61.2 Å²	61.2	58%	0.577	32%	0.318	S	S	*	.			trans	47.3	31.4	-170.5	-58	-177.1	179.6	173	1.4	113.6	E639	E639-R674 PolarHBondContact N-O 3.39Å
675	S	78.9	Confident	72.2	Confident	12 Å²	12	63.8 Å²	63.8	8%	0.084	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.7	-176.8	-61.7	0	0	0	0	110.4	A611 I637 Q638 S673	A611-S675 VanDerWaalsContact CB-O 3.27Å; A611-S675 WeakPolarHBondContact CB-O 3.34Å; A611-S675 PolarHBondContact N-O 3.48Å; I637-S675 CarbonylContact O-C 3.46Å; I637-S675 WeakPolarHBondContact O-CA 3.48Å; Q638-S675 VanDerWaalsContact CG-OG 3.27Å; Q638-S675 WeakPolarHBondContact CG-OG 3.33Å; S673-S675 PolarHBondContact O-N 2.77Å; S673-S675 PolarHBondContact O-OG 3.08Å; S673-S675 VanDerWaalsContact O-OG 3.07Å; S673-S675 WeakPolarHBondContact OG-CB 3.26Å; S673-S675 PolarHBondContact OG-N 3.15Å
676	K	80.3	Confident	72.6	Confident	18 Å²	18	64.3 Å²	64.3	8%	0.078	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	153.1	173.8	-70.6	-176.9	170.6	170.5	0	110.8	F597 H608 I637 E639 W646	F597-K676 HydrophobicContact CD1-CB 4.26Å; H608-K676 PolarHBondContact CE1-NZ 3.23Å; H608-K676 VanDerWaalsContact CG-CE 3.47Å; H608-K676 VanDerWaalsContact ND1-CE 3.32Å; H608-K676 WeakPolarHBondContact ND1-CE 3.42Å; H608-K676 PolarHBondContact ND1-NZ 2.91Å; H608-K676 PolarHBondContact NE2-NZ 2.87Å; I637-K676 PolarHBondContact N-O 2.84Å; I637-K676 PolarHBondContact O-N 2.81Å; E639-K676 VanDerWaalsContact CD-CE 3.4Å; E639-K676 WeakPolarHBondContact OE1-CE 3.37Å; E639-K676 IonicContact OE1-NZ 3.32Å; E639-K676 PolarHBondContact OE1-NZ 3.38Å; E639-K676 WeakPolarHBondContact OE2-CE 3.13Å; E639-K676 IonicContact OE2-NZ 3.26Å; E639-K676 PolarHBondContact OE2-NZ 2.06Å; W646-K676 HydrophobicContact CH2-CG 4.16Å; W646-K676 HydrophobicContact CZ3-CG 4.06Å
677	I	82.4	Confident	72.9	Confident	3 Å²	3	62 Å²	62	2%	0.015	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.9	176.8	-60.8	154.2	0	0	0	108.9	L598 V609 A611 W614 T634 L636 L679	L598-I677 PolarHBondContact N-O 3.13Å; V609-I677 HydrophobicContact CB-CD1 3.98Å; V609-I677 HydrophobicContact CG1-CD1 3.62Å; A611-I677 HydrophobicContact CB-CG1 4.08Å; W614-I677 HydrophobicContact CB-CD1 4.33Å; W614-I677 HydrophobicContact CD2-CD1 3.27Å; W614-I677 HydrophobicContact CD2-CG1 4.22Å; W614-I677 HydrophobicContact CE3-CD1 3.38Å; W614-I677 HydrophobicContact CG-CD1 3.73Å; W614-I677 HydrophobicContact CG-CG1 4.22Å; W614-I677 HydrophobicContact CH2-CD1 4.01Å; W614-I677 HydrophobicContact CZ2-CD1 3.96Å; W614-I677 HydrophobicContact CZ3-CD1 3.76Å; T634-I677 HydrophobicContact CG2-CG2 3.75Å; L636-I677 HydrophobicContact CD2-CG1 4.27Å; I677-L679 HydrophobicContact CG2-CD1 4.35Å; I677-L679 HydrophobicContact CG2-CD2 4.27Å; I677-L679 HydrophobicContact CG2-CG 3.92Å
678	S	82.1	Confident	73.7	Confident	8 Å²	8	62.3 Å²	62.3	6%	0.056	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128	168.6	179.1	0	0	0	0	109.7	S596 T634 K635	S596-S678 CarbonylContact O-C 3.33Å; S596-S678 WeakPolarHBondContact O-CA 3.22Å; S596-S678 WeakPolarHBondContact O-CB 3.46Å; S596-S678 PolarHBondContact O-OG 3.46Å; T634-S678 CarbonylContact C-O 3.56Å; T634-S678 WeakPolarHBondContact CA-O 3.43Å; K635-S678 PolarHBondContact N-O 3.31Å; K635-S678 WeakPolarHBondContact O-CA 3.07Å; K635-S678 WeakPolarHBondContact O-CB 3.1Å; K635-S678 PolarHBondContact O-N 3.05Å
679	L	77.9	Confident	74.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.5	-175.1	-74.4	171	0	0	0	110.9	L588 S596 L598 S619 A622 T634 I677	L588-L679 HydrophobicContact CD2-CB 3.95Å; S596-L679 WeakPolarHBondContact CB-O 3Å; S596-L679 PolarHBondContact O-N 2.73Å; S596-L679 PolarHBondContact OG-O 3.2Å; L598-L679 HydrophobicContact CB-CD1 4.1Å; L598-L679 HydrophobicContact CD1-CD1 3.96Å; L598-L679 HydrophobicContact CD2-CD1 3.89Å; L598-L679 HydrophobicContact CG-CD1 4.2Å; S619-L679 VanDerWaalsContact CB-CD2 3.43Å; A622-L679 HydrophobicContact CB-CD1 3.85Å; T634-L679 HydrophobicContact CG2-CD2 3.91Å; T634-L679 VanDerWaalsContact OG1-CD2 3.28Å; T634-L679 WeakPolarHBondContact OG1-CD2 3.42Å; I677-L679 HydrophobicContact CG2-CD1 4.35Å; I677-L679 HydrophobicContact CG2-CD2 4.27Å; I677-L679 HydrophobicContact CG2-CG 3.92Å
680	L	74.8	Confident	75.2	Confident	103 Å²	103	57.3 Å²	57.3	54%	0.539	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	101.7	168.1	-174.7	75.2	0	0	0	109.1	S632 V633	S632-L680 VanDerWaalsContact CA-O 3.31Å; S632-L680 WeakPolarHBondContact CA-O 3.44Å; V633-L680 HydrophobicContact CB-CB 4.33Å; V633-L680 PolarHBondContact N-O 3.31Å; V633-L680 PolarHBondContact O-N 3.43Å
681	C	70.2	Confident	75	Confident	23 Å²	23	54.4 Å²	54.4	16%	0.155	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.6	176.1	-49.4	0	0	0	0	110.5	C623 L628	C623-C681 VanDerWaalsContact CA-SG 3.52Å; C623-C681 HydrophobicContact CB-CB 3.64Å; C623-C681 WeakPolarHBondContact CB-SG 3.49Å; C623-C681 WeakPolarHBondContact SG-CB 3.48Å; C623-C681 CovalentContact SG-SG 2.02Å; C623-C681 PolarHBondContact SG-SG 3.24Å; L628-C681 HydrophobicContact CB-CB 3.45Å; L628-C681 VanDerWaalsContact CB-CB 3.45Å; L628-C681 HydrophobicContact CD1-CB 4.25Å; L628-C681 HydrophobicContact CG-CB 4.5Å
682	T	64.7	Low	74.4	Confident	66 Å²	66	55 Å²	55	41%	0.405	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-99.3	124.5	170.5	60.3	0	0	0	0	111.5	L628 G629 E630 P631 Q684	L628-T682 CarbonylContact O-C 3.51Å; G629-T682 CarbonylContact C-O 3.56Å; E630-T682 PolarHBondContact N-O 3.04Å; P631-T682 VanDerWaalsContact CD-OG1 3.25Å; P631-T682 WeakPolarHBondContact CD-OG1 3.46Å; P631-T682 PolarHBondContact O-N 3.39Å; P631-T682 PolarHBondContact O-OG1 3.15Å; P631-T682 VanDerWaalsContact O-OG1 3.1Å; T682-Q684 PolarHBondContact O-N 2.9Å
683	K	63.9	Low	73.4	Confident	108 Å²	108	57.4 Å²	57.4	47%	0.47	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-59	135.2	176.3	-158.7	173.5	-174.4	178.1	0	110.2	L628	L628-K683 VanDerWaalsContact O-CA 3.26Å; L628-K683 WeakPolarHBondContact O-CA 3.36Å; L628-K683 PolarHBondContact O-N 3.19Å; L628-K683 VanDerWaalsContact O-N 3.13Å
684	Q	65.7	Low	72.2	Confident	82 Å²	82	61.7 Å²	61.7	38%	0.383	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-48.6	141.8	177.4	-95.2	173.6	-11.3	0	0	112	T682 C686	T682-Q684 PolarHBondContact O-N 2.9Å; Q684-C686 PolarHBondContact O-N 3.12Å
685	D	75.1	Confident	70.3	Confident	61 Å²	61	61 Å²	61	33%	0.326	30%	0.304	S	S	.	.			trans	-73.1	87.8	-176.8	-168.1	44.6	0	0	0	111.2	R688 R805	D685-R688 IonicContact OD1-CZ 2.68Å; D685-R688 VanDerWaalsContact OD1-CZ 3.31Å; D685-R688 IonicContact OD1-NE 3.06Å; D685-R688 PolarHBondContact OD1-NE 3.43Å; D685-R688 IonicContact OD1-NH2 3.86Å; D685-R688 PolarHBondContact OD1-NH2 3.18Å; D685-R688 IonicContact OD2-CZ 3.31Å; D685-R688 IonicContact OD2-NE 2.76Å; D685-R688 PolarHBondContact OD2-NE 3.29Å; D685-R805 PolarHBondContact O-NH2 2.97Å; D685-R805 IonicContact OD2-CZ 2.66Å; D685-R805 IonicContact OD2-NH2 3.79Å; D685-R805 PolarHBondContact OD2-NH2 3.24Å
686	C	85.9	Confident	68.1	Low	11 Å²	11	70.2 Å²	70.2	7%	0.074	34%	0.343	C	S	.	.			trans	-98.4	163.4	-179.7	61.1	0	0	0	0	112.8	Q684 R688 P806 C808	Q684-C686 PolarHBondContact O-N 3.12Å; C686-R688 VanDerWaalsContact C-N 3.33Å; C686-R688 PolarHBondContact O-N 3.37Å; C686-P806 CarbonylContact C-O 3.43Å; C686-P806 WeakPolarHBondContact CA-O 3.18Å; C686-C808 HydrophobicContact CB-CB 4.03Å; C686-C808 WeakPolarHBondContact CB-SG 3.43Å; C686-C808 PolarHBondContact O-SG 3.22Å; C686-C808 WeakPolarHBondContact SG-CA 3.33Å; C686-C808 WeakPolarHBondContact SG-CB 3.29Å; C686-C808 CovalentContact SG-SG 2.04Å; C686-C808 PolarHBondContact SG-SG 3.01Å
687	G	84.3	Confident	65.8	Low	0 Å²	0	79.8 Å²	79.8	0%	0	38%	0.378	C	S	.	.	S	Bend	trans	69.3	23	165.9	0	0	0	0	0	115.3	P806 W894	G687-P806 PolarHBondContact N-O 2.78Å; G687-W894 WeakPolarHBondContact CA-O 3.31Å; G687-W894 PolarHBondContact O-N 3.11Å
688	R	86.6	Confident	63.6	Low	123 Å²	123	86.2 Å²	86.2	46%	0.464	41%	0.411	S	S	.	.			trans	-105.7	147.4	176.3	-62.6	-153.8	-163.5	-157.7	8.5	112.4	D685 C686 P690	D685-R688 IonicContact OD1-CZ 2.68Å; D685-R688 VanDerWaalsContact OD1-CZ 3.31Å; D685-R688 IonicContact OD1-NE 3.06Å; D685-R688 PolarHBondContact OD1-NE 3.43Å; D685-R688 IonicContact OD1-NH2 3.86Å; D685-R688 PolarHBondContact OD1-NH2 3.18Å; D685-R688 IonicContact OD2-CZ 3.31Å; D685-R688 IonicContact OD2-NE 2.76Å; D685-R688 PolarHBondContact OD2-NE 3.29Å; C686-R688 VanDerWaalsContact C-N 3.33Å; C686-R688 PolarHBondContact O-N 3.37Å; R688-P690 VanDerWaalsContact C-CD 3.47Å; R688-P690 VanDerWaalsContact O-CD 3.27Å; R688-P690 WeakPolarHBondContact O-CD 3.25Å
689	R	84.4	Confident	61.1	Low	33 Å²	33	91.8 Å²	91.8	13%	0.125	44%	0.44	C	S	.	.			trans	-119.2	72.4	-178.3	-60.3	-179.3	-67.6	178.9	6	112.1	A691 A692 R708 W711 E888 W894	R689-A691 VanDerWaalsContact C-N 3.34Å; R689-A691 PolarHBondContact O-N 3.34Å; R689-A692 HydrophobicContact CB-CB 4.13Å; R689-A692 PolarHBondContact O-N 3.29Å; R689-R708 WeakPolarHBondContact CD-O 3.37Å; R689-R708 WeakPolarHBondContact CG-O 3.49Å; R689-W711 HydrophobicContact CG-CH2 3.6Å; R689-W711 HydrophobicContact CG-CZ3 3.95Å; R689-E888 IonicContact NH2-OE1 3.57Å; R689-W894 VanDerWaalsContact NH1-CZ2 3.28Å
690	P	68.9	Low	59.2	Low	77 Å²	77	94.2 Å²	94.2	50%	0.5	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.8	-174.3	27	-35.4	0	0	0	114.4	R688 A692	R688-P690 VanDerWaalsContact C-CD 3.47Å; R688-P690 VanDerWaalsContact O-CD 3.27Å; R688-P690 WeakPolarHBondContact O-CD 3.25Å; P690-A692 VanDerWaalsContact C-N 3.34Å
691	A	60.8	Low	58.1	Low	35 Å²	35	91.8 Å²	91.8	29%	0.289	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-7.7	179.2	0	0	0	0	0	114.2	R689 R693 G802 Y803	R689-A691 VanDerWaalsContact C-N 3.34Å; R689-A691 PolarHBondContact O-N 3.34Å; A691-R693 PolarHBondContact O-N 2.89Å; A691-R693 VanDerWaalsContact O-N 3.13Å; A691-G802 WeakPolarHBondContact CB-O 3.22Å; A691-Y803 HydrophobicContact CB-CE1 4.3Å
692	A	57.3	Low	57.9	Low	22 Å²	22	94.4 Å²	94.4	18%	0.182	47%	0.471	C	S	.	.			trans	-81.2	93	-177.3	0	0	0	0	0	111.9	R689 P690 M694	R689-A692 HydrophobicContact CB-CB 4.13Å; R689-A692 PolarHBondContact O-N 3.29Å; P690-A692 VanDerWaalsContact C-N 3.34Å; A692-M694 PolarHBondContact O-N 3.4Å; A692-M694 VanDerWaalsContact O-N 3.1Å
693	R	51.9	Low	58.1	Low	229 Å²	229	94.8 Å²	94.8	86%	0.864	47%	0.473	S	S	*	.			trans	-67.5	106.1	163.3	-75.5	-172.4	178.3	-178.7	1.1	109.3	A691 N695	A691-R693 PolarHBondContact O-N 2.89Å; A691-R693 VanDerWaalsContact O-N 3.13Å; R693-N695 PolarHBondContact O-N 3.38Å
694	M	46.2	Very low	58.5	Low	128 Å²	128	89.8 Å²	89.8	63%	0.631	45%	0.452	S	S	*	.			trans	-69.7	106.9	178.4	-72.4	-80.5	-169.9	0	0	110.4	A692	A692-M694 PolarHBondContact O-N 3.4Å; A692-M694 VanDerWaalsContact O-N 3.1Å
695	N	33.7	Very low	58.9	Low	140 Å²	140	93 Å²	93	75%	0.749	46%	0.461	S	S	*	.			trans	-147	120.9	157	-97.5	-20.9	0	0	0	111	R693	R693-N695 PolarHBondContact O-N 3.38Å
696	K	32.3	Very low	59	Low	205 Å²	205	93.6 Å²	93.6	89%	0.891	47%	0.468	S	S	*	.			trans	65.7	139.1	168.6	-66.9	-175.7	178.3	-179.3	0	119.6
697	R	32.9	Very low	58.6	Low	218 Å²	218	93.5 Å²	93.5	82%	0.823	47%	0.469	S	S	*	.			trans	-101.7	123.6	-171.6	176.2	-172.8	-169.7	171.6	4.5	109.5
698	I	35.9	Very low	58.5	Low	138 Å²	138	95.3 Å²	95.3	71%	0.708	48%	0.476	S	S	*	.			trans	-147.9	142.4	164	-55.5	-172.1	0	0	0	108.5	R702	I698-R702 PolarHBondContact O-NH1 3.49Å
699	L	29.6	Very low	58.7	Low	126 Å²	126	89.9 Å²	89.9	66%	0.66	46%	0.456	S	S	*	.			trans	-95	154.2	-168	-72.5	153.6	0	0	0	112.7	E842	L699-E842 VanDerWaalsContact CD2-OE2 3.31Å; L699-E842 WeakPolarHBondContact CD2-OE2 3.19Å
700	G	37.4	Very low	59	Low	51 Å²	51	88.3 Å²	88.3	53%	0.526	45%	0.45	S	S	.	.	S	Bend	trans	106.7	138.6	-175.7	0	0	0	0	0	111.2	R702	G700-R702 PolarHBondContact O-N 2.98Å
701	G	52.9	Low	60.2	Low	52 Å²	52	84.7 Å²	84.7	54%	0.536	43%	0.426	S	S	.	.			trans	-49.8	125.5	-177.5	0	0	0	0	0	111.1	E840	G701-E840 CarbonylContact C-O 3.29Å; G701-E840 VanDerWaalsContact CA-O 3.29Å; G701-E840 WeakPolarHBondContact CA-O 3.41Å
702	R	65.8	Low	61.8	Low	78 Å²	78	83.2 Å²	83.2	29%	0.294	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	156.7	-171.2	66.6	-180	177	-141.8	-16.2	111.6	I698 G700 S704 R708 Q839 E840	I698-R702 PolarHBondContact O-NH1 3.49Å; G700-R702 PolarHBondContact O-N 2.98Å; R702-S704 PolarHBondContact O-N 3.11Å; R702-R708 VanDerWaalsContact NH2-NH2 3.14Å; R702-Q839 PolarHBondContact O-OE1 3.42Å; R702-E840 HydrophobicContact CG-CG 3.62Å; R702-E840 IonicContact CZ-OE1 3.68Å; R702-E840 PolarHBondContact N-O 3.49Å; R702-E840 IonicContact NE-OE1 3.83Å; R702-E840 PolarHBondContact NE-OE1 2.91Å; R702-E840 IonicContact NH2-OE1 3.93Å; R702-E840 PolarHBondContact NH2-OE1 3.21Å; R702-E840 PolarHBondContact O-N 3.24Å
703	T	67.6	Low	63.5	Low	73 Å²	73	82.1 Å²	82.1	45%	0.448	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	121.9	169.7	-62.4	0	0	0	0	109.9	K837 Q839	T703-K837 HydrophobicContact CG2-CB 3.63Å; T703-K837 HydrophobicContact CG2-CD 3.81Å; T703-K837 HydrophobicContact CG2-CG 4.34Å; T703-Q839 VanDerWaalsContact N-OE1 3.13Å; T703-Q839 PolarHBondContact OG1-NE2 2.98Å; T703-Q839 PolarHBondContact OG1-OE1 3.19Å
704	S	72.4	Confident	65.5	Low	4 Å²	4	71.2 Å²	71.2	3%	0.028	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-69.4	147.1	178.5	172.5	0	0	0	0	111.1	R702 W709 N757 L838	R702-S704 PolarHBondContact O-N 3.11Å; S704-W709 VanDerWaalsContact OG-CD1 3.31Å; S704-N757 PolarHBondContact O-ND2 2.78Å; S704-N757 PolarHBondContact O-OD1 2.79Å; S704-L838 WeakPolarHBondContact CB-O 3.23Å; S704-L838 PolarHBondContact N-O 2.89Å
705	R	75.6	Confident	67.7	Low	148 Å²	148	65.2 Å²	65.2	56%	0.558	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-81.6	146.7	172.2	-64.8	-177	180	169.7	1.5	110.3	G707 R708 N757	R705-G707 PolarHBondContact O-N 3.36Å; R705-R708 HydrophobicContact CB-CB 4.48Å; R705-R708 WeakPolarHBondContact O-CB 3.21Å; R705-R708 PolarHBondContact O-N 2.05Å; R705-R708 VanDerWaalsContact O-N 3.11Å; R705-N757 PolarHBondContact O-OD1 3.2Å
706	P	77.3	Confident	70.4	Confident	74 Å²	74	59.9 Å²	59.9	48%	0.481	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	130.3	174.4	-24.9	33.1	0	0	0	112	R708 N757 Y803	P706-R708 VanDerWaalsContact C-N 3.29Å; P706-R708 PolarHBondContact O-N 3.13Å; P706-N757 HydrophobicContact CB-CB 4.13Å; P706-N757 HydrophobicContact CG-CB 4Å; P706-Y803 HydrophobicContact CB-CE1 4.2Å
707	G	75.9	Confident	72.9	Confident	10 Å²	10	50.2 Å²	50.2	10%	0.103	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	6.1	178.3	0	0	0	0	0	115.3	R705	R705-G707 PolarHBondContact O-N 3.36Å
708	R	83.8	Confident	74.7	Confident	37 Å²	37	46.4 Å²	46.4	14%	0.14	25%	0.254	C	S	.	.	S	Bend	trans	-71.5	-35.2	173.8	-169.7	164.1	176.4	82.3	5	112.3	R689 R702 R705 P706 P710 E840	R689-R708 WeakPolarHBondContact CD-O 3.37Å; R689-R708 WeakPolarHBondContact CG-O 3.49Å; R702-R708 VanDerWaalsContact NH2-NH2 3.14Å; R705-R708 HydrophobicContact CB-CB 4.48Å; R705-R708 WeakPolarHBondContact O-CB 3.21Å; R705-R708 PolarHBondContact O-N 2.05Å; R705-R708 VanDerWaalsContact O-N 3.11Å; P706-R708 VanDerWaalsContact C-N 3.29Å; P706-R708 PolarHBondContact O-N 3.13Å; R708-P710 WeakPolarHBondContact O-CD 3.03Å; R708-E840 WeakPolarHBondContact CD-OE2 3.24Å; R708-E840 IonicContact CZ-OE1 3.76Å; R708-E840 IonicContact NE-OE1 2.67Å; R708-E840 PolarHBondContact NE-OE1 2.91Å; R708-E840 VanDerWaalsContact NE-OE1 3.1Å; R708-E840 IonicContact NE-OE2 3.25Å; R708-E840 PolarHBondContact NE-OE2 2.95Å; R708-E840 IonicContact NH2-OE1 2.73Å
709	W	90.4	Very high	75.9	Confident	9 Å²	9	46 Å²	46	3%	0.034	26%	0.26	C	S	.	.	S	Bend	trans	-124.1	77.1	178.6	-55.2	108.1	0	0	0	110.6	S704 W711 Q712 Y823 T825 E840 V886 W894	S704-W709 VanDerWaalsContact OG-CD1 3.31Å; W709-W711 AromaticContact CE3-CE2 3.96Å; W709-W711 HydrophobicContact CE3-CH2 4.39Å; W709-W711 AromaticContact CE3-CZ2 3.5Å; W709-W711 HydrophobicContact CE3-CZ2 3.5Å; W709-W711 VanDerWaalsContact CE3-CZ2 3.5Å; W709-W711 AromaticContact CZ3-CZ2 3.83Å; W709-W711 HydrophobicContact CZ3-CZ2 3.83Å; W709-W711 PolarHBondContact O-N 2.94Å; W709-W711 VanDerWaalsContact O-N 3.16Å; W709-Q712 HydrophobicContact CB-CB 4.23Å; W709-Q712 WeakPolarHBondContact O-CB 3.36Å; W709-Q712 PolarHBondContact O-N 3.19Å; W709-Q712 VanDerWaalsContact O-N 3.14Å; W709-Y823 AromaticContact CH2-CD1 3.96Å; W709-Y823 HydrophobicContact CH2-CD1 3.96Å; W709-Y823 HydrophobicContact CH2-CD2 4.31Å; W709-Y823 AromaticContact CH2-CG 3.67Å; W709-Y823 HydrophobicContact CH2-CG 3.67Å; W709-Y823 AromaticContact CZ2-CD1 3.81Å; W709-Y823 HydrophobicContact CZ2-CD1 3.81Å; W709-Y823 AromaticContact CZ2-CG 4Å; W709-Y823 HydrophobicContact CZ2-CG 4Å; W709-T825 HydrophobicContact CB-CG2 4.41Å; W709-T825 VanDerWaalsContact CD1-CG2 3.45Å; W709-T825 HydrophobicContact CD2-CG2 3.78Å; W709-T825 HydrophobicContact CG-CG2 3.65Å; W709-T825 HydrophobicContact CZ2-CG2 4.39Å; W709-E840 PolarHBondContact NE1-OE2 3.14Å; W709-V886 HydrophobicContact CE3-CG2 4.24Å; W709-V886 HydrophobicContact CH2-CG2 4.48Å; W709-V886 HydrophobicContact CZ3-CG2 3.77Å; W709-W894 HydrophobicContact CH2-CE3 4.14Å; W709-W894 AromaticContact CH2-CH2 3.82Å; W709-W894 HydrophobicContact CH2-CH2 3.82Å; W709-W894 HydrophobicContact CH2-CZ2 4.45Å; W709-W894 AromaticContact CH2-CZ3 3.65Å; W709-W894 HydrophobicContact CH2-CZ3 3.65Å; W709-W894 HydrophobicContact CZ3-CD2 4.11Å; W709-W894 AromaticContact CZ3-CE3 3.67Å; W709-W894 HydrophobicContact CZ3-CE3 3.67Å; W709-W894 HydrophobicContact CZ3-CH2 4.15Å; W709-W894 AromaticContact CZ3-CZ3 3.68Å; W709-W894 HydrophobicContact CZ3-CZ3 3.68Å
710	P	91.2	Very high	77.5	Confident	1 Å²	1	43 Å²	43	1%	0.006	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-10.1	-168.3	30.2	-37	0	0	0	114.7	R708 Y803 V804 R805	R708-P710 WeakPolarHBondContact O-CD 3.03Å; P710-Y803 WeakPolarHBondContact CA-O 3.25Å; P710-Y803 VanDerWaalsContact CB-C 3.49Å; P710-Y803 VanDerWaalsContact CB-O 3.32Å; P710-Y803 WeakPolarHBondContact CB-O 3.31Å; P710-V804 WeakPolarHBondContact O-CA 3.46Å; P710-R805 CarbonylContact C-O 3.48Å; P710-R805 HydrophobicContact CB-CB 4.12Å; P710-R805 HydrophobicContact CB-CG 4.5Å; P710-R805 HydrophobicContact CG-CB 4.15Å; P710-R805 PolarHBondContact O-N 3.42Å
711	W	94.1	Very high	79.7	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-13.4	174.9	44	79.3	0	0	0	113.3	R689 W709 C713 V727 L728 R805 V807 V886 W894	R689-W711 HydrophobicContact CG-CH2 3.6Å; R689-W711 HydrophobicContact CG-CZ3 3.95Å; W709-W711 AromaticContact CE3-CE2 3.96Å; W709-W711 HydrophobicContact CE3-CH2 4.39Å; W709-W711 AromaticContact CE3-CZ2 3.5Å; W709-W711 HydrophobicContact CE3-CZ2 3.5Å; W709-W711 VanDerWaalsContact CE3-CZ2 3.5Å; W709-W711 AromaticContact CZ3-CZ2 3.83Å; W709-W711 HydrophobicContact CZ3-CZ2 3.83Å; W709-W711 PolarHBondContact O-N 2.94Å; W709-W711 VanDerWaalsContact O-N 3.16Å; W711-C713 PolarHBondContact O-N 3.08Å; W711-V727 HydrophobicContact CB-CG1 4.33Å; W711-V727 WeakPolarHBondContact O-CA 3.29Å; W711-L728 HydrophobicContact CB-CB 4.44Å; W711-L728 PolarHBondContact O-N 3.17Å; W711-R805 WeakPolarHBondContact CA-O 3.31Å; W711-R805 VanDerWaalsContact CB-O 3.29Å; W711-R805 WeakPolarHBondContact CB-O 3.49Å; W711-R805 PolarHBondContact N-O 2.9Å; W711-V807 HydrophobicContact CB-CB 3.85Å; W711-V807 HydrophobicContact CB-CG1 4.49Å; W711-V807 HydrophobicContact CD2-CB 3.83Å; W711-V807 HydrophobicContact CD2-CG2 4Å; W711-V807 HydrophobicContact CE3-CB 4.18Å; W711-V807 HydrophobicContact CE3-CG2 4.39Å; W711-V807 HydrophobicContact CG-CB 3.69Å; W711-V807 HydrophobicContact CG-CG2 4.21Å; W711-V886 HydrophobicContact CZ2-CG2 4.36Å; W711-W894 HydrophobicContact CH2-CB 3.31Å; W711-W894 HydrophobicContact CH2-CD2 4.33Å; W711-W894 AromaticContact CH2-CG 3.56Å; W711-W894 HydrophobicContact CH2-CG 3.56Å; W711-W894 HydrophobicContact CZ2-CB 3.62Å; W711-W894 HydrophobicContact CZ2-CD2 4.33Å; W711-W894 AromaticContact CZ2-CG 3.93Å; W711-W894 HydrophobicContact CZ2-CG 3.93Å; W711-W894 HydrophobicContact CZ3-CB 4.17Å
712	Q	94	Very high	81.2	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.019	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	129.3	176.2	178.2	70.5	54.7	0	0	109.2	W709 C726 T825 W827 L838	W709-Q712 HydrophobicContact CB-CB 4.23Å; W709-Q712 WeakPolarHBondContact O-CB 3.36Å; W709-Q712 PolarHBondContact O-N 3.19Å; W709-Q712 VanDerWaalsContact O-N 3.14Å; Q712-C726 PolarHBondContact NE2-O 3.43Å; Q712-T825 PolarHBondContact OE1-O 3.47Å; Q712-T825 PolarHBondContact OE1-OG1 3.45Å; Q712-W827 HydrophobicContact CG-CH2 3.6Å; Q712-W827 HydrophobicContact CG-CZ3 3.68Å; Q712-L838 HydrophobicContact CG-CD1 3.88Å; Q712-L838 HydrophobicContact CG-CD2 4.25Å
713	C	93.4	Very high	82.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	161.2	170.1	60.1	0	0	0	0	111.5	W711 C726 V727 V734 V752 V753 L754	W711-C713 PolarHBondContact O-N 3.08Å; C713-C726 HydrophobicContact CB-CB 4.49Å; C713-C726 WeakPolarHBondContact CB-SG 3.34Å; C713-C726 PolarHBondContact N-O 3.48Å; C713-C726 PolarHBondContact O-N 2.97Å; C713-C726 PolarHBondContact O-SG 3.4Å; C713-C726 VanDerWaalsContact SG-CA 3.58Å; C713-C726 WeakPolarHBondContact SG-CB 3.04Å; C713-C726 PolarHBondContact SG-O 2.88Å; C713-C726 CovalentContact SG-SG 2.03Å; C713-C726 PolarHBondContact SG-SG 3.47Å; C713-V727 PolarHBondContact SG-N 3.1Å; C713-V734 VanDerWaalsContact SG-CG1 3.52Å; C713-V752 HydrophobicContact CB-CG1 3.83Å; C713-V753 WeakPolarHBondContact CA-O 3.09Å; C713-V753 WeakPolarHBondContact CB-O 3.49Å; C713-L754 HydrophobicContact CB-CD2 4.04Å; C713-L754 HydrophobicContact CB-CG 3.84Å
714	S	92.3	Very high	83.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.3	175.8	166.9	0	0	0	0	108.1	Q716 H722 V753	S714-Q716 VanDerWaalsContact OG-CG 3.25Å; S714-Q716 WeakPolarHBondContact OG-CG 3.29Å; S714-Q716 PolarHBondContact OG-NE2 3.28Å; S714-H722 PolarHBondContact OG-ND1 3.29Å; S714-V753 PolarHBondContact N-O 2.77Å; S714-V753 PolarHBondContact O-N 3.26Å
715	L	92.4	Very high	84.2	Confident	1 Å²	1	36 Å²	36	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118	170.6	-172.4	69.5	0	0	0	108.5	I723 C724 T736 C740 F741 W750 V752	L715-I723 PolarHBondContact O-N 2.87Å; L715-C724 HydrophobicContact CB-CB 4.34Å; L715-C724 WeakPolarHBondContact CB-O 3.45Å; L715-C724 HydrophobicContact CD2-CB 4.28Å; L715-C724 PolarHBondContact N-O 2.62Å; L715-C724 PolarHBondContact O-N 3.46Å; L715-T736 HydrophobicContact CD2-CG2 4.44Å; L715-C740 HydrophobicContact CD2-CB 4.36Å; L715-F741 HydrophobicContact CD1-CE1 4.3Å; L715-F741 HydrophobicContact CD1-CZ 4.32Å; L715-F741 HydrophobicContact CD2-CD1 4.49Å; L715-F741 HydrophobicContact CD2-CE1 3.62Å; L715-F741 HydrophobicContact CD2-CE2 4.46Å; L715-F741 HydrophobicContact CD2-CZ 3.59Å; L715-W750 HydrophobicContact CD1-CE3 3.89Å; L715-W750 HydrophobicContact CD1-CZ3 4.44Å; L715-W750 HydrophobicContact CD2-CE3 3.93Å; L715-W750 HydrophobicContact CD2-CH2 4.23Å; L715-W750 HydrophobicContact CD2-CZ3 3.68Å; L715-W750 HydrophobicContact CG-CE3 3.56Å; L715-W750 HydrophobicContact CG-CZ3 3.61Å; L715-V752 HydrophobicContact CD1-CG2 3.84Å
716	Q	90.4	Very high	85	Confident	28 Å²	28	29 Å²	29	13%	0.131	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.1	-174.5	-57.4	-175	-2.7	0	0	111.8	S714 G721 K751 V753	S714-Q716 VanDerWaalsContact OG-CG 3.25Å; S714-Q716 WeakPolarHBondContact OG-CG 3.29Å; S714-Q716 PolarHBondContact OG-NE2 3.28Å; Q716-G721 CarbonylContact C-O 3.55Å; Q716-G721 WeakPolarHBondContact CA-O 3.23Å; Q716-G721 WeakPolarHBondContact CB-O 3.36Å; Q716-K751 HydrophobicContact CB-CG 3.85Å; Q716-K751 PolarHBondContact N-O 3.47Å; Q716-K751 PolarHBondContact O-N 3.04Å; Q716-K751 VanDerWaalsContact OE1-CE 3.3Å; Q716-V753 HydrophobicContact CG-CG2 4.21Å
717	S	84.9	Confident	85.9	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.014	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139	173.5	-179.8	0	0	0	0	109.7	S720 G721 I723 R744 V749	S717-S720 CarbonylContact O-C 3.56Å; S717-S720 PolarHBondContact O-N 3.28Å; S717-G721 PolarHBondContact N-O 3.37Å; S717-G721 PolarHBondContact O-N 2.63Å; S717-I723 VanDerWaalsContact CB-CD1 3.49Å; S717-R744 PolarHBondContact OG-NH1 3.24Å; S717-V749 WeakPolarHBondContact CA-O 3.44Å; S717-V749 PolarHBondContact OG-O 3.15Å
718	E	70.4	Confident	86.8	Confident	138 Å²	138	25 Å²	25	65%	0.645	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	135.1	176	-70.9	-179.8	-174.6	0	0	110.4	K751	E718-K751 IonicContact OE1-NZ 3.1Å; E718-K751 PolarHBondContact OE1-NZ 3.3Å
719	P	60.8	Low	87.2	Confident	129 Å²	129	24 Å²	24	84%	0.838	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	cis	-91.9	0.8	6.3	36.4	-35.4	0	0	0	114.9	G721	P719-G721 PolarHBondContact O-N 2.98Å
720	S	64.9	Low	87.1	Confident	65 Å²	65	24.6 Å²	24.6	46%	0.455	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.1	-166.6	-52.5	0	0	0	0	115.6	S717 R744	S717-S720 CarbonylContact O-C 3.56Å; S717-S720 PolarHBondContact O-N 3.28Å; S720-R744 PolarHBondContact OG-NH1 3.37Å; S720-R744 PolarHBondContact OG-NH2 2.99Å
721	G	82	Confident	86.9	Confident	29 Å²	29	28.5 Å²	28.5	30%	0.299	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78	-135.9	-178.5	0	0	0	0	0	112.4	Q716 S717 P719	Q716-G721 CarbonylContact C-O 3.55Å; Q716-G721 WeakPolarHBondContact CA-O 3.23Å; Q716-G721 WeakPolarHBondContact CB-O 3.36Å; S717-G721 PolarHBondContact N-O 3.37Å; S717-G721 PolarHBondContact O-N 2.63Å; P719-G721 PolarHBondContact O-N 2.98Å
722	H	85.6	Confident	86.7	Confident	27 Å²	27	32 Å²	32	13%	0.125	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.4	178.5	178.6	91.9	0	0	0	111.6	S714 C724 L759 W827 M834 G879	S714-H722 PolarHBondContact OG-ND1 3.29Å; H722-C724 VanDerWaalsContact CE1-C 3.45Å; H722-C724 PolarHBondContact CE1-O 3.16Å; H722-L759 HydrophobicContact CB-CD1 3.97Å; H722-L759 HydrophobicContact CB-CD2 4.23Å; H722-W827 AromaticContact CE1-CE3 3.55Å; H722-M834 HydrophobicContact CB-CE 4.18Å; H722-M834 WeakPolarHBondContact CD2-CE 3.25Å; H722-G879 PolarHBondContact NE2-O 3.43Å; H722-G879 VanDerWaalsContact NE2-O 3.07Å
723	I	86	Confident	86.6	Confident	49 Å²	49	32.6 Å²	32.6	25%	0.251	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-50.8	176.9	-62.3	-175.4	0	0	0	110.8	L715 S717 W750	L715-I723 PolarHBondContact O-N 2.87Å; S717-I723 VanDerWaalsContact CB-CD1 3.49Å; I723-W750 HydrophobicContact CB-CH2 4.31Å; I723-W750 HydrophobicContact CB-CZ3 4.12Å; I723-W750 HydrophobicContact CD1-CH2 3.65Å; I723-W750 HydrophobicContact CD1-CZ3 3.74Å; I723-W750 HydrophobicContact CG1-CZ3 4.32Å; I723-W750 HydrophobicContact CG2-CH2 4.21Å; I723-W750 HydrophobicContact CG2-CZ3 4.49Å
724	C	90.5	Very high	86.7	Confident	6 Å²	6	32.6 Å²	32.6	4%	0.041	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	159.2	-176.5	-78.6	0	0	0	0	111.8	L715 H722 C740 S881	L715-C724 HydrophobicContact CB-CB 4.34Å; L715-C724 WeakPolarHBondContact CB-O 3.45Å; L715-C724 HydrophobicContact CD2-CB 4.28Å; L715-C724 PolarHBondContact N-O 2.62Å; L715-C724 PolarHBondContact O-N 3.46Å; H722-C724 VanDerWaalsContact CE1-C 3.45Å; H722-C724 PolarHBondContact CE1-O 3.16Å; C724-C740 HydrophobicContact CB-CB 3.82Å; C724-C740 WeakPolarHBondContact CB-SG 3.45Å; C724-C740 WeakPolarHBondContact SG-CB 3.15Å; C724-C740 CovalentContact SG-SG 2.03Å; C724-C740 PolarHBondContact SG-SG 3.27Å; C724-S881 CarbonylContact C-O 3.49Å; C724-S881 VanDerWaalsContact CB-O 3.3Å; C724-S881 WeakPolarHBondContact CB-O 3.49Å
725	G	91.6	Very high	86.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	160.9	161	0	0	0	0	0	112.1	T736 S881 G882	G725-T736 PolarHBondContact O-OG1 3.4Å; G725-S881 WeakPolarHBondContact CA-O 3.08Å; G725-S881 PolarHBondContact N-O 2.87Å; G725-G882 CarbonylContact C-O 3.53Å; G725-G882 CarbonylContact O-C 3.57Å; G725-G882 WeakPolarHBondContact O-CA 3Å
726	C	94	Very high	86.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	168.8	169.3	61	0	0	0	0	110.7	Q712 C713 V734 L735 G882	Q712-C726 PolarHBondContact NE2-O 3.43Å; C713-C726 HydrophobicContact CB-CB 4.49Å; C713-C726 WeakPolarHBondContact CB-SG 3.34Å; C713-C726 PolarHBondContact N-O 3.48Å; C713-C726 PolarHBondContact O-N 2.97Å; C713-C726 PolarHBondContact O-SG 3.4Å; C713-C726 VanDerWaalsContact SG-CA 3.58Å; C713-C726 WeakPolarHBondContact SG-CB 3.04Å; C713-C726 PolarHBondContact SG-O 2.88Å; C713-C726 CovalentContact SG-SG 2.03Å; C713-C726 PolarHBondContact SG-SG 3.47Å; C726-V734 HydrophobicContact CB-CG1 3.49Å; C726-V734 VanDerWaalsContact CB-CG1 3.49Å; C726-L735 CarbonylContact C-O 3.18Å; C726-L735 WeakPolarHBondContact CA-O 3.39Å; C726-G882 WeakPolarHBondContact CA-O 3.42Å
727	V	95.5	Very high	87.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	122.6	-173.8	-166.8	0	0	0	0	111.5	W711 C713 I729 V734 L735 V807 P884 L896 L899	W711-V727 HydrophobicContact CB-CG1 4.33Å; W711-V727 WeakPolarHBondContact O-CA 3.29Å; C713-V727 PolarHBondContact SG-N 3.1Å; V727-I729 PolarHBondContact O-N 3.45Å; V727-V734 CarbonylContact O-C 3.52Å; V727-V734 WeakPolarHBondContact O-CA 3.07Å; V727-L735 PolarHBondContact N-O 3.02Å; V727-L735 PolarHBondContact O-N 3.4Å; V727-V807 HydrophobicContact CG1-CB 4.36Å; V727-V807 HydrophobicContact CG1-CG1 3.53Å; V727-P884 HydrophobicContact CG1-CB 4.12Å; V727-P884 HydrophobicContact CG2-CB 3.53Å; V727-P884 HydrophobicContact CG2-CG 4.02Å; V727-L896 HydrophobicContact CB-CD2 4.39Å; V727-L896 HydrophobicContact CG1-CD1 4.26Å; V727-L896 HydrophobicContact CG1-CD2 4.07Å; V727-L896 HydrophobicContact CG2-CD1 4.35Å; V727-L899 HydrophobicContact CB-CD2 4.43Å; V727-L899 HydrophobicContact CG2-CD2 3.6Å
728	L	94.3	Very high	87.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.6	175.4	-173.6	69.8	0	0	0	111.1	W711 A730 V734 L754 I798 V804 P806 V807	W711-L728 HydrophobicContact CB-CB 4.44Å; W711-L728 PolarHBondContact O-N 3.17Å; L728-A730 WeakPolarHBondContact CD1-O 3.45Å; L728-V734 HydrophobicContact CD1-CG2 3.87Å; L728-L754 HydrophobicContact CB-CD2 4Å; L728-L754 HydrophobicContact CD1-CD2 3.82Å; L728-L754 HydrophobicContact CD2-CD2 3.83Å; L728-L754 HydrophobicContact CG-CD2 4.1Å; L728-I798 HydrophobicContact CD1-CG1 4.33Å; L728-I798 HydrophobicContact CD2-CD1 3.93Å; L728-I798 HydrophobicContact CD2-CG1 4.15Å; L728-V804 HydrophobicContact CD2-CG1 3.87Å; L728-P806 HydrophobicContact CG-CB 4.38Å; L728-P806 CarbonylContact O-C 3.58Å; L728-P806 VanDerWaalsContact O-CA 3.28Å; L728-P806 WeakPolarHBondContact O-CA 3.47Å; L728-V807 PolarHBondContact O-N 2.87Å
729	I	91.9	Very high	88.2	Confident	17 Å²	17	26.8 Å²	26.8	9%	0.087	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-25.8	178.9	56.1	159.1	0	0	0	113.6	V727 W733 L735 P806 V807 L809 L896 I926 I930	V727-I729 PolarHBondContact O-N 3.45Å; I729-W733 HydrophobicContact CD1-CB 4.1Å; I729-W733 HydrophobicContact CG1-CB 3.88Å; I729-W733 WeakPolarHBondContact CG1-O 3.1Å; I729-W733 PolarHBondContact N-O 3.19Å; I729-L735 HydrophobicContact CD1-CD1 4.11Å; I729-L735 HydrophobicContact CD1-CD2 3.8Å; I729-L735 HydrophobicContact CD1-CG 3.66Å; I729-L735 HydrophobicContact CG1-CG 4.05Å; I729-L735 HydrophobicContact CG2-CB 4.44Å; I729-L735 HydrophobicContact CG2-CD1 3.61Å; I729-L735 HydrophobicContact CG2-CG 3.72Å; I729-P806 WeakPolarHBondContact O-CB 3.31Å; I729-V807 HydrophobicContact CG2-CG1 4.11Å; I729-L809 HydrophobicContact CD1-CD1 4.5Å; I729-L809 HydrophobicContact CG2-CD2 3.98Å; I729-L809 HydrophobicContact CG2-CG 4.46Å; I729-L896 HydrophobicContact CG2-CD2 4.47Å; I729-I926 HydrophobicContact CD1-CG2 3.85Å; I729-I930 HydrophobicContact CD1-CD1 3.77Å
730	A	88.1	Confident	89.5	Confident	21 Å²	21	21 Å²	21	17%	0.174	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	175.4	171.5	0	0	0	0	0	110.1	L728 K732 W733	L728-A730 WeakPolarHBondContact CD1-O 3.45Å; A730-K732 VanDerWaalsContact C-N 3.25Å; A730-K732 PolarHBondContact O-N 3.32Å; A730-K732 VanDerWaalsContact O-N 3.11Å; A730-W733 HydrophobicContact CB-CB 4.1Å; A730-W733 HydrophobicContact CB-CG 4.49Å; A730-W733 PolarHBondContact N-O 2.03Å; A730-W733 PolarHBondContact O-N 2.8Å; A730-W733 VanDerWaalsContact O-N 3.09Å
731	K	87.4	Confident	90.5	Very high	82 Å²	82	18 Å²	18	36%	0.357	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.3	-171.1	-66.6	-177.6	179.3	179.1	0	115.7	I798 E800	K731-I798 HydrophobicContact CB-CG1 4.19Å; K731-I798 HydrophobicContact CG-CD1 4.44Å; K731-I798 HydrophobicContact CG-CG1 4.5Å; K731-I798 WeakPolarHBondContact O-CG1 3.36Å; K731-I798 PolarHBondContact O-N 3.28Å; K731-E800 WeakPolarHBondContact CE-OE1 3.46Å
732	K	89.3	Confident	90.2	Very high	74 Å²	74	20.5 Å²	20.5	32%	0.322	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	0.4	175	-58.8	-160	175.4	-176.3	0	114.3	A730 L794 D797	A730-K732 VanDerWaalsContact C-N 3.25Å; A730-K732 PolarHBondContact O-N 3.32Å; A730-K732 VanDerWaalsContact O-N 3.11Å; K732-L794 WeakPolarHBondContact O-CB 3.07Å; K732-L794 WeakPolarHBondContact O-CG 3.24Å; K732-L794 PolarHBondContact O-N 3.45Å; K732-D797 WeakPolarHBondContact CE-OD1 3.07Å; K732-D797 WeakPolarHBondContact CE-OD2 3.05Å; K732-D797 WeakPolarHBondContact CG-OD1 3.45Å; K732-D797 IonicContact NZ-OD2 3.99Å
733	W	92.5	Very high	89.3	Confident	16 Å²	16	22.8 Å²	22.8	6%	0.061	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.3	-164.2	-63.3	102.3	0	0	0	111.4	I729 A730 I775 I791 E793 I930 Q933	I729-W733 HydrophobicContact CD1-CB 4.1Å; I729-W733 HydrophobicContact CG1-CB 3.88Å; I729-W733 WeakPolarHBondContact CG1-O 3.1Å; I729-W733 PolarHBondContact N-O 3.19Å; A730-W733 HydrophobicContact CB-CB 4.1Å; A730-W733 HydrophobicContact CB-CG 4.49Å; A730-W733 PolarHBondContact N-O 2.03Å; A730-W733 PolarHBondContact O-N 2.8Å; A730-W733 VanDerWaalsContact O-N 3.09Å; W733-I775 HydrophobicContact CZ3-CD1 4.43Å; W733-I791 HydrophobicContact CE3-CG2 3.49Å; W733-I791 VanDerWaalsContact CE3-CG2 3.49Å; W733-I791 HydrophobicContact CZ3-CG2 3.7Å; W733-E793 HydrophobicContact CE3-CB 4.25Å; W733-E793 HydrophobicContact CH2-CB 3.92Å; W733-E793 HydrophobicContact CH2-CG 3.8Å; W733-E793 HydrophobicContact CZ2-CG 4.17Å; W733-E793 HydrophobicContact CZ3-CB 3.68Å; W733-E793 HydrophobicContact CZ3-CG 4.03Å; W733-I930 HydrophobicContact CB-CD1 4.32Å; W733-I930 HydrophobicContact CD2-CB 4.45Å; W733-I930 HydrophobicContact CD2-CD1 4.36Å; W733-I930 HydrophobicContact CD2-CG1 3.72Å; W733-I930 HydrophobicContact CD2-CG2 4.32Å; W733-I930 HydrophobicContact CE3-CG1 3.93Å; W733-I930 HydrophobicContact CG-CD1 4.15Å; W733-I930 HydrophobicContact CG-CG1 4.02Å; W733-I930 HydrophobicContact CG-CG2 4.46Å; W733-I930 HydrophobicContact CZ2-CB 4.43Å; W733-I930 HydrophobicContact CZ2-CG1 4.47Å; W733-I930 HydrophobicContact CZ2-CG2 4.21Å; W733-I930 HydrophobicContact CZ3-CG1 4.39Å; W733-Q933 HydrophobicContact CH2-CB 3.48Å; W733-Q933 VanDerWaalsContact CH2-CB 3.48Å; W733-Q933 HydrophobicContact CH2-CG 4.08Å; W733-Q933 HydrophobicContact CZ2-CB 4.06Å
734	V	94.9	Very high	88.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140.6	-179.1	172.5	0	0	0	0	108.9	C713 C726 V727 L728 V752 V792 L794	C713-V734 VanDerWaalsContact SG-CG1 3.52Å; C726-V734 HydrophobicContact CB-CG1 3.49Å; C726-V734 VanDerWaalsContact CB-CG1 3.49Å; V727-V734 CarbonylContact O-C 3.52Å; V727-V734 WeakPolarHBondContact O-CA 3.07Å; L728-V734 HydrophobicContact CD1-CG2 3.87Å; V734-V752 HydrophobicContact CG2-CG1 4.35Å; V734-V792 HydrophobicContact CB-CB 4.28Å; V734-V792 PolarHBondContact N-O 3.31Å; V734-V792 PolarHBondContact O-N 3.08Å; V734-L794 HydrophobicContact CG2-CD1 4.02Å; V734-L794 HydrophobicContact CG2-CD2 4.17Å; V734-L794 HydrophobicContact CG2-CG 4.22Å
735	L	95.4	Very high	87.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	144.7	171.6	-64.9	-177.1	0	0	0	110.7	C726 V727 I729 I791 L809 L896 L899 I926	C726-L735 CarbonylContact C-O 3.18Å; C726-L735 WeakPolarHBondContact CA-O 3.39Å; V727-L735 PolarHBondContact N-O 3.02Å; V727-L735 PolarHBondContact O-N 3.4Å; I729-L735 HydrophobicContact CD1-CD1 4.11Å; I729-L735 HydrophobicContact CD1-CD2 3.8Å; I729-L735 HydrophobicContact CD1-CG 3.66Å; I729-L735 HydrophobicContact CG1-CG 4.05Å; I729-L735 HydrophobicContact CG2-CB 4.44Å; I729-L735 HydrophobicContact CG2-CD1 3.61Å; I729-L735 HydrophobicContact CG2-CG 3.72Å; L735-I791 HydrophobicContact CD2-CB 4.44Å; L735-I791 HydrophobicContact CD2-CG1 3.67Å; L735-L809 HydrophobicContact CD1-CD2 4.02Å; L735-L896 HydrophobicContact CD1-CD2 3.94Å; L735-L899 HydrophobicContact CB-CD1 4.21Å; L735-L899 HydrophobicContact CB-CD2 4.48Å; L735-I926 HydrophobicContact CD1-CD1 3.81Å; L735-I926 HydrophobicContact CD2-CD1 4.27Å; L735-I926 HydrophobicContact CD2-CG1 4.15Å; L735-I926 HydrophobicContact CD2-CG2 4.19Å
736	T	94.7	Very high	87.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	-167.6	167.3	-171.9	0	0	0	0	108	L715 G725 F741 S790 V792 G882 L899	L715-T736 HydrophobicContact CD2-CG2 4.44Å; G725-T736 PolarHBondContact O-OG1 3.4Å; T736-F741 HydrophobicContact CG2-CD2 4.44Å; T736-F741 HydrophobicContact CG2-CE2 3.36Å; T736-F741 HydrophobicContact CG2-CZ 3.7Å; T736-S790 VanDerWaalsContact C-OG 3.28Å; T736-S790 WeakPolarHBondContact CG2-OG 3.34Å; T736-S790 PolarHBondContact N-O 3.07Å; T736-S790 VanDerWaalsContact N-O 3.1Å; T736-S790 PolarHBondContact O-N 3.01Å; T736-S790 VanDerWaalsContact O-O 3.12Å; T736-S790 PolarHBondContact O-OG 2.04Å; T736-V792 HydrophobicContact CG2-CG2 4.04Å; T736-G882 WeakPolarHBondContact OG1-CA 3.07Å; T736-L899 WeakPolarHBondContact O-CD1 3.04Å
737	V	93.5	Very high	86.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.			trans	-99.1	155.6	179.5	-68.7	0	0	0	0	110.8	H739 C740 D788 S790 L899 T900	V737-H739 WeakPolarHBondContact CG2-CE1 3.34Å; V737-H739 WeakPolarHBondContact CG2-ND1 3.42Å; V737-C740 HydrophobicContact CG2-CB 4.4Å; V737-C740 WeakPolarHBondContact CG2-SG 3.12Å; V737-D788 WeakPolarHBondContact CB-OD1 3.48Å; V737-D788 WeakPolarHBondContact CG1-O 3.39Å; V737-S790 PolarHBondContact O-OG 3.22Å; V737-L899 HydrophobicContact CG1-CB 3.79Å; V737-T900 VanDerWaalsContact CG1-O 3.32Å; V737-T900 WeakPolarHBondContact CG1-O 3.04Å
738	A	91.3	Very high	86.3	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.008	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-73	-36.9	-172.9	0	0	0	0	0	111.8	C740 F741 L776 Y780 D788	A738-C740 PolarHBondContact O-N 2.65Å; A738-C740 VanDerWaalsContact O-N 3.08Å; A738-F741 PolarHBondContact O-N 2.97Å; A738-F741 VanDerWaalsContact O-N 3.12Å; A738-L776 HydrophobicContact CB-CD2 4.18Å; A738-Y780 HydrophobicContact CB-CD1 3.64Å; A738-Y780 HydrophobicContact CB-CD2 3.74Å; A738-Y780 HydrophobicContact CB-CE1 3.98Å; A738-Y780 HydrophobicContact CB-CE2 4.07Å; A738-Y780 HydrophobicContact CB-CG 3.53Å; A738-D788 WeakPolarHBondContact CA-OD1 3.24Å; A738-D788 PolarHBondContact N-OD1 2.91Å
739	H	87.8	Confident	86	Confident	46 Å²	46	44.1 Å²	44.1	21%	0.213	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-61.1	-20.6	-179.5	76.9	-105.1	0	0	0	114.1	V737 F741 E742 Y780 D788 S881 S901	V737-H739 WeakPolarHBondContact CG2-CE1 3.34Å; V737-H739 WeakPolarHBondContact CG2-ND1 3.42Å; H739-F741 PolarHBondContact O-N 2.92Å; H739-E742 WeakPolarHBondContact O-CB 3.24Å; H739-E742 PolarHBondContact O-N 2.72Å; H739-Y780 WeakPolarHBondContact CB-OH 2.83Å; H739-D788 IonicContact CE1-OD2 3.43Å; H739-D788 PolarHBondContact CE1-OD2 3.14Å; H739-D788 IonicContact CG-OD1 3.4Å; H739-D788 IonicContact CG-OD2 3.95Å; H739-D788 PolarHBondContact N-OD1 3.02Å; H739-D788 IonicContact ND1-OD1 2.77Å; H739-D788 PolarHBondContact ND1-OD1 3.06Å; H739-D788 IonicContact ND1-OD2 3.31Å; H739-D788 PolarHBondContact ND1-OD2 3.45Å; H739-S881 WeakPolarHBondContact NE2-CB 3.41Å; H739-S881 PolarHBondContact NE2-OG 2.94Å; H739-S901 PolarHBondContact CE1-O 3.3Å
740	C	88.5	Confident	85.9	Confident	9 Å²	9	43.4 Å²	43.4	6%	0.061	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-65.7	-22.1	177.1	-72.8	0	0	0	0	113.8	L715 C724 V737 A738 W750	L715-C740 HydrophobicContact CD2-CB 4.36Å; C724-C740 HydrophobicContact CB-CB 3.82Å; C724-C740 WeakPolarHBondContact CB-SG 3.45Å; C724-C740 WeakPolarHBondContact SG-CB 3.15Å; C724-C740 CovalentContact SG-SG 2.03Å; C724-C740 PolarHBondContact SG-SG 3.27Å; V737-C740 HydrophobicContact CG2-CB 4.4Å; V737-C740 WeakPolarHBondContact CG2-SG 3.12Å; A738-C740 PolarHBondContact O-N 2.65Å; A738-C740 VanDerWaalsContact O-N 3.08Å; C740-W750 WeakPolarHBondContact O-CH2 3.2Å
741	F	86.5	Confident	86.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-99.8	-1.6	-178.7	-63	-67.8	0	0	0	113.3	L715 T736 A738 H739 G743 R744 W750 I774 L776 S790 V792	L715-F741 HydrophobicContact CD1-CE1 4.3Å; L715-F741 HydrophobicContact CD1-CZ 4.32Å; L715-F741 HydrophobicContact CD2-CD1 4.49Å; L715-F741 HydrophobicContact CD2-CE1 3.62Å; L715-F741 HydrophobicContact CD2-CE2 4.46Å; L715-F741 HydrophobicContact CD2-CZ 3.59Å; T736-F741 HydrophobicContact CG2-CD2 4.44Å; T736-F741 HydrophobicContact CG2-CE2 3.36Å; T736-F741 HydrophobicContact CG2-CZ 3.7Å; A738-F741 PolarHBondContact O-N 2.97Å; A738-F741 VanDerWaalsContact O-N 3.12Å; H739-F741 PolarHBondContact O-N 2.92Å; F741-G743 PolarHBondContact O-N 2.89Å; F741-R744 CarbonylContact O-C 3.56Å; F741-R744 VanDerWaalsContact O-C 3.29Å; F741-R744 PolarHBondContact O-N 2.81Å; F741-W750 HydrophobicContact CD1-CD2 4.27Å; F741-W750 AromaticContact CD1-CE2 3.67Å; F741-W750 HydrophobicContact CD1-CH2 4.43Å; F741-W750 AromaticContact CD1-CZ2 3.76Å; F741-W750 HydrophobicContact CD1-CZ2 3.76Å; F741-W750 AromaticContact CD1-NE1 3.77Å; F741-W750 HydrophobicContact CE1-CD2 4.04Å; F741-W750 AromaticContact CE1-CE2 3.92Å; F741-W750 HydrophobicContact CE1-CE3 4.49Å; F741-W750 HydrophobicContact CE1-CG 4.3Å; F741-W750 HydrophobicContact CE1-CZ2 4.24Å; F741-I774 HydrophobicContact CB-CG2 4.45Å; F741-I774 HydrophobicContact CD1-CD1 3.67Å; F741-I774 HydrophobicContact CD1-CG1 4.39Å; F741-I774 HydrophobicContact CD1-CG2 4.01Å; F741-I774 HydrophobicContact CD2-CG2 3.7Å; F741-I774 HydrophobicContact CE1-CD1 3.68Å; F741-I774 HydrophobicContact CE1-CG1 4.1Å; F741-I774 HydrophobicContact CE1-CG2 4.14Å; F741-I774 HydrophobicContact CE2-CG2 3.82Å; F741-I774 HydrophobicContact CG-CD1 4.46Å; F741-I774 HydrophobicContact CG-CG2 3.79Å; F741-I774 HydrophobicContact CZ-CD1 4.47Å; F741-I774 HydrophobicContact CZ-CG1 4.43Å; F741-I774 HydrophobicContact CZ-CG2 4.06Å; F741-L776 HydrophobicContact CB-CD2 4.02Å; F741-L776 HydrophobicContact CD2-CD2 3.68Å; F741-L776 HydrophobicContact CG-CD2 4.22Å; F741-S790 WeakPolarHBondContact CE2-OG 3.31Å; F741-V792 HydrophobicContact CE2-CG2 3.93Å; F741-V792 HydrophobicContact CZ-CG2 3.53Å
742	E	74.6	Confident	86.5	Confident	82 Å²	82	40.7 Å²	40.7	38%	0.383	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	126.1	-178.6	-168.4	173.5	-176.2	0	0	111	H739 R744 R782	H739-E742 WeakPolarHBondContact O-CB 3.24Å; H739-E742 PolarHBondContact O-N 2.72Å; E742-R744 VanDerWaalsContact C-N 3.27Å; E742-R744 PolarHBondContact O-N 3.32Å; E742-R782 WeakPolarHBondContact OE1-CD 3.22Å; E742-R782 IonicContact OE1-CZ 3.15Å; E742-R782 VanDerWaalsContact OE1-CZ 3.25Å; E742-R782 IonicContact OE1-NE 3.87Å; E742-R782 PolarHBondContact OE1-NE 3.28Å; E742-R782 IonicContact OE1-NH1 2.6Å; E742-R782 PolarHBondContact OE1-NH1 3.34Å; E742-R782 IonicContact OE2-CZ 2.76Å; E742-R782 IonicContact OE2-NE 3.14Å; E742-R782 IonicContact OE2-NH1 2.91Å
743	G	67.4	Low	86.6	Confident	76 Å²	76	37.3 Å²	37.3	78%	0.784	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	-1	-175.1	0	0	0	0	0	115.2	F741	F741-G743 PolarHBondContact O-N 2.89Å
744	R	70.6	Confident	86.6	Confident	100 Å²	100	36.6 Å²	36.6	38%	0.377	21%	0.211	S	C	.	.			trans	-146.2	62	177.9	-63.7	-173.4	-170.1	-152	4.4	111.8	S717 S720 F741 E742 N746 W750	S717-R744 PolarHBondContact OG-NH1 3.24Å; S720-R744 PolarHBondContact OG-NH1 3.37Å; S720-R744 PolarHBondContact OG-NH2 2.99Å; F741-R744 CarbonylContact O-C 3.56Å; F741-R744 VanDerWaalsContact O-C 3.29Å; F741-R744 PolarHBondContact O-N 2.81Å; E742-R744 VanDerWaalsContact C-N 3.27Å; E742-R744 PolarHBondContact O-N 3.32Å; R744-N746 VanDerWaalsContact C-N 3.31Å; R744-N746 PolarHBondContact O-N 3.17Å; R744-W750 HydrophobicContact CB-CZ2 3.75Å; R744-W750 PolarHBondContact O-NE1 2.05Å
745	E	73.3	Confident	86.2	Confident	142 Å²	142	37.1 Å²	37.1	66%	0.664	22%	0.217	S	C	*	.			trans	-77.5	-12.5	-173.9	-63.2	179.7	-175.5	0	0	114.6	A747	E745-A747 PolarHBondContact O-N 2.92Å
746	N	81.5	Confident	85.8	Confident	102 Å²	102	37.7 Å²	37.7	55%	0.545	22%	0.22	S	C	.	.			trans	-72.6	113	-176.9	-174	0.2	0	0	0	111.7	R744 A748 V749	R744-N746 VanDerWaalsContact C-N 3.31Å; R744-N746 PolarHBondContact O-N 3.17Å; N746-A748 PolarHBondContact O-N 3.22Å; N746-A748 VanDerWaalsContact O-N 3.09Å; N746-A748 PolarHBondContact OD1-N 2.99Å; N746-A748 VanDerWaalsContact OD1-N 3.15Å; N746-V749 WeakPolarHBondContact O-CG2 3.43Å; N746-V749 PolarHBondContact O-N 3.17Å
747	A	84.1	Confident	85	Confident	18 Å²	18	38.5 Å²	38.5	15%	0.149	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-53	-33	178	0	0	0	0	0	113.9	E745 V749 W750 V771 I774	E745-A747 PolarHBondContact O-N 2.92Å; A747-V749 PolarHBondContact O-N 3.42Å; A747-V749 VanDerWaalsContact O-N 3.16Å; A747-W750 PolarHBondContact O-N 3.39Å; A747-W750 VanDerWaalsContact O-N 3.11Å; A747-V771 HydrophobicContact CB-CG1 4.02Å; A747-I774 HydrophobicContact CB-CD1 4.19Å; A747-I774 HydrophobicContact CB-CG1 4.27Å
748	A	85	Confident	84.3	Confident	78 Å²	78	39.9 Å²	39.9	65%	0.645	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-64.9	-20.6	-175.9	0	0	0	0	0	114.4	N746 W750	N746-A748 PolarHBondContact O-N 3.22Å; N746-A748 VanDerWaalsContact O-N 3.09Å; N746-A748 PolarHBondContact OD1-N 2.99Å; N746-A748 VanDerWaalsContact OD1-N 3.15Å; A748-W750 VanDerWaalsContact C-N 3.34Å
749	V	87.4	Confident	83.6	Confident	63 Å²	63	41.6 Å²	41.6	38%	0.382	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-88.6	-4	179.1	-56.8	0	0	0	0	113.3	S717 N746 A747	S717-V749 WeakPolarHBondContact CA-O 3.44Å; S717-V749 PolarHBondContact OG-O 3.15Å; N746-V749 WeakPolarHBondContact O-CG2 3.43Å; N746-V749 PolarHBondContact O-N 3.17Å; A747-V749 PolarHBondContact O-N 3.42Å; A747-V749 VanDerWaalsContact O-N 3.16Å
750	W	90.6	Very high	82.7	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	137.6	-173.3	-66.8	102	0	0	0	112.2	L715 I723 C740 F741 R744 A747 A748 V771 I774	L715-W750 HydrophobicContact CD1-CE3 3.89Å; L715-W750 HydrophobicContact CD1-CZ3 4.44Å; L715-W750 HydrophobicContact CD2-CE3 3.93Å; L715-W750 HydrophobicContact CD2-CH2 4.23Å; L715-W750 HydrophobicContact CD2-CZ3 3.68Å; L715-W750 HydrophobicContact CG-CE3 3.56Å; L715-W750 HydrophobicContact CG-CZ3 3.61Å; I723-W750 HydrophobicContact CB-CH2 4.31Å; I723-W750 HydrophobicContact CB-CZ3 4.12Å; I723-W750 HydrophobicContact CD1-CH2 3.65Å; I723-W750 HydrophobicContact CD1-CZ3 3.74Å; I723-W750 HydrophobicContact CG1-CZ3 4.32Å; I723-W750 HydrophobicContact CG2-CH2 4.21Å; I723-W750 HydrophobicContact CG2-CZ3 4.49Å; C740-W750 WeakPolarHBondContact O-CH2 3.2Å; F741-W750 HydrophobicContact CD1-CD2 4.27Å; F741-W750 AromaticContact CD1-CE2 3.67Å; F741-W750 HydrophobicContact CD1-CH2 4.43Å; F741-W750 AromaticContact CD1-CZ2 3.76Å; F741-W750 HydrophobicContact CD1-CZ2 3.76Å; F741-W750 AromaticContact CD1-NE1 3.77Å; F741-W750 HydrophobicContact CE1-CD2 4.04Å; F741-W750 AromaticContact CE1-CE2 3.92Å; F741-W750 HydrophobicContact CE1-CE3 4.49Å; F741-W750 HydrophobicContact CE1-CG 4.3Å; F741-W750 HydrophobicContact CE1-CZ2 4.24Å; R744-W750 HydrophobicContact CB-CZ2 3.75Å; R744-W750 PolarHBondContact O-NE1 2.05Å; A747-W750 PolarHBondContact O-N 3.39Å; A747-W750 VanDerWaalsContact O-N 3.11Å; A748-W750 VanDerWaalsContact C-N 3.34Å; W750-V771 HydrophobicContact CB-CB 4.02Å; W750-V771 HydrophobicContact CB-CG2 3.65Å; W750-V771 PolarHBondContact O-N 3.12Å; W750-I774 HydrophobicContact CG-CD1 4.3Å
751	K	92.6	Very high	81.6	Confident	46 Å²	46	49.5 Å²	49.5	20%	0.2	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142	169.2	67.2	-170.7	177.7	-171.4	0	110	Q716 E718 T768 R769 F770	Q716-K751 HydrophobicContact CB-CG 3.85Å; Q716-K751 PolarHBondContact N-O 3.47Å; Q716-K751 PolarHBondContact O-N 3.04Å; Q716-K751 VanDerWaalsContact OE1-CE 3.3Å; E718-K751 IonicContact OE1-NZ 3.1Å; E718-K751 PolarHBondContact OE1-NZ 3.3Å; K751-T768 HydrophobicContact CB-CG2 4.2Å; K751-T768 HydrophobicContact CD-CG2 4.29Å; K751-T768 HydrophobicContact CG-CG2 4.5Å; K751-R769 WeakPolarHBondContact CA-O 3.41Å; K751-F770 HydrophobicContact CB-CD1 4.47Å
752	V	94.4	Very high	80.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.1	175.3	179.1	0	0	0	0	108.6	C713 L715 V734 L754 T768 R769 V771 L794	C713-V752 HydrophobicContact CB-CG1 3.83Å; L715-V752 HydrophobicContact CD1-CG2 3.84Å; V734-V752 HydrophobicContact CG2-CG1 4.35Å; V752-L754 HydrophobicContact CG1-CD1 3.91Å; V752-L754 HydrophobicContact CG1-CG 4.16Å; V752-T768 WeakPolarHBondContact O-CA 3.45Å; V752-R769 PolarHBondContact N-O 2.61Å; V752-R769 PolarHBondContact O-N 3Å; V752-V771 HydrophobicContact CG2-CG2 3.93Å; V752-L794 HydrophobicContact CB-CD2 3.86Å; V752-L794 HydrophobicContact CG1-CD2 4.4Å; V752-L794 HydrophobicContact CG2-CD2 3.78Å
753	V	92.6	Very high	80.3	Confident	3 Å²	3	52 Å²	52	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.3	179.3	-174.2	0	0	0	0	109.4	C713 S714 Q716 I756 M766 T768	C713-V753 WeakPolarHBondContact CA-O 3.09Å; C713-V753 WeakPolarHBondContact CB-O 3.49Å; S714-V753 PolarHBondContact N-O 2.77Å; S714-V753 PolarHBondContact O-N 3.26Å; Q716-V753 HydrophobicContact CG-CG2 4.21Å; V753-I756 HydrophobicContact CG1-CB 4.06Å; V753-I756 HydrophobicContact CG1-CD1 4.04Å; V753-I756 HydrophobicContact CG1-CG2 4Å; V753-M766 HydrophobicContact CG1-CG 3.46Å; V753-M766 VanDerWaalsContact CG1-CG 3.46Å; V753-M766 HydrophobicContact CG1-SD 3.5Å; V753-M766 VanDerWaalsContact CG1-SD 3.5Å; V753-T768 HydrophobicContact CG2-CG2 4.18Å
754	L	92.4	Very high	80.7	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	156.1	-177.7	-55	103.8	0	0	0	111.1	C713 L728 V752 I756 M766 Q767 I798 V804	C713-L754 HydrophobicContact CB-CD2 4.04Å; C713-L754 HydrophobicContact CB-CG 3.84Å; L728-L754 HydrophobicContact CB-CD2 4Å; L728-L754 HydrophobicContact CD1-CD2 3.82Å; L728-L754 HydrophobicContact CD2-CD2 3.83Å; L728-L754 HydrophobicContact CG-CD2 4.1Å; V752-L754 HydrophobicContact CG1-CD1 3.91Å; V752-L754 HydrophobicContact CG1-CG 4.16Å; L754-I756 PolarHBondContact O-N 2.05Å; L754-M766 CarbonylContact O-C 3.48Å; L754-M766 VanDerWaalsContact O-CA 3.31Å; L754-M766 WeakPolarHBondContact O-CA 3.18Å; L754-Q767 PolarHBondContact N-O 3.15Å; L754-Q767 PolarHBondContact O-N 3.42Å; L754-I798 HydrophobicContact CD1-CG2 4.01Å; L754-I798 HydrophobicContact CD2-CG2 4.5Å; L754-V804 HydrophobicContact CB-CG1 3.91Å; L754-V804 HydrophobicContact CB-CG2 4.05Å; L754-V804 HydrophobicContact CD2-CG1 3.96Å
755	G	86.7	Confident	81.1	Confident	12 Å²	12	55 Å²	55	12%	0.124	31%	0.309	C	S	.	.	S	Bend	trans	70.2	15.2	178.1	0	0	0	0	0	113.9
756	I	85.4	Confident	81.8	Confident	12 Å²	12	51.3 Å²	51.3	6%	0.062	29%	0.293	C	S	.	.			trans	-91.4	135.7	177.3	-171	164.9	0	0	0	110.1	V753 L754 N758 L759 M766 W827	V753-I756 HydrophobicContact CG1-CB 4.06Å; V753-I756 HydrophobicContact CG1-CD1 4.04Å; V753-I756 HydrophobicContact CG1-CG2 4Å; L754-I756 PolarHBondContact O-N 2.05Å; I756-N758 WeakPolarHBondContact CD1-O 3.47Å; I756-N758 WeakPolarHBondContact CG1-O 3.09Å; I756-L759 HydrophobicContact CD1-CD2 4.17Å; I756-M766 HydrophobicContact CB-CG 4.5Å; I756-M766 HydrophobicContact CD1-SD 4.19Å; I756-W827 HydrophobicContact CG2-CH2 3.89Å; I756-W827 HydrophobicContact CG2-CZ2 3.87Å; I756-W827 WeakPolarHBondContact O-CZ2 2.99Å
757	N	78.8	Confident	82.3	Confident	16 Å²	16	47.2 Å²	47.2	9%	0.086	27%	0.27	C	S	.	.	S	Bend	trans	-115.5	-26.9	172.7	-166.9	87.6	0	0	0	112.2	S704 R705 P706 K837 L838	S704-N757 PolarHBondContact O-ND2 2.78Å; S704-N757 PolarHBondContact O-OD1 2.79Å; R705-N757 PolarHBondContact O-OD1 3.2Å; P706-N757 HydrophobicContact CB-CB 4.13Å; P706-N757 HydrophobicContact CG-CB 4Å; N757-K837 CarbonylContact O-C 3.57Å; N757-K837 WeakPolarHBondContact O-CA 3.15Å; N757-L838 PolarHBondContact O-N 3.29Å
758	N	78.6	Confident	82.6	Confident	30 Å²	30	48.9 Å²	48.9	16%	0.16	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-124.5	126	177.5	-169.4	-10.4	0	0	0	109	I756 D760 H761 F836 K837	I756-N758 WeakPolarHBondContact CD1-O 3.47Å; I756-N758 WeakPolarHBondContact CG1-O 3.09Å; N758-D760 PolarHBondContact OD1-N 3.43Å; N758-H761 HydrophobicContact CB-CB 4.47Å; N758-H761 VanDerWaalsContact O-O 3.11Å; N758-F836 CarbonylContact C-O 3.59Å; N758-F836 VanDerWaalsContact CA-O 3.25Å; N758-F836 WeakPolarHBondContact CA-O 3.23Å; N758-F836 VanDerWaalsContact OD1-CB 3.24Å; N758-F836 WeakPolarHBondContact OD1-CB 3.44Å; N758-F836 PolarHBondContact OD1-O 3.43Å; N758-K837 HydrophobicContact CB-CG 4.45Å
759	L	76	Confident	83.1	Confident	37 Å²	37	47.3 Å²	47.3	19%	0.194	26%	0.256	C	S	.	.	S	Bend	trans	-69.7	-31.5	-178.1	-68.4	175.5	0	0	0	112.9	H722 I756 W827 M834 F836	H722-L759 HydrophobicContact CB-CD1 3.97Å; H722-L759 HydrophobicContact CB-CD2 4.23Å; I756-L759 HydrophobicContact CD1-CD2 4.17Å; L759-W827 HydrophobicContact CD1-CB 3.85Å; L759-W827 HydrophobicContact CD1-CD2 4.45Å; L759-W827 HydrophobicContact CD1-CG 3.77Å; L759-W827 HydrophobicContact CD2-CD2 4.36Å; L759-W827 HydrophobicContact CD2-CG 4.47Å; L759-W827 HydrophobicContact CG-CD2 4.45Å; L759-W827 HydrophobicContact CG-CG 4.1Å; L759-M834 HydrophobicContact CD1-CE 4.18Å; L759-F836 PolarHBondContact N-O 3.41Å
760	D	69.3	Low	83.3	Confident	91 Å²	91	50.8 Å²	50.8	49%	0.487	27%	0.266	S	S	.	.	S	Bend	trans	-84.9	-23.1	-178.4	-74.6	-10.8	0	0	0	113.8	N758 F836	N758-D760 PolarHBondContact OD1-N 3.43Å; D760-F836 HydrophobicContact CB-CD1 4.4Å; D760-F836 WeakPolarHBondContact OD1-CD1 3.14Å; D760-F836 VanDerWaalsContact OD1-CE1 3.29Å; D760-F836 WeakPolarHBondContact OD1-CE1 3.19Å; D760-F836 WeakPolarHBondContact OD2-CD1 3.44Å; D760-F836 WeakPolarHBondContact OD2-CD2 3.23Å; D760-F836 WeakPolarHBondContact OD2-CE1 3.25Å; D760-F836 WeakPolarHBondContact OD2-CG 3.49Å; D760-F836 WeakPolarHBondContact OD2-CZ 3.05Å
761	H	65.8	Low	83.5	Confident	129 Å²	129	51.1 Å²	51.1	60%	0.597	27%	0.269	S	S	*	.	S	Bend	trans	-120.8	106.6	-176.9	-69.4	-57.1	0	0	0	110.6	N758 S763	N758-H761 HydrophobicContact CB-CB 4.47Å; N758-H761 VanDerWaalsContact O-O 3.11Å; H761-S763 PolarHBondContact O-N 3.32Å
762	P	64.9	Low	83.4	Confident	100 Å²	100	53.5 Å²	53.5	65%	0.649	28%	0.279	S	S	*	.			trans	-61.5	122.9	179.3	23.3	-30.8	0	0	0	109.9	M766	P762-M766 HydrophobicContact CB-CE 3.95Å; P762-M766 HydrophobicContact CB-SD 4.05Å
763	S	69.4	Low	83.1	Confident	34 Å²	34	55.5 Å²	55.5	24%	0.238	29%	0.291	C	S	.	.			trans	-77	146.6	179.6	-61.6	0	0	0	0	110.6	H761 F765 M766	H761-S763 PolarHBondContact O-N 3.32Å; S763-F765 PolarHBondContact O-N 3.3Å; S763-M766 WeakPolarHBondContact O-CB 2.97Å; S763-M766 PolarHBondContact O-N 2.89Å
764	V	75.3	Confident	83.1	Confident	141 Å²	141	56.9 Å²	56.9	86%	0.855	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.9	178	-173.7	0	0	0	0	112.6
765	F	79	Confident	82.9	Confident	100 Å²	100	57.8 Å²	57.8	44%	0.439	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	6.3	179.9	-43.3	-70.7	0	0	0	113.5	S763 Y803	S763-F765 PolarHBondContact O-N 3.3Å; F765-Y803 HydrophobicContact CB-CD2 3.78Å; F765-Y803 HydrophobicContact CB-CE2 4.4Å; F765-Y803 HydrophobicContact CB-CG 3.89Å; F765-Y803 AromaticContact CD1-CD2 3.87Å; F765-Y803 HydrophobicContact CD1-CD2 3.87Å; F765-Y803 AromaticContact CD1-CE2 3.79Å; F765-Y803 HydrophobicContact CD1-CE2 3.79Å; F765-Y803 HydrophobicContact CD2-CD1 4.22Å; F765-Y803 AromaticContact CD2-CD2 3.95Å; F765-Y803 HydrophobicContact CD2-CD2 3.95Å; F765-Y803 HydrophobicContact CD2-CE1 4.05Å; F765-Y803 AromaticContact CD2-CE2 3.74Å; F765-Y803 HydrophobicContact CD2-CE2 3.74Å; F765-Y803 HydrophobicContact CD2-CG 4.2Å; F765-Y803 AromaticContact CD2-CZ 3.81Å; F765-Y803 HydrophobicContact CE1-CD2 4.47Å; F765-Y803 AromaticContact CE1-CE2 3.94Å; F765-Y803 HydrophobicContact CE1-CE2 3.94Å; F765-Y803 HydrophobicContact CE2-CE1 4.31Å; F765-Y803 AromaticContact CE2-CE2 3.9Å; F765-Y803 HydrophobicContact CE2-CE2 3.9Å; F765-Y803 AromaticContact CE2-CZ 3.77Å; F765-Y803 AromaticContact CG-CD2 3.56Å; F765-Y803 HydrophobicContact CG-CD2 3.56Å; F765-Y803 AromaticContact CG-CE2 3.69Å; F765-Y803 HydrophobicContact CG-CE2 3.69Å; F765-Y803 HydrophobicContact CG-CG 4.02Å; F765-Y803 AromaticContact CZ-CE2 3.99Å; F765-Y803 HydrophobicContact CZ-CE2 3.99Å
766	M	87.5	Confident	83.1	Confident	63 Å²	63	59.9 Å²	59.9	31%	0.31	31%	0.311	S	S	.	.			trans	-69.7	139.3	-178.2	-175.6	-177.1	80.6	0	0	111.2	V753 L754 I756 P762 S763	V753-M766 HydrophobicContact CG1-CG 3.46Å; V753-M766 VanDerWaalsContact CG1-CG 3.46Å; V753-M766 HydrophobicContact CG1-SD 3.5Å; V753-M766 VanDerWaalsContact CG1-SD 3.5Å; L754-M766 CarbonylContact O-C 3.48Å; L754-M766 VanDerWaalsContact O-CA 3.31Å; L754-M766 WeakPolarHBondContact O-CA 3.18Å; I756-M766 HydrophobicContact CB-CG 4.5Å; I756-M766 HydrophobicContact CD1-SD 4.19Å; P762-M766 HydrophobicContact CB-CE 3.95Å; P762-M766 HydrophobicContact CB-SD 4.05Å; S763-M766 WeakPolarHBondContact O-CB 2.97Å; S763-M766 PolarHBondContact O-N 2.89Å
767	Q	91.6	Very high	83.2	Confident	17 Å²	17	60.4 Å²	60.4	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.8	172.9	-66.6	178.9	62.5	0	0	109.6	L754 S799	L754-Q767 PolarHBondContact N-O 3.15Å; L754-Q767 PolarHBondContact O-N 3.42Å; Q767-S799 PolarHBondContact NE2-O 3.49Å; Q767-S799 PolarHBondContact NE2-OG 2.91Å; Q767-S799 VanDerWaalsContact NE2-OG 3.12Å; Q767-S799 PolarHBondContact OE1-O 2.7Å; Q767-S799 PolarHBondContact OE1-OG 3.12Å
768	T	91.8	Very high	83.3	Confident	52 Å²	52	65 Å²	65	32%	0.319	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.7	175.8	-55	0	0	0	0	109.6	K751 V752 V753	K751-T768 HydrophobicContact CB-CG2 4.2Å; K751-T768 HydrophobicContact CD-CG2 4.29Å; K751-T768 HydrophobicContact CG-CG2 4.5Å; V752-T768 WeakPolarHBondContact O-CA 3.45Å; V753-T768 HydrophobicContact CG2-CG2 4.18Å
769	R	93.9	Very high	83.4	Confident	45 Å²	45	67 Å²	67	17%	0.17	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.5	175.4	-65.7	-65.3	178.5	-94.1	6.2	109.8	K751 V752 L794 D797 I798	K751-R769 WeakPolarHBondContact CA-O 3.41Å; V752-R769 PolarHBondContact N-O 2.61Å; V752-R769 PolarHBondContact O-N 3Å; R769-L794 HydrophobicContact CB-CB 4.27Å; R769-L794 HydrophobicContact CB-CD1 4.2Å; R769-L794 HydrophobicContact CB-CD2 4.09Å; R769-L794 HydrophobicContact CB-CG 4.42Å; R769-L794 HydrophobicContact CG-CD1 4.28Å; R769-D797 PolarHBondContact NE-O 3.15Å; R769-D797 VanDerWaalsContact NE-O 3.11Å; R769-D797 PolarHBondContact NH2-O 2.76Å; R769-I798 HydrophobicContact CG-CG2 4.03Å
770	F	93.4	Very high	83.8	Confident	136 Å²	136	67.4 Å²	67.4	60%	0.596	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	154.7	172.2	-66.2	-76.8	0	0	0	110.1	K751 S795	K751-F770 HydrophobicContact CB-CD1 4.47Å; F770-S795 PolarHBondContact O-N 3.19Å; F770-S795 PolarHBondContact O-OG 2.91Å
771	V	93.6	Very high	84	Confident	10 Å²	10	65.6 Å²	65.6	6%	0.061	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	127.5	175.3	178.1	0	0	0	0	109.2	A747 W750 V752 I774 V792	A747-V771 HydrophobicContact CB-CG1 4.02Å; W750-V771 HydrophobicContact CB-CB 4.02Å; W750-V771 HydrophobicContact CB-CG2 3.65Å; W750-V771 PolarHBondContact O-N 3.12Å; V752-V771 HydrophobicContact CG2-CG2 3.93Å; V771-I774 HydrophobicContact CG1-CD1 4.24Å; V771-I774 HydrophobicContact CG1-CG1 3.6Å; V771-V792 HydrophobicContact CB-CG1 4.15Å; V771-V792 HydrophobicContact CG1-CG1 3.47Å; V771-V792 VanDerWaalsContact CG1-CG1 3.47Å; V771-V792 HydrophobicContact CG2-CG1 3.62Å
772	K	90.3	Very high	84.2	Confident	96 Å²	96	67.3 Å²	67.3	42%	0.417	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-50.8	174.5	-178.6	179.2	158	-154.3	0	110.4	E793 N938	K772-E793 HydrophobicContact CB-CG 4.48Å; K772-E793 WeakPolarHBondContact CD-OE1 3.46Å; K772-E793 WeakPolarHBondContact CD-OE2 3.35Å; K772-E793 PolarHBondContact N-O 3.05Å; K772-E793 IonicContact NZ-OE1 3.21Å; K772-E793 PolarHBondContact NZ-OE1 2.63Å; K772-E793 IonicContact NZ-OE2 3.92Å; K772-N938 PolarHBondContact NZ-OD1 3.05Å
773	T	89.8	Confident	84.3	Confident	41 Å²	41	66.7 Å²	66.7	25%	0.252	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.6	-174.3	-43.2	0	0	0	0	110.1	I775 E793	T773-I775 HydrophobicContact CG2-CG1 4.18Å; T773-E793 PolarHBondContact N-O 3.39Å; T773-E793 PolarHBondContact O-N 3.12Å; T773-E793 PolarHBondContact OG1-OE2 3.1Å
774	I	91.4	Very high	84.3	Confident	32 Å²	32	68.3 Å²	68.3	16%	0.164	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128	173.1	-60.6	166	0	0	0	107.7	F741 A747 W750 V771 L776	F741-I774 HydrophobicContact CB-CG2 4.45Å; F741-I774 HydrophobicContact CD1-CD1 3.67Å; F741-I774 HydrophobicContact CD1-CG1 4.39Å; F741-I774 HydrophobicContact CD1-CG2 4.01Å; F741-I774 HydrophobicContact CD2-CG2 3.7Å; F741-I774 HydrophobicContact CE1-CD1 3.68Å; F741-I774 HydrophobicContact CE1-CG1 4.1Å; F741-I774 HydrophobicContact CE1-CG2 4.14Å; F741-I774 HydrophobicContact CE2-CG2 3.82Å; F741-I774 HydrophobicContact CG-CD1 4.46Å; F741-I774 HydrophobicContact CG-CG2 3.79Å; F741-I774 HydrophobicContact CZ-CD1 4.47Å; F741-I774 HydrophobicContact CZ-CG1 4.43Å; F741-I774 HydrophobicContact CZ-CG2 4.06Å; A747-I774 HydrophobicContact CB-CD1 4.19Å; A747-I774 HydrophobicContact CB-CG1 4.27Å; W750-I774 HydrophobicContact CG-CD1 4.3Å; V771-I774 HydrophobicContact CG1-CD1 4.24Å; V771-I774 HydrophobicContact CG1-CG1 3.6Å; I774-L776 HydrophobicContact CG2-CD2 3.99Å; I774-L776 HydrophobicContact CG2-CG 4.44Å
775	I	89.4	Confident	84.4	Confident	19 Å²	19	62.6 Å²	62.6	10%	0.097	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	106.9	-177.2	-54.9	165.7	0	0	0	107.8	W733 T773 S790 I791 W925 Q929 Q933	W733-I775 HydrophobicContact CZ3-CD1 4.43Å; T773-I775 HydrophobicContact CG2-CG1 4.18Å; I775-S790 VanDerWaalsContact O-CA 3.3Å; I775-S790 WeakPolarHBondContact O-CA 3.26Å; I775-S790 WeakPolarHBondContact O-CB 3.45Å; I775-I791 HydrophobicContact CB-CB 4.32Å; I775-I791 PolarHBondContact N-O 3.26Å; I775-I791 PolarHBondContact O-N 3.37Å; I775-W925 HydrophobicContact CG2-CZ2 4.18Å; I775-Q929 HydrophobicContact CG2-CG 4.38Å; I775-Q933 HydrophobicContact CD1-CG 3.58Å
776	L	89.6	Confident	84.5	Confident	57 Å²	57	58.7 Å²	58.7	30%	0.298	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	147.6	174.7	-55.1	-178.4	0	0	0	109.8	A738 F741 I774	A738-L776 HydrophobicContact CB-CD2 4.18Å; F741-L776 HydrophobicContact CB-CD2 4.02Å; F741-L776 HydrophobicContact CD2-CD2 3.68Å; F741-L776 HydrophobicContact CG-CD2 4.22Å; I774-L776 HydrophobicContact CG2-CD2 3.99Å; I774-L776 HydrophobicContact CG2-CG 4.44Å
777	H	87.8	Confident	84.6	Confident	22 Å²	22	56.8 Å²	56.8	10%	0.102	29%	0.294	C	S	.	.			trans	-65.3	127.7	173.5	-167.1	-77.9	0	0	0	110.4	R779 Y780 Y787 I789 W925	H777-R779 PolarHBondContact ND1-N 3.07Å; H777-R779 PolarHBondContact O-N 3Å; H777-R779 VanDerWaalsContact O-N 3.13Å; H777-Y780 VanDerWaalsContact O-CB 3.24Å; H777-Y780 WeakPolarHBondContact O-CB 3.45Å; H777-Y780 PolarHBondContact O-N 3.4Å; H777-Y787 AromaticContact CE1-CD1 3.14Å; H777-Y787 WeakPolarHBondContact CE1-CD1 3.02Å; H777-Y787 AromaticContact CE1-CE1 3.66Å; H777-Y787 AromaticContact CE1-CG 3.9Å; H777-Y787 AromaticContact ND1-CD1 3.45Å; H777-Y787 WeakPolarHBondContact ND1-CD1 3.02Å; H777-Y787 AromaticContact ND1-CG 3.78Å; H777-Y787 AromaticContact NE2-CD1 3.61Å; H777-I789 HydrophobicContact CB-CG2 3.92Å; H777-I789 PolarHBondContact N-O 2.98Å; H777-W925 HydrophobicContact CB-CH2 4.3Å; H777-W925 HydrophobicContact CB-CZ2 4.17Å; H777-W925 AromaticContact CD2-CD2 3.73Å; H777-W925 AromaticContact CD2-CE2 3.59Å; H777-W925 AromaticContact CD2-CZ2 3.97Å; H777-W925 AromaticContact CD2-NE1 3.82Å
778	P	81.2	Confident	84.6	Confident	114 Å²	114	56 Å²	56	74%	0.74	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.2	-173.8	-26.4	33.9	0	0	0	115
779	R	80.9	Confident	84.7	Confident	71 Å²	71	53.5 Å²	53.5	27%	0.268	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	5.6	177.9	-59.3	-172.2	75.7	142.7	8.5	114.4	D534 F536 D538 H777 S781 Y787	D534-R779 VanDerWaalsContact CG-NH1 3.29Å; D534-R779 IonicContact OD1-NH1 3.15Å; D534-R779 IonicContact OD2-CZ 3.85Å; D534-R779 IonicContact OD2-NH1 2.97Å; D534-R779 PolarHBondContact OD2-NH1 3.4Å; D534-R779 IonicContact OD2-NH2 3.29Å; D534-R779 PolarHBondContact OD2-NH2 2.6Å; F536-R779 VanDerWaalsContact CD2-NH1 3.26Å; D538-R779 IonicContact OD1-NH2 3.7Å; D538-R779 IonicContact OD2-NH2 3.76Å; D538-R779 PolarHBondContact OD2-NH2 3.2Å; H777-R779 PolarHBondContact ND1-N 3.07Å; H777-R779 PolarHBondContact O-N 3Å; H777-R779 VanDerWaalsContact O-N 3.13Å; R779-S781 PolarHBondContact O-N 2.8Å; R779-Y787 HydrophobicContact CB-CD1 4.25Å; R779-Y787 HydrophobicContact CB-CD2 3.85Å; R779-Y787 HydrophobicContact CB-CE1 4.48Å; R779-Y787 HydrophobicContact CB-CE2 4.1Å; R779-Y787 HydrophobicContact CB-CG 3.94Å
780	Y	83.9	Confident	84.7	Confident	46 Å²	46	51.4 Å²	51.4	18%	0.18	27%	0.267	C	S	.	.			trans	-62	131.3	176.4	173.3	-111.1	0	0	0	110.4	A738 H739 H777 D786 D788	A738-Y780 HydrophobicContact CB-CD1 3.64Å; A738-Y780 HydrophobicContact CB-CD2 3.74Å; A738-Y780 HydrophobicContact CB-CE1 3.98Å; A738-Y780 HydrophobicContact CB-CE2 4.07Å; A738-Y780 HydrophobicContact CB-CG 3.53Å; H739-Y780 WeakPolarHBondContact CB-OH 2.83Å; H777-Y780 VanDerWaalsContact O-CB 3.24Å; H777-Y780 WeakPolarHBondContact O-CB 3.45Å; H777-Y780 PolarHBondContact O-N 3.4Å; Y780-D786 WeakPolarHBondContact CD2-O 3.31Å; Y780-D788 HydrophobicContact CD2-CB 4.11Å; Y780-D788 HydrophobicContact CE2-CB 3.91Å
781	S	73.1	Confident	84.7	Confident	52 Å²	52	44.9 Å²	44.9	36%	0.364	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-135.1	126.1	178.7	176.6	0	0	0	0	110.8	R779 A783 V784 V785	R779-S781 PolarHBondContact O-N 2.8Å; S781-A783 VanDerWaalsContact C-N 3.3Å; S781-A783 PolarHBondContact O-N 3.23Å; S781-V784 PolarHBondContact O-N 2.04Å; S781-V785 WeakPolarHBondContact O-CA 3.06Å; S781-V785 PolarHBondContact O-N 2.76Å
782	R	70.9	Confident	84.7	Confident	165 Å²	165	44.4 Å²	44.4	62%	0.623	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-35.6	-180	-166.9	-160.5	-173.7	145.4	-10.9	113.1	E742 V784 V785	E742-R782 WeakPolarHBondContact OE1-CD 3.22Å; E742-R782 IonicContact OE1-CZ 3.15Å; E742-R782 VanDerWaalsContact OE1-CZ 3.25Å; E742-R782 IonicContact OE1-NE 3.87Å; E742-R782 PolarHBondContact OE1-NE 3.28Å; E742-R782 IonicContact OE1-NH1 2.6Å; E742-R782 PolarHBondContact OE1-NH1 3.34Å; E742-R782 IonicContact OE2-CZ 2.76Å; E742-R782 IonicContact OE2-NE 3.14Å; E742-R782 IonicContact OE2-NH1 2.91Å; R782-V784 VanDerWaalsContact C-N 3.35Å; R782-V784 PolarHBondContact O-N 3.24Å; R782-V785 WeakPolarHBondContact O-CG2 3.33Å
783	A	66.3	Low	84.8	Confident	87 Å²	87	40.2 Å²	40.2	72%	0.719	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-38	-174.9	0	0	0	0	0	112.4	S781	S781-A783 VanDerWaalsContact C-N 3.3Å; S781-A783 PolarHBondContact O-N 3.23Å
784	V	69.1	Low	84.9	Confident	68 Å²	68	38.3 Å²	38.3	41%	0.412	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-22	-177.1	-166.1	0	0	0	0	111.4	S781 R782 D786	S781-V784 PolarHBondContact O-N 2.04Å; R782-V784 VanDerWaalsContact C-N 3.35Å; R782-V784 PolarHBondContact O-N 3.24Å; V784-D786 HydrophobicContact CB-CB 4.25Å; V784-D786 HydrophobicContact CG1-CB 3.97Å; V784-D786 PolarHBondContact O-N 3.05Å
785	V	77.6	Confident	84.9	Confident	22 Å²	22	39.1 Å²	39.1	13%	0.133	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	36.8	-171.2	-159.4	0	0	0	0	110.8	S781 R782 D788 M864 W902	S781-V785 WeakPolarHBondContact O-CA 3.06Å; S781-V785 PolarHBondContact O-N 2.76Å; R782-V785 WeakPolarHBondContact O-CG2 3.33Å; V785-D788 HydrophobicContact CG1-CB 4.21Å; V785-M864 WeakPolarHBondContact O-CE 3.48Å; V785-W902 VanDerWaalsContact CG1-CD1 3.5Å; V785-W902 HydrophobicContact CG1-CG 4.27Å
786	D	82.6	Confident	84.9	Confident	17 Å²	17	43.9 Å²	43.9	9%	0.091	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-97.8	154.5	173.6	-163.8	10.5	0	0	0	109.4	Y780 V784 D788 T861 R863 M864	Y780-D786 WeakPolarHBondContact CD2-O 3.31Å; V784-D786 HydrophobicContact CB-CB 4.25Å; V784-D786 HydrophobicContact CG1-CB 3.97Å; V784-D786 PolarHBondContact O-N 3.05Å; D786-D788 PolarHBondContact O-N 3.13Å; D786-T861 PolarHBondContact OD1-OG1 3.08Å; D786-R863 IonicContact OD1-CZ 2.72Å; D786-R863 IonicContact OD1-NE 3.82Å; D786-R863 PolarHBondContact OD1-NE 3.31Å; D786-R863 IonicContact OD1-NH2 2.89Å; D786-R863 IonicContact OD2-CZ 3.7Å; D786-R863 VanDerWaalsContact OD2-CZ 3.29Å; D786-R863 IonicContact OD2-NE 2.73Å; D786-R863 PolarHBondContact OD2-NE 2.99Å; D786-R863 VanDerWaalsContact OD2-NE 3.14Å; D786-R863 IonicContact OD2-NH2 3.65Å; D786-R863 PolarHBondContact OD2-NH2 2.89Å; D786-M864 HydrophobicContact CB-CE 3.98Å
787	Y	88.3	Confident	84.8	Confident	23 Å²	23	45.2 Å²	45.2	9%	0.09	24%	0.244	C	C	.	.	S	Bend	trans	56.8	34.4	-170.4	-64.1	-90.1	0	0	0	114	H777 R779 I789 R863 F922	H777-Y787 AromaticContact CE1-CD1 3.14Å; H777-Y787 WeakPolarHBondContact CE1-CD1 3.02Å; H777-Y787 AromaticContact CE1-CE1 3.66Å; H777-Y787 AromaticContact CE1-CG 3.9Å; H777-Y787 AromaticContact ND1-CD1 3.45Å; H777-Y787 WeakPolarHBondContact ND1-CD1 3.02Å; H777-Y787 AromaticContact ND1-CG 3.78Å; H777-Y787 AromaticContact NE2-CD1 3.61Å; R779-Y787 HydrophobicContact CB-CD1 4.25Å; R779-Y787 HydrophobicContact CB-CD2 3.85Å; R779-Y787 HydrophobicContact CB-CE1 4.48Å; R779-Y787 HydrophobicContact CB-CE2 4.1Å; R779-Y787 HydrophobicContact CB-CG 3.94Å; Y787-I789 VanDerWaalsContact C-N 3.27Å; Y787-I789 PolarHBondContact O-N 3.27Å; Y787-R863 VanDerWaalsContact CZ-CD 3.46Å; Y787-F922 AromaticContact CD1-CE1 3.59Å; Y787-F922 HydrophobicContact CD1-CE1 3.59Å; Y787-F922 HydrophobicContact CD1-CZ 4.06Å; Y787-F922 HydrophobicContact CE1-CE1 4.04Å
788	D	91.9	Very high	84.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	24%	0.241	C	C	.	.			trans	-78.2	74.2	-177.3	-170.1	24.5	0	0	0	112	V737 A738 H739 Y780 V785 D786 S901 S917	V737-D788 WeakPolarHBondContact CB-OD1 3.48Å; V737-D788 WeakPolarHBondContact CG1-O 3.39Å; A738-D788 WeakPolarHBondContact CA-OD1 3.24Å; A738-D788 PolarHBondContact N-OD1 2.91Å; H739-D788 IonicContact CE1-OD2 3.43Å; H739-D788 PolarHBondContact CE1-OD2 3.14Å; H739-D788 IonicContact CG-OD1 3.4Å; H739-D788 IonicContact CG-OD2 3.95Å; H739-D788 PolarHBondContact N-OD1 3.02Å; H739-D788 IonicContact ND1-OD1 2.77Å; H739-D788 PolarHBondContact ND1-OD1 3.06Å; H739-D788 IonicContact ND1-OD2 3.31Å; H739-D788 PolarHBondContact ND1-OD2 3.45Å; Y780-D788 HydrophobicContact CD2-CB 4.11Å; Y780-D788 HydrophobicContact CE2-CB 3.91Å; V785-D788 HydrophobicContact CG1-CB 4.21Å; D786-D788 PolarHBondContact O-N 3.13Å; D788-S901 WeakPolarHBondContact OD2-CB 3.19Å; D788-S901 PolarHBondContact OD2-OG 3.49Å; D788-S917 WeakPolarHBondContact O-CB 3.11Å; D788-S917 PolarHBondContact O-OG 2.55Å
789	I	93.4	Very high	85.4	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.			trans	-144.6	142.6	179.2	-168.6	169.2	0	0	0	110.7	H777 Y787 L899 F922 W925 I926	H777-I789 HydrophobicContact CB-CG2 3.92Å; H777-I789 PolarHBondContact N-O 2.98Å; Y787-I789 VanDerWaalsContact C-N 3.27Å; Y787-I789 PolarHBondContact O-N 3.27Å; I789-L899 HydrophobicContact CD1-CD1 4.25Å; I789-L899 HydrophobicContact CG1-CD1 4.04Å; I789-F922 HydrophobicContact CB-CD2 4.39Å; I789-F922 HydrophobicContact CD1-CB 3.6Å; I789-F922 HydrophobicContact CD1-CD2 3.83Å; I789-F922 HydrophobicContact CD1-CG 3.87Å; I789-F922 HydrophobicContact CG2-CD1 4.07Å; I789-F922 HydrophobicContact CG2-CD2 4.14Å; I789-F922 HydrophobicContact CG2-CE1 4.31Å; I789-F922 HydrophobicContact CG2-CE2 4.36Å; I789-F922 HydrophobicContact CG2-CG 4Å; I789-F922 HydrophobicContact CG2-CZ 4.44Å; I789-W925 HydrophobicContact CD1-CZ3 4.38Å; I789-W925 HydrophobicContact CG1-CZ3 4.18Å; I789-W925 HydrophobicContact CG2-CE3 4.23Å; I789-W925 HydrophobicContact CG2-CH2 4.4Å; I789-W925 HydrophobicContact CG2-CZ3 3.82Å; I789-I926 HydrophobicContact CD1-CD1 3.95Å; I789-I926 HydrophobicContact CD1-CG1 4.24Å
790	S	93.6	Very high	85.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	151.5	176.9	60.4	0	0	0	0	111.7	T736 V737 F741 I775	T736-S790 VanDerWaalsContact C-OG 3.28Å; T736-S790 WeakPolarHBondContact CG2-OG 3.34Å; T736-S790 PolarHBondContact N-O 3.07Å; T736-S790 VanDerWaalsContact N-O 3.1Å; T736-S790 PolarHBondContact O-N 3.01Å; T736-S790 VanDerWaalsContact O-O 3.12Å; T736-S790 PolarHBondContact O-OG 2.04Å; V737-S790 PolarHBondContact O-OG 3.22Å; F741-S790 WeakPolarHBondContact CE2-OG 3.31Å; I775-S790 VanDerWaalsContact O-CA 3.3Å; I775-S790 WeakPolarHBondContact O-CA 3.26Å; I775-S790 WeakPolarHBondContact O-CB 3.45Å
791	I	93.9	Very high	85.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.3	178.1	-58.5	167.2	0	0	0	108	W733 L735 I775 W925 I926 Q929	W733-I791 HydrophobicContact CE3-CG2 3.49Å; W733-I791 VanDerWaalsContact CE3-CG2 3.49Å; W733-I791 HydrophobicContact CZ3-CG2 3.7Å; L735-I791 HydrophobicContact CD2-CB 4.44Å; L735-I791 HydrophobicContact CD2-CG1 3.67Å; I775-I791 HydrophobicContact CB-CB 4.32Å; I775-I791 PolarHBondContact N-O 3.26Å; I775-I791 PolarHBondContact O-N 3.37Å; I791-W925 HydrophobicContact CD1-CE3 3.86Å; I791-W925 HydrophobicContact CD1-CH2 3.65Å; I791-W925 HydrophobicContact CD1-CZ2 4.33Å; I791-W925 HydrophobicContact CD1-CZ3 3.39Å; I791-W925 HydrophobicContact CG1-CE3 4.45Å; I791-W925 HydrophobicContact CG1-CH2 3.8Å; I791-W925 HydrophobicContact CG1-CZ3 3.57Å; I791-I926 HydrophobicContact CD1-CB 4.34Å; I791-I926 HydrophobicContact CD1-CG1 4.27Å; I791-I926 HydrophobicContact CD1-CG2 4.38Å; I791-Q929 HydrophobicContact CD1-CB 3.52Å; I791-Q929 HydrophobicContact CD1-CG 3.96Å
792	V	93.5	Very high	86.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	122.7	-179	-174.7	0	0	0	0	108.9	V734 T736 F741 V771	V734-V792 HydrophobicContact CB-CB 4.28Å; V734-V792 PolarHBondContact N-O 3.31Å; V734-V792 PolarHBondContact O-N 3.08Å; T736-V792 HydrophobicContact CG2-CG2 4.04Å; F741-V792 HydrophobicContact CE2-CG2 3.93Å; F741-V792 HydrophobicContact CZ-CG2 3.53Å; V771-V792 HydrophobicContact CB-CG1 4.15Å; V771-V792 HydrophobicContact CG1-CG1 3.47Å; V771-V792 VanDerWaalsContact CG1-CG1 3.47Å; V771-V792 HydrophobicContact CG2-CG1 3.62Å
793	E	92.6	Very high	87	Confident	7 Å²	7	36.7 Å²	36.7	3%	0.033	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.2	172	-168.8	-167.3	-179.7	0	0	109.5	W733 K772 T773	W733-E793 HydrophobicContact CE3-CB 4.25Å; W733-E793 HydrophobicContact CH2-CB 3.92Å; W733-E793 HydrophobicContact CH2-CG 3.8Å; W733-E793 HydrophobicContact CZ2-CG 4.17Å; W733-E793 HydrophobicContact CZ3-CB 3.68Å; W733-E793 HydrophobicContact CZ3-CG 4.03Å; K772-E793 HydrophobicContact CB-CG 4.48Å; K772-E793 WeakPolarHBondContact CD-OE1 3.46Å; K772-E793 WeakPolarHBondContact CD-OE2 3.35Å; K772-E793 PolarHBondContact N-O 3.05Å; K772-E793 IonicContact NZ-OE1 3.21Å; K772-E793 PolarHBondContact NZ-OE1 2.63Å; K772-E793 IonicContact NZ-OE2 3.92Å; T773-E793 PolarHBondContact N-O 3.39Å; T773-E793 PolarHBondContact O-N 3.12Å; T773-E793 PolarHBondContact OG1-OE2 3.1Å
794	L	92.4	Very high	88.2	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	145.3	175.1	-56.1	179.7	0	0	0	110.8	K732 V734 V752 R769 E796 I798	K732-L794 WeakPolarHBondContact O-CB 3.07Å; K732-L794 WeakPolarHBondContact O-CG 3.24Å; K732-L794 PolarHBondContact O-N 3.45Å; V734-L794 HydrophobicContact CG2-CD1 4.02Å; V734-L794 HydrophobicContact CG2-CD2 4.17Å; V734-L794 HydrophobicContact CG2-CG 4.22Å; V752-L794 HydrophobicContact CB-CD2 3.86Å; V752-L794 HydrophobicContact CG1-CD2 4.4Å; V752-L794 HydrophobicContact CG2-CD2 3.78Å; R769-L794 HydrophobicContact CB-CB 4.27Å; R769-L794 HydrophobicContact CB-CD1 4.2Å; R769-L794 HydrophobicContact CB-CD2 4.09Å; R769-L794 HydrophobicContact CB-CG 4.42Å; R769-L794 HydrophobicContact CG-CD1 4.28Å; L794-E796 PolarHBondContact O-N 3.43Å; L794-I798 HydrophobicContact CD1-CG2 3.75Å
795	S	90.6	Very high	89.2	Confident	49 Å²	49	31.1 Å²	31.1	34%	0.343	17%	0.169	S	C	.	.	S	Bend	trans	-61	-33.1	177.9	65.1	0	0	0	0	113.3	F770	F770-S795 PolarHBondContact O-N 3.19Å; F770-S795 PolarHBondContact O-OG 2.91Å
796	E	89.9	Confident	89.8	Confident	119 Å²	119	30.2 Å²	30.2	56%	0.556	16%	0.163	S	C	*	.	S	Bend	trans	-138.7	157.4	-177	-60.7	-178.2	162.7	0	0	111.5	L794	L794-E796 PolarHBondContact O-N 3.43Å
797	D	87.9	Confident	90.3	Very high	85 Å²	85	29.4 Å²	29.4	46%	0.455	16%	0.159	S	C	.	.	P	Polyproline II helix	trans	-62.1	140.2	173.2	-76.2	-52.7	0	0	0	111.8	K732 R769	K732-D797 WeakPolarHBondContact CE-OD1 3.07Å; K732-D797 WeakPolarHBondContact CE-OD2 3.05Å; K732-D797 WeakPolarHBondContact CG-OD1 3.45Å; K732-D797 IonicContact NZ-OD2 3.99Å; R769-D797 PolarHBondContact NE-O 3.15Å; R769-D797 VanDerWaalsContact NE-O 3.11Å; R769-D797 PolarHBondContact NH2-O 2.76Å
798	I	90.2	Very high	90.4	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.036	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-77.4	150.2	166.3	64.9	93.7	0	0	0	110.6	L728 K731 L754 R769 L794 E800 V804	L728-I798 HydrophobicContact CD1-CG1 4.33Å; L728-I798 HydrophobicContact CD2-CD1 3.93Å; L728-I798 HydrophobicContact CD2-CG1 4.15Å; K731-I798 HydrophobicContact CB-CG1 4.19Å; K731-I798 HydrophobicContact CG-CD1 4.44Å; K731-I798 HydrophobicContact CG-CG1 4.5Å; K731-I798 WeakPolarHBondContact O-CG1 3.36Å; K731-I798 PolarHBondContact O-N 3.28Å; L754-I798 HydrophobicContact CD1-CG2 4.01Å; L754-I798 HydrophobicContact CD2-CG2 4.5Å; R769-I798 HydrophobicContact CG-CG2 4.03Å; L794-I798 HydrophobicContact CD1-CG2 3.75Å; I798-E800 HydrophobicContact CD1-CG 3.83Å; I798-V804 HydrophobicContact CD1-CG1 4Å
799	S	90.2	Very high	90.3	Very high	62 Å²	62	30 Å²	30	43%	0.434	16%	0.164	S	C	.	.	P	Polyproline II helix	trans	-89.6	120.4	169.8	63.9	0	0	0	0	110	Q767 T801	Q767-S799 PolarHBondContact NE2-O 3.49Å; Q767-S799 PolarHBondContact NE2-OG 2.91Å; Q767-S799 VanDerWaalsContact NE2-OG 3.12Å; Q767-S799 PolarHBondContact OE1-O 2.7Å; Q767-S799 PolarHBondContact OE1-OG 3.12Å; S799-T801 PolarHBondContact O-N 2.86Å
800	E	86.7	Confident	90.1	Very high	79 Å²	79	30 Å²	30	37%	0.369	16%	0.164	S	C	.	.	P	Polyproline II helix	trans	-71.5	122.9	179.2	-70.8	-178.7	-160.9	0	0	110.3	K731 I798 V804	K731-E800 WeakPolarHBondContact CE-OE1 3.46Å; I798-E800 HydrophobicContact CD1-CG 3.83Å; E800-V804 WeakPolarHBondContact CA-O 3.44Å
801	T	86.6	Confident	89.4	Confident	52 Å²	52	34.3 Å²	34.3	32%	0.319	19%	0.187	S	C	.	.			trans	-131.4	-177.9	-179.6	65.5	0	0	0	0	110.6	S799 Y803 V804 R805	S799-T801 PolarHBondContact O-N 2.86Å; T801-Y803 PolarHBondContact O-N 2.03Å; T801-Y803 PolarHBondContact OG1-N 2.83Å; T801-V804 PolarHBondContact N-O 3.28Å; T801-V804 PolarHBondContact OG1-N 3.16Å; T801-V804 VanDerWaalsContact OG1-N 3.13Å; T801-R805 WeakPolarHBondContact O-CG 3.37Å
802	G	82.9	Confident	88.2	Confident	27 Å²	27	37.9 Å²	37.9	28%	0.278	21%	0.21	S	C	.	.	S	Bend	trans	-61.3	-20.1	171.1	0	0	0	0	0	114.2	A691	A691-G802 WeakPolarHBondContact CB-O 3.22Å
803	Y	86.4	Confident	86.7	Confident	64 Å²	64	46 Å²	46	25%	0.251	25%	0.248	S	C	.	.	S	Bend	trans	-110.9	-15.3	-172.6	-60.7	-90.4	0	0	0	113.6	A691 P706 P710 F765 T801	A691-Y803 HydrophobicContact CB-CE1 4.3Å; P706-Y803 HydrophobicContact CB-CE1 4.2Å; P710-Y803 WeakPolarHBondContact CA-O 3.25Å; P710-Y803 VanDerWaalsContact CB-C 3.49Å; P710-Y803 VanDerWaalsContact CB-O 3.32Å; P710-Y803 WeakPolarHBondContact CB-O 3.31Å; F765-Y803 HydrophobicContact CB-CD2 3.78Å; F765-Y803 HydrophobicContact CB-CE2 4.4Å; F765-Y803 HydrophobicContact CB-CG 3.89Å; F765-Y803 AromaticContact CD1-CD2 3.87Å; F765-Y803 HydrophobicContact CD1-CD2 3.87Å; F765-Y803 AromaticContact CD1-CE2 3.79Å; F765-Y803 HydrophobicContact CD1-CE2 3.79Å; F765-Y803 HydrophobicContact CD2-CD1 4.22Å; F765-Y803 AromaticContact CD2-CD2 3.95Å; F765-Y803 HydrophobicContact CD2-CD2 3.95Å; F765-Y803 HydrophobicContact CD2-CE1 4.05Å; F765-Y803 AromaticContact CD2-CE2 3.74Å; F765-Y803 HydrophobicContact CD2-CE2 3.74Å; F765-Y803 HydrophobicContact CD2-CG 4.2Å; F765-Y803 AromaticContact CD2-CZ 3.81Å; F765-Y803 HydrophobicContact CE1-CD2 4.47Å; F765-Y803 AromaticContact CE1-CE2 3.94Å; F765-Y803 HydrophobicContact CE1-CE2 3.94Å; F765-Y803 HydrophobicContact CE2-CE1 4.31Å; F765-Y803 AromaticContact CE2-CE2 3.9Å; F765-Y803 HydrophobicContact CE2-CE2 3.9Å; F765-Y803 AromaticContact CE2-CZ 3.77Å; F765-Y803 AromaticContact CG-CD2 3.56Å; F765-Y803 HydrophobicContact CG-CD2 3.56Å; F765-Y803 AromaticContact CG-CE2 3.69Å; F765-Y803 HydrophobicContact CG-CE2 3.69Å; F765-Y803 HydrophobicContact CG-CG 4.02Å; F765-Y803 AromaticContact CZ-CE2 3.99Å; F765-Y803 HydrophobicContact CZ-CE2 3.99Å; T801-Y803 PolarHBondContact O-N 2.03Å; T801-Y803 PolarHBondContact OG1-N 2.83Å
804	V	90.8	Very high	85.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.			trans	-130.6	107.9	179.8	-174.4	0	0	0	0	108.7	P710 L728 L754 I798 E800 T801	P710-V804 WeakPolarHBondContact O-CA 3.46Å; L728-V804 HydrophobicContact CD2-CG1 3.87Å; L754-V804 HydrophobicContact CB-CG1 3.91Å; L754-V804 HydrophobicContact CB-CG2 4.05Å; L754-V804 HydrophobicContact CD2-CG1 3.96Å; I798-V804 HydrophobicContact CD1-CG1 4Å; E800-V804 WeakPolarHBondContact CA-O 3.44Å; T801-V804 PolarHBondContact N-O 3.28Å; T801-V804 PolarHBondContact OG1-N 3.16Å; T801-V804 VanDerWaalsContact OG1-N 3.13Å
805	R	90.1	Very high	84.5	Confident	39 Å²	39	58.3 Å²	58.3	15%	0.147	30%	0.297	C	S	.	.			trans	-152	146.2	-179.7	-65.2	-167.8	65.9	153	-6.2	111.2	D685 P710 W711 T801	D685-R805 PolarHBondContact O-NH2 2.97Å; D685-R805 IonicContact OD2-CZ 2.66Å; D685-R805 IonicContact OD2-NH2 3.79Å; D685-R805 PolarHBondContact OD2-NH2 3.24Å; P710-R805 CarbonylContact C-O 3.48Å; P710-R805 HydrophobicContact CB-CB 4.12Å; P710-R805 HydrophobicContact CB-CG 4.5Å; P710-R805 HydrophobicContact CG-CB 4.15Å; P710-R805 PolarHBondContact O-N 3.42Å; W711-R805 WeakPolarHBondContact CA-O 3.31Å; W711-R805 VanDerWaalsContact CB-O 3.29Å; W711-R805 WeakPolarHBondContact CB-O 3.49Å; W711-R805 PolarHBondContact N-O 2.9Å; T801-R805 WeakPolarHBondContact O-CG 3.37Å
806	P	92.2	Very high	84.1	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.013	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-72.6	148.8	-179.8	28.7	-34.5	0	0	0	112.9	C686 G687 L728 I729	C686-P806 CarbonylContact C-O 3.43Å; C686-P806 WeakPolarHBondContact CA-O 3.18Å; G687-P806 PolarHBondContact N-O 2.78Å; L728-P806 HydrophobicContact CG-CB 4.38Å; L728-P806 CarbonylContact O-C 3.58Å; L728-P806 VanDerWaalsContact O-CA 3.28Å; L728-P806 WeakPolarHBondContact O-CA 3.47Å; I729-P806 WeakPolarHBondContact O-CB 3.31Å
807	V	92.6	Very high	83.7	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-83.7	156.4	169.5	73	0	0	0	0	110.9	W711 V727 L728 I729 V886 L896	W711-V807 HydrophobicContact CB-CB 3.85Å; W711-V807 HydrophobicContact CB-CG1 4.49Å; W711-V807 HydrophobicContact CD2-CB 3.83Å; W711-V807 HydrophobicContact CD2-CG2 4Å; W711-V807 HydrophobicContact CE3-CB 4.18Å; W711-V807 HydrophobicContact CE3-CG2 4.39Å; W711-V807 HydrophobicContact CG-CB 3.69Å; W711-V807 HydrophobicContact CG-CG2 4.21Å; V727-V807 HydrophobicContact CG1-CB 4.36Å; V727-V807 HydrophobicContact CG1-CG1 3.53Å; L728-V807 PolarHBondContact O-N 2.87Å; I729-V807 HydrophobicContact CG2-CG1 4.11Å; V807-V886 HydrophobicContact CG2-CG1 3.81Å; V807-L896 HydrophobicContact CG1-CB 3.77Å; V807-L896 HydrophobicContact CG1-CD2 4.19Å; V807-L896 HydrophobicContact CG1-CG 4.5Å; V807-L896 HydrophobicContact CG2-CB 4.07Å
808	C	90.7	Very high	83.5	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.034	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-80.7	139.5	174.2	-60.7	0	0	0	0	112	C686 R893 W894 T895 L896	C686-C808 HydrophobicContact CB-CB 4.03Å; C686-C808 WeakPolarHBondContact CB-SG 3.43Å; C686-C808 PolarHBondContact O-SG 3.22Å; C686-C808 WeakPolarHBondContact SG-CA 3.33Å; C686-C808 WeakPolarHBondContact SG-CB 3.29Å; C686-C808 CovalentContact SG-SG 2.04Å; C686-C808 PolarHBondContact SG-SG 3.01Å; C808-R893 WeakPolarHBondContact SG-CD 3.44Å; C808-R893 VanDerWaalsContact SG-CG 3.53Å; C808-W894 WeakPolarHBondContact CB-O 3.14Å; C808-W894 PolarHBondContact N-O 3.09Å; C808-T895 CarbonylContact O-C 3.54Å; C808-T895 WeakPolarHBondContact O-CA 3.3Å; C808-T895 WeakPolarHBondContact O-CG2 3.32Å; C808-L896 PolarHBondContact O-N 3.39Å
809	L	89.5	Confident	83.1	Confident	30 Å²	30	63.3 Å²	63.3	16%	0.157	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-80.9	148.3	165.9	-66.6	176.5	0	0	0	111.3	I729 L735 L896 V919 I926	I729-L809 HydrophobicContact CD1-CD1 4.5Å; I729-L809 HydrophobicContact CG2-CD2 3.98Å; I729-L809 HydrophobicContact CG2-CG 4.46Å; L735-L809 HydrophobicContact CD1-CD2 4.02Å; L809-L896 HydrophobicContact CD2-CD2 4.4Å; L809-V919 HydrophobicContact CD2-CG1 3.93Å; L809-I926 HydrophobicContact CD1-CG2 4.09Å
810	P	87.9	Confident	82.9	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-73.9	169.9	176.8	31.2	-29.1	0	0	0	110.6	T895 L896 F897 V919 V923	P810-T895 HydrophobicContact CB-CG2 3.88Å; P810-L896 WeakPolarHBondContact CD-O 3.49Å; P810-L896 WeakPolarHBondContact CG-O 3.09Å; P810-F897 HydrophobicContact CB-CD1 4.12Å; P810-F897 HydrophobicContact CB-CE1 3.85Å; P810-F897 HydrophobicContact CB-CZ 4.46Å; P810-F897 HydrophobicContact CG-CD1 4.47Å; P810-V919 HydrophobicContact CG-CG1 4.4Å; P810-V923 HydrophobicContact CG-CG2 3.77Å
811	N	80.3	Confident	82.8	Confident	91 Å²	91	65.3 Å²	65.3	49%	0.487	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-87.6	149.4	170.3	-66.6	-11	0	0	0	109	E813 Q814	N811-E813 PolarHBondContact O-N 3.43Å; N811-E813 VanDerWaalsContact O-N 3.12Å; N811-Q814 HydrophobicContact CB-CB 4.18Å; N811-Q814 VanDerWaalsContact O-CB 3.3Å; N811-Q814 WeakPolarHBondContact O-CB 3.5Å; N811-Q814 PolarHBondContact O-N 2.84Å
812	P	67.4	Low	83	Confident	75 Å²	75	62.9 Å²	62.9	49%	0.487	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-29.9	-175.9	-26.3	34.8	0	0	0	114.8	V923	P812-V923 HydrophobicContact CG-CG1 4.4Å
813	E	63.4	Low	83.3	Confident	169 Å²	169	63.9 Å²	63.9	79%	0.79	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	10.4	179.6	-59.4	-178.6	176.2	0	0	113.5	N811 W815	N811-E813 PolarHBondContact O-N 3.43Å; N811-E813 VanDerWaalsContact O-N 3.12Å; E813-W815 PolarHBondContact O-N 3.06Å; E813-W815 PolarHBondContact O-NE1 3.2Å
814	Q	70.7	Confident	83.5	Confident	58 Å²	58	61.5 Å²	61.5	27%	0.271	30%	0.295	S	S	.	.			trans	-90.6	108.9	-178.1	-176.6	164.1	10	0	0	111.2	N811 K889 F897	N811-Q814 HydrophobicContact CB-CB 4.18Å; N811-Q814 VanDerWaalsContact O-CB 3.3Å; N811-Q814 WeakPolarHBondContact O-CB 3.5Å; N811-Q814 PolarHBondContact O-N 2.84Å; Q814-K889 VanDerWaalsContact CD-NZ 3.32Å; Q814-F897 HydrophobicContact CG-CE1 4.17Å; Q814-F897 HydrophobicContact CG-CZ 4.34Å
815	W	68.4	Low	83.4	Confident	209 Å²	209	61.7 Å²	61.7	79%	0.792	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-90.8	144.6	176.1	-48.9	92.1	0	0	0	111	E813	E813-W815 PolarHBondContact O-N 3.06Å; E813-W815 PolarHBondContact O-NE1 3.2Å
816	L	80.7	Confident	83.3	Confident	37 Å²	37	60 Å²	60	19%	0.194	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-86.4	127.2	166.3	-86.1	161.5	0	0	0	108.8	T820 I845 I865 C887 F897	L816-T820 HydrophobicContact CD2-CG2 4.07Å; L816-I845 HydrophobicContact CD1-CD1 4.26Å; L816-I845 HydrophobicContact CD1-CG1 4.31Å; L816-I845 HydrophobicContact CD2-CG1 4.48Å; L816-I865 HydrophobicContact CD1-CD1 4.3Å; L816-C887 HydrophobicContact CD2-CB 4.4Å; L816-F897 HydrophobicContact CD1-CB 3.35Å; L816-F897 HydrophobicContact CD1-CD1 3.45Å; L816-F897 VanDerWaalsContact CD1-CD1 3.45Å; L816-F897 HydrophobicContact CD1-CD2 3.99Å; L816-F897 HydrophobicContact CD1-CE1 4.16Å; L816-F897 HydrophobicContact CD1-CG 3.34Å; L816-F897 HydrophobicContact CD2-CD1 4.32Å; L816-F897 HydrophobicContact CD2-CD2 4.07Å; L816-F897 HydrophobicContact CD2-CE1 4.28Å; L816-F897 HydrophobicContact CD2-CE2 4.02Å; L816-F897 HydrophobicContact CD2-CG 4.2Å; L816-F897 HydrophobicContact CD2-CZ 4.12Å; L816-F897 HydrophobicContact CG-CB 4.36Å; L816-F897 HydrophobicContact CG-CD1 3.6Å; L816-F897 HydrophobicContact CG-CD2 4.21Å; L816-F897 HydrophobicContact CG-CE1 3.77Å; L816-F897 HydrophobicContact CG-CE2 4.34Å; L816-F897 HydrophobicContact CG-CG 3.82Å; L816-F897 HydrophobicContact CG-CZ 4.13Å
817	E	82	Confident	82.8	Confident	150 Å²	150	59.9 Å²	59.9	70%	0.701	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-71.3	138.8	170.9	-66.2	-175.2	169.5	0	0	109.5	T820	E817-T820 VanDerWaalsContact O-CB 3.32Å; E817-T820 WeakPolarHBondContact O-CB 3.17Å; E817-T820 PolarHBondContact O-N 3.49Å; E817-T820 PolarHBondContact O-OG1 2.92Å
818	P	83.8	Confident	81.8	Confident	74 Å²	74	60 Å²	60	48%	0.481	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	151.7	169.4	-24.2	33.9	0	0	0	111.4	T820	P818-T820 PolarHBondContact O-N 2.87Å
819	D	81.3	Confident	80.5	Confident	104 Å²	104	63 Å²	63	56%	0.556	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	11.3	-175.5	-59.1	-53.1	0	0	0	115.6	I845	D819-I845 PolarHBondContact N-O 2.04Å
820	T	85.8	Confident	78.8	Confident	45 Å²	45	67.1 Å²	67.1	28%	0.276	33%	0.325	S	S	.	.			trans	-69.1	135.4	166.4	-59	0	0	0	0	110.4	L816 E817 P818 R844 I845	L816-T820 HydrophobicContact CD2-CG2 4.07Å; E817-T820 VanDerWaalsContact O-CB 3.32Å; E817-T820 WeakPolarHBondContact O-CB 3.17Å; E817-T820 PolarHBondContact O-N 3.49Å; E817-T820 PolarHBondContact O-OG1 2.92Å; P818-T820 PolarHBondContact O-N 2.87Å; T820-R844 WeakPolarHBondContact O-CA 3.44Å; T820-I845 WeakPolarHBondContact O-CG1 3.08Å; T820-I845 PolarHBondContact O-N 2.93Å
821	Y	86.4	Confident	77.2	Confident	139 Å²	139	68 Å²	68	55%	0.545	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	128	175.4	-68	-87.9	0	0	0	111.3	E842 R844	Y821-E842 HydrophobicContact CD1-CG 4.15Å; Y821-R844 HydrophobicContact CD1-CB 4.44Å; Y821-R844 HydrophobicContact CE1-CB 4.37Å
822	C	89.9	Confident	75.4	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	170.1	-179.3	-58.2	0	0	0	0	110	E842 V843 I845 L885 V886 C887	C822-E842 CarbonylContact O-C 3.58Å; C822-E842 WeakPolarHBondContact O-CA 3.46Å; C822-V843 PolarHBondContact N-O 3.33Å; C822-V843 PolarHBondContact O-N 3.05Å; C822-V843 VanDerWaalsContact O-O 3.12Å; C822-I845 HydrophobicContact CB-CD1 4.45Å; C822-L885 HydrophobicContact CB-CD1 3.85Å; C822-L885 HydrophobicContact CB-CG 4.41Å; C822-V886 WeakPolarHBondContact CA-O 3.06Å; C822-V886 WeakPolarHBondContact CB-O 3.1Å; C822-C887 HydrophobicContact CB-CB 4.05Å; C822-C887 WeakPolarHBondContact CB-SG 3.37Å; C822-C887 WeakPolarHBondContact SG-CB 3.29Å; C822-C887 CovalentContact SG-SG 2.03Å; C822-C887 PolarHBondContact SG-SG 3.33Å
823	Y	89.4	Confident	74.5	Confident	49 Å²	49	75.8 Å²	75.8	19%	0.192	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	139.5	-178.5	-74.1	-101.2	0	0	0	110.6	W709 G841 E842 V886 W894	W709-Y823 AromaticContact CH2-CD1 3.96Å; W709-Y823 HydrophobicContact CH2-CD1 3.96Å; W709-Y823 HydrophobicContact CH2-CD2 4.31Å; W709-Y823 AromaticContact CH2-CG 3.67Å; W709-Y823 HydrophobicContact CH2-CG 3.67Å; W709-Y823 AromaticContact CZ2-CD1 3.81Å; W709-Y823 HydrophobicContact CZ2-CD1 3.81Å; W709-Y823 AromaticContact CZ2-CG 4Å; W709-Y823 HydrophobicContact CZ2-CG 4Å; Y823-G841 CarbonylContact C-O 3.42Å; Y823-G841 VanDerWaalsContact CA-O 3.29Å; Y823-G841 WeakPolarHBondContact CA-O 3.18Å; Y823-E842 HydrophobicContact CD1-CB 4.31Å; Y823-E842 HydrophobicContact CE1-CB 3.93Å; Y823-E842 HydrophobicContact CE1-CG 4.41Å; Y823-E842 HydrophobicContact CE2-CG 4.24Å; Y823-E842 VanDerWaalsContact CZ-OE1 3.29Å; Y823-E842 PolarHBondContact OH-OE1 3.38Å; Y823-V886 PolarHBondContact N-O 2.89Å; Y823-V886 PolarHBondContact O-N 2.9Å; Y823-W894 AromaticContact CD2-CH2 3.5Å; Y823-W894 HydrophobicContact CD2-CH2 3.5Å; Y823-W894 VanDerWaalsContact CD2-CH2 3.5Å; Y823-W894 AromaticContact CD2-CZ3 3.62Å; Y823-W894 HydrophobicContact CD2-CZ3 3.62Å; Y823-W894 AromaticContact CE2-CH2 3.86Å; Y823-W894 HydrophobicContact CE2-CH2 3.86Å; Y823-W894 HydrophobicContact CE2-CZ3 4.43Å; Y823-W894 HydrophobicContact CG-CH2 4.22Å; Y823-W894 HydrophobicContact CG-CZ3 4.15Å
824	I	89.6	Confident	74.3	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.9	170.5	58.2	170.4	0	0	0	109.7	E840 G841 V843 P884 L885 Y916	I824-E840 CarbonylContact O-C 3.56Å; I824-E840 WeakPolarHBondContact O-CA 3.35Å; I824-G841 PolarHBondContact N-O 2.95Å; I824-G841 PolarHBondContact O-N 3.46Å; I824-V843 HydrophobicContact CD1-CG1 3.79Å; I824-V843 HydrophobicContact CG1-CG1 4.03Å; I824-V843 HydrophobicContact CG2-CG2 3.85Å; I824-P884 WeakPolarHBondContact CA-O 3.38Å; I824-L885 HydrophobicContact CG2-CB 4.28Å; I824-L885 HydrophobicContact CG2-CD1 3.42Å; I824-L885 VanDerWaalsContact CG2-CD1 3.42Å; I824-L885 HydrophobicContact CG2-CG 4.46Å; I824-Y916 HydrophobicContact CG2-CE1 3.77Å
825	T	89.6	Confident	73.9	Confident	5 Å²	5	69.1 Å²	69.1	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.3	179.8	53.7	0	0	0	0	111.5	W709 Q712 Q839 E840 P884	W709-T825 HydrophobicContact CB-CG2 4.41Å; W709-T825 VanDerWaalsContact CD1-CG2 3.45Å; W709-T825 HydrophobicContact CD2-CG2 3.78Å; W709-T825 HydrophobicContact CG-CG2 3.65Å; W709-T825 HydrophobicContact CZ2-CG2 4.39Å; Q712-T825 PolarHBondContact OE1-O 3.47Å; Q712-T825 PolarHBondContact OE1-OG1 3.45Å; T825-Q839 VanDerWaalsContact CA-O 3.29Å; T825-Q839 WeakPolarHBondContact CA-O 3.37Å; T825-E840 HydrophobicContact CG2-CB 3.88Å; T825-P884 VanDerWaalsContact OG1-CG 3.28Å; T825-P884 WeakPolarHBondContact OG1-CG 3.25Å
826	G	87.7	Confident	74	Confident	2 Å²	2	64.5 Å²	64.5	2%	0.021	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.5	-174.4	175.3	0	0	0	0	0	114	Q839 D880	G826-Q839 PolarHBondContact N-O 3.35Å; G826-Q839 PolarHBondContact O-N 3.44Å; G826-D880 WeakPolarHBondContact CA-OD1 3.36Å
827	W	82.5	Confident	73.8	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.335	C	S	.	.			trans	-115.6	20.3	-177.4	-65.7	-88	0	0	0	112.2	Q712 H722 I756 L759 M834 L838 D880	Q712-W827 HydrophobicContact CG-CH2 3.6Å; Q712-W827 HydrophobicContact CG-CZ3 3.68Å; H722-W827 AromaticContact CE1-CE3 3.55Å; I756-W827 HydrophobicContact CG2-CH2 3.89Å; I756-W827 HydrophobicContact CG2-CZ2 3.87Å; I756-W827 WeakPolarHBondContact O-CZ2 2.99Å; L759-W827 HydrophobicContact CD1-CB 3.85Å; L759-W827 HydrophobicContact CD1-CD2 4.45Å; L759-W827 HydrophobicContact CD1-CG 3.77Å; L759-W827 HydrophobicContact CD2-CD2 4.36Å; L759-W827 HydrophobicContact CD2-CG 4.47Å; L759-W827 HydrophobicContact CG-CD2 4.45Å; L759-W827 HydrophobicContact CG-CG 4.1Å; W827-M834 HydrophobicContact CB-CE 4.32Å; W827-M834 WeakPolarHBondContact O-CE 3.29Å; W827-M834 VanDerWaalsContact O-CG 3.27Å; W827-M834 WeakPolarHBondContact O-CG 3.31Å; W827-L838 HydrophobicContact CD2-CD1 3.85Å; W827-L838 HydrophobicContact CE3-CD1 4.08Å; W827-L838 HydrophobicContact CH2-CD1 3.99Å; W827-L838 HydrophobicContact CZ2-CB 4.02Å; W827-L838 HydrophobicContact CZ2-CD1 3.73Å; W827-L838 HydrophobicContact CZ2-CG 4.3Å; W827-L838 HydrophobicContact CZ3-CD1 4.16Å; W827-D880 PolarHBondContact N-OD1 2.94Å
828	G	70.3	Confident	73.8	Confident	4 Å²	4	61.3 Å²	61.3	4%	0.041	30%	0.303	C	S	.	.			trans	-68.6	164.9	-176.9	0	0	0	0	0	114.1	P835 M878 D880	G828-P835 WeakPolarHBondContact O-CD 3.33Å; G828-P835 WeakPolarHBondContact O-CG 3.42Å; G828-M878 CarbonylContact C-O 3.57Å; G828-M878 WeakPolarHBondContact CA-O 3.46Å; G828-D880 WeakPolarHBondContact CA-OD1 3.47Å; G828-D880 PolarHBondContact N-OD1 2.79Å
829	H	63.7	Low	73.8	Confident	68 Å²	68	59.1 Å²	59.1	32%	0.315	29%	0.286	S	S	.	.			trans	-62.1	133.3	-170.2	-146.8	-104.6	0	0	0	113.3	G831 K833 C877 M878	H829-G831 VanDerWaalsContact CE1-C 3.42Å; H829-G831 PolarHBondContact CE1-O 3.48Å; H829-G831 PolarHBondContact ND1-N 2.93Å; H829-G831 PolarHBondContact ND1-O 3.5Å; H829-K833 PolarHBondContact CE1-N 2.87Å; H829-C877 WeakPolarHBondContact O-CB 3.36Å; H829-C877 PolarHBondContact O-SG 3.31Å; H829-C877 VanDerWaalsContact O-SG 3.38Å; H829-M878 PolarHBondContact N-O 2.84Å
830	M	54.4	Low	73.9	Confident	116 Å²	116	54.5 Å²	54.5	57%	0.571	26%	0.261	S	S	*	.			trans	-105.2	16.7	177.7	-72.2	-158.3	-76.9	0	0	114.1	K833 P835 Q839 F907	M830-K833 PolarHBondContact N-O 3.29Å; M830-P835 HydrophobicContact CE-CB 3.5Å; M830-P835 HydrophobicContact CE-CG 3.8Å; M830-P835 HydrophobicContact CG-CG 4.18Å; M830-Q839 HydrophobicContact CE-CG 4.05Å; M830-Q839 HydrophobicContact SD-CG 4.1Å; M830-F907 VanDerWaalsContact C-CZ 3.43Å
831	G	54.8	Low	73.7	Confident	20 Å²	20	52.6 Å²	52.6	21%	0.206	25%	0.251	C	S	.	.	S	Bend	trans	136.6	-82.9	176.9	0	0	0	0	0	112.1	H829 F907	H829-G831 VanDerWaalsContact CE1-C 3.42Å; H829-G831 PolarHBondContact CE1-O 3.48Å; H829-G831 PolarHBondContact ND1-N 2.93Å; H829-G831 PolarHBondContact ND1-O 3.5Å; G831-F907 VanDerWaalsContact CA-CE1 3.49Å
832	N	41.5	Very low	73.5	Confident	161 Å²	161	48.1 Å²	48.1	86%	0.861	24%	0.235	S	C	*	.	S	Bend	trans	-109.3	-5.1	-178.5	-68.6	-17.2	0	0	0	113.7
833	K	49.7	Very low	73.3	Confident	169 Å²	169	48.1 Å²	48.1	74%	0.735	24%	0.235	S	C	*	.	S	Bend	trans	-148.8	149.5	179.2	-66.3	-172.7	-179.8	-179.8	0	111.6	H829 M830	H829-K833 PolarHBondContact CE1-N 2.87Å; M830-K833 PolarHBondContact N-O 3.29Å
834	M	58.1	Low	73.1	Confident	70 Å²	70	48.2 Å²	48.2	35%	0.345	24%	0.235	S	C	.	.			trans	-82	125	168.9	-167	174.5	168.8	0	0	109.5	H722 L759 W827	H722-M834 HydrophobicContact CB-CE 4.18Å; H722-M834 WeakPolarHBondContact CD2-CE 3.25Å; L759-M834 HydrophobicContact CD1-CE 4.18Å; W827-M834 HydrophobicContact CB-CE 4.32Å; W827-M834 WeakPolarHBondContact O-CE 3.29Å; W827-M834 VanDerWaalsContact O-CG 3.27Å; W827-M834 WeakPolarHBondContact O-CG 3.31Å
835	P	62.3	Low	73.1	Confident	16 Å²	16	47.9 Å²	47.9	10%	0.104	23%	0.234	C	C	.	.			trans	-75.4	128.3	-178.6	29.9	-33.3	0	0	0	111.8	G828 M830 K837 Q839	G828-P835 WeakPolarHBondContact O-CD 3.33Å; G828-P835 WeakPolarHBondContact O-CG 3.42Å; M830-P835 HydrophobicContact CE-CB 3.5Å; M830-P835 HydrophobicContact CE-CG 3.8Å; M830-P835 HydrophobicContact CG-CG 4.18Å; P835-K837 VanDerWaalsContact C-N 3.29Å; P835-K837 PolarHBondContact O-N 3.19Å; P835-Q839 HydrophobicContact CB-CG 4.37Å; P835-Q839 HydrophobicContact CG-CG 4Å
836	F	69.8	Low	73	Confident	113 Å²	113	48.4 Å²	48.4	50%	0.496	24%	0.236	S	C	.	.	S	Bend	trans	-69	-29.1	175.9	-56.2	-69.5	0	0	0	112.4	N758 L759 D760	N758-F836 CarbonylContact C-O 3.59Å; N758-F836 VanDerWaalsContact CA-O 3.25Å; N758-F836 WeakPolarHBondContact CA-O 3.23Å; N758-F836 VanDerWaalsContact OD1-CB 3.24Å; N758-F836 WeakPolarHBondContact OD1-CB 3.44Å; N758-F836 PolarHBondContact OD1-O 3.43Å; L759-F836 PolarHBondContact N-O 3.41Å; D760-F836 HydrophobicContact CB-CD1 4.4Å; D760-F836 WeakPolarHBondContact OD1-CD1 3.14Å; D760-F836 VanDerWaalsContact OD1-CE1 3.29Å; D760-F836 WeakPolarHBondContact OD1-CE1 3.19Å; D760-F836 WeakPolarHBondContact OD2-CD1 3.44Å; D760-F836 WeakPolarHBondContact OD2-CD2 3.23Å; D760-F836 WeakPolarHBondContact OD2-CE1 3.25Å; D760-F836 WeakPolarHBondContact OD2-CG 3.49Å; D760-F836 WeakPolarHBondContact OD2-CZ 3.05Å
837	K	76.3	Confident	73	Confident	114 Å²	114	50.4 Å²	50.4	50%	0.496	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-91.3	140.9	177.4	-62.9	179.9	-177.3	170.4	0	111.6	T703 N757 N758 P835 Q839	T703-K837 HydrophobicContact CG2-CB 3.63Å; T703-K837 HydrophobicContact CG2-CD 3.81Å; T703-K837 HydrophobicContact CG2-CG 4.34Å; N757-K837 CarbonylContact O-C 3.57Å; N757-K837 WeakPolarHBondContact O-CA 3.15Å; N758-K837 HydrophobicContact CB-CG 4.45Å; P835-K837 VanDerWaalsContact C-N 3.29Å; P835-K837 PolarHBondContact O-N 3.19Å; K837-Q839 PolarHBondContact O-N 2.79Å; K837-Q839 PolarHBondContact O-NE2 3.26Å
838	L	83.1	Confident	73.1	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-57.6	133.2	177.5	-179.7	66.6	0	0	0	110.9	S704 Q712 N757 W827	S704-L838 WeakPolarHBondContact CB-O 3.23Å; S704-L838 PolarHBondContact N-O 2.89Å; Q712-L838 HydrophobicContact CG-CD1 3.88Å; Q712-L838 HydrophobicContact CG-CD2 4.25Å; N757-L838 PolarHBondContact O-N 3.29Å; W827-L838 HydrophobicContact CD2-CD1 3.85Å; W827-L838 HydrophobicContact CE3-CD1 4.08Å; W827-L838 HydrophobicContact CH2-CD1 3.99Å; W827-L838 HydrophobicContact CZ2-CB 4.02Å; W827-L838 HydrophobicContact CZ2-CD1 3.73Å; W827-L838 HydrophobicContact CZ2-CG 4.3Å; W827-L838 HydrophobicContact CZ3-CD1 4.16Å
839	Q	83	Confident	73.8	Confident	28 Å²	28	61.9 Å²	61.9	13%	0.131	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	153.3	175.6	-56.1	-55.1	-48.5	0	0	111.2	R702 T703 T825 G826 M830 P835 K837	R702-Q839 PolarHBondContact O-OE1 3.42Å; T703-Q839 VanDerWaalsContact N-OE1 3.13Å; T703-Q839 PolarHBondContact OG1-NE2 2.98Å; T703-Q839 PolarHBondContact OG1-OE1 3.19Å; T825-Q839 VanDerWaalsContact CA-O 3.29Å; T825-Q839 WeakPolarHBondContact CA-O 3.37Å; G826-Q839 PolarHBondContact N-O 3.35Å; G826-Q839 PolarHBondContact O-N 3.44Å; M830-Q839 HydrophobicContact CE-CG 4.05Å; M830-Q839 HydrophobicContact SD-CG 4.1Å; P835-Q839 HydrophobicContact CB-CG 4.37Å; P835-Q839 HydrophobicContact CG-CG 4Å; K837-Q839 PolarHBondContact O-N 2.79Å; K837-Q839 PolarHBondContact O-NE2 3.26Å
840	E	84.4	Confident	74.8	Confident	7 Å²	7	62 Å²	62	3%	0.033	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.6	170.3	67.3	179.8	-137.4	0	0	110.9	G701 R702 R708 W709 I824 T825	G701-E840 CarbonylContact C-O 3.29Å; G701-E840 VanDerWaalsContact CA-O 3.29Å; G701-E840 WeakPolarHBondContact CA-O 3.41Å; R702-E840 HydrophobicContact CG-CG 3.62Å; R702-E840 IonicContact CZ-OE1 3.68Å; R702-E840 PolarHBondContact N-O 3.49Å; R702-E840 IonicContact NE-OE1 3.83Å; R702-E840 PolarHBondContact NE-OE1 2.91Å; R702-E840 IonicContact NH2-OE1 3.93Å; R702-E840 PolarHBondContact NH2-OE1 3.21Å; R702-E840 PolarHBondContact O-N 3.24Å; R708-E840 WeakPolarHBondContact CD-OE2 3.24Å; R708-E840 IonicContact CZ-OE1 3.76Å; R708-E840 IonicContact NE-OE1 2.67Å; R708-E840 PolarHBondContact NE-OE1 2.91Å; R708-E840 VanDerWaalsContact NE-OE1 3.1Å; R708-E840 IonicContact NE-OE2 3.25Å; R708-E840 PolarHBondContact NE-OE2 2.95Å; R708-E840 IonicContact NH2-OE1 2.73Å; W709-E840 PolarHBondContact NE1-OE2 3.14Å; I824-E840 CarbonylContact O-C 3.56Å; I824-E840 WeakPolarHBondContact O-CA 3.35Å; T825-E840 HydrophobicContact CG2-CB 3.88Å
841	G	80.5	Confident	76.2	Confident	6 Å²	6	56.5 Å²	56.5	6%	0.062	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.2	176.8	0	0	0	0	0	111.4	Y823 I824	Y823-G841 CarbonylContact C-O 3.42Å; Y823-G841 VanDerWaalsContact CA-O 3.29Å; Y823-G841 WeakPolarHBondContact CA-O 3.18Å; I824-G841 PolarHBondContact N-O 2.95Å; I824-G841 PolarHBondContact O-N 3.46Å
842	E	83.1	Confident	77.6	Confident	44 Å²	44	58.6 Å²	58.6	21%	0.206	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.2	172.6	-178.7	176	-107	0	0	109	L699 Y821 C822 Y823 Y869	L699-E842 VanDerWaalsContact CD2-OE2 3.31Å; L699-E842 WeakPolarHBondContact CD2-OE2 3.19Å; Y821-E842 HydrophobicContact CD1-CG 4.15Å; C822-E842 CarbonylContact O-C 3.58Å; C822-E842 WeakPolarHBondContact O-CA 3.46Å; Y823-E842 HydrophobicContact CD1-CB 4.31Å; Y823-E842 HydrophobicContact CE1-CB 3.93Å; Y823-E842 HydrophobicContact CE1-CG 4.41Å; Y823-E842 HydrophobicContact CE2-CG 4.24Å; Y823-E842 VanDerWaalsContact CZ-OE1 3.29Å; Y823-E842 PolarHBondContact OH-OE1 3.38Å; E842-Y869 WeakPolarHBondContact O-CE2 3.49Å; E842-Y869 PolarHBondContact O-OH 2.9Å
843	V	85.4	Confident	79.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152	-177.4	-65.4	0	0	0	0	110.5	C822 I824 A867 V874 L885	C822-V843 PolarHBondContact N-O 3.33Å; C822-V843 PolarHBondContact O-N 3.05Å; C822-V843 VanDerWaalsContact O-O 3.12Å; I824-V843 HydrophobicContact CD1-CG1 3.79Å; I824-V843 HydrophobicContact CG1-CG1 4.03Å; I824-V843 HydrophobicContact CG2-CG2 3.85Å; V843-A867 HydrophobicContact CB-CB 4.23Å; V843-A867 HydrophobicContact CG2-CB 3.85Å; V843-V874 HydrophobicContact CG1-CG1 4.13Å; V843-L885 HydrophobicContact CG2-CD1 3.51Å
844	R	84.4	Confident	80.7	Confident	51 Å²	51	49.2 Å²	49.2	19%	0.192	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.8	172.5	64.5	171.5	-173.6	172.6	3.3	110.8	T820 Y821 A867 G868 Y869 E870	T820-R844 WeakPolarHBondContact O-CA 3.44Å; Y821-R844 HydrophobicContact CD1-CB 4.44Å; Y821-R844 HydrophobicContact CE1-CB 4.37Å; R844-A867 CarbonylContact O-C 3.58Å; R844-A867 WeakPolarHBondContact O-CA 3.15Å; R844-G868 WeakPolarHBondContact CG-O 3.22Å; R844-G868 PolarHBondContact NE-O 2.89Å; R844-G868 PolarHBondContact O-N 3.25Å; R844-Y869 HydrophobicContact CG-CD1 4.28Å; R844-Y869 HydrophobicContact CG-CE1 4.17Å; R844-E870 IonicContact CZ-OE1 2.68Å; R844-E870 VanDerWaalsContact NH2-CD 3.3Å; R844-E870 VanDerWaalsContact NH2-CG 3.33Å; R844-E870 IonicContact NH2-OE1 3.31Å; R844-E870 PolarHBondContact NH2-OE1 3.09Å
845	I	89.8	Confident	81.4	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.036	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132	173.3	-57.9	-54.3	0	0	0	110	L816 D819 T820 C822 I865 A867 L885	L816-I845 HydrophobicContact CD1-CD1 4.26Å; L816-I845 HydrophobicContact CD1-CG1 4.31Å; L816-I845 HydrophobicContact CD2-CG1 4.48Å; D819-I845 PolarHBondContact N-O 2.04Å; T820-I845 WeakPolarHBondContact O-CG1 3.08Å; T820-I845 PolarHBondContact O-N 2.93Å; C822-I845 HydrophobicContact CB-CD1 4.45Å; I845-I865 HydrophobicContact CD1-CG2 4.15Å; I845-I865 HydrophobicContact CG2-CG2 4.27Å; I845-A867 HydrophobicContact CD1-CB 3.94Å; I845-L885 HydrophobicContact CD1-CD2 3.97Å
846	I	87.6	Confident	81.6	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.077	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.7	178.5	-62.3	166.6	0	0	0	108.7	H850 C851 C866 P913	I846-H850 HydrophobicContact CG2-CB 3.92Å; I846-C851 HydrophobicContact CG2-CB 4.3Å; I846-C866 HydrophobicContact CB-CB 4.24Å; I846-C866 PolarHBondContact N-O 3.18Å; I846-P913 HydrophobicContact CD1-CB 3.4Å; I846-P913 HydrophobicContact CD1-CG 3.84Å
847	S	88	Confident	81.2	Confident	45 Å²	45	57.3 Å²	57.3	32%	0.315	29%	0.286	S	S	.	.			trans	-65.9	150.5	177.3	65.9	0	0	0	0	111.7	E849 H850 C851	S847-E849 VanDerWaalsContact C-N 3.31Å; S847-E849 PolarHBondContact O-N 3.11Å; S847-H850 PolarHBondContact O-N 2.7Å; S847-H850 VanDerWaalsContact OG-CB 3.31Å; S847-H850 WeakPolarHBondContact OG-CB 2.97Å; S847-H850 PolarHBondContact OG-N 2.99Å; S847-C851 WeakPolarHBondContact O-CB 3.48Å; S847-C851 PolarHBondContact O-N 3.29Å
848	L	84.6	Confident	80.8	Confident	71 Å²	71	56.4 Å²	56.4	37%	0.372	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-43.2	-179	-176	67	0	0	0	112.4	H850 C851 Q852 I860 T862	L848-H850 PolarHBondContact O-N 3.29Å; L848-C851 PolarHBondContact O-N 3.01Å; L848-Q852 WeakPolarHBondContact O-CB 3.21Å; L848-Q852 PolarHBondContact O-N 3.43Å; L848-I860 HydrophobicContact CD1-CB 4.02Å; L848-I860 HydrophobicContact CD1-CG2 3.45Å; L848-I860 VanDerWaalsContact CD1-CG2 3.45Å; L848-T862 HydrophobicContact CD2-CG2 4.1Å
849	E	84.9	Confident	80.6	Confident	173 Å²	173	61 Å²	61	81%	0.808	31%	0.31	S	S	*	.	H	α-helix	trans	-61.9	-44	178.5	-64.5	178.8	179	0	0	112.1	S847 S853	S847-E849 VanDerWaalsContact C-N 3.31Å; S847-E849 PolarHBondContact O-N 3.11Å; E849-S853 PolarHBondContact O-N 3.3Å
850	H	84.3	Confident	80.5	Confident	72 Å²	72	60.2 Å²	60.2	33%	0.333	31%	0.306	S	S	.	.	H	α-helix	trans	-70.6	-38.1	178	-165.1	175.8	0	0	0	110.3	I846 S847 L848 S853 Y854 E870	I846-H850 HydrophobicContact CG2-CB 3.92Å; S847-H850 PolarHBondContact O-N 2.7Å; S847-H850 VanDerWaalsContact OG-CB 3.31Å; S847-H850 WeakPolarHBondContact OG-CB 2.97Å; S847-H850 PolarHBondContact OG-N 2.99Å; L848-H850 PolarHBondContact O-N 3.29Å; H850-S853 WeakPolarHBondContact O-CB 3.35Å; H850-S853 PolarHBondContact O-N 3.07Å; H850-S853 PolarHBondContact O-OG 2.97Å; H850-Y854 AromaticContact CD2-CE2 3.39Å; H850-Y854 WeakPolarHBondContact CD2-CE2 3.01Å; H850-Y854 AromaticContact CD2-CZ 3.98Å; H850-Y854 AromaticContact NE2-CE2 3.53Å; H850-Y854 AromaticContact NE2-CZ 3.65Å; H850-Y854 PolarHBondContact NE2-OH 2.01Å; H850-Y854 WeakPolarHBondContact O-CD2 3.4Å; H850-Y854 WeakPolarHBondContact O-CE2 3.17Å; H850-E870 IonicContact CE1-OE1 3.58Å
851	C	84.4	Confident	80.5	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-44.7	175.9	-171.4	0	0	0	0	112.6	I846 S847 L848 S853 Y854 F855 C866	I846-C851 HydrophobicContact CG2-CB 4.3Å; S847-C851 WeakPolarHBondContact O-CB 3.48Å; S847-C851 PolarHBondContact O-N 3.29Å; L848-C851 PolarHBondContact O-N 3.01Å; C851-S853 PolarHBondContact O-N 3.26Å; C851-Y854 PolarHBondContact O-N 3.48Å; C851-F855 WeakPolarHBondContact O-CD2 3.2Å; C851-C866 HydrophobicContact CB-CB 3.5Å; C851-C866 VanDerWaalsContact CB-CB 3.5Å; C851-C866 WeakPolarHBondContact CB-SG 3.02Å; C851-C866 WeakPolarHBondContact SG-CB 3.28Å; C851-C866 CovalentContact SG-SG 2Å; C851-C866 PolarHBondContact SG-SG 3.21Å
852	Q	84.4	Confident	80.7	Confident	63 Å²	63	64.7 Å²	64.7	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-58.5	-31	177.9	-175.4	60.4	61	0	0	112.3	L848 Y854 F855 K858	L848-Q852 WeakPolarHBondContact O-CB 3.21Å; L848-Q852 PolarHBondContact O-N 3.43Å; Q852-Y854 PolarHBondContact O-N 2.71Å; Q852-F855 PolarHBondContact NE2-O 3.28Å; Q852-F855 CarbonylContact O-C 3.58Å; Q852-F855 PolarHBondContact O-N 3.48Å; Q852-F855 VanDerWaalsContact O-N 3.12Å; Q852-K858 PolarHBondContact NE2-O 3.45Å
853	S	82.1	Confident	80.9	Confident	72 Å²	72	64.6 Å²	64.6	50%	0.503	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.3	177.8	78.1	0	0	0	0	114.6	E849 H850 C851	E849-S853 PolarHBondContact O-N 3.3Å; H850-S853 WeakPolarHBondContact O-CB 3.35Å; H850-S853 PolarHBondContact O-N 3.07Å; H850-S853 PolarHBondContact O-OG 2.97Å; C851-S853 PolarHBondContact O-N 3.26Å
854	Y	73.8	Confident	81.1	Confident	61 Å²	61	65.2 Å²	65.2	24%	0.239	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-16.4	174.2	-67.7	-82.3	0	0	0	112.8	H850 C851 Q852 E870 P913	H850-Y854 AromaticContact CD2-CE2 3.39Å; H850-Y854 WeakPolarHBondContact CD2-CE2 3.01Å; H850-Y854 AromaticContact CD2-CZ 3.98Å; H850-Y854 AromaticContact NE2-CE2 3.53Å; H850-Y854 AromaticContact NE2-CZ 3.65Å; H850-Y854 PolarHBondContact NE2-OH 2.01Å; H850-Y854 WeakPolarHBondContact O-CD2 3.4Å; H850-Y854 WeakPolarHBondContact O-CE2 3.17Å; C851-Y854 PolarHBondContact O-N 3.48Å; Q852-Y854 PolarHBondContact O-N 2.71Å; Y854-E870 WeakPolarHBondContact OH-CG 3.3Å; Y854-P913 HydrophobicContact CD2-CG 4.28Å
855	F	74.3	Confident	81.4	Confident	20 Å²	20	63.7 Å²	63.7	9%	0.088	33%	0.33	C	S	.	.			trans	-122.7	86.2	-172.3	-59.2	-69.1	0	0	0	110.8	C851 Q852 M857 I860 W902 P913 V915	C851-F855 WeakPolarHBondContact O-CD2 3.2Å; Q852-F855 PolarHBondContact NE2-O 3.28Å; Q852-F855 CarbonylContact O-C 3.58Å; Q852-F855 PolarHBondContact O-N 3.48Å; Q852-F855 VanDerWaalsContact O-N 3.12Å; F855-M857 VanDerWaalsContact C-N 3.32Å; F855-M857 PolarHBondContact O-N 3.41Å; F855-I860 HydrophobicContact CB-CD1 4.5Å; F855-I860 HydrophobicContact CD2-CD1 3.69Å; F855-I860 HydrophobicContact CD2-CG1 3.93Å; F855-I860 HydrophobicContact CE2-CD1 4.2Å; F855-I860 HydrophobicContact CG-CD1 4.24Å; F855-W902 HydrophobicContact CD1-CH2 4.3Å; F855-W902 HydrophobicContact CD1-CZ3 4.14Å; F855-W902 HydrophobicContact CE1-CH2 4.32Å; F855-W902 AromaticContact CE1-CZ3 3.85Å; F855-W902 HydrophobicContact CE1-CZ3 3.85Å; F855-W902 HydrophobicContact CG-CH2 4.47Å; F855-W902 HydrophobicContact CZ-CZ3 4.2Å; F855-P913 HydrophobicContact CE2-CG 4.39Å; F855-V915 HydrophobicContact CE2-CG2 3.83Å; F855-V915 HydrophobicContact CZ-CG2 3.88Å
856	D	64.9	Low	81.3	Confident	155 Å²	155	63.5 Å²	63.5	83%	0.829	33%	0.329	S	S	*	.	S	Bend	trans	-70.1	-24.8	-177.9	-71.3	-32.4	0	0	0	114.1
857	M	62.4	Low	81.3	Confident	194 Å²	194	62.8 Å²	62.8	96%	0.956	33%	0.325	S	S	*	.	S	Bend	trans	-106.2	-11.9	-174.6	-62	-176.1	80.5	0	0	114.2	F855	F855-M857 VanDerWaalsContact C-N 3.32Å; F855-M857 PolarHBondContact O-N 3.41Å
858	K	66.9	Low	80.9	Confident	96 Å²	96	60.7 Å²	60.7	42%	0.417	31%	0.311	S	S	.	.	S	Bend	trans	-123.5	133	-177.7	-73.4	-166.7	174.7	-168.2	0	111	Q852 W902	Q852-K858 PolarHBondContact NE2-O 3.45Å; K858-W902 HydrophobicContact CB-CH2 4.28Å; K858-W902 HydrophobicContact CD-CH2 3.77Å; K858-W902 HydrophobicContact CD-CZ2 4.31Å; K858-W902 HydrophobicContact CD-CZ3 4.01Å
859	T	79	Confident	80.3	Confident	100 Å²	100	59.9 Å²	59.9	61%	0.613	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-84.2	117.2	177.3	50.8	0	0	0	0	110.7
860	I	82.1	Confident	79	Confident	12 Å²	12	56.1 Å²	56.1	6%	0.062	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-83.2	122.3	173	-50.2	-60.5	0	0	0	108.6	L848 F855 M864 W902 V915	L848-I860 HydrophobicContact CD1-CB 4.02Å; L848-I860 HydrophobicContact CD1-CG2 3.45Å; L848-I860 VanDerWaalsContact CD1-CG2 3.45Å; F855-I860 HydrophobicContact CB-CD1 4.5Å; F855-I860 HydrophobicContact CD2-CD1 3.69Å; F855-I860 HydrophobicContact CD2-CG1 3.93Å; F855-I860 HydrophobicContact CE2-CD1 4.2Å; F855-I860 HydrophobicContact CG-CD1 4.24Å; I860-M864 HydrophobicContact CD1-SD 4.49Å; I860-M864 HydrophobicContact CG2-CB 3.88Å; I860-M864 HydrophobicContact CG2-SD 4.31Å; I860-W902 HydrophobicContact CD1-CH2 3.67Å; I860-W902 HydrophobicContact CD1-CZ2 3.69Å; I860-V915 HydrophobicContact CD1-CG2 4.39Å
861	T	84.1	Confident	77.6	Confident	23 Å²	23	56.9 Å²	56.9	14%	0.141	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-93.5	166.8	-177.7	69.4	0	0	0	0	111	D786 R863 M864	D786-T861 PolarHBondContact OD1-OG1 3.08Å; T861-R863 PolarHBondContact O-N 2.01Å; T861-R863 VanDerWaalsContact O-N 3.15Å; T861-R863 PolarHBondContact OG1-N 3.33Å; T861-M864 PolarHBondContact O-N 2.8Å
862	T	83.8	Confident	76.1	Confident	85 Å²	85	58.9 Å²	58.9	52%	0.521	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.8	174.2	52.6	0	0	0	0	113.6	L848 N918	L848-T862 HydrophobicContact CD2-CG2 4.1Å; T862-N918 PolarHBondContact O-ND2 3.12Å; T862-N918 VanDerWaalsContact O-ND2 3.13Å
863	R	87.5	Confident	74.6	Confident	41 Å²	41	60.7 Å²	60.7	16%	0.155	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.8	174	-63.1	172.5	-71.5	-83.8	3.5	112.8	D786 Y787 T861 N918 Y921 F922	D786-R863 IonicContact OD1-CZ 2.72Å; D786-R863 IonicContact OD1-NE 3.82Å; D786-R863 PolarHBondContact OD1-NE 3.31Å; D786-R863 IonicContact OD1-NH2 2.89Å; D786-R863 IonicContact OD2-CZ 3.7Å; D786-R863 VanDerWaalsContact OD2-CZ 3.29Å; D786-R863 IonicContact OD2-NE 2.73Å; D786-R863 PolarHBondContact OD2-NE 2.99Å; D786-R863 VanDerWaalsContact OD2-NE 3.14Å; D786-R863 IonicContact OD2-NH2 3.65Å; D786-R863 PolarHBondContact OD2-NH2 2.89Å; Y787-R863 VanDerWaalsContact CZ-CD 3.46Å; T861-R863 PolarHBondContact O-N 2.01Å; T861-R863 VanDerWaalsContact O-N 3.15Å; T861-R863 PolarHBondContact OG1-N 3.33Å; R863-N918 VanDerWaalsContact C-CB 3.43Å; R863-N918 WeakPolarHBondContact O-CB 3.4Å; R863-N918 PolarHBondContact O-N 2.85Å; R863-Y921 HydrophobicContact CG-CD1 3.69Å; R863-Y921 HydrophobicContact CG-CD2 4.2Å; R863-Y921 HydrophobicContact CG-CE1 3.7Å; R863-Y921 HydrophobicContact CG-CE2 4.2Å; R863-Y921 HydrophobicContact CG-CG 3.95Å; R863-F922 HydrophobicContact CB-CE2 4.42Å; R863-F922 HydrophobicContact CB-CZ 4Å; R863-F922 HydrophobicContact CG-CZ 4.2Å
864	M	89.6	Confident	73.3	Confident	13 Å²	13	58.6 Å²	58.6	6%	0.064	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.2	176.7	-60.9	177.1	-176.2	0	0	110.1	V785 D786 I860 T861 W902 V915 Y916	V785-M864 WeakPolarHBondContact O-CE 3.48Å; D786-M864 HydrophobicContact CB-CE 3.98Å; I860-M864 HydrophobicContact CD1-SD 4.49Å; I860-M864 HydrophobicContact CG2-CB 3.88Å; I860-M864 HydrophobicContact CG2-SD 4.31Å; T861-M864 PolarHBondContact O-N 2.8Å; M864-W902 HydrophobicContact SD-CZ2 4.26Å; M864-V915 HydrophobicContact CB-CG1 3.89Å; M864-V915 HydrophobicContact CG-CG1 4.17Å; M864-V915 HydrophobicContact SD-CG1 3.94Å; M864-Y916 CarbonylContact C-O 3.54Å; M864-Y916 WeakPolarHBondContact CA-O 3.04Å
865	I	90.2	Very high	72.5	Confident	19 Å²	19	58 Å²	58	10%	0.097	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.5	173.4	-62.9	171.5	0	0	0	107.4	L816 I845 L885 F897 Y916 N918	L816-I865 HydrophobicContact CD1-CD1 4.3Å; I845-I865 HydrophobicContact CD1-CG2 4.15Å; I845-I865 HydrophobicContact CG2-CG2 4.27Å; I865-L885 HydrophobicContact CG2-CD2 4.4Å; I865-F897 WeakPolarHBondContact CD1-O 3.35Å; I865-Y916 PolarHBondContact N-O 3.16Å; I865-Y916 PolarHBondContact O-N 3.38Å; I865-N918 HydrophobicContact CD1-CB 3.91Å; I865-N918 WeakPolarHBondContact CD1-OD1 3.47Å; I865-N918 HydrophobicContact CG1-CB 3.79Å
866	C	88.5	Confident	71.8	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.8	174	-53.4	0	0	0	0	110.1	I846 C851 P913 G914	I846-C866 HydrophobicContact CB-CB 4.24Å; I846-C866 PolarHBondContact N-O 3.18Å; C851-C866 HydrophobicContact CB-CB 3.5Å; C851-C866 VanDerWaalsContact CB-CB 3.5Å; C851-C866 WeakPolarHBondContact CB-SG 3.02Å; C851-C866 WeakPolarHBondContact SG-CB 3.28Å; C851-C866 CovalentContact SG-SG 2Å; C851-C866 PolarHBondContact SG-SG 3.21Å; C866-P913 HydrophobicContact CB-CB 4.5Å; C866-P913 HydrophobicContact CB-CG 4.18Å; C866-G914 WeakPolarHBondContact CA-O 3.29Å
867	A	86.8	Confident	71.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	139.6	176.8	0	0	0	0	0	110.5	V843 R844 I845 L885 G914 Y916	V843-A867 HydrophobicContact CB-CB 4.23Å; V843-A867 HydrophobicContact CG2-CB 3.85Å; R844-A867 CarbonylContact O-C 3.58Å; R844-A867 WeakPolarHBondContact O-CA 3.15Å; I845-A867 HydrophobicContact CD1-CB 3.94Å; A867-L885 HydrophobicContact CB-CD1 4.24Å; A867-L885 HydrophobicContact CB-CD2 4.22Å; A867-G914 PolarHBondContact N-O 3.26Å; A867-G914 PolarHBondContact O-N 3.17Å; A867-Y916 HydrophobicContact CB-CD2 4.09Å; A867-Y916 HydrophobicContact CB-CE2 3.72Å
868	G	80.4	Confident	71.6	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.01	28%	0.277	C	S	.	.	S	Bend	trans	150.7	-169.6	-178.7	0	0	0	0	0	113.2	R844	R844-G868 WeakPolarHBondContact CG-O 3.22Å; R844-G868 PolarHBondContact NE-O 2.89Å; R844-G868 PolarHBondContact O-N 3.25Å
869	Y	71.2	Confident	71.3	Confident	54 Å²	54	45.4 Å²	45.4	21%	0.212	26%	0.264	C	S	.	.			trans	-116.3	147.5	177.5	-60.2	-82.8	0	0	0	110.8	E842 R844 S871 G872 V874	E842-Y869 WeakPolarHBondContact O-CE2 3.49Å; E842-Y869 PolarHBondContact O-OH 2.9Å; R844-Y869 HydrophobicContact CG-CD1 4.28Å; R844-Y869 HydrophobicContact CG-CE1 4.17Å; Y869-S871 PolarHBondContact O-N 2.03Å; Y869-S871 VanDerWaalsContact O-N 3.14Å; Y869-G872 PolarHBondContact O-N 3.12Å; Y869-V874 HydrophobicContact CD2-CB 4.1Å; Y869-V874 HydrophobicContact CE2-CB 4.09Å; Y869-V874 HydrophobicContact CE2-CG2 4.37Å
870	E	58.7	Low	71.2	Confident	95 Å²	95	41.5 Å²	41.5	44%	0.444	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-29.3	179.1	-70.1	166	-152.3	0	0	112.5	R844 H850 Y854 G872 L911	R844-E870 IonicContact CZ-OE1 2.68Å; R844-E870 VanDerWaalsContact NH2-CD 3.3Å; R844-E870 VanDerWaalsContact NH2-CG 3.33Å; R844-E870 IonicContact NH2-OE1 3.31Å; R844-E870 PolarHBondContact NH2-OE1 3.09Å; H850-E870 IonicContact CE1-OE1 3.58Å; Y854-E870 WeakPolarHBondContact OH-CG 3.3Å; E870-G872 VanDerWaalsContact C-N 3.31Å; E870-L911 VanDerWaalsContact O-CD2 3.26Å; E870-L911 WeakPolarHBondContact O-CD2 3.32Å
871	S	53.9	Low	71.5	Confident	87 Å²	87	41.9 Å²	41.9	61%	0.608	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-4	178.9	-47.7	0	0	0	0	114	Y869 T873	Y869-S871 PolarHBondContact O-N 2.03Å; Y869-S871 VanDerWaalsContact O-N 3.14Å; S871-T873 PolarHBondContact O-N 2.91Å
872	G	54	Low	71.7	Confident	42 Å²	42	40.8 Å²	40.8	43%	0.433	24%	0.236	S	C	.	.			trans	65.8	20.2	-178.3	0	0	0	0	0	114.8	Y869 E870	Y869-G872 PolarHBondContact O-N 3.12Å; E870-G872 VanDerWaalsContact C-N 3.31Å
873	T	51.8	Low	72	Confident	102 Å²	102	36.7 Å²	36.7	63%	0.626	21%	0.212	S	C	*	.			trans	-74.9	-26.1	-170.7	49.2	0	0	0	0	114.5	S871	S871-T873 PolarHBondContact O-N 2.91Å
874	V	55.2	Low	72.3	Confident	27 Å²	27	34.8 Å²	34.8	16%	0.164	20%	0.204	C	C	.	.	S	Bend	trans	-141.6	112.6	177.3	-179.2	0	0	0	0	107.2	V843 Y869	V843-V874 HydrophobicContact CG1-CG1 4.13Å; Y869-V874 HydrophobicContact CD2-CB 4.1Å; Y869-V874 HydrophobicContact CE2-CB 4.09Å; Y869-V874 HydrophobicContact CE2-CG2 4.37Å
875	D	56.6	Low	72.5	Confident	48 Å²	48	34.1 Å²	34.1	26%	0.257	20%	0.201	S	C	.	.			trans	-147.7	161.1	179.1	-157.5	3.6	0	0	0	110.6	G914	D875-G914 VanDerWaalsContact OD1-CA 3.25Å; D875-G914 WeakPolarHBondContact OD1-CA 3.1Å; D875-G914 PolarHBondContact OD1-N 3.48Å; D875-G914 PolarHBondContact OD2-N 3.19Å
876	S	60	Low	72.7	Confident	12 Å²	12	33.2 Å²	33.2	8%	0.084	20%	0.197	C	C	.	.			trans	-80.3	146.9	174.1	55.1	0	0	0	0	111.8	T900 Y916	S876-T900 VanDerWaalsContact CB-CG2 3.47Å; S876-T900 WeakPolarHBondContact OG-CG2 3.12Å; S876-Y916 PolarHBondContact OG-OH 2.95Å
877	C	65.3	Low	72.8	Confident	16 Å²	16	33.3 Å²	33.3	11%	0.108	20%	0.197	C	C	.	.			trans	-127.9	179.3	-175.1	-153.6	0	0	0	0	115.7	H829 G879 D880 C906	H829-C877 WeakPolarHBondContact O-CB 3.36Å; H829-C877 PolarHBondContact O-SG 3.31Å; H829-C877 VanDerWaalsContact O-SG 3.38Å; C877-G879 PolarHBondContact O-N 3.13Å; C877-D880 PolarHBondContact N-OD2 3.2Å; C877-D880 VanDerWaalsContact O-CB 3.29Å; C877-D880 WeakPolarHBondContact O-CB 3.36Å; C877-D880 PolarHBondContact O-N 3.1Å; C877-C906 WeakPolarHBondContact CA-SG 3.18Å; C877-C906 HydrophobicContact CB-CB 4.19Å; C877-C906 WeakPolarHBondContact CB-SG 3.2Å; C877-C906 WeakPolarHBondContact SG-CB 3.09Å; C877-C906 CovalentContact SG-SG 2.01Å; C877-C906 PolarHBondContact SG-SG 2.66Å
878	M	57.5	Low	72.9	Confident	159 Å²	159	38.1 Å²	38.1	78%	0.783	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	122.9	171.1	-79.1	-178.1	151.8	0	0	110	G828 H829	G828-M878 CarbonylContact C-O 3.57Å; G828-M878 WeakPolarHBondContact CA-O 3.46Å; H829-M878 PolarHBondContact N-O 2.84Å
879	G	60.9	Low	73	Confident	14 Å²	14	40.4 Å²	40.4	14%	0.144	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.7	-12.6	-172.5	0	0	0	0	0	114.6	H722 C877	H722-G879 PolarHBondContact NE2-O 3.43Å; H722-G879 VanDerWaalsContact NE2-O 3.07Å; C877-G879 PolarHBondContact O-N 3.13Å
880	D	78.3	Confident	73	Confident	19 Å²	19	44.4 Å²	44.4	10%	0.102	26%	0.262	C	S	.	.			trans	-90.4	-8.4	170.7	-63.3	-44.6	0	0	0	113.1	G826 W827 G828 C877 G882 G883 T900	G826-D880 WeakPolarHBondContact CA-OD1 3.36Å; W827-D880 PolarHBondContact N-OD1 2.94Å; G828-D880 WeakPolarHBondContact CA-OD1 3.47Å; G828-D880 PolarHBondContact N-OD1 2.79Å; C877-D880 PolarHBondContact N-OD2 3.2Å; C877-D880 VanDerWaalsContact O-CB 3.29Å; C877-D880 WeakPolarHBondContact O-CB 3.36Å; C877-D880 PolarHBondContact O-N 3.1Å; D880-G882 PolarHBondContact O-N 2.69Å; D880-G883 WeakPolarHBondContact O-CA 3.38Å; D880-G883 PolarHBondContact O-N 3Å; D880-T900 HydrophobicContact CB-CG2 4.19Å; D880-T900 WeakPolarHBondContact O-CB 3.45Å; D880-T900 PolarHBondContact O-OG1 3.47Å
881	S	87.1	Confident	73.5	Confident	19 Å²	19	43.9 Å²	43.9	13%	0.133	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	132.9	177.5	-68.5	0	0	0	0	111.4	C724 G725 H739 G883 T900	C724-S881 CarbonylContact C-O 3.49Å; C724-S881 VanDerWaalsContact CB-O 3.3Å; C724-S881 WeakPolarHBondContact CB-O 3.49Å; G725-S881 WeakPolarHBondContact CA-O 3.08Å; G725-S881 PolarHBondContact N-O 2.87Å; H739-S881 WeakPolarHBondContact NE2-CB 3.41Å; H739-S881 PolarHBondContact NE2-OG 2.94Å; S881-G883 PolarHBondContact O-N 3.13Å; S881-T900 WeakPolarHBondContact CA-O 3.32Å
882	G	87.7	Confident	74.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	79	-3.9	-174.3	0	0	0	0	0	115	G725 C726 T736 D880 T900	G725-G882 CarbonylContact C-O 3.53Å; G725-G882 CarbonylContact O-C 3.57Å; G725-G882 WeakPolarHBondContact O-CA 3Å; C726-G882 WeakPolarHBondContact CA-O 3.42Å; T736-G882 WeakPolarHBondContact OG1-CA 3.07Å; D880-G882 PolarHBondContact O-N 2.69Å; G882-T900 PolarHBondContact N-O 3.19Å
883	G	90.4	Very high	76.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.271	C	S	.	.			trans	-66.3	157.1	172.9	0	0	0	0	0	113.1	D880 S881 L899 T900	D880-G883 WeakPolarHBondContact O-CA 3.38Å; D880-G883 PolarHBondContact O-N 3Å; S881-G883 PolarHBondContact O-N 3.13Å; G883-L899 WeakPolarHBondContact O-CA 3.49Å; G883-T900 PolarHBondContact O-N 3.32Å; G883-T900 PolarHBondContact O-OG1 3.16Å
884	P	94.7	Very high	78	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	135.9	-176.2	29.6	-29.5	0	0	0	112.9	V727 I824 T825 V886 L896	V727-P884 HydrophobicContact CG1-CB 4.12Å; V727-P884 HydrophobicContact CG2-CB 3.53Å; V727-P884 HydrophobicContact CG2-CG 4.02Å; I824-P884 WeakPolarHBondContact CA-O 3.38Å; T825-P884 VanDerWaalsContact OG1-CG 3.28Å; T825-P884 WeakPolarHBondContact OG1-CG 3.25Å; P884-V886 HydrophobicContact CB-CG1 3.93Å; P884-L896 HydrophobicContact CB-CD1 3.63Å
885	L	93.4	Very high	79.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	105.2	156.5	177.2	71.8	0	0	0	108.4	C822 I824 V843 I845 I865 A867 F897 G898 Y916	C822-L885 HydrophobicContact CB-CD1 3.85Å; C822-L885 HydrophobicContact CB-CG 4.41Å; I824-L885 HydrophobicContact CG2-CB 4.28Å; I824-L885 HydrophobicContact CG2-CD1 3.42Å; I824-L885 VanDerWaalsContact CG2-CD1 3.42Å; I824-L885 HydrophobicContact CG2-CG 4.46Å; V843-L885 HydrophobicContact CG2-CD1 3.51Å; I845-L885 HydrophobicContact CD1-CD2 3.97Å; I865-L885 HydrophobicContact CG2-CD2 4.4Å; A867-L885 HydrophobicContact CB-CD1 4.24Å; A867-L885 HydrophobicContact CB-CD2 4.22Å; L885-F897 PolarHBondContact O-N 3.39Å; L885-G898 WeakPolarHBondContact CB-O 3.17Å; L885-G898 PolarHBondContact N-O 3.49Å; L885-G898 PolarHBondContact O-N 3.3Å; L885-Y916 HydrophobicContact CB-CD1 3.87Å; L885-Y916 HydrophobicContact CB-CE1 4.2Å; L885-Y916 HydrophobicContact CB-CG 4.47Å; L885-Y916 HydrophobicContact CD2-CD1 4.18Å; L885-Y916 HydrophobicContact CD2-CD2 4.25Å; L885-Y916 HydrophobicContact CD2-CG 3.98Å; L885-Y916 HydrophobicContact CG-CD1 4.49Å
886	V	93.9	Very high	81.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.3	-173.8	-73.4	0	0	0	0	112.4	W709 W711 V807 C822 Y823 P884 W894 T895 L896	W709-V886 HydrophobicContact CE3-CG2 4.24Å; W709-V886 HydrophobicContact CH2-CG2 4.48Å; W709-V886 HydrophobicContact CZ3-CG2 3.77Å; W711-V886 HydrophobicContact CZ2-CG2 4.36Å; V807-V886 HydrophobicContact CG2-CG1 3.81Å; C822-V886 WeakPolarHBondContact CA-O 3.06Å; C822-V886 WeakPolarHBondContact CB-O 3.1Å; Y823-V886 PolarHBondContact N-O 2.89Å; Y823-V886 PolarHBondContact O-N 2.9Å; P884-V886 HydrophobicContact CB-CG1 3.93Å; V886-W894 HydrophobicContact CB-CE3 4Å; V886-W894 HydrophobicContact CG2-CE3 3.79Å; V886-W894 HydrophobicContact CG2-CZ3 4.14Å; V886-T895 VanDerWaalsContact CA-O 3.29Å; V886-T895 WeakPolarHBondContact CA-O 3.38Å; V886-L896 HydrophobicContact CG1-CB 4.3Å; V886-L896 HydrophobicContact CG1-CD1 4Å
887	C	91.2	Very high	83.1	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.027	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	143	179.6	-41.8	0	0	0	0	110.2	L816 C822 T895 F897	L816-C887 HydrophobicContact CD2-CB 4.4Å; C822-C887 HydrophobicContact CB-CB 4.05Å; C822-C887 WeakPolarHBondContact CB-SG 3.37Å; C822-C887 WeakPolarHBondContact SG-CB 3.29Å; C822-C887 CovalentContact SG-SG 2.03Å; C822-C887 PolarHBondContact SG-SG 3.33Å; C887-T895 PolarHBondContact N-O 3Å; C887-T895 PolarHBondContact O-N 3.27Å; C887-F897 HydrophobicContact CB-CD2 3.81Å; C887-F897 HydrophobicContact CB-CE2 3.9Å; C887-F897 VanDerWaalsContact SG-CD2 3.52Å
888	E	88.4	Confident	84.4	Confident	102 Å²	102	35.4 Å²	35.4	48%	0.477	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.1	179.3	-169.9	158.7	-135.5	0	0	111	R689 W894	R689-E888 IonicContact NH2-OE1 3.57Å; E888-W894 HydrophobicContact CB-CD2 4.22Å; E888-W894 HydrophobicContact CB-CE3 4.4Å; E888-W894 HydrophobicContact CB-CH2 3.85Å; E888-W894 HydrophobicContact CB-CZ2 3.55Å; E888-W894 HydrophobicContact CB-CZ3 4.25Å; E888-W894 VanDerWaalsContact CD-CZ2 3.43Å; E888-W894 HydrophobicContact CG-CZ2 3.87Å; E888-W894 PolarHBondContact OE1-NE1 3Å
889	K	82.1	Confident	86.1	Confident	49 Å²	49	27.8 Å²	27.8	21%	0.213	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	157.4	173.9	-70.3	-172.8	-179.7	171.7	0	111.7	Q814 G891 G892 R893 T895	Q814-K889 VanDerWaalsContact CD-NZ 3.32Å; K889-G891 PolarHBondContact O-N 2.03Å; K889-G892 PolarHBondContact O-N 3.11Å; K889-G892 VanDerWaalsContact O-N 3.11Å; K889-R893 WeakPolarHBondContact CB-O 3.3Å; K889-R893 PolarHBondContact N-O 2.94Å; K889-T895 VanDerWaalsContact CD-OG1 3.28Å; K889-T895 WeakPolarHBondContact CD-OG1 3.37Å; K889-T895 WeakPolarHBondContact CE-OG1 3.07Å; K889-T895 PolarHBondContact NZ-OG1 2.04Å
890	P	71.3	Confident	87.6	Confident	138 Å²	138	27.4 Å²	27.4	90%	0.896	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	126.4	169.8	-23.5	32.6	0	0	0	110.6
891	G	69.4	Low	88	Confident	84 Å²	84	26.8 Å²	26.8	87%	0.866	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	100.5	7.7	-173.7	0	0	0	0	0	115.4	K889	K889-G891 PolarHBondContact O-N 2.03Å
892	G	76.3	Confident	87.7	Confident	40 Å²	40	27.9 Å²	27.9	41%	0.412	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	24.4	170.8	0	0	0	0	0	114.3	K889	K889-G892 PolarHBondContact O-N 3.11Å; K889-G892 VanDerWaalsContact O-N 3.11Å
893	R	87.2	Confident	86.7	Confident	105 Å²	105	29.2 Å²	29.2	40%	0.396	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.9	-179.5	-174.8	179.6	-73.4	-175.7	0.1	110.2	C808 K889	C808-R893 WeakPolarHBondContact SG-CD 3.44Å; C808-R893 VanDerWaalsContact SG-CG 3.53Å; K889-R893 WeakPolarHBondContact CB-O 3.3Å; K889-R893 PolarHBondContact N-O 2.94Å
894	W	90.8	Very high	85.2	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.015	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.5	-177.1	-70.2	72.3	0	0	0	110.9	G687 R689 W709 W711 C808 Y823 V886 E888	G687-W894 WeakPolarHBondContact CA-O 3.31Å; G687-W894 PolarHBondContact O-N 3.11Å; R689-W894 VanDerWaalsContact NH1-CZ2 3.28Å; W709-W894 HydrophobicContact CH2-CE3 4.14Å; W709-W894 AromaticContact CH2-CH2 3.82Å; W709-W894 HydrophobicContact CH2-CH2 3.82Å; W709-W894 HydrophobicContact CH2-CZ2 4.45Å; W709-W894 AromaticContact CH2-CZ3 3.65Å; W709-W894 HydrophobicContact CH2-CZ3 3.65Å; W709-W894 HydrophobicContact CZ3-CD2 4.11Å; W709-W894 AromaticContact CZ3-CE3 3.67Å; W709-W894 HydrophobicContact CZ3-CE3 3.67Å; W709-W894 HydrophobicContact CZ3-CH2 4.15Å; W709-W894 AromaticContact CZ3-CZ3 3.68Å; W709-W894 HydrophobicContact CZ3-CZ3 3.68Å; W711-W894 HydrophobicContact CH2-CB 3.31Å; W711-W894 HydrophobicContact CH2-CD2 4.33Å; W711-W894 AromaticContact CH2-CG 3.56Å; W711-W894 HydrophobicContact CH2-CG 3.56Å; W711-W894 HydrophobicContact CZ2-CB 3.62Å; W711-W894 HydrophobicContact CZ2-CD2 4.33Å; W711-W894 AromaticContact CZ2-CG 3.93Å; W711-W894 HydrophobicContact CZ2-CG 3.93Å; W711-W894 HydrophobicContact CZ3-CB 4.17Å; C808-W894 WeakPolarHBondContact CB-O 3.14Å; C808-W894 PolarHBondContact N-O 3.09Å; Y823-W894 AromaticContact CD2-CH2 3.5Å; Y823-W894 HydrophobicContact CD2-CH2 3.5Å; Y823-W894 VanDerWaalsContact CD2-CH2 3.5Å; Y823-W894 AromaticContact CD2-CZ3 3.62Å; Y823-W894 HydrophobicContact CD2-CZ3 3.62Å; Y823-W894 AromaticContact CE2-CH2 3.86Å; Y823-W894 HydrophobicContact CE2-CH2 3.86Å; Y823-W894 HydrophobicContact CE2-CZ3 4.43Å; Y823-W894 HydrophobicContact CG-CH2 4.22Å; Y823-W894 HydrophobicContact CG-CZ3 4.15Å; V886-W894 HydrophobicContact CB-CE3 4Å; V886-W894 HydrophobicContact CG2-CE3 3.79Å; V886-W894 HydrophobicContact CG2-CZ3 4.14Å; E888-W894 HydrophobicContact CB-CD2 4.22Å; E888-W894 HydrophobicContact CB-CE3 4.4Å; E888-W894 HydrophobicContact CB-CH2 3.85Å; E888-W894 HydrophobicContact CB-CZ2 3.55Å; E888-W894 HydrophobicContact CB-CZ3 4.25Å; E888-W894 VanDerWaalsContact CD-CZ2 3.43Å; E888-W894 HydrophobicContact CG-CZ2 3.87Å; E888-W894 PolarHBondContact OE1-NE1 3Å
895	T	91.9	Very high	83.1	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.2	-179.4	-53.3	0	0	0	0	109.9	C808 P810 V886 C887 K889 F897	C808-T895 CarbonylContact O-C 3.54Å; C808-T895 WeakPolarHBondContact O-CA 3.3Å; C808-T895 WeakPolarHBondContact O-CG2 3.32Å; P810-T895 HydrophobicContact CB-CG2 3.88Å; V886-T895 VanDerWaalsContact CA-O 3.29Å; V886-T895 WeakPolarHBondContact CA-O 3.38Å; C887-T895 PolarHBondContact N-O 3Å; C887-T895 PolarHBondContact O-N 3.27Å; K889-T895 VanDerWaalsContact CD-OG1 3.28Å; K889-T895 WeakPolarHBondContact CD-OG1 3.37Å; K889-T895 WeakPolarHBondContact CE-OG1 3.07Å; K889-T895 PolarHBondContact NZ-OG1 2.04Å; T895-F897 HydrophobicContact CG2-CD2 4.33Å; T895-F897 HydrophobicContact CG2-CE2 3.95Å; T895-F897 HydrophobicContact CG2-CZ 4.18Å
896	L	93.8	Very high	81.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	123.5	175	-179.1	69.2	0	0	0	109.7	V727 I729 L735 V807 C808 L809 P810 P884 V886 G898 L899 V919	V727-L896 HydrophobicContact CB-CD2 4.39Å; V727-L896 HydrophobicContact CG1-CD1 4.26Å; V727-L896 HydrophobicContact CG1-CD2 4.07Å; V727-L896 HydrophobicContact CG2-CD1 4.35Å; I729-L896 HydrophobicContact CG2-CD2 4.47Å; L735-L896 HydrophobicContact CD1-CD2 3.94Å; V807-L896 HydrophobicContact CG1-CB 3.77Å; V807-L896 HydrophobicContact CG1-CD2 4.19Å; V807-L896 HydrophobicContact CG1-CG 4.5Å; V807-L896 HydrophobicContact CG2-CB 4.07Å; C808-L896 PolarHBondContact O-N 3.39Å; L809-L896 HydrophobicContact CD2-CD2 4.4Å; P810-L896 WeakPolarHBondContact CD-O 3.49Å; P810-L896 WeakPolarHBondContact CG-O 3.09Å; P884-L896 HydrophobicContact CB-CD1 3.63Å; V886-L896 HydrophobicContact CG1-CB 4.3Å; V886-L896 HydrophobicContact CG1-CD1 4Å; L896-G898 VanDerWaalsContact CD1-O 3.24Å; L896-G898 WeakPolarHBondContact CD1-O 3.25Å; L896-L899 HydrophobicContact CD1-CD2 4.31Å; L896-L899 HydrophobicContact CD2-CD2 4.23Å; L896-V919 HydrophobicContact CD2-CG1 4.23Å; L896-V919 HydrophobicContact CD2-CG2 4.12Å; L896-V919 HydrophobicContact CG-CG1 4.43Å; L896-V919 HydrophobicContact CG-CG2 4.08Å
897	F	92.8	Very high	78.9	Confident	5 Å²	5	43.9 Å²	43.9	2%	0.022	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-27.2	178.2	-78.4	-81	0	0	0	113.1	P810 Q814 L816 I865 L885 C887 T895 V919	P810-F897 HydrophobicContact CB-CD1 4.12Å; P810-F897 HydrophobicContact CB-CE1 3.85Å; P810-F897 HydrophobicContact CB-CZ 4.46Å; P810-F897 HydrophobicContact CG-CD1 4.47Å; Q814-F897 HydrophobicContact CG-CE1 4.17Å; Q814-F897 HydrophobicContact CG-CZ 4.34Å; L816-F897 HydrophobicContact CD1-CB 3.35Å; L816-F897 HydrophobicContact CD1-CD1 3.45Å; L816-F897 VanDerWaalsContact CD1-CD1 3.45Å; L816-F897 HydrophobicContact CD1-CD2 3.99Å; L816-F897 HydrophobicContact CD1-CE1 4.16Å; L816-F897 HydrophobicContact CD1-CG 3.34Å; L816-F897 HydrophobicContact CD2-CD1 4.32Å; L816-F897 HydrophobicContact CD2-CD2 4.07Å; L816-F897 HydrophobicContact CD2-CE1 4.28Å; L816-F897 HydrophobicContact CD2-CE2 4.02Å; L816-F897 HydrophobicContact CD2-CG 4.2Å; L816-F897 HydrophobicContact CD2-CZ 4.12Å; L816-F897 HydrophobicContact CG-CB 4.36Å; L816-F897 HydrophobicContact CG-CD1 3.6Å; L816-F897 HydrophobicContact CG-CD2 4.21Å; L816-F897 HydrophobicContact CG-CE1 3.77Å; L816-F897 HydrophobicContact CG-CE2 4.34Å; L816-F897 HydrophobicContact CG-CG 3.82Å; L816-F897 HydrophobicContact CG-CZ 4.13Å; I865-F897 WeakPolarHBondContact CD1-O 3.35Å; L885-F897 PolarHBondContact O-N 3.39Å; C887-F897 HydrophobicContact CB-CD2 3.81Å; C887-F897 HydrophobicContact CB-CE2 3.9Å; C887-F897 VanDerWaalsContact SG-CD2 3.52Å; T895-F897 HydrophobicContact CG2-CD2 4.33Å; T895-F897 HydrophobicContact CG2-CE2 3.95Å; T895-F897 HydrophobicContact CG2-CZ 4.18Å; F897-V919 PolarHBondContact O-N 2.73Å
898	G	92.5	Very high	76.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.3	178.6	0	0	0	0	0	112.7	L885 L896 S917	L885-G898 WeakPolarHBondContact CB-O 3.17Å; L885-G898 PolarHBondContact N-O 3.49Å; L885-G898 PolarHBondContact O-N 3.3Å; L896-G898 VanDerWaalsContact CD1-O 3.24Å; L896-G898 WeakPolarHBondContact CD1-O 3.25Å; G898-S917 WeakPolarHBondContact CA-O 3.18Å
899	L	94.1	Very high	74.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.4	165.4	-65.5	166.5	0	0	0	108.6	V727 L735 T736 V737 I789 G883 L896 S901 Y916 S917 V919	V727-L899 HydrophobicContact CB-CD2 4.43Å; V727-L899 HydrophobicContact CG2-CD2 3.6Å; L735-L899 HydrophobicContact CB-CD1 4.21Å; L735-L899 HydrophobicContact CB-CD2 4.48Å; T736-L899 WeakPolarHBondContact O-CD1 3.04Å; V737-L899 HydrophobicContact CG1-CB 3.79Å; I789-L899 HydrophobicContact CD1-CD1 4.25Å; I789-L899 HydrophobicContact CG1-CD1 4.04Å; G883-L899 WeakPolarHBondContact O-CA 3.49Å; L896-L899 HydrophobicContact CD1-CD2 4.31Å; L896-L899 HydrophobicContact CD2-CD2 4.23Å; L899-S901 PolarHBondContact O-N 2.83Å; L899-Y916 CarbonylContact O-C 3.57Å; L899-Y916 WeakPolarHBondContact O-CA 3.27Å; L899-Y916 WeakPolarHBondContact O-CB 3.39Å; L899-S917 PolarHBondContact N-O 3.48Å; L899-S917 VanDerWaalsContact N-O 3.12Å; L899-S917 PolarHBondContact O-N 3.07Å; L899-V919 HydrophobicContact CD1-CG2 4.14Å; L899-V919 HydrophobicContact CG-CG2 3.83Å
900	T	91.7	Very high	72.7	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	119.2	178.6	-53.8	0	0	0	0	110	V737 S876 D880 S881 G882 G883 Y916	V737-T900 VanDerWaalsContact CG1-O 3.32Å; V737-T900 WeakPolarHBondContact CG1-O 3.04Å; S876-T900 VanDerWaalsContact CB-CG2 3.47Å; S876-T900 WeakPolarHBondContact OG-CG2 3.12Å; D880-T900 HydrophobicContact CB-CG2 4.19Å; D880-T900 WeakPolarHBondContact O-CB 3.45Å; D880-T900 PolarHBondContact O-OG1 3.47Å; S881-T900 WeakPolarHBondContact CA-O 3.32Å; G882-T900 PolarHBondContact N-O 3.19Å; G883-T900 PolarHBondContact O-N 3.32Å; G883-T900 PolarHBondContact O-OG1 3.16Å; T900-Y916 HydrophobicContact CG2-CE1 4.43Å
901	S	87.4	Confident	71.9	Confident	7 Å²	7	51.6 Å²	51.6	5%	0.049	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	-71.5	-174.8	176.5	0	0	0	0	111.3	H739 D788 L899 V915	H739-S901 PolarHBondContact CE1-O 3.3Å; D788-S901 WeakPolarHBondContact OD2-CB 3.19Å; D788-S901 PolarHBondContact OD2-OG 3.49Å; L899-S901 PolarHBondContact O-N 2.83Å; S901-V915 PolarHBondContact N-O 3.34Å
902	W	80.1	Confident	71.7	Confident	41 Å²	41	48 Å²	48	16%	0.155	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	170.1	179.4	62.7	-87.1	0	0	0	110.9	V785 F855 K858 I860 M864 V915	V785-W902 VanDerWaalsContact CG1-CD1 3.5Å; V785-W902 HydrophobicContact CG1-CG 4.27Å; F855-W902 HydrophobicContact CD1-CH2 4.3Å; F855-W902 HydrophobicContact CD1-CZ3 4.14Å; F855-W902 HydrophobicContact CE1-CH2 4.32Å; F855-W902 AromaticContact CE1-CZ3 3.85Å; F855-W902 HydrophobicContact CE1-CZ3 3.85Å; F855-W902 HydrophobicContact CG-CH2 4.47Å; F855-W902 HydrophobicContact CZ-CZ3 4.2Å; K858-W902 HydrophobicContact CB-CH2 4.28Å; K858-W902 HydrophobicContact CD-CH2 3.77Å; K858-W902 HydrophobicContact CD-CZ2 4.31Å; K858-W902 HydrophobicContact CD-CZ3 4.01Å; I860-W902 HydrophobicContact CD1-CH2 3.67Å; I860-W902 HydrophobicContact CD1-CZ2 3.69Å; M864-W902 HydrophobicContact SD-CZ2 4.26Å; W902-V915 HydrophobicContact CD2-CB 4.09Å; W902-V915 HydrophobicContact CD2-CG2 4.27Å; W902-V915 HydrophobicContact CE3-CG2 4.26Å; W902-V915 HydrophobicContact CG-CB 4.43Å; W902-V915 HydrophobicContact CH2-CG2 4.02Å; W902-V915 HydrophobicContact CZ2-CB 4.26Å; W902-V915 HydrophobicContact CZ2-CG1 4.06Å; W902-V915 HydrophobicContact CZ2-CG2 4.03Å; W902-V915 HydrophobicContact CZ3-CG2 4.13Å; W902-V915 PolarHBondContact N-O 3.08Å; W902-V915 CarbonylContact O-C 3.29Å; W902-V915 VanDerWaalsContact O-CA 3.3Å; W902-V915 WeakPolarHBondContact O-CA 3.25Å; W902-V915 VanDerWaalsContact O-CB 3.27Å; W902-V915 WeakPolarHBondContact O-CB 3.26Å; W902-V915 PolarHBondContact O-N 2.88Å
903	G	68.4	Low	71.7	Confident	28 Å²	28	46.3 Å²	46.3	29%	0.289	24%	0.244	S	C	.	.			trans	-168.8	177.1	178.7	0	0	0	0	0	111.9	V905	G903-V905 PolarHBondContact O-N 3.24Å
904	S	57.1	Low	71.5	Confident	20 Å²	20	41.3 Å²	41.3	14%	0.14	23%	0.225	C	C	.	.	S	Bend	trans	-59	122.2	168.8	-71.2	0	0	0	0	108.4	C906 V910	S904-C906 PolarHBondContact O-N 2.85Å; S904-C906 VanDerWaalsContact O-N 3.11Å; S904-V910 WeakPolarHBondContact CB-O 3.16Å
905	V	51	Low	71.4	Confident	110 Å²	110	41.1 Å²	41.1	67%	0.667	23%	0.225	S	C	*	.			trans	-41.3	120.8	-176.4	-176.6	0	0	0	0	110	G903 F907 S908	G903-V905 PolarHBondContact O-N 3.24Å; V905-F907 PolarHBondContact O-N 3.05Å; V905-S908 VanDerWaalsContact O-CB 3.25Å; V905-S908 WeakPolarHBondContact O-CB 3.34Å; V905-S908 PolarHBondContact O-N 2.97Å
906	C	51.6	Low	71.3	Confident	36 Å²	36	41 Å²	41	24%	0.243	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	134.1	174.6	-44.6	0	0	0	0	108.6	C877 S904 S908	C877-C906 WeakPolarHBondContact CA-SG 3.18Å; C877-C906 HydrophobicContact CB-CB 4.19Å; C877-C906 WeakPolarHBondContact CB-SG 3.2Å; C877-C906 WeakPolarHBondContact SG-CB 3.09Å; C877-C906 CovalentContact SG-SG 2.01Å; C877-C906 PolarHBondContact SG-SG 2.66Å; S904-C906 PolarHBondContact O-N 2.85Å; S904-C906 VanDerWaalsContact O-N 3.11Å; C906-S908 VanDerWaalsContact C-N 3.3Å; C906-S908 PolarHBondContact O-N 2.71Å
907	F	47.9	Very low	71.3	Confident	142 Å²	142	41.3 Å²	41.3	62%	0.623	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.9	4.4	-178.3	-40.1	-72	0	0	0	115.9	M830 G831 V905	M830-F907 VanDerWaalsContact C-CZ 3.43Å; G831-F907 VanDerWaalsContact CA-CE1 3.49Å; V905-F907 PolarHBondContact O-N 3.05Å
908	S	43.7	Very low	71.2	Confident	59 Å²	59	41.8 Å²	41.8	41%	0.413	23%	0.229	S	C	.	.			trans	-80.7	144	164.1	-179.9	0	0	0	0	111.2	V905 C906 V910	V905-S908 VanDerWaalsContact O-CB 3.25Å; V905-S908 WeakPolarHBondContact O-CB 3.34Å; V905-S908 PolarHBondContact O-N 2.97Å; C906-S908 VanDerWaalsContact C-N 3.3Å; C906-S908 PolarHBondContact O-N 2.71Å; S908-V910 PolarHBondContact O-N 3.34Å; S908-V910 VanDerWaalsContact O-N 3.08Å; S908-V910 WeakPolarHBondContact OG-CG2 3.28Å; S908-V910 PolarHBondContact OG-N 3.28Å
909	K	40	Very low	71.2	Confident	203 Å²	203	41.8 Å²	41.8	88%	0.883	23%	0.229	S	C	*	.	S	Bend	trans	-69.3	3	173	-67.2	-170.8	176.8	-168.1	0	113.7	L911	K909-L911 PolarHBondContact O-N 2.95Å
910	V	47.1	Very low	71	Confident	89 Å²	89	42.3 Å²	42.3	54%	0.539	23%	0.233	S	C	.	.			trans	-84	95.6	175.1	-176.9	0	0	0	0	108	S904 S908 G912	S904-V910 WeakPolarHBondContact CB-O 3.16Å; S908-V910 PolarHBondContact O-N 3.34Å; S908-V910 VanDerWaalsContact O-N 3.08Å; S908-V910 WeakPolarHBondContact OG-CG2 3.28Å; S908-V910 PolarHBondContact OG-N 3.28Å; V910-G912 PolarHBondContact O-N 2.73Å
911	L	55.8	Low	70.8	Confident	105 Å²	105	47 Å²	47	55%	0.55	25%	0.25	S	S	.	.			trans	-63.3	117.8	174.7	-71.1	137.2	0	0	0	109.6	E870 K909	E870-L911 VanDerWaalsContact O-CD2 3.26Å; E870-L911 WeakPolarHBondContact O-CD2 3.32Å; K909-L911 PolarHBondContact O-N 2.95Å
912	G	63.7	Low	70.8	Confident	8 Å²	8	46.8 Å²	46.8	8%	0.082	25%	0.249	C	C	.	.			trans	-163.1	154.3	172.9	0	0	0	0	0	110.7	V910	V910-G912 PolarHBondContact O-N 2.73Å
913	P	77.3	Confident	71.2	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.026	24%	0.241	C	C	.	.			trans	-77.1	158.1	179.1	32.7	-35.4	0	0	0	112.5	I846 Y854 F855 C866	I846-P913 HydrophobicContact CD1-CB 3.4Å; I846-P913 HydrophobicContact CD1-CG 3.84Å; Y854-P913 HydrophobicContact CD2-CG 4.28Å; F855-P913 HydrophobicContact CE2-CG 4.39Å; C866-P913 HydrophobicContact CB-CB 4.5Å; C866-P913 HydrophobicContact CB-CG 4.18Å
914	G	82.5	Confident	71.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	142.9	168.8	0	0	0	0	0	112	C866 A867 D875 Y916	C866-G914 WeakPolarHBondContact CA-O 3.29Å; A867-G914 PolarHBondContact N-O 3.26Å; A867-G914 PolarHBondContact O-N 3.17Å; D875-G914 VanDerWaalsContact OD1-CA 3.25Å; D875-G914 WeakPolarHBondContact OD1-CA 3.1Å; D875-G914 PolarHBondContact OD1-N 3.48Å; D875-G914 PolarHBondContact OD2-N 3.19Å; G914-Y916 WeakPolarHBondContact O-CD2 3.09Å; G914-Y916 VanDerWaalsContact O-CE2 3.3Å; G914-Y916 WeakPolarHBondContact O-CE2 3.19Å
915	V	88.2	Confident	73.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.1	178.8	-172.6	0	0	0	0	109.6	F855 I860 M864 S901 W902	F855-V915 HydrophobicContact CE2-CG2 3.83Å; F855-V915 HydrophobicContact CZ-CG2 3.88Å; I860-V915 HydrophobicContact CD1-CG2 4.39Å; M864-V915 HydrophobicContact CB-CG1 3.89Å; M864-V915 HydrophobicContact CG-CG1 4.17Å; M864-V915 HydrophobicContact SD-CG1 3.94Å; S901-V915 PolarHBondContact N-O 3.34Å; W902-V915 HydrophobicContact CD2-CB 4.09Å; W902-V915 HydrophobicContact CD2-CG2 4.27Å; W902-V915 HydrophobicContact CE3-CG2 4.26Å; W902-V915 HydrophobicContact CG-CB 4.43Å; W902-V915 HydrophobicContact CH2-CG2 4.02Å; W902-V915 HydrophobicContact CZ2-CB 4.26Å; W902-V915 HydrophobicContact CZ2-CG1 4.06Å; W902-V915 HydrophobicContact CZ2-CG2 4.03Å; W902-V915 HydrophobicContact CZ3-CG2 4.13Å; W902-V915 PolarHBondContact N-O 3.08Å; W902-V915 CarbonylContact O-C 3.29Å; W902-V915 VanDerWaalsContact O-CA 3.3Å; W902-V915 WeakPolarHBondContact O-CA 3.25Å; W902-V915 VanDerWaalsContact O-CB 3.27Å; W902-V915 WeakPolarHBondContact O-CB 3.26Å; W902-V915 PolarHBondContact O-N 2.88Å
916	Y	91.3	Very high	75	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.8	-173.2	-57.8	-100.6	0	0	0	109.9	I824 M864 I865 A867 S876 L885 L899 T900 G914 N918	I824-Y916 HydrophobicContact CG2-CE1 3.77Å; M864-Y916 CarbonylContact C-O 3.54Å; M864-Y916 WeakPolarHBondContact CA-O 3.04Å; I865-Y916 PolarHBondContact N-O 3.16Å; I865-Y916 PolarHBondContact O-N 3.38Å; A867-Y916 HydrophobicContact CB-CD2 4.09Å; A867-Y916 HydrophobicContact CB-CE2 3.72Å; S876-Y916 PolarHBondContact OG-OH 2.95Å; L885-Y916 HydrophobicContact CB-CD1 3.87Å; L885-Y916 HydrophobicContact CB-CE1 4.2Å; L885-Y916 HydrophobicContact CB-CG 4.47Å; L885-Y916 HydrophobicContact CD2-CD1 4.18Å; L885-Y916 HydrophobicContact CD2-CD2 4.25Å; L885-Y916 HydrophobicContact CD2-CG 3.98Å; L885-Y916 HydrophobicContact CG-CD1 4.49Å; L899-Y916 CarbonylContact O-C 3.57Å; L899-Y916 WeakPolarHBondContact O-CA 3.27Å; L899-Y916 WeakPolarHBondContact O-CB 3.39Å; T900-Y916 HydrophobicContact CG2-CE1 4.43Å; G914-Y916 WeakPolarHBondContact O-CD2 3.09Å; G914-Y916 VanDerWaalsContact O-CE2 3.3Å; G914-Y916 WeakPolarHBondContact O-CE2 3.19Å; Y916-N918 PolarHBondContact O-N 3.39Å
917	S	92.6	Very high	76.5	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.035	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	125	172.9	-59.7	0	0	0	0	110.3	D788 G898 L899 V919	D788-S917 WeakPolarHBondContact O-CB 3.11Å; D788-S917 PolarHBondContact O-OG 2.55Å; G898-S917 WeakPolarHBondContact CA-O 3.18Å; L899-S917 PolarHBondContact N-O 3.48Å; L899-S917 VanDerWaalsContact N-O 3.12Å; L899-S917 PolarHBondContact O-N 3.07Å; S917-V919 PolarHBondContact O-N 3.24Å
918	N	91.8	Very high	78.1	Confident	15 Å²	15	43 Å²	43	8%	0.08	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	98.1	-177	-173.4	-9.7	0	0	0	111.5	T862 R863 I865 Y916 S920 Y921 F922	T862-N918 PolarHBondContact O-ND2 3.12Å; T862-N918 VanDerWaalsContact O-ND2 3.13Å; R863-N918 VanDerWaalsContact C-CB 3.43Å; R863-N918 WeakPolarHBondContact O-CB 3.4Å; R863-N918 PolarHBondContact O-N 2.85Å; I865-N918 HydrophobicContact CD1-CB 3.91Å; I865-N918 WeakPolarHBondContact CD1-OD1 3.47Å; I865-N918 HydrophobicContact CG1-CB 3.79Å; Y916-N918 PolarHBondContact O-N 3.39Å; N918-S920 PolarHBondContact O-N 3.03Å; N918-S920 VanDerWaalsContact OD1-CB 3.28Å; N918-S920 WeakPolarHBondContact OD1-CB 3.19Å; N918-S920 PolarHBondContact OD1-N 2.91Å; N918-S920 VanDerWaalsContact OD1-N 3.1Å; N918-S920 PolarHBondContact OD1-OG 2.8Å; N918-Y921 WeakPolarHBondContact O-CB 3.21Å; N918-Y921 PolarHBondContact O-N 3.47Å; N918-F922 WeakPolarHBondContact O-CD2 3.49Å
919	V	92	Very high	80	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-29.7	-178.3	177.6	0	0	0	0	111.8	L809 P810 L896 F897 L899 S917 Y921 F922 V923 I926	L809-V919 HydrophobicContact CD2-CG1 3.93Å; P810-V919 HydrophobicContact CG-CG1 4.4Å; L896-V919 HydrophobicContact CD2-CG1 4.23Å; L896-V919 HydrophobicContact CD2-CG2 4.12Å; L896-V919 HydrophobicContact CG-CG1 4.43Å; L896-V919 HydrophobicContact CG-CG2 4.08Å; F897-V919 PolarHBondContact O-N 2.73Å; L899-V919 HydrophobicContact CD1-CG2 4.14Å; L899-V919 HydrophobicContact CG-CG2 3.83Å; S917-V919 PolarHBondContact O-N 3.24Å; V919-Y921 PolarHBondContact O-N 3.42Å; V919-F922 CarbonylContact O-C 3.59Å; V919-F922 PolarHBondContact O-N 2.75Å; V919-V923 VanDerWaalsContact O-CG2 3.24Å; V919-V923 WeakPolarHBondContact O-CG2 3.48Å; V919-V923 PolarHBondContact O-N 2.68Å; V919-V923 VanDerWaalsContact O-N 3.11Å; V919-I926 HydrophobicContact CG1-CD1 4.07Å
920	S	89.3	Confident	82.1	Confident	12 Å²	12	33.8 Å²	33.8	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-35.6	179.7	-43	0	0	0	0	112.4	N918	N918-S920 PolarHBondContact O-N 3.03Å; N918-S920 VanDerWaalsContact OD1-CB 3.28Å; N918-S920 WeakPolarHBondContact OD1-CB 3.19Å; N918-S920 PolarHBondContact OD1-N 2.91Å; N918-S920 VanDerWaalsContact OD1-N 3.1Å; N918-S920 PolarHBondContact OD1-OG 2.8Å
921	Y	87.9	Confident	83.6	Confident	102 Å²	102	30 Å²	30	40%	0.4	14%	0.14	S	C	.	.	H	α-helix	trans	-69.8	-34.7	176.1	-167.9	-87.2	0	0	0	112	R863 N918 V919	R863-Y921 HydrophobicContact CG-CD1 3.69Å; R863-Y921 HydrophobicContact CG-CD2 4.2Å; R863-Y921 HydrophobicContact CG-CE1 3.7Å; R863-Y921 HydrophobicContact CG-CE2 4.2Å; R863-Y921 HydrophobicContact CG-CG 3.95Å; N918-Y921 WeakPolarHBondContact O-CB 3.21Å; N918-Y921 PolarHBondContact O-N 3.47Å; V919-Y921 PolarHBondContact O-N 3.42Å
922	F	88.5	Confident	84.6	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.018	12%	0.116	C	C	.	.	H	α-helix	trans	-93.1	1	-175	-58.5	-64.6	0	0	0	114.4	Y787 I789 R863 N918 V919 E924 W925 I926	Y787-F922 AromaticContact CD1-CE1 3.59Å; Y787-F922 HydrophobicContact CD1-CE1 3.59Å; Y787-F922 HydrophobicContact CD1-CZ 4.06Å; Y787-F922 HydrophobicContact CE1-CE1 4.04Å; I789-F922 HydrophobicContact CB-CD2 4.39Å; I789-F922 HydrophobicContact CD1-CB 3.6Å; I789-F922 HydrophobicContact CD1-CD2 3.83Å; I789-F922 HydrophobicContact CD1-CG 3.87Å; I789-F922 HydrophobicContact CG2-CD1 4.07Å; I789-F922 HydrophobicContact CG2-CD2 4.14Å; I789-F922 HydrophobicContact CG2-CE1 4.31Å; I789-F922 HydrophobicContact CG2-CE2 4.36Å; I789-F922 HydrophobicContact CG2-CG 4Å; I789-F922 HydrophobicContact CG2-CZ 4.44Å; R863-F922 HydrophobicContact CB-CE2 4.42Å; R863-F922 HydrophobicContact CB-CZ 4Å; R863-F922 HydrophobicContact CG-CZ 4.2Å; N918-F922 WeakPolarHBondContact O-CD2 3.49Å; V919-F922 CarbonylContact O-C 3.59Å; V919-F922 PolarHBondContact O-N 2.75Å; F922-E924 VanDerWaalsContact C-N 3.25Å; F922-E924 PolarHBondContact O-N 3.38Å; F922-W925 PolarHBondContact O-N 2.72Å; F922-I926 HydrophobicContact CB-CD1 4.2Å; F922-I926 HydrophobicContact CB-CG1 4.46Å; F922-I926 WeakPolarHBondContact O-CD1 3.35Å; F922-I926 VanDerWaalsContact O-CG1 3.23Å; F922-I926 WeakPolarHBondContact O-CG1 3.46Å; F922-I926 PolarHBondContact O-N 3.42Å
923	V	87.1	Confident	85.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.8	-41	-176.5	174.7	0	0	0	0	112.3	P810 P812 V919 I926 K927	P810-V923 HydrophobicContact CG-CG2 3.77Å; P812-V923 HydrophobicContact CG-CG1 4.4Å; V919-V923 VanDerWaalsContact O-CG2 3.24Å; V919-V923 WeakPolarHBondContact O-CG2 3.48Å; V919-V923 PolarHBondContact O-N 2.68Å; V919-V923 VanDerWaalsContact O-N 3.11Å; V923-I926 PolarHBondContact O-N 2.71Å; V923-K927 HydrophobicContact CG1-CD 4.19Å; V923-K927 HydrophobicContact CG1-CG 4.46Å; V923-K927 WeakPolarHBondContact O-CG 3.25Å; V923-K927 PolarHBondContact O-N 3.49Å
924	E	83	Confident	85.1	Confident	131 Å²	131	27.5 Å²	27.5	61%	0.612	13%	0.125	S	C	*	.	H	α-helix	trans	-65.5	-48.7	179.7	-172.2	173	-179.4	0	0	111.3	F922 I926 K927 R928	F922-E924 VanDerWaalsContact C-N 3.25Å; F922-E924 PolarHBondContact O-N 3.38Å; E924-I926 VanDerWaalsContact C-N 3.33Å; E924-I926 PolarHBondContact O-N 2.73Å; E924-K927 PolarHBondContact O-N 3.32Å; E924-R928 WeakPolarHBondContact O-CB 3.11Å; E924-R928 PolarHBondContact O-N 2.77Å
925	W	85.9	Confident	84.4	Confident	37 Å²	37	28.7 Å²	28.7	14%	0.14	13%	0.13	C	C	.	.	H	α-helix	trans	-57.3	-44.9	173.9	178.7	81.2	0	0	0	111.9	I775 H777 I789 I791 F922 K927 R928 Q929	I775-W925 HydrophobicContact CG2-CZ2 4.18Å; H777-W925 HydrophobicContact CB-CH2 4.3Å; H777-W925 HydrophobicContact CB-CZ2 4.17Å; H777-W925 AromaticContact CD2-CD2 3.73Å; H777-W925 AromaticContact CD2-CE2 3.59Å; H777-W925 AromaticContact CD2-CZ2 3.97Å; H777-W925 AromaticContact CD2-NE1 3.82Å; I789-W925 HydrophobicContact CD1-CZ3 4.38Å; I789-W925 HydrophobicContact CG1-CZ3 4.18Å; I789-W925 HydrophobicContact CG2-CE3 4.23Å; I789-W925 HydrophobicContact CG2-CH2 4.4Å; I789-W925 HydrophobicContact CG2-CZ3 3.82Å; I791-W925 HydrophobicContact CD1-CE3 3.86Å; I791-W925 HydrophobicContact CD1-CH2 3.65Å; I791-W925 HydrophobicContact CD1-CZ2 4.33Å; I791-W925 HydrophobicContact CD1-CZ3 3.39Å; I791-W925 HydrophobicContact CG1-CE3 4.45Å; I791-W925 HydrophobicContact CG1-CH2 3.8Å; I791-W925 HydrophobicContact CG1-CZ3 3.57Å; F922-W925 PolarHBondContact O-N 2.72Å; W925-K927 PolarHBondContact O-N 2.75Å; W925-R928 PolarHBondContact O-N 2.72Å; W925-Q929 HydrophobicContact CD2-CG 4.07Å; W925-Q929 HydrophobicContact CG-CG 4.41Å; W925-Q929 HydrophobicContact CZ2-CG 3.88Å; W925-Q929 WeakPolarHBondContact O-CG 3.39Å; W925-Q929 PolarHBondContact O-N 3.48Å
926	I	87.6	Confident	83.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.7	-50	178.2	-66.4	159.2	0	0	0	111.2	I729 L735 I789 I791 L809 V919 F922 V923 E924 R928 Q929 I930	I729-I926 HydrophobicContact CD1-CG2 3.85Å; L735-I926 HydrophobicContact CD1-CD1 3.81Å; L735-I926 HydrophobicContact CD2-CD1 4.27Å; L735-I926 HydrophobicContact CD2-CG1 4.15Å; L735-I926 HydrophobicContact CD2-CG2 4.19Å; I789-I926 HydrophobicContact CD1-CD1 3.95Å; I789-I926 HydrophobicContact CD1-CG1 4.24Å; I791-I926 HydrophobicContact CD1-CB 4.34Å; I791-I926 HydrophobicContact CD1-CG1 4.27Å; I791-I926 HydrophobicContact CD1-CG2 4.38Å; L809-I926 HydrophobicContact CD1-CG2 4.09Å; V919-I926 HydrophobicContact CG1-CD1 4.07Å; F922-I926 HydrophobicContact CB-CD1 4.2Å; F922-I926 HydrophobicContact CB-CG1 4.46Å; F922-I926 WeakPolarHBondContact O-CD1 3.35Å; F922-I926 VanDerWaalsContact O-CG1 3.23Å; F922-I926 WeakPolarHBondContact O-CG1 3.46Å; F922-I926 PolarHBondContact O-N 3.42Å; V923-I926 PolarHBondContact O-N 2.71Å; E924-I926 VanDerWaalsContact C-N 3.33Å; E924-I926 PolarHBondContact O-N 2.73Å; I926-R928 VanDerWaalsContact C-N 3.32Å; I926-R928 PolarHBondContact O-N 3.26Å; I926-Q929 PolarHBondContact O-N 2.74Å; I926-I930 HydrophobicContact CG2-CD1 3.8Å; I926-I930 VanDerWaalsContact O-CG1 3.25Å; I926-I930 WeakPolarHBondContact O-CG1 3.26Å; I926-I930 PolarHBondContact O-N 3.44Å; I926-I930 VanDerWaalsContact O-N 3.08Å
927	K	83.7	Confident	81.6	Confident	90 Å²	90	36 Å²	36	39%	0.391	17%	0.168	S	C	.	.	H	α-helix	trans	-62.2	-42.1	-179.5	-74	176.9	177.7	-178.7	0	111.7	W583 V923 E924 W925 I930 Y931	W583-K927 HydrophobicContact CH2-CB 3.78Å; W583-K927 WeakPolarHBondContact CH2-O 3.15Å; W583-K927 HydrophobicContact CZ2-CB 3.97Å; V923-K927 HydrophobicContact CG1-CD 4.19Å; V923-K927 HydrophobicContact CG1-CG 4.46Å; V923-K927 WeakPolarHBondContact O-CG 3.25Å; V923-K927 PolarHBondContact O-N 3.49Å; E924-K927 PolarHBondContact O-N 3.32Å; W925-K927 PolarHBondContact O-N 2.75Å; K927-I930 PolarHBondContact O-N 3.35Å; K927-Y931 PolarHBondContact O-N 3.37Å; K927-Y931 VanDerWaalsContact O-N 3.08Å
928	R	81.5	Confident	79.6	Confident	38 Å²	38	42.9 Å²	42.9	14%	0.143	21%	0.205	C	C	.	.	H	α-helix	trans	-63.9	-48.3	179.7	179.9	170.3	166.8	-162.9	-8.4	112	A559 D578 S580 W583 E924 W925 I926 I930 Y931 I932	A559-R928 VanDerWaalsContact CB-NH1 3.25Å; D578-R928 VanDerWaalsContact CB-NH2 3.34Å; D578-R928 PolarHBondContact O-NH2 2.79Å; D578-R928 IonicContact OD1-NH2 2.85Å; D578-R928 PolarHBondContact OD1-NH2 3.48Å; D578-R928 IonicContact OD2-CZ 3.63Å; D578-R928 IonicContact OD2-NH1 3.82Å; D578-R928 IonicContact OD2-NH2 3.52Å; D578-R928 PolarHBondContact OD2-NH2 2.8Å; S580-R928 VanDerWaalsContact OG-CZ 3.27Å; S580-R928 PolarHBondContact OG-NH1 3.48Å; S580-R928 PolarHBondContact OG-NH2 2.77Å; W583-R928 HydrophobicContact CD2-CB 4.02Å; W583-R928 HydrophobicContact CD2-CG 3.92Å; W583-R928 HydrophobicContact CE3-CB 4.29Å; W583-R928 HydrophobicContact CE3-CG 4.23Å; W583-R928 HydrophobicContact CG-CG 4.2Å; W583-R928 HydrophobicContact CH2-CB 4.24Å; W583-R928 HydrophobicContact CZ2-CB 3.9Å; W583-R928 HydrophobicContact CZ3-CB 4.46Å; E924-R928 WeakPolarHBondContact O-CB 3.11Å; E924-R928 PolarHBondContact O-N 2.77Å; W925-R928 PolarHBondContact O-N 2.72Å; I926-R928 VanDerWaalsContact C-N 3.32Å; I926-R928 PolarHBondContact O-N 3.26Å; R928-I930 VanDerWaalsContact C-N 3.33Å; R928-I930 PolarHBondContact O-N 3.19Å; R928-Y931 WeakPolarHBondContact O-CB 3.36Å; R928-Y931 PolarHBondContact O-N 2.9Å; R928-Y931 VanDerWaalsContact O-N 3.13Å; R928-I932 HydrophobicContact CG-CD1 3.75Å; R928-I932 HydrophobicContact CG-CG1 4.39Å; R928-I932 WeakPolarHBondContact O-CG1 3.05Å; R928-I932 PolarHBondContact O-N 3.33Å
929	Q	84.3	Confident	78.9	Confident	33 Å²	33	44.3 Å²	44.3	15%	0.154	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-42.4	177.6	-70	-56.4	-44.5	0	0	112	I775 I791 W925 I926 Y931 I932 Q933	I775-Q929 HydrophobicContact CG2-CG 4.38Å; I791-Q929 HydrophobicContact CD1-CB 3.52Å; I791-Q929 HydrophobicContact CD1-CG 3.96Å; W925-Q929 HydrophobicContact CD2-CG 4.07Å; W925-Q929 HydrophobicContact CG-CG 4.41Å; W925-Q929 HydrophobicContact CZ2-CG 3.88Å; W925-Q929 WeakPolarHBondContact O-CG 3.39Å; W925-Q929 PolarHBondContact O-N 3.48Å; I926-Q929 PolarHBondContact O-N 2.74Å; Q929-Y931 VanDerWaalsContact C-N 3.28Å; Q929-Y931 PolarHBondContact O-N 3.18Å; Q929-I932 PolarHBondContact O-N 3.34Å; Q929-Q933 WeakPolarHBondContact O-CB 3.34Å; Q929-Q933 WeakPolarHBondContact O-CG 3.44Å; Q929-Q933 PolarHBondContact O-N 2.72Å; Q929-Q933 VanDerWaalsContact O-N 3.13Å
930	I	83.6	Confident	78.3	Confident	36 Å²	36	46.6 Å²	46.6	19%	0.185	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-42.3	175.5	-71.5	170.8	0	0	0	111	I729 W733 I926 K927 R928 T934	I729-I930 HydrophobicContact CD1-CD1 3.77Å; W733-I930 HydrophobicContact CB-CD1 4.32Å; W733-I930 HydrophobicContact CD2-CB 4.45Å; W733-I930 HydrophobicContact CD2-CD1 4.36Å; W733-I930 HydrophobicContact CD2-CG1 3.72Å; W733-I930 HydrophobicContact CD2-CG2 4.32Å; W733-I930 HydrophobicContact CE3-CG1 3.93Å; W733-I930 HydrophobicContact CG-CD1 4.15Å; W733-I930 HydrophobicContact CG-CG1 4.02Å; W733-I930 HydrophobicContact CG-CG2 4.46Å; W733-I930 HydrophobicContact CZ2-CB 4.43Å; W733-I930 HydrophobicContact CZ2-CG1 4.47Å; W733-I930 HydrophobicContact CZ2-CG2 4.21Å; W733-I930 HydrophobicContact CZ3-CG1 4.39Å; I926-I930 HydrophobicContact CG2-CD1 3.8Å; I926-I930 VanDerWaalsContact O-CG1 3.25Å; I926-I930 WeakPolarHBondContact O-CG1 3.26Å; I926-I930 PolarHBondContact O-N 3.44Å; I926-I930 VanDerWaalsContact O-N 3.08Å; K927-I930 PolarHBondContact O-N 3.35Å; R928-I930 VanDerWaalsContact C-N 3.33Å; R928-I930 PolarHBondContact O-N 3.19Å; I930-T934 WeakPolarHBondContact O-CB 3.37Å; I930-T934 PolarHBondContact O-N 3.35Å; I930-T934 PolarHBondContact O-OG1 3.16Å
931	Y	79.1	Confident	77.6	Confident	11 Å²	11	48.6 Å²	48.6	4%	0.043	23%	0.23	C	C	.	.	H	α-helix	trans	-68.3	-50	-179.8	174.4	-86.7	0	0	0	113.1	E582 W583 Q625 K927 R928 Q929 Q933 T934 F935 L936	E582-Y931 WeakPolarHBondContact O-CE1 3.36Å; E582-Y931 PolarHBondContact O-OH 3.5Å; W583-Y931 AromaticContact CE3-CD1 3.53Å; W583-Y931 HydrophobicContact CE3-CD1 3.53Å; W583-Y931 HydrophobicContact CE3-CD2 4.19Å; W583-Y931 HydrophobicContact CE3-CE1 4.15Å; W583-Y931 AromaticContact CE3-CG 3.56Å; W583-Y931 HydrophobicContact CE3-CG 3.56Å; W583-Y931 AromaticContact CZ3-CD1 3.85Å; W583-Y931 HydrophobicContact CZ3-CD1 3.85Å; W583-Y931 AromaticContact CZ3-CD2 3.8Å; W583-Y931 HydrophobicContact CZ3-CD2 3.8Å; W583-Y931 AromaticContact CZ3-CG 3.34Å; W583-Y931 HydrophobicContact CZ3-CG 3.34Å; Q625-Y931 HydrophobicContact CB-CE2 4.15Å; Q625-Y931 HydrophobicContact CG-CE2 4.29Å; K927-Y931 PolarHBondContact O-N 3.37Å; K927-Y931 VanDerWaalsContact O-N 3.08Å; R928-Y931 WeakPolarHBondContact O-CB 3.36Å; R928-Y931 PolarHBondContact O-N 2.9Å; R928-Y931 VanDerWaalsContact O-N 3.13Å; Q929-Y931 VanDerWaalsContact C-N 3.28Å; Q929-Y931 PolarHBondContact O-N 3.18Å; Y931-Q933 VanDerWaalsContact C-N 3.26Å; Y931-Q933 PolarHBondContact O-N 2.96Å; Y931-T934 PolarHBondContact O-N 2.89Å; Y931-F935 AromaticContact CD2-CD2 3.53Å; Y931-F935 HydrophobicContact CD2-CD2 3.53Å; Y931-F935 AromaticContact CD2-CE2 3.94Å; Y931-F935 HydrophobicContact CD2-CE2 3.94Å; Y931-F935 AromaticContact CE2-CD2 3.86Å; Y931-F935 HydrophobicContact CE2-CD2 3.86Å; Y931-F935 HydrophobicContact CE2-CE2 4.36Å; Y931-F935 HydrophobicContact CE2-CG 4.49Å; Y931-F935 HydrophobicContact CG-CD2 4.02Å; Y931-F935 WeakPolarHBondContact O-CD2 3.49Å; Y931-F935 PolarHBondContact O-N 2.94Å; Y931-L936 HydrophobicContact CE1-CD1 4.47Å
932	I	76	Confident	77	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-54.3	-48.6	-179.8	-68.2	167.6	0	0	0	109.6	R928 Q929 T934 L936 L937	R928-I932 HydrophobicContact CG-CD1 3.75Å; R928-I932 HydrophobicContact CG-CG1 4.39Å; R928-I932 WeakPolarHBondContact O-CG1 3.05Å; R928-I932 PolarHBondContact O-N 3.33Å; Q929-I932 PolarHBondContact O-N 3.34Å; I932-T934 VanDerWaalsContact C-N 3.35Å; I932-T934 PolarHBondContact O-N 3.49Å; I932-L936 HydrophobicContact CB-CD1 4.41Å; I932-L936 HydrophobicContact CG1-CD1 4.13Å; I932-L936 HydrophobicContact CG2-CB 4.49Å; I932-L936 HydrophobicContact CG2-CD1 4.31Å; I932-L936 WeakPolarHBondContact O-CA 3.46Å; I932-L936 WeakPolarHBondContact O-CB 3.47Å; I932-L936 PolarHBondContact O-N 3.42Å; I932-L937 HydrophobicContact CG2-CD1 3.92Å; I932-L937 HydrophobicContact CG2-CG 4.29Å; I932-L937 PolarHBondContact O-N 3.49Å
933	Q	77.1	Confident	76.3	Confident	30 Å²	30	48 Å²	48	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-71.9	-28	-179.1	-62.7	-69	-17.2	0	0	113.6	W733 I775 Q929 Y931 N938	W733-Q933 HydrophobicContact CH2-CB 3.48Å; W733-Q933 VanDerWaalsContact CH2-CB 3.48Å; W733-Q933 HydrophobicContact CH2-CG 4.08Å; W733-Q933 HydrophobicContact CZ2-CB 4.06Å; I775-Q933 HydrophobicContact CD1-CG 3.58Å; Q929-Q933 WeakPolarHBondContact O-CB 3.34Å; Q929-Q933 WeakPolarHBondContact O-CG 3.44Å; Q929-Q933 PolarHBondContact O-N 2.72Å; Q929-Q933 VanDerWaalsContact O-N 3.13Å; Y931-Q933 VanDerWaalsContact C-N 3.26Å; Y931-Q933 PolarHBondContact O-N 2.96Å; Q933-N938 PolarHBondContact O-ND2 3.48Å
934	T	73.3	Confident	75.6	Confident	26 Å²	26	51.2 Å²	51.2	16%	0.16	25%	0.248	C	C	.	.	H	α-helix	trans	-78.7	-37.7	179	-59.7	0	0	0	0	111.9	I930 Y931 I932 N938	I930-T934 WeakPolarHBondContact O-CB 3.37Å; I930-T934 PolarHBondContact O-N 3.35Å; I930-T934 PolarHBondContact O-OG1 3.16Å; Y931-T934 PolarHBondContact O-N 2.89Å; I932-T934 VanDerWaalsContact C-N 3.35Å; I932-T934 PolarHBondContact O-N 3.49Å; T934-N938 PolarHBondContact O-ND2 3.13Å
935	F	67.8	Low	75.1	Confident	24 Å²	24	45.5 Å²	45.5	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-120.8	-23.9	-164.6	-64.1	-73.2	0	0	0	115.6	L621 K624 Q625 T660 Y931	L621-F935 HydrophobicContact CD1-CE1 3.89Å; K624-F935 HydrophobicContact CB-CZ 4.46Å; K624-F935 HydrophobicContact CD-CZ 4.07Å; K624-F935 HydrophobicContact CG-CZ 4.01Å; Q625-F935 HydrophobicContact CB-CZ 4.47Å; Q625-F935 HydrophobicContact CG-CD1 4.35Å; Q625-F935 HydrophobicContact CG-CD2 4.45Å; Q625-F935 HydrophobicContact CG-CE1 3.86Å; Q625-F935 HydrophobicContact CG-CE2 3.99Å; Q625-F935 HydrophobicContact CG-CZ 3.66Å; T660-F935 HydrophobicContact CG2-CB 3.93Å; Y931-F935 AromaticContact CD2-CD2 3.53Å; Y931-F935 HydrophobicContact CD2-CD2 3.53Å; Y931-F935 AromaticContact CD2-CE2 3.94Å; Y931-F935 HydrophobicContact CD2-CE2 3.94Å; Y931-F935 AromaticContact CE2-CD2 3.86Å; Y931-F935 HydrophobicContact CE2-CD2 3.86Å; Y931-F935 HydrophobicContact CE2-CE2 4.36Å; Y931-F935 HydrophobicContact CE2-CG 4.49Å; Y931-F935 HydrophobicContact CG-CD2 4.02Å; Y931-F935 WeakPolarHBondContact O-CD2 3.49Å; Y931-F935 PolarHBondContact O-N 2.94Å
936	L	63.9	Low	74.2	Confident	44 Å²	44	46.2 Å²	46.2	23%	0.23	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-27.8	-178.1	-60.9	176.1	0	0	0	113	E582 T660 Y931 I932	E582-L936 HydrophobicContact CB-CD1 3.77Å; E582-L936 HydrophobicContact CB-CD2 4.07Å; E582-L936 HydrophobicContact CG-CD1 4.46Å; E582-L936 HydrophobicContact CG-CD2 4.28Å; T660-L936 HydrophobicContact CG2-CD2 4.44Å; Y931-L936 HydrophobicContact CE1-CD1 4.47Å; I932-L936 HydrophobicContact CB-CD1 4.41Å; I932-L936 HydrophobicContact CG1-CD1 4.13Å; I932-L936 HydrophobicContact CG2-CB 4.49Å; I932-L936 HydrophobicContact CG2-CD1 4.31Å; I932-L936 WeakPolarHBondContact O-CA 3.46Å; I932-L936 WeakPolarHBondContact O-CB 3.47Å; I932-L936 PolarHBondContact O-N 3.42Å
937	L	56.8	Low	73.1	Confident	110 Å²	110	50 Å²	50	58%	0.576	25%	0.248	S	C	*	.			trans	-111.3	5.9	-173.4	-64	173.7	0	0	0	114.5	I932	I932-L937 HydrophobicContact CG2-CD1 3.92Å; I932-L937 HydrophobicContact CG2-CG 4.29Å; I932-L937 PolarHBondContact O-N 3.49Å
938	N	50.7	Low	72.2	Confident	150 Å²	150	46.4 Å²	46.4	80%	0.802	24%	0.235	S	C	*	.			trans	-97.7	0	-177	-98.9	-27.9	0	0	0	114	K772 Q933 T934	K772-N938 PolarHBondContact NZ-OD1 3.05Å; Q933-N938 PolarHBondContact O-ND2 3.48Å; T934-N938 PolarHBondContact O-ND2 3.13Å

Retrieved 938 of 938 residues in 487 ms (Link to these results)

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