A0A087Y7J3_POEFO Loading...

E3 ubiquitin-protein ligase TRIM71

E3 ubiquitin-protein ligase that cooperates with the microRNAs (miRNAs) machinery and promotes embryonic stem cells proliferation and maintenance. Binds to miRNAs and participates in post-transcriptional repression of transcripts. Required to maintain proliferation and prevent premature differentiation of neural progenitor cells during early neural development.

AlphaFold DB , UniProt , Accession A0A087Y7J3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 831 aa.

						>A0A087Y7J3_POEFO|A0A087Y7J3
MASFPDSDLQTCPLCKELCGSSAPISSNSSTSSSSSQTSVSSNHATKKLHVLPCLHTFCRQCLEGQRSPSDPLKLCCPTCDQKVSISEAGVDSLPSSNFLFSNLLDVVVSSEDQMQNKNGHHHLGGLIGGSSGFHPSHGGLLHVQHMGEPQCSSCDEENPATSHCLDCEEYLCDNCVRAHQRVRLTKDHYIDPLGESLHLSRVNSISSGTGQPGVSVSLAQSLQNNFALLSLFQGRMSFCQHHDGEVFLFFCETCSVPICRECSVGRHIGHTYVYLQDAVQDCRAITIQLLADAQQGRQAVQQSMEKVQAMAEQVEIKAKVVQTEVKALVLRHKKALEERECELLWKVDKIRQMKAKTLYLQVEKLHQSLTKLDSTIAAVSQMLDEGHHLDVLLARERMLTQIHELKTLRGLMQPQDDDRIMFTPPDQALYIAIQSMGLISSSAFAPVTKVHGEGLKNVLCGKPASFTVIGYDHDGEPCLSGGDTVSAMVMSVTDGSLSAVEVTDRQNGSYTVCFLPKMEGEHLVSVLVCHQHVQGSPFKVTVKSRRNYRSLGSQMSSFGCEGEGDGQLCRPWGISVDREGYVVVADRSNNRIQIFKPCGAFHHKFGSLGSRPGQFDRPAGVACDSQRRIIVADKDNHRVQVFTFEGQFLLKFGEKGTKNGQFNYPWDVAVNSEGKILVSDTRNHRVQLFAPDGSFLNKYGFEGTLWKHFDSPRGVAFNHEDHLVVTDFNNHRLLVIRPDCQAARFLGSEGTKDGQFLRPQGVAVDQENRIIVADSRNHRIQVFEASGSFLCNFGSQGSGYGQMDRPSGVAVMPDGIIVVVDFGNNRILKF
					

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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	29.9	Very low	35.4	Very low	252 Å²	252	121.8 Å²	121.8	100%	1.241	68%	0.684	S	S	*	*				0	108.5	0	-78.8	178.5	158.6	0	0	107.7
2	A	23.2	Very low	37.5	Very low	85 Å²	85	112.1 Å²	112.1	70%	0.702	63%	0.63	S	S	*	*			trans	-107.4	108.8	168.3	0	0	0	0	0	106.2	F4	A2-F4 PolarHBondContact O-N 3.2Å
3	S	22.3	Very low	39.6	Very low	119 Å²	119	108.8 Å²	108.8	83%	0.832	62%	0.616	S	S	*	*			trans	-71.7	109.9	173.6	47.8	0	0	0	0	108.6
4	F	25.6	Very low	41.5	Very low	179 Å²	179	103.8 Å²	103.8	79%	0.785	59%	0.586	S	S	*	*			trans	-76.7	126.4	167.7	-74.6	-82	0	0	0	108.4	A2	A2-F4 PolarHBondContact O-N 3.2Å
5	P	29.2	Very low	43	Very low	77 Å²	77	99.3 Å²	99.3	50%	0.5	56%	0.564	S	S	.	*			trans	-68	132.8	174	-7.5	21.9	0	0	0	109.4	S7 D8	P5-S7 PolarHBondContact O-N 3.13Å; P5-D8 PolarHBondContact O-N 2.98Å
6	D	30.9	Very low	43.9	Very low	153 Å²	153	99.6 Å²	99.6	82%	0.818	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-7.9	179.8	-81.1	-43.6	0	0	0	115
7	S	35.9	Very low	44.6	Very low	99 Å²	99	103.4 Å²	103.4	69%	0.692	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-10.2	-176.7	54.2	0	0	0	0	115.8	P5	P5-S7 PolarHBondContact O-N 3.13Å
8	D	39.7	Very low	45	Very low	80 Å²	80	105.2 Å²	105.2	43%	0.428	58%	0.577	S	S	.	*	S	Bend	trans	-97.5	-12.1	-173.6	-91	-5.6	0	0	0	115.3	P5 Q10 T11 K16	P5-D8 PolarHBondContact O-N 2.98Å; D8-Q10 VanDerWaalsContact C-N 3.33Å; D8-Q10 PolarHBondContact O-N 3.27Å; D8-T11 PolarHBondContact O-N 3.03Å; D8-T11 PolarHBondContact O-OG1 3.12Å; D8-K16 IonicContact OD1-NZ 2.8Å; D8-K16 PolarHBondContact OD1-NZ 3.42Å; D8-K16 IonicContact OD2-NZ 3.21Å; D8-K16 PolarHBondContact OD2-NZ 3.02Å
9	L	48.1	Very low	45	Very low	78 Å²	78	106.2 Å²	106.2	41%	0.408	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-1	-166.8	-76.5	142.1	0	0	0	115.7	F101	L9-F101 HydrophobicContact CB-CE1 4.29Å; L9-F101 HydrophobicContact CB-CE2 4.31Å; L9-F101 HydrophobicContact CB-CZ 3.54Å; L9-F101 HydrophobicContact CD1-CE1 4.27Å; L9-F101 HydrophobicContact CD1-CZ 4.14Å; L9-F101 HydrophobicContact CD2-CZ 3.87Å; L9-F101 HydrophobicContact CG-CZ 4.03Å
10	Q	48.4	Very low	44.6	Very low	152 Å²	152	104 Å²	104	71%	0.71	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	0.5	171.2	-71.7	-172.5	-9.5	0	0	113.4	D8	D8-Q10 VanDerWaalsContact C-N 3.33Å; D8-Q10 PolarHBondContact O-N 3.27Å
11	T	56.3	Low	43.9	Very low	66 Å²	66	104.1 Å²	104.1	41%	0.405	60%	0.6	S	S	.	*	S	Bend	trans	-109.2	133	-179.8	56.3	0	0	0	0	111.6	D8	D8-T11 PolarHBondContact O-N 3.03Å; D8-T11 PolarHBondContact O-OG1 3.12Å
12	C	60	Low	43.9	Very low	5 Å²	5	97.8 Å²	97.8	3%	0.034	58%	0.581	C	S	.	*			trans	-67.4	128.9	174.9	172.4	0	0	0	0	110.1	L14 C15 K16 L49 C59	C12-L14 PolarHBondContact O-N 2.71Å; C12-C15 HydrophobicContact CB-CB 3.98Å; C12-C15 WeakPolarHBondContact O-CB 3.34Å; C12-C15 PolarHBondContact O-N 2.89Å; C12-K16 PolarHBondContact O-N 3.49Å; C12-L49 HydrophobicContact CB-CD2 3.7Å; C12-C59 HydrophobicContact CB-CB 3.62Å; C12-C59 PolarHBondContact SG-N 3.05Å
13	P	65.4	Low	44.3	Very low	70 Å²	70	97.7 Å²	97.7	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-55.6	-39.3	-178.9	-25.2	32.5	0	0	0	113	C15 K16 E17 T57	P13-C15 VanDerWaalsContact C-N 3.35Å; P13-C15 PolarHBondContact O-N 3.04Å; P13-K16 PolarHBondContact O-N 3.12Å; P13-E17 PolarHBondContact O-N 3.31Å; P13-T57 WeakPolarHBondContact CD-O 3.25Å
14	L	66.8	Low	44.6	Very low	38 Å²	38	98.3 Å²	98.3	20%	0.199	58%	0.581	C	S	.	*	H	α-helix	trans	-72.6	-24.5	178.5	-66.8	163.4	0	0	0	113.2	C12 L18 F58 C62 P78	C12-L14 PolarHBondContact O-N 2.71Å; L14-L18 WeakPolarHBondContact O-CB 3.32Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.37Å; L14-F58 HydrophobicContact CD1-CD1 3.38Å; L14-F58 HydrophobicContact CD1-CE1 3.67Å; L14-F58 HydrophobicContact CD1-CG 4.19Å; L14-F58 HydrophobicContact CG-CD1 3.87Å; L14-F58 HydrophobicContact CG-CE1 3.98Å; L14-C62 HydrophobicContact CB-CB 3.86Å; L14-C62 VanDerWaalsContact CB-SG 3.56Å; L14-C62 HydrophobicContact CD1-CB 3.7Å; L14-C62 HydrophobicContact CG-CB 4.44Å; L14-P78 HydrophobicContact CD1-CB 4.13Å; L14-P78 HydrophobicContact CD1-CG 3.82Å; L14-P78 HydrophobicContact CD2-CB 4.29Å
15	C	63.9	Low	44.8	Very low	36 Å²	36	97.6 Å²	97.6	24%	0.243	58%	0.584	C	S	.	*	H	α-helix	trans	-76.7	-29.4	174.5	-71	0	0	0	0	112.5	C12 P13 E17 C19 C59	C12-C15 HydrophobicContact CB-CB 3.98Å; C12-C15 WeakPolarHBondContact O-CB 3.34Å; C12-C15 PolarHBondContact O-N 2.89Å; P13-C15 VanDerWaalsContact C-N 3.35Å; P13-C15 PolarHBondContact O-N 3.04Å; C15-E17 VanDerWaalsContact C-N 3.31Å; C15-C19 PolarHBondContact O-N 3.35Å; C15-C59 PolarHBondContact SG-SG 3.03Å
16	K	57.4	Low	44.6	Very low	104 Å²	104	98.7 Å²	98.7	45%	0.452	59%	0.593	S	S	.	*	H	α-helix	trans	-62.9	-40.4	170.9	-96.3	-175	177.6	-176	0	111	D8 C12 P13	D8-K16 IonicContact OD1-NZ 2.8Å; D8-K16 PolarHBondContact OD1-NZ 3.42Å; D8-K16 IonicContact OD2-NZ 3.21Å; D8-K16 PolarHBondContact OD2-NZ 3.02Å; C12-K16 PolarHBondContact O-N 3.49Å; P13-K16 PolarHBondContact O-N 3.12Å
17	E	54.6	Low	44.5	Very low	164 Å²	164	96.3 Å²	96.3	77%	0.766	59%	0.589	S	S	*	*	H	α-helix	trans	-71.3	-34.5	178.2	-67.2	-110.7	145.9	0	0	113.3	P13 C15	P13-E17 PolarHBondContact O-N 3.31Å; C15-E17 VanDerWaalsContact C-N 3.31Å
18	L	51.8	Low	44	Very low	136 Å²	136	99 Å²	99	71%	0.712	60%	0.596	S	S	*	*	H	α-helix	trans	-93.3	-11.2	-173.8	-73.7	165	0	0	0	115.8	L14	L14-L18 WeakPolarHBondContact O-CB 3.32Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.37Å
19	C	46.7	Very low	43.4	Very low	125 Å²	125	100.9 Å²	100.9	85%	0.845	62%	0.615	S	S	*	*	H	α-helix	trans	-136.6	19.5	-175.9	-83.6	0	0	0	0	115.6	C15	C15-C19 PolarHBondContact O-N 3.35Å
20	G	35.2	Very low	42.5	Very low	62 Å²	62	102.2 Å²	102.2	64%	0.639	63%	0.631	S	S	*	*			trans	-159.8	44.8	-174.6	0	0	0	0	0	116.9
21	S	29.8	Very low	41.4	Very low	106 Å²	106	101.2 Å²	101.2	74%	0.741	64%	0.635	S	S	*	*			trans	-110.4	85.1	158	52.3	0	0	0	0	109.7	A23	S21-A23 PolarHBondContact O-N 3.47Å
22	S	30.9	Very low	40.1	Very low	120 Å²	120	103 Å²	103	84%	0.839	65%	0.651	S	S	*	*			trans	-70.9	104	153.7	49.6	0	0	0	0	107.4
23	A	31.6	Very low	38.5	Very low	82 Å²	82	108.6 Å²	108.6	68%	0.678	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-64.2	144	176.4	0	0	0	0	0	111.8	S21	S21-A23 PolarHBondContact O-N 3.47Å
24	P	28.5	Very low	36.7	Very low	132 Å²	132	110.3 Å²	110.3	86%	0.857	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-88.5	116.8	162.6	31.9	-24.3	0	0	0	109.4
25	I	28.9	Very low	34.9	Very low	164 Å²	164	113.5 Å²	113.5	84%	0.841	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-90.1	136.3	162.7	-63.4	175.2	0	0	0	108
26	S	27	Very low	33.2	Very low	100 Å²	100	116.8 Å²	116.8	70%	0.699	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-74.7	154.1	-176.9	41.6	0	0	0	0	114.7
27	S	27.2	Very low	31.7	Very low	103 Å²	103	120.6 Å²	120.6	72%	0.72	77%	0.772	S	S	*	*			trans	79.9	112	150	60.5	0	0	0	0	121.9
28	N	26.3	Very low	30.3	Very low	156 Å²	156	119.7 Å²	119.7	83%	0.834	78%	0.778	S	S	*	*			trans	75.6	129.3	135.3	-72.2	-3.9	0	0	0	123.2
29	S	27.4	Very low	29.3	Very low	120 Å²	120	118 Å²	118	84%	0.839	78%	0.777	S	S	*	*			trans	97.8	121.7	150.8	72.1	0	0	0	0	118.4
30	S	27.6	Very low	28.4	Very low	106 Å²	106	118.6 Å²	118.6	74%	0.741	78%	0.776	S	S	*	*			trans	-60.4	141.9	179.1	40.1	0	0	0	0	114.9
31	T	26.7	Very low	28	Very low	131 Å²	131	120.5 Å²	120.5	80%	0.804	78%	0.78	S	S	*	*				-179.4	128.9	117.7	27.2	0	0	0	0	111.9
32	S	27.7	Very low	28.2	Very low	104 Å²	104	120.5 Å²	120.5	73%	0.727	78%	0.78	S	S	*	*			trans	23.1	123.9	150.1	56.6	0	0	0	0	120.8
33	S	28	Very low	28	Very low	122 Å²	122	122.9 Å²	122.9	85%	0.853	78%	0.784	S	S	*	*				165.7	155.2	94.4	46.7	0	0	0	0	112.6
34	S	26.8	Very low	28.2	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	79%	0.794	S	S	*	*			trans	-81.2	152.1	-161.2	-26.9	0	0	0	0	114.8
35	S	28.5	Very low	28.6	Very low	106 Å²	106	125.8 Å²	125.8	74%	0.741	79%	0.785	S	S	*	*			trans	63.3	142.7	141.4	47.2	0	0	0	0	119.9
36	S	28.3	Very low	29.4	Very low	105 Å²	105	124.2 Å²	124.2	73%	0.734	78%	0.783	S	S	*	*			cis	-173.4	163.9	-8.2	-79	0	0	0	0	107.4
37	Q	26.7	Very low	30.7	Very low	183 Å²	183	125 Å²	125	86%	0.855	77%	0.774	S	S	*	*			trans	78.7	113	158.7	-62.1	178.2	13	0	0	118.9
38	T	25.6	Very low	32.4	Very low	146 Å²	146	125.3 Å²	125.3	90%	0.896	76%	0.762	S	S	*	*				-163	142.5	106.9	31.2	0	0	0	0	111.3
39	S	29.1	Very low	34.7	Very low	100 Å²	100	118.2 Å²	118.2	70%	0.699	72%	0.724	S	S	*	*			trans	-86.4	142.7	-175.5	47.1	0	0	0	0	114.6
40	V	28	Very low	36.9	Very low	137 Å²	137	112.7 Å²	112.7	83%	0.83	69%	0.685	S	S	*	*			trans	-158.6	94.7	142.1	-171.5	0	0	0	0	107.6
41	S	27.1	Very low	39.2	Very low	102 Å²	102	108 Å²	108	71%	0.713	65%	0.652	S	S	*	*				63.3	83.1	91.7	-52.9	0	0	0	0	115.9
42	S	34	Very low	41.5	Very low	107 Å²	107	101.8 Å²	101.8	75%	0.748	61%	0.614	S	S	*	*			trans	-1.6	124.6	142.4	46.7	0	0	0	0	120.4
43	N	27.6	Very low	43.4	Very low	170 Å²	170	98.8 Å²	98.8	91%	0.909	59%	0.592	S	S	*	*			trans	-142.4	76.7	148	-102.9	-12.7	0	0	0	109.2	A45	N43-A45 PolarHBondContact O-N 3.2Å; N43-A45 VanDerWaalsContact O-N 3.14Å
44	H	35.9	Very low	45.4	Very low	193 Å²	193	94 Å²	94	89%	0.894	56%	0.559	S	S	*	*			trans	-78.9	87.3	168.2	-93.4	-67.7	0	0	0	109.2	T46	H44-T46 PolarHBondContact O-N 3.48Å
45	A	35.5	Very low	47.6	Very low	82 Å²	82	95.1 Å²	95.1	68%	0.678	56%	0.556	S	S	*	*			trans	-70.9	120	159.8	0	0	0	0	0	108.4	N43 K47	N43-A45 PolarHBondContact O-N 3.2Å; N43-A45 VanDerWaalsContact O-N 3.14Å; A45-K47 PolarHBondContact O-N 3.44Å
46	T	45.3	Very low	49.8	Very low	130 Å²	130	93 Å²	93	80%	0.798	53%	0.534	S	S	*	.			trans	-53.5	102.8	172	34.8	0	0	0	0	110.4	H44 K48	H44-T46 PolarHBondContact O-N 3.48Å; T46-K48 PolarHBondContact O-N 2.85Å
47	K	56	Low	52.1	Low	116 Å²	116	89.8 Å²	89.8	50%	0.504	51%	0.51	S	S	.	.			trans	-74.1	111.9	178.8	-71.8	-173	-176.6	-177.8	0	109.6	A45 L49	A45-K47 PolarHBondContact O-N 3.44Å; K47-L49 PolarHBondContact O-N 3.19Å
48	K	63.1	Low	54.7	Low	110 Å²	110	81.2 Å²	81.2	48%	0.478	47%	0.47	S	S	.	.			trans	-54.6	121.8	171.1	-167.5	173.3	177.5	-179	0	109.5	T46 S96	T46-K48 PolarHBondContact O-N 2.85Å; K48-S96 VanDerWaalsContact CE-CB 3.42Å
49	L	73.5	Confident	57.3	Low	7 Å²	7	74.3 Å²	74.3	4%	0.037	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	147.9	175.4	-55.3	174.6	0	0	0	109.7	C12 K47 T57 F58 C59 S96 S97	C12-L49 HydrophobicContact CB-CD2 3.7Å; K47-L49 PolarHBondContact O-N 3.19Å; L49-T57 HydrophobicContact CB-CG2 3.78Å; L49-T57 HydrophobicContact CD1-CG2 4.36Å; L49-F58 CarbonylContact C-O 3.15Å; L49-F58 WeakPolarHBondContact CA-O 3.3Å; L49-C59 HydrophobicContact CD2-CB 3.83Å; L49-S96 CarbonylContact O-C 3.54Å; L49-S96 WeakPolarHBondContact O-CA 3.44Å; L49-S96 WeakPolarHBondContact O-CB 3.42Å; L49-S97 PolarHBondContact O-N 3.35Å
50	H	73.8	Confident	59.4	Low	4 Å²	4	74 Å²	74	2%	0.019	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.5	-179.7	-63.3	-89.1	0	0	0	111	T57 F58 L63 V91 L94 P95	H50-T57 WeakPolarHBondContact O-CA 3.39Å; H50-F58 PolarHBondContact N-O 3.43Å; H50-F58 PolarHBondContact O-N 2.86Å; H50-L63 HydrophobicContact CB-CD1 3.86Å; H50-V91 PolarHBondContact CE1-O 3.38Å; H50-V91 PolarHBondContact ND1-O 2.65Å; H50-L94 HydrophobicContact CB-CB 3.94Å; H50-L94 PolarHBondContact ND1-O 2.89Å; H50-P95 CarbonylContact C-O 3.58Å; H50-P95 VanDerWaalsContact CA-O 3.31Å; H50-P95 WeakPolarHBondContact CA-O 3.35Å
51	V	77.1	Confident	61.6	Low	8 Å²	8	73.2 Å²	73.2	5%	0.048	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128	-178.9	-173.8	0	0	0	0	109.5	T57 P95 L100	V51-T57 HydrophobicContact CG2-CG2 3.93Å; V51-P95 HydrophobicContact CB-CG 4.35Å; V51-P95 PolarHBondContact N-O 2.9Å; V51-L100 HydrophobicContact CG1-CD1 4.31Å; V51-L100 HydrophobicContact CG2-CD1 3.66Å; V51-L100 HydrophobicContact CG2-CG 4.47Å
52	L	73.3	Confident	63.9	Low	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.369	C	S	.	.			trans	-84.9	163.6	175.7	-65.9	-176	0	0	0	112	C54 L55 H56 F58 L63 L75 C77 V84 L94	L52-C54 VanDerWaalsContact CB-SG 3.51Å; L52-C54 PolarHBondContact O-N 3.43Å; L52-C54 VanDerWaalsContact O-N 3.11Å; L52-L55 WeakPolarHBondContact O-CA 3.29Å; L52-L55 PolarHBondContact O-N 2.9Å; L52-H56 PolarHBondContact N-O 3.23Å; L52-F58 HydrophobicContact CD1-CD2 3.95Å; L52-F58 HydrophobicContact CD1-CE2 3.86Å; L52-F58 HydrophobicContact CG-CD2 4.33Å; L52-L63 HydrophobicContact CD1-CD2 3.99Å; L52-L63 HydrophobicContact CD2-CD1 4.31Å; L52-L63 HydrophobicContact CD2-CD2 4.06Å; L52-L63 HydrophobicContact CG-CD2 4.25Å; L52-L75 HydrophobicContact CD1-CD1 3.78Å; L52-L75 HydrophobicContact CD2-CD1 3.62Å; L52-L75 HydrophobicContact CD2-CD2 3.81Å; L52-L75 HydrophobicContact CD2-CG 4.41Å; L52-L75 HydrophobicContact CG-CD1 4.36Å; L52-C77 HydrophobicContact CD1-CB 3.76Å; L52-V84 HydrophobicContact CD2-CG1 4.48Å; L52-L94 HydrophobicContact CD2-CD1 3.79Å
53	P	68.7	Low	65.9	Low	42 Å²	42	64 Å²	64	27%	0.273	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-31	169.1	-31.9	37.5	0	0	0	116.8	L55 V84 F227	P53-L55 PolarHBondContact O-N 3.45Å; P53-V84 HydrophobicContact CB-CG2 4.36Å; P53-V84 HydrophobicContact CG-CB 4.46Å; P53-V84 HydrophobicContact CG-CG1 3.75Å; P53-V84 HydrophobicContact CG-CG2 3.97Å; P53-F227 VanDerWaalsContact CA-CE2 3.43Å; P53-F227 HydrophobicContact CB-CD1 4.46Å; P53-F227 HydrophobicContact CB-CD2 4.1Å; P53-F227 HydrophobicContact CB-CE1 4.35Å; P53-F227 HydrophobicContact CB-CE2 4.02Å; P53-F227 HydrophobicContact CB-CG 4.36Å; P53-F227 HydrophobicContact CB-CZ 4.18Å; P53-F227 HydrophobicContact CG-CD1 3.82Å; P53-F227 HydrophobicContact CG-CD2 4.25Å; P53-F227 HydrophobicContact CG-CE1 3.93Å; P53-F227 HydrophobicContact CG-CE2 4.39Å; P53-F227 HydrophobicContact CG-CG 4Å; P53-F227 HydrophobicContact CG-CZ 4.27Å
54	C	70.6	Confident	68.1	Low	21 Å²	21	58.9 Å²	58.9	14%	0.142	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	9	174.6	60.8	0	0	0	0	114	L52 H56 C77 C80 Q82	L52-C54 VanDerWaalsContact CB-SG 3.51Å; L52-C54 PolarHBondContact O-N 3.43Å; L52-C54 VanDerWaalsContact O-N 3.11Å; C54-H56 PolarHBondContact O-N 2.92Å; C54-H56 PolarHBondContact SG-ND1 3.32Å; C54-C77 PolarHBondContact SG-SG 2.96Å; C54-C80 WeakPolarHBondContact CB-SG 3.48Å; C54-Q82 HydrophobicContact CB-CB 4.38Å
55	L	71.9	Confident	69.7	Low	128 Å²	128	52.6 Å²	52.6	67%	0.67	29%	0.292	S	S	*	.	S	Bend	trans	64.3	1.7	-176.6	-54	174.6	0	0	0	115.9	L52 P53	L52-L55 WeakPolarHBondContact O-CA 3.29Å; L52-L55 PolarHBondContact O-N 2.9Å; P53-L55 PolarHBondContact O-N 3.45Å
56	H	74.8	Confident	71.4	Confident	62 Å²	62	52.9 Å²	52.9	29%	0.287	28%	0.279	S	S	.	.			trans	-74.2	145.4	171.2	-63.3	116.7	0	0	0	111.4	L52 C54 F58 C77 T79	L52-H56 PolarHBondContact N-O 3.23Å; C54-H56 PolarHBondContact O-N 2.92Å; C54-H56 PolarHBondContact SG-ND1 3.32Å; H56-F58 HydrophobicContact CB-CD2 4.45Å; H56-F58 HydrophobicContact CB-CE2 3.51Å; H56-F58 HydrophobicContact CB-CZ 3.89Å; H56-C77 PolarHBondContact ND1-SG 3.23Å; H56-C77 VanDerWaalsContact ND1-SG 3.36Å; H56-T79 WeakPolarHBondContact NE2-CG2 3.48Å
57	T	76.3	Confident	72.6	Confident	37 Å²	37	51.2 Å²	51.2	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.7	-168.4	-47.2	0	0	0	0	111.6	P13 L49 H50 V51	P13-T57 WeakPolarHBondContact CD-O 3.25Å; L49-T57 HydrophobicContact CB-CG2 3.78Å; L49-T57 HydrophobicContact CD1-CG2 4.36Å; H50-T57 WeakPolarHBondContact O-CA 3.39Å; V51-T57 HydrophobicContact CG2-CG2 3.93Å
58	F	80.8	Confident	72.9	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	157.8	-174.3	-56.4	-79.3	0	0	0	112.4	L14 L49 H50 L52 H56 L63 P78	L14-F58 HydrophobicContact CD1-CD1 3.38Å; L14-F58 HydrophobicContact CD1-CE1 3.67Å; L14-F58 HydrophobicContact CD1-CG 4.19Å; L14-F58 HydrophobicContact CG-CD1 3.87Å; L14-F58 HydrophobicContact CG-CE1 3.98Å; L49-F58 CarbonylContact C-O 3.15Å; L49-F58 WeakPolarHBondContact CA-O 3.3Å; H50-F58 PolarHBondContact N-O 3.43Å; H50-F58 PolarHBondContact O-N 2.86Å; L52-F58 HydrophobicContact CD1-CD2 3.95Å; L52-F58 HydrophobicContact CD1-CE2 3.86Å; L52-F58 HydrophobicContact CG-CD2 4.33Å; H56-F58 HydrophobicContact CB-CD2 4.45Å; H56-F58 HydrophobicContact CB-CE2 3.51Å; H56-F58 HydrophobicContact CB-CZ 3.89Å; F58-L63 HydrophobicContact CB-CD1 4.15Å; F58-L63 HydrophobicContact CB-CD2 3.86Å; F58-L63 HydrophobicContact CB-CG 3.74Å; F58-L63 HydrophobicContact CD2-CD2 3.81Å; F58-L63 HydrophobicContact CG-CD2 4.11Å; F58-P78 HydrophobicContact CZ-CB 4.44Å; F58-P78 HydrophobicContact CZ-CG 4.41Å
59	C	80.2	Confident	72.7	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	157.5	172.2	77.3	0	0	0	0	111.2	C12 C15 L49 Q61 C62 L63	C12-C59 HydrophobicContact CB-CB 3.62Å; C12-C59 PolarHBondContact SG-N 3.05Å; C15-C59 PolarHBondContact SG-SG 3.03Å; L49-C59 HydrophobicContact CD2-CB 3.83Å; C59-Q61 VanDerWaalsContact C-N 3.33Å; C59-Q61 PolarHBondContact O-N 3Å; C59-C62 PolarHBondContact O-N 3.45Å; C59-C62 VanDerWaalsContact O-N 3.16Å; C59-C62 PolarHBondContact SG-SG 3.31Å; C59-L63 PolarHBondContact O-N 3.22Å; C59-L63 VanDerWaalsContact O-N 3.16Å
60	R	75.2	Confident	72	Confident	92 Å²	92	54 Å²	54	35%	0.347	30%	0.304	S	S	.	.	H	α-helix	trans	-49.1	-50.3	179.1	-176.4	-171.2	169.2	124.7	8.6	113.4	C62 L63 E64 V91 D92	R60-C62 VanDerWaalsContact C-N 3.3Å; R60-C62 PolarHBondContact O-N 3.1Å; R60-L63 PolarHBondContact O-N 3.33Å; R60-L63 VanDerWaalsContact O-N 3.15Å; R60-E64 HydrophobicContact CG-CG 4.29Å; R60-E64 IonicContact CZ-OE1 3.63Å; R60-E64 IonicContact NE-OE1 2.65Å; R60-E64 PolarHBondContact NE-OE1 2.87Å; R60-E64 IonicContact NE-OE2 2.88Å; R60-E64 IonicContact NH2-OE1 3.33Å; R60-E64 PolarHBondContact NH2-OE1 2.99Å; R60-E64 WeakPolarHBondContact O-CG 3.4Å; R60-E64 PolarHBondContact O-N 3.05Å; R60-V91 HydrophobicContact CB-CG1 4.47Å; R60-V91 HydrophobicContact CG-CB 4.35Å; R60-V91 HydrophobicContact CG-CG1 4.12Å; R60-D92 IonicContact CZ-OD1 3.21Å; R60-D92 IonicContact CZ-OD2 2.99Å; R60-D92 IonicContact NH1-OD1 2.92Å; R60-D92 PolarHBondContact NH1-OD1 3.39Å; R60-D92 IonicContact NH1-OD2 3.47Å; R60-D92 PolarHBondContact NH1-OD2 3.46Å; R60-D92 IonicContact NH2-OD2 3.38Å
61	Q	73.3	Confident	71.8	Confident	121 Å²	121	56 Å²	56	57%	0.565	31%	0.314	S	S	*	.	H	α-helix	trans	-60.6	-38.6	-176.5	-71.7	175.2	-23.8	0	0	112.5	C59 G65	C59-Q61 VanDerWaalsContact C-N 3.33Å; C59-Q61 PolarHBondContact O-N 3Å; Q61-G65 PolarHBondContact O-N 3.41Å; Q61-G65 VanDerWaalsContact O-N 3.14Å
62	C	76	Confident	71.1	Confident	16 Å²	16	59.7 Å²	59.7	11%	0.108	34%	0.339	C	S	.	.	H	α-helix	trans	-73.2	-32.3	178.7	-66.5	0	0	0	0	112.4	L14 C59 R60 Q66	L14-C62 HydrophobicContact CB-CB 3.86Å; L14-C62 VanDerWaalsContact CB-SG 3.56Å; L14-C62 HydrophobicContact CD1-CB 3.7Å; L14-C62 HydrophobicContact CG-CB 4.44Å; C59-C62 PolarHBondContact O-N 3.45Å; C59-C62 VanDerWaalsContact O-N 3.16Å; C59-C62 PolarHBondContact SG-SG 3.31Å; R60-C62 VanDerWaalsContact C-N 3.3Å; R60-C62 PolarHBondContact O-N 3.1Å; C62-Q66 VanDerWaalsContact O-CG 3.25Å; C62-Q66 WeakPolarHBondContact O-CG 3.47Å
63	L	74.4	Confident	70.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-73.6	-36.5	173.9	-70	174.6	0	0	0	112.3	H50 L52 F58 C59 R60 G65 Q66 V91 L94	H50-L63 HydrophobicContact CB-CD1 3.86Å; L52-L63 HydrophobicContact CD1-CD2 3.99Å; L52-L63 HydrophobicContact CD2-CD1 4.31Å; L52-L63 HydrophobicContact CD2-CD2 4.06Å; L52-L63 HydrophobicContact CG-CD2 4.25Å; F58-L63 HydrophobicContact CB-CD1 4.15Å; F58-L63 HydrophobicContact CB-CD2 3.86Å; F58-L63 HydrophobicContact CB-CG 3.74Å; F58-L63 HydrophobicContact CD2-CD2 3.81Å; F58-L63 HydrophobicContact CG-CD2 4.11Å; C59-L63 PolarHBondContact O-N 3.22Å; C59-L63 VanDerWaalsContact O-N 3.16Å; R60-L63 PolarHBondContact O-N 3.33Å; R60-L63 VanDerWaalsContact O-N 3.15Å; L63-G65 VanDerWaalsContact C-N 3.3Å; L63-G65 PolarHBondContact O-N 3.46Å; L63-Q66 PolarHBondContact O-N 2.78Å; L63-Q66 VanDerWaalsContact O-N 3.17Å; L63-V91 HydrophobicContact CB-CG1 3.97Å; L63-V91 HydrophobicContact CB-CG2 4.23Å; L63-V91 HydrophobicContact CD1-CG1 3.77Å; L63-L94 HydrophobicContact CD1-CD1 4.23Å
64	E	74.2	Confident	71.2	Confident	62 Å²	62	65.7 Å²	65.7	29%	0.29	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-35.1	175.1	-74.7	177.2	153.1	0	0	112.1	R60 Q66 R67 V91	R60-E64 HydrophobicContact CG-CG 4.29Å; R60-E64 IonicContact CZ-OE1 3.63Å; R60-E64 IonicContact NE-OE1 2.65Å; R60-E64 PolarHBondContact NE-OE1 2.87Å; R60-E64 IonicContact NE-OE2 2.88Å; R60-E64 IonicContact NH2-OE1 3.33Å; R60-E64 PolarHBondContact NH2-OE1 2.99Å; R60-E64 WeakPolarHBondContact O-CG 3.4Å; R60-E64 PolarHBondContact O-N 3.05Å; E64-Q66 PolarHBondContact O-N 2.83Å; E64-R67 PolarHBondContact O-N 3.2Å; E64-V91 HydrophobicContact CG-CG2 3.97Å
65	G	69.6	Low	71.6	Confident	62 Å²	62	64.8 Å²	64.8	64%	0.639	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-13	173.8	0	0	0	0	0	115.1	Q61 L63	Q61-G65 PolarHBondContact O-N 3.41Å; Q61-G65 VanDerWaalsContact O-N 3.14Å; L63-G65 VanDerWaalsContact C-N 3.3Å; L63-G65 PolarHBondContact O-N 3.46Å
66	Q	72.1	Confident	72	Confident	88 Å²	88	60.9 Å²	60.9	41%	0.411	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	16	-179.4	-62.6	-69	-21.2	0	0	112.3	C62 L63 E64 P78	C62-Q66 VanDerWaalsContact O-CG 3.25Å; C62-Q66 WeakPolarHBondContact O-CG 3.47Å; L63-Q66 PolarHBondContact O-N 2.78Å; L63-Q66 VanDerWaalsContact O-N 3.17Å; E64-Q66 PolarHBondContact O-N 2.83Å; Q66-P78 HydrophobicContact CG-CG 3.75Å
67	R	69.8	Low	72.1	Confident	94 Å²	94	58 Å²	58	36%	0.355	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	138.8	172.8	-81	-177.3	171.4	175.3	-3.6	110.7	E64	E64-R67 PolarHBondContact O-N 3.2Å
68	S	62.7	Low	72.1	Confident	44 Å²	44	58.2 Å²	58.2	31%	0.308	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129	171.9	-173.4	0	0	0	0	109.9	S70 D71 K74	S68-S70 PolarHBondContact O-N 3.09Å; S68-S70 VanDerWaalsContact O-N 3.11Å; S68-S70 PolarHBondContact OG-OG 3.48Å; S68-D71 PolarHBondContact O-N 2.88Å; S68-K74 PolarHBondContact N-O 3.12Å
69	P	59.1	Low	71.9	Confident	141 Å²	141	62.3 Å²	62.3	92%	0.916	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.3	175.3	-21.1	30.7	0	0	0	113.4
70	S	59.1	Low	71.8	Confident	107 Å²	107	65 Å²	65	75%	0.748	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-16	-176.5	55.3	0	0	0	0	114.8	S68	S68-S70 PolarHBondContact O-N 3.09Å; S68-S70 VanDerWaalsContact O-N 3.11Å; S68-S70 PolarHBondContact OG-OG 3.48Å
71	D	69.6	Low	71.9	Confident	45 Å²	45	66.8 Å²	66.8	24%	0.241	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	103.5	-177.2	-171	-11	0	0	0	110.5	S68 L73 K74	S68-D71 PolarHBondContact O-N 2.88Å; D71-L73 PolarHBondContact O-N 3.45Å; D71-L73 VanDerWaalsContact O-N 3.15Å; D71-L73 PolarHBondContact OD1-N 3.03Å; D71-K74 PolarHBondContact O-N 3.04Å; D71-K74 WeakPolarHBondContact OD2-CD 3.4Å; D71-K74 WeakPolarHBondContact OD2-CE 3.15Å; D71-K74 IonicContact OD2-NZ 3.7Å; D71-K74 PolarHBondContact OD2-NZ 3.37Å
72	P	62.6	Low	72.1	Confident	87 Å²	87	65.4 Å²	65.4	57%	0.565	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	-8.6	-174.5	26.6	-32.3	0	0	0	114.2
73	L	68.4	Low	72.3	Confident	74 Å²	74	72.6 Å²	72.6	39%	0.387	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	6.4	178	-64.5	166.5	0	0	0	113.1	D71 S85 I86	D71-L73 PolarHBondContact O-N 3.45Å; D71-L73 VanDerWaalsContact O-N 3.15Å; D71-L73 PolarHBondContact OD1-N 3.03Å; L73-S85 WeakPolarHBondContact O-CA 3.29Å; L73-I86 WeakPolarHBondContact CD2-O 3.49Å; L73-I86 PolarHBondContact O-N 2.89Å
74	K	73.9	Confident	72.4	Confident	94 Å²	94	72.9 Å²	72.9	41%	0.409	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.1	177.3	-68.9	-178.1	-175	124.8	0	112.4	S68 D71 V84	S68-K74 PolarHBondContact N-O 3.12Å; D71-K74 PolarHBondContact O-N 3.04Å; D71-K74 WeakPolarHBondContact OD2-CD 3.4Å; D71-K74 WeakPolarHBondContact OD2-CE 3.15Å; D71-K74 IonicContact OD2-NZ 3.7Å; D71-K74 PolarHBondContact OD2-NZ 3.37Å; K74-V84 WeakPolarHBondContact CA-O 3.46Å
75	L	79.9	Confident	72.4	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	152.4	171.2	72.1	87.4	0	0	0	110.2	L52 V84 I86 L94	L52-L75 HydrophobicContact CD1-CD1 3.78Å; L52-L75 HydrophobicContact CD2-CD1 3.62Å; L52-L75 HydrophobicContact CD2-CD2 3.81Å; L52-L75 HydrophobicContact CD2-CG 4.41Å; L52-L75 HydrophobicContact CG-CD1 4.36Å; L75-V84 HydrophobicContact CD1-CB 3.65Å; L75-V84 HydrophobicContact CD1-CG1 4.24Å; L75-V84 HydrophobicContact CD1-CG2 4.04Å; L75-V84 HydrophobicContact CD2-CB 4.39Å; L75-V84 HydrophobicContact CD2-CG1 4.21Å; L75-V84 HydrophobicContact CG-CB 3.77Å; L75-V84 HydrophobicContact CG-CG1 4.11Å; L75-V84 PolarHBondContact N-O 3.42Å; L75-V84 PolarHBondContact O-N 2.95Å; L75-I86 HydrophobicContact CB-CD1 4.14Å; L75-I86 HydrophobicContact CD2-CD1 3.61Å; L75-I86 HydrophobicContact CD2-CG1 3.7Å; L75-I86 HydrophobicContact CG-CD1 4.21Å; L75-I86 HydrophobicContact CG-CG1 4.21Å; L75-L94 HydrophobicContact CD2-CD1 4.08Å
76	C	79.3	Confident	72.5	Confident	47 Å²	47	72 Å²	72	32%	0.318	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.6	168	-67.2	0	0	0	0	109.7	P78	C76-P78 VanDerWaalsContact O-CD 3.3Å; C76-P78 WeakPolarHBondContact O-CD 3.49Å
77	C	78.6	Confident	72.2	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	40%	0.404	C	S	.	.			trans	-68.7	124.1	171.6	176.2	0	0	0	0	110.4	L52 C54 H56 T79 D81 Q82	L52-C77 HydrophobicContact CD1-CB 3.76Å; C54-C77 PolarHBondContact SG-SG 2.96Å; H56-C77 PolarHBondContact ND1-SG 3.23Å; H56-C77 VanDerWaalsContact ND1-SG 3.36Å; C77-T79 PolarHBondContact O-N 2.84Å; C77-T79 VanDerWaalsContact O-N 3.1Å; C77-T79 PolarHBondContact SG-N 3.37Å; C77-D81 VanDerWaalsContact O-CA 3.22Å; C77-D81 WeakPolarHBondContact O-CA 3.45Å; C77-D81 PolarHBondContact O-N 3.43Å; C77-Q82 HydrophobicContact CB-CB 4.42Å; C77-Q82 PolarHBondContact N-O 3.42Å
78	P	75.8	Confident	71.8	Confident	42 Å²	42	75.4 Å²	75.4	27%	0.273	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.8	-178.1	-28.2	41.8	0	0	0	116.1	L14 F58 Q66 C76	L14-P78 HydrophobicContact CD1-CB 4.13Å; L14-P78 HydrophobicContact CD1-CG 3.82Å; L14-P78 HydrophobicContact CD2-CB 4.29Å; F58-P78 HydrophobicContact CZ-CB 4.44Å; F58-P78 HydrophobicContact CZ-CG 4.41Å; Q66-P78 HydrophobicContact CG-CG 3.75Å; C76-P78 VanDerWaalsContact O-CD 3.3Å; C76-P78 WeakPolarHBondContact O-CD 3.49Å
79	T	76.8	Confident	71.5	Confident	90 Å²	90	76.6 Å²	76.6	55%	0.552	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-29.9	-177.6	-52.4	0	0	0	0	113	H56 C77	H56-T79 WeakPolarHBondContact NE2-CG2 3.48Å; C77-T79 PolarHBondContact O-N 2.84Å; C77-T79 VanDerWaalsContact O-N 3.1Å; C77-T79 PolarHBondContact SG-N 3.37Å
80	C	77.4	Confident	71.8	Confident	58 Å²	58	70.4 Å²	70.4	39%	0.392	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	6.5	-176	65.6	0	0	0	0	114	C54 Q82	C54-C80 WeakPolarHBondContact CB-SG 3.48Å; C80-Q82 PolarHBondContact O-N 3.49Å
81	D	78.1	Confident	72.1	Confident	129 Å²	129	65.3 Å²	65.3	69%	0.69	37%	0.369	S	S	*	.			trans	54.8	14.4	-178.7	-68.6	-30.6	0	0	0	115.7	C77 K83	C77-D81 VanDerWaalsContact O-CA 3.22Å; C77-D81 WeakPolarHBondContact O-CA 3.45Å; C77-D81 PolarHBondContact O-N 3.43Å; D81-K83 PolarHBondContact O-N 3.02Å
82	Q	77.5	Confident	71.9	Confident	92 Å²	92	66.7 Å²	66.7	43%	0.43	38%	0.376	S	S	.	.			trans	-66.8	125.4	178.9	-172.4	171.4	-5.3	0	0	110.4	C54 C77 C80	C54-Q82 HydrophobicContact CB-CB 4.38Å; C77-Q82 HydrophobicContact CB-CB 4.42Å; C77-Q82 PolarHBondContact N-O 3.42Å; C80-Q82 PolarHBondContact O-N 3.49Å
83	K	79.3	Confident	72	Confident	167 Å²	167	63.8 Å²	63.8	73%	0.726	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.5	175.3	-65.9	179.3	-177.4	176.5	0	110.1	D81	D81-K83 PolarHBondContact O-N 3.02Å
84	V	76.2	Confident	71.9	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.6	-177.7	172.9	0	0	0	0	108.3	L52 P53 K74 L75	L52-V84 HydrophobicContact CD2-CG1 4.48Å; P53-V84 HydrophobicContact CB-CG2 4.36Å; P53-V84 HydrophobicContact CG-CB 4.46Å; P53-V84 HydrophobicContact CG-CG1 3.75Å; P53-V84 HydrophobicContact CG-CG2 3.97Å; K74-V84 WeakPolarHBondContact CA-O 3.46Å; L75-V84 HydrophobicContact CD1-CB 3.65Å; L75-V84 HydrophobicContact CD1-CG1 4.24Å; L75-V84 HydrophobicContact CD1-CG2 4.04Å; L75-V84 HydrophobicContact CD2-CB 4.39Å; L75-V84 HydrophobicContact CD2-CG1 4.21Å; L75-V84 HydrophobicContact CG-CB 3.77Å; L75-V84 HydrophobicContact CG-CG1 4.11Å; L75-V84 PolarHBondContact N-O 3.42Å; L75-V84 PolarHBondContact O-N 2.95Å
85	S	74.4	Confident	71.4	Confident	91 Å²	91	56.7 Å²	56.7	64%	0.636	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.7	174.7	-55.3	0	0	0	0	109.2	L73	L73-S85 WeakPolarHBondContact O-CA 3.29Å
86	I	72.7	Confident	70.6	Confident	13 Å²	13	57.4 Å²	57.4	7%	0.067	33%	0.33	C	S	.	.			trans	-112.7	146.8	-179.4	-22.4	167.2	0	0	0	108.7	L73 L75 G90 V91	L73-I86 WeakPolarHBondContact CD2-O 3.49Å; L73-I86 PolarHBondContact O-N 2.89Å; L75-I86 HydrophobicContact CB-CD1 4.14Å; L75-I86 HydrophobicContact CD2-CD1 3.61Å; L75-I86 HydrophobicContact CD2-CG1 3.7Å; L75-I86 HydrophobicContact CG-CD1 4.21Å; L75-I86 HydrophobicContact CG-CG1 4.21Å; I86-G90 VanDerWaalsContact CG2-O 3.22Å; I86-G90 WeakPolarHBondContact CG2-O 3.41Å; I86-V91 HydrophobicContact CD1-CG2 4.4Å
87	S	66.1	Low	69.5	Low	60 Å²	60	55.8 Å²	55.8	42%	0.42	32%	0.319	S	S	.	.			trans	-71.2	168.2	175.3	71.5	0	0	0	0	112.1	A89 G90 S93	S87-A89 PolarHBondContact O-N 3.44Å; S87-A89 PolarHBondContact OG-N 3.29Å; S87-G90 PolarHBondContact O-N 3.02Å; S87-S93 VanDerWaalsContact OG-CB 3.24Å; S87-S93 WeakPolarHBondContact OG-CB 3.44Å; S87-S93 PolarHBondContact OG-OG 2.98Å; S87-S93 VanDerWaalsContact OG-OG 3.06Å
88	E	59.3	Low	68.3	Low	194 Å²	194	61 Å²	61	91%	0.907	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.5	174.7	-68.1	-174.8	165.8	0	0	113.2	G90	E88-G90 PolarHBondContact O-N 3.03Å
89	A	57.6	Low	67.1	Low	70 Å²	70	61.3 Å²	61.3	58%	0.579	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-1.4	173.3	0	0	0	0	0	114	S87	S87-A89 PolarHBondContact O-N 3.44Å; S87-A89 PolarHBondContact OG-N 3.29Å
90	G	66.1	Low	65.9	Low	10 Å²	10	60.5 Å²	60.5	10%	0.103	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	71.4	-161.4	173.7	0	0	0	0	0	114.5	I86 S87 E88 D92 S93	I86-G90 VanDerWaalsContact CG2-O 3.22Å; I86-G90 WeakPolarHBondContact CG2-O 3.41Å; S87-G90 PolarHBondContact O-N 3.02Å; E88-G90 PolarHBondContact O-N 3.03Å; G90-D92 PolarHBondContact O-N 3.17Å; G90-D92 VanDerWaalsContact O-N 3.07Å; G90-S93 PolarHBondContact O-N 3.46Å; G90-S93 PolarHBondContact O-OG 3.28Å
91	V	65.3	Low	64.3	Low	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-59.9	-22.5	-174.2	177.8	0	0	0	0	112.6	H50 R60 L63 E64 I86 S93 L94	H50-V91 PolarHBondContact CE1-O 3.38Å; H50-V91 PolarHBondContact ND1-O 2.65Å; R60-V91 HydrophobicContact CB-CG1 4.47Å; R60-V91 HydrophobicContact CG-CB 4.35Å; R60-V91 HydrophobicContact CG-CG1 4.12Å; L63-V91 HydrophobicContact CB-CG1 3.97Å; L63-V91 HydrophobicContact CB-CG2 4.23Å; L63-V91 HydrophobicContact CD1-CG1 3.77Å; E64-V91 HydrophobicContact CG-CG2 3.97Å; I86-V91 HydrophobicContact CD1-CG2 4.4Å; V91-S93 PolarHBondContact O-N 3.41Å; V91-L94 HydrophobicContact CG1-CD1 4.23Å; V91-L94 WeakPolarHBondContact O-CB 3.31Å; V91-L94 PolarHBondContact O-N 3.13Å; V91-L94 VanDerWaalsContact O-N 3.12Å
92	D	65.2	Low	62.5	Low	74 Å²	74	58 Å²	58	40%	0.396	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-66.6	-19.8	177	-64.8	-37.3	0	0	0	114	R60 G90 L94	R60-D92 IonicContact CZ-OD1 3.21Å; R60-D92 IonicContact CZ-OD2 2.99Å; R60-D92 IonicContact NH1-OD1 2.92Å; R60-D92 PolarHBondContact NH1-OD1 3.39Å; R60-D92 IonicContact NH1-OD2 3.47Å; R60-D92 PolarHBondContact NH1-OD2 3.46Å; R60-D92 IonicContact NH2-OD2 3.38Å; G90-D92 PolarHBondContact O-N 3.17Å; G90-D92 VanDerWaalsContact O-N 3.07Å; D92-L94 PolarHBondContact O-N 3.25Å
93	S	63.2	Low	61	Low	27 Å²	27	58.2 Å²	58.2	19%	0.189	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-72.7	-12.8	175.1	76.2	0	0	0	0	112.7	S87 G90 V91 S231	S87-S93 VanDerWaalsContact OG-CB 3.24Å; S87-S93 WeakPolarHBondContact OG-CB 3.44Å; S87-S93 PolarHBondContact OG-OG 2.98Å; S87-S93 VanDerWaalsContact OG-OG 3.06Å; G90-S93 PolarHBondContact O-N 3.46Å; G90-S93 PolarHBondContact O-OG 3.28Å; V91-S93 PolarHBondContact O-N 3.41Å; S93-S231 PolarHBondContact O-OG 3.35Å
94	L	66.3	Low	59	Low	11 Å²	11	55 Å²	55	6%	0.058	31%	0.314	C	S	.	.	S	Bend	trans	-81.2	138.8	178.7	-65.9	166.8	0	0	0	111.2	H50 L52 L63 L75 V91 D92	H50-L94 HydrophobicContact CB-CB 3.94Å; H50-L94 PolarHBondContact ND1-O 2.89Å; L52-L94 HydrophobicContact CD2-CD1 3.79Å; L63-L94 HydrophobicContact CD1-CD1 4.23Å; L75-L94 HydrophobicContact CD2-CD1 4.08Å; V91-L94 HydrophobicContact CG1-CD1 4.23Å; V91-L94 WeakPolarHBondContact O-CB 3.31Å; V91-L94 PolarHBondContact O-N 3.13Å; V91-L94 VanDerWaalsContact O-N 3.12Å; D92-L94 PolarHBondContact O-N 3.25Å
95	P	63.8	Low	56.9	Low	8 Å²	8	60.9 Å²	60.9	5%	0.052	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-60.8	142.1	-178	23	-32	0	0	0	111.7	H50 V51 F227 L230	H50-P95 CarbonylContact C-O 3.58Å; H50-P95 VanDerWaalsContact CA-O 3.31Å; H50-P95 WeakPolarHBondContact CA-O 3.35Å; V51-P95 HydrophobicContact CB-CG 4.35Å; V51-P95 PolarHBondContact N-O 2.9Å; P95-F227 HydrophobicContact CG-CE1 4.35Å; P95-L230 HydrophobicContact CB-CB 4.04Å; P95-L230 HydrophobicContact CG-CB 3.82Å; P95-L230 HydrophobicContact CG-CD1 4.22Å
96	S	63.8	Low	55	Low	16 Å²	16	63.3 Å²	63.3	11%	0.112	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-86.1	153.4	-178.7	57.1	0	0	0	0	113.5	K48 L49 N98 F99	K48-S96 VanDerWaalsContact CE-CB 3.42Å; L49-S96 CarbonylContact O-C 3.54Å; L49-S96 WeakPolarHBondContact O-CA 3.44Å; L49-S96 WeakPolarHBondContact O-CB 3.42Å; S96-N98 PolarHBondContact O-N 3Å; S96-N98 VanDerWaalsContact O-N 3.09Å; S96-F99 WeakPolarHBondContact O-CB 3.36Å; S96-F99 PolarHBondContact O-N 2.93Å
97	S	56.4	Low	53.3	Low	12 Å²	12	66.7 Å²	66.7	8%	0.084	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-31.9	177.7	57.1	0	0	0	0	114.3	L49 F99 L100 F101	L49-S97 PolarHBondContact O-N 3.35Å; S97-F99 PolarHBondContact O-N 3.48Å; S97-F99 VanDerWaalsContact O-N 3.12Å; S97-L100 PolarHBondContact O-N 3.46Å; S97-F101 VanDerWaalsContact O-CD2 3.22Å; S97-F101 WeakPolarHBondContact O-CD2 3.41Å; S97-F101 PolarHBondContact O-N 3.36Å
98	N	52.8	Low	51.6	Low	111 Å²	111	67.7 Å²	67.7	59%	0.594	38%	0.375	S	S	*	.	H	α-helix	trans	-59.3	-21.7	175.1	-75	-4.7	0	0	0	113.9	S96 L100	S96-N98 PolarHBondContact O-N 3Å; S96-N98 VanDerWaalsContact O-N 3.09Å; N98-L100 VanDerWaalsContact C-N 3.35Å
99	F	51.6	Low	50.4	Low	48 Å²	48	64.2 Å²	64.2	21%	0.211	37%	0.367	C	S	.	.	H	α-helix	trans	-69.3	-30.9	174.2	177.7	-97.6	0	0	0	112.5	S96 S97 L230 F233	S96-F99 WeakPolarHBondContact O-CB 3.36Å; S96-F99 PolarHBondContact O-N 2.93Å; S97-F99 PolarHBondContact O-N 3.48Å; S97-F99 VanDerWaalsContact O-N 3.12Å; F99-L230 HydrophobicContact CD1-CD2 3.97Å; F99-L230 HydrophobicContact CE1-CD2 3.14Å; F99-L230 HydrophobicContact CZ-CD2 3.53Å; F99-F233 HydrophobicContact CD2-CB 3.96Å; F99-F233 WeakPolarHBondContact CD2-O 3.49Å; F99-F233 HydrophobicContact CE2-CB 3.34Å; F99-F233 HydrophobicContact CE2-CD2 4.48Å; F99-F233 HydrophobicContact CE2-CG 4.09Å; F99-F233 HydrophobicContact CZ-CB 4.23Å
100	L	50.4	Low	49.2	Very low	72 Å²	72	65.7 Å²	65.7	38%	0.377	37%	0.373	S	S	.	.	H	α-helix	trans	-80.7	-35.4	177.6	-70.6	170	0	0	0	112	V51 S97 N98 N103 L104	V51-L100 HydrophobicContact CG1-CD1 4.31Å; V51-L100 HydrophobicContact CG2-CD1 3.66Å; V51-L100 HydrophobicContact CG2-CG 4.47Å; S97-L100 PolarHBondContact O-N 3.46Å; N98-L100 VanDerWaalsContact C-N 3.35Å; L100-N103 PolarHBondContact O-N 3.27Å; L100-L104 PolarHBondContact O-N 3.33Å
101	F	44.5	Very low	47.7	Very low	78 Å²	78	69 Å²	69	34%	0.342	39%	0.394	S	S	.	.	H	α-helix	trans	-71.8	-31.8	-175.2	-78	-72.8	0	0	0	114.6	L9 S97 N103	L9-F101 HydrophobicContact CB-CE1 4.29Å; L9-F101 HydrophobicContact CB-CE2 4.31Å; L9-F101 HydrophobicContact CB-CZ 3.54Å; L9-F101 HydrophobicContact CD1-CE1 4.27Å; L9-F101 HydrophobicContact CD1-CZ 4.14Å; L9-F101 HydrophobicContact CD2-CZ 3.87Å; L9-F101 HydrophobicContact CG-CZ 4.03Å; S97-F101 VanDerWaalsContact O-CD2 3.22Å; S97-F101 WeakPolarHBondContact O-CD2 3.41Å; S97-F101 PolarHBondContact O-N 3.36Å; F101-N103 VanDerWaalsContact C-N 3.25Å; F101-N103 PolarHBondContact O-N 3.03Å
102	S	40.1	Very low	46	Very low	57 Å²	57	76.5 Å²	76.5	40%	0.399	43%	0.429	S	S	.	.	H	α-helix	trans	-74.5	-15.7	179.5	66.7	0	0	0	0	113.9
103	N	46.3	Very low	44.4	Very low	96 Å²	96	80.7 Å²	80.7	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-106.7	-7.7	-176.5	-65.7	-18.8	0	0	0	113.4	L100 F101	L100-N103 PolarHBondContact O-N 3.27Å; F101-N103 VanDerWaalsContact C-N 3.25Å; F101-N103 PolarHBondContact O-N 3.03Å
104	L	36.9	Very low	43	Very low	99 Å²	99	88.1 Å²	88.1	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-84.1	-21.1	175.5	-86.1	162	0	0	0	113.2	L100 V108	L100-L104 PolarHBondContact O-N 3.33Å; L104-V108 WeakPolarHBondContact O-CG2 3.48Å
105	L	32.6	Very low	41.3	Very low	132 Å²	132	95.8 Å²	95.8	69%	0.691	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-23.1	-179.4	-86.9	157.4	0	0	0	114.1
106	D	34.3	Very low	39.8	Very low	141 Å²	141	104.4 Å²	104.4	75%	0.754	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-6.1	178.7	-82.4	-18.2	0	0	0	114
107	V	36	Very low	38.3	Very low	84 Å²	84	110.9 Å²	110.9	51%	0.509	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.9	-18.1	179	179.5	0	0	0	0	112.4
108	V	31.6	Very low	37.1	Very low	82 Å²	82	120.1 Å²	120.1	50%	0.497	63%	0.633	S	S	.	*	S	Bend	trans	-92.9	-16.1	-172.4	178.6	0	0	0	0	113.8	L104 S110	L104-V108 WeakPolarHBondContact O-CG2 3.48Å; V108-S110 PolarHBondContact O-N 3.14Å
109	V	34.2	Very low	36	Very low	121 Å²	121	123.2 Å²	123.2	73%	0.733	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-1.3	-175	-177	0	0	0	0	114.4
110	S	32.6	Very low	34.8	Very low	101 Å²	101	124 Å²	124	71%	0.706	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	4.5	-179.2	-51.2	0	0	0	0	115.5	V108	V108-S110 PolarHBondContact O-N 3.14Å
111	S	33	Very low	33.7	Very low	78 Å²	78	128.3 Å²	128.3	55%	0.545	69%	0.689	S	S	.	*	S	Bend	trans	-115.6	-1.4	-174.9	37.2	0	0	0	0	115.4
112	E	30.7	Very low	32.9	Very low	158 Å²	158	133.4 Å²	133.4	74%	0.738	71%	0.713	S	S	*	*	S	Bend	trans	-93.7	-13.4	179.9	-71.7	-169.3	150.5	0	0	114.8
113	D	31.5	Very low	32.2	Very low	163 Å²	163	138.3 Å²	138.3	87%	0.872	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	3.9	-177.2	-86.7	-17.5	0	0	0	116
114	Q	33.8	Very low	31.3	Very low	183 Å²	183	141.6 Å²	141.6	86%	0.855	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	6.2	179.3	-73.3	-164.2	5.1	0	0	116.1
115	M	31.6	Very low	30.8	Very low	172 Å²	172	140.8 Å²	140.8	85%	0.847	76%	0.762	S	S	*	*	S	Bend	trans	-106.6	7	-177.1	-73.6	-92	121.1	0	0	114.7
116	Q	31.8	Very low	30.3	Very low	188 Å²	188	137.8 Å²	137.8	88%	0.879	76%	0.763	S	S	*	*	S	Bend	trans	-106.2	6.1	179.4	-84.5	-170.9	-1.9	0	0	116.8
117	N	32.3	Very low	29.8	Very low	153 Å²	153	139 Å²	139	82%	0.818	77%	0.769	S	S	*	*	S	Bend	trans	-129.3	87.9	175.6	-105.4	-16.2	0	0	0	112.3
118	K	31.5	Very low	29.3	Very low	205 Å²	205	142.5 Å²	142.5	89%	0.891	78%	0.783	S	S	*	*			trans	169.1	76	142.1	-91	164.4	-171.6	-175.1	0	110.1
119	N	28.8	Very low	28.9	Very low	177 Å²	177	142.3 Å²	142.3	95%	0.947	80%	0.798	S	S	*	*			trans	-126.8	111.5	155.3	-99	-15.7	0	0	0	107.7
120	G	27	Very low	28.4	Very low	64 Å²	64	140 Å²	140	66%	0.66	80%	0.798	S	S	*	*			trans	-166.3	100.6	176.1	0	0	0	0	0	112.1
121	H	27.2	Very low	27.9	Very low	163 Å²	163	140.8 Å²	140.8	76%	0.755	80%	0.804	S	S	*	*			trans	34.5	131.6	145.8	-62.9	-74.7	0	0	0	120.1
122	H	26.8	Very low	27.4	Very low	184 Å²	184	143.1 Å²	143.1	85%	0.852	82%	0.82	S	S	*	*				-168.9	161.2	70.3	-101.9	-74.9	0	0	0	115
123	H	26.2	Very low	27	Very low	160 Å²	160	138.9 Å²	138.9	74%	0.741	82%	0.819	S	S	*	*			trans	-77.6	147.3	-174.8	-98.2	-67.6	0	0	0	117.6
124	L	27.2	Very low	26.5	Very low	165 Å²	165	141.3 Å²	141.3	86%	0.864	82%	0.822	S	S	*	*			trans	48.5	135.5	131.5	-105.7	95	0	0	0	125.1
125	G	25.2	Very low	25.8	Very low	82 Å²	82	140.9 Å²	140.9	85%	0.845	82%	0.82	S	S	*	*			trans	129.4	132.3	149.7	0	0	0	0	0	112.7
126	G	23.6	Very low	25.9	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	81%	0.81	S	S	*	*			cis	142.7	117.7	7.8	0	0	0	0	0	110.1
127	L	23.9	Very low	25.4	Very low	166 Å²	166	133.4 Å²	133.4	87%	0.869	80%	0.803	S	S	*	*			trans	77.2	129.4	144.7	-75.3	163.3	0	0	0	124.8
128	I	24.9	Very low	25.1	Very low	158 Å²	158	135 Å²	135	81%	0.81	81%	0.805	S	S	*	*			trans	94	129.2	135.6	-61.8	158.1	0	0	0	122.8
129	G	23.7	Very low	24.6	Very low	78 Å²	78	128.8 Å²	128.8	80%	0.804	80%	0.799	S	S	*	*			trans	99.2	139.9	143.7	0	0	0	0	0	116
130	G	22.7	Very low	24.3	Very low	72 Å²	72	124 Å²	124	74%	0.742	79%	0.791	S	S	*	*			cis	157.7	127.4	7.1	0	0	0	0	0	109.2
131	S	22.2	Very low	24	Very low	118 Å²	118	129 Å²	129	83%	0.825	80%	0.802	S	S	*	*			trans	44.6	132	145.7	-42.7	0	0	0	0	124.9
132	S	23.3	Very low	23.9	Very low	126 Å²	126	129.1 Å²	129.1	88%	0.881	81%	0.807	S	S	*	*			trans	101.3	130.2	130.9	74.8	0	0	0	0	122.4
133	G	21.7	Very low	23.6	Very low	69 Å²	69	128.8 Å²	128.8	71%	0.711	81%	0.805	S	S	*	*				125.6	91.1	128	0	0	0	0	0	121.8
134	F	20.4	Very low	23.5	Very low	215 Å²	215	125.7 Å²	125.7	94%	0.943	80%	0.798	S	S	*	*			trans	48.8	130.6	134.5	-79.8	-91.2	0	0	0	126.2
135	H	20.5	Very low	23.4	Very low	174 Å²	174	127.4 Å²	127.4	81%	0.806	80%	0.801	S	S	*	*			trans	-49.2	-175.3	161.4	-88.6	-75.3	0	0	0	119.1
136	P	32.8	Very low	23.4	Very low	101 Å²	101	131.4 Å²	131.4	66%	0.656	80%	0.798	S	S	*	*			cis	-143.2	-176.6	-32.1	37.5	-17.8	0	0	0	116.5
137	S	22.2	Very low	23.7	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	81%	0.808	S	S	*	*			trans	81.7	134	152.9	70.2	0	0	0	0	118.7
138	H	24.9	Very low	24.4	Very low	186 Å²	186	132.4 Å²	132.4	86%	0.861	80%	0.799	S	S	*	*			cis	-161.3	145.3	43.6	-113.6	-84.6	0	0	0	113
139	G	22.2	Very low	25.8	Very low	75 Å²	75	130.7 Å²	130.7	77%	0.773	79%	0.788	S	S	*	*				88.5	97.7	129	0	0	0	0	0	123
140	G	21.3	Very low	27.8	Very low	75 Å²	75	129.7 Å²	129.7	77%	0.773	77%	0.767	S	S	*	*				89.2	115.2	117.8	0	0	0	0	0	122.6
141	L	21.9	Very low	30.4	Very low	171 Å²	171	131.4 Å²	131.4	90%	0.895	76%	0.755	S	S	*	*			trans	86.7	131.5	144.3	-69.4	153.6	0	0	0	121.3
142	L	23.5	Very low	33	Very low	165 Å²	165	126.2 Å²	126.2	86%	0.864	72%	0.719	S	S	*	*			trans	104.3	105.9	157.7	-56.9	174.2	0	0	0	119.6
143	H	22	Very low	35.4	Very low	176 Å²	176	123.8 Å²	123.8	82%	0.815	70%	0.702	S	S	*	*				51.5	113	128.5	-130.8	57.8	0	0	0	122.5
144	V	23	Very low	37.5	Very low	96 Å²	96	123.2 Å²	123.2	58%	0.582	69%	0.687	S	S	*	*			trans	40.8	121.9	138	-169.5	0	0	0	0	120.2
145	Q	24.9	Very low	40.1	Very low	201 Å²	201	114.4 Å²	114.4	94%	0.939	65%	0.652	S	S	*	*			trans	-133.6	112.1	135.8	-92.2	-173.1	-21.5	0	0	112
146	H	26.6	Very low	42.2	Very low	166 Å²	166	114.4 Å²	114.4	77%	0.769	66%	0.658	S	S	*	*			trans	-54.4	138.2	158.6	-103.8	-88.7	0	0	0	109.5	G148	H146-G148 PolarHBondContact O-N 2.96Å; H146-G148 VanDerWaalsContact O-N 3.14Å
147	M	29.8	Very low	43.9	Very low	192 Å²	192	117.3 Å²	117.3	95%	0.946	66%	0.662	S	S	*	*			trans	-68.7	103	153	-68.6	-70.4	-171.7	0	0	106
148	G	38	Very low	45.9	Very low	65 Å²	65	119.1 Å²	119.1	67%	0.67	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-85.3	142.9	-179.6	0	0	0	0	0	111.8	H146	H146-G148 PolarHBondContact O-N 2.96Å; H146-G148 VanDerWaalsContact O-N 3.14Å
149	E	54.6	Low	48.2	Very low	122 Å²	122	113.1 Å²	113.1	57%	0.57	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-54.7	144.2	171	-70.6	166.1	-157.8	0	0	111.1
150	P	65.1	Low	50.7	Low	56 Å²	56	112.9 Å²	112.9	36%	0.364	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-62.1	140.8	-178.2	24.7	-32.1	0	0	0	111.5	A161 Y171 L194	P150-A161 HydrophobicContact CB-CB 4.39Å; P150-A161 VanDerWaalsContact O-CB 3.28Å; P150-A161 WeakPolarHBondContact O-CB 3.44Å; P150-A161 PolarHBondContact O-N 3.27Å; P150-Y171 HydrophobicContact CB-CD1 3.7Å; P150-Y171 HydrophobicContact CB-CE1 3.92Å; P150-Y171 HydrophobicContact CB-CG 4.28Å; P150-Y171 HydrophobicContact CG-CD1 4.05Å; P150-Y171 HydrophobicContact CG-CE1 4.09Å; P150-L194 HydrophobicContact CG-CD1 4Å
151	Q	76.6	Confident	53.2	Low	109 Å²	109	109.9 Å²	109.9	51%	0.509	59%	0.587	S	S	.	*	B	Isolated β-bridge	trans	-101.5	153.2	178.4	-72.7	-169.4	-21.8	0	0	112.7	S153 E158	Q151-S153 PolarHBondContact O-N 3.42Å; Q151-E158 PolarHBondContact NE2-O 3.29Å
152	C	78.6	Confident	55.8	Low	8 Å²	8	104.3 Å²	104.3	5%	0.054	56%	0.56	C	S	.	*	P	Polyproline II helix	trans	-67.9	123	-178.2	175.4	0	0	0	0	111.2	N159 Y171 C173	C152-N159 WeakPolarHBondContact CB-O 3.48Å; C152-N159 PolarHBondContact N-O 3.47Å; C152-Y171 CarbonylContact C-O 3.52Å; C152-Y171 VanDerWaalsContact CA-O 3.3Å; C152-Y171 WeakPolarHBondContact CA-O 3.37Å; C152-C173 HydrophobicContact CB-CB 3.72Å; C152-C173 PolarHBondContact SG-N 2.91Å; C152-C173 VanDerWaalsContact SG-SG 3.63Å
153	S	73.2	Confident	58.4	Low	76 Å²	76	97 Å²	97	53%	0.531	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-21.3	-172.7	-41.1	0	0	0	0	113.7	Q151 Y171	Q151-S153 PolarHBondContact O-N 3.42Å; S153-Y171 PolarHBondContact N-O 2.96Å; S153-Y171 PolarHBondContact OG-N 2.85Å; S153-Y171 PolarHBondContact OG-O 3.28Å
154	S	66.4	Low	61.2	Low	57 Å²	57	89.9 Å²	89.9	40%	0.399	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	13.9	-169	-18.7	0	0	0	0	114.6	E170 L172	S154-E170 PolarHBondContact OG-OE2 2.76Å; S154-L172 WeakPolarHBondContact OG-CD2 3.36Å
155	C	74.3	Confident	63.7	Low	29 Å²	29	85.3 Å²	85.3	20%	0.196	46%	0.462	C	S	.	.			trans	-123.1	142.6	170.9	65.2	0	0	0	0	112.3	E157	C155-E157 PolarHBondContact O-N 2.94Å
156	D	64.9	Low	65.8	Low	174 Å²	174	79.7 Å²	79.7	93%	0.93	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.2	179	-64.7	-33.5	0	0	0	114
157	E	68.1	Low	68	Low	162 Å²	162	76.5 Å²	76.5	76%	0.757	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	15.5	-175	-59.3	-147.4	154.3	0	0	114.7	C155 N159	C155-E157 PolarHBondContact O-N 2.94Å; E157-N159 PolarHBondContact O-N 2.88Å
158	E	64.7	Low	70.1	Confident	141 Å²	141	69.4 Å²	69.4	66%	0.659	40%	0.395	S	S	*	.			trans	50	32.7	172.6	-62.9	-174.6	173.9	0	0	115.6	Q151	Q151-E158 PolarHBondContact NE2-O 3.29Å
159	N	73	Confident	72	Confident	60 Å²	60	74 Å²	74	32%	0.321	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-66	147.8	179.5	-70.2	-63.2	0	0	0	111.7	C152 E157 C173	C152-N159 WeakPolarHBondContact CB-O 3.48Å; C152-N159 PolarHBondContact N-O 3.47Å; E157-N159 PolarHBondContact O-N 2.88Å; N159-C173 HydrophobicContact CB-CB 3.95Å
160	P	75.3	Confident	73	Confident	70 Å²	70	71.8 Å²	71.8	46%	0.455	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-62.5	141.9	174.9	26.6	-33.3	0	0	0	111	C173	P160-C173 WeakPolarHBondContact O-CB 3.49Å
161	A	73.7	Confident	73.8	Confident	12 Å²	12	73.2 Å²	73.2	10%	0.099	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-79.4	122.3	179.4	0	0	0	0	0	110.3	P150 Y171 L194	P150-A161 HydrophobicContact CB-CB 4.39Å; P150-A161 VanDerWaalsContact O-CB 3.28Å; P150-A161 WeakPolarHBondContact O-CB 3.44Å; P150-A161 PolarHBondContact O-N 3.27Å; A161-Y171 HydrophobicContact CB-CD1 4.1Å; A161-Y171 HydrophobicContact CB-CG 4.34Å; A161-L194 HydrophobicContact CB-CD1 4.42Å
162	T	76.4	Confident	73.9	Confident	53 Å²	53	68.1 Å²	68.1	33%	0.325	36%	0.364	S	S	.	.			trans	-96.8	-15.1	179.1	52.7	0	0	0	0	111.7	L172 D174 L194	T162-L172 PolarHBondContact N-O 3.17Å; T162-L172 PolarHBondContact OG1-O 3.33Å; T162-D174 WeakPolarHBondContact CB-OD1 3.49Å; T162-D174 PolarHBondContact OG1-N 2.75Å; T162-D174 PolarHBondContact OG1-OD1 3.47Å; T162-L194 PolarHBondContact O-N 3.47Å
163	S	76.8	Confident	74.1	Confident	12 Å²	12	68.1 Å²	68.1	8%	0.084	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.3	-179.4	-52	0	0	0	0	111.6	L172 I191 D192	S163-L172 PolarHBondContact N-O 2.81Å; S163-L172 PolarHBondContact O-N 3.41Å; S163-L172 VanDerWaalsContact O-O 3.14Å; S163-I191 VanDerWaalsContact CB-CG2 3.45Å; S163-D192 CarbonylContact C-O 3.55Å; S163-D192 WeakPolarHBondContact CA-O 3.34Å
164	H	80.3	Confident	74.5	Confident	27 Å²	27	68.5 Å²	68.5	13%	0.125	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	119.7	176.6	-176	-111.4	0	0	0	109.4	L166 E170 Y171 D192 L194	H164-L166 WeakPolarHBondContact ND1-CD2 3.47Å; H164-L166 PolarHBondContact O-N 3.45Å; H164-E170 PolarHBondContact CD2-O 3.31Å; H164-Y171 HydrophobicContact CB-CD1 4.29Å; H164-Y171 HydrophobicContact CB-CE1 4.18Å; H164-Y171 AromaticContact CD2-CD1 3.8Å; H164-Y171 AromaticContact CD2-CD2 3.62Å; H164-Y171 AromaticContact CD2-CE1 3.66Å; H164-Y171 AromaticContact CD2-CE2 3.46Å; H164-Y171 VanDerWaalsContact CD2-CE2 3.46Å; H164-Y171 WeakPolarHBondContact CD2-CE2 3.41Å; H164-Y171 AromaticContact CD2-CG 3.76Å; H164-Y171 AromaticContact CD2-CZ 3.47Å; H164-Y171 VanDerWaalsContact CD2-CZ 3.47Å; H164-Y171 AromaticContact NE2-CE2 3.69Å; H164-Y171 AromaticContact NE2-CZ 3.91Å; H164-D192 PolarHBondContact N-O 2.92Å; H164-D192 PolarHBondContact O-N 3.4Å; H164-L194 HydrophobicContact CB-CD1 4.12Å; H164-L194 HydrophobicContact CB-CD2 4.16Å; H164-L194 HydrophobicContact CB-CG 4.1Å
165	C	76.7	Confident	75	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	110.1	175.4	-174.8	0	0	0	0	108.8	D167 C168 E169 E170 L172 H180 I191	C165-D167 VanDerWaalsContact C-N 3.31Å; C165-D167 PolarHBondContact O-N 3.49Å; C165-C168 HydrophobicContact CB-CB 4.24Å; C165-C168 PolarHBondContact O-N 2.87Å; C165-E169 VanDerWaalsContact O-CA 3.29Å; C165-E169 WeakPolarHBondContact O-CA 3.42Å; C165-E169 PolarHBondContact O-N 3.17Å; C165-E170 PolarHBondContact N-O 3.04Å; C165-E170 PolarHBondContact O-N 3.45Å; C165-L172 HydrophobicContact CB-CD1 3.87Å; C165-H180 PolarHBondContact SG-NE2 3.46Å; C165-H180 VanDerWaalsContact SG-NE2 3.37Å; C165-I191 HydrophobicContact CB-CG1 4.06Å
166	L	69.4	Low	75.3	Confident	83 Å²	83	70.3 Å²	70.3	44%	0.435	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-25.6	-174.2	-69.8	175	0	0	0	112.7	H164 Y190 D192	H164-L166 WeakPolarHBondContact ND1-CD2 3.47Å; H164-L166 PolarHBondContact O-N 3.45Å; L166-Y190 HydrophobicContact CD1-CD1 3.94Å; L166-Y190 HydrophobicContact CD1-CE1 4.24Å; L166-Y190 PolarHBondContact N-O 2.96Å; L166-D192 HydrophobicContact CD1-CB 3.9Å; L166-D192 HydrophobicContact CG-CB 4.11Å
167	D	71.4	Confident	76	Confident	99 Å²	99	62.8 Å²	62.8	53%	0.529	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-23.6	177.2	-62.1	-72	0	0	0	113.4	C165 H189 Y190	C165-D167 VanDerWaalsContact C-N 3.31Å; C165-D167 PolarHBondContact O-N 3.49Å; D167-H189 HydrophobicContact CB-CB 3.97Å; D167-H189 WeakPolarHBondContact OD2-CA 3.49Å; D167-Y190 WeakPolarHBondContact OD2-CB 3.26Å; D167-Y190 PolarHBondContact OD2-N 3.39Å
168	C	74.6	Confident	76.6	Confident	43 Å²	43	60.9 Å²	60.9	29%	0.291	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-11.1	174.5	-71.1	0	0	0	0	113.8	C165 E170 H180 H189	C165-C168 HydrophobicContact CB-CB 4.24Å; C165-C168 PolarHBondContact O-N 2.87Å; C168-E170 HydrophobicContact CB-CB 4.33Å; C168-E170 HydrophobicContact CB-CG 4.32Å; C168-E170 PolarHBondContact O-N 3.12Å; C168-H180 VanDerWaalsContact SG-CE1 3.58Å; C168-H180 PolarHBondContact SG-NE2 3.04Å; C168-H180 VanDerWaalsContact SG-NE2 3.42Å; C168-H189 PolarHBondContact SG-CE1 3.43Å; C168-H189 PolarHBondContact SG-ND1 2.85Å
169	E	78.1	Confident	77.1	Confident	160 Å²	160	56.7 Å²	56.7	75%	0.748	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	34.3	-169.6	-58.9	-175.1	174.2	0	0	113.2	C165	C165-E169 VanDerWaalsContact O-CA 3.29Å; C165-E169 WeakPolarHBondContact O-CA 3.42Å; C165-E169 PolarHBondContact O-N 3.17Å
170	E	76.6	Confident	77.4	Confident	77 Å²	77	55 Å²	55	36%	0.36	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.5	-179.2	-73.3	-170.4	-173.9	0	0	112.2	S154 H164 C165 C168 L172	S154-E170 PolarHBondContact OG-OE2 2.76Å; H164-E170 PolarHBondContact CD2-O 3.31Å; C165-E170 PolarHBondContact N-O 3.04Å; C165-E170 PolarHBondContact O-N 3.45Å; C168-E170 HydrophobicContact CB-CB 4.33Å; C168-E170 HydrophobicContact CB-CG 4.32Å; C168-E170 PolarHBondContact O-N 3.12Å; E170-L172 HydrophobicContact CB-CD2 4.36Å
171	Y	80.8	Confident	77.5	Confident	86 Å²	86	56 Å²	56	34%	0.337	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.9	174.6	-73.6	-90	0	0	0	109.5	P150 C152 S153 A161 H164 L194	P150-Y171 HydrophobicContact CB-CD1 3.7Å; P150-Y171 HydrophobicContact CB-CE1 3.92Å; P150-Y171 HydrophobicContact CB-CG 4.28Å; P150-Y171 HydrophobicContact CG-CD1 4.05Å; P150-Y171 HydrophobicContact CG-CE1 4.09Å; C152-Y171 CarbonylContact C-O 3.52Å; C152-Y171 VanDerWaalsContact CA-O 3.3Å; C152-Y171 WeakPolarHBondContact CA-O 3.37Å; S153-Y171 PolarHBondContact N-O 2.96Å; S153-Y171 PolarHBondContact OG-N 2.85Å; S153-Y171 PolarHBondContact OG-O 3.28Å; A161-Y171 HydrophobicContact CB-CD1 4.1Å; A161-Y171 HydrophobicContact CB-CG 4.34Å; H164-Y171 HydrophobicContact CB-CD1 4.29Å; H164-Y171 HydrophobicContact CB-CE1 4.18Å; H164-Y171 AromaticContact CD2-CD1 3.8Å; H164-Y171 AromaticContact CD2-CD2 3.62Å; H164-Y171 AromaticContact CD2-CE1 3.66Å; H164-Y171 AromaticContact CD2-CE2 3.46Å; H164-Y171 VanDerWaalsContact CD2-CE2 3.46Å; H164-Y171 WeakPolarHBondContact CD2-CE2 3.41Å; H164-Y171 AromaticContact CD2-CG 3.76Å; H164-Y171 AromaticContact CD2-CZ 3.47Å; H164-Y171 VanDerWaalsContact CD2-CZ 3.47Å; H164-Y171 AromaticContact NE2-CE2 3.69Å; H164-Y171 AromaticContact NE2-CZ 3.91Å; Y171-L194 HydrophobicContact CD1-CD1 3.36Å; Y171-L194 HydrophobicContact CE1-CD1 3.47Å; Y171-L194 VanDerWaalsContact CE1-CD1 3.47Å; Y171-L194 HydrophobicContact CE1-CD2 4.09Å; Y171-L194 HydrophobicContact CE1-CG 4.4Å
172	L	78.1	Confident	77.5	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	137	-172.3	-57.3	177.3	0	0	0	110.8	S154 T162 S163 C165 E170 C176 V177 H180 I191	S154-L172 WeakPolarHBondContact OG-CD2 3.36Å; T162-L172 PolarHBondContact N-O 3.17Å; T162-L172 PolarHBondContact OG1-O 3.33Å; S163-L172 PolarHBondContact N-O 2.81Å; S163-L172 PolarHBondContact O-N 3.41Å; S163-L172 VanDerWaalsContact O-O 3.14Å; C165-L172 HydrophobicContact CB-CD1 3.87Å; E170-L172 HydrophobicContact CB-CD2 4.36Å; L172-C176 HydrophobicContact CB-CB 4.2Å; L172-C176 HydrophobicContact CD2-CB 4.02Å; L172-V177 HydrophobicContact CB-CG2 3.6Å; L172-V177 HydrophobicContact CD1-CG2 4.25Å; L172-H180 HydrophobicContact CD1-CB 3.96Å; L172-I191 HydrophobicContact CD1-CD1 4.39Å
173	C	83.4	Confident	77.3	Confident	8 Å²	8	65.9 Å²	65.9	5%	0.054	33%	0.326	C	S	.	.			trans	-80.1	163.9	163.4	70.6	0	0	0	0	110.3	C152 N159 P160 N175 C176 V177	C152-C173 HydrophobicContact CB-CB 3.72Å; C152-C173 PolarHBondContact SG-N 2.91Å; C152-C173 VanDerWaalsContact SG-SG 3.63Å; N159-C173 HydrophobicContact CB-CB 3.95Å; P160-C173 WeakPolarHBondContact O-CB 3.49Å; C173-N175 PolarHBondContact O-N 3.2Å; C173-C176 CarbonylContact O-C 3.57Å; C173-C176 WeakPolarHBondContact O-CA 3.45Å; C173-C176 PolarHBondContact O-N 3.01Å; C173-V177 WeakPolarHBondContact O-CG2 3.4Å; C173-V177 PolarHBondContact O-N 3.25Å
174	D	80.8	Confident	76.6	Confident	84 Å²	84	76.9 Å²	76.9	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-51	-36.4	-177.5	-77.9	0	0	0	0	114.4	T162 R178	T162-D174 WeakPolarHBondContact CB-OD1 3.49Å; T162-D174 PolarHBondContact OG1-N 2.75Å; T162-D174 PolarHBondContact OG1-OD1 3.47Å; D174-R178 VanDerWaalsContact O-CG 3.32Å; D174-R178 WeakPolarHBondContact O-CG 3.09Å; D174-R178 PolarHBondContact O-N 2.91Å; D174-R178 VanDerWaalsContact O-N 3.17Å
175	N	78.6	Confident	76	Confident	105 Å²	105	82.9 Å²	82.9	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-71.5	-39.8	178.4	-75.1	-24	0	0	0	111.7	C173 R178 A179	C173-N175 PolarHBondContact O-N 3.2Å; N175-R178 PolarHBondContact O-N 2.92Å; N175-R178 PolarHBondContact OD1-NH1 3.01Å; N175-R178 VanDerWaalsContact OD1-NH1 3.16Å; N175-A179 PolarHBondContact O-N 2.79Å; N175-A179 VanDerWaalsContact O-N 3.08Å
176	C	80.2	Confident	75.6	Confident	19 Å²	19	84 Å²	84	13%	0.128	41%	0.405	C	S	.	.	H	α-helix	trans	-70.3	-37.5	175.4	-70.4	0	0	0	0	111.7	L172 C173 R178 A179 H180	L172-C176 HydrophobicContact CB-CB 4.2Å; L172-C176 HydrophobicContact CD2-CB 4.02Å; C173-C176 CarbonylContact O-C 3.57Å; C173-C176 WeakPolarHBondContact O-CA 3.45Å; C173-C176 PolarHBondContact O-N 3.01Å; C176-R178 VanDerWaalsContact C-N 3.3Å; C176-R178 PolarHBondContact O-N 3.26Å; C176-A179 PolarHBondContact O-N 3.01Å; C176-A179 VanDerWaalsContact O-N 3.13Å; C176-H180 WeakPolarHBondContact O-CB 3.39Å; C176-H180 PolarHBondContact O-N 3.42Å
177	V	78.8	Confident	75.7	Confident	16 Å²	16	86 Å²	86	10%	0.097	41%	0.41	C	S	.	.	H	α-helix	trans	-55.4	-47.1	171.3	172.1	0	0	0	0	110.7	L172 C173 A179 H180 Q181 I191	L172-V177 HydrophobicContact CB-CG2 3.6Å; L172-V177 HydrophobicContact CD1-CG2 4.25Å; C173-V177 WeakPolarHBondContact O-CG2 3.4Å; C173-V177 PolarHBondContact O-N 3.25Å; V177-A179 VanDerWaalsContact C-N 3.33Å; V177-A179 PolarHBondContact O-N 3.26Å; V177-H180 PolarHBondContact O-N 2.72Å; V177-Q181 WeakPolarHBondContact O-CB 3.49Å; V177-Q181 WeakPolarHBondContact O-CG 3.43Å; V177-Q181 PolarHBondContact O-N 3.02Å; V177-I191 HydrophobicContact CG1-CD1 3.89Å; V177-I191 HydrophobicContact CG1-CG2 4.36Å; V177-I191 HydrophobicContact CG2-CG2 4.18Å
178	R	80.7	Confident	75.7	Confident	123 Å²	123	88.2 Å²	88.2	46%	0.464	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-33	178.3	-69.2	177.3	-152.7	147.3	3.4	113.1	D174 N175 C176 R182	D174-R178 VanDerWaalsContact O-CG 3.32Å; D174-R178 WeakPolarHBondContact O-CG 3.09Å; D174-R178 PolarHBondContact O-N 2.91Å; D174-R178 VanDerWaalsContact O-N 3.17Å; N175-R178 PolarHBondContact O-N 2.92Å; N175-R178 PolarHBondContact OD1-NH1 3.01Å; N175-R178 VanDerWaalsContact OD1-NH1 3.16Å; C176-R178 VanDerWaalsContact C-N 3.3Å; C176-R178 PolarHBondContact O-N 3.26Å; R178-R182 WeakPolarHBondContact O-CD 3.37Å; R178-R182 WeakPolarHBondContact O-CG 3.48Å; R178-R182 PolarHBondContact O-N 2.94Å; R178-R182 PolarHBondContact O-NE 2.68Å; R178-R182 VanDerWaalsContact O-NE 3.15Å
179	A	76.5	Confident	75.9	Confident	52 Å²	52	88.6 Å²	88.6	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-71.8	-43.3	174	0	0	0	0	0	110.8	N175 C176 V177 Q181 R182 V183	N175-A179 PolarHBondContact O-N 2.79Å; N175-A179 VanDerWaalsContact O-N 3.08Å; C176-A179 PolarHBondContact O-N 3.01Å; C176-A179 VanDerWaalsContact O-N 3.13Å; V177-A179 VanDerWaalsContact C-N 3.33Å; V177-A179 PolarHBondContact O-N 3.26Å; A179-Q181 VanDerWaalsContact C-N 3.31Å; A179-Q181 PolarHBondContact O-N 3.29Å; A179-R182 PolarHBondContact O-N 3.34Å; A179-V183 PolarHBondContact O-N 3.37Å
180	H	79.5	Confident	75.5	Confident	26 Å²	26	88.5 Å²	88.5	12%	0.12	41%	0.413	C	S	.	.	H	α-helix	trans	-60.4	-39.6	178.9	-152.4	77.4	0	0	0	111.4	C165 C168 L172 C176 V177 R182 T186 H189	C165-H180 PolarHBondContact SG-NE2 3.46Å; C165-H180 VanDerWaalsContact SG-NE2 3.37Å; C168-H180 VanDerWaalsContact SG-CE1 3.58Å; C168-H180 PolarHBondContact SG-NE2 3.04Å; C168-H180 VanDerWaalsContact SG-NE2 3.42Å; L172-H180 HydrophobicContact CD1-CB 3.96Å; C176-H180 WeakPolarHBondContact O-CB 3.39Å; C176-H180 PolarHBondContact O-N 3.42Å; V177-H180 PolarHBondContact O-N 2.72Å; H180-R182 VanDerWaalsContact C-N 3.3Å; H180-R182 PolarHBondContact O-N 2.63Å; H180-T186 CarbonylContact O-C 3.36Å; H180-T186 PolarHBondContact O-OG1 3.45Å; H180-H189 AromaticContact NE2-ND1 3.51Å
181	Q	77.1	Confident	75.6	Confident	90 Å²	90	86.1 Å²	86.1	42%	0.421	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-12.1	174.3	-71.3	177.2	-17.1	0	0	114.4	V177 A179 K187 I191	V177-Q181 WeakPolarHBondContact O-CB 3.49Å; V177-Q181 WeakPolarHBondContact O-CG 3.43Å; V177-Q181 PolarHBondContact O-N 3.02Å; A179-Q181 VanDerWaalsContact C-N 3.31Å; A179-Q181 PolarHBondContact O-N 3.29Å; Q181-K187 WeakPolarHBondContact O-CB 3.13Å; Q181-K187 WeakPolarHBondContact O-CG 3.47Å; Q181-I191 HydrophobicContact CG-CD1 4.01Å
182	R	72.3	Confident	75	Confident	192 Å²	192	85.5 Å²	85.5	73%	0.725	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-19.8	179.5	-76.5	179.3	-137.6	176.2	0.8	113.5	R178 A179 H180	R178-R182 WeakPolarHBondContact O-CD 3.37Å; R178-R182 WeakPolarHBondContact O-CG 3.48Å; R178-R182 PolarHBondContact O-N 2.94Å; R178-R182 PolarHBondContact O-NE 2.68Å; R178-R182 VanDerWaalsContact O-NE 3.15Å; A179-R182 PolarHBondContact O-N 3.34Å; H180-R182 VanDerWaalsContact C-N 3.3Å; H180-R182 PolarHBondContact O-N 2.63Å
183	V	72.9	Confident	74.8	Confident	80 Å²	80	89.6 Å²	89.6	49%	0.485	43%	0.432	S	S	.	.	S	Bend	trans	-80.1	128.4	177.2	176.4	0	0	0	0	109.1	A179 L185 T186 K187	A179-V183 PolarHBondContact O-N 3.37Å; V183-L185 HydrophobicContact CG1-CB 4.49Å; V183-L185 PolarHBondContact O-N 3.42Å; V183-T186 PolarHBondContact O-N 2.95Å; V183-T186 VanDerWaalsContact O-N 3.1Å; V183-K187 WeakPolarHBondContact O-CB 3.35Å; V183-K187 PolarHBondContact O-N 2.92Å
184	R	62.1	Low	73.9	Confident	244 Å²	244	92.5 Å²	92.5	92%	0.921	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-28.8	-173.9	-103.5	-175.6	171.6	-179	-2.7	114.8
185	L	66.9	Low	72.3	Confident	152 Å²	152	92.1 Å²	92.1	80%	0.796	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-27	-176.7	-79.8	151.5	0	0	0	113.5	V183	V183-L185 HydrophobicContact CG1-CB 4.49Å; V183-L185 PolarHBondContact O-N 3.42Å
186	T	70	Confident	70.2	Confident	23 Å²	23	94.5 Å²	94.5	14%	0.141	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	4.6	-172.8	52.8	0	0	0	0	112.9	H180 V183 D188 H189	H180-T186 CarbonylContact O-C 3.36Å; H180-T186 PolarHBondContact O-OG1 3.45Å; V183-T186 PolarHBondContact O-N 2.95Å; V183-T186 VanDerWaalsContact O-N 3.1Å; T186-D188 VanDerWaalsContact C-N 3.28Å; T186-D188 PolarHBondContact O-N 3.32Å; T186-H189 VanDerWaalsContact CG2-CE1 3.45Å; T186-H189 WeakPolarHBondContact CG2-CE1 3.44Å; T186-H189 WeakPolarHBondContact O-CB 3.41Å; T186-H189 PolarHBondContact O-N 3.38Å
187	K	70.3	Confident	67.6	Low	125 Å²	125	99 Å²	99	54%	0.543	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-34.1	-175.4	172.3	170.3	-179.6	-162.7	0	113.5	Q181 V183	Q181-K187 WeakPolarHBondContact O-CB 3.13Å; Q181-K187 WeakPolarHBondContact O-CG 3.47Å; V183-K187 WeakPolarHBondContact O-CB 3.35Å; V183-K187 PolarHBondContact O-N 2.92Å
188	D	70.8	Confident	65.1	Low	147 Å²	147	105.7 Å²	105.7	79%	0.786	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	10.6	-175.2	-55.5	-37.6	0	0	0	112.2	T186	T186-D188 VanDerWaalsContact C-N 3.28Å; T186-D188 PolarHBondContact O-N 3.32Å
189	H	78.6	Confident	62.3	Low	51 Å²	51	107.9 Å²	107.9	24%	0.236	55%	0.552	C	S	.	*			trans	-71.1	141.5	175	-67.3	-177.8	0	0	0	111.4	D167 C168 H180 T186 I191	D167-H189 HydrophobicContact CB-CB 3.97Å; D167-H189 WeakPolarHBondContact OD2-CA 3.49Å; C168-H189 PolarHBondContact SG-CE1 3.43Å; C168-H189 PolarHBondContact SG-ND1 2.85Å; H180-H189 AromaticContact NE2-ND1 3.51Å; T186-H189 VanDerWaalsContact CG2-CE1 3.45Å; T186-H189 WeakPolarHBondContact CG2-CE1 3.44Å; T186-H189 WeakPolarHBondContact O-CB 3.41Å; T186-H189 PolarHBondContact O-N 3.38Å; H189-I191 PolarHBondContact O-N 2.99Å
190	Y	70.6	Confident	59.8	Low	158 Å²	158	112.1 Å²	112.1	62%	0.62	57%	0.566	S	S	*	*			trans	-81.2	111.9	178.2	-164.9	-87.3	0	0	0	110.2	L166 D167	L166-Y190 HydrophobicContact CD1-CD1 3.94Å; L166-Y190 HydrophobicContact CD1-CE1 4.24Å; L166-Y190 PolarHBondContact N-O 2.96Å; D167-Y190 WeakPolarHBondContact OD2-CB 3.26Å; D167-Y190 PolarHBondContact OD2-N 3.39Å
191	I	78.6	Confident	57.1	Low	26 Å²	26	115.3 Å²	115.3	13%	0.133	59%	0.592	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.1	116.5	-177.5	-59.5	175.4	0	0	0	108.3	S163 C165 L172 V177 Q181 H189	S163-I191 VanDerWaalsContact CB-CG2 3.45Å; C165-I191 HydrophobicContact CB-CG1 4.06Å; L172-I191 HydrophobicContact CD1-CD1 4.39Å; V177-I191 HydrophobicContact CG1-CD1 3.89Å; V177-I191 HydrophobicContact CG1-CG2 4.36Å; V177-I191 HydrophobicContact CG2-CG2 4.18Å; Q181-I191 HydrophobicContact CG-CD1 4.01Å; H189-I191 PolarHBondContact O-N 2.99Å
192	D	68.4	Low	54.5	Low	74 Å²	74	123.2 Å²	123.2	40%	0.396	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.8	114.7	-178.9	-165.7	20.8	0	0	0	110.3	S163 H164 L166 L194	S163-D192 CarbonylContact C-O 3.55Å; S163-D192 WeakPolarHBondContact CA-O 3.34Å; H164-D192 PolarHBondContact N-O 2.92Å; H164-D192 PolarHBondContact O-N 3.4Å; L166-D192 HydrophobicContact CD1-CB 3.9Å; L166-D192 HydrophobicContact CG-CB 4.11Å; D192-L194 PolarHBondContact O-N 3.29Å
193	P	73.4	Confident	52.2	Low	87 Å²	87	119.8 Å²	119.8	57%	0.565	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65.3	129.3	178.6	-17.5	30.7	0	0	0	111.2	G195	P193-G195 PolarHBondContact O-N 3.13Å
194	L	64.2	Low	49.9	Very low	68 Å²	68	122.8 Å²	122.8	36%	0.356	63%	0.631	S	S	.	*			trans	-78.1	93.7	178.9	-70	159.4	0	0	0	108.5	P150 A161 T162 H164 Y171 D192 E196	P150-L194 HydrophobicContact CG-CD1 4Å; A161-L194 HydrophobicContact CB-CD1 4.42Å; T162-L194 PolarHBondContact O-N 3.47Å; H164-L194 HydrophobicContact CB-CD1 4.12Å; H164-L194 HydrophobicContact CB-CD2 4.16Å; H164-L194 HydrophobicContact CB-CG 4.1Å; Y171-L194 HydrophobicContact CD1-CD1 3.36Å; Y171-L194 HydrophobicContact CE1-CD1 3.47Å; Y171-L194 VanDerWaalsContact CE1-CD1 3.47Å; Y171-L194 HydrophobicContact CE1-CD2 4.09Å; Y171-L194 HydrophobicContact CE1-CG 4.4Å; D192-L194 PolarHBondContact O-N 3.29Å; L194-E196 PolarHBondContact O-N 3.5Å
195	G	47.8	Very low	48	Very low	77 Å²	77	117.1 Å²	117.1	79%	0.794	63%	0.629	S	S	*	*			trans	-75.8	108.2	-177.7	0	0	0	0	0	112.5	P193	P193-G195 PolarHBondContact O-N 3.13Å
196	E	34.5	Very low	45.9	Very low	154 Å²	154	117.5 Å²	117.5	72%	0.72	63%	0.63	S	S	*	*			trans	-91.8	144.4	154.5	-81.2	-162.5	164.5	0	0	111.4	L194	L194-E196 PolarHBondContact O-N 3.5Å
197	S	24.8	Very low	43.7	Very low	113 Å²	113	121.2 Å²	121.2	79%	0.79	66%	0.657	S	S	*	*			trans	-63.9	133.1	-175.4	-67.6	0	0	0	0	113
198	L	26.5	Very low	41.4	Very low	157 Å²	157	121 Å²	121	82%	0.822	67%	0.671	S	S	*	*			trans	59	109.1	155.2	-62.1	165.4	0	0	0	117.6
199	H	23.1	Very low	39	Very low	170 Å²	170	117.1 Å²	117.1	79%	0.787	67%	0.666	S	S	*	*				-176.1	119.7	117.3	-112.5	-110.8	0	0	0	114.5
200	L	23.2	Very low	36.4	Very low	140 Å²	140	122 Å²	122	73%	0.733	70%	0.699	S	S	*	*			trans	84.8	125.8	130.2	-121.2	79.8	0	0	0	123.3
201	S	22.7	Very low	34.2	Very low	94 Å²	94	118.1 Å²	118.1	66%	0.657	71%	0.708	S	S	*	*			trans	100.4	122.5	132.7	-41.6	0	0	0	0	119.7
202	R	22	Very low	31.6	Very low	255 Å²	255	125.9 Å²	125.9	96%	0.962	74%	0.743	S	S	*	*			trans	-133.7	127.2	142.9	-143.9	176.6	-173.6	-173.5	2.1	110.6
203	V	25.8	Very low	29.6	Very low	121 Å²	121	128.4 Å²	128.4	73%	0.733	76%	0.764	S	S	*	*			trans	-87.8	142.2	-171.2	166.9	0	0	0	0	111.9
204	N	22.8	Very low	27.3	Very low	143 Å²	143	128.1 Å²	128.1	77%	0.765	78%	0.777	S	S	*	*			trans	17.6	137	153.3	-68.1	-21.9	0	0	0	122.1
205	S	22.8	Very low	25.4	Very low	125 Å²	125	130.9 Å²	130.9	87%	0.874	80%	0.796	S	S	*	*			trans	-151	100	135.6	-66.7	0	0	0	0	111.8
206	I	23.3	Very low	24.3	Very low	159 Å²	159	132.6 Å²	132.6	82%	0.815	80%	0.796	S	S	*	*			trans	13.6	126.5	148	-61.4	166.5	0	0	0	121.7
207	S	22.7	Very low	23.9	Very low	102 Å²	102	130.7 Å²	130.7	71%	0.713	79%	0.794	S	S	*	*			trans	101.1	116.4	136.2	67.4	0	0	0	0	123.8
208	S	22.4	Very low	23.9	Very low	120 Å²	120	128.5 Å²	128.5	84%	0.839	78%	0.779	S	S	*	*			trans	76.8	118.7	136	58.5	0	0	0	0	122
209	G	21.8	Very low	24.1	Very low	65 Å²	65	128.2 Å²	128.2	67%	0.67	78%	0.778	S	S	*	*			trans	119.5	88.9	134	0	0	0	0	0	118
210	T	23.9	Very low	24.3	Very low	153 Å²	153	122.9 Å²	122.9	94%	0.939	76%	0.763	S	S	*	*			trans	53.7	119.1	143.1	59.6	0	0	0	0	120.9
211	G	22.8	Very low	24.6	Very low	77 Å²	77	121.4 Å²	121.4	79%	0.794	75%	0.752	S	S	*	*			trans	147.1	106.3	151.6	0	0	0	0	0	115.6
212	Q	24.4	Very low	25	Very low	189 Å²	189	120.2 Å²	120.2	88%	0.883	74%	0.744	S	S	*	*			trans	19	151.8	158.2	-63.5	-158.8	-21.1	0	0	123.8
213	P	27.2	Very low	25.5	Very low	127 Å²	127	113.3 Å²	113.3	83%	0.825	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-77.5	134.2	-177.7	3	15.2	0	0	0	112.8
214	G	23.7	Very low	25.8	Very low	81 Å²	81	114.1 Å²	114.1	84%	0.835	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69.8	144.7	-179	0	0	0	0	0	114.9
215	V	25.2	Very low	26.3	Very low	127 Å²	127	113.1 Å²	113.1	77%	0.77	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.6	136.6	177.2	176.4	0	0	0	0	110.9	V217	V215-V217 PolarHBondContact O-N 2.97Å
216	S	24.6	Very low	27.1	Very low	112 Å²	112	111 Å²	111	78%	0.783	70%	0.695	S	S	*	*			trans	-65.1	110	166	45.7	0	0	0	0	109.8	S218	S216-S218 PolarHBondContact O-N 3.19Å
217	V	27	Very low	27.7	Very low	114 Å²	114	105.2 Å²	105.2	69%	0.691	66%	0.664	S	S	*	*			trans	-74.4	109.1	175	-177.6	0	0	0	0	108.3	V215 Q221	V215-V217 PolarHBondContact O-N 2.97Å; V217-Q221 HydrophobicContact CG1-CB 4.4Å
218	S	24.7	Very low	28.4	Very low	67 Å²	67	103.8 Å²	103.8	47%	0.469	66%	0.658	S	S	.	*			trans	-61.2	133.5	173	171.6	0	0	0	0	110.5	S216 A220 Q221	S216-S218 PolarHBondContact O-N 3.19Å; S218-A220 PolarHBondContact O-N 3.38Å; S218-A220 WeakPolarHBondContact OG-CB 3.25Å; S218-A220 PolarHBondContact OG-N 2.97Å; S218-Q221 WeakPolarHBondContact O-CB 3.49Å; S218-Q221 PolarHBondContact O-N 3.02Å
219	L	30	Very low	29.3	Very low	152 Å²	152	100 Å²	100	80%	0.796	63%	0.628	S	S	*	*	H	α-helix	trans	-51.6	-23.4	175.1	-138.9	84.2	0	0	0	113	Q221	L219-Q221 VanDerWaalsContact C-N 3.28Å; L219-Q221 PolarHBondContact O-N 3.18Å
220	A	28.3	Very low	30.1	Very low	58 Å²	58	98.8 Å²	98.8	48%	0.479	61%	0.606	S	S	.	*	H	α-helix	trans	-66.7	-26.5	175.9	0	0	0	0	0	113.6	S218	S218-A220 PolarHBondContact O-N 3.38Å; S218-A220 WeakPolarHBondContact OG-CB 3.25Å; S218-A220 PolarHBondContact OG-N 2.97Å
221	Q	29.5	Very low	30.7	Very low	109 Å²	109	94.1 Å²	94.1	51%	0.509	58%	0.58	S	S	.	*	H	α-helix	trans	-81.3	-27.2	-177.6	-131.6	160.4	3.9	0	0	112.1	V217 S218 L219	V217-Q221 HydrophobicContact CG1-CB 4.4Å; S218-Q221 WeakPolarHBondContact O-CB 3.49Å; S218-Q221 PolarHBondContact O-N 3.02Å; L219-Q221 VanDerWaalsContact C-N 3.28Å; L219-Q221 PolarHBondContact O-N 3.18Å
222	S	30.8	Very low	31.5	Very low	69 Å²	69	94.3 Å²	94.3	48%	0.483	56%	0.562	S	S	.	*	H	α-helix	trans	-72.7	-35.9	173.8	-163.1	0	0	0	0	112	Q224 N225 N226	S222-Q224 PolarHBondContact O-N 3.34Å; S222-N225 PolarHBondContact O-N 2.89Å; S222-N226 PolarHBondContact O-N 2.93Å
223	L	31	Very low	32.6	Very low	110 Å²	110	88.9 Å²	88.9	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-69.6	-28.5	177.2	-73.9	165.5	0	0	0	113.6
224	Q	33.3	Very low	33.2	Very low	138 Å²	138	88.9 Å²	88.9	65%	0.645	53%	0.525	S	S	*	.	H	α-helix	trans	-70.5	-35.6	175.5	-81	177.9	-27.7	0	0	112.6	S222	S222-Q224 PolarHBondContact O-N 3.34Å
225	N	33.5	Very low	33.9	Very low	122 Å²	122	86.9 Å²	86.9	65%	0.652	50%	0.504	S	S	*	.	H	α-helix	trans	-74.1	-30.9	179.8	-74.3	-11.5	0	0	0	112.7	S222 F227	S222-N225 PolarHBondContact O-N 2.89Å; N225-F227 VanDerWaalsContact C-N 3.3Å; N225-F227 PolarHBondContact O-N 3.33Å
226	N	39.2	Very low	35.1	Very low	79 Å²	79	91.6 Å²	91.6	42%	0.422	51%	0.508	S	S	.	.	H	α-helix	trans	-72.6	-19	177.9	-75	-23	0	0	0	113.9	S222 L229	S222-N226 PolarHBondContact O-N 2.93Å; N226-L229 PolarHBondContact O-N 3.06Å
227	F	36.5	Very low	36.5	Very low	39 Å²	39	90.5 Å²	90.5	17%	0.171	49%	0.492	C	S	.	.	H	α-helix	trans	-78.3	-25.8	178.9	-107.4	-90.4	0	0	0	114.1	P53 P95 N225 L229 L230	P53-F227 VanDerWaalsContact CA-CE2 3.43Å; P53-F227 HydrophobicContact CB-CD1 4.46Å; P53-F227 HydrophobicContact CB-CD2 4.1Å; P53-F227 HydrophobicContact CB-CE1 4.35Å; P53-F227 HydrophobicContact CB-CE2 4.02Å; P53-F227 HydrophobicContact CB-CG 4.36Å; P53-F227 HydrophobicContact CB-CZ 4.18Å; P53-F227 HydrophobicContact CG-CD1 3.82Å; P53-F227 HydrophobicContact CG-CD2 4.25Å; P53-F227 HydrophobicContact CG-CE1 3.93Å; P53-F227 HydrophobicContact CG-CE2 4.39Å; P53-F227 HydrophobicContact CG-CG 4Å; P53-F227 HydrophobicContact CG-CZ 4.27Å; P95-F227 HydrophobicContact CG-CE1 4.35Å; N225-F227 VanDerWaalsContact C-N 3.3Å; N225-F227 PolarHBondContact O-N 3.33Å; F227-L229 PolarHBondContact O-N 3.23Å; F227-L230 HydrophobicContact CD1-CD1 3.89Å; F227-L230 HydrophobicContact CD2-CD1 4.23Å; F227-L230 HydrophobicContact CE1-CD1 3.64Å; F227-L230 HydrophobicContact CE2-CD1 3.96Å; F227-L230 HydrophobicContact CG-CD1 4.16Å; F227-L230 HydrophobicContact CZ-CD1 3.62Å; F227-L230 PolarHBondContact O-N 3.38Å
228	A	36.6	Very low	37.8	Very low	71 Å²	71	88.3 Å²	88.3	59%	0.587	48%	0.481	S	S	*	.	H	α-helix	trans	-65.7	-24.8	172.3	0	0	0	0	0	112.2
229	L	41.4	Very low	39.8	Very low	41 Å²	41	89.4 Å²	89.4	22%	0.215	48%	0.478	C	S	.	.	H	α-helix	trans	-77.8	-26.4	179.5	-66.7	172.6	0	0	0	113	N226 F227 S231 L232 F233 S256 V257	N226-L229 PolarHBondContact O-N 3.06Å; F227-L229 PolarHBondContact O-N 3.23Å; L229-S231 VanDerWaalsContact C-N 3.29Å; L229-S231 PolarHBondContact O-N 3.2Å; L229-L232 HydrophobicContact CD2-CD1 4.42Å; L229-L232 PolarHBondContact O-N 2.95Å; L229-F233 WeakPolarHBondContact O-CD2 3.38Å; L229-F233 WeakPolarHBondContact O-CE2 3.5Å; L229-S256 VanDerWaalsContact CD1-O 3.25Å; L229-S256 WeakPolarHBondContact CD1-O 3.44Å; L229-V257 HydrophobicContact CD2-CG1 3.56Å
230	L	38.4	Very low	41.8	Very low	39 Å²	39	82.6 Å²	82.6	20%	0.204	44%	0.443	C	S	.	.	H	α-helix	trans	-70.7	-24.6	-179.3	-73.6	164.5	0	0	0	113.1	P95 F99 F227 L232	P95-L230 HydrophobicContact CB-CB 4.04Å; P95-L230 HydrophobicContact CG-CB 3.82Å; P95-L230 HydrophobicContact CG-CD1 4.22Å; F99-L230 HydrophobicContact CD1-CD2 3.97Å; F99-L230 HydrophobicContact CE1-CD2 3.14Å; F99-L230 HydrophobicContact CZ-CD2 3.53Å; F227-L230 HydrophobicContact CD1-CD1 3.89Å; F227-L230 HydrophobicContact CD2-CD1 4.23Å; F227-L230 HydrophobicContact CE1-CD1 3.64Å; F227-L230 HydrophobicContact CE2-CD1 3.96Å; F227-L230 HydrophobicContact CG-CD1 4.16Å; F227-L230 HydrophobicContact CZ-CD1 3.62Å; F227-L230 PolarHBondContact O-N 3.38Å; L230-L232 PolarHBondContact O-N 3.43Å
231	S	37.6	Very low	43.8	Very low	56 Å²	56	85 Å²	85	39%	0.392	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.9	176	-54.6	0	0	0	0	113.3	S93 L229	S93-S231 PolarHBondContact O-OG 3.35Å; L229-S231 VanDerWaalsContact C-N 3.29Å; L229-S231 PolarHBondContact O-N 3.2Å
232	L	39.6	Very low	45.8	Very low	81 Å²	81	84.9 Å²	84.9	42%	0.424	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.1	179.9	-75.9	163.2	0	0	0	114.1	L229 L230 Q241	L229-L232 HydrophobicContact CD2-CD1 4.42Å; L229-L232 PolarHBondContact O-N 2.95Å; L230-L232 PolarHBondContact O-N 3.43Å; L232-Q241 PolarHBondContact O-NE2 2.76Å
233	F	46.7	Very low	47.8	Very low	74 Å²	74	84.3 Å²	84.3	33%	0.325	43%	0.433	S	S	.	.			trans	-107	54.3	-173.5	-64.9	-79.2	0	0	0	113.4	F99 L229 G235 P258	F99-F233 HydrophobicContact CD2-CB 3.96Å; F99-F233 WeakPolarHBondContact CD2-O 3.49Å; F99-F233 HydrophobicContact CE2-CB 3.34Å; F99-F233 HydrophobicContact CE2-CD2 4.48Å; F99-F233 HydrophobicContact CE2-CG 4.09Å; F99-F233 HydrophobicContact CZ-CB 4.23Å; L229-F233 WeakPolarHBondContact O-CD2 3.38Å; L229-F233 WeakPolarHBondContact O-CE2 3.5Å; F233-G235 VanDerWaalsContact C-N 3.29Å; F233-G235 PolarHBondContact O-N 3.2Å; F233-P258 HydrophobicContact CE1-CG 4.36Å; F233-P258 HydrophobicContact CZ-CG 4.01Å
234	Q	39.2	Very low	49.6	Very low	128 Å²	128	87.1 Å²	87.1	60%	0.598	45%	0.449	S	S	*	.	S	Bend	trans	-84.8	16.2	176.6	-96.1	-174.6	2.5	0	0	115.6
235	G	39.6	Very low	51.2	Low	39 Å²	39	83.2 Å²	83.2	40%	0.402	45%	0.445	S	S	.	.	S	Bend	trans	-167.6	164.4	169.9	0	0	0	0	0	109.7	F233 M237	F233-G235 VanDerWaalsContact C-N 3.29Å; F233-G235 PolarHBondContact O-N 3.2Å; G235-M237 PolarHBondContact O-N 3.11Å
236	R	50.6	Low	53.1	Low	225 Å²	225	81 Å²	81	85%	0.849	43%	0.431	S	S	*	.			trans	-59.7	78.8	165.5	-79.9	-176.7	173.1	-175.9	-3.3	108.8	S238	R236-S238 PolarHBondContact O-N 3.07Å
237	M	52.7	Low	54.9	Low	89 Å²	89	80.6 Å²	80.6	44%	0.438	43%	0.432	S	S	.	.			trans	-94.4	83	178.5	-64	-88.8	74.7	0	0	105.6	G235 F239 F248	G235-M237 PolarHBondContact O-N 3.11Å; M237-F239 PolarHBondContact O-N 3.04Å; M237-F248 WeakPolarHBondContact O-CD2 3.32Å; M237-F248 WeakPolarHBondContact O-CE2 3.34Å
238	S	55.1	Low	56.9	Low	68 Å²	68	80.8 Å²	80.8	48%	0.476	43%	0.432	S	S	.	.			trans	-63.3	-6.5	161.9	-33.2	0	0	0	0	111.3	R236 V247 F248	R236-S238 PolarHBondContact O-N 3.07Å; S238-V247 CarbonylContact O-C 3.56Å; S238-V247 WeakPolarHBondContact O-CA 3.42Å; S238-V247 VanDerWaalsContact O-CB 3.29Å; S238-V247 WeakPolarHBondContact O-CB 3.38Å; S238-V247 WeakPolarHBondContact O-CG1 3.46Å; S238-F248 PolarHBondContact O-N 3.38Å
239	F	66.9	Low	58.9	Low	91 Å²	91	81.1 Å²	81.1	40%	0.399	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-121.8	146.1	-165.9	-55.7	-81.9	0	0	0	112.8	M237 G245 E246 V247 F248	M237-F239 PolarHBondContact O-N 3.04Å; F239-G245 WeakPolarHBondContact CD1-O 3.28Å; F239-E246 CarbonylContact C-O 3.5Å; F239-E246 WeakPolarHBondContact CA-O 3.25Å; F239-V247 HydrophobicContact CD1-CG1 3.62Å; F239-V247 HydrophobicContact CE1-CG1 3.45Å; F239-V247 VanDerWaalsContact CE1-CG1 3.45Å; F239-V247 HydrophobicContact CZ-CG1 4.24Å; F239-F248 WeakPolarHBondContact O-CE2 3.5Å
240	C	71.4	Confident	60.8	Low	8 Å²	8	80.3 Å²	80.3	5%	0.054	42%	0.419	C	S	.	.			trans	-69	129.9	-179.8	-173.7	0	0	0	0	111.8	H242 H243 E246 F248 C260	C240-H242 PolarHBondContact O-N 2.66Å; C240-H242 PolarHBondContact SG-N 3.12Å; C240-H243 HydrophobicContact CB-CB 4.21Å; C240-H243 CarbonylContact O-C 3.54Å; C240-H243 PolarHBondContact O-N 2.93Å; C240-E246 HydrophobicContact CB-CB 4.4Å; C240-E246 PolarHBondContact N-O 3.43Å; C240-F248 HydrophobicContact CB-CE1 4.13Å; C240-F248 HydrophobicContact CB-CZ 4.48Å; C240-C260 HydrophobicContact CB-CB 3.85Å
241	Q	69.6	Low	62.9	Low	109 Å²	109	81.2 Å²	81.2	51%	0.509	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-12.1	177.7	-64.6	-173.8	-0.1	0	0	114.2	L232	L232-Q241 PolarHBondContact O-NE2 2.76Å
242	H	71.4	Confident	65	Low	107 Å²	107	78.6 Å²	78.6	50%	0.495	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-15.2	179.6	-64.7	-42.9	0	0	0	113.2	C240 R267	C240-H242 PolarHBondContact O-N 2.66Å; C240-H242 PolarHBondContact SG-N 3.12Å; H242-R267 PolarHBondContact CD2-NH1 2.86Å; H242-R267 PolarHBondContact CE1-NH1 2.89Å; H242-R267 VanDerWaalsContact CE1-NH1 3.28Å; H242-R267 PolarHBondContact ND1-NH1 3.47Å; H242-R267 PolarHBondContact NE2-NH1 3.26Å
243	H	73.1	Confident	66.9	Low	56 Å²	56	79.4 Å²	79.4	26%	0.259	40%	0.404	S	S	.	.	S	Bend	trans	-135.4	101.3	-177.6	-56	114.1	0	0	0	108.3	C240 G245 E246 C260 C263	C240-H243 HydrophobicContact CB-CB 4.21Å; C240-H243 CarbonylContact O-C 3.54Å; C240-H243 PolarHBondContact O-N 2.93Å; H243-G245 PolarHBondContact O-N 3.39Å; H243-E246 HydrophobicContact CB-CB 4.04Å; H243-E246 HydrophobicContact CB-CG 4.08Å; H243-E246 PolarHBondContact O-N 2.93Å; H243-C260 PolarHBondContact ND1-SG 2.8Å; H243-C260 VanDerWaalsContact ND1-SG 3.38Å; H243-C263 PolarHBondContact CE1-SG 3.48Å; H243-C263 PolarHBondContact ND1-SG 3.14Å
244	D	70.1	Confident	68.4	Low	169 Å²	169	79.6 Å²	79.6	90%	0.904	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	126.6	-176.5	-98.5	-16.1	0	0	0	111.3	E246	D244-E246 VanDerWaalsContact C-N 3.31Å; D244-E246 PolarHBondContact O-N 2.88Å
245	G	65.9	Low	70.3	Confident	56 Å²	56	75.8 Å²	75.8	58%	0.577	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-8.3	176.6	0	0	0	0	0	116.1	F239 H243	F239-G245 WeakPolarHBondContact CD1-O 3.28Å; H243-G245 PolarHBondContact O-N 3.39Å
246	E	74.4	Confident	72.1	Confident	76 Å²	76	76.5 Å²	76.5	36%	0.355	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-84.9	133.7	179.1	-77.1	-60.9	131.7	0	0	112.3	F239 C240 H243 D244 C260 E262	F239-E246 CarbonylContact C-O 3.5Å; F239-E246 WeakPolarHBondContact CA-O 3.25Å; C240-E246 HydrophobicContact CB-CB 4.4Å; C240-E246 PolarHBondContact N-O 3.43Å; H243-E246 HydrophobicContact CB-CB 4.04Å; H243-E246 HydrophobicContact CB-CG 4.08Å; H243-E246 PolarHBondContact O-N 2.93Å; D244-E246 VanDerWaalsContact C-N 3.31Å; D244-E246 PolarHBondContact O-N 2.88Å; E246-C260 HydrophobicContact CB-CB 3.96Å; E246-E262 HydrophobicContact CG-CG 4.26Å
247	V	77.3	Confident	73.4	Confident	71 Å²	71	67.3 Å²	67.3	43%	0.43	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-86	147.4	-179.1	-65.1	0	0	0	0	113.4	S238 F239 L249 C260	S238-V247 CarbonylContact O-C 3.56Å; S238-V247 WeakPolarHBondContact O-CA 3.42Å; S238-V247 VanDerWaalsContact O-CB 3.29Å; S238-V247 WeakPolarHBondContact O-CB 3.38Å; S238-V247 WeakPolarHBondContact O-CG1 3.46Å; F239-V247 HydrophobicContact CD1-CG1 3.62Å; F239-V247 HydrophobicContact CE1-CG1 3.45Å; F239-V247 VanDerWaalsContact CE1-CG1 3.45Å; F239-V247 HydrophobicContact CZ-CG1 4.24Å; V247-L249 PolarHBondContact O-N 3.35Å; V247-C260 WeakPolarHBondContact O-CA 3.46Å; V247-C260 WeakPolarHBondContact O-CB 3.42Å
248	F	78.2	Confident	74.6	Confident	43 Å²	43	64.3 Å²	64.3	19%	0.189	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-67.7	121.6	170.1	-67.1	-61.5	0	0	0	109.9	M237 S238 F239 C240 P258 L276	M237-F248 WeakPolarHBondContact O-CD2 3.32Å; M237-F248 WeakPolarHBondContact O-CE2 3.34Å; S238-F248 PolarHBondContact O-N 3.38Å; F239-F248 WeakPolarHBondContact O-CE2 3.5Å; C240-F248 HydrophobicContact CB-CE1 4.13Å; C240-F248 HydrophobicContact CB-CZ 4.48Å; F248-P258 HydrophobicContact CB-CB 4.19Å; F248-P258 HydrophobicContact CD1-CB 3.96Å; F248-P258 HydrophobicContact CD1-CG 4.39Å; F248-P258 WeakPolarHBondContact CD1-O 3.34Å; F248-P258 HydrophobicContact CE1-CB 4.46Å; F248-P258 HydrophobicContact CE1-CG 4.44Å; F248-P258 VanDerWaalsContact CE1-O 3.26Å; F248-P258 WeakPolarHBondContact CE1-O 2.83Å; F248-P258 HydrophobicContact CG-CB 4.01Å; F248-L276 HydrophobicContact CB-CD2 4.04Å
249	L	78.4	Confident	75.7	Confident	78 Å²	78	61.2 Å²	61.2	41%	0.408	33%	0.331	S	S	.	.			trans	-121.7	-29.6	-175.9	-172.7	64.3	0	0	0	112.3	V247 I259 Y275 L276	V247-L249 PolarHBondContact O-N 3.35Å; L249-I259 PolarHBondContact N-O 3.27Å; L249-I259 VanDerWaalsContact N-O 3.07Å; L249-Y275 HydrophobicContact CG-CD1 4.43Å; L249-L276 WeakPolarHBondContact O-CB 3.35Å; L249-L276 PolarHBondContact O-N 3.36Å
250	F	79.8	Confident	76.5	Confident	24 Å²	24	56.9 Å²	56.9	11%	0.105	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	156.2	-177.6	-52.6	-73.7	0	0	0	111.1	P258 I259 R261 Y273 V274 Y275	F250-P258 CarbonylContact O-C 3.44Å; F250-P258 WeakPolarHBondContact O-CA 3.32Å; F250-I259 HydrophobicContact CB-CD1 4.33Å; F250-I259 HydrophobicContact CB-CG1 3.78Å; F250-I259 PolarHBondContact N-O 3.01Å; F250-I259 PolarHBondContact O-N 3.15Å; F250-R261 HydrophobicContact CE2-CB 4.4Å; F250-Y273 HydrophobicContact CB-CD2 3.77Å; F250-Y273 HydrophobicContact CB-CG 4.34Å; F250-Y273 AromaticContact CD1-CD2 3.73Å; F250-Y273 HydrophobicContact CD1-CD2 3.73Å; F250-Y273 AromaticContact CD1-CE2 3.96Å; F250-Y273 HydrophobicContact CD1-CE2 3.96Å; F250-Y273 HydrophobicContact CD2-CD2 4.31Å; F250-Y273 HydrophobicContact CD2-CE2 4.28Å; F250-Y273 HydrophobicContact CE1-CD2 4.4Å; F250-Y273 HydrophobicContact CE1-CE2 4.18Å; F250-Y273 HydrophobicContact CE2-CE2 4.49Å; F250-Y273 AromaticContact CG-CD2 3.68Å; F250-Y273 HydrophobicContact CG-CD2 3.68Å; F250-Y273 HydrophobicContact CG-CE2 4.01Å; F250-Y273 HydrophobicContact CZ-CE2 4.44Å; F250-V274 CarbonylContact C-O 3.58Å; F250-V274 WeakPolarHBondContact CA-O 3.46Å; F250-V274 WeakPolarHBondContact CB-O 3.47Å; F250-Y275 AromaticContact CD1-CD1 3.99Å; F250-Y275 HydrophobicContact CD1-CD1 3.99Å; F250-Y275 HydrophobicContact CD1-CE1 4.23Å; F250-Y275 HydrophobicContact CD1-CG 4.49Å; F250-Y275 AromaticContact CE1-CD1 3.71Å; F250-Y275 HydrophobicContact CE1-CD1 3.71Å; F250-Y275 AromaticContact CE1-CE1 3.46Å; F250-Y275 HydrophobicContact CE1-CE1 3.46Å; F250-Y275 VanDerWaalsContact CE1-CE1 3.46Å; F250-Y275 HydrophobicContact CE1-CG 4.43Å; F250-Y275 HydrophobicContact CZ-CE1 4.2Å
251	F	82.9	Confident	77	Confident	58 Å²	58	64.7 Å²	64.7	25%	0.254	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.8	166.9	-175.6	-100.1	0	0	0	108.5	E253 Y273 V274 L276 A279	F251-E253 HydrophobicContact CD1-CG 4.44Å; F251-E253 PolarHBondContact O-N 3.11Å; F251-Y273 CarbonylContact O-C 3.52Å; F251-Y273 WeakPolarHBondContact O-CA 3.44Å; F251-Y273 VanDerWaalsContact O-CB 3.31Å; F251-Y273 WeakPolarHBondContact O-CB 3.47Å; F251-V274 HydrophobicContact CB-CG2 4.29Å; F251-V274 PolarHBondContact N-O 3.01Å; F251-V274 PolarHBondContact O-N 3.24Å; F251-L276 HydrophobicContact CB-CD1 3.96Å; F251-L276 HydrophobicContact CD2-CD1 4.25Å; F251-A279 HydrophobicContact CB-CB 3.62Å; F251-A279 HydrophobicContact CD1-CB 4.05Å; F251-A279 HydrophobicContact CG-CB 3.94Å
252	C	81.5	Confident	77.5	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	109.4	175.3	-177.5	0	0	0	0	109.2	T254 C255 S256 V257 I259 H268 H271 T272	C252-T254 VanDerWaalsContact C-N 3.34Å; C252-C255 HydrophobicContact CB-CB 4.36Å; C252-C255 PolarHBondContact O-N 2.98Å; C252-S256 VanDerWaalsContact O-CA 3.24Å; C252-S256 WeakPolarHBondContact O-CA 3.34Å; C252-S256 PolarHBondContact O-N 2.9Å; C252-V257 HydrophobicContact CB-CG2 4.42Å; C252-V257 PolarHBondContact N-O 3.31Å; C252-V257 PolarHBondContact O-N 2.73Å; C252-I259 HydrophobicContact CB-CD1 3.97Å; C252-I259 HydrophobicContact CB-CG1 4.3Å; C252-I259 HydrophobicContact CB-CG2 3.96Å; C252-H268 PolarHBondContact SG-ND1 3.46Å; C252-H268 VanDerWaalsContact SG-ND1 3.44Å; C252-H271 VanDerWaalsContact SG-CB 3.52Å; C252-T272 CarbonylContact C-O 3.56Å; C252-T272 WeakPolarHBondContact CA-O 3.48Å
253	E	79.2	Confident	78	Confident	98 Å²	98	59.1 Å²	59.1	46%	0.458	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-38.9	-179.2	-58.7	174.7	137.9	0	0	111	F251 C255 S256 T272 V274	F251-E253 HydrophobicContact CD1-CG 4.44Å; F251-E253 PolarHBondContact O-N 3.11Å; E253-C255 VanDerWaalsContact C-N 3.28Å; E253-C255 PolarHBondContact O-N 3.32Å; E253-S256 PolarHBondContact O-N 3.44Å; E253-S256 PolarHBondContact O-OG 3.43Å; E253-T272 PolarHBondContact N-O 3.27Å; E253-T272 WeakPolarHBondContact OE2-CB 3.46Å; E253-T272 PolarHBondContact OE2-OG1 3.49Å; E253-T272 VanDerWaalsContact OE2-OG1 3.05Å; E253-V274 HydrophobicContact CG-CG2 4.45Å
254	T	79.4	Confident	78.3	Confident	79 Å²	79	56.9 Å²	56.9	49%	0.485	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-37	-179.5	-43.4	0	0	0	0	112.4	C252 H271 T272	C252-T254 VanDerWaalsContact C-N 3.34Å; T254-H271 HydrophobicContact CG2-CB 4.41Å; T254-T272 PolarHBondContact OG1-N 3.49Å; T254-T272 PolarHBondContact OG1-OG1 3.24Å
255	C	78.2	Confident	78.8	Confident	48 Å²	48	53.1 Å²	53.1	32%	0.324	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-7.8	-179.7	-63.9	0	0	0	0	113.4	C252 E253 V257 H268 H271	C252-C255 HydrophobicContact CB-CB 4.36Å; C252-C255 PolarHBondContact O-N 2.98Å; E253-C255 VanDerWaalsContact C-N 3.28Å; E253-C255 PolarHBondContact O-N 3.32Å; C255-V257 VanDerWaalsContact C-N 3.29Å; C255-V257 HydrophobicContact CB-CG2 3.71Å; C255-V257 PolarHBondContact O-N 3.23Å; C255-H268 VanDerWaalsContact SG-CE1 3.56Å; C255-H268 PolarHBondContact SG-ND1 3.43Å; C255-H268 VanDerWaalsContact SG-ND1 3.36Å; C255-H271 PolarHBondContact SG-CE1 3.06Å; C255-H271 PolarHBondContact SG-ND1 3.07Å
256	S	77.8	Confident	79.6	Confident	54 Å²	54	52.3 Å²	52.3	38%	0.378	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	42.2	-173.6	-59.2	0	0	0	0	113.5	L229 C252 E253	L229-S256 VanDerWaalsContact CD1-O 3.25Å; L229-S256 WeakPolarHBondContact CD1-O 3.44Å; C252-S256 VanDerWaalsContact O-CA 3.24Å; C252-S256 WeakPolarHBondContact O-CA 3.34Å; C252-S256 PolarHBondContact O-N 2.9Å; E253-S256 PolarHBondContact O-N 3.44Å; E253-S256 PolarHBondContact O-OG 3.43Å
257	V	77.4	Confident	79.8	Confident	32 Å²	32	56 Å²	56	19%	0.194	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.7	-179.6	-65.8	0	0	0	0	112.3	L229 C252 C255 I259	L229-V257 HydrophobicContact CD2-CG1 3.56Å; C252-V257 HydrophobicContact CB-CG2 4.42Å; C252-V257 PolarHBondContact N-O 3.31Å; C252-V257 PolarHBondContact O-N 2.73Å; C255-V257 VanDerWaalsContact C-N 3.29Å; C255-V257 HydrophobicContact CB-CG2 3.71Å; C255-V257 PolarHBondContact O-N 3.23Å; V257-I259 HydrophobicContact CG2-CG2 3.93Å
258	P	78.6	Confident	79.9	Confident	26 Å²	26	53.9 Å²	53.9	17%	0.169	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	138.1	168	30.5	-33.9	0	0	0	110.1	F233 F248 F250 L276	F233-P258 HydrophobicContact CE1-CG 4.36Å; F233-P258 HydrophobicContact CZ-CG 4.01Å; F248-P258 HydrophobicContact CB-CB 4.19Å; F248-P258 HydrophobicContact CD1-CB 3.96Å; F248-P258 HydrophobicContact CD1-CG 4.39Å; F248-P258 WeakPolarHBondContact CD1-O 3.34Å; F248-P258 HydrophobicContact CE1-CB 4.46Å; F248-P258 HydrophobicContact CE1-CG 4.44Å; F248-P258 VanDerWaalsContact CE1-O 3.26Å; F248-P258 WeakPolarHBondContact CE1-O 2.83Å; F248-P258 HydrophobicContact CG-CB 4.01Å; F250-P258 CarbonylContact O-C 3.44Å; F250-P258 WeakPolarHBondContact O-CA 3.32Å; P258-L276 HydrophobicContact CB-CD1 4.09Å
259	I	78.3	Confident	79.8	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	146.5	-179.1	65.7	169.6	0	0	0	110.7	L249 F250 C252 V257 C263 H268 Y273	L249-I259 PolarHBondContact N-O 3.27Å; L249-I259 VanDerWaalsContact N-O 3.07Å; F250-I259 HydrophobicContact CB-CD1 4.33Å; F250-I259 HydrophobicContact CB-CG1 3.78Å; F250-I259 PolarHBondContact N-O 3.01Å; F250-I259 PolarHBondContact O-N 3.15Å; C252-I259 HydrophobicContact CB-CD1 3.97Å; C252-I259 HydrophobicContact CB-CG1 4.3Å; C252-I259 HydrophobicContact CB-CG2 3.96Å; V257-I259 HydrophobicContact CG2-CG2 3.93Å; I259-C263 HydrophobicContact CB-CB 3.73Å; I259-C263 HydrophobicContact CG2-CB 4.23Å; I259-H268 HydrophobicContact CD1-CB 4.2Å; I259-Y273 HydrophobicContact CD1-CD1 4.34Å; I259-Y273 HydrophobicContact CD1-CG 4.22Å
260	C	83	Confident	79.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.317	C	S	.	.			trans	-83.1	175.1	168.2	69	0	0	0	0	110.5	C240 H243 E246 V247 E262 C263 S264	C240-C260 HydrophobicContact CB-CB 3.85Å; H243-C260 PolarHBondContact ND1-SG 2.8Å; H243-C260 VanDerWaalsContact ND1-SG 3.38Å; E246-C260 HydrophobicContact CB-CB 3.96Å; V247-C260 WeakPolarHBondContact O-CA 3.46Å; V247-C260 WeakPolarHBondContact O-CB 3.42Å; C260-E262 VanDerWaalsContact C-N 3.34Å; C260-E262 PolarHBondContact O-N 3.05Å; C260-C263 WeakPolarHBondContact O-CB 3.5Å; C260-C263 PolarHBondContact O-N 3.42Å; C260-S264 PolarHBondContact O-N 2.86Å
261	R	81.4	Confident	80.2	Confident	172 Å²	172	59.7 Å²	59.7	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-58.7	-42.9	178.9	-172.7	179.7	-178.7	-178.6	-0.1	112.7	F250 C263 S264	F250-R261 HydrophobicContact CE2-CB 4.4Å; R261-C263 VanDerWaalsContact C-N 3.29Å; R261-C263 PolarHBondContact O-N 2.8Å; R261-S264 PolarHBondContact O-N 3.49Å; R261-S264 PolarHBondContact O-OG 3.34Å
262	E	81.3	Confident	80.3	Confident	95 Å²	95	60.7 Å²	60.7	44%	0.444	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-32	179.1	-64.8	-60.9	146.4	0	0	112.5	E246 C260 V265 G266	E246-E262 HydrophobicContact CG-CG 4.26Å; C260-E262 VanDerWaalsContact C-N 3.34Å; C260-E262 PolarHBondContact O-N 3.05Å; E262-V265 WeakPolarHBondContact O-CG2 3.42Å; E262-G266 PolarHBondContact O-N 3.04Å; E262-G266 VanDerWaalsContact O-N 3.1Å
263	C	81.4	Confident	80.4	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.034	36%	0.355	C	S	.	.	H	α-helix	trans	-67.7	-35.9	175.7	-80.7	0	0	0	0	112.9	H243 I259 C260 R261 V265 G266 R267 H268	H243-C263 PolarHBondContact CE1-SG 3.48Å; H243-C263 PolarHBondContact ND1-SG 3.14Å; I259-C263 HydrophobicContact CB-CB 3.73Å; I259-C263 HydrophobicContact CG2-CB 4.23Å; C260-C263 WeakPolarHBondContact O-CB 3.5Å; C260-C263 PolarHBondContact O-N 3.42Å; R261-C263 VanDerWaalsContact C-N 3.29Å; R261-C263 PolarHBondContact O-N 2.8Å; C263-V265 VanDerWaalsContact C-N 3.34Å; C263-G266 PolarHBondContact O-N 3.49Å; C263-R267 PolarHBondContact O-N 3.42Å; C263-H268 PolarHBondContact O-N 3.19Å
264	S	80.1	Confident	80.7	Confident	8 Å²	8	62.7 Å²	62.7	6%	0.056	35%	0.346	C	S	.	.	H	α-helix	trans	-69	-34	-178.7	70.8	0	0	0	0	112.4	C260 R261 H268	C260-S264 PolarHBondContact O-N 2.86Å; R261-S264 PolarHBondContact O-N 3.49Å; R261-S264 PolarHBondContact O-OG 3.34Å; S264-H268 CarbonylContact O-C 3.57Å
265	V	80.4	Confident	80.9	Confident	91 Å²	91	65.3 Å²	65.3	55%	0.552	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-0.4	175.6	-66.3	0	0	0	0	113.8	E262 C263 I269	E262-V265 WeakPolarHBondContact O-CG2 3.42Å; C263-V265 VanDerWaalsContact C-N 3.34Å; V265-I269 WeakPolarHBondContact O-CD1 3.45Å; V265-I269 VanDerWaalsContact O-CG1 3.29Å; V265-I269 WeakPolarHBondContact O-CG1 3.41Å
266	G	82.6	Confident	80.8	Confident	38 Å²	38	65.3 Å²	65.3	39%	0.392	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-98.5	178	0	0	0	0	0	111.9	E262 C263 H268 I269	E262-G266 PolarHBondContact O-N 3.04Å; E262-G266 VanDerWaalsContact O-N 3.1Å; C263-G266 PolarHBondContact O-N 3.49Å; G266-H268 PolarHBondContact O-N 3.42Å; G266-I269 WeakPolarHBondContact O-CD1 3.39Å; G266-I269 VanDerWaalsContact O-CG1 3.3Å; G266-I269 WeakPolarHBondContact O-CG1 3.34Å; G266-I269 PolarHBondContact O-N 3.41Å
267	R	78.3	Confident	80.6	Confident	154 Å²	154	69.4 Å²	69.4	58%	0.581	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-18	-171.9	-62.5	-172.3	-165.4	176.7	8	114.5	H242 C263	H242-R267 PolarHBondContact CD2-NH1 2.86Å; H242-R267 PolarHBondContact CE1-NH1 2.89Å; H242-R267 VanDerWaalsContact CE1-NH1 3.28Å; H242-R267 PolarHBondContact ND1-NH1 3.47Å; H242-R267 PolarHBondContact NE2-NH1 3.26Å; C263-R267 PolarHBondContact O-N 3.42Å
268	H	78.9	Confident	80.5	Confident	27 Å²	27	71.4 Å²	71.4	13%	0.125	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	26.2	179.8	-61.2	-102.9	0	0	0	112.1	C252 C255 I259 C263 S264 G266 G270 H271	C252-H268 PolarHBondContact SG-ND1 3.46Å; C252-H268 VanDerWaalsContact SG-ND1 3.44Å; C255-H268 VanDerWaalsContact SG-CE1 3.56Å; C255-H268 PolarHBondContact SG-ND1 3.43Å; C255-H268 VanDerWaalsContact SG-ND1 3.36Å; I259-H268 HydrophobicContact CD1-CB 4.2Å; C263-H268 PolarHBondContact O-N 3.19Å; S264-H268 CarbonylContact O-C 3.57Å; G266-H268 PolarHBondContact O-N 3.42Å; H268-G270 PolarHBondContact O-N 3.39Å; H268-H271 HydrophobicContact CB-CB 4.25Å; H268-H271 AromaticContact CG-ND1 3.89Å; H268-H271 AromaticContact ND1-ND1 3.47Å; H268-H271 PolarHBondContact ND1-ND1 2.99Å; H268-H271 WeakPolarHBondContact O-CB 3.33Å; H268-H271 PolarHBondContact O-N 3.45Å; H268-H271 VanDerWaalsContact O-N 3.1Å
269	I	77.5	Confident	80.2	Confident	125 Å²	125	70.9 Å²	70.9	64%	0.641	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	124.7	172.3	-79.1	165.6	0	0	0	109.6	V265 G266 H271	V265-I269 WeakPolarHBondContact O-CD1 3.45Å; V265-I269 VanDerWaalsContact O-CG1 3.29Å; V265-I269 WeakPolarHBondContact O-CG1 3.41Å; G266-I269 WeakPolarHBondContact O-CD1 3.39Å; G266-I269 VanDerWaalsContact O-CG1 3.3Å; G266-I269 WeakPolarHBondContact O-CG1 3.34Å; G266-I269 PolarHBondContact O-N 3.41Å; I269-H271 VanDerWaalsContact C-N 3.33Å
270	G	77.2	Confident	80.1	Confident	78 Å²	78	75 Å²	75	80%	0.804	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	1.5	178.5	0	0	0	0	0	114.8	H268	H268-G270 PolarHBondContact O-N 3.39Å
271	H	87.9	Confident	79.7	Confident	64 Å²	64	80.2 Å²	80.2	30%	0.296	41%	0.414	S	S	.	.			trans	-87.8	151	171.9	-64.7	165.7	0	0	0	111.8	C252 T254 C255 H268 I269 Y273	C252-H271 VanDerWaalsContact SG-CB 3.52Å; T254-H271 HydrophobicContact CG2-CB 4.41Å; C255-H271 PolarHBondContact SG-CE1 3.06Å; C255-H271 PolarHBondContact SG-ND1 3.07Å; H268-H271 HydrophobicContact CB-CB 4.25Å; H268-H271 AromaticContact CG-ND1 3.89Å; H268-H271 AromaticContact ND1-ND1 3.47Å; H268-H271 PolarHBondContact ND1-ND1 2.99Å; H268-H271 WeakPolarHBondContact O-CB 3.33Å; H268-H271 PolarHBondContact O-N 3.45Å; H268-H271 VanDerWaalsContact O-N 3.1Å; I269-H271 VanDerWaalsContact C-N 3.33Å; H271-Y273 WeakPolarHBondContact O-CD1 3.28Å
272	T	85.1	Confident	79.2	Confident	78 Å²	78	76.7 Å²	76.7	48%	0.479	41%	0.408	S	S	.	.			trans	-79.4	135.4	172.9	59.7	0	0	0	0	109.8	C252 E253 T254	C252-T272 CarbonylContact C-O 3.56Å; C252-T272 WeakPolarHBondContact CA-O 3.48Å; E253-T272 PolarHBondContact N-O 3.27Å; E253-T272 WeakPolarHBondContact OE2-CB 3.46Å; E253-T272 PolarHBondContact OE2-OG1 3.49Å; E253-T272 VanDerWaalsContact OE2-OG1 3.05Å; T254-T272 PolarHBondContact OG1-N 3.49Å; T254-T272 PolarHBondContact OG1-OG1 3.24Å
273	Y	84.8	Confident	79	Confident	96 Å²	96	75.7 Å²	75.7	38%	0.376	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	148.4	177.3	60.6	-96.4	0	0	0	110.8	F250 F251 I259 H271	F250-Y273 HydrophobicContact CB-CD2 3.77Å; F250-Y273 HydrophobicContact CB-CG 4.34Å; F250-Y273 AromaticContact CD1-CD2 3.73Å; F250-Y273 HydrophobicContact CD1-CD2 3.73Å; F250-Y273 AromaticContact CD1-CE2 3.96Å; F250-Y273 HydrophobicContact CD1-CE2 3.96Å; F250-Y273 HydrophobicContact CD2-CD2 4.31Å; F250-Y273 HydrophobicContact CD2-CE2 4.28Å; F250-Y273 HydrophobicContact CE1-CD2 4.4Å; F250-Y273 HydrophobicContact CE1-CE2 4.18Å; F250-Y273 HydrophobicContact CE2-CE2 4.49Å; F250-Y273 AromaticContact CG-CD2 3.68Å; F250-Y273 HydrophobicContact CG-CD2 3.68Å; F250-Y273 HydrophobicContact CG-CE2 4.01Å; F250-Y273 HydrophobicContact CZ-CE2 4.44Å; F251-Y273 CarbonylContact O-C 3.52Å; F251-Y273 WeakPolarHBondContact O-CA 3.44Å; F251-Y273 VanDerWaalsContact O-CB 3.31Å; F251-Y273 WeakPolarHBondContact O-CB 3.47Å; I259-Y273 HydrophobicContact CD1-CD1 4.34Å; I259-Y273 HydrophobicContact CD1-CG 4.22Å; H271-Y273 WeakPolarHBondContact O-CD1 3.28Å
274	V	85.6	Confident	78.8	Confident	45 Å²	45	81.9 Å²	81.9	27%	0.273	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	168.8	179	-65.1	0	0	0	0	109.9	F250 F251 E253 L276 A279	F250-V274 CarbonylContact C-O 3.58Å; F250-V274 WeakPolarHBondContact CA-O 3.46Å; F250-V274 WeakPolarHBondContact CB-O 3.47Å; F251-V274 HydrophobicContact CB-CG2 4.29Å; F251-V274 PolarHBondContact N-O 3.01Å; F251-V274 PolarHBondContact O-N 3.24Å; E253-V274 HydrophobicContact CG-CG2 4.45Å; V274-L276 PolarHBondContact O-N 3.11Å; V274-A279 HydrophobicContact CG2-CB 3.7Å
275	Y	82.9	Confident	78.5	Confident	134 Å²	134	84.2 Å²	84.2	53%	0.525	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	137.2	171.3	-75	-75.7	0	0	0	109.9	L249 F250 Q277 D278 A279	L249-Y275 HydrophobicContact CG-CD1 4.43Å; F250-Y275 AromaticContact CD1-CD1 3.99Å; F250-Y275 HydrophobicContact CD1-CD1 3.99Å; F250-Y275 HydrophobicContact CD1-CE1 4.23Å; F250-Y275 HydrophobicContact CD1-CG 4.49Å; F250-Y275 AromaticContact CE1-CD1 3.71Å; F250-Y275 HydrophobicContact CE1-CD1 3.71Å; F250-Y275 AromaticContact CE1-CE1 3.46Å; F250-Y275 HydrophobicContact CE1-CE1 3.46Å; F250-Y275 VanDerWaalsContact CE1-CE1 3.46Å; F250-Y275 HydrophobicContact CE1-CG 4.43Å; F250-Y275 HydrophobicContact CZ-CE1 4.2Å; Y275-Q277 PolarHBondContact O-N 2.87Å; Y275-D278 PolarHBondContact O-N 3.11Å; Y275-D278 VanDerWaalsContact O-N 3.12Å; Y275-A279 PolarHBondContact O-N 3.25Å
276	L	76	Confident	78.3	Confident	47 Å²	47	84.8 Å²	84.8	25%	0.246	45%	0.452	C	S	.	.	H	α-helix	trans	-59.4	-34.6	-176.8	-177	62.9	0	0	0	111.5	F248 L249 F251 P258 V274 V280	F248-L276 HydrophobicContact CB-CD2 4.04Å; L249-L276 WeakPolarHBondContact O-CB 3.35Å; L249-L276 PolarHBondContact O-N 3.36Å; F251-L276 HydrophobicContact CB-CD1 3.96Å; F251-L276 HydrophobicContact CD2-CD1 4.25Å; P258-L276 HydrophobicContact CB-CD1 4.09Å; V274-L276 PolarHBondContact O-N 3.11Å; L276-V280 HydrophobicContact CD1-CG2 4.5Å; L276-V280 WeakPolarHBondContact O-CB 3.4Å; L276-V280 WeakPolarHBondContact O-CG2 3.35Å; L276-V280 PolarHBondContact O-N 3.41Å
277	Q	74.6	Confident	77.9	Confident	140 Å²	140	86.8 Å²	86.8	65%	0.654	46%	0.457	S	S	*	.	H	α-helix	trans	-66.3	-41	177.8	-169.8	169.4	3.6	0	0	112.4	Y275 V280 Q281	Y275-Q277 PolarHBondContact O-N 2.87Å; Q277-V280 PolarHBondContact O-N 3.36Å; Q277-Q281 WeakPolarHBondContact O-CG 3.34Å; Q277-Q281 PolarHBondContact O-N 3.23Å
278	D	73.8	Confident	78	Confident	75 Å²	75	84.2 Å²	84.2	40%	0.401	45%	0.454	S	S	.	.	H	α-helix	trans	-68.3	-45.9	177.6	-59.2	-18.2	0	0	0	110.2	Y275 V280 Q281 D282	Y275-D278 PolarHBondContact O-N 3.11Å; Y275-D278 VanDerWaalsContact O-N 3.12Å; D278-V280 VanDerWaalsContact C-N 3.25Å; D278-V280 PolarHBondContact O-N 2.78Å; D278-Q281 PolarHBondContact O-N 3.05Å; D278-Q281 VanDerWaalsContact O-N 3.08Å; D278-D282 PolarHBondContact O-N 3.35Å
279	A	73.4	Confident	78.1	Confident	14 Å²	14	88.2 Å²	88.2	12%	0.116	47%	0.472	C	S	.	.	H	α-helix	trans	-57.4	-37.9	173.3	0	0	0	0	0	112.9	F251 V274 Y275 C283	F251-A279 HydrophobicContact CB-CB 3.62Å; F251-A279 HydrophobicContact CD1-CB 4.05Å; F251-A279 HydrophobicContact CG-CB 3.94Å; V274-A279 HydrophobicContact CG2-CB 3.7Å; Y275-A279 PolarHBondContact O-N 3.25Å; A279-C283 WeakPolarHBondContact O-CB 3.45Å; A279-C283 PolarHBondContact O-N 2.89Å
280	V	74.9	Confident	78.1	Confident	89 Å²	89	87.4 Å²	87.4	54%	0.539	47%	0.469	S	S	.	.	H	α-helix	trans	-69.3	-40.2	176.5	167.7	0	0	0	0	111.1	L276 Q277 D278 R284	L276-V280 HydrophobicContact CD1-CG2 4.5Å; L276-V280 WeakPolarHBondContact O-CB 3.4Å; L276-V280 WeakPolarHBondContact O-CG2 3.35Å; L276-V280 PolarHBondContact O-N 3.41Å; Q277-V280 PolarHBondContact O-N 3.36Å; D278-V280 VanDerWaalsContact C-N 3.25Å; D278-V280 PolarHBondContact O-N 2.78Å; V280-R284 VanDerWaalsContact O-CB 3.24Å; V280-R284 WeakPolarHBondContact O-CB 3.33Å; V280-R284 PolarHBondContact O-N 2.94Å
281	Q	75.1	Confident	78.4	Confident	109 Å²	109	88.5 Å²	88.5	51%	0.509	46%	0.455	S	S	.	.	H	α-helix	trans	-65.7	-45.6	176.1	-73.3	178.3	14.3	0	0	111.7	Q277 D278 R284 A285	Q277-Q281 WeakPolarHBondContact O-CG 3.34Å; Q277-Q281 PolarHBondContact O-N 3.23Å; D278-Q281 PolarHBondContact O-N 3.05Å; D278-Q281 VanDerWaalsContact O-N 3.08Å; Q281-R284 WeakPolarHBondContact O-CB 3.44Å; Q281-R284 PolarHBondContact O-N 3.2Å; Q281-A285 PolarHBondContact O-N 3.08Å
282	D	72.4	Confident	78.3	Confident	99 Å²	99	87.5 Å²	87.5	53%	0.529	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-45.3	176.8	-70.7	-18.1	0	0	0	111.1	D278 R284 A285 I286	D278-D282 PolarHBondContact O-N 3.35Å; D282-R284 VanDerWaalsContact C-N 3.3Å; D282-R284 PolarHBondContact O-N 2.75Å; D282-A285 PolarHBondContact O-N 2.83Å; D282-I286 WeakPolarHBondContact O-CB 2.99Å; D282-I286 VanDerWaalsContact O-CG1 3.28Å; D282-I286 WeakPolarHBondContact O-CG1 3.28Å; D282-I286 PolarHBondContact O-N 3.3Å
283	C	76.1	Confident	78.2	Confident	73 Å²	73	87.2 Å²	87.2	49%	0.493	45%	0.454	S	S	.	.	H	α-helix	trans	-61.5	-39.3	175.1	-174.4	0	0	0	0	111.6	A279 T287	A279-C283 WeakPolarHBondContact O-CB 3.45Å; A279-C283 PolarHBondContact O-N 2.89Å; C283-T287 VanDerWaalsContact O-CB 3.25Å; C283-T287 WeakPolarHBondContact O-CB 3.16Å; C283-T287 PolarHBondContact O-N 2.94Å; C283-T287 PolarHBondContact O-OG1 3.2Å
284	R	76.9	Confident	78.1	Confident	135 Å²	135	85.6 Å²	85.6	51%	0.509	46%	0.461	S	S	.	.	H	α-helix	trans	-63.6	-45.6	174.6	-177.3	178.8	178.8	174.8	1.4	111.3	V280 Q281 D282 T287 I288	V280-R284 VanDerWaalsContact O-CB 3.24Å; V280-R284 WeakPolarHBondContact O-CB 3.33Å; V280-R284 PolarHBondContact O-N 2.94Å; Q281-R284 WeakPolarHBondContact O-CB 3.44Å; Q281-R284 PolarHBondContact O-N 3.2Å; D282-R284 VanDerWaalsContact C-N 3.3Å; D282-R284 PolarHBondContact O-N 2.75Å; R284-T287 PolarHBondContact O-N 2.83Å; R284-I288 HydrophobicContact CG-CD1 3.97Å; R284-I288 VanDerWaalsContact O-CG1 3.26Å; R284-I288 WeakPolarHBondContact O-CG1 3.45Å; R284-I288 PolarHBondContact O-N 3.31Å
285	A	74.3	Confident	78.2	Confident	57 Å²	57	88.5 Å²	88.5	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-47.7	177.7	0	0	0	0	0	111.7	Q281 D282 T287 I288 Q289	Q281-A285 PolarHBondContact O-N 3.08Å; D282-A285 PolarHBondContact O-N 2.83Å; A285-T287 VanDerWaalsContact C-N 3.33Å; A285-T287 PolarHBondContact O-N 3.48Å; A285-I288 PolarHBondContact O-N 3.31Å; A285-Q289 PolarHBondContact O-N 3.43Å
286	I	75.4	Confident	78.5	Confident	104 Å²	104	88.5 Å²	88.5	53%	0.533	48%	0.476	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175.8	-66.7	165.5	0	0	0	110.8	D282 I288 Q289 L290	D282-I286 WeakPolarHBondContact O-CB 2.99Å; D282-I286 VanDerWaalsContact O-CG1 3.28Å; D282-I286 WeakPolarHBondContact O-CG1 3.28Å; D282-I286 PolarHBondContact O-N 3.3Å; I286-I288 PolarHBondContact O-N 2.88Å; I286-Q289 PolarHBondContact O-N 2.8Å; I286-L290 HydrophobicContact CG2-CD1 3.93Å; I286-L290 HydrophobicContact CG2-CG 4.28Å; I286-L290 WeakPolarHBondContact O-CB 3.41Å; I286-L290 WeakPolarHBondContact O-CG 3.3Å; I286-L290 PolarHBondContact O-N 3.01Å
287	T	74.6	Confident	78.9	Confident	80 Å²	80	88 Å²	88	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-38.6	179.3	-57.7	0	0	0	0	111.8	C283 R284 A285 L290 L291	C283-T287 VanDerWaalsContact O-CB 3.25Å; C283-T287 WeakPolarHBondContact O-CB 3.16Å; C283-T287 PolarHBondContact O-N 2.94Å; C283-T287 PolarHBondContact O-OG1 3.2Å; R284-T287 PolarHBondContact O-N 2.83Å; A285-T287 VanDerWaalsContact C-N 3.33Å; A285-T287 PolarHBondContact O-N 3.48Å; T287-L290 PolarHBondContact O-N 3.16Å; T287-L291 WeakPolarHBondContact O-CB 3.32Å; T287-L291 PolarHBondContact O-N 3.18Å
288	I	81.6	Confident	79.7	Confident	100 Å²	100	88.4 Å²	88.4	51%	0.513	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-43.2	173.2	-70.6	165.5	0	0	0	110.4	R284 A285 I286 L291 A292	R284-I288 HydrophobicContact CG-CD1 3.97Å; R284-I288 VanDerWaalsContact O-CG1 3.26Å; R284-I288 WeakPolarHBondContact O-CG1 3.45Å; R284-I288 PolarHBondContact O-N 3.31Å; A285-I288 PolarHBondContact O-N 3.31Å; I286-I288 PolarHBondContact O-N 2.88Å; I288-L291 WeakPolarHBondContact O-CB 3.38Å; I288-L291 PolarHBondContact O-N 3.21Å; I288-A292 PolarHBondContact O-N 3.32Å
289	Q	79.1	Confident	80.5	Confident	110 Å²	110	90.1 Å²	90.1	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-47.3	176.7	-173.8	60.4	47	0	0	111.8	A285 I286 L291 A292 D293	A285-Q289 PolarHBondContact O-N 3.43Å; I286-Q289 PolarHBondContact O-N 2.8Å; Q289-L291 PolarHBondContact O-N 3.45Å; Q289-A292 WeakPolarHBondContact O-CB 3.44Å; Q289-A292 PolarHBondContact O-N 2.89Å; Q289-D293 PolarHBondContact NE2-OD1 2.77Å; Q289-D293 VanDerWaalsContact O-CG 3.29Å; Q289-D293 PolarHBondContact O-N 2.84Å
290	L	79.3	Confident	81	Confident	108 Å²	108	92.1 Å²	92.1	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-59.7	-36	175.7	-72.1	172.8	0	0	0	111.9	I286 T287 A294	I286-L290 HydrophobicContact CG2-CD1 3.93Å; I286-L290 HydrophobicContact CG2-CG 4.28Å; I286-L290 WeakPolarHBondContact O-CB 3.41Å; I286-L290 WeakPolarHBondContact O-CG 3.3Å; I286-L290 PolarHBondContact O-N 3.01Å; T287-L290 PolarHBondContact O-N 3.16Å; L290-A294 VanDerWaalsContact O-CB 3.27Å; L290-A294 WeakPolarHBondContact O-CB 3.27Å; L290-A294 PolarHBondContact O-N 3.19Å
291	L	83.1	Confident	81.6	Confident	101 Å²	101	92.1 Å²	92.1	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-42.5	174.1	-177.9	65.2	0	0	0	111.4	T287 I288 Q289 A294 Q295	T287-L291 WeakPolarHBondContact O-CB 3.32Å; T287-L291 PolarHBondContact O-N 3.18Å; I288-L291 WeakPolarHBondContact O-CB 3.38Å; I288-L291 PolarHBondContact O-N 3.21Å; Q289-L291 PolarHBondContact O-N 3.45Å; L291-A294 PolarHBondContact O-N 3.39Å; L291-Q295 WeakPolarHBondContact O-CB 3.22Å; L291-Q295 VanDerWaalsContact O-CG 3.23Å; L291-Q295 WeakPolarHBondContact O-CG 3.47Å; L291-Q295 PolarHBondContact O-N 2.88Å
292	A	85.8	Confident	82.3	Confident	43 Å²	43	91.4 Å²	91.4	36%	0.355	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-46.2	175.3	0	0	0	0	0	111.4	I288 Q289 A294 Q295 Q296	I288-A292 PolarHBondContact O-N 3.32Å; Q289-A292 WeakPolarHBondContact O-CB 3.44Å; Q289-A292 PolarHBondContact O-N 2.89Å; A292-A294 VanDerWaalsContact C-N 3.35Å; A292-A294 PolarHBondContact O-N 2.86Å; A292-Q295 WeakPolarHBondContact O-CB 3.46Å; A292-Q295 PolarHBondContact O-N 2.82Å; A292-Q296 PolarHBondContact O-N 3.21Å
293	D	82.7	Confident	83.1	Confident	72 Å²	72	91 Å²	91	39%	0.385	49%	0.491	S	S	.	.	H	α-helix	trans	-61.1	-42.6	176.4	-64.5	-10.3	0	0	0	111.2	Q289 Q296 G297	Q289-D293 PolarHBondContact NE2-OD1 2.77Å; Q289-D293 VanDerWaalsContact O-CG 3.29Å; Q289-D293 PolarHBondContact O-N 2.84Å; D293-Q296 PolarHBondContact O-N 2.76Å; D293-G297 PolarHBondContact O-N 3.39Å
294	A	82.6	Confident	83.7	Confident	63 Å²	63	90.7 Å²	90.7	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-38.7	175.5	0	0	0	0	0	112.3	L290 L291 A292 G297 R298	L290-A294 VanDerWaalsContact O-CB 3.27Å; L290-A294 WeakPolarHBondContact O-CB 3.27Å; L290-A294 PolarHBondContact O-N 3.19Å; L291-A294 PolarHBondContact O-N 3.39Å; A292-A294 VanDerWaalsContact C-N 3.35Å; A292-A294 PolarHBondContact O-N 2.86Å; A294-G297 PolarHBondContact O-N 2.84Å; A294-R298 WeakPolarHBondContact O-CB 3.29Å; A294-R298 PolarHBondContact O-N 3.15Å
295	Q	88.7	Confident	84.3	Confident	105 Å²	105	89.4 Å²	89.4	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-40.2	175.2	-74.9	176.4	6.9	0	0	111.8	L291 A292 R298 Q299	L291-Q295 WeakPolarHBondContact O-CB 3.22Å; L291-Q295 VanDerWaalsContact O-CG 3.23Å; L291-Q295 WeakPolarHBondContact O-CG 3.47Å; L291-Q295 PolarHBondContact O-N 2.88Å; A292-Q295 WeakPolarHBondContact O-CB 3.46Å; A292-Q295 PolarHBondContact O-N 2.82Å; Q295-R298 WeakPolarHBondContact O-CB 3.42Å; Q295-R298 PolarHBondContact O-N 3.02Å; Q295-Q299 PolarHBondContact O-N 2.88Å
296	Q	88.8	Confident	85.1	Confident	134 Å²	134	91.9 Å²	91.9	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-64.1	-45.6	173.8	-173.1	-178.2	14.4	0	0	111	A292 D293 R298 Q299 A300	A292-Q296 PolarHBondContact O-N 3.21Å; D293-Q296 PolarHBondContact O-N 2.76Å; Q296-R298 VanDerWaalsContact C-N 3.32Å; Q296-R298 PolarHBondContact O-N 3.05Å; Q296-Q299 PolarHBondContact O-N 3.33Å; Q296-Q299 VanDerWaalsContact O-N 3.16Å; Q296-A300 PolarHBondContact O-N 3.42Å
297	G	83.4	Confident	85.7	Confident	36 Å²	36	94.2 Å²	94.2	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-56.6	-44.7	173.6	0	0	0	0	0	112.1	D293 A294 Q299 A300 V301	D293-G297 PolarHBondContact O-N 3.39Å; A294-G297 PolarHBondContact O-N 2.84Å; G297-Q299 PolarHBondContact O-N 3.2Å; G297-A300 PolarHBondContact O-N 3.4Å; G297-V301 WeakPolarHBondContact O-CG2 3.48Å; G297-V301 PolarHBondContact O-N 3.45Å
298	R	91.4	Very high	86.2	Confident	150 Å²	150	94.4 Å²	94.4	57%	0.566	50%	0.5	S	S	*	.	H	α-helix	trans	-58.8	-44.6	174.6	-175.2	-173.3	65.8	78.8	2.6	112.1	A294 Q295 Q296 V301 Q302	A294-R298 WeakPolarHBondContact O-CB 3.29Å; A294-R298 PolarHBondContact O-N 3.15Å; Q295-R298 WeakPolarHBondContact O-CB 3.42Å; Q295-R298 PolarHBondContact O-N 3.02Å; Q296-R298 VanDerWaalsContact C-N 3.32Å; Q296-R298 PolarHBondContact O-N 3.05Å; R298-V301 PolarHBondContact O-N 3.03Å; R298-Q302 WeakPolarHBondContact O-CB 3.49Å; R298-Q302 PolarHBondContact O-N 2.9Å
299	Q	90.2	Very high	86.7	Confident	111 Å²	111	95 Å²	95	52%	0.519	50%	0.5	S	S	.	.	H	α-helix	trans	-64.5	-41	178	-173	178.1	4.3	0	0	111.8	Q295 Q296 G297 Q302 Q303	Q295-Q299 PolarHBondContact O-N 2.88Å; Q296-Q299 PolarHBondContact O-N 3.33Å; Q296-Q299 VanDerWaalsContact O-N 3.16Å; G297-Q299 PolarHBondContact O-N 3.2Å; Q299-Q302 PolarHBondContact O-N 3.38Å; Q299-Q303 WeakPolarHBondContact O-CG 3.43Å; Q299-Q303 PolarHBondContact O-N 2.86Å
300	A	85.8	Confident	87.2	Confident	56 Å²	56	92.4 Å²	92.4	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-42.2	176.1	0	0	0	0	0	112.1	Q296 G297 S304	Q296-A300 PolarHBondContact O-N 3.42Å; G297-A300 PolarHBondContact O-N 3.4Å; A300-S304 WeakPolarHBondContact O-CB 3.38Å; A300-S304 PolarHBondContact O-N 3.02Å
301	V	85.9	Confident	87.6	Confident	89 Å²	89	92.8 Å²	92.8	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-44.3	174.1	175.4	0	0	0	0	110.7	G297 R298 Q303 S304 M305	G297-V301 WeakPolarHBondContact O-CG2 3.48Å; G297-V301 PolarHBondContact O-N 3.45Å; R298-V301 PolarHBondContact O-N 3.03Å; V301-Q303 PolarHBondContact O-N 3.23Å; V301-S304 WeakPolarHBondContact O-CB 3.33Å; V301-S304 PolarHBondContact O-N 3.48Å; V301-S304 VanDerWaalsContact O-N 3.16Å; V301-M305 HydrophobicContact CG1-CG 4.44Å; V301-M305 HydrophobicContact CG1-SD 4.33Å; V301-M305 WeakPolarHBondContact O-CG 3.31Å; V301-M305 PolarHBondContact O-N 2.89Å
302	Q	90.8	Very high	87.7	Confident	93 Å²	93	91 Å²	91	44%	0.435	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-44.8	179.7	-172.1	167.4	-5	0	0	112.4	R298 Q299 S304 M305 E306	R298-Q302 WeakPolarHBondContact O-CB 3.49Å; R298-Q302 PolarHBondContact O-N 2.9Å; Q299-Q302 PolarHBondContact O-N 3.38Å; Q302-S304 VanDerWaalsContact C-N 3.29Å; Q302-S304 PolarHBondContact O-N 2.71Å; Q302-M305 WeakPolarHBondContact O-CB 3.49Å; Q302-M305 PolarHBondContact O-N 2.91Å; Q302-E306 PolarHBondContact O-N 3.31Å; Q302-E306 VanDerWaalsContact O-N 3.08Å
303	Q	89.7	Confident	88	Confident	92 Å²	92	95.2 Å²	95.2	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-35.3	174.2	-71.4	176.7	-4.1	0	0	112.5	Q299 V301 K307	Q299-Q303 WeakPolarHBondContact O-CG 3.43Å; Q299-Q303 PolarHBondContact O-N 2.86Å; V301-Q303 PolarHBondContact O-N 3.23Å; Q303-K307 WeakPolarHBondContact O-CG 3.23Å; Q303-K307 PolarHBondContact O-N 2.83Å; Q303-K307 VanDerWaalsContact O-N 3.14Å
304	S	88.5	Confident	88.3	Confident	66 Å²	66	96.7 Å²	96.7	46%	0.462	52%	0.515	S	S	.	.	H	α-helix	trans	-65.6	-42.5	174.5	-169.4	0	0	0	0	111.5	A300 V301 Q302 E306 K307 V308	A300-S304 WeakPolarHBondContact O-CB 3.38Å; A300-S304 PolarHBondContact O-N 3.02Å; V301-S304 WeakPolarHBondContact O-CB 3.33Å; V301-S304 PolarHBondContact O-N 3.48Å; V301-S304 VanDerWaalsContact O-N 3.16Å; Q302-S304 VanDerWaalsContact C-N 3.29Å; Q302-S304 PolarHBondContact O-N 2.71Å; S304-E306 PolarHBondContact O-N 2.83Å; S304-K307 PolarHBondContact O-N 2.79Å; S304-V308 WeakPolarHBondContact O-CG2 3.48Å; S304-V308 PolarHBondContact O-N 2.79Å
305	M	88.6	Confident	88.5	Confident	107 Å²	107	98.2 Å²	98.2	53%	0.527	52%	0.517	S	S	.	.	H	α-helix	trans	-59.2	-45.9	175.7	-70.8	177.9	66.9	0	0	111.6	V301 Q302 K307 V308 Q309	V301-M305 HydrophobicContact CG1-CG 4.44Å; V301-M305 HydrophobicContact CG1-SD 4.33Å; V301-M305 WeakPolarHBondContact O-CG 3.31Å; V301-M305 PolarHBondContact O-N 2.89Å; Q302-M305 WeakPolarHBondContact O-CB 3.49Å; Q302-M305 PolarHBondContact O-N 2.91Å; M305-K307 VanDerWaalsContact C-N 3.35Å; M305-K307 PolarHBondContact O-N 2.94Å; M305-V308 PolarHBondContact O-N 2.92Å; M305-Q309 WeakPolarHBondContact O-CB 3.45Å; M305-Q309 WeakPolarHBondContact O-CG 3.14Å; M305-Q309 PolarHBondContact O-N 2.97Å
306	E	91.6	Very high	88.6	Confident	110 Å²	110	98.1 Å²	98.1	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-59.7	-43.8	177	-71.5	170.3	-169.3	0	0	111.7	Q302 S304 Q309 A310	Q302-E306 PolarHBondContact O-N 3.31Å; Q302-E306 VanDerWaalsContact O-N 3.08Å; S304-E306 PolarHBondContact O-N 2.83Å; E306-Q309 PolarHBondContact O-N 3.31Å; E306-A310 WeakPolarHBondContact O-CB 3.48Å; E306-A310 PolarHBondContact O-N 3.37Å
307	K	86.8	Confident	88.8	Confident	152 Å²	152	96.9 Å²	96.9	66%	0.661	51%	0.513	S	S	*	.	H	α-helix	trans	-62.6	-43.9	175.9	-72.7	174.1	-177.4	177.7	0	112.5	Q303 S304 M305 M311	Q303-K307 WeakPolarHBondContact O-CG 3.23Å; Q303-K307 PolarHBondContact O-N 2.83Å; Q303-K307 VanDerWaalsContact O-N 3.14Å; S304-K307 PolarHBondContact O-N 2.79Å; M305-K307 VanDerWaalsContact C-N 3.35Å; M305-K307 PolarHBondContact O-N 2.94Å; K307-M311 WeakPolarHBondContact O-CB 3.45Å; K307-M311 PolarHBondContact O-N 2.88Å
308	V	86.2	Confident	89.1	Confident	84 Å²	84	100.9 Å²	100.9	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-42.1	179.1	171.3	0	0	0	0	110.9	S304 M305 M311 A312	S304-V308 WeakPolarHBondContact O-CG2 3.48Å; S304-V308 PolarHBondContact O-N 2.79Å; M305-V308 PolarHBondContact O-N 2.92Å; V308-M311 PolarHBondContact O-N 2.87Å; V308-A312 WeakPolarHBondContact O-CB 3.37Å; V308-A312 PolarHBondContact O-N 2.8Å
309	Q	91.8	Very high	88.9	Confident	113 Å²	113	96.2 Å²	96.2	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-48.3	176.2	-75.3	175	-17.4	0	0	111.7	M305 E306 M311 A312 E313	M305-Q309 WeakPolarHBondContact O-CB 3.45Å; M305-Q309 WeakPolarHBondContact O-CG 3.14Å; M305-Q309 PolarHBondContact O-N 2.97Å; E306-Q309 PolarHBondContact O-N 3.31Å; Q309-M311 VanDerWaalsContact C-N 3.29Å; Q309-M311 PolarHBondContact O-N 2.82Å; Q309-A312 PolarHBondContact O-N 2.65Å; Q309-A312 VanDerWaalsContact O-N 3.16Å; Q309-E313 PolarHBondContact O-N 2.84Å
310	A	90.6	Very high	89	Confident	56 Å²	56	96.1 Å²	96.1	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-39.7	176.9	0	0	0	0	0	112.2	E306 Q314	E306-A310 WeakPolarHBondContact O-CB 3.48Å; E306-A310 PolarHBondContact O-N 3.37Å; A310-Q314 WeakPolarHBondContact O-CB 3.42Å; A310-Q314 PolarHBondContact O-N 2.93Å
311	M	87.1	Confident	89.3	Confident	115 Å²	115	97 Å²	97	57%	0.567	51%	0.511	S	S	*	.	H	α-helix	trans	-67.3	-40	176.6	-170.2	159.9	64.6	0	0	112.1	K307 V308 Q309 Q314 V315	K307-M311 WeakPolarHBondContact O-CB 3.45Å; K307-M311 PolarHBondContact O-N 2.88Å; V308-M311 PolarHBondContact O-N 2.87Å; Q309-M311 VanDerWaalsContact C-N 3.29Å; Q309-M311 PolarHBondContact O-N 2.82Å; M311-Q314 PolarHBondContact O-N 3.03Å; M311-V315 WeakPolarHBondContact O-CG2 3.39Å; M311-V315 PolarHBondContact O-N 3.1Å
312	A	84.8	Confident	89.6	Confident	63 Å²	63	95.7 Å²	95.7	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-44	176	0	0	0	0	0	112.1	V308 Q309 Q314 V315 E316	V308-A312 WeakPolarHBondContact O-CB 3.37Å; V308-A312 PolarHBondContact O-N 2.8Å; Q309-A312 PolarHBondContact O-N 2.65Å; Q309-A312 VanDerWaalsContact O-N 3.16Å; A312-Q314 VanDerWaalsContact C-N 3.32Å; A312-Q314 PolarHBondContact O-N 2.79Å; A312-V315 PolarHBondContact O-N 3.12Å; A312-E316 PolarHBondContact O-N 2.81Å
313	E	92.1	Very high	89.5	Confident	133 Å²	133	96.4 Å²	96.4	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-61.5	-41.2	173.7	-70.1	178.1	-177	0	0	111.8	Q309 V315 E316 I317	Q309-E313 PolarHBondContact O-N 2.84Å; E313-V315 VanDerWaalsContact C-N 3.35Å; E313-V315 PolarHBondContact O-N 3.46Å; E313-E316 PolarHBondContact O-N 2.87Å; E313-I317 WeakPolarHBondContact O-CG1 3.46Å; E313-I317 PolarHBondContact O-N 3.26Å; E313-I317 VanDerWaalsContact O-N 3.07Å
314	Q	90	Very high	89.7	Confident	103 Å²	103	96.2 Å²	96.2	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-65.6	-36.6	178.5	-166.5	177.4	29.7	0	0	112.6	A310 M311 A312 I317 K318	A310-Q314 WeakPolarHBondContact O-CB 3.42Å; A310-Q314 PolarHBondContact O-N 2.93Å; M311-Q314 PolarHBondContact O-N 3.03Å; A312-Q314 VanDerWaalsContact C-N 3.32Å; A312-Q314 PolarHBondContact O-N 2.79Å; Q314-I317 PolarHBondContact O-N 3.46Å; Q314-K318 HydrophobicContact CG-CD 4.36Å; Q314-K318 WeakPolarHBondContact O-CB 3.35Å; Q314-K318 WeakPolarHBondContact O-CG 3.48Å; Q314-K318 PolarHBondContact O-N 2.96Å
315	V	86.8	Confident	89.8	Confident	94 Å²	94	99 Å²	99	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-60.8	-46.2	174.5	169.1	0	0	0	0	110.5	M311 A312 E313 I317 K318 A319	M311-V315 WeakPolarHBondContact O-CG2 3.39Å; M311-V315 PolarHBondContact O-N 3.1Å; A312-V315 PolarHBondContact O-N 3.12Å; E313-V315 VanDerWaalsContact C-N 3.35Å; E313-V315 PolarHBondContact O-N 3.46Å; V315-I317 PolarHBondContact O-N 3.45Å; V315-K318 PolarHBondContact O-N 2.96Å; V315-A319 WeakPolarHBondContact O-CB 3.35Å; V315-A319 PolarHBondContact O-N 2.98Å
316	E	90.8	Very high	90	Very high	103 Å²	103	97 Å²	97	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-41	178.6	-178.5	61.7	-161.1	0	0	112.2	A312 E313 K320	A312-E316 PolarHBondContact O-N 2.81Å; E313-E316 PolarHBondContact O-N 2.87Å; E316-K320 WeakPolarHBondContact O-CG 3.25Å; E316-K320 PolarHBondContact O-N 2.8Å; E316-K320 WeakPolarHBondContact OE1-CE 3.29Å; E316-K320 IonicContact OE1-NZ 3.62Å; E316-K320 PolarHBondContact OE1-NZ 3.15Å
317	I	92.7	Very high	90	Very high	108 Å²	108	97.8 Å²	97.8	55%	0.554	51%	0.513	S	S	*	.	H	α-helix	trans	-64.8	-48.2	175.5	-66.4	167	0	0	0	110.6	E313 Q314 V315 A319 K320 V321	E313-I317 WeakPolarHBondContact O-CG1 3.46Å; E313-I317 PolarHBondContact O-N 3.26Å; E313-I317 VanDerWaalsContact O-N 3.07Å; Q314-I317 PolarHBondContact O-N 3.46Å; V315-I317 PolarHBondContact O-N 3.45Å; I317-A319 VanDerWaalsContact C-N 3.33Å; I317-A319 PolarHBondContact O-N 3.13Å; I317-K320 PolarHBondContact O-N 3.03Å; I317-V321 WeakPolarHBondContact O-CG2 3.42Å; I317-V321 PolarHBondContact O-N 2.9Å
318	K	89	Confident	90.3	Very high	121 Å²	121	92.9 Å²	92.9	53%	0.526	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-41.6	179.1	-76.9	178.8	176.7	178.5	0	111.7	Q314 V315 K320 V321 V322	Q314-K318 HydrophobicContact CG-CD 4.36Å; Q314-K318 WeakPolarHBondContact O-CB 3.35Å; Q314-K318 WeakPolarHBondContact O-CG 3.48Å; Q314-K318 PolarHBondContact O-N 2.96Å; V315-K318 PolarHBondContact O-N 2.96Å; K318-K320 VanDerWaalsContact C-N 3.33Å; K318-K320 PolarHBondContact O-N 3.22Å; K318-V321 PolarHBondContact O-N 2.71Å; K318-V322 WeakPolarHBondContact O-CG2 3.43Å; K318-V322 PolarHBondContact O-N 2.97Å
319	A	87.8	Confident	90.6	Very high	52 Å²	52	92.2 Å²	92.2	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-59	-43.4	175.9	0	0	0	0	0	111.9	V315 I317 V321 V322 Q323	V315-A319 WeakPolarHBondContact O-CB 3.35Å; V315-A319 PolarHBondContact O-N 2.98Å; I317-A319 VanDerWaalsContact C-N 3.33Å; I317-A319 PolarHBondContact O-N 3.13Å; A319-V321 PolarHBondContact O-N 2.9Å; A319-V322 PolarHBondContact O-N 3.24Å; A319-Q323 WeakPolarHBondContact O-CB 3.29Å; A319-Q323 PolarHBondContact O-N 3Å
320	K	91.4	Very high	90.6	Very high	109 Å²	109	91.1 Å²	91.1	47%	0.474	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-39.1	176	-74.7	171.2	-179.6	151.4	0	113	E316 I317 K318 T324	E316-K320 WeakPolarHBondContact O-CG 3.25Å; E316-K320 PolarHBondContact O-N 2.8Å; E316-K320 WeakPolarHBondContact OE1-CE 3.29Å; E316-K320 IonicContact OE1-NZ 3.62Å; E316-K320 PolarHBondContact OE1-NZ 3.15Å; I317-K320 PolarHBondContact O-N 3.03Å; K318-K320 VanDerWaalsContact C-N 3.33Å; K318-K320 PolarHBondContact O-N 3.22Å; K320-T324 PolarHBondContact O-N 3.21Å; K320-T324 VanDerWaalsContact O-N 3.1Å; K320-T324 PolarHBondContact O-OG1 3.34Å
321	V	93.3	Very high	90.7	Very high	73 Å²	73	94.1 Å²	94.1	44%	0.442	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-53.4	175.8	173.3	0	0	0	0	110.1	I317 K318 A319 Q323 T324 E325	I317-V321 WeakPolarHBondContact O-CG2 3.42Å; I317-V321 PolarHBondContact O-N 2.9Å; K318-V321 PolarHBondContact O-N 2.71Å; A319-V321 PolarHBondContact O-N 2.9Å; V321-Q323 VanDerWaalsContact C-N 3.31Å; V321-Q323 PolarHBondContact O-N 3.02Å; V321-T324 WeakPolarHBondContact O-CA 3.48Å; V321-T324 WeakPolarHBondContact O-CB 3.47Å; V321-T324 PolarHBondContact O-N 2.92Å; V321-E325 PolarHBondContact O-N 3.1Å
322	V	90.3	Very high	91	Very high	62 Å²	62	96.4 Å²	96.4	38%	0.376	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-42	179.3	174.5	0	0	0	0	111.2	K318 A319 T324 E325 V326	K318-V322 WeakPolarHBondContact O-CG2 3.43Å; K318-V322 PolarHBondContact O-N 2.97Å; A319-V322 PolarHBondContact O-N 3.24Å; V322-T324 VanDerWaalsContact C-N 3.25Å; V322-T324 PolarHBondContact O-N 2.93Å; V322-E325 PolarHBondContact O-N 3.26Å; V322-V326 HydrophobicContact CG1-CG2 4.33Å; V322-V326 WeakPolarHBondContact O-CG2 3.07Å; V322-V326 PolarHBondContact O-N 3.14Å
323	Q	89.6	Confident	91.3	Very high	108 Å²	108	97 Å²	97	51%	0.505	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-38.1	176	-168	-172.3	22.7	0	0	112.2	A319 V321 K327	A319-Q323 WeakPolarHBondContact O-CB 3.29Å; A319-Q323 PolarHBondContact O-N 3Å; V321-Q323 VanDerWaalsContact C-N 3.31Å; V321-Q323 PolarHBondContact O-N 3.02Å; Q323-K327 VanDerWaalsContact O-CG 3.31Å; Q323-K327 WeakPolarHBondContact O-CG 3.22Å; Q323-K327 PolarHBondContact O-N 3.49Å
324	T	93	Very high	91.4	Very high	89 Å²	89	96.1 Å²	96.1	55%	0.546	49%	0.491	S	S	.	.	H	α-helix	trans	-71	-40.9	178.3	-55.4	0	0	0	0	111.2	K320 V321 V322 K327 A328	K320-T324 PolarHBondContact O-N 3.21Å; K320-T324 VanDerWaalsContact O-N 3.1Å; K320-T324 PolarHBondContact O-OG1 3.34Å; V321-T324 WeakPolarHBondContact O-CA 3.48Å; V321-T324 WeakPolarHBondContact O-CB 3.47Å; V321-T324 PolarHBondContact O-N 2.92Å; V322-T324 VanDerWaalsContact C-N 3.25Å; V322-T324 PolarHBondContact O-N 2.93Å; T324-K327 PolarHBondContact O-N 2.9Å; T324-A328 WeakPolarHBondContact O-CB 3.5Å; T324-A328 PolarHBondContact O-N 3.1Å
325	E	92.4	Very high	91.6	Very high	125 Å²	125	97 Å²	97	58%	0.584	49%	0.493	S	S	*	.	H	α-helix	trans	-63.1	-45.3	176.1	-70.5	-178.6	169.7	0	0	112.3	V321 V322 K327 A328 L329	V321-E325 PolarHBondContact O-N 3.1Å; V322-E325 PolarHBondContact O-N 3.26Å; E325-K327 PolarHBondContact O-N 3.45Å; E325-A328 PolarHBondContact O-N 3.1Å; E325-L329 WeakPolarHBondContact O-CB 3.42Å; E325-L329 PolarHBondContact O-N 3.2Å
326	V	91.7	Very high	91.9	Very high	65 Å²	65	95.2 Å²	95.2	39%	0.394	49%	0.488	S	S	.	.	H	α-helix	trans	-57.4	-49.2	175.5	170.8	0	0	0	0	110.4	V322 A328 L329 V330	V322-V326 HydrophobicContact CG1-CG2 4.33Å; V322-V326 WeakPolarHBondContact O-CG2 3.07Å; V322-V326 PolarHBondContact O-N 3.14Å; V326-A328 VanDerWaalsContact C-N 3.35Å; V326-A328 PolarHBondContact O-N 2.95Å; V326-L329 PolarHBondContact O-N 3.42Å; V326-V330 WeakPolarHBondContact O-CG2 3.45Å; V326-V330 PolarHBondContact O-N 2.9Å
327	K	92.1	Very high	92	Very high	126 Å²	126	94.9 Å²	94.9	55%	0.548	49%	0.489	S	S	.	.	H	α-helix	trans	-59.5	-44.3	177.6	-74.2	172.6	-177.8	172.2	0	111.9	Q323 T324 E325 L331	Q323-K327 VanDerWaalsContact O-CG 3.31Å; Q323-K327 WeakPolarHBondContact O-CG 3.22Å; Q323-K327 PolarHBondContact O-N 3.49Å; T324-K327 PolarHBondContact O-N 2.9Å; E325-K327 PolarHBondContact O-N 3.45Å; K327-L331 WeakPolarHBondContact O-CB 3.36Å; K327-L331 PolarHBondContact O-N 2.97Å
328	A	92.6	Very high	92.1	Very high	48 Å²	48	94 Å²	94	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-40.7	179.8	0	0	0	0	0	112.5	T324 E325 V326 L331 R332	T324-A328 WeakPolarHBondContact O-CB 3.5Å; T324-A328 PolarHBondContact O-N 3.1Å; E325-A328 PolarHBondContact O-N 3.1Å; V326-A328 VanDerWaalsContact C-N 3.35Å; V326-A328 PolarHBondContact O-N 2.95Å; A328-L331 PolarHBondContact O-N 2.94Å; A328-R332 WeakPolarHBondContact O-CB 3.26Å; A328-R332 PolarHBondContact O-N 2.83Å
329	L	92.5	Very high	92.4	Very high	70 Å²	70	93.7 Å²	93.7	37%	0.366	48%	0.483	S	S	.	.	H	α-helix	trans	-65	-47.9	179.1	-174.5	69.1	0	0	0	111.6	E325 V326 L331 R332 H333	E325-L329 WeakPolarHBondContact O-CB 3.42Å; E325-L329 PolarHBondContact O-N 3.2Å; V326-L329 PolarHBondContact O-N 3.42Å; L329-L331 VanDerWaalsContact C-N 3.34Å; L329-L331 PolarHBondContact O-N 3.3Å; L329-R332 WeakPolarHBondContact O-CB 3.29Å; L329-R332 PolarHBondContact O-N 3.01Å; L329-H333 PolarHBondContact O-N 2.93Å; L329-H333 VanDerWaalsContact O-N 3.11Å; L329-H333 PolarHBondContact O-ND1 3.36Å
330	V	91.4	Very high	92.8	Very high	91 Å²	91	96.7 Å²	96.7	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-61.7	-43.8	177.9	173.1	0	0	0	0	110.5	V326 R332 H333 K334	V326-V330 WeakPolarHBondContact O-CG2 3.45Å; V326-V330 PolarHBondContact O-N 2.9Å; V330-R332 VanDerWaalsContact C-N 3.31Å; V330-R332 PolarHBondContact O-N 3.41Å; V330-H333 PolarHBondContact O-N 2.98Å; V330-K334 WeakPolarHBondContact O-CB 3.41Å; V330-K334 PolarHBondContact O-N 3.22Å
331	L	93.5	Very high	92.9	Very high	118 Å²	118	97 Å²	97	62%	0.618	49%	0.486	S	S	*	.	H	α-helix	trans	-61.4	-39.9	177.5	-174.9	64.9	0	0	0	112.1	K327 A328 L329 K334 K335	K327-L331 WeakPolarHBondContact O-CB 3.36Å; K327-L331 PolarHBondContact O-N 2.97Å; A328-L331 PolarHBondContact O-N 2.94Å; L329-L331 VanDerWaalsContact C-N 3.34Å; L329-L331 PolarHBondContact O-N 3.3Å; L331-K334 PolarHBondContact O-N 3.25Å; L331-K335 WeakPolarHBondContact O-CB 3.31Å; L331-K335 PolarHBondContact O-N 3.27Å
332	R	93.2	Very high	93	Very high	163 Å²	163	97.6 Å²	97.6	62%	0.615	49%	0.493	S	S	*	.	H	α-helix	trans	-61.9	-44.4	176.5	-171.6	-173.4	-62.8	141	1	111.8	A328 L329 V330 K335 A336	A328-R332 WeakPolarHBondContact O-CB 3.26Å; A328-R332 PolarHBondContact O-N 2.83Å; L329-R332 WeakPolarHBondContact O-CB 3.29Å; L329-R332 PolarHBondContact O-N 3.01Å; V330-R332 VanDerWaalsContact C-N 3.31Å; V330-R332 PolarHBondContact O-N 3.41Å; R332-K335 PolarHBondContact O-N 3.37Å; R332-A336 PolarHBondContact O-N 3.34Å; R332-A336 VanDerWaalsContact O-N 3.11Å
333	H	91.8	Very high	93.3	Very high	75 Å²	75	98.5 Å²	98.5	35%	0.347	49%	0.493	S	S	.	.	H	α-helix	trans	-70.6	-40.2	179.9	-73.3	62.4	0	0	0	111.7	L329 V330 K335 A336 L337 M437	L329-H333 PolarHBondContact O-N 2.93Å; L329-H333 VanDerWaalsContact O-N 3.11Å; L329-H333 PolarHBondContact O-ND1 3.36Å; V330-H333 PolarHBondContact O-N 2.98Å; H333-K335 VanDerWaalsContact C-N 3.34Å; H333-K335 PolarHBondContact O-N 2.85Å; H333-A336 PolarHBondContact O-N 2.98Å; H333-L337 WeakPolarHBondContact O-CG 3.28Å; H333-L337 PolarHBondContact O-N 2.9Å; H333-M437 PolarHBondContact CD2-SD 2.74Å
334	K	92.5	Very high	93.6	Very high	116 Å²	116	95.9 Å²	95.9	50%	0.504	48%	0.482	S	S	.	.	H	α-helix	trans	-55.7	-49	172.2	177.9	176.5	169.5	177.2	0	111.2	V330 L331 A336 L337 E338	V330-K334 WeakPolarHBondContact O-CB 3.41Å; V330-K334 PolarHBondContact O-N 3.22Å; L331-K334 PolarHBondContact O-N 3.25Å; K334-A336 VanDerWaalsContact C-N 3.33Å; K334-A336 PolarHBondContact O-N 3.41Å; K334-L337 WeakPolarHBondContact O-CB 3.45Å; K334-L337 PolarHBondContact O-N 3.04Å; K334-L337 VanDerWaalsContact O-N 3.14Å; K334-E338 WeakPolarHBondContact CE-OE1 3.23Å; K334-E338 HydrophobicContact CG-CG 4.44Å; K334-E338 IonicContact NZ-OE1 3.91Å; K334-E338 WeakPolarHBondContact O-CG 3.31Å; K334-E338 PolarHBondContact O-N 3.38Å
335	K	94.7	Very high	93.7	Very high	122 Å²	122	96.5 Å²	96.5	53%	0.53	48%	0.482	S	S	.	.	H	α-helix	trans	-59.2	-42.7	178	-177.4	175.1	174.1	179	0	112.3	L331 R332 H333 L337 E338 E339	L331-K335 WeakPolarHBondContact O-CB 3.31Å; L331-K335 PolarHBondContact O-N 3.27Å; R332-K335 PolarHBondContact O-N 3.37Å; H333-K335 VanDerWaalsContact C-N 3.34Å; H333-K335 PolarHBondContact O-N 2.85Å; K335-L337 VanDerWaalsContact C-N 3.31Å; K335-L337 PolarHBondContact O-N 2.82Å; K335-E338 PolarHBondContact O-N 3.21Å; K335-E339 WeakPolarHBondContact CE-OE1 3.31Å; K335-E339 HydrophobicContact CG-CG 4.47Å; K335-E339 IonicContact NZ-OE1 2.66Å; K335-E339 WeakPolarHBondContact O-CB 3.23Å; K335-E339 WeakPolarHBondContact O-CG 3.33Å; K335-E339 PolarHBondContact O-N 2.88Å
336	A	93.3	Very high	94	Very high	56 Å²	56	97.7 Å²	97.7	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-62.9	-37.6	176.9	0	0	0	0	0	112.5	R332 H333 K334 R340	R332-A336 PolarHBondContact O-N 3.34Å; R332-A336 VanDerWaalsContact O-N 3.11Å; H333-A336 PolarHBondContact O-N 2.98Å; K334-A336 VanDerWaalsContact C-N 3.33Å; K334-A336 PolarHBondContact O-N 3.41Å; A336-R340 WeakPolarHBondContact O-CB 3.27Å; A336-R340 PolarHBondContact O-N 3.33Å
337	L	92.3	Very high	94.2	Very high	95 Å²	95	98.7 Å²	98.7	50%	0.497	48%	0.48	S	S	.	.	H	α-helix	trans	-67.9	-43.2	174.9	-69.3	172.1	0	0	0	112	H333 K334 K335 R340 E341 I434	H333-L337 WeakPolarHBondContact O-CG 3.28Å; H333-L337 PolarHBondContact O-N 2.9Å; K334-L337 WeakPolarHBondContact O-CB 3.45Å; K334-L337 PolarHBondContact O-N 3.04Å; K334-L337 VanDerWaalsContact O-N 3.14Å; K335-L337 VanDerWaalsContact C-N 3.31Å; K335-L337 PolarHBondContact O-N 2.82Å; L337-R340 PolarHBondContact O-N 2.92Å; L337-E341 PolarHBondContact O-N 3.09Å; L337-I434 HydrophobicContact CD1-CD1 4.41Å; L337-I434 HydrophobicContact CD2-CD1 4.49Å
338	E	95.7	Very high	94.4	Very high	91 Å²	91	96 Å²	96	43%	0.425	47%	0.474	S	S	.	.	H	α-helix	trans	-62.4	-43.5	176.1	-71.3	172.6	162.5	0	0	111.8	K334 K335 R340 E341 C342	K334-E338 WeakPolarHBondContact CE-OE1 3.23Å; K334-E338 HydrophobicContact CG-CG 4.44Å; K334-E338 IonicContact NZ-OE1 3.91Å; K334-E338 WeakPolarHBondContact O-CG 3.31Å; K334-E338 PolarHBondContact O-N 3.38Å; K335-E338 PolarHBondContact O-N 3.21Å; E338-R340 VanDerWaalsContact C-N 3.3Å; E338-R340 PolarHBondContact O-N 3.09Å; E338-E341 WeakPolarHBondContact O-CB 3.37Å; E338-E341 PolarHBondContact O-N 3.05Å; E338-C342 PolarHBondContact O-N 3.16Å; E338-C342 PolarHBondContact O-SG 3.27Å
339	E	96.4	Very high	94.6	Very high	114 Å²	114	97.1 Å²	97.1	53%	0.533	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-40.8	174.4	-75.1	173.5	178.6	0	0	111.5	K335 C342 E343	K335-E339 WeakPolarHBondContact CE-OE1 3.31Å; K335-E339 HydrophobicContact CG-CG 4.47Å; K335-E339 IonicContact NZ-OE1 2.66Å; K335-E339 WeakPolarHBondContact O-CB 3.23Å; K335-E339 WeakPolarHBondContact O-CG 3.33Å; K335-E339 PolarHBondContact O-N 2.88Å; E339-C342 PolarHBondContact O-N 3.32Å; E339-E343 PolarHBondContact O-N 3.06Å
340	R	94.4	Very high	94.7	Very high	114 Å²	114	98.9 Å²	98.9	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-39.7	178.2	-176.4	55.3	175.9	154.9	-9.3	112.4	A336 L337 E338 E343 L344	A336-R340 WeakPolarHBondContact O-CB 3.27Å; A336-R340 PolarHBondContact O-N 3.33Å; L337-R340 PolarHBondContact O-N 2.92Å; E338-R340 VanDerWaalsContact C-N 3.3Å; E338-R340 PolarHBondContact O-N 3.09Å; R340-E343 IonicContact CZ-OE2 2.83Å; R340-E343 IonicContact NH1-OE1 2.95Å; R340-E343 PolarHBondContact NH1-OE1 2.83Å; R340-E343 VanDerWaalsContact NH1-OE1 3.15Å; R340-E343 IonicContact NH1-OE2 3.28Å; R340-E343 PolarHBondContact NH1-OE2 3.14Å; R340-E343 PolarHBondContact O-N 2.9Å; R340-L344 HydrophobicContact CG-CD1 4.26Å; R340-L344 WeakPolarHBondContact O-CG 3.06Å; R340-L344 PolarHBondContact O-N 2.84Å; R340-L344 VanDerWaalsContact O-N 3.07Å
341	E	94.3	Very high	94.8	Very high	116 Å²	116	98.3 Å²	98.3	54%	0.542	47%	0.471	S	S	.	.	H	α-helix	trans	-58.2	-50.1	173.5	-179.5	-177.8	-179.6	0	0	110.7	L337 E338 E343 L344 L345	L337-E341 PolarHBondContact O-N 3.09Å; E338-E341 WeakPolarHBondContact O-CB 3.37Å; E338-E341 PolarHBondContact O-N 3.05Å; E341-E343 VanDerWaalsContact C-N 3.32Å; E341-E343 PolarHBondContact O-N 3.13Å; E341-L344 PolarHBondContact O-N 3.28Å; E341-L345 HydrophobicContact CG-CD1 4Å; E341-L345 HydrophobicContact CG-CG 4.48Å; E341-L345 WeakPolarHBondContact O-CG 3.48Å; E341-L345 PolarHBondContact O-N 3.21Å
342	C	96	Very high	94.9	Very high	85 Å²	85	98.7 Å²	98.7	57%	0.574	46%	0.464	S	S	*	.	H	α-helix	trans	-59.3	-42.3	179.5	-66.7	0	0	0	0	112.1	E338 E339 W346	E338-C342 PolarHBondContact O-N 3.16Å; E338-C342 PolarHBondContact O-SG 3.27Å; E339-C342 PolarHBondContact O-N 3.32Å; C342-W346 VanDerWaalsContact O-CB 3.32Å; C342-W346 WeakPolarHBondContact O-CB 3.29Å; C342-W346 PolarHBondContact O-N 2.79Å
343	E	96.6	Very high	95	Very high	82 Å²	82	96.5 Å²	96.5	38%	0.383	46%	0.461	S	S	.	.	H	α-helix	trans	-63.9	-42.3	177.8	-164.7	-152.6	145.8	0	0	112.4	E339 R340 E341 W346 K347	E339-E343 PolarHBondContact O-N 3.06Å; R340-E343 IonicContact CZ-OE2 2.83Å; R340-E343 IonicContact NH1-OE1 2.95Å; R340-E343 PolarHBondContact NH1-OE1 2.83Å; R340-E343 VanDerWaalsContact NH1-OE1 3.15Å; R340-E343 IonicContact NH1-OE2 3.28Å; R340-E343 PolarHBondContact NH1-OE2 3.14Å; R340-E343 PolarHBondContact O-N 2.9Å; E341-E343 VanDerWaalsContact C-N 3.32Å; E341-E343 PolarHBondContact O-N 3.13Å; E343-W346 PolarHBondContact O-N 3.4Å; E343-K347 WeakPolarHBondContact O-CG 3.42Å; E343-K347 PolarHBondContact O-N 2.84Å; E343-K347 WeakPolarHBondContact OE1-CE 3.41Å; E343-K347 IonicContact OE1-NZ 2.68Å; E343-K347 PolarHBondContact OE1-NZ 3.31Å
344	L	95.8	Very high	95.2	Very high	53 Å²	53	98.5 Å²	98.5	28%	0.277	47%	0.472	S	S	.	.	H	α-helix	trans	-68	-44.5	179.5	-72.8	173.8	0	0	0	111.5	R340 E341 W346 K347 V348 F423	R340-L344 HydrophobicContact CG-CD1 4.26Å; R340-L344 WeakPolarHBondContact O-CG 3.06Å; R340-L344 PolarHBondContact O-N 2.84Å; R340-L344 VanDerWaalsContact O-N 3.07Å; E341-L344 PolarHBondContact O-N 3.28Å; L344-W346 VanDerWaalsContact C-N 3.33Å; L344-W346 PolarHBondContact O-N 3.02Å; L344-K347 WeakPolarHBondContact O-CB 3.36Å; L344-K347 PolarHBondContact O-N 2.86Å; L344-V348 WeakPolarHBondContact O-CG2 3.42Å; L344-V348 PolarHBondContact O-N 3.2Å; L344-F423 HydrophobicContact CD1-CE2 4.13Å
345	L	95.6	Very high	95.2	Very high	102 Å²	102	94.4 Å²	94.4	53%	0.534	45%	0.454	S	S	.	.	H	α-helix	trans	-61.4	-43	175.6	-69.6	176.1	0	0	0	111.2	E341 K347 V348 D349	E341-L345 HydrophobicContact CG-CD1 4Å; E341-L345 HydrophobicContact CG-CG 4.48Å; E341-L345 WeakPolarHBondContact O-CG 3.48Å; E341-L345 PolarHBondContact O-N 3.21Å; L345-K347 VanDerWaalsContact C-N 3.31Å; L345-K347 PolarHBondContact O-N 3.27Å; L345-V348 WeakPolarHBondContact O-CB 3.2Å; L345-V348 PolarHBondContact O-N 2.94Å; L345-D349 PolarHBondContact O-N 2.96Å
346	W	97.3	Very high	95.1	Very high	150 Å²	150	90 Å²	90	57%	0.568	44%	0.44	S	S	*	.	H	α-helix	trans	-59.9	-40.2	174.9	179.7	86.4	0	0	0	112.5	C342 E343 L344 D349 K350	C342-W346 VanDerWaalsContact O-CB 3.32Å; C342-W346 WeakPolarHBondContact O-CB 3.29Å; C342-W346 PolarHBondContact O-N 2.79Å; E343-W346 PolarHBondContact O-N 3.4Å; L344-W346 VanDerWaalsContact C-N 3.33Å; L344-W346 PolarHBondContact O-N 3.02Å; W346-D349 PolarHBondContact O-N 3.25Å; W346-K350 HydrophobicContact CH2-CD 3.51Å; W346-K350 HydrophobicContact CZ2-CD 3.89Å; W346-K350 HydrophobicContact CZ3-CD 3.83Å; W346-K350 WeakPolarHBondContact O-CB 3.34Å; W346-K350 PolarHBondContact O-N 2.88Å
347	K	96.2	Very high	95.2	Very high	86 Å²	86	93.8 Å²	93.8	37%	0.374	45%	0.446	S	S	.	.	H	α-helix	trans	-63.5	-42.6	175.2	-79	173.1	171.7	166.4	0	112.1	E343 L344 L345 K350 I351	E343-K347 WeakPolarHBondContact O-CG 3.42Å; E343-K347 PolarHBondContact O-N 2.84Å; E343-K347 WeakPolarHBondContact OE1-CE 3.41Å; E343-K347 IonicContact OE1-NZ 2.68Å; E343-K347 PolarHBondContact OE1-NZ 3.31Å; L344-K347 WeakPolarHBondContact O-CB 3.36Å; L344-K347 PolarHBondContact O-N 2.86Å; L345-K347 VanDerWaalsContact C-N 3.31Å; L345-K347 PolarHBondContact O-N 3.27Å; K347-K350 PolarHBondContact O-N 2.92Å; K347-I351 VanDerWaalsContact O-CG1 3.32Å; K347-I351 WeakPolarHBondContact O-CG1 3.33Å; K347-I351 PolarHBondContact O-N 2.9Å
348	V	96.1	Very high	95.2	Very high	69 Å²	69	91.4 Å²	91.4	42%	0.418	44%	0.436	S	S	.	.	H	α-helix	trans	-59	-49.1	175.5	171.4	0	0	0	0	110.2	L344 L345 K350 I351 R352 I421	L344-V348 WeakPolarHBondContact O-CG2 3.42Å; L344-V348 PolarHBondContact O-N 3.2Å; L345-V348 WeakPolarHBondContact O-CB 3.2Å; L345-V348 PolarHBondContact O-N 2.94Å; V348-K350 VanDerWaalsContact C-N 3.33Å; V348-K350 PolarHBondContact O-N 2.84Å; V348-I351 PolarHBondContact O-N 2.72Å; V348-R352 WeakPolarHBondContact O-CB 3.26Å; V348-R352 PolarHBondContact O-N 2.91Å; V348-I421 HydrophobicContact CG1-CG2 4.41Å
349	D	96.2	Very high	95.1	Very high	72 Å²	72	89.8 Å²	89.8	39%	0.385	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-38.8	179.1	-105.1	-35.4	0	0	0	112.6	L345 W346 R352 Q353	L345-D349 PolarHBondContact O-N 2.96Å; W346-D349 PolarHBondContact O-N 3.25Å; D349-R352 WeakPolarHBondContact O-CB 3.39Å; D349-R352 PolarHBondContact O-N 3.15Å; D349-R352 IonicContact OD1-CZ 3.39Å; D349-R352 IonicContact OD1-NE 2.91Å; D349-R352 PolarHBondContact OD1-NE 2.98Å; D349-R352 IonicContact OD1-NH2 2.63Å; D349-R352 PolarHBondContact OD1-NH2 2.8Å; D349-Q353 WeakPolarHBondContact O-CB 3.38Å; D349-Q353 VanDerWaalsContact O-CG 3.28Å; D349-Q353 WeakPolarHBondContact O-CG 3.49Å; D349-Q353 PolarHBondContact O-N 3.38Å
350	K	95.9	Very high	95	Very high	106 Å²	106	92.6 Å²	92.6	46%	0.461	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-45.7	176.4	-173.2	175.8	-176.7	179.4	0	111.9	W346 K347 V348 Q353 M354	W346-K350 HydrophobicContact CH2-CD 3.51Å; W346-K350 HydrophobicContact CZ2-CD 3.89Å; W346-K350 HydrophobicContact CZ3-CD 3.83Å; W346-K350 WeakPolarHBondContact O-CB 3.34Å; W346-K350 PolarHBondContact O-N 2.88Å; K347-K350 PolarHBondContact O-N 2.92Å; V348-K350 VanDerWaalsContact C-N 3.33Å; V348-K350 PolarHBondContact O-N 2.84Å; K350-Q353 PolarHBondContact O-N 3.07Å; K350-M354 WeakPolarHBondContact O-CB 3.4Å; K350-M354 VanDerWaalsContact O-CG 3.25Å; K350-M354 WeakPolarHBondContact O-CG 3.33Å; K350-M354 PolarHBondContact O-N 3.13Å
351	I	93.6	Very high	94.9	Very high	79 Å²	79	90.8 Å²	90.8	41%	0.405	44%	0.435	S	S	.	.	H	α-helix	trans	-61.9	-46.4	176.4	-68.4	166.7	0	0	0	109.8	K347 V348 Q353 M354 K355 I421	K347-I351 VanDerWaalsContact O-CG1 3.32Å; K347-I351 WeakPolarHBondContact O-CG1 3.33Å; K347-I351 PolarHBondContact O-N 2.9Å; V348-I351 PolarHBondContact O-N 2.72Å; I351-Q353 PolarHBondContact O-N 2.94Å; I351-M354 PolarHBondContact O-N 3.43Å; I351-K355 HydrophobicContact CG2-CD 3.82Å; I351-K355 HydrophobicContact CG2-CG 4.27Å; I351-K355 WeakPolarHBondContact O-CB 3.39Å; I351-K355 WeakPolarHBondContact O-CG 3.38Å; I351-K355 PolarHBondContact O-N 3.01Å; I351-I421 HydrophobicContact CG2-CD1 4.39Å; I351-I421 HydrophobicContact CG2-CG1 4.23Å
352	R	95.2	Very high	94.8	Very high	126 Å²	126	85.7 Å²	85.7	48%	0.475	41%	0.412	S	S	.	.	H	α-helix	trans	-55.4	-49.4	175.8	-177.1	-171	67.6	83.6	-3.1	111.6	V348 D349 A356 I421	V348-R352 WeakPolarHBondContact O-CB 3.26Å; V348-R352 PolarHBondContact O-N 2.91Å; D349-R352 WeakPolarHBondContact O-CB 3.39Å; D349-R352 PolarHBondContact O-N 3.15Å; D349-R352 IonicContact OD1-CZ 3.39Å; D349-R352 IonicContact OD1-NE 2.91Å; D349-R352 PolarHBondContact OD1-NE 2.98Å; D349-R352 IonicContact OD1-NH2 2.63Å; D349-R352 PolarHBondContact OD1-NH2 2.8Å; R352-A356 WeakPolarHBondContact O-CB 3.47Å; R352-A356 PolarHBondContact O-N 2.99Å; R352-I421 HydrophobicContact CB-CD1 4.48Å
353	Q	95.7	Very high	94.6	Very high	118 Å²	118	86 Å²	86	55%	0.551	41%	0.411	S	S	*	.	H	α-helix	trans	-62.4	-43.4	179.5	-75.4	178.6	17.1	0	0	112.3	D349 K350 I351 K357	D349-Q353 WeakPolarHBondContact O-CB 3.38Å; D349-Q353 VanDerWaalsContact O-CG 3.28Å; D349-Q353 WeakPolarHBondContact O-CG 3.49Å; D349-Q353 PolarHBondContact O-N 3.38Å; K350-Q353 PolarHBondContact O-N 3.07Å; I351-Q353 PolarHBondContact O-N 2.94Å; Q353-K357 VanDerWaalsContact O-CB 3.25Å; Q353-K357 WeakPolarHBondContact O-CB 3.43Å; Q353-K357 PolarHBondContact O-N 3.27Å
354	M	94.9	Very high	94.4	Very high	117 Å²	117	87.1 Å²	87.1	58%	0.576	42%	0.416	S	S	*	.	H	α-helix	trans	-66.2	-49.9	179.7	-69.7	-66.9	-67.2	0	0	111.8	K350 I351 K357 T358	K350-M354 WeakPolarHBondContact O-CB 3.4Å; K350-M354 VanDerWaalsContact O-CG 3.25Å; K350-M354 WeakPolarHBondContact O-CG 3.33Å; K350-M354 PolarHBondContact O-N 3.13Å; I351-M354 PolarHBondContact O-N 3.43Å; M354-K357 PolarHBondContact O-N 2.87Å; M354-T358 PolarHBondContact O-N 3.42Å; M354-T358 PolarHBondContact O-OG1 3.36Å; M354-T358 VanDerWaalsContact O-OG1 3.13Å
355	K	93.6	Very high	94.2	Very high	29 Å²	29	89.7 Å²	89.7	13%	0.126	43%	0.425	C	S	.	.	H	α-helix	trans	-59.4	-47.6	176.7	-74.5	-179.3	164.4	-79	0	111.4	I351 K357 T358 L359 D417 D418	I351-K355 HydrophobicContact CG2-CD 3.82Å; I351-K355 HydrophobicContact CG2-CG 4.27Å; I351-K355 WeakPolarHBondContact O-CB 3.39Å; I351-K355 WeakPolarHBondContact O-CG 3.38Å; I351-K355 PolarHBondContact O-N 3.01Å; K355-K357 VanDerWaalsContact C-N 3.35Å; K355-K357 PolarHBondContact O-N 2.81Å; K355-T358 PolarHBondContact O-N 3.2Å; K355-L359 WeakPolarHBondContact O-CG 3.19Å; K355-L359 PolarHBondContact O-N 3.29Å; K355-D417 WeakPolarHBondContact CG-OD2 3.44Å; K355-D417 IonicContact NZ-OD1 2.79Å; K355-D417 PolarHBondContact NZ-OD1 3.12Å; K355-D418 PolarHBondContact NZ-O 2.8Å; K355-D418 IonicContact NZ-OD1 2.87Å; K355-D418 PolarHBondContact NZ-OD1 3.07Å
356	A	92.8	Very high	93.9	Very high	30 Å²	30	87.6 Å²	87.6	25%	0.248	41%	0.414	C	S	.	.	H	α-helix	trans	-59.3	-45.4	177.5	0	0	0	0	0	111.6	R352 T358 L359 Y360	R352-A356 WeakPolarHBondContact O-CB 3.47Å; R352-A356 PolarHBondContact O-N 2.99Å; A356-T358 PolarHBondContact O-N 3.44Å; A356-L359 PolarHBondContact O-N 3.11Å; A356-Y360 HydrophobicContact CB-CD2 4.19Å; A356-Y360 HydrophobicContact CB-CE2 4.16Å; A356-Y360 WeakPolarHBondContact O-CB 3.41Å; A356-Y360 WeakPolarHBondContact O-CD2 3.36Å; A356-Y360 PolarHBondContact O-N 3.19Å
357	K	94.6	Very high	93.6	Very high	135 Å²	135	86.3 Å²	86.3	59%	0.587	41%	0.414	S	S	*	.	H	α-helix	trans	-59.2	-45.3	177.4	-176.8	178.5	179.4	-180	0	111.8	Q353 M354 K355 L361	Q353-K357 VanDerWaalsContact O-CB 3.25Å; Q353-K357 WeakPolarHBondContact O-CB 3.43Å; Q353-K357 PolarHBondContact O-N 3.27Å; M354-K357 PolarHBondContact O-N 2.87Å; K355-K357 VanDerWaalsContact C-N 3.35Å; K355-K357 PolarHBondContact O-N 2.81Å; K357-L361 HydrophobicContact CG-CD1 3.91Å; K357-L361 WeakPolarHBondContact O-CB 3.35Å; K357-L361 VanDerWaalsContact O-CG 3.26Å; K357-L361 WeakPolarHBondContact O-CG 3.43Å; K357-L361 PolarHBondContact O-N 3.07Å
358	T	93.1	Very high	93.3	Very high	46 Å²	46	87.8 Å²	87.8	28%	0.282	42%	0.422	S	S	.	.	H	α-helix	trans	-59.6	-49.3	177.3	-58.6	0	0	0	0	111.4	M354 K355 A356 L361 Q362 Q416 D417	M354-T358 PolarHBondContact O-N 3.42Å; M354-T358 PolarHBondContact O-OG1 3.36Å; M354-T358 VanDerWaalsContact O-OG1 3.13Å; K355-T358 PolarHBondContact O-N 3.2Å; A356-T358 PolarHBondContact O-N 3.44Å; T358-L361 PolarHBondContact O-N 3.23Å; T358-Q362 WeakPolarHBondContact O-CB 3.46Å; T358-Q362 PolarHBondContact O-N 2.89Å; T358-Q416 HydrophobicContact CG2-CB 4.15Å; T358-D417 HydrophobicContact CG2-CB 4.45Å
359	L	92.7	Very high	92.9	Very high	57 Å²	57	85.8 Å²	85.8	30%	0.298	41%	0.411	S	S	.	.	H	α-helix	trans	-67.3	-43.1	-178.4	-67	172.2	0	0	0	112.3	K355 A356 Q362 V363 P415 D417	K355-L359 WeakPolarHBondContact O-CG 3.19Å; K355-L359 PolarHBondContact O-N 3.29Å; A356-L359 PolarHBondContact O-N 3.11Å; L359-Q362 WeakPolarHBondContact O-CB 3.28Å; L359-Q362 PolarHBondContact O-N 3.42Å; L359-V363 WeakPolarHBondContact O-CG2 3.36Å; L359-V363 PolarHBondContact O-N 3.22Å; L359-P415 HydrophobicContact CD2-CB 4.18Å; L359-D417 HydrophobicContact CD2-CB 4.23Å; L359-D417 HydrophobicContact CG-CB 4.38Å
360	Y	94	Very high	92.6	Very high	173 Å²	173	86.7 Å²	86.7	68%	0.678	42%	0.415	S	S	*	.	H	α-helix	trans	-63.4	-42.3	176.7	-79	-58.3	0	0	0	112.2	A356 Q362 V363 E364	A356-Y360 HydrophobicContact CB-CD2 4.19Å; A356-Y360 HydrophobicContact CB-CE2 4.16Å; A356-Y360 WeakPolarHBondContact O-CB 3.41Å; A356-Y360 WeakPolarHBondContact O-CD2 3.36Å; A356-Y360 PolarHBondContact O-N 3.19Å; Y360-Q362 VanDerWaalsContact C-N 3.28Å; Y360-Q362 PolarHBondContact O-N 3.31Å; Y360-V363 PolarHBondContact O-N 3.25Å; Y360-E364 PolarHBondContact O-N 3.14Å
361	L	92.6	Very high	92.3	Very high	76 Å²	76	85.3 Å²	85.3	40%	0.398	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-34.8	174.6	-75.9	169.6	0	0	0	112.1	K357 T358 K365	K357-L361 HydrophobicContact CG-CD1 3.91Å; K357-L361 WeakPolarHBondContact O-CB 3.35Å; K357-L361 VanDerWaalsContact O-CG 3.26Å; K357-L361 WeakPolarHBondContact O-CG 3.43Å; K357-L361 PolarHBondContact O-N 3.07Å; T358-L361 PolarHBondContact O-N 3.23Å; L361-K365 WeakPolarHBondContact O-CG 3.5Å; L361-K365 PolarHBondContact O-N 2.74Å; L361-K365 VanDerWaalsContact O-N 3.17Å
362	Q	92.3	Very high	92.1	Very high	9 Å²	9	86.1 Å²	86.1	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-67.3	-45.4	174.5	-177.8	179.3	10.4	0	0	111.5	T358 L359 Y360 E364 K365 L366 L412 Q414	T358-Q362 WeakPolarHBondContact O-CB 3.46Å; T358-Q362 PolarHBondContact O-N 2.89Å; L359-Q362 WeakPolarHBondContact O-CB 3.28Å; L359-Q362 PolarHBondContact O-N 3.42Å; Y360-Q362 VanDerWaalsContact C-N 3.28Å; Y360-Q362 PolarHBondContact O-N 3.31Å; Q362-E364 VanDerWaalsContact C-N 3.3Å; Q362-E364 PolarHBondContact O-N 3.3Å; Q362-K365 PolarHBondContact O-N 2.93Å; Q362-L366 HydrophobicContact CG-CD1 4.19Å; Q362-L366 WeakPolarHBondContact O-CG 3.28Å; Q362-L366 PolarHBondContact O-N 3.06Å; Q362-L412 PolarHBondContact NE2-O 3.33Å; Q362-Q414 PolarHBondContact NE2-O 3.46Å
363	V	92.1	Very high	91.7	Very high	92 Å²	92	81.4 Å²	81.4	56%	0.558	40%	0.401	S	S	*	.	H	α-helix	trans	-57.4	-44.8	175.6	169.5	0	0	0	0	110.6	L359 Y360 K365 L366 H367	L359-V363 WeakPolarHBondContact O-CG2 3.36Å; L359-V363 PolarHBondContact O-N 3.22Å; Y360-V363 PolarHBondContact O-N 3.25Å; V363-K365 PolarHBondContact O-N 3.43Å; V363-L366 PolarHBondContact O-N 3.49Å; V363-H367 WeakPolarHBondContact O-CB 3.36Å; V363-H367 PolarHBondContact O-N 2.92Å
364	E	93.1	Very high	91.5	Very high	105 Å²	105	80 Å²	80	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-45.8	178.2	-168.9	-178	176.1	0	0	112.1	Y360 Q362 H367 Q368	Y360-E364 PolarHBondContact O-N 3.14Å; Q362-E364 VanDerWaalsContact C-N 3.3Å; Q362-E364 PolarHBondContact O-N 3.3Å; E364-H367 PolarHBondContact O-N 2.8Å; E364-Q368 WeakPolarHBondContact O-CG 3.3Å; E364-Q368 PolarHBondContact O-N 3.32Å
365	K	90.1	Very high	91.3	Very high	106 Å²	106	77.6 Å²	77.6	46%	0.461	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-41.3	177	-72.5	173.7	-176.6	176.7	0	112.9	L361 Q362 V363 H367 S369	L361-K365 WeakPolarHBondContact O-CG 3.5Å; L361-K365 PolarHBondContact O-N 2.74Å; L361-K365 VanDerWaalsContact O-N 3.17Å; Q362-K365 PolarHBondContact O-N 2.93Å; V363-K365 PolarHBondContact O-N 3.43Å; K365-H367 VanDerWaalsContact C-N 3.34Å; K365-S369 WeakPolarHBondContact O-CB 3.39Å; K365-S369 PolarHBondContact O-N 2.65Å; K365-S369 PolarHBondContact O-OG 3.02Å
366	L	89.7	Confident	91	Very high	58 Å²	58	77.5 Å²	77.5	30%	0.304	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-42	175.6	-73.8	173.7	0	0	0	110.9	Q362 V363 S369 L370 L412	Q362-L366 HydrophobicContact CG-CD1 4.19Å; Q362-L366 WeakPolarHBondContact O-CG 3.28Å; Q362-L366 PolarHBondContact O-N 3.06Å; V363-L366 PolarHBondContact O-N 3.49Å; L366-S369 PolarHBondContact O-N 2.89Å; L366-L370 WeakPolarHBondContact O-CB 3.32Å; L366-L370 PolarHBondContact O-N 2.63Å; L366-L412 WeakPolarHBondContact CD1-O 3.31Å; L366-L412 HydrophobicContact CD2-CB 4.01Å
367	H	92	Very high	90.8	Very high	124 Å²	124	79.3 Å²	79.3	57%	0.574	40%	0.399	S	S	*	.	H	α-helix	trans	-63.2	-46.2	177.3	-162.2	72.8	0	0	0	111.6	V363 E364 K365 S369 L370 T371	V363-H367 WeakPolarHBondContact O-CB 3.36Å; V363-H367 PolarHBondContact O-N 2.92Å; E364-H367 PolarHBondContact O-N 2.8Å; K365-H367 VanDerWaalsContact C-N 3.34Å; H367-S369 VanDerWaalsContact C-N 3.3Å; H367-S369 PolarHBondContact O-N 3.21Å; H367-L370 PolarHBondContact O-N 2.91Å; H367-T371 PolarHBondContact O-N 2.89Å; H367-T371 PolarHBondContact O-OG1 2.89Å
368	Q	89.9	Confident	90.5	Very high	116 Å²	116	75.8 Å²	75.8	54%	0.542	39%	0.394	S	S	.	.	H	α-helix	trans	-58.3	-42.2	174.3	-71.5	173.8	9.5	0	0	112.3	E364 T371 K372	E364-Q368 WeakPolarHBondContact O-CG 3.3Å; E364-Q368 PolarHBondContact O-N 3.32Å; Q368-T371 PolarHBondContact O-N 3.39Å; Q368-K372 PolarHBondContact O-N 3.14Å
369	S	87.3	Confident	90.2	Very high	28 Å²	28	75.5 Å²	75.5	20%	0.196	40%	0.397	C	S	.	.	H	α-helix	trans	-66.6	-39.3	178.6	-57.6	0	0	0	0	112.2	K365 L366 H367 K372 L373	K365-S369 WeakPolarHBondContact O-CB 3.39Å; K365-S369 PolarHBondContact O-N 2.65Å; K365-S369 PolarHBondContact O-OG 3.02Å; L366-S369 PolarHBondContact O-N 2.89Å; H367-S369 VanDerWaalsContact C-N 3.3Å; H367-S369 PolarHBondContact O-N 3.21Å; S369-K372 PolarHBondContact O-N 3Å; S369-L373 WeakPolarHBondContact O-CB 3.47Å; S369-L373 PolarHBondContact O-N 3.11Å
370	L	89.1	Confident	89.9	Confident	90 Å²	90	73.6 Å²	73.6	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-49.1	175.7	-176.7	64.7	0	0	0	110.7	L366 H367 K372 L373 D374	L366-L370 WeakPolarHBondContact O-CB 3.32Å; L366-L370 PolarHBondContact O-N 2.63Å; H367-L370 PolarHBondContact O-N 2.91Å; L370-K372 VanDerWaalsContact C-N 3.31Å; L370-K372 PolarHBondContact O-N 3.12Å; L370-L373 WeakPolarHBondContact O-CA 3.43Å; L370-L373 WeakPolarHBondContact O-CB 3.44Å; L370-L373 PolarHBondContact O-N 3.43Å; L370-D374 PolarHBondContact O-N 3.15Å
371	T	91	Very high	89.6	Confident	78 Å²	78	67.9 Å²	67.9	48%	0.479	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-41	177	-50.7	0	0	0	0	112.1	H367 Q368 L373 D374 S375	H367-T371 PolarHBondContact O-N 2.89Å; H367-T371 PolarHBondContact O-OG1 2.89Å; Q368-T371 PolarHBondContact O-N 3.39Å; T371-L373 VanDerWaalsContact C-N 3.34Å; T371-D374 PolarHBondContact O-N 2.82Å; T371-S375 WeakPolarHBondContact O-CB 3.47Å; T371-S375 PolarHBondContact O-N 2.88Å; T371-S375 PolarHBondContact O-OG 3.26Å
372	K	88.6	Confident	89.2	Confident	96 Å²	96	70 Å²	70	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-43	174.8	-170.8	-175.5	175.1	-170.3	0	111.1	Q368 S369 L370 S375 T376 E405	Q368-K372 PolarHBondContact O-N 3.14Å; S369-K372 PolarHBondContact O-N 3Å; L370-K372 VanDerWaalsContact C-N 3.31Å; L370-K372 PolarHBondContact O-N 3.12Å; K372-S375 PolarHBondContact O-OG 2.91Å; K372-T376 WeakPolarHBondContact O-CB 3.49Å; K372-T376 PolarHBondContact O-N 2.83Å; K372-T376 VanDerWaalsContact O-N 3.09Å; K372-T376 PolarHBondContact O-OG1 3.19Å; K372-E405 IonicContact NZ-OE1 3.28Å; K372-E405 PolarHBondContact NZ-OE1 2.74Å; K372-E405 IonicContact NZ-OE2 2.65Å; K372-E405 PolarHBondContact NZ-OE2 2.98Å
373	L	87.5	Confident	88.9	Confident	26 Å²	26	71.3 Å²	71.3	14%	0.136	39%	0.388	C	S	.	.	H	α-helix	trans	-63.9	-49.1	176.8	-175.6	67	0	0	0	111.7	S369 L370 T371 S375 T376 I377 Q402 L406	S369-L373 WeakPolarHBondContact O-CB 3.47Å; S369-L373 PolarHBondContact O-N 3.11Å; L370-L373 WeakPolarHBondContact O-CA 3.43Å; L370-L373 WeakPolarHBondContact O-CB 3.44Å; L370-L373 PolarHBondContact O-N 3.43Å; T371-L373 VanDerWaalsContact C-N 3.34Å; L373-S375 VanDerWaalsContact C-N 3.35Å; L373-S375 PolarHBondContact O-N 2.83Å; L373-T376 WeakPolarHBondContact O-CB 3.45Å; L373-T376 PolarHBondContact O-N 2.79Å; L373-T376 VanDerWaalsContact O-N 3.12Å; L373-I377 HydrophobicContact CD1-CD1 4.21Å; L373-I377 HydrophobicContact CD1-CG1 4.42Å; L373-I377 HydrophobicContact CD2-CD1 4.3Å; L373-I377 HydrophobicContact CG-CD1 3.8Å; L373-I377 HydrophobicContact CG-CG1 4.39Å; L373-I377 WeakPolarHBondContact O-CG1 3.12Å; L373-I377 PolarHBondContact O-N 3.32Å; L373-Q402 HydrophobicContact CD1-CG 3.64Å; L373-L406 HydrophobicContact CD1-CD1 3.52Å; L373-L406 HydrophobicContact CD1-CG 4.22Å; L373-L406 HydrophobicContact CD2-CD1 3.8Å; L373-L406 HydrophobicContact CD2-CD2 4.08Å; L373-L406 HydrophobicContact CD2-CG 4.45Å; L373-L406 HydrophobicContact CG-CD1 4.28Å
374	D	90.6	Very high	88.4	Confident	88 Å²	88	71.7 Å²	71.7	47%	0.471	39%	0.386	S	S	.	.	H	α-helix	trans	-58.8	-45.1	179.9	-71.8	-24.3	0	0	0	111.6	L370 T371 T376 I377 A378	L370-D374 PolarHBondContact O-N 3.15Å; T371-D374 PolarHBondContact O-N 2.82Å; D374-T376 VanDerWaalsContact C-N 3.33Å; D374-T376 PolarHBondContact O-N 3.12Å; D374-I377 PolarHBondContact O-N 3.35Å; D374-A378 WeakPolarHBondContact O-CB 3.45Å; D374-A378 PolarHBondContact O-N 2.92Å
375	S	90.4	Very high	87.9	Confident	68 Å²	68	73.3 Å²	73.3	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-63.1	-37.7	176.2	67.6	0	0	0	0	112.8	T371 K372 L373 A379	T371-S375 WeakPolarHBondContact O-CB 3.47Å; T371-S375 PolarHBondContact O-N 2.88Å; T371-S375 PolarHBondContact O-OG 3.26Å; K372-S375 PolarHBondContact O-OG 2.91Å; L373-S375 VanDerWaalsContact C-N 3.35Å; L373-S375 PolarHBondContact O-N 2.83Å; S375-A379 WeakPolarHBondContact O-CB 3.2Å; S375-A379 PolarHBondContact O-N 2.91Å
376	T	87.4	Confident	87.3	Confident	26 Å²	26	75.3 Å²	75.3	16%	0.16	41%	0.409	C	S	.	.	H	α-helix	trans	-68.4	-43	176.7	-54.5	0	0	0	0	110.9	K372 L373 D374 A379 V380 Q402	K372-T376 WeakPolarHBondContact O-CB 3.49Å; K372-T376 PolarHBondContact O-N 2.83Å; K372-T376 VanDerWaalsContact O-N 3.09Å; K372-T376 PolarHBondContact O-OG1 3.19Å; L373-T376 WeakPolarHBondContact O-CB 3.45Å; L373-T376 PolarHBondContact O-N 2.79Å; L373-T376 VanDerWaalsContact O-N 3.12Å; D374-T376 VanDerWaalsContact C-N 3.33Å; D374-T376 PolarHBondContact O-N 3.12Å; T376-A379 PolarHBondContact O-N 3Å; T376-V380 HydrophobicContact CG2-CG2 4.35Å; T376-V380 WeakPolarHBondContact O-CB 3.37Å; T376-V380 VanDerWaalsContact O-CG2 3.29Å; T376-V380 WeakPolarHBondContact O-CG2 3.25Å; T376-V380 PolarHBondContact O-N 3.13Å; T376-Q402 HydrophobicContact CG2-CB 4.09Å; T376-Q402 HydrophobicContact CG2-CG 4.11Å
377	I	88.6	Confident	86.4	Confident	69 Å²	69	74 Å²	74	35%	0.354	41%	0.409	S	S	.	.	H	α-helix	trans	-61.8	-46.1	176.7	-70.6	170.2	0	0	0	110.3	L373 D374 V380 S381 M399	L373-I377 HydrophobicContact CD1-CD1 4.21Å; L373-I377 HydrophobicContact CD1-CG1 4.42Å; L373-I377 HydrophobicContact CD2-CD1 4.3Å; L373-I377 HydrophobicContact CG-CD1 3.8Å; L373-I377 HydrophobicContact CG-CG1 4.39Å; L373-I377 WeakPolarHBondContact O-CG1 3.12Å; L373-I377 PolarHBondContact O-N 3.32Å; D374-I377 PolarHBondContact O-N 3.35Å; I377-V380 PolarHBondContact O-N 3.05Å; I377-S381 WeakPolarHBondContact O-CB 3.1Å; I377-S381 PolarHBondContact O-N 2.98Å; I377-S381 PolarHBondContact O-OG 2.81Å; I377-M399 HydrophobicContact CG1-CE 4.29Å
378	A	89.1	Confident	85.6	Confident	60 Å²	60	75.3 Å²	75.3	50%	0.496	42%	0.415	S	S	.	.	H	α-helix	trans	-60.2	-47.9	177.9	0	0	0	0	0	111.7	D374 S381 Q382	D374-A378 WeakPolarHBondContact O-CB 3.45Å; D374-A378 PolarHBondContact O-N 2.92Å; A378-S381 PolarHBondContact O-N 2.82Å; A378-Q382 PolarHBondContact O-N 3.3Å
379	A	86	Confident	85	Confident	41 Å²	41	78.3 Å²	78.3	34%	0.339	43%	0.429	S	S	.	.	H	α-helix	trans	-63.6	-43.7	178.9	0	0	0	0	0	112.7	S375 T376 Q382 M383	S375-A379 WeakPolarHBondContact O-CB 3.2Å; S375-A379 PolarHBondContact O-N 2.91Å; T376-A379 PolarHBondContact O-N 3Å; A379-Q382 PolarHBondContact O-N 3.09Å; A379-M383 VanDerWaalsContact O-CG 3.3Å; A379-M383 WeakPolarHBondContact O-CG 3.36Å; A379-M383 PolarHBondContact O-N 2.98Å
380	V	86.3	Confident	84.6	Confident	17 Å²	17	82.9 Å²	82.9	10%	0.103	45%	0.45	C	S	.	.	H	α-helix	trans	-65.6	-40.3	177.4	166.9	0	0	0	0	111.2	T376 I377 M383 L384 A395 M399	T376-V380 HydrophobicContact CG2-CG2 4.35Å; T376-V380 WeakPolarHBondContact O-CB 3.37Å; T376-V380 VanDerWaalsContact O-CG2 3.29Å; T376-V380 WeakPolarHBondContact O-CG2 3.25Å; T376-V380 PolarHBondContact O-N 3.13Å; I377-V380 PolarHBondContact O-N 3.05Å; V380-M383 PolarHBondContact O-N 3.12Å; V380-L384 HydrophobicContact CG1-CD1 3.98Å; V380-L384 HydrophobicContact CG1-CG 4.46Å; V380-L384 VanDerWaalsContact O-CG 3.32Å; V380-L384 WeakPolarHBondContact O-CG 3.47Å; V380-L384 PolarHBondContact O-N 2.79Å; V380-A395 HydrophobicContact CG1-CB 4.18Å; V380-A395 HydrophobicContact CG2-CB 4.29Å; V380-M399 HydrophobicContact CG2-CB 4.48Å
381	S	87.3	Confident	84.1	Confident	53 Å²	53	81.2 Å²	81.2	37%	0.371	44%	0.442	S	S	.	.	H	α-helix	trans	-62.4	-46	177.9	-55.8	0	0	0	0	111	I377 A378 M383 L384 D385	I377-S381 WeakPolarHBondContact O-CB 3.1Å; I377-S381 PolarHBondContact O-N 2.98Å; I377-S381 PolarHBondContact O-OG 2.81Å; A378-S381 PolarHBondContact O-N 2.82Å; S381-M383 PolarHBondContact O-N 2.88Å; S381-L384 PolarHBondContact O-N 3.05Å; S381-L384 VanDerWaalsContact O-N 3.12Å; S381-D385 PolarHBondContact O-N 3.12Å
382	Q	85.3	Confident	83.6	Confident	120 Å²	120	80.1 Å²	80.1	56%	0.561	44%	0.435	S	S	*	.	H	α-helix	trans	-60.8	-42.6	175.5	-172.1	178.8	8.1	0	0	112.6	A378 A379 L384 D385 E386	A378-Q382 PolarHBondContact O-N 3.3Å; A379-Q382 PolarHBondContact O-N 3.09Å; Q382-L384 PolarHBondContact O-N 3.15Å; Q382-D385 PolarHBondContact O-N 3.32Å; Q382-E386 PolarHBondContact NE2-OE2 3.01Å; Q382-E386 PolarHBondContact O-N 3.17Å
383	M	85.6	Confident	83.2	Confident	37 Å²	37	80.4 Å²	80.4	18%	0.182	44%	0.441	C	S	.	.	H	α-helix	trans	-65.4	-26.7	176.8	-71.1	177.5	74.7	0	0	113.1	A379 V380 S381 G387 D391 L394 A395	A379-M383 VanDerWaalsContact O-CG 3.3Å; A379-M383 WeakPolarHBondContact O-CG 3.36Å; A379-M383 PolarHBondContact O-N 2.98Å; V380-M383 PolarHBondContact O-N 3.12Å; S381-M383 PolarHBondContact O-N 2.88Å; M383-G387 VanDerWaalsContact O-CA 3.25Å; M383-G387 WeakPolarHBondContact O-CA 3.18Å; M383-G387 PolarHBondContact O-N 2.87Å; M383-G387 VanDerWaalsContact O-N 3.13Å; M383-D391 HydrophobicContact CE-CB 3.62Å; M383-D391 WeakPolarHBondContact CE-O 3.38Å; M383-L394 HydrophobicContact CE-CB 4.49Å; M383-A395 HydrophobicContact CB-CB 4.23Å; M383-A395 HydrophobicContact CE-CB 4.27Å; M383-A395 HydrophobicContact SD-CB 4.29Å
384	L	82.3	Confident	82.9	Confident	99 Å²	99	83 Å²	83	52%	0.518	45%	0.454	S	S	.	.	H	α-helix	trans	-78.3	-35	175	-72.5	169.1	0	0	0	112.3	V380 S381 Q382 V392	V380-L384 HydrophobicContact CG1-CD1 3.98Å; V380-L384 HydrophobicContact CG1-CG 4.46Å; V380-L384 VanDerWaalsContact O-CG 3.32Å; V380-L384 WeakPolarHBondContact O-CG 3.47Å; V380-L384 PolarHBondContact O-N 2.79Å; S381-L384 PolarHBondContact O-N 3.05Å; S381-L384 VanDerWaalsContact O-N 3.12Å; Q382-L384 PolarHBondContact O-N 3.15Å; L384-V392 HydrophobicContact CD2-CG1 3.86Å; L384-V392 HydrophobicContact CD2-CG2 4.38Å
385	D	82.8	Confident	82.5	Confident	139 Å²	139	78.9 Å²	78.9	74%	0.743	43%	0.432	S	S	*	.	H	α-helix	trans	-79.1	-36.3	-178.8	-68.9	-24.7	0	0	0	112.7	S381 Q382	S381-D385 PolarHBondContact O-N 3.12Å; Q382-D385 PolarHBondContact O-N 3.32Å
386	E	76.3	Confident	82.2	Confident	148 Å²	148	83.9 Å²	83.9	69%	0.692	44%	0.441	S	S	*	.	H	α-helix	trans	-122	-7.7	-169.6	-60	-179.9	156.9	0	0	114.6	Q382	Q382-E386 PolarHBondContact NE2-OE2 3.01Å; Q382-E386 PolarHBondContact O-N 3.17Å
387	G	70.7	Confident	82	Confident	30 Å²	30	88.8 Å²	88.8	31%	0.309	46%	0.462	S	S	.	.			trans	-85.4	155	-167.7	0	0	0	0	0	116.1	M383	M383-G387 VanDerWaalsContact O-CA 3.25Å; M383-G387 WeakPolarHBondContact O-CA 3.18Å; M383-G387 PolarHBondContact O-N 2.87Å; M383-G387 VanDerWaalsContact O-N 3.13Å
388	H	75.6	Confident	81.7	Confident	152 Å²	152	92.4 Å²	92.4	70%	0.704	47%	0.471	S	S	*	.			trans	-75.9	163.9	171.7	-69.9	-63.9	0	0	0	111.1	L390 D391 V392	H388-L390 PolarHBondContact O-N 2.83Å; H388-D391 PolarHBondContact N-OD2 3.24Å; H388-D391 VanDerWaalsContact N-OD2 3.12Å; H388-D391 WeakPolarHBondContact O-CB 3.43Å; H388-D391 PolarHBondContact O-N 2.86Å; H388-V392 PolarHBondContact O-N 3.3Å
389	H	77.6	Confident	81.5	Confident	180 Å²	180	92 Å²	92	83%	0.833	46%	0.46	S	S	*	.	H	α-helix	trans	-50.6	-28.9	-174.4	-66.4	-63	0	0	0	115.1
390	L	78.3	Confident	81.5	Confident	123 Å²	123	94.8 Å²	94.8	64%	0.644	47%	0.469	S	S	*	.	H	α-helix	trans	-78.1	-34.4	178.3	-168.5	63.7	0	0	0	113.1	H388 V392 L393 L394	H388-L390 PolarHBondContact O-N 2.83Å; L390-V392 VanDerWaalsContact C-N 3.33Å; L390-V392 PolarHBondContact O-N 2.86Å; L390-L393 PolarHBondContact O-N 2.86Å; L390-L394 PolarHBondContact O-N 2.68Å
391	D	79.4	Confident	81.4	Confident	56 Å²	56	97.9 Å²	97.9	30%	0.299	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-39.3	179.3	-63.8	-43.7	0	0	0	110.9	M383 H388 L393 L394 A395	M383-D391 HydrophobicContact CE-CB 3.62Å; M383-D391 WeakPolarHBondContact CE-O 3.38Å; H388-D391 PolarHBondContact N-OD2 3.24Å; H388-D391 VanDerWaalsContact N-OD2 3.12Å; H388-D391 WeakPolarHBondContact O-CB 3.43Å; H388-D391 PolarHBondContact O-N 2.86Å; D391-L393 VanDerWaalsContact C-N 3.28Å; D391-L393 PolarHBondContact O-N 2.8Å; D391-L394 PolarHBondContact O-N 2.82Å; D391-A395 WeakPolarHBondContact O-CB 3.47Å; D391-A395 PolarHBondContact O-N 2.87Å
392	V	79.6	Confident	81.2	Confident	54 Å²	54	96 Å²	96	33%	0.327	47%	0.473	S	S	.	.	H	α-helix	trans	-60.5	-37.3	175.7	176.5	0	0	0	0	111.8	L384 H388 L390 A395 R396	L384-V392 HydrophobicContact CD2-CG1 3.86Å; L384-V392 HydrophobicContact CD2-CG2 4.38Å; H388-V392 PolarHBondContact O-N 3.3Å; L390-V392 VanDerWaalsContact C-N 3.33Å; L390-V392 PolarHBondContact O-N 2.86Å; V392-A395 PolarHBondContact O-N 2.76Å; V392-R396 PolarHBondContact O-N 2.88Å
393	L	80.2	Confident	81.1	Confident	103 Å²	103	93.5 Å²	93.5	54%	0.539	46%	0.463	S	S	.	.	H	α-helix	trans	-68.6	-40.9	176.8	-65.9	174.6	0	0	0	111.6	L390 D391 R396 E397	L390-L393 PolarHBondContact O-N 2.86Å; D391-L393 VanDerWaalsContact C-N 3.28Å; D391-L393 PolarHBondContact O-N 2.8Å; L393-R396 WeakPolarHBondContact O-CB 3.39Å; L393-R396 PolarHBondContact O-N 3.04Å; L393-E397 PolarHBondContact O-N 2.99Å
394	L	81.4	Confident	80.9	Confident	79 Å²	79	97.8 Å²	97.8	41%	0.414	48%	0.482	S	S	.	.	H	α-helix	trans	-68.3	-34.8	175.4	-66.7	173.5	0	0	0	112.3	M383 L390 D391 R396 E397 R398	M383-L394 HydrophobicContact CE-CB 4.49Å; L390-L394 PolarHBondContact O-N 2.68Å; D391-L394 PolarHBondContact O-N 2.82Å; L394-R396 VanDerWaalsContact C-N 3.32Å; L394-R396 PolarHBondContact O-N 3.32Å; L394-E397 PolarHBondContact O-N 2.98Å; L394-R398 WeakPolarHBondContact O-CG 3.47Å; L394-R398 PolarHBondContact O-N 3.07Å; L394-R398 VanDerWaalsContact O-N 3.1Å
395	A	82.6	Confident	80.8	Confident	2 Å²	2	96.5 Å²	96.5	2%	0.017	47%	0.473	C	S	.	.	H	α-helix	trans	-62.9	-38.2	175.9	0	0	0	0	0	111.8	V380 M383 D391 V392 R398 M399	V380-A395 HydrophobicContact CG1-CB 4.18Å; V380-A395 HydrophobicContact CG2-CB 4.29Å; M383-A395 HydrophobicContact CB-CB 4.23Å; M383-A395 HydrophobicContact CE-CB 4.27Å; M383-A395 HydrophobicContact SD-CB 4.29Å; D391-A395 WeakPolarHBondContact O-CB 3.47Å; D391-A395 PolarHBondContact O-N 2.87Å; V392-A395 PolarHBondContact O-N 2.76Å; A395-R398 PolarHBondContact O-N 3.42Å; A395-M399 WeakPolarHBondContact O-CB 3.47Å; A395-M399 PolarHBondContact O-N 2.77Å
396	R	83.4	Confident	80.7	Confident	174 Å²	174	92.9 Å²	92.9	66%	0.657	45%	0.454	S	S	*	.	H	α-helix	trans	-60	-47	173.7	-179.2	-174.9	175.5	-170.2	-1.1	112	V392 L393 L394 M399 L400	V392-R396 PolarHBondContact O-N 2.88Å; L393-R396 WeakPolarHBondContact O-CB 3.39Å; L393-R396 PolarHBondContact O-N 3.04Å; L394-R396 VanDerWaalsContact C-N 3.32Å; L394-R396 PolarHBondContact O-N 3.32Å; R396-M399 PolarHBondContact O-N 3.14Å; R396-L400 HydrophobicContact CG-CD1 4.06Å; R396-L400 WeakPolarHBondContact O-CB 3.46Å; R396-L400 VanDerWaalsContact O-CG 3.31Å; R396-L400 WeakPolarHBondContact O-CG 3.34Å; R396-L400 PolarHBondContact O-N 3.34Å
397	E	83.1	Confident	80.8	Confident	129 Å²	129	92.3 Å²	92.3	60%	0.603	45%	0.449	S	S	*	.	H	α-helix	trans	-65.5	-40.5	-180	-71	-169.7	162.7	0	0	112.3	L393 L394 L400 T401	L393-E397 PolarHBondContact O-N 2.99Å; L394-E397 PolarHBondContact O-N 2.98Å; E397-L400 PolarHBondContact O-N 2.89Å; E397-T401 PolarHBondContact O-N 3.15Å; E397-T401 PolarHBondContact O-OG1 3.5Å
398	R	82.9	Confident	81.2	Confident	144 Å²	144	95.9 Å²	95.9	54%	0.543	47%	0.465	S	S	.	.	H	α-helix	trans	-61.2	-45.4	174.7	-73.2	179.6	178.2	177	0.4	112	L394 A395 T401 Q402	L394-R398 WeakPolarHBondContact O-CG 3.47Å; L394-R398 PolarHBondContact O-N 3.07Å; L394-R398 VanDerWaalsContact O-N 3.1Å; A395-R398 PolarHBondContact O-N 3.42Å; R398-T401 PolarHBondContact O-N 3.07Å; R398-Q402 PolarHBondContact O-N 3.47Å
399	M	85	Confident	81.4	Confident	52 Å²	52	90.3 Å²	90.3	26%	0.256	44%	0.44	S	S	.	.	H	α-helix	trans	-68.1	-38.9	179.1	-167.7	60.7	179.9	0	0	112.3	I377 V380 A395 R396 T401 Q402 I403	I377-M399 HydrophobicContact CG1-CE 4.29Å; V380-M399 HydrophobicContact CG2-CB 4.48Å; A395-M399 WeakPolarHBondContact O-CB 3.47Å; A395-M399 PolarHBondContact O-N 2.77Å; R396-M399 PolarHBondContact O-N 3.14Å; M399-T401 VanDerWaalsContact C-N 3.32Å; M399-T401 PolarHBondContact O-N 3.45Å; M399-Q402 PolarHBondContact O-N 3.16Å; M399-I403 HydrophobicContact CE-CD1 4Å; M399-I403 HydrophobicContact CE-CG1 4.07Å; M399-I403 HydrophobicContact CG-CD1 3.94Å; M399-I403 HydrophobicContact CG-CG1 4.39Å; M399-I403 WeakPolarHBondContact O-CB 3.23Å; M399-I403 VanDerWaalsContact O-CG1 3.29Å; M399-I403 WeakPolarHBondContact O-CG1 3.18Å; M399-I403 PolarHBondContact O-N 3.16Å
400	L	84.9	Confident	81.4	Confident	100 Å²	100	90.6 Å²	90.6	52%	0.524	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-41.2	175	-77.3	172.8	0	0	0	111.9	R396 E397 H404	R396-L400 HydrophobicContact CG-CD1 4.06Å; R396-L400 WeakPolarHBondContact O-CB 3.46Å; R396-L400 VanDerWaalsContact O-CG 3.31Å; R396-L400 WeakPolarHBondContact O-CG 3.34Å; R396-L400 PolarHBondContact O-N 3.34Å; E397-L400 PolarHBondContact O-N 2.89Å; L400-H404 WeakPolarHBondContact O-CB 3.42Å; L400-H404 PolarHBondContact O-N 2.95Å
401	T	85.4	Confident	81.1	Confident	82 Å²	82	87.8 Å²	87.8	50%	0.503	44%	0.435	S	S	.	.	H	α-helix	trans	-63.1	-47.2	176.1	-52.7	0	0	0	0	110.7	E397 R398 M399 I403 H404 E405	E397-T401 PolarHBondContact O-N 3.15Å; E397-T401 PolarHBondContact O-OG1 3.5Å; R398-T401 PolarHBondContact O-N 3.07Å; M399-T401 VanDerWaalsContact C-N 3.32Å; M399-T401 PolarHBondContact O-N 3.45Å; T401-I403 PolarHBondContact O-N 3.32Å; T401-H404 WeakPolarHBondContact O-CB 3.45Å; T401-H404 PolarHBondContact O-N 3.47Å; T401-H404 VanDerWaalsContact O-N 3.14Å; T401-E405 PolarHBondContact O-N 3.18Å
402	Q	83.4	Confident	81	Confident	12 Å²	12	86.8 Å²	86.8	6%	0.056	43%	0.429	C	S	.	.	H	α-helix	trans	-67.4	-37	-179.5	-165.5	64.9	8.5	0	0	113.1	L373 T376 R398 M399 H404 E405 L406	L373-Q402 HydrophobicContact CD1-CG 3.64Å; T376-Q402 HydrophobicContact CG2-CB 4.09Å; T376-Q402 HydrophobicContact CG2-CG 4.11Å; R398-Q402 PolarHBondContact O-N 3.47Å; M399-Q402 PolarHBondContact O-N 3.16Å; Q402-H404 VanDerWaalsContact C-N 3.3Å; Q402-H404 PolarHBondContact O-N 3.48Å; Q402-E405 PolarHBondContact O-N 3.2Å; Q402-E405 PolarHBondContact OE1-OE2 3.47Å; Q402-L406 PolarHBondContact O-N 3.36Å
403	I	81.9	Confident	80.9	Confident	69 Å²	69	91.1 Å²	91.1	35%	0.354	45%	0.447	S	S	.	.	H	α-helix	trans	-65.5	-34.6	172.7	-71.3	172	0	0	0	111.1	M399 T401 L406 K407	M399-I403 HydrophobicContact CE-CD1 4Å; M399-I403 HydrophobicContact CE-CG1 4.07Å; M399-I403 HydrophobicContact CG-CD1 3.94Å; M399-I403 HydrophobicContact CG-CG1 4.39Å; M399-I403 WeakPolarHBondContact O-CB 3.23Å; M399-I403 VanDerWaalsContact O-CG1 3.29Å; M399-I403 WeakPolarHBondContact O-CG1 3.18Å; M399-I403 PolarHBondContact O-N 3.16Å; T401-I403 PolarHBondContact O-N 3.32Å; I403-L406 PolarHBondContact O-N 3.25Å; I403-K407 WeakPolarHBondContact O-CG 3.35Å; I403-K407 PolarHBondContact O-N 3.17Å
404	H	82.7	Confident	81.1	Confident	127 Å²	127	93.5 Å²	93.5	59%	0.588	46%	0.456	S	S	*	.	H	α-helix	trans	-68.1	-41.8	175.1	-166.4	74.3	0	0	0	111.6	L400 T401 Q402 L406 K407 T408	L400-H404 WeakPolarHBondContact O-CB 3.42Å; L400-H404 PolarHBondContact O-N 2.95Å; T401-H404 WeakPolarHBondContact O-CB 3.45Å; T401-H404 PolarHBondContact O-N 3.47Å; T401-H404 VanDerWaalsContact O-N 3.14Å; Q402-H404 VanDerWaalsContact C-N 3.3Å; Q402-H404 PolarHBondContact O-N 3.48Å; H404-L406 VanDerWaalsContact C-N 3.33Å; H404-L406 PolarHBondContact O-N 3.15Å; H404-K407 WeakPolarHBondContact O-CB 3.24Å; H404-K407 PolarHBondContact O-N 2.75Å; H404-K407 VanDerWaalsContact O-N 3.13Å; H404-T408 PolarHBondContact O-N 2.91Å
405	E	80.1	Confident	81.3	Confident	71 Å²	71	94.6 Å²	94.6	33%	0.332	47%	0.468	S	S	.	.	H	α-helix	trans	-63.1	-35	171.8	-68.3	-175.9	-175.3	0	0	112.6	K372 T401 Q402 K407 T408 L409	K372-E405 IonicContact NZ-OE1 3.28Å; K372-E405 PolarHBondContact NZ-OE1 2.74Å; K372-E405 IonicContact NZ-OE2 2.65Å; K372-E405 PolarHBondContact NZ-OE2 2.98Å; T401-E405 PolarHBondContact O-N 3.18Å; Q402-E405 PolarHBondContact O-N 3.2Å; Q402-E405 PolarHBondContact OE1-OE2 3.47Å; E405-K407 VanDerWaalsContact C-N 3.29Å; E405-K407 PolarHBondContact O-N 2.79Å; E405-T408 PolarHBondContact O-N 3.1Å; E405-T408 VanDerWaalsContact O-N 3.17Å; E405-T408 PolarHBondContact O-OG1 2.86Å; E405-L409 WeakPolarHBondContact O-CG 3.42Å; E405-L409 PolarHBondContact O-N 3.28Å; E405-L409 VanDerWaalsContact O-N 3.12Å
406	L	79.6	Confident	81.5	Confident	64 Å²	64	99.5 Å²	99.5	34%	0.335	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-34.1	172.1	-82.2	170.7	0	0	0	113	L373 Q402 I403 H404 T408 L409 R410	L373-L406 HydrophobicContact CD1-CD1 3.52Å; L373-L406 HydrophobicContact CD1-CG 4.22Å; L373-L406 HydrophobicContact CD2-CD1 3.8Å; L373-L406 HydrophobicContact CD2-CD2 4.08Å; L373-L406 HydrophobicContact CD2-CG 4.45Å; L373-L406 HydrophobicContact CG-CD1 4.28Å; Q402-L406 PolarHBondContact O-N 3.36Å; I403-L406 PolarHBondContact O-N 3.25Å; H404-L406 VanDerWaalsContact C-N 3.33Å; H404-L406 PolarHBondContact O-N 3.15Å; L406-T408 VanDerWaalsContact C-N 3.28Å; L406-T408 PolarHBondContact O-N 3.22Å; L406-L409 HydrophobicContact CD2-CD1 4.18Å; L406-L409 PolarHBondContact O-N 3.25Å; L406-R410 PolarHBondContact O-N 3.24Å
407	K	78.6	Confident	81.8	Confident	136 Å²	136	93.7 Å²	93.7	59%	0.591	47%	0.472	S	S	*	.	H	α-helix	trans	-66.4	-32.1	175.4	-71.2	175.3	-178.8	179.4	0	111.6	I403 H404 E405 R410	I403-K407 WeakPolarHBondContact O-CG 3.35Å; I403-K407 PolarHBondContact O-N 3.17Å; H404-K407 WeakPolarHBondContact O-CB 3.24Å; H404-K407 PolarHBondContact O-N 2.75Å; H404-K407 VanDerWaalsContact O-N 3.13Å; E405-K407 VanDerWaalsContact C-N 3.29Å; E405-K407 PolarHBondContact O-N 2.79Å; K407-R410 WeakPolarHBondContact O-CB 3.39Å
408	T	78.9	Confident	81.9	Confident	105 Å²	105	91.6 Å²	91.6	64%	0.644	47%	0.465	S	S	*	.	H	α-helix	trans	-76.6	-23.8	175.3	63.8	0	0	0	0	112.5	H404 E405 L406 R410	H404-T408 PolarHBondContact O-N 2.91Å; E405-T408 PolarHBondContact O-N 3.1Å; E405-T408 VanDerWaalsContact O-N 3.17Å; E405-T408 PolarHBondContact O-OG1 2.86Å; L406-T408 VanDerWaalsContact C-N 3.28Å; L406-T408 PolarHBondContact O-N 3.22Å; T408-R410 VanDerWaalsContact C-N 3.32Å; T408-R410 PolarHBondContact O-N 3.46Å
409	L	79.6	Confident	82.2	Confident	34 Å²	34	92 Å²	92	18%	0.178	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-76.2	-9.9	174.3	-72	169.6	0	0	0	114.9	E405 L406 G411 L412	E405-L409 WeakPolarHBondContact O-CG 3.42Å; E405-L409 PolarHBondContact O-N 3.28Å; E405-L409 VanDerWaalsContact O-N 3.12Å; L406-L409 HydrophobicContact CD2-CD1 4.18Å; L406-L409 PolarHBondContact O-N 3.25Å; L409-G411 PolarHBondContact O-N 3.46Å; L409-L412 HydrophobicContact CD2-CD1 3.76Å; L409-L412 PolarHBondContact O-N 2.96Å
410	R	77.5	Confident	82.4	Confident	187 Å²	187	98 Å²	98	71%	0.706	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-53.1	-32.2	-177	-171.2	-177.1	-77.1	-172.1	-5.3	113.2	L406 K407 T408 L412 M413	L406-R410 PolarHBondContact O-N 3.24Å; K407-R410 WeakPolarHBondContact O-CB 3.39Å; T408-R410 VanDerWaalsContact C-N 3.32Å; T408-R410 PolarHBondContact O-N 3.46Å; R410-L412 VanDerWaalsContact C-N 3.31Å; R410-L412 PolarHBondContact O-N 3.02Å; R410-M413 PolarHBondContact O-N 3.21Å
411	G	72.5	Confident	82.8	Confident	64 Å²	64	96.8 Å²	96.8	66%	0.66	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-72.3	-16	177.1	0	0	0	0	0	115.4	L409	L409-G411 PolarHBondContact O-N 3.46Å
412	L	77.3	Confident	83.2	Confident	35 Å²	35	99.5 Å²	99.5	18%	0.183	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-95.6	-5.6	176.8	-67.3	173.4	0	0	0	113	Q362 L366 L409 R410 Q414	Q362-L412 PolarHBondContact NE2-O 3.33Å; L366-L412 WeakPolarHBondContact CD1-O 3.31Å; L366-L412 HydrophobicContact CD2-CB 4.01Å; L409-L412 HydrophobicContact CD2-CD1 3.76Å; L409-L412 PolarHBondContact O-N 2.96Å; R410-L412 VanDerWaalsContact C-N 3.31Å; R410-L412 PolarHBondContact O-N 3.02Å; L412-Q414 VanDerWaalsContact C-N 3.33Å
413	M	78.1	Confident	83.7	Confident	144 Å²	144	105.4 Å²	105.4	71%	0.709	53%	0.526	S	S	*	.	S	Bend	trans	-79.3	-14.9	-177.3	-64.5	-175.2	71.5	0	0	113.6	R410	R410-M413 PolarHBondContact O-N 3.21Å
414	Q	84.2	Confident	84.2	Confident	153 Å²	153	107.9 Å²	107.9	72%	0.715	54%	0.544	S	S	*	.	S	Bend	trans	-100.4	143.7	169.1	-69.3	-171	-9.3	0	0	109.9	Q362 L412 Q416	Q362-Q414 PolarHBondContact NE2-O 3.46Å; L412-Q414 VanDerWaalsContact C-N 3.33Å; Q414-Q416 PolarHBondContact O-N 3.22Å
415	P	86.1	Confident	84.4	Confident	103 Å²	103	106 Å²	106	67%	0.669	54%	0.543	S	S	*	.			trans	-50.4	128.2	173.6	-25	33.8	0	0	0	111	L359 D417	L359-P415 HydrophobicContact CD2-CB 4.18Å; P415-D417 WeakPolarHBondContact CB-O 3.21Å; P415-D417 PolarHBondContact O-N 3.44Å
416	Q	86.1	Confident	84.7	Confident	104 Å²	104	106.6 Å²	106.6	49%	0.486	55%	0.553	S	S	.	*	S	Bend	trans	-73.8	-12.9	-180	-78.5	-174.6	-25	0	0	113.2	T358 Q414	T358-Q416 HydrophobicContact CG2-CB 4.15Å; Q414-Q416 PolarHBondContact O-N 3.22Å
417	D	88.9	Confident	85	Confident	53 Å²	53	108.9 Å²	108.9	28%	0.283	57%	0.566	S	S	.	*	S	Bend	trans	-142.7	159.2	180	-146.3	-31.6	0	0	0	109.5	K355 T358 L359 P415	K355-D417 WeakPolarHBondContact CG-OD2 3.44Å; K355-D417 IonicContact NZ-OD1 2.79Å; K355-D417 PolarHBondContact NZ-OD1 3.12Å; T358-D417 HydrophobicContact CG2-CB 4.45Å; L359-D417 HydrophobicContact CD2-CB 4.23Å; L359-D417 HydrophobicContact CG-CB 4.38Å; P415-D417 WeakPolarHBondContact CB-O 3.21Å; P415-D417 PolarHBondContact O-N 3.44Å
418	D	87.1	Confident	85.5	Confident	84 Å²	84	108.4 Å²	108.4	45%	0.449	57%	0.566	S	S	.	*			trans	-98.5	173.1	176.5	69.1	30.1	0	0	0	112.1	K355 R420	K355-D418 PolarHBondContact NZ-O 2.8Å; K355-D418 IonicContact NZ-OD1 2.87Å; K355-D418 PolarHBondContact NZ-OD1 3.07Å; D418-R420 WeakPolarHBondContact OD1-CB 3.41Å; D418-R420 PolarHBondContact OD1-N 2.89Å
419	D	87.7	Confident	86	Confident	154 Å²	154	106 Å²	106	82%	0.824	56%	0.557	S	S	*	*			trans	-91.7	5.6	176.9	65.2	-27.3	0	0	0	113.4	I421	D419-I421 PolarHBondContact O-N 2.87Å
420	R	90.4	Very high	86.3	Confident	176 Å²	176	108.2 Å²	108.2	66%	0.664	57%	0.568	S	S	*	*			trans	-74.8	116.5	-169.7	-168.9	176.4	179.3	-172.1	-1.2	111.8	D418 M422	D418-R420 WeakPolarHBondContact OD1-CB 3.41Å; D418-R420 PolarHBondContact OD1-N 2.89Å; R420-M422 HydrophobicContact CG-CG 4.03Å
421	I	93.3	Very high	86.7	Confident	75 Å²	75	105.8 Å²	105.8	39%	0.385	56%	0.56	S	S	.	*			trans	-131.9	118.4	169.4	-56.3	177.8	0	0	0	107.3	V348 I351 R352 D419	V348-I421 HydrophobicContact CG1-CG2 4.41Å; I351-I421 HydrophobicContact CG2-CD1 4.39Å; I351-I421 HydrophobicContact CG2-CG1 4.23Å; R352-I421 HydrophobicContact CB-CD1 4.48Å; D419-I421 PolarHBondContact O-N 2.87Å
422	M	92.9	Very high	87.2	Confident	139 Å²	139	107 Å²	107	69%	0.685	55%	0.55	S	S	*	*			trans	-123.3	135.3	-175.2	-66.8	-64.5	-62	0	0	110.9	R420	R420-M422 HydrophobicContact CG-CG 4.03Å
423	F	94.4	Very high	87.7	Confident	137 Å²	137	107.8 Å²	107.8	60%	0.601	56%	0.562	S	S	*	*			trans	-105.2	128.1	165.9	173.6	-114.8	0	0	0	109.2	L344 P425	L344-F423 HydrophobicContact CD1-CE2 4.13Å; F423-P425 HydrophobicContact CE1-CB 3.94Å; F423-P425 HydrophobicContact CZ-CB 4.38Å
424	T	91.3	Very high	88.1	Confident	121 Å²	121	104.3 Å²	104.3	74%	0.742	55%	0.545	S	S	*	.			trans	-106.1	111.6	173.4	-52.9	0	0	0	0	108
425	P	87.7	Confident	88.1	Confident	86 Å²	86	103.5 Å²	103.5	56%	0.558	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-67.9	155.4	179.2	28.8	-34.2	0	0	0	111.3	F423	F423-P425 HydrophobicContact CE1-CB 3.94Å; F423-P425 HydrophobicContact CZ-CB 4.38Å
426	P	86.6	Confident	88	Confident	85 Å²	85	102.7 Å²	102.7	55%	0.552	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-63.6	163	170.1	27.6	-32.6	0	0	0	111.4	L430	P426-L430 HydrophobicContact CB-CB 4.38Å; P426-L430 HydrophobicContact CB-CD2 3.69Å; P426-L430 HydrophobicContact CG-CD2 3.92Å
427	D	86.3	Confident	87.9	Confident	112 Å²	112	101.7 Å²	101.7	60%	0.599	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-69.2	160.4	178	65.6	-7.4	0	0	0	112.5	A429 L430	D427-A429 PolarHBondContact O-N 2.79Å; D427-A429 VanDerWaalsContact O-N 3.11Å; D427-L430 PolarHBondContact O-N 2.93Å; D427-L430 PolarHBondContact OD1-N 2.86Å
428	Q	89.4	Confident	87.3	Confident	125 Å²	125	102.1 Å²	102.1	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-61	-22.4	179.9	-168.9	63.4	19.2	0	0	112.5	L430 Y431 I432	Q428-L430 VanDerWaalsContact C-N 3.33Å; Q428-L430 PolarHBondContact O-N 2.62Å; Q428-Y431 VanDerWaalsContact NE2-CD1 3.3Å; Q428-Y431 WeakPolarHBondContact O-CB 3.27Å; Q428-Y431 PolarHBondContact O-N 2.9Å; Q428-I432 HydrophobicContact CG-CD1 4.2Å; Q428-I432 WeakPolarHBondContact O-CG1 3.49Å; Q428-I432 PolarHBondContact O-N 3.42Å; Q428-I432 VanDerWaalsContact O-N 3.11Å
429	A	88.1	Confident	87	Confident	55 Å²	55	103.8 Å²	103.8	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-61	-40	177.8	0	0	0	0	0	112	D427 Y431 I432 A433	D427-A429 PolarHBondContact O-N 2.79Å; D427-A429 VanDerWaalsContact O-N 3.11Å; A429-Y431 PolarHBondContact O-N 3.33Å; A429-I432 PolarHBondContact O-N 2.89Å; A429-A433 VanDerWaalsContact O-CB 3.32Å; A429-A433 WeakPolarHBondContact O-CB 3.35Å; A429-A433 PolarHBondContact O-N 2.89Å
430	L	87.1	Confident	86.7	Confident	80 Å²	80	103 Å²	103	42%	0.419	55%	0.554	S	S	.	*	H	α-helix	trans	-64.4	-39.7	176.5	-177.8	62.5	0	0	0	112.2	P426 D427 Q428 A433 I434	P426-L430 HydrophobicContact CB-CB 4.38Å; P426-L430 HydrophobicContact CB-CD2 3.69Å; P426-L430 HydrophobicContact CG-CD2 3.92Å; D427-L430 PolarHBondContact O-N 2.93Å; D427-L430 PolarHBondContact OD1-N 2.86Å; Q428-L430 VanDerWaalsContact C-N 3.33Å; Q428-L430 PolarHBondContact O-N 2.62Å; L430-A433 PolarHBondContact O-N 2.95Å; L430-I434 HydrophobicContact CD1-CD1 4.25Å; L430-I434 HydrophobicContact CD1-CG1 4.44Å; L430-I434 HydrophobicContact CG-CD1 4.09Å; L430-I434 WeakPolarHBondContact O-CG1 3.27Å; L430-I434 PolarHBondContact O-N 3.3Å
431	Y	84.2	Confident	86	Confident	136 Å²	136	97.5 Å²	97.5	53%	0.533	54%	0.543	S	S	.	.	H	α-helix	trans	-61.2	-47.7	176.5	174.6	-95.7	0	0	0	111.2	Q428 A429 A433 I434 Q435	Q428-Y431 VanDerWaalsContact NE2-CD1 3.3Å; Q428-Y431 WeakPolarHBondContact O-CB 3.27Å; Q428-Y431 PolarHBondContact O-N 2.9Å; A429-Y431 PolarHBondContact O-N 3.33Å; Y431-A433 VanDerWaalsContact C-N 3.34Å; Y431-A433 PolarHBondContact O-N 3.22Å; Y431-I434 PolarHBondContact O-N 2.87Å; Y431-Q435 VanDerWaalsContact CE1-OE1 3.3Å; Y431-Q435 WeakPolarHBondContact O-CB 3.47Å; Y431-Q435 PolarHBondContact O-N 2.83Å
432	I	84.9	Confident	85.4	Confident	90 Å²	90	96.7 Å²	96.7	46%	0.462	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-43.5	177.8	-64.8	168.7	0	0	0	110.3	Q428 A429 I434 Q435 S436	Q428-I432 HydrophobicContact CG-CD1 4.2Å; Q428-I432 WeakPolarHBondContact O-CG1 3.49Å; Q428-I432 PolarHBondContact O-N 3.42Å; Q428-I432 VanDerWaalsContact O-N 3.11Å; A429-I432 PolarHBondContact O-N 2.89Å; I432-I434 VanDerWaalsContact C-N 3.29Å; I432-I434 PolarHBondContact O-N 2.81Å; I432-Q435 PolarHBondContact O-N 3.2Å; I432-Q435 VanDerWaalsContact O-N 3.12Å; I432-S436 PolarHBondContact O-N 3.32Å; I432-S436 PolarHBondContact O-OG 2.82Å; I432-S436 VanDerWaalsContact O-OG 3.08Å
433	A	86.4	Confident	85	Confident	51 Å²	51	93.2 Å²	93.2	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-61.2	-36.2	178.3	0	0	0	0	0	112.8	A429 L430 Y431 M437	A429-A433 VanDerWaalsContact O-CB 3.32Å; A429-A433 WeakPolarHBondContact O-CB 3.35Å; A429-A433 PolarHBondContact O-N 2.89Å; L430-A433 PolarHBondContact O-N 2.95Å; Y431-A433 VanDerWaalsContact C-N 3.34Å; Y431-A433 PolarHBondContact O-N 3.22Å; A433-M437 WeakPolarHBondContact O-CB 3.03Å; A433-M437 PolarHBondContact O-N 2.82Å
434	I	87.3	Confident	84.6	Confident	72 Å²	72	86.9 Å²	86.9	37%	0.369	51%	0.507	S	S	.	.	H	α-helix	trans	-71.7	-41.2	174	-67.1	167.5	0	0	0	110.8	L337 L430 Y431 I432 M437	L337-I434 HydrophobicContact CD1-CD1 4.41Å; L337-I434 HydrophobicContact CD2-CD1 4.49Å; L430-I434 HydrophobicContact CD1-CD1 4.25Å; L430-I434 HydrophobicContact CD1-CG1 4.44Å; L430-I434 HydrophobicContact CG-CD1 4.09Å; L430-I434 WeakPolarHBondContact O-CG1 3.27Å; L430-I434 PolarHBondContact O-N 3.3Å; Y431-I434 PolarHBondContact O-N 2.87Å; I432-I434 VanDerWaalsContact C-N 3.29Å; I432-I434 PolarHBondContact O-N 2.81Å; I434-M437 HydrophobicContact CB-CE 4.31Å; I434-M437 HydrophobicContact CG1-CE 4.1Å; I434-M437 HydrophobicContact CG2-CE 4.43Å; I434-M437 WeakPolarHBondContact O-CB 3.48Å; I434-M437 PolarHBondContact O-N 3.05Å
435	Q	84.4	Confident	84.5	Confident	136 Å²	136	84.2 Å²	84.2	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-67.2	-37.2	-179	-171.7	179	7.1	0	0	112.8	Y431 I432 M437	Y431-Q435 VanDerWaalsContact CE1-OE1 3.3Å; Y431-Q435 WeakPolarHBondContact O-CB 3.47Å; Y431-Q435 PolarHBondContact O-N 2.83Å; I432-Q435 PolarHBondContact O-N 3.2Å; I432-Q435 VanDerWaalsContact O-N 3.12Å; Q435-M437 VanDerWaalsContact C-N 3.34Å
436	S	83.8	Confident	84.5	Confident	86 Å²	86	80.3 Å²	80.3	60%	0.601	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	18.2	179.4	72.3	0	0	0	0	113.1	I432 G438	I432-S436 PolarHBondContact O-N 3.32Å; I432-S436 PolarHBondContact O-OG 2.82Å; I432-S436 VanDerWaalsContact O-OG 3.08Å; S436-G438 PolarHBondContact O-N 2.85Å
437	M	83.1	Confident	84.5	Confident	82 Å²	82	79 Å²	79	40%	0.404	45%	0.452	S	S	.	.			trans	-77	121.6	-173.4	-166.3	-174.8	-46.6	0	0	111.8	H333 A433 I434 Q435	H333-M437 PolarHBondContact CD2-SD 2.74Å; A433-M437 WeakPolarHBondContact O-CB 3.03Å; A433-M437 PolarHBondContact O-N 2.82Å; I434-M437 HydrophobicContact CB-CE 4.31Å; I434-M437 HydrophobicContact CG1-CE 4.1Å; I434-M437 HydrophobicContact CG2-CE 4.43Å; I434-M437 WeakPolarHBondContact O-CB 3.48Å; I434-M437 PolarHBondContact O-N 3.05Å; Q435-M437 VanDerWaalsContact C-N 3.34Å
438	G	77.3	Confident	84.7	Confident	63 Å²	63	75.9 Å²	75.9	65%	0.649	44%	0.436	S	S	*	.			trans	89.4	146.8	177.5	0	0	0	0	0	112.4	S436	S436-G438 PolarHBondContact O-N 2.85Å
439	L	80.6	Confident	84.7	Confident	118 Å²	118	69.9 Å²	69.9	62%	0.618	41%	0.408	S	S	*	.			trans	-137.8	137.6	177.1	-178.4	72.2	0	0	0	107.9	L480	L439-L480 HydrophobicContact CD1-CD1 3.78Å; L439-L480 HydrophobicContact CD2-CB 3.74Å; L439-L480 HydrophobicContact CD2-CD1 3.59Å; L439-L480 HydrophobicContact CD2-CG 4.3Å; L439-L480 HydrophobicContact CG-CD1 4.29Å
440	I	80.6	Confident	84.9	Confident	137 Å²	137	72.3 Å²	72.3	70%	0.703	41%	0.408	S	S	*	.			trans	-102	121.4	169.3	-59.6	175	0	0	0	106
441	S	75.5	Confident	85.1	Confident	62 Å²	62	69.6 Å²	69.6	43%	0.434	40%	0.395	S	S	.	.			trans	-117.8	146.8	173.1	59.1	0	0	0	0	110.6	S481	S441-S481 WeakPolarHBondContact CB-OG 3.47Å; S441-S481 PolarHBondContact OG-OG 2.76Å
442	S	81.2	Confident	85.4	Confident	58 Å²	58	67.6 Å²	67.6	41%	0.406	39%	0.39	S	S	.	.			trans	-109.2	158.9	168.7	-171.8	0	0	0	0	109.5
443	S	84.1	Confident	85.4	Confident	66 Å²	66	64.6 Å²	64.6	46%	0.462	38%	0.382	S	S	.	.			trans	-64.5	155.7	171.5	54.6	0	0	0	0	111.3	F445 D484	S443-F445 PolarHBondContact O-N 2.76Å; S443-D484 VanDerWaalsContact CA-OD1 3.23Å; S443-D484 WeakPolarHBondContact CA-OD1 3.35Å; S443-D484 VanDerWaalsContact CB-OD1 3.24Å; S443-D484 WeakPolarHBondContact CB-OD1 3.47Å
444	A	86.2	Confident	85	Confident	4 Å²	4	68 Å²	68	3%	0.033	39%	0.389	C	S	.	.			trans	-61.2	131.9	175.6	0	0	0	0	0	111.9	D484 V529	A444-D484 HydrophobicContact CB-CB 4.37Å; A444-D484 WeakPolarHBondContact CB-OD2 3.47Å; A444-D484 PolarHBondContact N-OD1 2.77Å; A444-V529 HydrophobicContact CB-CG1 3.83Å
445	F	89.8	Confident	84.8	Confident	64 Å²	64	64.7 Å²	64.7	28%	0.281	37%	0.373	S	S	.	.			trans	-93.4	113.1	173.5	-176.1	-131.6	0	0	0	109.5	S443 P447 V448 T449 Y472 H474	S443-F445 PolarHBondContact O-N 2.76Å; F445-P447 VanDerWaalsContact C-CD 3.48Å; F445-P447 HydrophobicContact CD1-CB 4.43Å; F445-P447 HydrophobicContact CD1-CG 4.37Å; F445-P447 HydrophobicContact CD2-CG 4.34Å; F445-P447 HydrophobicContact CE1-CB 3.91Å; F445-P447 HydrophobicContact CE1-CG 3.8Å; F445-P447 VanDerWaalsContact CE2-CD 3.48Å; F445-P447 HydrophobicContact CE2-CG 3.77Å; F445-P447 HydrophobicContact CZ-CB 4.08Å; F445-P447 HydrophobicContact CZ-CG 3.47Å; F445-P447 VanDerWaalsContact CZ-CG 3.47Å; F445-V448 HydrophobicContact CB-CG2 3.87Å; F445-V448 HydrophobicContact CD1-CG1 4.21Å; F445-V448 HydrophobicContact CD1-CG2 3.62Å; F445-V448 HydrophobicContact CG-CG2 4.18Å; F445-V448 WeakPolarHBondContact O-CG2 3.42Å; F445-V448 PolarHBondContact O-N 3.41Å; F445-T449 PolarHBondContact O-N 2.83Å; F445-T449 VanDerWaalsContact O-N 3.07Å; F445-T449 PolarHBondContact O-OG1 3.03Å; F445-Y472 PolarHBondContact N-O 2.6Å; F445-H474 AromaticContact CD1-CE1 3.93Å; F445-H474 AromaticContact CD1-ND1 3.53Å; F445-H474 AromaticContact CD2-CE1 3.18Å; F445-H474 WeakPolarHBondContact CD2-CE1 3.49Å; F445-H474 AromaticContact CD2-ND1 3.68Å; F445-H474 AromaticContact CD2-NE2 3.78Å; F445-H474 AromaticContact CE1-ND1 3.73Å; F445-H474 AromaticContact CE2-CE1 3.35Å; F445-H474 WeakPolarHBondContact CE2-CE1 3.47Å; F445-H474 AromaticContact CE2-ND1 3.87Å; F445-H474 AromaticContact CG-CE1 3.51Å; F445-H474 AromaticContact CG-ND1 3.53Å; F445-H474 AromaticContact CZ-CE1 3.8Å; F445-H474 AromaticContact CZ-ND1 3.89Å
446	A	87.8	Confident	84.7	Confident	4 Å²	4	59.2 Å²	59.2	3%	0.033	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-53.5	-43.3	-172	0	0	0	0	0	114.5	V448 T449 V529 Q532 V534 Q535	A446-V448 PolarHBondContact O-N 3.24Å; A446-V448 VanDerWaalsContact O-N 3.14Å; A446-T449 WeakPolarHBondContact O-CB 3.49Å; A446-T449 PolarHBondContact O-N 3.15Å; A446-V529 HydrophobicContact CB-CB 4.04Å; A446-Q532 HydrophobicContact CB-CB 3.8Å; A446-V534 HydrophobicContact CB-CG1 4.44Å; A446-V534 VanDerWaalsContact O-CA 3.29Å; A446-V534 WeakPolarHBondContact O-CA 3.27Å; A446-Q535 PolarHBondContact O-N 2.83Å
447	P	87.1	Confident	84.5	Confident	59 Å²	59	60.7 Å²	60.7	38%	0.383	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-63.3	-21.3	-176.9	-27.4	39	0	0	0	115.9	F445	F445-P447 VanDerWaalsContact C-CD 3.48Å; F445-P447 HydrophobicContact CD1-CB 4.43Å; F445-P447 HydrophobicContact CD1-CG 4.37Å; F445-P447 HydrophobicContact CD2-CG 4.34Å; F445-P447 HydrophobicContact CE1-CB 3.91Å; F445-P447 HydrophobicContact CE1-CG 3.8Å; F445-P447 VanDerWaalsContact CE2-CD 3.48Å; F445-P447 HydrophobicContact CE2-CG 3.77Å; F445-P447 HydrophobicContact CZ-CB 4.08Å; F445-P447 HydrophobicContact CZ-CG 3.47Å; F445-P447 VanDerWaalsContact CZ-CG 3.47Å
448	V	89.1	Confident	84.1	Confident	45 Å²	45	61.5 Å²	61.5	27%	0.273	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-112	-7.7	179.3	-63.8	0	0	0	0	112.8	F445 A446 K450 D473	F445-V448 HydrophobicContact CB-CG2 3.87Å; F445-V448 HydrophobicContact CD1-CG1 4.21Å; F445-V448 HydrophobicContact CD1-CG2 3.62Å; F445-V448 HydrophobicContact CG-CG2 4.18Å; F445-V448 WeakPolarHBondContact O-CG2 3.42Å; F445-V448 PolarHBondContact O-N 3.41Å; A446-V448 PolarHBondContact O-N 3.24Å; A446-V448 VanDerWaalsContact O-N 3.14Å; V448-K450 PolarHBondContact O-N 2.8Å; V448-D473 VanDerWaalsContact CG2-O 3.23Å; V448-D473 WeakPolarHBondContact CG2-O 3.36Å
449	T	90.7	Very high	84.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.32	C	S	.	.			trans	-63.1	132.4	173.6	-67.3	0	0	0	0	109.9	F445 A446 V469 I470 V529 V534	F445-T449 PolarHBondContact O-N 2.83Å; F445-T449 VanDerWaalsContact O-N 3.07Å; F445-T449 PolarHBondContact O-OG1 3.03Å; A446-T449 WeakPolarHBondContact O-CB 3.49Å; A446-T449 PolarHBondContact O-N 3.15Å; T449-V469 HydrophobicContact CG2-CG1 3.51Å; T449-I470 WeakPolarHBondContact CG2-O 3.48Å; T449-V529 HydrophobicContact CG2-CG2 4.1Å; T449-V534 HydrophobicContact CG2-CB 4.26Å; T449-V534 HydrophobicContact CG2-CG1 3.74Å
450	K	91.1	Very high	84.4	Confident	105 Å²	105	54.8 Å²	54.8	46%	0.457	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	148	-175.8	-64.4	178.2	-175.5	163.1	0	111.1	V448 I470 Y472	V448-K450 PolarHBondContact O-N 2.8Å; K450-I470 PolarHBondContact N-O 2.91Å; K450-I470 VanDerWaalsContact N-O 3.12Å; K450-I470 PolarHBondContact O-N 2.84Å; K450-Y472 HydrophobicContact CB-CD2 4.42Å; K450-Y472 HydrophobicContact CB-CE2 3.97Å; K450-Y472 HydrophobicContact CD-CE2 3.89Å; K450-Y472 HydrophobicContact CG-CD2 4.25Å; K450-Y472 HydrophobicContact CG-CE2 3.94Å
451	V	92.3	Very high	84.6	Confident	24 Å²	24	49.7 Å²	49.7	15%	0.145	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.7	176.7	-162.4	0	0	0	0	109.6	L456 F467 T468 V469 V527 V534 F539	V451-L456 HydrophobicContact CB-CD1 3.96Å; V451-L456 HydrophobicContact CG1-CD1 3.52Å; V451-L456 HydrophobicContact CG1-CG 4.45Å; V451-F467 HydrophobicContact CG1-CD2 3.24Å; V451-F467 HydrophobicContact CG1-CE2 3.58Å; V451-F467 HydrophobicContact CG1-CG 4.23Å; V451-T468 WeakPolarHBondContact CA-O 3.42Å; V451-T468 WeakPolarHBondContact CG1-O 3.42Å; V451-V469 HydrophobicContact CG1-CG2 4.04Å; V451-V469 HydrophobicContact CG2-CG1 4.4Å; V451-V469 HydrophobicContact CG2-CG2 4.22Å; V451-V527 HydrophobicContact CG2-CG1 4.36Å; V451-V534 HydrophobicContact CG2-CG2 3.53Å; V451-F539 HydrophobicContact CB-CE2 4.18Å; V451-F539 HydrophobicContact CB-CZ 3.85Å; V451-F539 HydrophobicContact CG2-CE2 3.98Å; V451-F539 HydrophobicContact CG2-CZ 3.81Å
452	H	89.6	Confident	84.9	Confident	93 Å²	93	49.2 Å²	49.2	43%	0.431	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	148.7	176.5	58	68.5	0	0	0	111.8	T468 I470	H452-T468 PolarHBondContact N-O 2.7Å; H452-T468 PolarHBondContact O-N 3.05Å; H452-I470 WeakPolarHBondContact NE2-CD1 3.25Å
453	G	85.4	Confident	84.9	Confident	28 Å²	28	50 Å²	50	29%	0.289	28%	0.276	S	S	.	.	S	Bend	trans	151.2	160	175.7	0	0	0	0	0	111.8	G455 L456	G453-G455 PolarHBondContact O-N 2.76Å; G453-L456 PolarHBondContact O-N 2.92Å
454	E	78.4	Confident	85.1	Confident	122 Å²	122	52 Å²	52	57%	0.57	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-66.2	-23.8	178.9	-70.4	-59.6	128.2	0	0	112.3	L456 K457	E454-L456 PolarHBondContact O-N 3.11Å; E454-K457 PolarHBondContact O-N 2.93Å; E454-K457 IonicContact OE1-NZ 3.15Å; E454-K457 PolarHBondContact OE1-NZ 3.48Å
455	G	82.3	Confident	85.3	Confident	2 Å²	2	52.5 Å²	52.5	2%	0.021	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-61.3	-9.6	172.2	0	0	0	0	0	115.4	G453 S466 F515	G453-G455 PolarHBondContact O-N 2.76Å; G455-S466 WeakPolarHBondContact CA-O 3.42Å; G455-S466 PolarHBondContact N-O 2.79Å; G455-F515 WeakPolarHBondContact O-CE1 3.2Å; G455-F515 WeakPolarHBondContact O-CZ 3.34Å
456	L	83.7	Confident	85.4	Confident	22 Å²	22	52.3 Å²	52.3	12%	0.115	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-100.5	3.2	174.3	-65.6	-178.5	0	0	0	114.3	V451 G453 E454 F467 V525 F539 V541	V451-L456 HydrophobicContact CB-CD1 3.96Å; V451-L456 HydrophobicContact CG1-CD1 3.52Å; V451-L456 HydrophobicContact CG1-CG 4.45Å; G453-L456 PolarHBondContact O-N 2.92Å; E454-L456 PolarHBondContact O-N 3.11Å; L456-F467 HydrophobicContact CD2-CD1 3.84Å; L456-F467 HydrophobicContact CD2-CD2 4.35Å; L456-F467 HydrophobicContact CD2-CE1 3.97Å; L456-F467 HydrophobicContact CD2-CE2 4.44Å; L456-F467 HydrophobicContact CD2-CG 4.03Å; L456-F467 HydrophobicContact CD2-CZ 4.25Å; L456-F467 HydrophobicContact CG-CB 4.03Å; L456-F467 HydrophobicContact CG-CD1 4.13Å; L456-F467 HydrophobicContact CG-CD2 4.4Å; L456-F467 HydrophobicContact CG-CG 3.94Å; L456-V525 HydrophobicContact CD2-CB 4.41Å; L456-V525 HydrophobicContact CD2-CG1 4.16Å; L456-F539 HydrophobicContact CD1-CD1 4.23Å; L456-F539 HydrophobicContact CD1-CD2 4.47Å; L456-F539 HydrophobicContact CD1-CE1 4.32Å; L456-F539 HydrophobicContact CD1-CG 4.32Å; L456-F539 HydrophobicContact CD1-CZ 4.5Å; L456-F539 HydrophobicContact CD2-CB 3.98Å; L456-F539 HydrophobicContact CD2-CD2 3.93Å; L456-F539 HydrophobicContact CD2-CG 3.92Å; L456-V541 HydrophobicContact CD2-CG2 4.47Å
457	K	79.1	Confident	85.7	Confident	116 Å²	116	52.2 Å²	52.2	50%	0.504	30%	0.297	S	S	.	.	S	Bend	trans	-118.7	-93	-175.8	-60.7	177.6	-166.2	158.5	0	111.8	E454 T542	E454-K457 PolarHBondContact O-N 2.93Å; E454-K457 IonicContact OE1-NZ 3.15Å; E454-K457 PolarHBondContact OE1-NZ 3.48Å; K457-T542 PolarHBondContact O-N 3.08Å
458	N	73.7	Confident	86	Confident	99 Å²	99	50.8 Å²	50.8	53%	0.529	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113.2	-178.3	-68.6	-59.7	0	0	0	108.2
459	V	83.1	Confident	86.3	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.036	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	149.4	179.2	178.6	0	0	0	0	109.4	A465 F515 P517 V541 T542 V543 K544	V459-A465 HydrophobicContact CB-CB 4.24Å; V459-A465 HydrophobicContact CG1-CB 3.43Å; V459-A465 VanDerWaalsContact CG1-CB 3.43Å; V459-A465 HydrophobicContact CG2-CB 3.74Å; V459-F515 HydrophobicContact CG1-CE2 4.44Å; V459-F515 HydrophobicContact CG2-CZ 4.07Å; V459-P517 HydrophobicContact CG1-CG 3.47Å; V459-P517 VanDerWaalsContact CG1-CG 3.47Å; V459-V541 HydrophobicContact CB-CG1 4.22Å; V459-V541 HydrophobicContact CG2-CG1 3.66Å; V459-T542 PolarHBondContact N-O 3.48Å; V459-T542 VanDerWaalsContact N-O 3.12Å; V459-V543 HydrophobicContact CB-CG2 4.31Å; V459-V543 CarbonylContact O-C 3.6Å; V459-V543 VanDerWaalsContact O-CA 3.28Å; V459-V543 WeakPolarHBondContact O-CA 3.36Å; V459-K544 PolarHBondContact O-N 2.89Å
460	L	82.5	Confident	86.4	Confident	35 Å²	35	50.6 Å²	50.6	18%	0.183	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	133	176.1	-65.9	174.5	0	0	0	110.4	G462 K463 K544 E768	L460-G462 PolarHBondContact O-N 2.94Å; L460-K463 HydrophobicContact CB-CB 4.35Å; L460-K463 HydrophobicContact CD1-CD 4.32Å; L460-K463 PolarHBondContact O-N 2.92Å; L460-K544 WeakPolarHBondContact CA-O 3.18Å; L460-K544 HydrophobicContact CD2-CB 4.31Å; L460-E768 HydrophobicContact CD1-CG 3.45Å; L460-E768 VanDerWaalsContact CD1-CG 3.45Å
461	C	85.1	Confident	86.4	Confident	30 Å²	30	45.6 Å²	45.6	20%	0.203	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	128.7	174	-176.6	0	0	0	0	110.2	K463 K518 V543 K544	C461-K463 VanDerWaalsContact C-N 3.33Å; C461-K463 PolarHBondContact O-N 3.04Å; C461-K518 PolarHBondContact SG-O 2.9Å; C461-V543 HydrophobicContact CB-CG1 3.86Å; C461-K544 PolarHBondContact N-O 2.91Å
462	G	81.4	Confident	86.2	Confident	52 Å²	52	46.6 Å²	46.6	54%	0.536	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	6	178.7	0	0	0	0	0	115.9	L460 L516 P517	L460-G462 PolarHBondContact O-N 2.94Å; G462-L516 VanDerWaalsContact C-CD1 3.46Å; G462-P517 PolarHBondContact N-O 3.28Å
463	K	81.6	Confident	86.2	Confident	73 Å²	73	43.5 Å²	43.5	32%	0.317	25%	0.251	S	S	.	.	S	Bend	trans	-109	140.7	167.7	-78	-163.4	178.4	179.6	0	111.1	L460 C461 A465 P517 E768	L460-K463 HydrophobicContact CB-CB 4.35Å; L460-K463 HydrophobicContact CD1-CD 4.32Å; L460-K463 PolarHBondContact O-N 2.92Å; C461-K463 VanDerWaalsContact C-N 3.33Å; C461-K463 PolarHBondContact O-N 3.04Å; K463-A465 PolarHBondContact O-N 3.45Å; K463-P517 WeakPolarHBondContact O-CD 3.41Å; K463-E768 IonicContact NZ-OE2 2.81Å; K463-E768 PolarHBondContact NZ-OE2 2.88Å
464	P	87.5	Confident	86.1	Confident	110 Å²	110	48 Å²	48	71%	0.714	27%	0.265	S	S	*	.			trans	-63.2	129	174.6	26.3	-32.6	0	0	0	109.2	F515	P464-F515 WeakPolarHBondContact CA-O 3.35Å
465	A	89.6	Confident	86.3	Confident	13 Å²	13	49.2 Å²	49.2	11%	0.107	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	149.1	172	0	0	0	0	0	109.7	V459 K463 C514 F515	V459-A465 HydrophobicContact CB-CB 4.24Å; V459-A465 HydrophobicContact CG1-CB 3.43Å; V459-A465 VanDerWaalsContact CG1-CB 3.43Å; V459-A465 HydrophobicContact CG2-CB 3.74Å; K463-A465 PolarHBondContact O-N 3.45Å; A465-C514 CarbonylContact O-C 3.47Å; A465-C514 WeakPolarHBondContact O-CA 3.29Å; A465-F515 HydrophobicContact CB-CD1 4.38Å; A465-F515 HydrophobicContact CB-CE1 3.9Å; A465-F515 HydrophobicContact CB-CE2 4.21Å; A465-F515 HydrophobicContact CB-CZ 3.83Å; A465-F515 PolarHBondContact N-O 2.9Å; A465-F515 PolarHBondContact O-N 3.08Å
466	S	92.3	Very high	86.3	Confident	60 Å²	60	50.7 Å²	50.7	42%	0.42	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	154.1	177.8	64.4	0	0	0	0	112.6	G455 V513 C514	G455-S466 WeakPolarHBondContact CA-O 3.42Å; G455-S466 PolarHBondContact N-O 2.79Å; S466-V513 CarbonylContact C-O 3.55Å; S466-V513 WeakPolarHBondContact CA-O 3.36Å; S466-V513 WeakPolarHBondContact CB-O 3.38Å; S466-C514 VanDerWaalsContact CB-SG 3.6Å
467	F	94.4	Very high	86.4	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.009	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	167.5	171.4	60.2	-94.7	0	0	0	109.7	V451 L456 V469 V513 F515 V525 V527	V451-F467 HydrophobicContact CG1-CD2 3.24Å; V451-F467 HydrophobicContact CG1-CE2 3.58Å; V451-F467 HydrophobicContact CG1-CG 4.23Å; L456-F467 HydrophobicContact CD2-CD1 3.84Å; L456-F467 HydrophobicContact CD2-CD2 4.35Å; L456-F467 HydrophobicContact CD2-CE1 3.97Å; L456-F467 HydrophobicContact CD2-CE2 4.44Å; L456-F467 HydrophobicContact CD2-CG 4.03Å; L456-F467 HydrophobicContact CD2-CZ 4.25Å; L456-F467 HydrophobicContact CG-CB 4.03Å; L456-F467 HydrophobicContact CG-CD1 4.13Å; L456-F467 HydrophobicContact CG-CD2 4.4Å; L456-F467 HydrophobicContact CG-CG 3.94Å; F467-V469 HydrophobicContact CD2-CG2 4.29Å; F467-V469 HydrophobicContact CE2-CG2 3.97Å; F467-V513 HydrophobicContact CD1-CB 4.36Å; F467-V513 HydrophobicContact CD2-CB 3.99Å; F467-V513 HydrophobicContact CD2-CG2 4.27Å; F467-V513 HydrophobicContact CE1-CB 3.92Å; F467-V513 HydrophobicContact CE1-CG1 3.77Å; F467-V513 HydrophobicContact CE2-CB 3.54Å; F467-V513 HydrophobicContact CE2-CG1 4.01Å; F467-V513 HydrophobicContact CE2-CG2 3.63Å; F467-V513 HydrophobicContact CG-CB 4.4Å; F467-V513 HydrophobicContact CZ-CB 3.51Å; F467-V513 HydrophobicContact CZ-CG1 3.44Å; F467-V513 VanDerWaalsContact CZ-CG1 3.44Å; F467-V513 HydrophobicContact CZ-CG2 3.96Å; F467-V513 PolarHBondContact N-O 3.39Å; F467-V513 PolarHBondContact O-N 3.47Å; F467-F515 HydrophobicContact CD1-CD1 4.33Å; F467-F515 AromaticContact CD1-CE1 3.9Å; F467-F515 HydrophobicContact CD1-CE1 3.9Å; F467-F515 AromaticContact CE1-CD1 3.99Å; F467-F515 HydrophobicContact CE1-CD1 3.99Å; F467-F515 AromaticContact CE1-CE1 3.8Å; F467-F515 HydrophobicContact CE1-CE1 3.8Å; F467-V525 HydrophobicContact CE1-CG1 3.77Å; F467-V525 HydrophobicContact CZ-CG1 3.72Å; F467-V527 HydrophobicContact CE2-CG2 3.68Å; F467-V527 HydrophobicContact CZ-CG2 3.68Å
468	T	94.4	Very high	86.7	Confident	30 Å²	30	52.5 Å²	52.5	18%	0.184	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133	-177.6	-52.7	0	0	0	0	110	V451 H452 I470 Y511	V451-T468 WeakPolarHBondContact CA-O 3.42Å; V451-T468 WeakPolarHBondContact CG1-O 3.42Å; H452-T468 PolarHBondContact N-O 2.7Å; H452-T468 PolarHBondContact O-N 3.05Å; T468-I470 HydrophobicContact CG2-CG1 4.21Å; T468-Y511 CarbonylContact C-O 3.38Å; T468-Y511 VanDerWaalsContact CA-O 3.31Å; T468-Y511 WeakPolarHBondContact CA-O 3.17Å
469	V	94.7	Very high	87.4	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.8	169.2	-176.6	0	0	0	0	106.8	T449 V451 F467 S510 Y511 V513 V527 V529	T449-V469 HydrophobicContact CG2-CG1 3.51Å; V451-V469 HydrophobicContact CG1-CG2 4.04Å; V451-V469 HydrophobicContact CG2-CG1 4.4Å; V451-V469 HydrophobicContact CG2-CG2 4.22Å; F467-V469 HydrophobicContact CD2-CG2 4.29Å; F467-V469 HydrophobicContact CE2-CG2 3.97Å; V469-S510 CarbonylContact O-C 3.59Å; V469-S510 WeakPolarHBondContact O-CA 3.47Å; V469-Y511 PolarHBondContact N-O 2.91Å; V469-Y511 PolarHBondContact O-N 3.45Å; V469-V513 HydrophobicContact CG2-CG2 3.87Å; V469-V527 HydrophobicContact CG2-CG1 3.74Å; V469-V529 HydrophobicContact CG1-CG2 4.44Å
470	I	92.8	Very high	87.4	Confident	40 Å²	40	53 Å²	53	21%	0.205	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	115.6	173.6	-60.3	-174.1	0	0	0	107.6	T449 K450 H452 T468 Y472	T449-I470 WeakPolarHBondContact CG2-O 3.48Å; K450-I470 PolarHBondContact N-O 2.91Å; K450-I470 VanDerWaalsContact N-O 3.12Å; K450-I470 PolarHBondContact O-N 2.84Å; H452-I470 WeakPolarHBondContact NE2-CD1 3.25Å; T468-I470 HydrophobicContact CG2-CG1 4.21Å; I470-Y472 HydrophobicContact CB-CE2 3.94Å; I470-Y472 HydrophobicContact CG2-CD2 4.11Å; I470-Y472 HydrophobicContact CG2-CE2 3.53Å; I470-Y472 VanDerWaalsContact O-CD2 3.24Å; I470-Y472 WeakPolarHBondContact O-CD2 3.46Å
471	G	90.4	Very high	87.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.312	C	S	.	.			trans	-67.3	134.2	174	0	0	0	0	0	110.9	C479 G509	G471-C479 PolarHBondContact O-N 2.85Å; G471-G509 PolarHBondContact N-O 3.34Å
472	Y	89.1	Confident	87.3	Confident	44 Å²	44	53 Å²	53	17%	0.173	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-124.1	140.9	171.8	-75.6	-94.7	0	0	0	108.5	F445 K450 I470 G476 E477 P478	F445-Y472 PolarHBondContact N-O 2.6Å; K450-Y472 HydrophobicContact CB-CD2 4.42Å; K450-Y472 HydrophobicContact CB-CE2 3.97Å; K450-Y472 HydrophobicContact CD-CE2 3.89Å; K450-Y472 HydrophobicContact CG-CD2 4.25Å; K450-Y472 HydrophobicContact CG-CE2 3.94Å; I470-Y472 HydrophobicContact CB-CE2 3.94Å; I470-Y472 HydrophobicContact CG2-CD2 4.11Å; I470-Y472 HydrophobicContact CG2-CE2 3.53Å; I470-Y472 VanDerWaalsContact O-CD2 3.24Å; I470-Y472 WeakPolarHBondContact O-CD2 3.46Å; Y472-G476 WeakPolarHBondContact CD1-O 3.4Å; Y472-E477 CarbonylContact C-O 3.55Å; Y472-E477 VanDerWaalsContact CA-O 3.26Å; Y472-E477 WeakPolarHBondContact CA-O 3.4Å; Y472-P478 HydrophobicContact CD1-CB 4.43Å; Y472-P478 HydrophobicContact CE1-CB 4.16Å
473	D	87.9	Confident	87.5	Confident	29 Å²	29	53.6 Å²	53.6	16%	0.155	32%	0.32	C	S	.	.			trans	-78.6	-175.9	176.9	67.1	19.7	0	0	0	112.2	V448 D475 G476 E477	V448-D473 VanDerWaalsContact CG2-O 3.23Å; V448-D473 WeakPolarHBondContact CG2-O 3.36Å; D473-D475 PolarHBondContact O-N 2.92Å; D473-D475 WeakPolarHBondContact OD1-CA 3.29Å; D473-D475 PolarHBondContact OD1-N 2.82Å; D473-G476 PolarHBondContact O-N 3.49Å; D473-G476 VanDerWaalsContact O-N 3.1Å; D473-G476 PolarHBondContact OD1-N 2.89Å; D473-G476 VanDerWaalsContact OD1-N 3.1Å; D473-E477 PolarHBondContact N-O 3.2Å; D473-E477 PolarHBondContact OD1-N 2.79Å
474	H	85.4	Confident	87.8	Confident	123 Å²	123	51.2 Å²	51.2	57%	0.569	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.5	-179.6	-79.8	-75.9	0	0	0	114.5	F445 G476	F445-H474 AromaticContact CD1-CE1 3.93Å; F445-H474 AromaticContact CD1-ND1 3.53Å; F445-H474 AromaticContact CD2-CE1 3.18Å; F445-H474 WeakPolarHBondContact CD2-CE1 3.49Å; F445-H474 AromaticContact CD2-ND1 3.68Å; F445-H474 AromaticContact CD2-NE2 3.78Å; F445-H474 AromaticContact CE1-ND1 3.73Å; F445-H474 AromaticContact CE2-CE1 3.35Å; F445-H474 WeakPolarHBondContact CE2-CE1 3.47Å; F445-H474 AromaticContact CE2-ND1 3.87Å; F445-H474 AromaticContact CG-CE1 3.51Å; F445-H474 AromaticContact CG-ND1 3.53Å; F445-H474 AromaticContact CZ-CE1 3.8Å; F445-H474 AromaticContact CZ-ND1 3.89Å; H474-G476 VanDerWaalsContact C-N 3.31Å
475	D	82.6	Confident	87.9	Confident	146 Å²	146	50 Å²	50	78%	0.781	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.9	179	-64.9	-39.7	0	0	0	111.7	D473	D473-D475 PolarHBondContact O-N 2.92Å; D473-D475 WeakPolarHBondContact OD1-CA 3.29Å; D473-D475 PolarHBondContact OD1-N 2.82Å
476	G	81.5	Confident	88.1	Confident	34 Å²	34	50.3 Å²	50.3	35%	0.351	30%	0.302	S	S	.	.	S	Bend	trans	81	18.5	-178.3	0	0	0	0	0	113.1	Y472 D473 H474	Y472-G476 WeakPolarHBondContact CD1-O 3.4Å; D473-G476 PolarHBondContact O-N 3.49Å; D473-G476 VanDerWaalsContact O-N 3.1Å; D473-G476 PolarHBondContact OD1-N 2.89Å; D473-G476 VanDerWaalsContact OD1-N 3.1Å; H474-G476 VanDerWaalsContact C-N 3.31Å
477	E	84.6	Confident	88.2	Confident	121 Å²	121	50.1 Å²	50.1	57%	0.565	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-90.9	145.8	173.2	-67.1	-59.7	141.5	0	0	110.5	Y472 D473 C479	Y472-E477 CarbonylContact C-O 3.55Å; Y472-E477 VanDerWaalsContact CA-O 3.26Å; Y472-E477 WeakPolarHBondContact CA-O 3.4Å; D473-E477 PolarHBondContact N-O 3.2Å; D473-E477 PolarHBondContact OD1-N 2.79Å; E477-C479 PolarHBondContact O-N 3.49Å
478	P	86.3	Confident	88.2	Confident	55 Å²	55	50.9 Å²	50.9	36%	0.357	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-67.7	131.3	-178.6	27.6	-33	0	0	0	110.6	Y472 L480	Y472-P478 HydrophobicContact CD1-CB 4.43Å; Y472-P478 HydrophobicContact CE1-CB 4.16Å; P478-L480 PolarHBondContact O-N 2.9Å
479	C	87.6	Confident	88.1	Confident	8 Å²	8	53.7 Å²	53.7	5%	0.054	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-59.8	135.7	172.3	-66	0	0	0	0	109.4	G471 E477 N508 G509	G471-C479 PolarHBondContact O-N 2.85Å; E477-C479 PolarHBondContact O-N 3.49Å; C479-N508 VanDerWaalsContact O-O 3.06Å; C479-G509 WeakPolarHBondContact O-CA 3.41Å
480	L	83.4	Confident	88.1	Confident	107 Å²	107	53.7 Å²	53.7	56%	0.56	32%	0.32	S	S	*	.	S	Bend	trans	-102.1	-5	-177.6	-62.6	175.7	0	0	0	112.9	L439 P478	L439-L480 HydrophobicContact CD1-CD1 3.78Å; L439-L480 HydrophobicContact CD2-CB 3.74Å; L439-L480 HydrophobicContact CD2-CD1 3.59Å; L439-L480 HydrophobicContact CD2-CG 4.3Å; L439-L480 HydrophobicContact CG-CD1 4.29Å; P478-L480 PolarHBondContact O-N 2.9Å
481	S	82.8	Confident	88.1	Confident	40 Å²	40	55.5 Å²	55.5	28%	0.28	33%	0.328	S	S	.	.	S	Bend	trans	-128.9	145.9	178.7	55.1	0	0	0	0	110.1	S441 G509	S441-S481 WeakPolarHBondContact CB-OG 3.47Å; S441-S481 PolarHBondContact OG-OG 2.76Å; S481-G509 VanDerWaalsContact C-N 3.31Å; S481-G509 VanDerWaalsContact O-CA 3.31Å; S481-G509 WeakPolarHBondContact O-CA 3.38Å; S481-G509 PolarHBondContact O-N 3.14Å
482	G	84	Confident	88.1	Confident	24 Å²	24	55.5 Å²	55.5	25%	0.247	33%	0.328	C	S	.	.			trans	-81	-162.4	171	0	0	0	0	0	113.2	D505 Q507 Y511	G482-D505 WeakPolarHBondContact CA-OD1 3.45Å; G482-Q507 PolarHBondContact N-O 2.91Å; G482-Y511 WeakPolarHBondContact CA-OH 3.43Å
483	G	84.3	Confident	88.1	Confident	65 Å²	65	57.2 Å²	57.2	67%	0.67	34%	0.343	S	S	*	.			trans	98.6	1.8	177.5	0	0	0	0	0	115.3	D505 Y511	G483-D505 PolarHBondContact N-OD2 3.45Å; G483-Y511 PolarHBondContact N-OH 3.01Å
484	D	88.5	Confident	87.8	Confident	23 Å²	23	60.6 Å²	60.6	12%	0.123	37%	0.365	C	S	.	.			trans	-69	148.7	174.2	-53.7	-63.7	0	0	0	110.8	S443 A444 V486 Y511 V529	S443-D484 VanDerWaalsContact CA-OD1 3.23Å; S443-D484 WeakPolarHBondContact CA-OD1 3.35Å; S443-D484 VanDerWaalsContact CB-OD1 3.24Å; S443-D484 WeakPolarHBondContact CB-OD1 3.47Å; A444-D484 HydrophobicContact CB-CB 4.37Å; A444-D484 WeakPolarHBondContact CB-OD2 3.47Å; A444-D484 PolarHBondContact N-OD1 2.77Å; D484-V486 VanDerWaalsContact C-N 3.31Å; D484-V486 HydrophobicContact CB-CG2 4.08Å; D484-V486 PolarHBondContact O-N 2.78Å; D484-Y511 HydrophobicContact CB-CE2 4.32Å; D484-Y511 WeakPolarHBondContact CB-OH 3.3Å; D484-Y511 PolarHBondContact N-OH 3.34Å; D484-Y511 PolarHBondContact OD2-OH 3.16Å; D484-V529 HydrophobicContact CB-CG1 4.47Å
485	T	89.6	Confident	87.7	Confident	86 Å²	86	59 Å²	59	53%	0.528	36%	0.361	S	S	.	.			trans	-78.4	83.4	174.4	23.1	0	0	0	0	109.8	C530	T485-C530 PolarHBondContact O-N 2.89Å
486	V	93.4	Very high	87.7	Confident	19 Å²	19	54 Å²	54	12%	0.115	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.9	176.4	-172.7	0	0	0	0	110.2	D484 V503 Y511 L528 V529	D484-V486 VanDerWaalsContact C-N 3.31Å; D484-V486 HydrophobicContact CB-CG2 4.08Å; D484-V486 PolarHBondContact O-N 2.78Å; V486-V503 HydrophobicContact CB-CG1 4.11Å; V486-V503 HydrophobicContact CG1-CG1 4.06Å; V486-Y511 HydrophobicContact CB-CD1 4.11Å; V486-Y511 HydrophobicContact CB-CE1 4.48Å; V486-Y511 HydrophobicContact CB-CG 4.19Å; V486-Y511 HydrophobicContact CG1-CG 4.4Å; V486-Y511 HydrophobicContact CG2-CD1 3.64Å; V486-Y511 HydrophobicContact CG2-CD2 3.63Å; V486-Y511 HydrophobicContact CG2-CE1 3.68Å; V486-Y511 HydrophobicContact CG2-CE2 3.66Å; V486-Y511 HydrophobicContact CG2-CG 3.64Å; V486-L528 WeakPolarHBondContact CA-O 3.26Å; V486-V529 HydrophobicContact CG1-CG2 4.36Å; V486-V529 HydrophobicContact CG2-CG2 4.03Å
487	S	93.8	Very high	88	Confident	55 Å²	55	54.3 Å²	54.3	39%	0.385	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.5	173.2	65.4	0	0	0	0	110.7	L528	S487-L528 PolarHBondContact N-O 3.05Å; S487-L528 PolarHBondContact O-N 3.04Å
488	A	94.6	Very high	88.1	Confident	18 Å²	18	53.4 Å²	53.4	15%	0.149	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.6	176.5	0	0	0	0	0	110.8	V501 V513 S526 V527	A488-V501 HydrophobicContact CB-CG1 3.87Å; A488-V513 HydrophobicContact CB-CG1 3.71Å; A488-V513 HydrophobicContact CB-CG2 4.41Å; A488-S526 CarbonylContact C-O 3.57Å; A488-S526 WeakPolarHBondContact CA-O 3.13Å; A488-S526 WeakPolarHBondContact CB-O 3.46Å; A488-V527 HydrophobicContact CB-CG2 4.29Å
489	M	93.9	Very high	88.1	Confident	90 Å²	90	51.4 Å²	51.4	44%	0.443	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.7	-179.5	-177.2	-177	-67.3	0	0	108.7	M491 L498 V525 S526	M489-M491 HydrophobicContact SD-CE 4.23Å; M489-L498 HydrophobicContact CG-CD2 3.67Å; M489-L498 HydrophobicContact SD-CD2 3.84Å; M489-V525 CarbonylContact O-C 3.32Å; M489-V525 WeakPolarHBondContact O-CA 3.4Å; M489-S526 PolarHBondContact N-O 3.06Å; M489-S526 PolarHBondContact O-N 2.79Å
490	V	93.1	Very high	88.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.9	179.3	178.4	0	0	0	0	108	L498 S499 V501 F515 H523 L524 V525	V490-L498 WeakPolarHBondContact O-CA 3.04Å; V490-S499 PolarHBondContact O-N 2.58Å; V490-V501 HydrophobicContact CB-CG2 4.22Å; V490-V501 HydrophobicContact CG2-CG2 3.71Å; V490-F515 HydrophobicContact CB-CD2 4.35Å; V490-F515 HydrophobicContact CG1-CD2 3.9Å; V490-F515 HydrophobicContact CG1-CE2 4.03Å; V490-F515 HydrophobicContact CG2-CB 4.01Å; V490-F515 HydrophobicContact CG2-CD1 4.18Å; V490-F515 HydrophobicContact CG2-CD2 3.92Å; V490-F515 HydrophobicContact CG2-CE2 4.39Å; V490-F515 HydrophobicContact CG2-CG 3.79Å; V490-H523 HydrophobicContact CG1-CB 4.37Å; V490-L524 WeakPolarHBondContact CA-O 3.4Å; V490-V525 HydrophobicContact CG1-CG2 4.18Å; V490-V525 HydrophobicContact CG2-CB 4.46Å; V490-V525 HydrophobicContact CG2-CG1 4.08Å; V490-V525 HydrophobicContact CG2-CG2 3.98Å
491	M	92.9	Very high	88.6	Confident	78 Å²	78	51.6 Å²	51.6	38%	0.384	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.5	-176.3	-172.7	-177.2	-68.7	0	0	110.7	M489 S497 L498 H523 L524	M489-M491 HydrophobicContact SD-CE 4.23Å; M491-S497 CarbonylContact C-O 3.55Å; M491-S497 WeakPolarHBondContact CA-O 3.38Å; M491-L498 HydrophobicContact CB-CD2 3.91Å; M491-L498 HydrophobicContact CE-CD2 3.78Å; M491-L498 HydrophobicContact CG-CD2 4.1Å; M491-H523 CarbonylContact O-C 3.42Å; M491-H523 VanDerWaalsContact O-CA 3.22Å; M491-H523 WeakPolarHBondContact O-CA 3.23Å; M491-L524 PolarHBondContact N-O 3.02Å; M491-L524 PolarHBondContact O-N 2.81Å
492	S	90.3	Very high	89.2	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	132	170.3	164.2	0	0	0	0	110.4	T494 D495 G496 S497	S492-T494 VanDerWaalsContact C-N 3.29Å; S492-T494 PolarHBondContact OG-N 3.28Å; S492-T494 PolarHBondContact OG-OG1 3.41Å; S492-D495 WeakPolarHBondContact CB-OD1 3.32Å; S492-D495 PolarHBondContact OG-OD1 3.31Å; S492-G496 WeakPolarHBondContact O-CA 3.36Å; S492-G496 PolarHBondContact O-N 2.7Å; S492-S497 WeakPolarHBondContact CB-OG 3.26Å; S492-S497 PolarHBondContact N-O 2.71Å
493	V	88.9	Confident	89.7	Confident	80 Å²	80	57.3 Å²	57.3	49%	0.485	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-23.5	179.8	179.5	0	0	0	0	111.7	E522 L524	V493-E522 HydrophobicContact CB-CB 4.33Å; V493-E522 WeakPolarHBondContact CB-O 3.39Å; V493-E522 HydrophobicContact CG2-CB 4.14Å; V493-E522 WeakPolarHBondContact CG2-O 3.29Å; V493-E522 PolarHBondContact N-O 2.9Å; V493-L524 HydrophobicContact CG2-CD1 4.18Å; V493-L524 HydrophobicContact CG2-CG 3.81Å
494	T	81.4	Confident	90.2	Very high	100 Å²	100	57.2 Å²	57.2	61%	0.613	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-36.8	-173.3	53.4	0	0	0	0	113	S492	S492-T494 VanDerWaalsContact C-N 3.29Å; S492-T494 PolarHBondContact OG-N 3.28Å; S492-T494 PolarHBondContact OG-OG1 3.41Å
495	D	84.1	Confident	90.4	Very high	89 Å²	89	58.9 Å²	58.9	48%	0.476	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-2.5	-174.5	73.4	-24.4	0	0	0	114.1	S492 S497 M519	S492-D495 WeakPolarHBondContact CB-OD1 3.32Å; S492-D495 PolarHBondContact OG-OD1 3.31Å; D495-S497 VanDerWaalsContact CG-OG 3.26Å; D495-S497 PolarHBondContact O-N 3.16Å; D495-S497 WeakPolarHBondContact OD1-CB 3.49Å; D495-S497 PolarHBondContact OD1-N 3.21Å; D495-S497 PolarHBondContact OD1-OG 2.88Å; D495-S497 WeakPolarHBondContact OD2-CB 3.41Å; D495-S497 PolarHBondContact OD2-OG 2.83Å; D495-M519 HydrophobicContact CB-CE 3.9Å; D495-M519 WeakPolarHBondContact OD1-CE 3.32Å; D495-M519 WeakPolarHBondContact OD2-CE 3.36Å
496	G	83.6	Confident	90.4	Very high	41 Å²	41	61.5 Å²	61.5	42%	0.423	35%	0.354	S	S	.	.			trans	72.5	8.7	-177.2	0	0	0	0	0	114.6	S492	S492-G496 WeakPolarHBondContact O-CA 3.36Å; S492-G496 PolarHBondContact O-N 2.7Å
497	S	85.9	Confident	90.2	Very high	40 Å²	40	68.1 Å²	68.1	28%	0.28	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-67.5	141.4	-178	61.6	0	0	0	0	112.3	M491 S492 D495	M491-S497 CarbonylContact C-O 3.55Å; M491-S497 WeakPolarHBondContact CA-O 3.38Å; S492-S497 WeakPolarHBondContact CB-OG 3.26Å; S492-S497 PolarHBondContact N-O 2.71Å; D495-S497 VanDerWaalsContact CG-OG 3.26Å; D495-S497 PolarHBondContact O-N 3.16Å; D495-S497 WeakPolarHBondContact OD1-CB 3.49Å; D495-S497 PolarHBondContact OD1-N 3.21Å; D495-S497 PolarHBondContact OD1-OG 2.88Å; D495-S497 WeakPolarHBondContact OD2-CB 3.41Å; D495-S497 PolarHBondContact OD2-OG 2.83Å
498	L	88.2	Confident	89.8	Confident	103 Å²	103	69.5 Å²	69.5	54%	0.539	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.2	178.8	-65.8	176.4	0	0	0	111	M489 V490 M491	M489-L498 HydrophobicContact CG-CD2 3.67Å; M489-L498 HydrophobicContact SD-CD2 3.84Å; V490-L498 WeakPolarHBondContact O-CA 3.04Å; M491-L498 HydrophobicContact CB-CD2 3.91Å; M491-L498 HydrophobicContact CE-CD2 3.78Å; M491-L498 HydrophobicContact CG-CD2 4.1Å
499	S	86.8	Confident	89.4	Confident	13 Å²	13	68.7 Å²	68.7	9%	0.091	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	146.7	170.6	-58.2	0	0	0	0	110.7	V490 V501	V490-S499 PolarHBondContact O-N 2.58Å; S499-V501 PolarHBondContact O-N 2.91Å
500	A	86.9	Confident	89.4	Confident	74 Å²	74	65 Å²	65	61%	0.612	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-66.6	133.7	173.2	0	0	0	0	0	109.6	F515 L516	A500-F515 WeakPolarHBondContact O-CA 3.26Å; A500-F515 WeakPolarHBondContact O-CB 3.47Å; A500-L516 PolarHBondContact O-N 3.48Å
501	V	93.8	Very high	89.4	Confident	44 Å²	44	65.2 Å²	65.2	27%	0.267	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.7	-178.9	-174.9	0	0	0	0	109	A488 V490 S499 V503 V513 C514 F515	A488-V501 HydrophobicContact CB-CG1 3.87Å; V490-V501 HydrophobicContact CB-CG2 4.22Å; V490-V501 HydrophobicContact CG2-CG2 3.71Å; S499-V501 PolarHBondContact O-N 2.91Å; V501-V503 HydrophobicContact CG1-CG2 4.38Å; V501-V513 HydrophobicContact CG1-CG1 3.45Å; V501-V513 VanDerWaalsContact CG1-CG1 3.45Å; V501-C514 CarbonylContact C-O 3.57Å; V501-C514 WeakPolarHBondContact CA-O 3.33Å; V501-F515 HydrophobicContact CG2-CB 4.04Å
502	E	95.2	Very high	89.5	Confident	131 Å²	131	62.3 Å²	62.3	61%	0.612	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.7	172.9	-173.7	179.4	177.2	0	0	108.7	V513 C514	E502-V513 CarbonylContact O-C 3.54Å; E502-V513 WeakPolarHBondContact O-CA 3.49Å; E502-C514 HydrophobicContact CB-CB 4.46Å; E502-C514 PolarHBondContact N-O 3.33Å; E502-C514 PolarHBondContact O-N 3.36Å
503	V	95.3	Very high	89.8	Confident	53 Å²	53	62.2 Å²	62.2	32%	0.321	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120	176.9	-175.6	0	0	0	0	108.4	V486 V501 T512 V513	V486-V503 HydrophobicContact CB-CG1 4.11Å; V486-V503 HydrophobicContact CG1-CG1 4.06Å; V501-V503 HydrophobicContact CG1-CG2 4.38Å; V503-T512 WeakPolarHBondContact CA-O 3.22Å; V503-V513 HydrophobicContact CG1-CG2 4.44Å; V503-V513 HydrophobicContact CG2-CG1 4.49Å; V503-V513 HydrophobicContact CG2-CG2 4.25Å
504	T	94.8	Very high	90	Very high	63 Å²	63	60.4 Å²	60.4	39%	0.387	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119	178.5	-44.2	0	0	0	0	109.9	Y511 T512	T504-Y511 CarbonylContact O-C 3.55Å; T504-Y511 WeakPolarHBondContact O-CA 3.39Å; T504-T512 PolarHBondContact N-O 3.03Å; T504-T512 PolarHBondContact O-N 3.01Å
505	D	92.6	Very high	90.5	Very high	58 Å²	58	55.9 Å²	55.9	31%	0.31	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.6	172.4	-174.8	-3.7	0	0	0	110.5	G482 G483 Q507 Y511	G482-D505 WeakPolarHBondContact CA-OD1 3.45Å; G483-D505 PolarHBondContact N-OD2 3.45Å; D505-Q507 VanDerWaalsContact C-N 3.31Å; D505-Q507 WeakPolarHBondContact OD1-CA 3.13Å; D505-Q507 PolarHBondContact OD1-N 2.93Å; D505-Y511 HydrophobicContact CB-CD1 3.88Å; D505-Y511 HydrophobicContact CB-CE1 3.84Å; D505-Y511 VanDerWaalsContact CG-CE1 3.44Å
506	R	89.8	Confident	90.8	Very high	141 Å²	141	55 Å²	55	53%	0.532	31%	0.307	S	S	.	.			trans	-88.7	3.1	176.8	-60.6	-170.4	176.8	-160.1	5.1	113.6	N508 S510 T512	R506-N508 WeakPolarHBondContact CB-OD1 3.45Å; R506-N508 PolarHBondContact O-N 3.36Å; R506-N508 VanDerWaalsContact O-N 3.15Å; R506-S510 VanDerWaalsContact CB-O 3.31Å; R506-S510 WeakPolarHBondContact CB-O 3.25Å; R506-S510 WeakPolarHBondContact CD-OG 3.42Å; R506-S510 PolarHBondContact N-O 2.93Å; R506-T512 VanDerWaalsContact CZ-OG1 3.29Å; R506-T512 PolarHBondContact NE-OG1 3.34Å; R506-T512 PolarHBondContact NH2-OG1 2.98Å
507	Q	87.9	Confident	91	Very high	159 Å²	159	53 Å²	53	74%	0.743	29%	0.287	S	S	*	.	S	Bend	trans	62	15.6	178.9	-55.4	-178.7	3.7	0	0	114.8	G482 D505	G482-Q507 PolarHBondContact N-O 2.91Å; D505-Q507 VanDerWaalsContact C-N 3.31Å; D505-Q507 WeakPolarHBondContact OD1-CA 3.13Å; D505-Q507 PolarHBondContact OD1-N 2.93Å
508	N	86.8	Confident	90.9	Very high	83 Å²	83	58.4 Å²	58.4	44%	0.444	31%	0.305	S	S	.	.	S	Bend	trans	-127.6	23	-177.6	70.7	-10.2	0	0	0	112.3	C479 R506 S510	C479-N508 VanDerWaalsContact O-O 3.06Å; R506-N508 WeakPolarHBondContact CB-OD1 3.45Å; R506-N508 PolarHBondContact O-N 3.36Å; R506-N508 VanDerWaalsContact O-N 3.15Å; N508-S510 VanDerWaalsContact C-N 3.28Å; N508-S510 PolarHBondContact O-N 2.94Å; N508-S510 WeakPolarHBondContact OD1-CB 3.42Å; N508-S510 PolarHBondContact OD1-N 3.27Å; N508-S510 VanDerWaalsContact OD1-N 3.12Å; N508-S510 PolarHBondContact OD1-OG 2.98Å
509	G	85.8	Confident	90.7	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.01	30%	0.295	C	S	.	.	S	Bend	trans	78.3	3.8	-175.4	0	0	0	0	0	115.2	G471 C479 S481	G471-G509 PolarHBondContact N-O 3.34Å; C479-G509 WeakPolarHBondContact O-CA 3.41Å; S481-G509 VanDerWaalsContact C-N 3.31Å; S481-G509 VanDerWaalsContact O-CA 3.31Å; S481-G509 WeakPolarHBondContact O-CA 3.38Å; S481-G509 PolarHBondContact O-N 3.14Å
510	S	92.7	Very high	90.7	Very high	14 Å²	14	61.3 Å²	61.3	10%	0.098	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.1	172.6	73.8	0	0	0	0	112.6	V469 R506 N508	V469-S510 CarbonylContact O-C 3.59Å; V469-S510 WeakPolarHBondContact O-CA 3.47Å; R506-S510 VanDerWaalsContact CB-O 3.31Å; R506-S510 WeakPolarHBondContact CB-O 3.25Å; R506-S510 WeakPolarHBondContact CD-OG 3.42Å; R506-S510 PolarHBondContact N-O 2.93Å; N508-S510 VanDerWaalsContact C-N 3.28Å; N508-S510 PolarHBondContact O-N 2.94Å; N508-S510 WeakPolarHBondContact OD1-CB 3.42Å; N508-S510 PolarHBondContact OD1-N 3.27Å; N508-S510 VanDerWaalsContact OD1-N 3.12Å; N508-S510 PolarHBondContact OD1-OG 2.98Å
511	Y	94.6	Very high	90.7	Very high	4 Å²	4	59 Å²	59	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134.9	-176.7	-52.6	-96.1	0	0	0	109.3	T468 V469 G482 G483 D484 V486 T504 D505	T468-Y511 CarbonylContact C-O 3.38Å; T468-Y511 VanDerWaalsContact CA-O 3.31Å; T468-Y511 WeakPolarHBondContact CA-O 3.17Å; V469-Y511 PolarHBondContact N-O 2.91Å; V469-Y511 PolarHBondContact O-N 3.45Å; G482-Y511 WeakPolarHBondContact CA-OH 3.43Å; G483-Y511 PolarHBondContact N-OH 3.01Å; D484-Y511 HydrophobicContact CB-CE2 4.32Å; D484-Y511 WeakPolarHBondContact CB-OH 3.3Å; D484-Y511 PolarHBondContact N-OH 3.34Å; D484-Y511 PolarHBondContact OD2-OH 3.16Å; V486-Y511 HydrophobicContact CB-CD1 4.11Å; V486-Y511 HydrophobicContact CB-CE1 4.48Å; V486-Y511 HydrophobicContact CB-CG 4.19Å; V486-Y511 HydrophobicContact CG1-CG 4.4Å; V486-Y511 HydrophobicContact CG2-CD1 3.64Å; V486-Y511 HydrophobicContact CG2-CD2 3.63Å; V486-Y511 HydrophobicContact CG2-CE1 3.68Å; V486-Y511 HydrophobicContact CG2-CE2 3.66Å; V486-Y511 HydrophobicContact CG2-CG 3.64Å; T504-Y511 CarbonylContact O-C 3.55Å; T504-Y511 WeakPolarHBondContact O-CA 3.39Å; D505-Y511 HydrophobicContact CB-CD1 3.88Å; D505-Y511 HydrophobicContact CB-CE1 3.84Å; D505-Y511 VanDerWaalsContact CG-CE1 3.44Å
512	T	94.8	Very high	90.5	Very high	16 Å²	16	61.9 Å²	61.9	10%	0.098	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.8	172.4	-56.6	0	0	0	0	108.9	V503 T504 R506	V503-T512 WeakPolarHBondContact CA-O 3.22Å; T504-T512 PolarHBondContact N-O 3.03Å; T504-T512 PolarHBondContact O-N 3.01Å; R506-T512 VanDerWaalsContact CZ-OG1 3.29Å; R506-T512 PolarHBondContact NE-OG1 3.34Å; R506-T512 PolarHBondContact NH2-OG1 2.98Å
513	V	95.3	Very high	90.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.4	174.1	-176.6	0	0	0	0	107.6	S466 F467 V469 A488 V501 E502 V503	S466-V513 CarbonylContact C-O 3.55Å; S466-V513 WeakPolarHBondContact CA-O 3.36Å; S466-V513 WeakPolarHBondContact CB-O 3.38Å; F467-V513 HydrophobicContact CD1-CB 4.36Å; F467-V513 HydrophobicContact CD2-CB 3.99Å; F467-V513 HydrophobicContact CD2-CG2 4.27Å; F467-V513 HydrophobicContact CE1-CB 3.92Å; F467-V513 HydrophobicContact CE1-CG1 3.77Å; F467-V513 HydrophobicContact CE2-CB 3.54Å; F467-V513 HydrophobicContact CE2-CG1 4.01Å; F467-V513 HydrophobicContact CE2-CG2 3.63Å; F467-V513 HydrophobicContact CG-CB 4.4Å; F467-V513 HydrophobicContact CZ-CB 3.51Å; F467-V513 HydrophobicContact CZ-CG1 3.44Å; F467-V513 VanDerWaalsContact CZ-CG1 3.44Å; F467-V513 HydrophobicContact CZ-CG2 3.96Å; F467-V513 PolarHBondContact N-O 3.39Å; F467-V513 PolarHBondContact O-N 3.47Å; V469-V513 HydrophobicContact CG2-CG2 3.87Å; A488-V513 HydrophobicContact CB-CG1 3.71Å; A488-V513 HydrophobicContact CB-CG2 4.41Å; V501-V513 HydrophobicContact CG1-CG1 3.45Å; V501-V513 VanDerWaalsContact CG1-CG1 3.45Å; E502-V513 CarbonylContact O-C 3.54Å; E502-V513 WeakPolarHBondContact O-CA 3.49Å; V503-V513 HydrophobicContact CG1-CG2 4.44Å; V503-V513 HydrophobicContact CG2-CG1 4.49Å; V503-V513 HydrophobicContact CG2-CG2 4.25Å
514	C	93.1	Very high	90.3	Very high	41 Å²	41	56 Å²	56	28%	0.277	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.8	177.1	-69.1	0	0	0	0	109.4	A465 S466 V501 E502	A465-C514 CarbonylContact O-C 3.47Å; A465-C514 WeakPolarHBondContact O-CA 3.29Å; S466-C514 VanDerWaalsContact CB-SG 3.6Å; V501-C514 CarbonylContact C-O 3.57Å; V501-C514 WeakPolarHBondContact CA-O 3.33Å; E502-C514 HydrophobicContact CB-CB 4.46Å; E502-C514 PolarHBondContact N-O 3.33Å; E502-C514 PolarHBondContact O-N 3.36Å
515	F	92.8	Very high	90.3	Very high	5 Å²	5	53 Å²	53	2%	0.022	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	156.6	175.9	69.4	-85.6	0	0	0	111.6	G455 V459 P464 A465 F467 V490 A500 V501 P517	G455-F515 WeakPolarHBondContact O-CE1 3.2Å; G455-F515 WeakPolarHBondContact O-CZ 3.34Å; V459-F515 HydrophobicContact CG1-CE2 4.44Å; V459-F515 HydrophobicContact CG2-CZ 4.07Å; P464-F515 WeakPolarHBondContact CA-O 3.35Å; A465-F515 HydrophobicContact CB-CD1 4.38Å; A465-F515 HydrophobicContact CB-CE1 3.9Å; A465-F515 HydrophobicContact CB-CE2 4.21Å; A465-F515 HydrophobicContact CB-CZ 3.83Å; A465-F515 PolarHBondContact N-O 2.9Å; A465-F515 PolarHBondContact O-N 3.08Å; F467-F515 HydrophobicContact CD1-CD1 4.33Å; F467-F515 AromaticContact CD1-CE1 3.9Å; F467-F515 HydrophobicContact CD1-CE1 3.9Å; F467-F515 AromaticContact CE1-CD1 3.99Å; F467-F515 HydrophobicContact CE1-CD1 3.99Å; F467-F515 AromaticContact CE1-CE1 3.8Å; F467-F515 HydrophobicContact CE1-CE1 3.8Å; V490-F515 HydrophobicContact CB-CD2 4.35Å; V490-F515 HydrophobicContact CG1-CD2 3.9Å; V490-F515 HydrophobicContact CG1-CE2 4.03Å; V490-F515 HydrophobicContact CG2-CB 4.01Å; V490-F515 HydrophobicContact CG2-CD1 4.18Å; V490-F515 HydrophobicContact CG2-CD2 3.92Å; V490-F515 HydrophobicContact CG2-CE2 4.39Å; V490-F515 HydrophobicContact CG2-CG 3.79Å; A500-F515 WeakPolarHBondContact O-CA 3.26Å; A500-F515 WeakPolarHBondContact O-CB 3.47Å; V501-F515 HydrophobicContact CG2-CB 4.04Å; F515-P517 HydrophobicContact CD2-CB 4.49Å; F515-P517 HydrophobicContact CD2-CG 4.36Å; F515-P517 HydrophobicContact CE2-CB 4.34Å; F515-P517 HydrophobicContact CE2-CG 4.09Å
516	L	90.6	Very high	90.4	Very high	71 Å²	71	51.3 Å²	51.3	37%	0.372	26%	0.255	S	S	.	.			trans	-121.7	99.1	179.9	-177.9	66.2	0	0	0	109.9	G462 A500	G462-L516 VanDerWaalsContact C-CD1 3.46Å; A500-L516 PolarHBondContact O-N 3.48Å
517	P	87.4	Confident	90.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.			trans	-74.3	131.6	178.2	29.3	-30	0	0	0	110.3	V459 G462 K463 F515 V543	V459-P517 HydrophobicContact CG1-CG 3.47Å; V459-P517 VanDerWaalsContact CG1-CG 3.47Å; G462-P517 PolarHBondContact N-O 3.28Å; K463-P517 WeakPolarHBondContact O-CD 3.41Å; F515-P517 HydrophobicContact CD2-CB 4.49Å; F515-P517 HydrophobicContact CD2-CG 4.36Å; F515-P517 HydrophobicContact CE2-CB 4.34Å; F515-P517 HydrophobicContact CE2-CG 4.09Å; P517-V543 HydrophobicContact CB-CB 4.47Å; P517-V543 HydrophobicContact CB-CG1 3.93Å; P517-V543 HydrophobicContact CB-CG2 3.75Å; P517-V543 HydrophobicContact CG-CG1 3.91Å; P517-V543 HydrophobicContact CG-CG2 4.04Å
518	K	84.1	Confident	90.9	Very high	153 Å²	153	38.8 Å²	38.8	67%	0.665	20%	0.203	S	C	*	.			trans	-96.6	-16.8	-176.3	-65.3	-176.9	-179.4	175.8	0	113.7	C461	C461-K518 PolarHBondContact SG-O 2.9Å
519	M	83.8	Confident	91.2	Very high	63 Å²	63	34.8 Å²	34.8	31%	0.31	18%	0.182	S	C	.	.	S	Bend	trans	-126	155	-177.3	-61.7	-138	-49.8	0	0	111.3	D495 H523 V543	D495-M519 HydrophobicContact CB-CE 3.9Å; D495-M519 WeakPolarHBondContact OD1-CE 3.32Å; D495-M519 WeakPolarHBondContact OD2-CE 3.36Å; M519-H523 PolarHBondContact O-CE1 2.95Å; M519-V543 WeakPolarHBondContact O-CB 3.48Å; M519-V543 WeakPolarHBondContact O-CG1 3.27Å
520	E	86.8	Confident	91.2	Very high	114 Å²	114	37.2 Å²	37.2	53%	0.533	20%	0.198	S	C	.	.			trans	-82.2	160	170	64.5	-179.7	177.3	0	0	111.6	V543 S545	E520-V543 WeakPolarHBondContact CA-O 3.43Å; E520-S545 VanDerWaalsContact OE2-CB 3.22Å; E520-S545 WeakPolarHBondContact OE2-CB 3.24Å; E520-S545 PolarHBondContact OE2-OG 3.44Å
521	G	86.1	Confident	90.8	Very high	25 Å²	25	44 Å²	44	26%	0.258	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	110.4	-170.5	178.8	0	0	0	0	0	113.4	H523 V543	G521-H523 PolarHBondContact O-ND1 3.17Å; G521-V543 PolarHBondContact N-O 3.19Å; G521-V543 PolarHBondContact O-N 2.92Å
522	E	90.1	Very high	90.5	Very high	104 Å²	104	49 Å²	49	49%	0.486	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	133.4	-179.3	-63.7	-167.5	160.3	0	0	111.3	V493	V493-E522 HydrophobicContact CB-CB 4.33Å; V493-E522 WeakPolarHBondContact CB-O 3.39Å; V493-E522 HydrophobicContact CG2-CB 4.14Å; V493-E522 WeakPolarHBondContact CG2-O 3.29Å; V493-E522 PolarHBondContact N-O 2.9Å
523	H	92.4	Very high	90.4	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	145	175.4	-67.8	59.8	0	0	0	109.5	V490 M491 M519 G521 V541 V543	V490-H523 HydrophobicContact CG1-CB 4.37Å; M491-H523 CarbonylContact O-C 3.42Å; M491-H523 VanDerWaalsContact O-CA 3.22Å; M491-H523 WeakPolarHBondContact O-CA 3.23Å; M519-H523 PolarHBondContact O-CE1 2.95Å; G521-H523 PolarHBondContact O-ND1 3.17Å; H523-V541 PolarHBondContact N-O 3.02Å; H523-V541 PolarHBondContact O-N 3.2Å; H523-V543 HydrophobicContact CB-CG2 4.36Å; H523-V543 VanDerWaalsContact ND1-CG2 3.26Å; H523-V543 WeakPolarHBondContact ND1-CG2 3.38Å
524	L	93.3	Very high	90.3	Very high	59 Å²	59	52.7 Å²	52.7	31%	0.309	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.6	171	-68.1	174.8	0	0	0	109.5	V490 M491 V493 F539 K540	V490-L524 WeakPolarHBondContact CA-O 3.4Å; M491-L524 PolarHBondContact N-O 3.02Å; M491-L524 PolarHBondContact O-N 2.81Å; V493-L524 HydrophobicContact CG2-CD1 4.18Å; V493-L524 HydrophobicContact CG2-CG 3.81Å; L524-F539 CarbonylContact C-O 3.53Å; L524-F539 WeakPolarHBondContact CA-O 3.32Å; L524-K540 HydrophobicContact CD2-CG 3.81Å
525	V	94.8	Very high	90	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103.6	176.9	-177.6	0	0	0	0	108.8	L456 F467 M489 V490 V527 P538 F539 V541	L456-V525 HydrophobicContact CD2-CB 4.41Å; L456-V525 HydrophobicContact CD2-CG1 4.16Å; F467-V525 HydrophobicContact CE1-CG1 3.77Å; F467-V525 HydrophobicContact CZ-CG1 3.72Å; M489-V525 CarbonylContact O-C 3.32Å; M489-V525 WeakPolarHBondContact O-CA 3.4Å; V490-V525 HydrophobicContact CG1-CG2 4.18Å; V490-V525 HydrophobicContact CG2-CB 4.46Å; V490-V525 HydrophobicContact CG2-CG1 4.08Å; V490-V525 HydrophobicContact CG2-CG2 3.98Å; V525-V527 HydrophobicContact CG1-CG2 4.14Å; V525-P538 CarbonylContact O-C 3.57Å; V525-P538 WeakPolarHBondContact O-CA 3.37Å; V525-F539 HydrophobicContact CB-CB 4.32Å; V525-F539 PolarHBondContact N-O 3.19Å; V525-F539 WeakPolarHBondContact O-CD2 3.4Å; V525-F539 PolarHBondContact O-N 2.88Å; V525-V541 HydrophobicContact CB-CG2 4.31Å; V525-V541 HydrophobicContact CG2-CB 4.18Å; V525-V541 HydrophobicContact CG2-CG2 3.49Å; V525-V541 VanDerWaalsContact CG2-CG2 3.49Å
526	S	94.8	Very high	89.8	Confident	24 Å²	24	58.7 Å²	58.7	17%	0.168	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	129.9	172.8	-65.3	0	0	0	0	109.2	A488 M489 S537	A488-S526 CarbonylContact C-O 3.57Å; A488-S526 WeakPolarHBondContact CA-O 3.13Å; A488-S526 WeakPolarHBondContact CB-O 3.46Å; M489-S526 PolarHBondContact N-O 3.06Å; M489-S526 PolarHBondContact O-N 2.79Å; S526-S537 WeakPolarHBondContact CA-OG 3.31Å
527	V	95.8	Very high	89.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.5	176.7	-178.8	0	0	0	0	106.7	V451 F467 V469 A488 V525 V534 S537 F539	V451-V527 HydrophobicContact CG2-CG1 4.36Å; F467-V527 HydrophobicContact CE2-CG2 3.68Å; F467-V527 HydrophobicContact CZ-CG2 3.68Å; V469-V527 HydrophobicContact CG2-CG1 3.74Å; A488-V527 HydrophobicContact CB-CG2 4.29Å; V525-V527 HydrophobicContact CG1-CG2 4.14Å; V527-V534 HydrophobicContact CB-CG2 3.77Å; V527-V534 HydrophobicContact CG1-CG1 4.25Å; V527-V534 HydrophobicContact CG1-CG2 3.9Å; V527-V534 PolarHBondContact O-N 2.98Å; V527-V534 VanDerWaalsContact O-N 3.08Å; V527-S537 PolarHBondContact N-OG 3.05Å; V527-S537 PolarHBondContact O-OG 3.03Å; V527-F539 HydrophobicContact CB-CE2 4.33Å; V527-F539 HydrophobicContact CG2-CD2 4.23Å; V527-F539 HydrophobicContact CG2-CE2 3.99Å
528	L	93.3	Very high	90.2	Very high	36 Å²	36	59.2 Å²	59.2	19%	0.188	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138	-178.3	-55.3	96	0	0	0	110.2	V486 S487 Q532	V486-L528 WeakPolarHBondContact CA-O 3.26Å; S487-L528 PolarHBondContact N-O 3.05Å; S487-L528 PolarHBondContact O-N 3.04Å; L528-Q532 CarbonylContact C-O 3.59Å; L528-Q532 WeakPolarHBondContact CA-O 3.46Å
529	V	92.1	Very high	90.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.8	168.4	173.8	0	0	0	0	107	A444 A446 T449 V469 D484 V486 H531 Q532 V534	A444-V529 HydrophobicContact CB-CG1 3.83Å; A446-V529 HydrophobicContact CB-CB 4.04Å; T449-V529 HydrophobicContact CG2-CG2 4.1Å; V469-V529 HydrophobicContact CG1-CG2 4.44Å; D484-V529 HydrophobicContact CB-CG1 4.47Å; V486-V529 HydrophobicContact CG1-CG2 4.36Å; V486-V529 HydrophobicContact CG2-CG2 4.03Å; V529-H531 PolarHBondContact O-N 2.97Å; V529-Q532 PolarHBondContact N-O 2.89Å; V529-Q532 PolarHBondContact O-N 2.82Å; V529-V534 HydrophobicContact CB-CG1 4.02Å; V529-V534 HydrophobicContact CG2-CG1 3.51Å
530	C	86.1	Confident	91	Very high	51 Å²	51	58.2 Å²	58.2	35%	0.345	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	39.2	-174.5	-60.2	0	0	0	0	112.8	T485 Q532	T485-C530 PolarHBondContact O-N 2.89Å; C530-Q532 PolarHBondContact O-N 2.85Å
531	H	85.4	Confident	91.2	Very high	156 Å²	156	52.8 Å²	52.8	72%	0.722	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	15.6	-178	-45.9	85.3	0	0	0	115.6	V529	V529-H531 PolarHBondContact O-N 2.97Å
532	Q	87.9	Confident	91.3	Very high	111 Å²	111	54.5 Å²	54.5	52%	0.519	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.4	174.8	-64.4	-175.5	16.2	0	0	110.9	A446 L528 V529 C530 V534	A446-Q532 HydrophobicContact CB-CB 3.8Å; L528-Q532 CarbonylContact C-O 3.59Å; L528-Q532 WeakPolarHBondContact CA-O 3.46Å; V529-Q532 PolarHBondContact N-O 2.89Å; V529-Q532 PolarHBondContact O-N 2.82Å; C530-Q532 PolarHBondContact O-N 2.85Å; Q532-V534 PolarHBondContact O-N 3.4Å
533	H	92.4	Very high	91.2	Very high	89 Å²	89	49.7 Å²	49.7	41%	0.412	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	132.1	174.5	-82.2	-87.7	0	0	0	110.9	S537	H533-S537 WeakPolarHBondContact ND1-CB 3.43Å; H533-S537 PolarHBondContact ND1-OG 3.07Å
534	V	92.7	Very high	90.7	Very high	4 Å²	4	54 Å²	54	2%	0.024	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-73.1	167.1	171.1	-56.3	0	0	0	0	111.1	A446 T449 V451 V527 V529 Q532 G536 S537 F539	A446-V534 HydrophobicContact CB-CG1 4.44Å; A446-V534 VanDerWaalsContact O-CA 3.29Å; A446-V534 WeakPolarHBondContact O-CA 3.27Å; T449-V534 HydrophobicContact CG2-CB 4.26Å; T449-V534 HydrophobicContact CG2-CG1 3.74Å; V451-V534 HydrophobicContact CG2-CG2 3.53Å; V527-V534 HydrophobicContact CB-CG2 3.77Å; V527-V534 HydrophobicContact CG1-CG1 4.25Å; V527-V534 HydrophobicContact CG1-CG2 3.9Å; V527-V534 PolarHBondContact O-N 2.98Å; V527-V534 VanDerWaalsContact O-N 3.08Å; V529-V534 HydrophobicContact CB-CG1 4.02Å; V529-V534 HydrophobicContact CG2-CG1 3.51Å; Q532-V534 PolarHBondContact O-N 3.4Å; V534-G536 PolarHBondContact O-N 2.85Å; V534-S537 VanDerWaalsContact O-CB 3.29Å; V534-S537 WeakPolarHBondContact O-CB 3.35Å; V534-S537 PolarHBondContact O-N 3.43Å; V534-F539 HydrophobicContact CG2-CE2 4.23Å; V534-F539 HydrophobicContact CG2-CZ 4.35Å
535	Q	87.1	Confident	89.9	Confident	116 Å²	116	54.3 Å²	54.3	54%	0.542	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	125.4	178.1	-164.2	-179.2	16.6	0	0	111.9	A446 S537 F539	A446-Q535 PolarHBondContact O-N 2.83Å; Q535-S537 VanDerWaalsContact C-N 3.29Å; Q535-S537 PolarHBondContact O-N 2.84Å; Q535-F539 WeakPolarHBondContact O-CZ 3.4Å
536	G	88.8	Confident	88.8	Confident	55 Å²	55	60.5 Å²	60.5	57%	0.567	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-4.2	178.5	0	0	0	0	0	115.2	V534 P538 F539	V534-G536 PolarHBondContact O-N 2.85Å; G536-P538 CarbonylContact O-C 3.5Å; G536-F539 WeakPolarHBondContact O-CD1 3.31Å; G536-F539 WeakPolarHBondContact O-CE1 3.48Å
537	S	93	Very high	87.7	Confident	19 Å²	19	62.8 Å²	62.8	13%	0.133	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-79.1	142.2	173.3	-169.8	0	0	0	0	111.5	S526 V527 H533 V534 Q535	S526-S537 WeakPolarHBondContact CA-OG 3.31Å; V527-S537 PolarHBondContact N-OG 3.05Å; V527-S537 PolarHBondContact O-OG 3.03Å; H533-S537 WeakPolarHBondContact ND1-CB 3.43Å; H533-S537 PolarHBondContact ND1-OG 3.07Å; V534-S537 VanDerWaalsContact O-CB 3.29Å; V534-S537 WeakPolarHBondContact O-CB 3.35Å; V534-S537 PolarHBondContact O-N 3.43Å; Q535-S537 VanDerWaalsContact C-N 3.29Å; Q535-S537 PolarHBondContact O-N 2.84Å
538	P	93.2	Very high	86.5	Confident	64 Å²	64	67.2 Å²	67.2	42%	0.416	34%	0.344	S	S	.	.	S	Bend	cis	-74.8	140.1	-2.7	30.8	-34.9	0	0	0	113.6	V525 G536	V525-P538 CarbonylContact O-C 3.57Å; V525-P538 WeakPolarHBondContact O-CA 3.37Å; G536-P538 CarbonylContact O-C 3.5Å
539	F	93.4	Very high	85.4	Confident	37 Å²	37	65.7 Å²	65.7	16%	0.162	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	137.2	178.5	-56.1	-85	0	0	0	111	V451 L456 L524 V525 V527 V534 Q535 G536	V451-F539 HydrophobicContact CB-CE2 4.18Å; V451-F539 HydrophobicContact CB-CZ 3.85Å; V451-F539 HydrophobicContact CG2-CE2 3.98Å; V451-F539 HydrophobicContact CG2-CZ 3.81Å; L456-F539 HydrophobicContact CD1-CD1 4.23Å; L456-F539 HydrophobicContact CD1-CD2 4.47Å; L456-F539 HydrophobicContact CD1-CE1 4.32Å; L456-F539 HydrophobicContact CD1-CG 4.32Å; L456-F539 HydrophobicContact CD1-CZ 4.5Å; L456-F539 HydrophobicContact CD2-CB 3.98Å; L456-F539 HydrophobicContact CD2-CD2 3.93Å; L456-F539 HydrophobicContact CD2-CG 3.92Å; L524-F539 CarbonylContact C-O 3.53Å; L524-F539 WeakPolarHBondContact CA-O 3.32Å; V525-F539 HydrophobicContact CB-CB 4.32Å; V525-F539 PolarHBondContact N-O 3.19Å; V525-F539 WeakPolarHBondContact O-CD2 3.4Å; V525-F539 PolarHBondContact O-N 2.88Å; V527-F539 HydrophobicContact CB-CE2 4.33Å; V527-F539 HydrophobicContact CG2-CD2 4.23Å; V527-F539 HydrophobicContact CG2-CE2 3.99Å; V534-F539 HydrophobicContact CG2-CE2 4.23Å; V534-F539 HydrophobicContact CG2-CZ 4.35Å; Q535-F539 WeakPolarHBondContact O-CZ 3.4Å; G536-F539 WeakPolarHBondContact O-CD1 3.31Å; G536-F539 WeakPolarHBondContact O-CE1 3.48Å
540	K	91.8	Very high	83.7	Confident	157 Å²	157	75.5 Å²	75.5	68%	0.683	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	121.8	171.6	-66.9	-176.2	179.2	-170.9	0	109.9	L524	L524-K540 HydrophobicContact CD2-CG 3.81Å
541	V	90.9	Very high	82.5	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.006	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.4	-179.6	-178.1	0	0	0	0	109.2	L456 V459 H523 V525	L456-V541 HydrophobicContact CD2-CG2 4.47Å; V459-V541 HydrophobicContact CB-CG1 4.22Å; V459-V541 HydrophobicContact CG2-CG1 3.66Å; H523-V541 PolarHBondContact N-O 3.02Å; H523-V541 PolarHBondContact O-N 3.2Å; V525-V541 HydrophobicContact CB-CG2 4.31Å; V525-V541 HydrophobicContact CG2-CB 4.18Å; V525-V541 HydrophobicContact CG2-CG2 3.49Å; V525-V541 VanDerWaalsContact CG2-CG2 3.49Å
542	T	88.1	Confident	81.3	Confident	61 Å²	61	71.6 Å²	71.6	37%	0.374	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	115.6	176.2	-53.6	0	0	0	0	109.3	K457 V459 K544	K457-T542 PolarHBondContact O-N 3.08Å; V459-T542 PolarHBondContact N-O 3.48Å; V459-T542 VanDerWaalsContact N-O 3.12Å; T542-K544 HydrophobicContact CG2-CG 4.42Å
543	V	87.3	Confident	79.9	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.012	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119	173.8	-174.7	0	0	0	0	109	V459 C461 P517 M519 E520 G521 H523	V459-V543 HydrophobicContact CB-CG2 4.31Å; V459-V543 CarbonylContact O-C 3.6Å; V459-V543 VanDerWaalsContact O-CA 3.28Å; V459-V543 WeakPolarHBondContact O-CA 3.36Å; C461-V543 HydrophobicContact CB-CG1 3.86Å; P517-V543 HydrophobicContact CB-CB 4.47Å; P517-V543 HydrophobicContact CB-CG1 3.93Å; P517-V543 HydrophobicContact CB-CG2 3.75Å; P517-V543 HydrophobicContact CG-CG1 3.91Å; P517-V543 HydrophobicContact CG-CG2 4.04Å; M519-V543 WeakPolarHBondContact O-CB 3.48Å; M519-V543 WeakPolarHBondContact O-CG1 3.27Å; E520-V543 WeakPolarHBondContact CA-O 3.43Å; G521-V543 PolarHBondContact N-O 3.19Å; G521-V543 PolarHBondContact O-N 2.92Å; H523-V543 HydrophobicContact CB-CG2 4.36Å; H523-V543 VanDerWaalsContact ND1-CG2 3.26Å; H523-V543 WeakPolarHBondContact ND1-CG2 3.38Å
544	K	82.4	Confident	78.8	Confident	91 Å²	91	67.6 Å²	67.6	40%	0.396	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	147.2	179.1	-64.6	-175.8	178.9	-177	0	111	V459 L460 C461 T542	V459-K544 PolarHBondContact O-N 2.89Å; L460-K544 WeakPolarHBondContact CA-O 3.18Å; L460-K544 HydrophobicContact CD2-CB 4.31Å; C461-K544 PolarHBondContact N-O 2.91Å; T542-K544 HydrophobicContact CG2-CG 4.42Å
545	S	77.3	Confident	78.1	Confident	67 Å²	67	67.9 Å²	67.9	47%	0.469	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-62.2	149.2	170.1	-96.9	0	0	0	0	112.4	E520	E520-S545 VanDerWaalsContact OE2-CB 3.22Å; E520-S545 WeakPolarHBondContact OE2-CB 3.24Å; E520-S545 PolarHBondContact OE2-OG 3.44Å
546	R	71.6	Confident	78	Confident	130 Å²	130	67.5 Å²	67.5	49%	0.491	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-68.7	131.4	173.6	-165.7	-176.1	-175.3	-157.8	-2.2	109.8	N548 E768	R546-N548 PolarHBondContact O-N 2.88Å; R546-E768 WeakPolarHBondContact CG-OE1 3.21Å; R546-E768 IonicContact CZ-OE2 3.27Å; R546-E768 IonicContact NE-OE1 2.67Å; R546-E768 IonicContact NE-OE2 3.17Å; R546-E768 PolarHBondContact NE-OE2 3.23Å; R546-E768 IonicContact NH2-OE2 3.6Å; R546-E768 PolarHBondContact NH2-OE2 3.4Å; R546-E768 VanDerWaalsContact NH2-OE2 3.15Å
547	R	71.8	Confident	78.1	Confident	71 Å²	71	67.1 Å²	67.1	27%	0.268	35%	0.351	S	S	.	.			trans	-74.4	112.1	170	-171.8	66.9	172.7	175.2	-1.1	108.3	Y549 L552 R770 F831	R547-Y549 HydrophobicContact CG-CD1 4.12Å; R547-Y549 HydrophobicContact CG-CE1 3.6Å; R547-Y549 PolarHBondContact O-N 3.39Å; R547-L552 HydrophobicContact CG-CD1 4.42Å; R547-L552 VanDerWaalsContact NE-CD1 3.33Å; R547-L552 VanDerWaalsContact NH2-CD2 3.26Å; R547-R770 PolarHBondContact O-NH1 3.44Å; R547-R770 PolarHBondContact O-NH2 2.92Å; R547-F831 PolarHBondContact NH2-OXT 3.19Å
548	N	69.3	Low	78.2	Confident	93 Å²	93	69 Å²	69	50%	0.497	36%	0.364	S	S	.	.			trans	-90.9	100.5	177.6	-172.4	-9.7	0	0	0	110.6	R546 R550 L552	R546-N548 PolarHBondContact O-N 2.88Å; N548-R550 PolarHBondContact O-N 2.78Å; N548-R550 VanDerWaalsContact OD1-CB 3.26Å; N548-R550 WeakPolarHBondContact OD1-CB 3.31Å; N548-R550 PolarHBondContact OD1-N 3.11Å; N548-L552 WeakPolarHBondContact O-CD1 3.5Å
549	Y	70.7	Confident	78.4	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.016	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-70.6	-1.6	177.8	-65.9	-56.6	0	0	0	115.2	R547 L552 D766 R770 V783 L791 C792 G816 I818	R547-Y549 HydrophobicContact CG-CD1 4.12Å; R547-Y549 HydrophobicContact CG-CE1 3.6Å; R547-Y549 PolarHBondContact O-N 3.39Å; Y549-L552 HydrophobicContact CD1-CD1 3.76Å; Y549-L552 HydrophobicContact CE1-CD1 4.35Å; Y549-D766 VanDerWaalsContact CE2-OD2 3.3Å; Y549-D766 WeakPolarHBondContact CE2-OD2 2.96Å; Y549-D766 PolarHBondContact OH-OD2 3.07Å; Y549-R770 VanDerWaalsContact CE2-NE 3.27Å; Y549-V783 HydrophobicContact CD2-CG1 3.97Å; Y549-V783 HydrophobicContact CE2-CG1 4.33Å; Y549-L791 HydrophobicContact CD2-CD2 4.49Å; Y549-C792 PolarHBondContact O-SG 2.92Å; Y549-G816 PolarHBondContact OH-O 2.78Å; Y549-I818 HydrophobicContact CD1-CD1 4.11Å; Y549-I818 HydrophobicContact CE1-CD1 3.59Å; Y549-I818 HydrophobicContact CE1-CG1 3.95Å
550	R	57.6	Low	78.4	Confident	206 Å²	206	66.7 Å²	66.7	78%	0.777	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-74.3	-21.6	179.2	-67.9	-173.9	173.6	-176.4	-1	114.2	N548	N548-R550 PolarHBondContact O-N 2.78Å; N548-R550 VanDerWaalsContact OD1-CB 3.26Å; N548-R550 WeakPolarHBondContact OD1-CB 3.31Å; N548-R550 PolarHBondContact OD1-N 3.11Å
551	S	59.2	Low	78.6	Confident	97 Å²	97	62.1 Å²	62.1	68%	0.678	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-99.9	8.4	177.8	53.3	0	0	0	0	113.6
552	L	61.9	Low	78.9	Confident	29 Å²	29	68.6 Å²	68.6	15%	0.152	37%	0.373	C	S	.	.			trans	-109.3	104.6	-165.5	-82.5	155.1	0	0	0	112.8	R547 N548 Y549 F794 F831	R547-L552 HydrophobicContact CG-CD1 4.42Å; R547-L552 VanDerWaalsContact NE-CD1 3.33Å; R547-L552 VanDerWaalsContact NH2-CD2 3.26Å; N548-L552 WeakPolarHBondContact O-CD1 3.5Å; Y549-L552 HydrophobicContact CD1-CD1 3.76Å; Y549-L552 HydrophobicContact CE1-CD1 4.35Å; L552-F794 WeakPolarHBondContact O-CD1 3.4Å; L552-F831 WeakPolarHBondContact CD2-OXT 3.48Å
553	G	58.4	Low	79.3	Confident	37 Å²	37	66.6 Å²	66.6	38%	0.381	36%	0.364	S	S	.	.			trans	-147.5	-4.1	160	0	0	0	0	0	112.6	Q555	G553-Q555 PolarHBondContact O-N 2.82Å
554	S	69	Low	79.7	Confident	79 Å²	79	73.7 Å²	73.7	55%	0.552	40%	0.397	S	S	*	.	S	Bend	trans	-83.2	112.4	178.7	-61	0	0	0	0	109.8	M556	S554-M556 PolarHBondContact O-N 3.2Å
555	Q	77.9	Confident	80.4	Confident	9 Å²	9	70.9 Å²	70.9	4%	0.042	39%	0.394	C	S	.	.			trans	-53.3	122.5	172.7	175	-173.3	-37.4	0	0	110.5	G553 S558 Y801 L829 K830 F831	G553-Q555 PolarHBondContact O-N 2.82Å; Q555-S558 VanDerWaalsContact NE2-CB 3.25Å; Q555-S558 PolarHBondContact NE2-OG 3.29Å; Q555-S558 VanDerWaalsContact NE2-OG 3.15Å; Q555-Y801 HydrophobicContact CB-CD1 4.44Å; Q555-Y801 HydrophobicContact CB-CD2 4.28Å; Q555-Y801 HydrophobicContact CB-CE1 4.21Å; Q555-Y801 HydrophobicContact CB-CE2 4.05Å; Q555-Y801 HydrophobicContact CB-CG 4.5Å; Q555-Y801 HydrophobicContact CG-CE2 4.38Å; Q555-Y801 WeakPolarHBondContact O-CE2 3.31Å; Q555-Y801 PolarHBondContact O-OH 3.44Å; Q555-L829 HydrophobicContact CG-CD2 4.41Å; Q555-K830 CarbonylContact C-O 3.57Å; Q555-F831 HydrophobicContact CB-CD1 4.42Å; Q555-F831 HydrophobicContact CB-CE1 4.07Å
556	M	84.5	Confident	81.4	Confident	108 Å²	108	72.5 Å²	72.5	53%	0.532	40%	0.397	S	S	.	.			trans	-74.4	-46.1	177	-66	-177.4	64.6	0	0	111.8	S554 I817 K830 F831	S554-M556 PolarHBondContact O-N 3.2Å; M556-I817 HydrophobicContact CE-CD1 3.79Å; M556-I817 HydrophobicContact CE-CG1 4.49Å; M556-I817 HydrophobicContact SD-CD1 3.78Å; M556-I817 HydrophobicContact SD-CG1 3.91Å; M556-I817 HydrophobicContact SD-CG2 4.34Å; M556-K830 HydrophobicContact CB-CB 4.49Å; M556-K830 PolarHBondContact N-O 3.02Å; M556-F831 WeakPolarHBondContact CG-OXT 3.19Å
557	S	91	Very high	82.6	Confident	47 Å²	47	67 Å²	67	33%	0.329	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	164.3	179.7	55.9	0	0	0	0	110.7	K830	S557-K830 PolarHBondContact O-N 2.8Å; S557-K830 WeakPolarHBondContact OG-CD 3.32Å
558	S	94.4	Very high	83.8	Confident	58 Å²	58	66.9 Å²	66.9	41%	0.406	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	148.6	171.9	55.7	0	0	0	0	110.5	Q555 I828	Q555-S558 VanDerWaalsContact NE2-CB 3.25Å; Q555-S558 PolarHBondContact NE2-OG 3.29Å; Q555-S558 VanDerWaalsContact NE2-OG 3.15Å; S558-I828 VanDerWaalsContact CA-O 3.23Å; S558-I828 WeakPolarHBondContact CA-O 3.47Å
559	F	96.9	Very high	85.2	Confident	25 Å²	25	62.4 Å²	62.4	11%	0.11	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	165.5	175.6	59.1	-83.1	0	0	0	110.6	V583 F596 G600 I828 K830	F559-V583 HydrophobicContact CZ-CB 4.48Å; F559-V583 HydrophobicContact CZ-CG1 4.34Å; F559-V583 HydrophobicContact CZ-CG2 4.47Å; F559-F596 AromaticContact CD2-CD1 3.74Å; F559-F596 HydrophobicContact CD2-CD1 3.74Å; F559-F596 AromaticContact CD2-CE1 3.97Å; F559-F596 HydrophobicContact CD2-CE1 3.97Å; F559-F596 HydrophobicContact CD2-CG 4.13Å; F559-F596 HydrophobicContact CE2-CB 3.97Å; F559-F596 AromaticContact CE2-CD1 3.75Å; F559-F596 HydrophobicContact CE2-CD1 3.75Å; F559-F596 HydrophobicContact CE2-CD2 4Å; F559-F596 HydrophobicContact CE2-CE1 4.2Å; F559-F596 HydrophobicContact CE2-CE2 4.44Å; F559-F596 AromaticContact CE2-CG 3.64Å; F559-F596 HydrophobicContact CE2-CG 3.64Å; F559-G600 WeakPolarHBondContact CD2-O 3.29Å; F559-I828 HydrophobicContact CD1-CB 4.33Å; F559-I828 HydrophobicContact CD2-CB 4.17Å; F559-I828 HydrophobicContact CD2-CG1 4.28Å; F559-I828 HydrophobicContact CE1-CB 3.86Å; F559-I828 HydrophobicContact CE1-CG2 3.76Å; F559-I828 HydrophobicContact CE2-CB 3.72Å; F559-I828 HydrophobicContact CE2-CG1 3.75Å; F559-I828 HydrophobicContact CE2-CG2 4.09Å; F559-I828 HydrophobicContact CG-CB 4.46Å; F559-I828 HydrophobicContact CZ-CB 3.56Å; F559-I828 HydrophobicContact CZ-CG1 4.02Å; F559-I828 HydrophobicContact CZ-CG2 3.45Å; F559-I828 VanDerWaalsContact CZ-CG2 3.45Å; F559-I828 PolarHBondContact N-O 3.42Å; F559-I828 VanDerWaalsContact N-O 3.09Å; F559-I828 PolarHBondContact O-N 2.85Å; F559-K830 HydrophobicContact CE1-CD 4.08Å; F559-K830 HydrophobicContact CE1-CG 4.32Å
560	G	95.1	Very high	86.5	Confident	28 Å²	28	63.6 Å²	63.6	29%	0.289	37%	0.368	S	S	.	.			trans	83.6	158.5	-168.7	0	0	0	0	0	112.8	G567	G560-G567 WeakPolarHBondContact CA-O 3.38Å
561	C	94.4	Very high	88.4	Confident	62 Å²	62	59.9 Å²	59.9	42%	0.419	35%	0.354	S	S	.	.			trans	-158.9	168.3	173.4	58	0	0	0	0	108.7	G563 Q568 L569 N826	C561-G563 PolarHBondContact O-N 3.13Å; C561-Q568 CarbonylContact O-C 3.54Å; C561-Q568 VanDerWaalsContact O-CA 3.31Å; C561-Q568 WeakPolarHBondContact O-CA 3.24Å; C561-L569 PolarHBondContact O-N 2.84Å; C561-N826 CarbonylContact C-O 3.57Å; C561-N826 WeakPolarHBondContact CA-O 3.48Å; C561-N826 PolarHBondContact N-O 2.85Å
562	E	97.5	Very high	90.2	Very high	137 Å²	137	55.2 Å²	55.2	64%	0.64	32%	0.321	S	S	*	.	B	Isolated β-bridge	trans	-61.7	131.3	177.8	-170.8	167.1	-169	0	0	112.2	L569 N826	E562-L569 VanDerWaalsContact CA-O 3.27Å; E562-L569 WeakPolarHBondContact CA-O 3.3Å; E562-N826 HydrophobicContact CB-CB 3.97Å; E562-N826 PolarHBondContact OE2-ND2 3.14Å
563	G	96.9	Very high	92	Very high	18 Å²	18	53.9 Å²	53.9	19%	0.186	31%	0.314	C	S	.	.	S	Bend	trans	153.9	-172.3	172.2	0	0	0	0	0	114.3	C561 L569 N590	C561-G563 PolarHBondContact O-N 3.13Å; G563-L569 PolarHBondContact N-O 3.2Å; G563-L569 VanDerWaalsContact N-O 3.11Å; G563-L569 CarbonylContact O-C 3.55Å; G563-N590 PolarHBondContact O-ND2 3.33Å
564	E	96.4	Very high	93.8	Very high	152 Å²	152	52.2 Å²	52.2	71%	0.71	30%	0.297	S	S	*	.	S	Bend	trans	-114.3	-10.2	-176.1	-55.5	-171.5	168.1	0	0	113	R592	E564-R592 PolarHBondContact O-NH1 2.78Å; E564-R592 PolarHBondContact O-NH2 2.78Å; E564-R592 VanDerWaalsContact O-NH2 3.14Å
565	G	97.3	Very high	95.2	Very high	32 Å²	32	49 Å²	49	33%	0.33	27%	0.273	S	S	.	.	S	Bend	trans	-68.9	175.5	177.7	0	0	0	0	0	113.5	G567 Q568 R592	G565-G567 PolarHBondContact O-N 3.45Å; G565-Q568 WeakPolarHBondContact O-CB 3.27Å; G565-Q568 PolarHBondContact O-N 2.95Å; G565-Q568 VanDerWaalsContact O-N 3.15Å; G565-R592 PolarHBondContact O-NH2 3.29Å
566	D	97.9	Very high	96.2	Very high	100 Å²	100	49.4 Å²	49.4	54%	0.535	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	130	177.6	-70.8	-14	0	0	0	111.1	Q568 F602 K605	D566-Q568 PolarHBondContact O-N 2.8Å; D566-F602 HydrophobicContact CB-CD1 3.84Å; D566-F602 HydrophobicContact CB-CD2 4.29Å; D566-F602 HydrophobicContact CB-CE1 3.73Å; D566-F602 HydrophobicContact CB-CE2 4.19Å; D566-F602 HydrophobicContact CB-CG 4.11Å; D566-F602 HydrophobicContact CB-CZ 3.9Å; D566-K605 WeakPolarHBondContact OD1-CD 3.28Å; D566-K605 WeakPolarHBondContact OD1-CE 3.43Å; D566-K605 IonicContact OD1-NZ 2.71Å; D566-K605 PolarHBondContact OD1-NZ 2.83Å
567	G	95.9	Very high	96.8	Very high	14 Å²	14	45.3 Å²	45.3	14%	0.144	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-5.3	-175.8	0	0	0	0	0	115.2	G560 G565	G560-G567 WeakPolarHBondContact CA-O 3.38Å; G565-G567 PolarHBondContact O-N 3.45Å
568	Q	98.1	Very high	97	Very high	69 Å²	69	43.4 Å²	43.4	32%	0.322	24%	0.244	S	C	.	.			trans	-89	147.3	172.3	-56.1	-177.2	-29.3	0	0	110.7	C561 G565 D566 R592 Q594	C561-Q568 CarbonylContact O-C 3.54Å; C561-Q568 VanDerWaalsContact O-CA 3.31Å; C561-Q568 WeakPolarHBondContact O-CA 3.24Å; G565-Q568 WeakPolarHBondContact O-CB 3.27Å; G565-Q568 PolarHBondContact O-N 2.95Å; G565-Q568 VanDerWaalsContact O-N 3.15Å; D566-Q568 PolarHBondContact O-N 2.8Å; Q568-R592 PolarHBondContact O-NH2 3.45Å; Q568-Q594 PolarHBondContact O-NE2 3.46Å
569	L	98	Very high	96.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-124	149	-172.6	-58.6	170.9	0	0	0	110.5	C561 E562 G563 P572 V585 D587 F596 I828	C561-L569 PolarHBondContact O-N 2.84Å; E562-L569 VanDerWaalsContact CA-O 3.27Å; E562-L569 WeakPolarHBondContact CA-O 3.3Å; G563-L569 PolarHBondContact N-O 3.2Å; G563-L569 VanDerWaalsContact N-O 3.11Å; G563-L569 CarbonylContact O-C 3.55Å; L569-P572 HydrophobicContact CB-CB 4.28Å; L569-P572 HydrophobicContact CB-CG 3.92Å; L569-P572 HydrophobicContact CD1-CB 4.35Å; L569-P572 HydrophobicContact CD1-CG 4.05Å; L569-P572 HydrophobicContact CD2-CB 4.47Å; L569-P572 HydrophobicContact CG-CG 4.49Å; L569-V585 HydrophobicContact CD2-CG1 4.09Å; L569-D587 WeakPolarHBondContact CA-OD1 3.18Å; L569-D587 HydrophobicContact CD2-CB 4.17Å; L569-F596 HydrophobicContact CD2-CE2 4.46Å; L569-F596 HydrophobicContact CD2-CZ 4.27Å; L569-I828 HydrophobicContact CD1-CD1 3.84Å; L569-I828 HydrophobicContact CD1-CG1 3.83Å
570	C	97.9	Very high	96.6	Very high	28 Å²	28	53.6 Å²	53.6	19%	0.189	28%	0.278	C	S	.	.	S	Bend	trans	-133.7	105	172.4	-169.3	0	0	0	0	111.3	D587 S589 N590	C570-D587 PolarHBondContact N-OD1 2.77Å; C570-S589 WeakPolarHBondContact O-CB 3.4Å; C570-S589 PolarHBondContact O-N 3Å; C570-S589 PolarHBondContact O-OG 2.81Å; C570-S589 VanDerWaalsContact O-OG 3.13Å; C570-N590 WeakPolarHBondContact CB-OD1 3.45Å
571	R	97.1	Very high	96.5	Very high	128 Å²	128	52.4 Å²	52.4	48%	0.483	27%	0.266	S	S	.	.	S	Bend	trans	51.4	50.6	-175.7	-46.7	174.1	72.6	-173.3	8.2	112	R588 S589 F823 N826	R571-R588 WeakPolarHBondContact O-CB 3.42Å; R571-S589 WeakPolarHBondContact CB-OG 3.45Å; R571-S589 WeakPolarHBondContact CD-OG 3.46Å; R571-F823 HydrophobicContact CB-CD2 4.49Å; R571-F823 HydrophobicContact CB-CE2 3.68Å; R571-F823 HydrophobicContact CB-CZ 4.02Å; R571-F823 HydrophobicContact CG-CZ 4.46Å; R571-N826 WeakPolarHBondContact CA-OD1 3.17Å; R571-N826 PolarHBondContact N-OD1 3.15Å
572	P	98.2	Very high	96.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.254	C	S	.	.			trans	-60.6	154.6	-179.9	30.3	-37.5	0	0	0	110.7	L569 V585 A586 V821 F823	L569-P572 HydrophobicContact CB-CB 4.28Å; L569-P572 HydrophobicContact CB-CG 3.92Å; L569-P572 HydrophobicContact CD1-CB 4.35Å; L569-P572 HydrophobicContact CD1-CG 4.05Å; L569-P572 HydrophobicContact CD2-CB 4.47Å; L569-P572 HydrophobicContact CG-CG 4.49Å; P572-V585 HydrophobicContact CB-CG1 3.88Å; P572-A586 WeakPolarHBondContact CA-O 3.41Å; P572-V821 HydrophobicContact CB-CG1 3.81Å; P572-V821 HydrophobicContact CG-CG1 3.61Å; P572-V821 WeakPolarHBondContact O-CG1 3.16Å; P572-F823 VanDerWaalsContact O-CD2 3.28Å; P572-F823 WeakPolarHBondContact O-CD2 3.31Å
573	W	98.4	Very high	96.7	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	22%	0.224	C	C	.	.			trans	-132.2	-69.2	178.8	-166	90.9	0	0	0	113.5	A586 W667 D668 R714 Q761 S808 G809 V821	W573-A586 PolarHBondContact N-O 2.94Å; W573-A586 VanDerWaalsContact N-O 3.12Å; W573-W667 AromaticContact CD1-NE1 3.77Å; W573-W667 AromaticContact CD2-CD1 3.87Å; W573-W667 AromaticContact CD2-NE1 3.22Å; W573-W667 AromaticContact CE2-CD1 3.75Å; W573-W667 AromaticContact CE2-NE1 3.03Å; W573-W667 AromaticContact CE3-CD1 3.85Å; W573-W667 AromaticContact CE3-NE1 3.69Å; W573-W667 AromaticContact CG-NE1 3.73Å; W573-W667 AromaticContact CH2-CD1 3.75Å; W573-W667 AromaticContact CH2-NE1 3.9Å; W573-W667 AromaticContact CZ2-CD1 3.7Å; W573-W667 AromaticContact CZ2-NE1 3.41Å; W573-W667 AromaticContact CZ3-CD1 3.82Å; W573-W667 AromaticContact NE1-CE2 3.99Å; W573-W667 AromaticContact NE1-NE1 3.32Å; W573-D668 HydrophobicContact CH2-CB 3.87Å; W573-D668 HydrophobicContact CZ3-CB 3.7Å; W573-D668 VanDerWaalsContact CZ3-CG 3.4Å; W573-D668 WeakPolarHBondContact CZ3-OD1 3.46Å; W573-R714 HydrophobicContact CH2-CG 4.33Å; W573-R714 HydrophobicContact CZ2-CG 3.76Å; W573-Q761 HydrophobicContact CZ2-CB 4.16Å; W573-S808 PolarHBondContact O-OG 3.13Å; W573-G809 WeakPolarHBondContact O-CA 3.35Å; W573-G809 PolarHBondContact O-N 3.15Å; W573-V821 WeakPolarHBondContact O-CG2 3.29Å
574	G	97.5	Very high	96.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.01	22%	0.215	C	C	.	.			trans	-79.6	146.6	-174.8	0	0	0	0	0	111.4	V585 A586 A620	G574-V585 WeakPolarHBondContact O-CA 3.25Å; G574-A586 PolarHBondContact O-N 3.39Å; G574-A620 WeakPolarHBondContact CA-O 3.34Å; G574-A620 PolarHBondContact N-O 2.89Å
575	I	98.6	Very high	96.9	Very high	12 Å²	12	37 Å²	37	6%	0.062	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	141.1	176.5	-168.8	165.9	0	0	0	109.5	V583 V584 V585 G809 A811 V819 V821 I828	I575-V583 HydrophobicContact CD1-CG1 3.57Å; I575-V583 HydrophobicContact CG1-CG1 3.68Å; I575-V584 CarbonylContact C-O 3.54Å; I575-V584 VanDerWaalsContact CA-O 3.31Å; I575-V584 WeakPolarHBondContact CA-O 3.27Å; I575-V585 HydrophobicContact CD1-CG2 4.31Å; I575-V585 HydrophobicContact CG1-CG2 4.23Å; I575-G809 VanDerWaalsContact CG2-C 3.42Å; I575-A811 HydrophobicContact CG2-CB 4.02Å; I575-V819 HydrophobicContact CD1-CB 4.07Å; I575-V819 HydrophobicContact CD1-CG1 3.46Å; I575-V819 VanDerWaalsContact CD1-CG1 3.46Å; I575-V821 HydrophobicContact CB-CG2 3.57Å; I575-V821 HydrophobicContact CD1-CG2 3.95Å; I575-V821 HydrophobicContact CG1-CG2 4.34Å; I575-V821 HydrophobicContact CG2-CG2 3.81Å; I575-I828 HydrophobicContact CD1-CD1 4.26Å; I575-I828 HydrophobicContact CD1-CG2 3.78Å
576	S	98	Very high	97	Very high	18 Å²	18	35.5 Å²	35.5	13%	0.126	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	158.1	172.4	-167.9	0	0	0	0	109.5	V584 V622 C624	S576-V584 PolarHBondContact N-O 3.17Å; S576-V584 PolarHBondContact O-N 3.11Å; S576-V622 WeakPolarHBondContact CB-O 3.18Å; S576-C624 PolarHBondContact OG-N 3.08Å; S576-C624 VanDerWaalsContact OG-N 3.12Å
577	V	97.6	Very high	97	Very high	21 Å²	21	30.7 Å²	30.7	13%	0.127	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.2	177.3	-173.9	0	0	0	0	108.5	Y582 V583 A811 M813 V819	V577-Y582 VanDerWaalsContact CA-O 3.27Å; V577-Y582 WeakPolarHBondContact CA-O 3.13Å; V577-V583 HydrophobicContact CG2-CG2 4.29Å; V577-A811 HydrophobicContact CG2-CB 3.89Å; V577-M813 HydrophobicContact CG1-CB 4.45Å; V577-M813 HydrophobicContact CG1-CG 4.11Å; V577-M813 HydrophobicContact CG2-CG 4.23Å; V577-V819 HydrophobicContact CG2-CG2 4.21Å
578	D	94.8	Very high	97.1	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	14%	0.137	C	C	.	.			trans	-81.7	176	175.3	82.5	-4	0	0	0	112.3	E580 G581 Y582 C624 R628	D578-E580 PolarHBondContact O-N 3.14Å; D578-E580 WeakPolarHBondContact OD1-CA 3.22Å; D578-E580 PolarHBondContact OD1-N 2.84Å; D578-G581 PolarHBondContact O-N 3.15Å; D578-G581 PolarHBondContact OD1-N 3.35Å; D578-Y582 PolarHBondContact N-O 3.4Å; D578-Y582 PolarHBondContact OD1-N 3.15Å; D578-C624 HydrophobicContact CB-CB 4.3Å; D578-R628 IonicContact OD2-CZ 2.88Å; D578-R628 IonicContact OD2-NE 2.79Å; D578-R628 PolarHBondContact OD2-NE 3Å; D578-R628 IonicContact OD2-NH2 3.64Å; D578-R628 PolarHBondContact OD2-NH2 2.82Å
579	R	90.3	Very high	97.1	Very high	189 Å²	189	29.5 Å²	29.5	71%	0.713	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.8	-179.4	-66.8	-175.8	175.8	-167.2	-1.2	114	P814	R579-P814 WeakPolarHBondContact O-CG 3.2Å
580	E	92.2	Very high	97.1	Very high	109 Å²	109	30.8 Å²	30.8	51%	0.509	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.3	176.7	-69.9	176.7	-162.7	0	0	112	D578 Y582 P598 R628	D578-E580 PolarHBondContact O-N 3.14Å; D578-E580 WeakPolarHBondContact OD1-CA 3.22Å; D578-E580 PolarHBondContact OD1-N 2.84Å; E580-Y582 HydrophobicContact CB-CD2 3.76Å; E580-Y582 HydrophobicContact CB-CE2 3.93Å; E580-Y582 WeakPolarHBondContact OE2-CE2 3.44Å; E580-P598 WeakPolarHBondContact O-CG 3.42Å; E580-R628 VanDerWaalsContact CD-CZ 3.46Å; E580-R628 IonicContact OE1-CZ 2.76Å; E580-R628 IonicContact OE1-NH1 2.71Å; E580-R628 PolarHBondContact OE1-NH1 3.14Å; E580-R628 IonicContact OE1-NH2 3.52Å; E580-R628 IonicContact OE2-CZ 3.15Å; E580-R628 IonicContact OE2-NH1 3.19Å; E580-R628 PolarHBondContact OE2-NH1 2.92Å; E580-R628 IonicContact OE2-NH2 2.93Å; E580-R628 PolarHBondContact OE2-NH2 2.83Å
581	G	94.3	Very high	97.2	Very high	3 Å²	3	30.5 Å²	30.5	3%	0.031	14%	0.137	C	C	.	.			trans	89.8	9.5	179.3	0	0	0	0	0	114.6	D578 P598	D578-G581 PolarHBondContact O-N 3.15Å; D578-G581 PolarHBondContact OD1-N 3.35Å; G581-P598 WeakPolarHBondContact O-CA 3.42Å
582	Y	97.9	Very high	97.2	Very high	45 Å²	45	25.1 Å²	25.1	18%	0.176	12%	0.117	C	C	.	.			trans	-68.5	135	173.1	-73.3	-96.9	0	0	0	110.3	V577 D578 E580 I595 F596 K597 H603 F645	V577-Y582 VanDerWaalsContact CA-O 3.27Å; V577-Y582 WeakPolarHBondContact CA-O 3.13Å; D578-Y582 PolarHBondContact N-O 3.4Å; D578-Y582 PolarHBondContact OD1-N 3.15Å; E580-Y582 HydrophobicContact CB-CD2 3.76Å; E580-Y582 HydrophobicContact CB-CE2 3.93Å; E580-Y582 WeakPolarHBondContact OE2-CE2 3.44Å; Y582-I595 HydrophobicContact CD1-CG2 4.06Å; Y582-F596 CarbonylContact C-O 3.57Å; Y582-F596 WeakPolarHBondContact CA-O 3.46Å; Y582-F596 WeakPolarHBondContact CD1-O 3.42Å; Y582-K597 HydrophobicContact CE1-CB 4.4Å; Y582-K597 HydrophobicContact CE1-CG 3.92Å; Y582-H603 AromaticContact CE1-CD2 3.57Å; Y582-F645 AromaticContact CD1-CZ 3.91Å; Y582-F645 HydrophobicContact CD1-CZ 3.91Å; Y582-F645 HydrophobicContact CD2-CZ 4.19Å; Y582-F645 HydrophobicContact CE1-CZ 4.5Å; Y582-F645 HydrophobicContact CG-CE2 4.43Å; Y582-F645 AromaticContact CG-CZ 3.74Å; Y582-F645 HydrophobicContact CG-CZ 3.74Å
583	V	98.4	Very high	97.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.2	-177.3	-176.1	0	0	0	0	108.9	F559 I575 V577 V585 I595 F596 V819	F559-V583 HydrophobicContact CZ-CB 4.48Å; F559-V583 HydrophobicContact CZ-CG1 4.34Å; F559-V583 HydrophobicContact CZ-CG2 4.47Å; I575-V583 HydrophobicContact CD1-CG1 3.57Å; I575-V583 HydrophobicContact CG1-CG1 3.68Å; V577-V583 HydrophobicContact CG2-CG2 4.29Å; V583-V585 HydrophobicContact CG1-CG2 4Å; V583-I595 CarbonylContact O-C 3.59Å; V583-I595 WeakPolarHBondContact O-CA 3.34Å; V583-F596 HydrophobicContact CB-CB 4.31Å; V583-F596 PolarHBondContact N-O 3.26Å; V583-F596 PolarHBondContact O-N 3.06Å; V583-V819 HydrophobicContact CG1-CG1 4.36Å
584	V	98.7	Very high	97.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.1	178.5	-172.6	0	0	0	0	108.8	I575 S576 I593 Q594 I595 V622 C624 I630	I575-V584 CarbonylContact C-O 3.54Å; I575-V584 VanDerWaalsContact CA-O 3.31Å; I575-V584 WeakPolarHBondContact CA-O 3.27Å; S576-V584 PolarHBondContact N-O 3.17Å; S576-V584 PolarHBondContact O-N 3.11Å; V584-I593 HydrophobicContact CG1-CG2 3.42Å; V584-I593 VanDerWaalsContact CG1-CG2 3.42Å; V584-Q594 WeakPolarHBondContact CA-O 3.34Å; V584-I595 HydrophobicContact CG1-CG1 4.31Å; V584-I595 HydrophobicContact CG2-CG1 4.1Å; V584-I595 HydrophobicContact CG2-CG2 4.35Å; V584-V622 HydrophobicContact CB-CG2 4.39Å; V584-V622 HydrophobicContact CG1-CG1 4.44Å; V584-V622 HydrophobicContact CG1-CG2 3.63Å; V584-V622 WeakPolarHBondContact O-CG1 3.39Å; V584-C624 VanDerWaalsContact CG2-SG 3.56Å; V584-I630 HydrophobicContact CG1-CD1 4.18Å; V584-I630 HydrophobicContact CG1-CG2 4.07Å; V584-I630 HydrophobicContact CG2-CD1 4.38Å
585	V	98.8	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.1	-173.4	-177.4	0	0	0	0	110.2	L569 P572 G574 I575 V583 D587 I593 Q594 F596 I828	L569-V585 HydrophobicContact CD2-CG1 4.09Å; P572-V585 HydrophobicContact CB-CG1 3.88Å; G574-V585 WeakPolarHBondContact O-CA 3.25Å; I575-V585 HydrophobicContact CD1-CG2 4.31Å; I575-V585 HydrophobicContact CG1-CG2 4.23Å; V583-V585 HydrophobicContact CG1-CG2 4Å; V585-D587 PolarHBondContact O-N 2.64Å; V585-I593 WeakPolarHBondContact O-CA 3.44Å; V585-Q594 PolarHBondContact N-O 3.28Å; V585-Q594 PolarHBondContact O-N 3.02Å; V585-F596 HydrophobicContact CB-CE2 4.27Å; V585-F596 HydrophobicContact CG2-CD2 4.07Å; V585-F596 HydrophobicContact CG2-CE2 3.95Å; V585-I828 HydrophobicContact CG1-CD1 4.14Å; V585-I828 HydrophobicContact CG2-CD1 3.99Å; V585-I828 HydrophobicContact CG2-CG1 4.23Å
586	A	98.6	Very high	97.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	100	169	0	0	0	0	0	110.1	P572 W573 G574 R588 I593 A620 V622	P572-A586 WeakPolarHBondContact CA-O 3.41Å; W573-A586 PolarHBondContact N-O 2.94Å; W573-A586 VanDerWaalsContact N-O 3.12Å; G574-A586 PolarHBondContact O-N 3.39Å; A586-R588 VanDerWaalsContact C-N 3.31Å; A586-R588 PolarHBondContact O-N 3.35Å; A586-I593 HydrophobicContact CB-CD1 4.02Å; A586-A620 WeakPolarHBondContact CB-O 3.32Å; A586-V622 HydrophobicContact CB-CB 4.4Å; A586-V622 HydrophobicContact CB-CG1 4.32Å
587	D	98.4	Very high	97.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	75.8	-178	-172.4	10.7	0	0	0	110.1	L569 C570 V585 S589 N590 N591 R592 Q594	L569-D587 WeakPolarHBondContact CA-OD1 3.18Å; L569-D587 HydrophobicContact CD2-CB 4.17Å; C570-D587 PolarHBondContact N-OD1 2.77Å; V585-D587 PolarHBondContact O-N 2.64Å; D587-S589 PolarHBondContact O-N 3.27Å; D587-N590 HydrophobicContact CB-CB 4.48Å; D587-N590 CarbonylContact O-C 3.44Å; D587-N590 PolarHBondContact O-N 2.91Å; D587-N590 PolarHBondContact OD1-ND2 2.8Å; D587-N590 WeakPolarHBondContact OD2-CB 3.34Å; D587-N590 PolarHBondContact OD2-ND2 3.11Å; D587-N591 PolarHBondContact O-N 3.33Å; D587-N591 VanDerWaalsContact O-N 3.16Å; D587-R592 HydrophobicContact CB-CG 3.89Å; D587-R592 WeakPolarHBondContact CB-O 3.48Å; D587-R592 PolarHBondContact N-O 3.22Å; D587-R592 IonicContact OD2-CZ 2.65Å; D587-R592 IonicContact OD2-NE 3.57Å; D587-R592 PolarHBondContact OD2-NE 3.46Å; D587-R592 IonicContact OD2-NH2 2.8Å; D587-R592 PolarHBondContact OD2-NH2 3.23Å; D587-Q594 HydrophobicContact CB-CG 4.46Å; D587-Q594 PolarHBondContact OD2-NE2 3.2Å
588	R	98.2	Very high	97.1	Very high	22 Å²	22	29.6 Å²	29.6	8%	0.083	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-55.1	-49.1	-158.9	-168.8	178.3	80	-157.2	1.1	114.7	R571 A586 N590 N591 R618 P619	R571-R588 WeakPolarHBondContact O-CB 3.42Å; A586-R588 VanDerWaalsContact C-N 3.31Å; A586-R588 PolarHBondContact O-N 3.35Å; R588-N590 VanDerWaalsContact C-N 3.34Å; R588-N591 PolarHBondContact O-N 3.49Å; R588-R618 HydrophobicContact CG-CB 3.8Å; R588-R618 WeakPolarHBondContact O-CA 3.06Å; R588-P619 WeakPolarHBondContact CA-O 3.43Å; R588-P619 WeakPolarHBondContact CB-O 3.33Å; R588-P619 VanDerWaalsContact CG-O 3.3Å; R588-P619 WeakPolarHBondContact CG-O 3.46Å
589	S	97.9	Very high	97	Very high	36 Å²	36	33.9 Å²	33.9	25%	0.252	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-81.7	-18.8	-174.6	-47.8	0	0	0	0	112.9	C570 R571 D587 N591	C570-S589 WeakPolarHBondContact O-CB 3.4Å; C570-S589 PolarHBondContact O-N 3Å; C570-S589 PolarHBondContact O-OG 2.81Å; C570-S589 VanDerWaalsContact O-OG 3.13Å; R571-S589 WeakPolarHBondContact CB-OG 3.45Å; R571-S589 WeakPolarHBondContact CD-OG 3.46Å; D587-S589 PolarHBondContact O-N 3.27Å; S589-N591 VanDerWaalsContact C-N 3.26Å; S589-N591 PolarHBondContact O-ND2 2.82Å
590	N	98.4	Very high	97.2	Very high	27 Å²	27	25.3 Å²	25.3	14%	0.144	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-83.7	-1.3	170.5	-68.6	-22.8	0	0	0	112.5	G563 C570 D587 R588 R592	G563-N590 PolarHBondContact O-ND2 3.33Å; C570-N590 WeakPolarHBondContact CB-OD1 3.45Å; D587-N590 HydrophobicContact CB-CB 4.48Å; D587-N590 CarbonylContact O-C 3.44Å; D587-N590 PolarHBondContact O-N 2.91Å; D587-N590 PolarHBondContact OD1-ND2 2.8Å; D587-N590 WeakPolarHBondContact OD2-CB 3.34Å; D587-N590 PolarHBondContact OD2-ND2 3.11Å; R588-N590 VanDerWaalsContact C-N 3.34Å; N590-R592 VanDerWaalsContact C-N 3.28Å; N590-R592 HydrophobicContact CB-CG 3.94Å; N590-R592 PolarHBondContact O-N 2.99Å
591	N	98.5	Very high	97.4	Very high	21 Å²	21	22.4 Å²	22.4	11%	0.112	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	41.3	177.4	-54.9	-73.5	0	0	0	113.6	D587 R588 S589 G607 S608 L609 R618	D587-N591 PolarHBondContact O-N 3.33Å; D587-N591 VanDerWaalsContact O-N 3.16Å; R588-N591 PolarHBondContact O-N 3.49Å; S589-N591 VanDerWaalsContact C-N 3.26Å; S589-N591 PolarHBondContact O-ND2 2.82Å; N591-G607 CarbonylContact O-C 3.47Å; N591-S608 CarbonylContact O-C 3.33Å; N591-S608 PolarHBondContact O-N 2.97Å; N591-L609 HydrophobicContact CB-CB 4.09Å; N591-L609 HydrophobicContact CB-CD1 4.42Å; N591-R618 PolarHBondContact OD1-N 3.39Å
592	R	98.4	Very high	97.6	Very high	16 Å²	16	25.2 Å²	25.2	6%	0.06	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	164.8	-176.5	69.9	-174.3	-176.5	-175.3	5.8	111.8	E564 G565 Q568 D587 N590 Q594 K605 F606	E564-R592 PolarHBondContact O-NH1 2.78Å; E564-R592 PolarHBondContact O-NH2 2.78Å; E564-R592 VanDerWaalsContact O-NH2 3.14Å; G565-R592 PolarHBondContact O-NH2 3.29Å; Q568-R592 PolarHBondContact O-NH2 3.45Å; D587-R592 HydrophobicContact CB-CG 3.89Å; D587-R592 WeakPolarHBondContact CB-O 3.48Å; D587-R592 PolarHBondContact N-O 3.22Å; D587-R592 IonicContact OD2-CZ 2.65Å; D587-R592 IonicContact OD2-NE 3.57Å; D587-R592 PolarHBondContact OD2-NE 3.46Å; D587-R592 IonicContact OD2-NH2 2.8Å; D587-R592 PolarHBondContact OD2-NH2 3.23Å; N590-R592 VanDerWaalsContact C-N 3.28Å; N590-R592 HydrophobicContact CB-CG 3.94Å; N590-R592 PolarHBondContact O-N 2.99Å; R592-Q594 HydrophobicContact CG-CG 4.33Å; R592-K605 VanDerWaalsContact NH1-NZ 3.13Å; R592-F606 WeakPolarHBondContact CA-O 3.48Å; R592-F606 WeakPolarHBondContact CB-O 3.34Å
593	I	98.8	Very high	97.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	136.8	167.8	-54.5	-56.2	0	0	0	108.2	V584 V585 A586 I595 K605 F606 F616 P619 V632	V584-I593 HydrophobicContact CG1-CG2 3.42Å; V584-I593 VanDerWaalsContact CG1-CG2 3.42Å; V585-I593 WeakPolarHBondContact O-CA 3.44Å; A586-I593 HydrophobicContact CB-CD1 4.02Å; I593-I595 HydrophobicContact CG2-CD1 4.49Å; I593-K605 VanDerWaalsContact O-CA 3.27Å; I593-K605 WeakPolarHBondContact O-CA 3.46Å; I593-K605 WeakPolarHBondContact O-CB 3.32Å; I593-F606 HydrophobicContact CB-CD1 4.47Å; I593-F606 HydrophobicContact CB-CE1 4.01Å; I593-F606 HydrophobicContact CB-CE2 4.03Å; I593-F606 HydrophobicContact CB-CZ 3.76Å; I593-F606 HydrophobicContact CG1-CE2 4.03Å; I593-F606 HydrophobicContact CG1-CZ 4.06Å; I593-F606 HydrophobicContact CG2-CE1 4.05Å; I593-F606 HydrophobicContact CG2-CZ 3.97Å; I593-F606 PolarHBondContact N-O 2.85Å; I593-F606 PolarHBondContact O-N 2.76Å; I593-F616 HydrophobicContact CG1-CE2 3.98Å; I593-F616 HydrophobicContact CG1-CZ 4.06Å; I593-P619 HydrophobicContact CD1-CB 4.17Å; I593-P619 HydrophobicContact CD1-CG 4.39Å; I593-V632 HydrophobicContact CD1-CG1 3.82Å; I593-V632 HydrophobicContact CD1-CG2 3.96Å; I593-V632 HydrophobicContact CG1-CG1 4.37Å; I593-V632 HydrophobicContact CG1-CG2 3.83Å
594	Q	98.7	Very high	97.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.9	174.6	-68.1	-163.4	73.5	0	0	110.8	Q568 V584 V585 D587 R592 F596 F602 K605	Q568-Q594 PolarHBondContact O-NE2 3.46Å; V584-Q594 WeakPolarHBondContact CA-O 3.34Å; V585-Q594 PolarHBondContact N-O 3.28Å; V585-Q594 PolarHBondContact O-N 3.02Å; D587-Q594 HydrophobicContact CB-CG 4.46Å; D587-Q594 PolarHBondContact OD2-NE2 3.2Å; R592-Q594 HydrophobicContact CG-CG 4.33Å; Q594-F596 HydrophobicContact CB-CD2 4.47Å; Q594-F596 HydrophobicContact CB-CE2 3.68Å; Q594-F596 HydrophobicContact CB-CZ 4.14Å; Q594-F602 HydrophobicContact CG-CE2 4.49Å; Q594-F602 VanDerWaalsContact OE1-CE2 3.26Å; Q594-K605 HydrophobicContact CG-CB 3.89Å
595	I	98.6	Very high	97.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134	175.7	-55.3	80.3	0	0	0	108.4	Y582 V583 V584 I593 H603 H604 F606 I630 F645	Y582-I595 HydrophobicContact CD1-CG2 4.06Å; V583-I595 CarbonylContact O-C 3.59Å; V583-I595 WeakPolarHBondContact O-CA 3.34Å; V584-I595 HydrophobicContact CG1-CG1 4.31Å; V584-I595 HydrophobicContact CG2-CG1 4.1Å; V584-I595 HydrophobicContact CG2-CG2 4.35Å; I593-I595 HydrophobicContact CG2-CD1 4.49Å; I595-H603 HydrophobicContact CB-CB 4.44Å; I595-H603 HydrophobicContact CG2-CB 4.3Å; I595-H603 WeakPolarHBondContact O-CA 3.45Å; I595-H603 VanDerWaalsContact O-CB 3.26Å; I595-H603 WeakPolarHBondContact O-CB 3.16Å; I595-H603 PolarHBondContact O-N 3.49Å; I595-H604 WeakPolarHBondContact CD1-CE1 3.34Å; I595-H604 WeakPolarHBondContact CD1-NE2 3.38Å; I595-H604 VanDerWaalsContact CG1-CE1 3.47Å; I595-H604 WeakPolarHBondContact CG1-CE1 3.27Å; I595-H604 PolarHBondContact N-O 2.95Å; I595-H604 PolarHBondContact O-N 3.02Å; I595-F606 HydrophobicContact CD1-CD1 3.88Å; I595-F606 HydrophobicContact CD1-CE1 3.68Å; I595-I630 HydrophobicContact CD1-CD1 4.41Å; I595-I630 HydrophobicContact CG1-CD1 4.24Å; I595-F645 HydrophobicContact CG2-CE2 4.14Å; I595-F645 HydrophobicContact CG2-CZ 3.76Å
596	F	98.5	Very high	97.6	Very high	3 Å²	3	33.8 Å²	33.8	1%	0.013	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.8	176.8	-59.9	-98.2	0	0	0	109.9	F559 L569 Y582 V583 V585 Q594 G600 A601	F559-F596 AromaticContact CD2-CD1 3.74Å; F559-F596 HydrophobicContact CD2-CD1 3.74Å; F559-F596 AromaticContact CD2-CE1 3.97Å; F559-F596 HydrophobicContact CD2-CE1 3.97Å; F559-F596 HydrophobicContact CD2-CG 4.13Å; F559-F596 HydrophobicContact CE2-CB 3.97Å; F559-F596 AromaticContact CE2-CD1 3.75Å; F559-F596 HydrophobicContact CE2-CD1 3.75Å; F559-F596 HydrophobicContact CE2-CD2 4Å; F559-F596 HydrophobicContact CE2-CE1 4.2Å; F559-F596 HydrophobicContact CE2-CE2 4.44Å; F559-F596 AromaticContact CE2-CG 3.64Å; F559-F596 HydrophobicContact CE2-CG 3.64Å; L569-F596 HydrophobicContact CD2-CE2 4.46Å; L569-F596 HydrophobicContact CD2-CZ 4.27Å; Y582-F596 CarbonylContact C-O 3.57Å; Y582-F596 WeakPolarHBondContact CA-O 3.46Å; Y582-F596 WeakPolarHBondContact CD1-O 3.42Å; V583-F596 HydrophobicContact CB-CB 4.31Å; V583-F596 PolarHBondContact N-O 3.26Å; V583-F596 PolarHBondContact O-N 3.06Å; V585-F596 HydrophobicContact CB-CE2 4.27Å; V585-F596 HydrophobicContact CG2-CD2 4.07Å; V585-F596 HydrophobicContact CG2-CE2 3.95Å; Q594-F596 HydrophobicContact CB-CD2 4.47Å; Q594-F596 HydrophobicContact CB-CE2 3.68Å; Q594-F596 HydrophobicContact CB-CZ 4.14Å; F596-G600 WeakPolarHBondContact CD1-O 3.49Å; F596-A601 CarbonylContact C-O 3.56Å; F596-A601 VanDerWaalsContact CA-O 3.27Å; F596-A601 WeakPolarHBondContact CA-O 3.38Å
597	K	97	Very high	97.6	Very high	91 Å²	91	35.2 Å²	35.2	40%	0.396	20%	0.198	S	C	.	.			trans	-63.7	161.6	172.1	-67.4	-177.4	178.7	-179.9	0	110.6	Y582 C599 G600 A601 H603	Y582-K597 HydrophobicContact CE1-CB 4.4Å; Y582-K597 HydrophobicContact CE1-CG 3.92Å; K597-C599 PolarHBondContact O-N 3.05Å; K597-G600 PolarHBondContact O-N 3.36Å; K597-A601 PolarHBondContact N-O 3.12Å; K597-H603 HydrophobicContact CG-CB 4.21Å
598	P	94.5	Very high	97.5	Very high	53 Å²	53	38 Å²	38	34%	0.344	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-27.1	175	-25.8	31.8	0	0	0	114.4	E580 G581 G600 M813 K830	E580-P598 WeakPolarHBondContact O-CG 3.42Å; G581-P598 WeakPolarHBondContact O-CA 3.42Å; P598-G600 VanDerWaalsContact C-N 3.32Å; P598-G600 PolarHBondContact O-N 3.07Å; P598-M813 HydrophobicContact CB-CE 4.32Å; P598-K830 PolarHBondContact O-NZ 3.01Å
599	C	92.6	Very high	97.6	Very high	97 Å²	97	42.1 Å²	42.1	66%	0.655	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-8.3	174.4	60.6	0	0	0	0	114.8	K597	K597-C599 PolarHBondContact O-N 3.05Å
600	G	94.1	Very high	97.6	Very high	9 Å²	9	41.3 Å²	41.3	9%	0.093	24%	0.238	C	C	.	.	S	Bend	trans	91.6	-0.5	-176.6	0	0	0	0	0	114.9	F559 F596 K597 P598	F559-G600 WeakPolarHBondContact CD2-O 3.29Å; F596-G600 WeakPolarHBondContact CD1-O 3.49Å; K597-G600 PolarHBondContact O-N 3.36Å; P598-G600 VanDerWaalsContact C-N 3.32Å; P598-G600 PolarHBondContact O-N 3.07Å
601	A	96.6	Very high	97.5	Very high	48 Å²	48	43.9 Å²	43.9	40%	0.397	26%	0.258	S	S	.	.			trans	-70.2	142.5	173.1	0	0	0	0	0	111.2	F596 K597 H603	F596-A601 CarbonylContact C-O 3.56Å; F596-A601 VanDerWaalsContact CA-O 3.27Å; F596-A601 WeakPolarHBondContact CA-O 3.38Å; K597-A601 PolarHBondContact N-O 3.12Å; A601-H603 PolarHBondContact O-N 3.28Å
602	F	98.1	Very high	97.5	Very high	62 Å²	62	51.6 Å²	51.6	27%	0.272	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	134.3	173.1	176.1	-102.6	0	0	0	110.7	D566 Q594 H604 K605	D566-F602 HydrophobicContact CB-CD1 3.84Å; D566-F602 HydrophobicContact CB-CD2 4.29Å; D566-F602 HydrophobicContact CB-CE1 3.73Å; D566-F602 HydrophobicContact CB-CE2 4.19Å; D566-F602 HydrophobicContact CB-CG 4.11Å; D566-F602 HydrophobicContact CB-CZ 3.9Å; Q594-F602 HydrophobicContact CG-CE2 4.49Å; Q594-F602 VanDerWaalsContact OE1-CE2 3.26Å; F602-H604 WeakPolarHBondContact CE2-O 3.4Å; F602-H604 VanDerWaalsContact CZ-C 3.46Å; F602-K605 HydrophobicContact CE2-CB 4Å; F602-K605 HydrophobicContact CE2-CD 4.4Å; F602-K605 HydrophobicContact CE2-CG 4.47Å; F602-K605 HydrophobicContact CZ-CB 4.06Å; F602-K605 HydrophobicContact CZ-CD 4.16Å; F602-K605 HydrophobicContact CZ-CG 4.12Å
603	H	98.1	Very high	97.5	Very high	77 Å²	77	54.3 Å²	54.3	36%	0.356	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-65	173.9	-173.2	-75.8	0	0	0	110.9	Y582 I595 K597 A601	Y582-H603 AromaticContact CE1-CD2 3.57Å; I595-H603 HydrophobicContact CB-CB 4.44Å; I595-H603 HydrophobicContact CG2-CB 4.3Å; I595-H603 WeakPolarHBondContact O-CA 3.45Å; I595-H603 VanDerWaalsContact O-CB 3.26Å; I595-H603 WeakPolarHBondContact O-CB 3.16Å; I595-H603 PolarHBondContact O-N 3.49Å; K597-H603 HydrophobicContact CG-CB 4.21Å; A601-H603 PolarHBondContact O-N 3.28Å
604	H	98.5	Very high	97.4	Very high	37 Å²	37	55.3 Å²	55.3	17%	0.171	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	173	178.4	74.9	-71.1	0	0	0	111	I595 F602 F645	I595-H604 WeakPolarHBondContact CD1-CE1 3.34Å; I595-H604 WeakPolarHBondContact CD1-NE2 3.38Å; I595-H604 VanDerWaalsContact CG1-CE1 3.47Å; I595-H604 WeakPolarHBondContact CG1-CE1 3.27Å; I595-H604 PolarHBondContact N-O 2.95Å; I595-H604 PolarHBondContact O-N 3.02Å; F602-H604 WeakPolarHBondContact CE2-O 3.4Å; F602-H604 VanDerWaalsContact CZ-C 3.46Å; H604-F645 PolarHBondContact CE1-O 3.13Å; H604-F645 PolarHBondContact NE2-O 2.77Å
605	K	98.4	Very high	97.4	Very high	86 Å²	86	57.7 Å²	57.7	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	155.2	177.2	71.2	-169.4	-173.6	-169.7	0	111.2	D566 R592 I593 Q594 F602	D566-K605 WeakPolarHBondContact OD1-CD 3.28Å; D566-K605 WeakPolarHBondContact OD1-CE 3.43Å; D566-K605 IonicContact OD1-NZ 2.71Å; D566-K605 PolarHBondContact OD1-NZ 2.83Å; R592-K605 VanDerWaalsContact NH1-NZ 3.13Å; I593-K605 VanDerWaalsContact O-CA 3.27Å; I593-K605 WeakPolarHBondContact O-CA 3.46Å; I593-K605 WeakPolarHBondContact O-CB 3.32Å; Q594-K605 HydrophobicContact CG-CB 3.89Å; F602-K605 HydrophobicContact CE2-CB 4Å; F602-K605 HydrophobicContact CE2-CD 4.4Å; F602-K605 HydrophobicContact CE2-CG 4.47Å; F602-K605 HydrophobicContact CZ-CB 4.06Å; F602-K605 HydrophobicContact CZ-CD 4.16Å; F602-K605 HydrophobicContact CZ-CG 4.12Å
606	F	98.7	Very high	97.4	Very high	24 Å²	24	57.7 Å²	57.7	11%	0.105	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	160.2	171.8	64.1	-91.9	0	0	0	111.2	R592 I593 I595 F616 I630 F643	R592-F606 WeakPolarHBondContact CA-O 3.48Å; R592-F606 WeakPolarHBondContact CB-O 3.34Å; I593-F606 HydrophobicContact CB-CD1 4.47Å; I593-F606 HydrophobicContact CB-CE1 4.01Å; I593-F606 HydrophobicContact CB-CE2 4.03Å; I593-F606 HydrophobicContact CB-CZ 3.76Å; I593-F606 HydrophobicContact CG1-CE2 4.03Å; I593-F606 HydrophobicContact CG1-CZ 4.06Å; I593-F606 HydrophobicContact CG2-CE1 4.05Å; I593-F606 HydrophobicContact CG2-CZ 3.97Å; I593-F606 PolarHBondContact N-O 2.85Å; I593-F606 PolarHBondContact O-N 2.76Å; I595-F606 HydrophobicContact CD1-CD1 3.88Å; I595-F606 HydrophobicContact CD1-CE1 3.68Å; F606-F616 HydrophobicContact CD2-CE2 4.2Å; F606-F616 HydrophobicContact CD2-CZ 4.41Å; F606-F616 HydrophobicContact CE2-CE2 4.21Å; F606-F616 HydrophobicContact CE2-CZ 4.04Å; F606-I630 HydrophobicContact CE1-CD1 3.85Å; F606-I630 HydrophobicContact CZ-CB 4.48Å; F606-I630 HydrophobicContact CZ-CD1 4.06Å; F606-I630 HydrophobicContact CZ-CG2 4.24Å; F606-F643 HydrophobicContact CD2-CD1 4.3Å; F606-F643 HydrophobicContact CD2-CE1 4.47Å; F606-F643 HydrophobicContact CE2-CB 4.24Å; F606-F643 AromaticContact CE2-CD1 3.86Å; F606-F643 HydrophobicContact CE2-CD1 3.86Å; F606-F643 AromaticContact CE2-CD2 3.89Å; F606-F643 HydrophobicContact CE2-CD2 3.89Å; F606-F643 HydrophobicContact CE2-CE1 4.2Å; F606-F643 HydrophobicContact CE2-CE2 4.21Å; F606-F643 AromaticContact CE2-CG 3.72Å; F606-F643 HydrophobicContact CE2-CG 3.72Å; F606-F643 HydrophobicContact CE2-CZ 4.37Å; F606-F643 HydrophobicContact CZ-CB 4.21Å; F606-F643 HydrophobicContact CZ-CD2 4.35Å; F606-F643 HydrophobicContact CZ-CG 4.16Å
607	G	98	Very high	97.4	Very high	31 Å²	31	59.9 Å²	59.9	32%	0.32	34%	0.338	S	S	.	.			trans	102.6	153.7	-176.8	0	0	0	0	0	113.8	N591	N591-G607 CarbonylContact O-C 3.47Å
608	S	97.8	Very high	97.4	Very high	58 Å²	58	61.5 Å²	61.5	41%	0.406	34%	0.342	S	S	.	.			trans	-151.3	163.2	175.1	54.5	0	0	0	0	109	N591 G610 Q615 F616	N591-S608 CarbonylContact O-C 3.33Å; N591-S608 PolarHBondContact O-N 2.97Å; S608-G610 PolarHBondContact O-N 3.29Å; S608-Q615 CarbonylContact O-C 3.43Å; S608-Q615 VanDerWaalsContact O-CA 3.29Å; S608-Q615 WeakPolarHBondContact O-CA 3.35Å; S608-Q615 WeakPolarHBondContact O-CB 3.11Å; S608-F616 PolarHBondContact O-N 3.29Å
609	L	98.5	Very high	97.6	Very high	108 Å²	108	59 Å²	59	57%	0.565	33%	0.325	S	S	*	.	B	Isolated β-bridge	trans	-60	129.9	177.2	178.7	64.6	0	0	0	111.4	N591 F616 D617	N591-L609 HydrophobicContact CB-CB 4.09Å; N591-L609 HydrophobicContact CB-CD1 4.42Å; L609-F616 CarbonylContact C-O 3.44Å; L609-F616 VanDerWaalsContact CA-O 3.25Å; L609-F616 WeakPolarHBondContact CA-O 3.46Å; L609-D617 HydrophobicContact CD1-CB 4.37Å
610	G	98	Very high	97.9	Very high	20 Å²	20	54.4 Å²	54.4	21%	0.206	29%	0.294	C	S	.	.	S	Bend	trans	151.5	-172.1	170.6	0	0	0	0	0	113.7	S608 Q615 F616 N637	S608-G610 PolarHBondContact O-N 3.29Å; G610-Q615 CarbonylContact O-C 3.54Å; G610-F616 PolarHBondContact N-O 3.32Å; G610-F616 CarbonylContact O-C 3.57Å; G610-F616 VanDerWaalsContact O-C 3.32Å; G610-F616 PolarHBondContact O-N 3.06Å; G610-N637 PolarHBondContact O-ND2 2.84Å
611	S	97.6	Very high	98.1	Very high	81 Å²	81	54 Å²	54	57%	0.566	29%	0.29	S	S	*	.	S	Bend	trans	-117.5	-0.7	-173.6	61.5	0	0	0	0	114	N637 R639	S611-N637 WeakPolarHBondContact CB-OD1 3.43Å; S611-R639 PolarHBondContact O-NH1 2.92Å; S611-R639 PolarHBondContact O-NH2 2.74Å
612	R	98.1	Very high	98.2	Very high	183 Å²	183	51.9 Å²	51.9	69%	0.691	27%	0.272	S	S	*	.	S	Bend	trans	-71.8	161.4	174.6	-61.1	-179.7	-179.6	-116	0.4	110.9	G614 Q615 R639	R612-G614 PolarHBondContact O-N 2.81Å; R612-Q615 HydrophobicContact CB-CG 4.16Å; R612-Q615 VanDerWaalsContact CB-OE1 3.29Å; R612-Q615 VanDerWaalsContact N-OE1 3.12Å; R612-Q615 WeakPolarHBondContact O-CB 3.41Å; R612-Q615 PolarHBondContact O-N 2.88Å; R612-R639 PolarHBondContact O-NH2 3.41Å
613	P	98.1	Very high	98.2	Very high	73 Å²	73	49.1 Å²	49.1	47%	0.474	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	131.5	169.7	-25.4	35.4	0	0	0	111.2	Q615 F649 K652	P613-Q615 VanDerWaalsContact C-N 3.27Å; P613-Q615 PolarHBondContact O-N 3.11Å; P613-F649 HydrophobicContact CB-CD1 3.97Å; P613-F649 HydrophobicContact CB-CD2 4.01Å; P613-F649 HydrophobicContact CB-CE1 3.83Å; P613-F649 HydrophobicContact CB-CE2 3.87Å; P613-F649 HydrophobicContact CB-CG 4.05Å; P613-F649 HydrophobicContact CB-CZ 3.78Å; P613-K652 HydrophobicContact CG-CD 4.41Å
614	G	96.4	Very high	98.1	Very high	20 Å²	20	46.3 Å²	46.3	21%	0.206	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	-2	-175.7	0	0	0	0	0	116.2	R612	R612-G614 PolarHBondContact O-N 2.81Å
615	Q	98.6	Very high	97.9	Very high	50 Å²	50	45 Å²	45	23%	0.234	24%	0.244	C	C	.	.			trans	-99.1	157.1	166.5	-61.7	-176.7	-34.7	0	0	110.4	S608 G610 R612 P613 R639 Q641	S608-Q615 CarbonylContact O-C 3.43Å; S608-Q615 VanDerWaalsContact O-CA 3.29Å; S608-Q615 WeakPolarHBondContact O-CA 3.35Å; S608-Q615 WeakPolarHBondContact O-CB 3.11Å; G610-Q615 CarbonylContact O-C 3.54Å; R612-Q615 HydrophobicContact CB-CG 4.16Å; R612-Q615 VanDerWaalsContact CB-OE1 3.29Å; R612-Q615 VanDerWaalsContact N-OE1 3.12Å; R612-Q615 WeakPolarHBondContact O-CB 3.41Å; R612-Q615 PolarHBondContact O-N 2.88Å; P613-Q615 VanDerWaalsContact C-N 3.27Å; P613-Q615 PolarHBondContact O-N 3.11Å; Q615-R639 PolarHBondContact O-NH2 3.15Å; Q615-Q641 PolarHBondContact O-NE2 3.06Å
616	F	98.7	Very high	97.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-130.4	155.2	-178.1	-56.8	-67.7	0	0	0	111.9	I593 F606 S608 L609 G610 P619 V632 D634 Q641 F643	I593-F616 HydrophobicContact CG1-CE2 3.98Å; I593-F616 HydrophobicContact CG1-CZ 4.06Å; F606-F616 HydrophobicContact CD2-CE2 4.2Å; F606-F616 HydrophobicContact CD2-CZ 4.41Å; F606-F616 HydrophobicContact CE2-CE2 4.21Å; F606-F616 HydrophobicContact CE2-CZ 4.04Å; S608-F616 PolarHBondContact O-N 3.29Å; L609-F616 CarbonylContact C-O 3.44Å; L609-F616 VanDerWaalsContact CA-O 3.25Å; L609-F616 WeakPolarHBondContact CA-O 3.46Å; G610-F616 PolarHBondContact N-O 3.32Å; G610-F616 CarbonylContact O-C 3.57Å; G610-F616 VanDerWaalsContact O-C 3.32Å; G610-F616 PolarHBondContact O-N 3.06Å; F616-P619 HydrophobicContact CB-CB 4.09Å; F616-P619 HydrophobicContact CB-CG 3.81Å; F616-P619 HydrophobicContact CD1-CB 4.17Å; F616-P619 HydrophobicContact CD2-CG 4.45Å; F616-P619 HydrophobicContact CG-CB 4.11Å; F616-P619 HydrophobicContact CG-CG 4.08Å; F616-V632 HydrophobicContact CD1-CG1 4.14Å; F616-V632 HydrophobicContact CE1-CB 4.03Å; F616-V632 HydrophobicContact CE1-CG1 3.7Å; F616-V632 HydrophobicContact CE1-CG2 4.33Å; F616-V632 HydrophobicContact CZ-CB 4.49Å; F616-V632 HydrophobicContact CZ-CG1 4.28Å; F616-V632 HydrophobicContact CZ-CG2 4.3Å; F616-D634 WeakPolarHBondContact CA-OD1 3.47Å; F616-D634 HydrophobicContact CD1-CB 4.15Å; F616-Q641 HydrophobicContact CE1-CB 4.44Å; F616-F643 AromaticContact CE1-CE2 3.7Å; F616-F643 HydrophobicContact CE1-CE2 3.7Å; F616-F643 AromaticContact CE1-CZ 3.77Å; F616-F643 HydrophobicContact CE1-CZ 3.77Å; F616-F643 HydrophobicContact CE2-CZ 4.47Å; F616-F643 HydrophobicContact CZ-CD2 4.44Å; F616-F643 HydrophobicContact CZ-CE1 4.37Å; F616-F643 AromaticContact CZ-CE2 3.47Å; F616-F643 HydrophobicContact CZ-CE2 3.47Å; F616-F643 VanDerWaalsContact CZ-CE2 3.47Å; F616-F643 AromaticContact CZ-CZ 3.43Å; F616-F643 HydrophobicContact CZ-CZ 3.43Å; F616-F643 VanDerWaalsContact CZ-CZ 3.43Å
617	D	98.4	Very high	97.3	Very high	50 Å²	50	49.1 Å²	49.1	27%	0.267	27%	0.271	S	S	.	.	S	Bend	trans	-129.8	105.6	163.8	-168.4	-7	0	0	0	108.4	L609 D634 D636 N637	L609-D617 HydrophobicContact CD1-CB 4.37Å; D617-D634 PolarHBondContact N-OD1 3.18Å; D617-D636 HydrophobicContact CB-CB 3.98Å; D617-D636 WeakPolarHBondContact O-CB 3.37Å; D617-D636 PolarHBondContact O-N 3.3Å; D617-N637 PolarHBondContact N-ND2 3.15Å
618	R	98	Very high	97.2	Very high	125 Å²	125	50.9 Å²	50.9	47%	0.472	27%	0.268	S	S	.	.	S	Bend	trans	49.2	61.1	-174.4	-57.4	-163.9	-172.6	132.6	-7.7	113.7	R588 N591 A620 K635 D636	R588-R618 HydrophobicContact CG-CB 3.8Å; R588-R618 WeakPolarHBondContact O-CA 3.06Å; N591-R618 PolarHBondContact OD1-N 3.39Å; R618-A620 PolarHBondContact O-N 3.27Å; R618-K635 WeakPolarHBondContact O-CB 3.38Å; R618-D636 VanDerWaalsContact CD-OD2 3.22Å; R618-D636 WeakPolarHBondContact CD-OD2 3.28Å; R618-D636 IonicContact CZ-OD2 2.76Å; R618-D636 IonicContact NE-OD2 2.78Å; R618-D636 IonicContact NH1-OD2 3.45Å; R618-D636 PolarHBondContact NH1-OD2 2.98Å
619	P	98.4	Very high	97.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	127.9	177	28.4	-32.5	0	0	0	109.4	R588 I593 F616 V632 A633	R588-P619 WeakPolarHBondContact CA-O 3.43Å; R588-P619 WeakPolarHBondContact CB-O 3.33Å; R588-P619 VanDerWaalsContact CG-O 3.3Å; R588-P619 WeakPolarHBondContact CG-O 3.46Å; I593-P619 HydrophobicContact CD1-CB 4.17Å; I593-P619 HydrophobicContact CD1-CG 4.39Å; F616-P619 HydrophobicContact CB-CB 4.09Å; F616-P619 HydrophobicContact CB-CG 3.81Å; F616-P619 HydrophobicContact CD1-CB 4.17Å; F616-P619 HydrophobicContact CD2-CG 4.45Å; F616-P619 HydrophobicContact CG-CB 4.11Å; F616-P619 HydrophobicContact CG-CG 4.08Å; P619-V632 HydrophobicContact CB-CG1 3.75Å; P619-A633 WeakPolarHBondContact CA-O 3.48Å
620	A	98.1	Very high	97.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-62.6	-169.2	0	0	0	0	0	111.9	G574 A586 R618 A633 K635 W667	G574-A620 WeakPolarHBondContact CA-O 3.34Å; G574-A620 PolarHBondContact N-O 2.89Å; A586-A620 WeakPolarHBondContact CB-O 3.32Å; R618-A620 PolarHBondContact O-N 3.27Å; A620-A633 PolarHBondContact N-O 2.84Å; A620-K635 HydrophobicContact CB-CB 4Å; A620-K635 HydrophobicContact CB-CD 4Å; A620-W667 CarbonylContact C-O 3.55Å; A620-W667 HydrophobicContact CB-CG 4.32Å; A620-W667 WeakPolarHBondContact CB-O 3.47Å
621	G	98.1	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	153.2	179.9	0	0	0	0	0	113.1	A633 W667 D668	G621-A633 PolarHBondContact O-N 3.49Å; G621-W667 WeakPolarHBondContact CA-O 3.3Å; G621-W667 PolarHBondContact N-O 3.16Å; G621-D668 WeakPolarHBondContact CA-OD1 3.48Å
622	V	98.6	Very high	97.3	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	141.7	174	65.1	0	0	0	0	110.4	S576 V584 A586 I630 I631 V632	S576-V622 WeakPolarHBondContact CB-O 3.18Å; V584-V622 HydrophobicContact CB-CG2 4.39Å; V584-V622 HydrophobicContact CG1-CG1 4.44Å; V584-V622 HydrophobicContact CG1-CG2 3.63Å; V584-V622 WeakPolarHBondContact O-CG1 3.39Å; A586-V622 HydrophobicContact CB-CB 4.4Å; A586-V622 HydrophobicContact CB-CG1 4.32Å; V622-I630 HydrophobicContact CG2-CG2 3.55Å; V622-I631 CarbonylContact C-O 3.54Å; V622-I631 VanDerWaalsContact CA-O 3.28Å; V622-I631 WeakPolarHBondContact CA-O 3.46Å; V622-V632 HydrophobicContact CG2-CG2 4.35Å
623	A	98.4	Very high	97.3	Very high	5 Å²	5	31.2 Å²	31.2	4%	0.041	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.9	174.3	0	0	0	0	0	110.9	I631 V669 V671	A623-I631 PolarHBondContact N-O 3.12Å; A623-I631 PolarHBondContact O-N 2.84Å; A623-V669 HydrophobicContact CB-CG1 4.11Å; A623-V671 HydrophobicContact CB-CG1 4.09Å
624	C	96.9	Very high	97.3	Very high	17 Å²	17	27.7 Å²	27.7	12%	0.115	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.7	171.4	-71.1	0	0	0	0	110.4	S576 D578 V584 R629 V671	S576-C624 PolarHBondContact OG-N 3.08Å; S576-C624 VanDerWaalsContact OG-N 3.12Å; D578-C624 HydrophobicContact CB-CB 4.3Å; V584-C624 VanDerWaalsContact CG2-SG 3.56Å; C624-R629 WeakPolarHBondContact CA-O 3.45Å; C624-V671 VanDerWaalsContact O-CG1 3.27Å; C624-V671 WeakPolarHBondContact O-CG1 3.33Å
625	D	94.5	Very high	97.4	Very high	11 Å²	11	27.5 Å²	27.5	6%	0.059	13%	0.129	C	C	.	.			trans	-91	179.1	177.6	76.4	7.1	0	0	0	113.3	Q627 R628 R629 I631 V671	D625-Q627 PolarHBondContact O-N 3.4Å; D625-Q627 WeakPolarHBondContact OD1-CA 3.4Å; D625-Q627 WeakPolarHBondContact OD1-CB 3.43Å; D625-Q627 PolarHBondContact OD1-N 3.26Å; D625-R628 PolarHBondContact O-N 3.46Å; D625-R628 PolarHBondContact OD1-N 3.21Å; D625-R628 VanDerWaalsContact OD1-N 3.09Å; D625-R629 PolarHBondContact N-O 2.8Å; D625-R629 VanDerWaalsContact N-O 3.09Å; D625-R629 WeakPolarHBondContact OD1-CB 3.23Å; D625-R629 PolarHBondContact OD1-N 2.89Å; D625-R629 IonicContact OD2-CZ 3.97Å; D625-R629 IonicContact OD2-NE 3.2Å; D625-R629 PolarHBondContact OD2-NE 3.26Å; D625-R629 IonicContact OD2-NH2 3.41Å; D625-R629 PolarHBondContact OD2-NH2 2.84Å; D625-I631 HydrophobicContact CB-CD1 4.1Å; D625-V671 HydrophobicContact CB-CB 4.42Å; D625-V671 HydrophobicContact CB-CG1 3.81Å; D625-V671 HydrophobicContact CB-CG2 3.81Å
626	S	90.9	Very high	97.4	Very high	53 Å²	53	26.4 Å²	26.4	37%	0.371	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.6	179.7	56.2	0	0	0	0	114
627	Q	92.9	Very high	97.4	Very high	143 Å²	143	28 Å²	28	67%	0.668	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	7.3	175.2	-61.3	178.7	-3.8	0	0	112.3	D625 R629	D625-Q627 PolarHBondContact O-N 3.4Å; D625-Q627 WeakPolarHBondContact OD1-CA 3.4Å; D625-Q627 WeakPolarHBondContact OD1-CB 3.43Å; D625-Q627 PolarHBondContact OD1-N 3.26Å; Q627-R629 HydrophobicContact CB-CG 4.23Å; Q627-R629 PolarHBondContact O-N 2.79Å
628	R	95.4	Very high	97.4	Very high	67 Å²	67	26.2 Å²	26.2	25%	0.253	12%	0.123	S	C	.	.			trans	61.1	23.5	-174.2	-52.1	-179.3	70.9	167.5	13.6	113.9	D578 E580 D625 F645	D578-R628 IonicContact OD2-CZ 2.88Å; D578-R628 IonicContact OD2-NE 2.79Å; D578-R628 PolarHBondContact OD2-NE 3Å; D578-R628 IonicContact OD2-NH2 3.64Å; D578-R628 PolarHBondContact OD2-NH2 2.82Å; E580-R628 VanDerWaalsContact CD-CZ 3.46Å; E580-R628 IonicContact OE1-CZ 2.76Å; E580-R628 IonicContact OE1-NH1 2.71Å; E580-R628 PolarHBondContact OE1-NH1 3.14Å; E580-R628 IonicContact OE1-NH2 3.52Å; E580-R628 IonicContact OE2-CZ 3.15Å; E580-R628 IonicContact OE2-NH1 3.19Å; E580-R628 PolarHBondContact OE2-NH1 2.92Å; E580-R628 IonicContact OE2-NH2 2.93Å; E580-R628 PolarHBondContact OE2-NH2 2.83Å; D625-R628 PolarHBondContact O-N 3.46Å; D625-R628 PolarHBondContact OD1-N 3.21Å; D625-R628 VanDerWaalsContact OD1-N 3.09Å; R628-F645 HydrophobicContact CB-CB 4.21Å; R628-F645 HydrophobicContact CB-CD2 4.41Å; R628-F645 WeakPolarHBondContact O-CB 3.29Å; R628-F645 PolarHBondContact O-N 2.95Å
629	R	97.7	Very high	97.4	Very high	37 Å²	37	20.8 Å²	20.8	14%	0.14	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-73.8	140.8	168.6	-56.9	-175.4	-59.1	159.1	8.4	109.1	C624 D625 Q627 V642 F643 L650 P692	C624-R629 WeakPolarHBondContact CA-O 3.45Å; D625-R629 PolarHBondContact N-O 2.8Å; D625-R629 VanDerWaalsContact N-O 3.09Å; D625-R629 WeakPolarHBondContact OD1-CB 3.23Å; D625-R629 PolarHBondContact OD1-N 2.89Å; D625-R629 IonicContact OD2-CZ 3.97Å; D625-R629 IonicContact OD2-NE 3.2Å; D625-R629 PolarHBondContact OD2-NE 3.26Å; D625-R629 IonicContact OD2-NH2 3.41Å; D625-R629 PolarHBondContact OD2-NH2 2.84Å; Q627-R629 HydrophobicContact CB-CG 4.23Å; Q627-R629 PolarHBondContact O-N 2.79Å; R629-V642 HydrophobicContact CB-CG1 4.06Å; R629-F643 CarbonylContact C-O 3.53Å; R629-F643 WeakPolarHBondContact CA-O 3.14Å; R629-F643 WeakPolarHBondContact CB-O 3.41Å; R629-L650 HydrophobicContact CG-CD1 4.12Å; R629-P692 PolarHBondContact NH1-O 2.8Å
630	I	98.6	Very high	97.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117.2	178.1	-59.4	173.7	0	0	0	108.3	V584 I595 F606 V622 V632 V642 F643 F645	V584-I630 HydrophobicContact CG1-CD1 4.18Å; V584-I630 HydrophobicContact CG1-CG2 4.07Å; V584-I630 HydrophobicContact CG2-CD1 4.38Å; I595-I630 HydrophobicContact CD1-CD1 4.41Å; I595-I630 HydrophobicContact CG1-CD1 4.24Å; F606-I630 HydrophobicContact CE1-CD1 3.85Å; F606-I630 HydrophobicContact CZ-CB 4.48Å; F606-I630 HydrophobicContact CZ-CD1 4.06Å; F606-I630 HydrophobicContact CZ-CG2 4.24Å; V622-I630 HydrophobicContact CG2-CG2 3.55Å; I630-V632 HydrophobicContact CG2-CG2 3.93Å; I630-V642 CarbonylContact O-C 3.56Å; I630-V642 WeakPolarHBondContact O-CA 3.19Å; I630-F643 HydrophobicContact CB-CB 4.42Å; I630-F643 PolarHBondContact N-O 2.67Å; I630-F643 PolarHBondContact O-N 2.81Å; I630-F645 HydrophobicContact CD1-CD2 4.33Å
631	I	98.8	Very high	97.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.1	177.2	-55.4	91.5	0	0	0	108.3	V622 A623 D625 V640 Q641 V642 V669 V671 I677	V622-I631 CarbonylContact C-O 3.54Å; V622-I631 VanDerWaalsContact CA-O 3.28Å; V622-I631 WeakPolarHBondContact CA-O 3.46Å; A623-I631 PolarHBondContact N-O 3.12Å; A623-I631 PolarHBondContact O-N 2.84Å; D625-I631 HydrophobicContact CB-CD1 4.1Å; I631-V640 HydrophobicContact CG2-CG1 3.43Å; I631-V640 VanDerWaalsContact CG2-CG1 3.43Å; I631-Q641 CarbonylContact C-O 3.48Å; I631-Q641 WeakPolarHBondContact CA-O 3.42Å; I631-V642 HydrophobicContact CG1-CG1 4.22Å; I631-V642 HydrophobicContact CG1-CG2 4.03Å; I631-V642 HydrophobicContact CG2-CG2 4.24Å; I631-V669 HydrophobicContact CB-CG2 4.44Å; I631-V669 HydrophobicContact CG2-CG1 4.39Å; I631-V669 HydrophobicContact CG2-CG2 3.68Å; I631-V669 WeakPolarHBondContact O-CG1 3.19Å; I631-V671 HydrophobicContact CD1-CB 4.48Å; I631-V671 HydrophobicContact CD1-CG1 4.41Å; I631-I677 HydrophobicContact CG1-CD1 4.35Å; I631-I677 HydrophobicContact CG2-CD1 4.37Å; I631-I677 HydrophobicContact CG2-CG2 4.1Å
632	V	98.9	Very high	97.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.6	-172.9	-177.2	0	0	0	0	110.4	I593 F616 P619 V622 I630 D634 V640 Q641 F643	I593-V632 HydrophobicContact CD1-CG1 3.82Å; I593-V632 HydrophobicContact CD1-CG2 3.96Å; I593-V632 HydrophobicContact CG1-CG1 4.37Å; I593-V632 HydrophobicContact CG1-CG2 3.83Å; F616-V632 HydrophobicContact CD1-CG1 4.14Å; F616-V632 HydrophobicContact CE1-CB 4.03Å; F616-V632 HydrophobicContact CE1-CG1 3.7Å; F616-V632 HydrophobicContact CE1-CG2 4.33Å; F616-V632 HydrophobicContact CZ-CB 4.49Å; F616-V632 HydrophobicContact CZ-CG1 4.28Å; F616-V632 HydrophobicContact CZ-CG2 4.3Å; P619-V632 HydrophobicContact CB-CG1 3.75Å; V622-V632 HydrophobicContact CG2-CG2 4.35Å; I630-V632 HydrophobicContact CG2-CG2 3.93Å; V632-D634 PolarHBondContact O-N 2.8Å; V632-V640 WeakPolarHBondContact O-CA 3.4Å; V632-Q641 PolarHBondContact N-O 3.27Å; V632-Q641 PolarHBondContact O-N 3.32Å; V632-F643 HydrophobicContact CB-CE2 4.46Å; V632-F643 HydrophobicContact CG2-CD2 4.11Å; V632-F643 HydrophobicContact CG2-CE2 4.11Å
633	A	98.7	Very high	97.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	99.8	167.8	0	0	0	0	0	109.7	P619 A620 G621 K635 W667 V669	P619-A633 WeakPolarHBondContact CA-O 3.48Å; A620-A633 PolarHBondContact N-O 2.84Å; G621-A633 PolarHBondContact O-N 3.49Å; A633-K635 PolarHBondContact O-N 3.32Å; A633-K635 VanDerWaalsContact O-N 3.1Å; A633-W667 WeakPolarHBondContact CB-O 3.41Å; A633-V669 HydrophobicContact CB-CB 4.38Å; A633-V669 HydrophobicContact CB-CG1 4.35Å
634	D	98.6	Very high	97.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	80	-179.4	-173.1	10.8	0	0	0	109.5	F616 D617 V632 D636 N637 H638 R639 Q641	F616-D634 WeakPolarHBondContact CA-OD1 3.47Å; F616-D634 HydrophobicContact CD1-CB 4.15Å; D617-D634 PolarHBondContact N-OD1 3.18Å; V632-D634 PolarHBondContact O-N 2.8Å; D634-D636 PolarHBondContact O-N 2.64Å; D634-N637 HydrophobicContact CB-CB 4.44Å; D634-N637 VanDerWaalsContact CG-ND2 3.34Å; D634-N637 CarbonylContact O-C 3.58Å; D634-N637 PolarHBondContact O-N 3.09Å; D634-N637 PolarHBondContact OD1-ND2 2.95Å; D634-N637 VanDerWaalsContact OD1-ND2 3.16Å; D634-N637 WeakPolarHBondContact OD2-CB 3.47Å; D634-N637 PolarHBondContact OD2-ND2 2.83Å; D634-H638 PolarHBondContact O-N 3.47Å; D634-H638 VanDerWaalsContact O-N 3.12Å; D634-R639 WeakPolarHBondContact CA-O 3.45Å; D634-R639 HydrophobicContact CB-CG 3.84Å; D634-R639 WeakPolarHBondContact CB-O 3.37Å; D634-R639 PolarHBondContact N-O 2.82Å; D634-R639 PolarHBondContact O-N 3.26Å; D634-R639 IonicContact OD2-CZ 3.76Å; D634-R639 IonicContact OD2-NE 2.73Å; D634-R639 PolarHBondContact OD2-NE 2.65Å; D634-R639 IonicContact OD2-NH2 3.74Å; D634-R639 PolarHBondContact OD2-NH2 2.73Å; D634-Q641 PolarHBondContact OD2-NE2 2.79Å
635	K	98.3	Very high	97.5	Very high	16 Å²	16	21.7 Å²	21.7	7%	0.07	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-53.2	-160.3	-177.2	-177.7	67.2	78.5	0	114.4	R618 A620 A633 N637 H638 Y665 P666 W667	R618-K635 WeakPolarHBondContact O-CB 3.38Å; A620-K635 HydrophobicContact CB-CB 4Å; A620-K635 HydrophobicContact CB-CD 4Å; A633-K635 PolarHBondContact O-N 3.32Å; A633-K635 VanDerWaalsContact O-N 3.1Å; K635-N637 VanDerWaalsContact C-N 3.33Å; K635-H638 PolarHBondContact O-N 2.87Å; K635-Y665 HydrophobicContact CG-CD1 4.06Å; K635-P666 VanDerWaalsContact CA-O 3.31Å; K635-P666 WeakPolarHBondContact CA-O 3.41Å; K635-P666 WeakPolarHBondContact CB-O 3.39Å; K635-P666 WeakPolarHBondContact CG-O 3.39Å; K635-W667 HydrophobicContact CD-CD2 3.98Å; K635-W667 HydrophobicContact CD-CE3 3.54Å; K635-W667 HydrophobicContact CD-CH2 4.36Å; K635-W667 HydrophobicContact CD-CZ3 3.76Å
636	D	98.2	Very high	97.7	Very high	26 Å²	26	26.8 Å²	26.8	14%	0.139	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-16.2	-173.4	-71.7	0.7	0	0	0	111.7	D617 R618 D634 H638 Y665	D617-D636 HydrophobicContact CB-CB 3.98Å; D617-D636 WeakPolarHBondContact O-CB 3.37Å; D617-D636 PolarHBondContact O-N 3.3Å; R618-D636 VanDerWaalsContact CD-OD2 3.22Å; R618-D636 WeakPolarHBondContact CD-OD2 3.28Å; R618-D636 IonicContact CZ-OD2 2.76Å; R618-D636 IonicContact NE-OD2 2.78Å; R618-D636 IonicContact NH1-OD2 3.45Å; R618-D636 PolarHBondContact NH1-OD2 2.98Å; D634-D636 PolarHBondContact O-N 2.64Å; D636-H638 VanDerWaalsContact C-N 3.31Å; D636-H638 PolarHBondContact O-CD2 2.84Å; D636-Y665 VanDerWaalsContact OD1-CD1 3.29Å; D636-Y665 WeakPolarHBondContact OD1-CD1 3.48Å; D636-Y665 VanDerWaalsContact OD1-CE1 3.26Å; D636-Y665 WeakPolarHBondContact OD1-CE1 3.34Å
637	N	98.6	Very high	98	Very high	33 Å²	33	25 Å²	25	18%	0.176	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-0.8	166.1	-76.3	-44.4	0	0	0	113.8	G610 S611 D617 D634 K635 R639	G610-N637 PolarHBondContact O-ND2 2.84Å; S611-N637 WeakPolarHBondContact CB-OD1 3.43Å; D617-N637 PolarHBondContact N-ND2 3.15Å; D634-N637 HydrophobicContact CB-CB 4.44Å; D634-N637 VanDerWaalsContact CG-ND2 3.34Å; D634-N637 CarbonylContact O-C 3.58Å; D634-N637 PolarHBondContact O-N 3.09Å; D634-N637 PolarHBondContact OD1-ND2 2.95Å; D634-N637 VanDerWaalsContact OD1-ND2 3.16Å; D634-N637 WeakPolarHBondContact OD2-CB 3.47Å; D634-N637 PolarHBondContact OD2-ND2 2.83Å; K635-N637 VanDerWaalsContact C-N 3.33Å; N637-R639 VanDerWaalsContact C-N 3.32Å; N637-R639 HydrophobicContact CB-CG 4.01Å; N637-R639 PolarHBondContact O-N 3.23Å
638	H	98.6	Very high	98.2	Very high	13 Å²	13	24.4 Å²	24.4	6%	0.06	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	38	176.8	-57.9	-91.3	0	0	0	114.6	D634 K635 D636 G654 E655 K656 F663 Y665	D634-H638 PolarHBondContact O-N 3.47Å; D634-H638 VanDerWaalsContact O-N 3.12Å; K635-H638 PolarHBondContact O-N 2.87Å; D636-H638 VanDerWaalsContact C-N 3.31Å; D636-H638 PolarHBondContact O-CD2 2.84Å; H638-G654 CarbonylContact O-C 3.48Å; H638-E655 CarbonylContact O-C 3.5Å; H638-E655 WeakPolarHBondContact O-CA 3.49Å; H638-E655 PolarHBondContact O-N 3.41Å; H638-K656 HydrophobicContact CB-CB 3.9Å; H638-F663 PolarHBondContact ND1-O 2.96Å; H638-Y665 AromaticContact CE1-CD2 3.94Å; H638-Y665 AromaticContact CE1-CE2 3.98Å; H638-Y665 PolarHBondContact ND1-N 2.86Å
639	R	98.5	Very high	98.4	Very high	12 Å²	12	25 Å²	25	5%	0.045	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	168.9	-175.2	70	-175.7	179.9	-176.8	4.3	112.5	S611 R612 Q615 D634 N637 Q641 F653 G654	S611-R639 PolarHBondContact O-NH1 2.92Å; S611-R639 PolarHBondContact O-NH2 2.74Å; R612-R639 PolarHBondContact O-NH2 3.41Å; Q615-R639 PolarHBondContact O-NH2 3.15Å; D634-R639 WeakPolarHBondContact CA-O 3.45Å; D634-R639 HydrophobicContact CB-CG 3.84Å; D634-R639 WeakPolarHBondContact CB-O 3.37Å; D634-R639 PolarHBondContact N-O 2.82Å; D634-R639 PolarHBondContact O-N 3.26Å; D634-R639 IonicContact OD2-CZ 3.76Å; D634-R639 IonicContact OD2-NE 2.73Å; D634-R639 PolarHBondContact OD2-NE 2.65Å; D634-R639 IonicContact OD2-NH2 3.74Å; D634-R639 PolarHBondContact OD2-NH2 2.73Å; N637-R639 VanDerWaalsContact C-N 3.32Å; N637-R639 HydrophobicContact CB-CG 4.01Å; N637-R639 PolarHBondContact O-N 3.23Å; R639-Q641 HydrophobicContact CG-CG 4.34Å; R639-F653 WeakPolarHBondContact CB-O 3.46Å; R639-G654 WeakPolarHBondContact CB-O 3.37Å
640	V	98.8	Very high	98.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.7	167.7	178.8	0	0	0	0	108.8	I631 V632 K652 F653 F663 V679	I631-V640 HydrophobicContact CG2-CG1 3.43Å; I631-V640 VanDerWaalsContact CG2-CG1 3.43Å; V632-V640 WeakPolarHBondContact O-CA 3.4Å; V640-K652 VanDerWaalsContact O-CA 3.27Å; V640-K652 WeakPolarHBondContact O-CA 3.05Å; V640-F653 HydrophobicContact CB-CD1 4.43Å; V640-F653 HydrophobicContact CB-CD2 4.4Å; V640-F653 HydrophobicContact CB-CE1 3.94Å; V640-F653 HydrophobicContact CB-CE2 3.9Å; V640-F653 HydrophobicContact CB-CZ 3.65Å; V640-F653 HydrophobicContact CG1-CE1 3.81Å; V640-F653 HydrophobicContact CG1-CE2 4.39Å; V640-F653 HydrophobicContact CG1-CZ 3.65Å; V640-F653 HydrophobicContact CG2-CE2 4.18Å; V640-F653 HydrophobicContact CG2-CZ 4.22Å; V640-F653 PolarHBondContact N-O 3.39Å; V640-F653 PolarHBondContact O-N 3.46Å; V640-F663 HydrophobicContact CG2-CE2 4.1Å; V640-F663 HydrophobicContact CG2-CZ 4.17Å; V640-V679 HydrophobicContact CG2-CG1 4.21Å; V640-V679 HydrophobicContact CG2-CG2 3.9Å
641	Q	98.8	Very high	98.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.9	176.2	-65.1	-168.4	80.6	0	0	110.4	Q615 F616 I631 V632 D634 R639 F643 K652	Q615-Q641 PolarHBondContact O-NE2 3.06Å; F616-Q641 HydrophobicContact CE1-CB 4.44Å; I631-Q641 CarbonylContact C-O 3.48Å; I631-Q641 WeakPolarHBondContact CA-O 3.42Å; V632-Q641 PolarHBondContact N-O 3.27Å; V632-Q641 PolarHBondContact O-N 3.32Å; D634-Q641 PolarHBondContact OD2-NE2 2.79Å; R639-Q641 HydrophobicContact CG-CG 4.34Å; Q641-F643 HydrophobicContact CB-CD2 4.37Å; Q641-F643 HydrophobicContact CB-CE2 3.39Å; Q641-F643 HydrophobicContact CB-CZ 3.75Å; Q641-K652 HydrophobicContact CG-CB 3.91Å
642	V	98.6	Very high	98.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.8	-179.9	-175.6	0	0	0	0	109.3	R629 I630 I631 L650 L651 F653	R629-V642 HydrophobicContact CB-CG1 4.06Å; I630-V642 CarbonylContact O-C 3.56Å; I630-V642 WeakPolarHBondContact O-CA 3.19Å; I631-V642 HydrophobicContact CG1-CG1 4.22Å; I631-V642 HydrophobicContact CG1-CG2 4.03Å; I631-V642 HydrophobicContact CG2-CG2 4.24Å; V642-L650 HydrophobicContact CG1-CD1 4.31Å; V642-L650 WeakPolarHBondContact O-CB 3.44Å; V642-L650 PolarHBondContact O-N 3.35Å; V642-L651 HydrophobicContact CB-CD1 3.96Å; V642-L651 HydrophobicContact CB-CG 3.99Å; V642-L651 HydrophobicContact CG2-CD1 3.54Å; V642-L651 HydrophobicContact CG2-CG 4.11Å; V642-L651 PolarHBondContact N-O 2.89Å; V642-L651 PolarHBondContact O-N 2.88Å; V642-F653 HydrophobicContact CG2-CE1 4.44Å
643	F	98.8	Very high	98.3	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.009	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	160.3	-175.6	-59.5	-93.2	0	0	0	111.3	F606 F616 R629 I630 V632 Q641 Q648 F649	F606-F643 HydrophobicContact CD2-CD1 4.3Å; F606-F643 HydrophobicContact CD2-CE1 4.47Å; F606-F643 HydrophobicContact CE2-CB 4.24Å; F606-F643 AromaticContact CE2-CD1 3.86Å; F606-F643 HydrophobicContact CE2-CD1 3.86Å; F606-F643 AromaticContact CE2-CD2 3.89Å; F606-F643 HydrophobicContact CE2-CD2 3.89Å; F606-F643 HydrophobicContact CE2-CE1 4.2Å; F606-F643 HydrophobicContact CE2-CE2 4.21Å; F606-F643 AromaticContact CE2-CG 3.72Å; F606-F643 HydrophobicContact CE2-CG 3.72Å; F606-F643 HydrophobicContact CE2-CZ 4.37Å; F606-F643 HydrophobicContact CZ-CB 4.21Å; F606-F643 HydrophobicContact CZ-CD2 4.35Å; F606-F643 HydrophobicContact CZ-CG 4.16Å; F616-F643 AromaticContact CE1-CE2 3.7Å; F616-F643 HydrophobicContact CE1-CE2 3.7Å; F616-F643 AromaticContact CE1-CZ 3.77Å; F616-F643 HydrophobicContact CE1-CZ 3.77Å; F616-F643 HydrophobicContact CE2-CZ 4.47Å; F616-F643 HydrophobicContact CZ-CD2 4.44Å; F616-F643 HydrophobicContact CZ-CE1 4.37Å; F616-F643 AromaticContact CZ-CE2 3.47Å; F616-F643 HydrophobicContact CZ-CE2 3.47Å; F616-F643 VanDerWaalsContact CZ-CE2 3.47Å; F616-F643 AromaticContact CZ-CZ 3.43Å; F616-F643 HydrophobicContact CZ-CZ 3.43Å; F616-F643 VanDerWaalsContact CZ-CZ 3.43Å; R629-F643 CarbonylContact C-O 3.53Å; R629-F643 WeakPolarHBondContact CA-O 3.14Å; R629-F643 WeakPolarHBondContact CB-O 3.41Å; I630-F643 HydrophobicContact CB-CB 4.42Å; I630-F643 PolarHBondContact N-O 2.67Å; I630-F643 PolarHBondContact O-N 2.81Å; V632-F643 HydrophobicContact CB-CE2 4.46Å; V632-F643 HydrophobicContact CG2-CD2 4.11Å; V632-F643 HydrophobicContact CG2-CE2 4.11Å; Q641-F643 HydrophobicContact CB-CD2 4.37Å; Q641-F643 HydrophobicContact CB-CE2 3.39Å; Q641-F643 HydrophobicContact CB-CZ 3.75Å; F643-Q648 CarbonylContact C-O 3.56Å; F643-Q648 WeakPolarHBondContact CA-O 3.22Å; F643-Q648 WeakPolarHBondContact CB-O 3.31Å; F643-F649 HydrophobicContact CD1-CB 4.16Å; F643-F649 HydrophobicContact CE1-CB 3.93Å; F643-F649 AromaticContact CE1-CD2 3.93Å; F643-F649 HydrophobicContact CE1-CD2 3.93Å; F643-F649 HydrophobicContact CE1-CG 4.45Å; F643-F649 HydrophobicContact CZ-CD2 4.18Å
644	T	98.4	Very high	98.3	Very high	26 Å²	26	36.7 Å²	36.7	16%	0.16	19%	0.186	C	C	.	.			trans	-67.9	169.3	160.3	75.7	0	0	0	0	110.2	E646 G647 Q648 L650	T644-E646 WeakPolarHBondContact CB-OE2 3.24Å; T644-E646 PolarHBondContact O-N 2.88Å; T644-E646 PolarHBondContact OG1-N 3.35Å; T644-E646 PolarHBondContact OG1-OE2 3.43Å; T644-G647 PolarHBondContact O-N 2.82Å; T644-Q648 HydrophobicContact CG2-CB 3.98Å; T644-Q648 PolarHBondContact N-O 2.85Å; T644-Q648 WeakPolarHBondContact OG1-CB 3.36Å; T644-Q648 PolarHBondContact OG1-N 2.83Å; T644-L650 HydrophobicContact CG2-CD1 4.05Å; T644-L650 HydrophobicContact CG2-CD2 3.77Å; T644-L650 HydrophobicContact CG2-CG 4.01Å
645	F	97.7	Very high	98.2	Very high	16 Å²	16	42.2 Å²	42.2	7%	0.07	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-32.2	176.1	-173.8	-105.9	0	0	0	112.6	Y582 I595 H604 R628 I630 G647	Y582-F645 AromaticContact CD1-CZ 3.91Å; Y582-F645 HydrophobicContact CD1-CZ 3.91Å; Y582-F645 HydrophobicContact CD2-CZ 4.19Å; Y582-F645 HydrophobicContact CE1-CZ 4.5Å; Y582-F645 HydrophobicContact CG-CE2 4.43Å; Y582-F645 AromaticContact CG-CZ 3.74Å; Y582-F645 HydrophobicContact CG-CZ 3.74Å; I595-F645 HydrophobicContact CG2-CE2 4.14Å; I595-F645 HydrophobicContact CG2-CZ 3.76Å; H604-F645 PolarHBondContact CE1-O 3.13Å; H604-F645 PolarHBondContact NE2-O 2.77Å; R628-F645 HydrophobicContact CB-CB 4.21Å; R628-F645 HydrophobicContact CB-CD2 4.41Å; R628-F645 WeakPolarHBondContact O-CB 3.29Å; R628-F645 PolarHBondContact O-N 2.95Å; I630-F645 HydrophobicContact CD1-CD2 4.33Å; F645-G647 PolarHBondContact O-N 2.85Å
646	E	97.5	Very high	98.2	Very high	119 Å²	119	48 Å²	48	56%	0.556	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-0.8	178.3	-55.6	70	-151.3	0	0	113.3	T644	T644-E646 WeakPolarHBondContact CB-OE2 3.24Å; T644-E646 PolarHBondContact O-N 2.88Å; T644-E646 PolarHBondContact OG1-N 3.35Å; T644-E646 PolarHBondContact OG1-OE2 3.43Å
647	G	97.1	Very high	98.2	Very high	15 Å²	15	47.7 Å²	47.7	16%	0.155	24%	0.239	C	C	.	.			trans	86	16	178.6	0	0	0	0	0	115.3	T644 F645	T644-G647 PolarHBondContact O-N 2.82Å; F645-G647 PolarHBondContact O-N 2.85Å
648	Q	98.1	Very high	98.1	Very high	131 Å²	131	50.8 Å²	50.8	61%	0.612	26%	0.26	S	S	*	.			trans	-76.6	130.5	173.6	-60.3	179.9	1.4	0	0	110.1	F643 T644 L650	F643-Q648 CarbonylContact C-O 3.56Å; F643-Q648 WeakPolarHBondContact CA-O 3.22Å; F643-Q648 WeakPolarHBondContact CB-O 3.31Å; T644-Q648 HydrophobicContact CG2-CB 3.98Å; T644-Q648 PolarHBondContact N-O 2.85Å; T644-Q648 WeakPolarHBondContact OG1-CB 3.36Å; T644-Q648 PolarHBondContact OG1-N 2.83Å; Q648-L650 PolarHBondContact O-N 3.03Å
649	F	98.4	Very high	98.1	Very high	78 Å²	78	57.3 Å²	57.3	34%	0.342	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	130.8	-179.7	174.1	-95.9	0	0	0	111.5	P613 F643 L651 K652	P613-F649 HydrophobicContact CB-CD1 3.97Å; P613-F649 HydrophobicContact CB-CD2 4.01Å; P613-F649 HydrophobicContact CB-CE1 3.83Å; P613-F649 HydrophobicContact CB-CE2 3.87Å; P613-F649 HydrophobicContact CB-CG 4.05Å; P613-F649 HydrophobicContact CB-CZ 3.78Å; F643-F649 HydrophobicContact CD1-CB 4.16Å; F643-F649 HydrophobicContact CE1-CB 3.93Å; F643-F649 AromaticContact CE1-CD2 3.93Å; F643-F649 HydrophobicContact CE1-CD2 3.93Å; F643-F649 HydrophobicContact CE1-CG 4.45Å; F643-F649 HydrophobicContact CZ-CD2 4.18Å; F649-L651 VanDerWaalsContact CE2-C 3.47Å; F649-L651 VanDerWaalsContact CE2-O 3.3Å; F649-L651 WeakPolarHBondContact CE2-O 3.47Å; F649-K652 HydrophobicContact CE2-CB 3.93Å; F649-K652 HydrophobicContact CE2-CG 4.4Å; F649-K652 HydrophobicContact CZ-CB 3.98Å; F649-K652 HydrophobicContact CZ-CD 4.29Å; F649-K652 HydrophobicContact CZ-CG 4.04Å
650	L	98.1	Very high	98	Very high	82 Å²	82	60.7 Å²	60.7	43%	0.429	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-59.7	176.3	-63.5	176.7	0	0	0	111.6	R629 V642 T644 Q648	R629-L650 HydrophobicContact CG-CD1 4.12Å; V642-L650 HydrophobicContact CG1-CD1 4.31Å; V642-L650 WeakPolarHBondContact O-CB 3.44Å; V642-L650 PolarHBondContact O-N 3.35Å; T644-L650 HydrophobicContact CG2-CD1 4.05Å; T644-L650 HydrophobicContact CG2-CD2 3.77Å; T644-L650 HydrophobicContact CG2-CG 4.01Å; Q648-L650 PolarHBondContact O-N 3.03Å
651	L	97.9	Very high	97.9	Very high	45 Å²	45	61.5 Å²	61.5	24%	0.236	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	164.8	-178.3	64.4	81.6	0	0	0	112.1	V642 F649 F653	V642-L651 HydrophobicContact CB-CD1 3.96Å; V642-L651 HydrophobicContact CB-CG 3.99Å; V642-L651 HydrophobicContact CG2-CD1 3.54Å; V642-L651 HydrophobicContact CG2-CG 4.11Å; V642-L651 PolarHBondContact N-O 2.89Å; V642-L651 PolarHBondContact O-N 2.88Å; F649-L651 VanDerWaalsContact CE2-C 3.47Å; F649-L651 VanDerWaalsContact CE2-O 3.3Å; F649-L651 WeakPolarHBondContact CE2-O 3.47Å; L651-F653 HydrophobicContact CD1-CD1 3.73Å; L651-F653 HydrophobicContact CD1-CE1 4.11Å
652	K	98.3	Very high	97.9	Very high	104 Å²	104	63 Å²	63	45%	0.452	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.7	170.9	69.1	-174.4	-178.3	105.1	0	110.2	P613 V640 Q641 F649	P613-K652 HydrophobicContact CG-CD 4.41Å; V640-K652 VanDerWaalsContact O-CA 3.27Å; V640-K652 WeakPolarHBondContact O-CA 3.05Å; Q641-K652 HydrophobicContact CG-CB 3.91Å; F649-K652 HydrophobicContact CE2-CB 3.93Å; F649-K652 HydrophobicContact CE2-CG 4.4Å; F649-K652 HydrophobicContact CZ-CB 3.98Å; F649-K652 HydrophobicContact CZ-CD 4.29Å; F649-K652 HydrophobicContact CZ-CG 4.04Å
653	F	98.7	Very high	97.9	Very high	25 Å²	25	63 Å²	63	11%	0.11	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	158.4	173.4	60.8	-86.6	0	0	0	110.9	R639 V640 V642 L651 F663 I677 F690 G694	R639-F653 WeakPolarHBondContact CB-O 3.46Å; V640-F653 HydrophobicContact CB-CD1 4.43Å; V640-F653 HydrophobicContact CB-CD2 4.4Å; V640-F653 HydrophobicContact CB-CE1 3.94Å; V640-F653 HydrophobicContact CB-CE2 3.9Å; V640-F653 HydrophobicContact CB-CZ 3.65Å; V640-F653 HydrophobicContact CG1-CE1 3.81Å; V640-F653 HydrophobicContact CG1-CE2 4.39Å; V640-F653 HydrophobicContact CG1-CZ 3.65Å; V640-F653 HydrophobicContact CG2-CE2 4.18Å; V640-F653 HydrophobicContact CG2-CZ 4.22Å; V640-F653 PolarHBondContact N-O 3.39Å; V640-F653 PolarHBondContact O-N 3.46Å; V642-F653 HydrophobicContact CG2-CE1 4.44Å; L651-F653 HydrophobicContact CD1-CD1 3.73Å; L651-F653 HydrophobicContact CD1-CE1 4.11Å; F653-F663 HydrophobicContact CD2-CE2 4.29Å; F653-F663 HydrophobicContact CD2-CZ 4.44Å; F653-F663 HydrophobicContact CE2-CE2 4.41Å; F653-F663 HydrophobicContact CE2-CZ 4.2Å; F653-I677 HydrophobicContact CE1-CD1 4.15Å; F653-I677 HydrophobicContact CZ-CD1 4.09Å; F653-I677 HydrophobicContact CZ-CG2 4.45Å; F653-F690 HydrophobicContact CD2-CD1 4.14Å; F653-F690 HydrophobicContact CD2-CE1 4.22Å; F653-F690 HydrophobicContact CE2-CB 4.29Å; F653-F690 AromaticContact CE2-CD1 3.8Å; F653-F690 HydrophobicContact CE2-CD1 3.8Å; F653-F690 AromaticContact CE2-CD2 3.97Å; F653-F690 HydrophobicContact CE2-CD2 3.97Å; F653-F690 HydrophobicContact CE2-CE1 4.1Å; F653-F690 HydrophobicContact CE2-CE2 4.24Å; F653-F690 AromaticContact CE2-CG 3.75Å; F653-F690 HydrophobicContact CE2-CG 3.75Å; F653-F690 HydrophobicContact CE2-CZ 4.32Å; F653-F690 HydrophobicContact CZ-CB 4.43Å; F653-F690 HydrophobicContact CZ-CG 4.34Å; F653-G694 VanDerWaalsContact CD1-CA 3.48Å
654	G	98	Very high	97.9	Very high	28 Å²	28	64.9 Å²	64.9	29%	0.289	33%	0.333	S	S	.	.			trans	90.2	153.2	-176.1	0	0	0	0	0	114.7	H638 R639 G661	H638-G654 CarbonylContact O-C 3.48Å; R639-G654 WeakPolarHBondContact CB-O 3.37Å; G654-G661 VanDerWaalsContact CA-O 3.29Å; G654-G661 WeakPolarHBondContact CA-O 3.36Å
655	E	97.6	Very high	97.9	Very high	116 Å²	116	67.5 Å²	67.5	54%	0.542	34%	0.34	S	S	.	.			trans	-151.3	169.6	177.6	61.9	179.1	-176.8	0	0	108.9	H638 G657 Q662 F663	H638-E655 CarbonylContact O-C 3.5Å; H638-E655 WeakPolarHBondContact O-CA 3.49Å; H638-E655 PolarHBondContact O-N 3.41Å; E655-G657 PolarHBondContact O-N 2.76Å; E655-Q662 HydrophobicContact CG-CG 3.81Å; E655-Q662 CarbonylContact O-C 3.52Å; E655-Q662 WeakPolarHBondContact O-CA 3.4Å; E655-Q662 WeakPolarHBondContact O-CB 3.45Å; E655-Q662 PolarHBondContact OE1-NE2 3.25Å; E655-F663 PolarHBondContact O-N 3.26Å
656	K	98.4	Very high	97.9	Very high	138 Å²	138	66.8 Å²	66.8	60%	0.6	34%	0.337	S	S	*	.	B	Isolated β-bridge	trans	-64.7	123.1	179.3	-170.9	174.7	-173.7	170.4	0	111.7	H638 F663	H638-K656 HydrophobicContact CB-CB 3.9Å; K656-F663 VanDerWaalsContact CA-O 3.28Å; K656-F663 WeakPolarHBondContact CA-O 3.39Å
657	G	97.7	Very high	97.9	Very high	18 Å²	18	62.9 Å²	62.9	19%	0.186	32%	0.317	C	S	.	.	S	Bend	trans	165.8	-168	174.4	0	0	0	0	0	114.3	E655 F663 N684	E655-G657 PolarHBondContact O-N 2.76Å; G657-F663 PolarHBondContact N-O 2.79Å; G657-F663 CarbonylContact O-C 3.59Å; G657-N684 PolarHBondContact O-ND2 3.49Å
658	T	96.6	Very high	98	Very high	99 Å²	99	62.7 Å²	62.7	61%	0.607	31%	0.313	S	S	*	.	S	Bend	trans	-119.5	-10.2	-174.6	57.1	0	0	0	0	113.4	R686	T658-R686 PolarHBondContact O-NH1 3.16Å; T658-R686 PolarHBondContact O-NH2 3.47Å
659	K	97.4	Very high	98.1	Very high	149 Å²	149	56.7 Å²	56.7	65%	0.648	29%	0.285	S	S	*	.	S	Bend	trans	-69.9	166	177.2	-61.4	179.9	179.1	178.3	0	111	G661 Q662 R686	K659-G661 PolarHBondContact O-N 2.78Å; K659-Q662 HydrophobicContact CB-CG 4.14Å; K659-Q662 VanDerWaalsContact N-OE1 3.14Å; K659-Q662 WeakPolarHBondContact O-CB 3.43Å; K659-Q662 PolarHBondContact O-N 3.35Å; K659-R686 PolarHBondContact O-NH2 3.24Å
660	N	97.8	Very high	98.1	Very high	83 Å²	83	53.5 Å²	53.5	44%	0.444	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	134.1	172.1	-63.9	-7.1	0	0	0	109.4	Q662 F696	N660-Q662 PolarHBondContact O-N 3.01Å; N660-F696 HydrophobicContact CB-CD1 3.89Å; N660-F696 HydrophobicContact CB-CD2 3.89Å; N660-F696 HydrophobicContact CB-CE1 3.82Å; N660-F696 HydrophobicContact CB-CE2 3.81Å; N660-F696 HydrophobicContact CB-CG 3.92Å; N660-F696 HydrophobicContact CB-CZ 3.78Å; N660-F696 WeakPolarHBondContact ND2-CE1 3.36Å
661	G	96.6	Very high	98.1	Very high	18 Å²	18	50.9 Å²	50.9	19%	0.186	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-6.9	-174.1	0	0	0	0	0	115.8	G654 K659	G654-G661 VanDerWaalsContact CA-O 3.29Å; G654-G661 WeakPolarHBondContact CA-O 3.36Å; K659-G661 PolarHBondContact O-N 2.78Å
662	Q	98.5	Very high	98	Very high	31 Å²	31	49.3 Å²	49.3	15%	0.145	25%	0.252	C	S	.	.			trans	-96.2	155.2	168	-60.9	-178	-30	0	0	110.4	E655 K659 N660 R686 Q688	E655-Q662 HydrophobicContact CG-CG 3.81Å; E655-Q662 CarbonylContact O-C 3.52Å; E655-Q662 WeakPolarHBondContact O-CA 3.4Å; E655-Q662 WeakPolarHBondContact O-CB 3.45Å; E655-Q662 PolarHBondContact OE1-NE2 3.25Å; K659-Q662 HydrophobicContact CB-CG 4.14Å; K659-Q662 VanDerWaalsContact N-OE1 3.14Å; K659-Q662 WeakPolarHBondContact O-CB 3.43Å; K659-Q662 PolarHBondContact O-N 3.35Å; N660-Q662 PolarHBondContact O-N 3.01Å; Q662-R686 PolarHBondContact O-NH2 3.31Å; Q662-Q688 PolarHBondContact O-NE2 3.19Å
663	F	98.6	Very high	97.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-129.6	155.1	-175.6	-57.2	-70.1	0	0	0	113.2	H638 V640 F653 E655 K656 G657 P666 V679 D681 Q688 F690	H638-F663 PolarHBondContact ND1-O 2.96Å; V640-F663 HydrophobicContact CG2-CE2 4.1Å; V640-F663 HydrophobicContact CG2-CZ 4.17Å; F653-F663 HydrophobicContact CD2-CE2 4.29Å; F653-F663 HydrophobicContact CD2-CZ 4.44Å; F653-F663 HydrophobicContact CE2-CE2 4.41Å; F653-F663 HydrophobicContact CE2-CZ 4.2Å; E655-F663 PolarHBondContact O-N 3.26Å; K656-F663 VanDerWaalsContact CA-O 3.28Å; K656-F663 WeakPolarHBondContact CA-O 3.39Å; G657-F663 PolarHBondContact N-O 2.79Å; G657-F663 CarbonylContact O-C 3.59Å; F663-P666 HydrophobicContact CB-CB 4.06Å; F663-P666 HydrophobicContact CB-CG 3.82Å; F663-P666 HydrophobicContact CD1-CB 4.09Å; F663-P666 HydrophobicContact CD2-CG 4.38Å; F663-P666 HydrophobicContact CG-CB 4.01Å; F663-P666 HydrophobicContact CG-CG 4.07Å; F663-V679 HydrophobicContact CD1-CG1 4.3Å; F663-V679 HydrophobicContact CE1-CB 4.06Å; F663-V679 HydrophobicContact CE1-CG1 3.81Å; F663-V679 HydrophobicContact CE1-CG2 4.45Å; F663-V679 HydrophobicContact CZ-CB 4.48Å; F663-V679 HydrophobicContact CZ-CG1 4.3Å; F663-V679 HydrophobicContact CZ-CG2 4.39Å; F663-D681 WeakPolarHBondContact CA-OD1 3.36Å; F663-D681 HydrophobicContact CD1-CB 4.19Å; F663-Q688 HydrophobicContact CE1-CB 4.46Å; F663-F690 AromaticContact CE1-CE2 3.7Å; F663-F690 HydrophobicContact CE1-CE2 3.7Å; F663-F690 AromaticContact CE1-CZ 3.7Å; F663-F690 HydrophobicContact CE1-CZ 3.7Å; F663-F690 HydrophobicContact CE2-CZ 4.39Å; F663-F690 HydrophobicContact CZ-CE1 4.29Å; F663-F690 AromaticContact CZ-CE2 3.49Å; F663-F690 HydrophobicContact CZ-CE2 3.49Å; F663-F690 VanDerWaalsContact CZ-CE2 3.49Å; F663-F690 AromaticContact CZ-CZ 3.35Å; F663-F690 HydrophobicContact CZ-CZ 3.35Å
664	N	98.1	Very high	97.3	Very high	42 Å²	42	52.7 Å²	52.7	23%	0.225	28%	0.28	C	S	.	.	S	Bend	trans	-130.9	96.5	168.3	-165	1.4	0	0	0	109	D681 R683 N684	N664-D681 PolarHBondContact N-OD1 3.44Å; N664-R683 HydrophobicContact CB-CB 3.86Å; N664-R683 VanDerWaalsContact CG-CB 3.48Å; N664-R683 WeakPolarHBondContact ND2-CB 3.46Å; N664-R683 VanDerWaalsContact O-CB 3.31Å; N664-R683 WeakPolarHBondContact O-CB 3.31Å; N664-R683 PolarHBondContact O-N 2.84Å; N664-N684 WeakPolarHBondContact CB-OD1 3.13Å; N664-N684 PolarHBondContact N-ND2 3.09Å
665	Y	97.9	Very high	97.2	Very high	81 Å²	81	51.6 Å²	51.6	32%	0.318	27%	0.269	S	S	.	.	S	Bend	trans	54.6	67.5	-170.3	-60.5	-83.5	0	0	0	112.6	K635 D636 H638 W667 T682 R683	K635-Y665 HydrophobicContact CG-CD1 4.06Å; D636-Y665 VanDerWaalsContact OD1-CD1 3.29Å; D636-Y665 WeakPolarHBondContact OD1-CD1 3.48Å; D636-Y665 VanDerWaalsContact OD1-CE1 3.26Å; D636-Y665 WeakPolarHBondContact OD1-CE1 3.34Å; H638-Y665 AromaticContact CE1-CD2 3.94Å; H638-Y665 AromaticContact CE1-CE2 3.98Å; H638-Y665 PolarHBondContact ND1-N 2.86Å; Y665-W667 PolarHBondContact O-N 2.91Å; Y665-T682 PolarHBondContact O-OG1 3.38Å; Y665-R683 HydrophobicContact CD2-CB 4.32Å; Y665-R683 HydrophobicContact CD2-CG 3.64Å; Y665-R683 HydrophobicContact CE2-CG 4.45Å; Y665-R683 HydrophobicContact CG-CG 4.35Å
666	P	98.4	Very high	97.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	124.7	171.1	28.4	-30.6	0	0	0	108.3	K635 F663 V679 S680	K635-P666 VanDerWaalsContact CA-O 3.31Å; K635-P666 WeakPolarHBondContact CA-O 3.41Å; K635-P666 WeakPolarHBondContact CB-O 3.39Å; K635-P666 WeakPolarHBondContact CG-O 3.39Å; F663-P666 HydrophobicContact CB-CB 4.06Å; F663-P666 HydrophobicContact CB-CG 3.82Å; F663-P666 HydrophobicContact CD1-CB 4.09Å; F663-P666 HydrophobicContact CD2-CG 4.38Å; F663-P666 HydrophobicContact CG-CB 4.01Å; F663-P666 HydrophobicContact CG-CG 4.07Å; P666-V679 HydrophobicContact CB-CG1 3.69Å; P666-S680 CarbonylContact C-O 3.52Å; P666-S680 VanDerWaalsContact CA-O 3.28Å; P666-S680 WeakPolarHBondContact CA-O 3.41Å
667	W	98.6	Very high	97.2	Very high	37 Å²	37	42.7 Å²	42.7	14%	0.14	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-58.7	-168.7	-163.9	-67.1	0	0	0	112.7	W573 A620 G621 A633 K635 Y665 S680 T682 R714	W573-W667 AromaticContact CD1-NE1 3.77Å; W573-W667 AromaticContact CD2-CD1 3.87Å; W573-W667 AromaticContact CD2-NE1 3.22Å; W573-W667 AromaticContact CE2-CD1 3.75Å; W573-W667 AromaticContact CE2-NE1 3.03Å; W573-W667 AromaticContact CE3-CD1 3.85Å; W573-W667 AromaticContact CE3-NE1 3.69Å; W573-W667 AromaticContact CG-NE1 3.73Å; W573-W667 AromaticContact CH2-CD1 3.75Å; W573-W667 AromaticContact CH2-NE1 3.9Å; W573-W667 AromaticContact CZ2-CD1 3.7Å; W573-W667 AromaticContact CZ2-NE1 3.41Å; W573-W667 AromaticContact CZ3-CD1 3.82Å; W573-W667 AromaticContact NE1-CE2 3.99Å; W573-W667 AromaticContact NE1-NE1 3.32Å; A620-W667 CarbonylContact C-O 3.55Å; A620-W667 HydrophobicContact CB-CG 4.32Å; A620-W667 WeakPolarHBondContact CB-O 3.47Å; G621-W667 WeakPolarHBondContact CA-O 3.3Å; G621-W667 PolarHBondContact N-O 3.16Å; A633-W667 WeakPolarHBondContact CB-O 3.41Å; K635-W667 HydrophobicContact CD-CD2 3.98Å; K635-W667 HydrophobicContact CD-CE3 3.54Å; K635-W667 HydrophobicContact CD-CH2 4.36Å; K635-W667 HydrophobicContact CD-CZ3 3.76Å; Y665-W667 PolarHBondContact O-N 2.91Å; W667-S680 PolarHBondContact N-O 3.27Å; W667-T682 WeakPolarHBondContact CB-OG1 3.5Å; W667-R714 VanDerWaalsContact CD1-CD 3.44Å
668	D	98.6	Very high	97.3	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.064	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	158.1	-177.3	-161.2	20	0	0	0	111.5	W573 G621 V679 S680 R714 G715 V716	W573-D668 HydrophobicContact CH2-CB 3.87Å; W573-D668 HydrophobicContact CZ3-CB 3.7Å; W573-D668 VanDerWaalsContact CZ3-CG 3.4Å; W573-D668 WeakPolarHBondContact CZ3-OD1 3.46Å; G621-D668 WeakPolarHBondContact CA-OD1 3.48Å; D668-V679 WeakPolarHBondContact O-CA 3.28Å; D668-S680 WeakPolarHBondContact CA-OG 3.15Å; D668-S680 WeakPolarHBondContact CB-OG 3.5Å; D668-S680 PolarHBondContact N-OG 3.4Å; D668-S680 PolarHBondContact O-N 2.87Å; D668-S680 PolarHBondContact O-OG 2.73Å; D668-R714 WeakPolarHBondContact CB-O 3.2Å; D668-G715 VanDerWaalsContact OD2-CA 3.25Å; D668-G715 WeakPolarHBondContact OD2-CA 3.41Å; D668-V716 HydrophobicContact CB-CG2 3.98Å; D668-V716 PolarHBondContact OD2-N 3.34Å
669	V	98.8	Very high	97.4	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.024	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.6	-179.6	64.2	0	0	0	0	110.7	A623 I631 A633 I677 L678 V679	A623-V669 HydrophobicContact CB-CG1 4.11Å; I631-V669 HydrophobicContact CB-CG2 4.44Å; I631-V669 HydrophobicContact CG2-CG1 4.39Å; I631-V669 HydrophobicContact CG2-CG2 3.68Å; I631-V669 WeakPolarHBondContact O-CG1 3.19Å; A633-V669 HydrophobicContact CB-CB 4.38Å; A633-V669 HydrophobicContact CB-CG1 4.35Å; V669-I677 HydrophobicContact CG2-CG2 3.46Å; V669-I677 VanDerWaalsContact CG2-CG2 3.46Å; V669-L678 CarbonylContact C-O 3.59Å; V669-L678 VanDerWaalsContact CA-O 3.25Å; V669-L678 WeakPolarHBondContact CA-O 3.23Å; V669-V679 HydrophobicContact CG2-CG2 4.24Å
670	A	98.6	Very high	97.4	Very high	11 Å²	11	30 Å²	30	9%	0.091	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158.1	172.4	0	0	0	0	0	110.1	I677 L678 V716 F718	A670-I677 WeakPolarHBondContact O-CA 3.34Å; A670-L678 PolarHBondContact N-O 3.41Å; A670-L678 PolarHBondContact O-N 3.4Å; A670-V716 HydrophobicContact CB-CB 4.45Å; A670-V716 HydrophobicContact CB-CG2 3.87Å; A670-V716 WeakPolarHBondContact CB-O 3.5Å; A670-F718 HydrophobicContact CB-CD2 4.06Å; A670-F718 HydrophobicContact CB-CE2 4.21Å
671	V	98.1	Very high	97.4	Very high	27 Å²	27	26 Å²	26	16%	0.164	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	138	178.3	66.5	0	0	0	0	110	A623 C624 D625 I631 K676	A623-V671 HydrophobicContact CB-CG1 4.09Å; C624-V671 VanDerWaalsContact O-CG1 3.27Å; C624-V671 WeakPolarHBondContact O-CG1 3.33Å; D625-V671 HydrophobicContact CB-CB 4.42Å; D625-V671 HydrophobicContact CB-CG1 3.81Å; D625-V671 HydrophobicContact CB-CG2 3.81Å; I631-V671 HydrophobicContact CD1-CB 4.48Å; I631-V671 HydrophobicContact CD1-CG1 4.41Å; V671-K676 VanDerWaalsContact CA-O 3.28Å; V671-K676 WeakPolarHBondContact CA-O 3.47Å; V671-K676 WeakPolarHBondContact CG2-O 3.37Å
672	N	95.8	Very high	97.4	Very high	12 Å²	12	25.5 Å²	25.5	6%	0.064	13%	0.131	C	C	.	.			trans	-92.7	-179	177.1	81.8	-19.3	0	0	0	112	E674 G675 K676 F718 D722	N672-E674 PolarHBondContact O-N 3.33Å; N672-E674 PolarHBondContact OD1-N 3.46Å; N672-G675 PolarHBondContact O-N 3.42Å; N672-G675 PolarHBondContact OD1-N 2.89Å; N672-G675 VanDerWaalsContact OD1-N 3.13Å; N672-K676 PolarHBondContact N-O 3.18Å; N672-K676 VanDerWaalsContact N-O 3.14Å; N672-K676 WeakPolarHBondContact OD1-CB 3.46Å; N672-K676 PolarHBondContact OD1-N 2.96Å; N672-F718 HydrophobicContact CB-CB 4.18Å; N672-F718 HydrophobicContact CB-CD1 3.86Å; N672-F718 HydrophobicContact CB-CD2 3.71Å; N672-F718 HydrophobicContact CB-CE1 4.07Å; N672-F718 HydrophobicContact CB-CE2 3.94Å; N672-F718 HydrophobicContact CB-CG 3.66Å; N672-F718 HydrophobicContact CB-CZ 4.09Å; N672-D722 PolarHBondContact ND2-OD1 3.39Å
673	S	91.1	Very high	97.3	Very high	88 Å²	88	31.7 Å²	31.7	62%	0.615	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.7	-178.9	55	0	0	0	0	113.9	G675	S673-G675 VanDerWaalsContact C-N 3.33Å
674	E	92.6	Very high	97.3	Very high	113 Å²	113	32.9 Å²	32.9	53%	0.528	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.7	176.2	-57.8	-179.8	159.7	0	0	113.3	N672 K676	N672-E674 PolarHBondContact O-N 3.33Å; N672-E674 PolarHBondContact OD1-N 3.46Å; E674-K676 WeakPolarHBondContact OE2-CE 3.46Å; E674-K676 IonicContact OE2-NZ 2.8Å; E674-K676 PolarHBondContact OE2-NZ 3.21Å
675	G	95.3	Very high	97.2	Very high	5 Å²	5	33 Å²	33	5%	0.052	16%	0.159	C	C	.	.			trans	85.5	9.6	-177.2	0	0	0	0	0	114.9	N672 S673 P692	N672-G675 PolarHBondContact O-N 3.42Å; N672-G675 PolarHBondContact OD1-N 2.89Å; N672-G675 VanDerWaalsContact OD1-N 3.13Å; S673-G675 VanDerWaalsContact C-N 3.33Å; G675-P692 WeakPolarHBondContact O-CA 3.46Å; G675-P692 WeakPolarHBondContact O-CG 3.39Å
676	K	97.9	Very high	97.2	Very high	66 Å²	66	30 Å²	30	29%	0.287	15%	0.147	S	C	.	.			trans	-66.5	135.8	172.7	-66.6	172.1	175.4	152.9	0	109.8	V671 N672 E674 L689 F690 L697	V671-K676 VanDerWaalsContact CA-O 3.28Å; V671-K676 WeakPolarHBondContact CA-O 3.47Å; V671-K676 WeakPolarHBondContact CG2-O 3.37Å; N672-K676 PolarHBondContact N-O 3.18Å; N672-K676 VanDerWaalsContact N-O 3.14Å; N672-K676 WeakPolarHBondContact OD1-CB 3.46Å; N672-K676 PolarHBondContact OD1-N 2.96Å; E674-K676 WeakPolarHBondContact OE2-CE 3.46Å; E674-K676 IonicContact OE2-NZ 2.8Å; E674-K676 PolarHBondContact OE2-NZ 3.21Å; K676-L689 HydrophobicContact CB-CD1 4.12Å; K676-F690 CarbonylContact C-O 3.56Å; K676-F690 VanDerWaalsContact CA-O 3.29Å; K676-F690 WeakPolarHBondContact CA-O 3.33Å; K676-L697 HydrophobicContact CD-CD1 4.35Å; K676-L697 HydrophobicContact CG-CD1 4.14Å
677	I	98.6	Very high	97.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.9	-173.2	-54.7	171.9	0	0	0	109.1	I631 F653 V669 A670 V679 L689 F690	I631-I677 HydrophobicContact CG1-CD1 4.35Å; I631-I677 HydrophobicContact CG2-CD1 4.37Å; I631-I677 HydrophobicContact CG2-CG2 4.1Å; F653-I677 HydrophobicContact CE1-CD1 4.15Å; F653-I677 HydrophobicContact CZ-CD1 4.09Å; F653-I677 HydrophobicContact CZ-CG2 4.45Å; V669-I677 HydrophobicContact CG2-CG2 3.46Å; V669-I677 VanDerWaalsContact CG2-CG2 3.46Å; A670-I677 WeakPolarHBondContact O-CA 3.34Å; I677-V679 HydrophobicContact CG2-CG2 4.01Å; I677-L689 CarbonylContact O-C 3.49Å; I677-L689 WeakPolarHBondContact O-CA 3.31Å; I677-F690 HydrophobicContact CB-CB 4.26Å; I677-F690 PolarHBondContact N-O 3.22Å; I677-F690 PolarHBondContact O-N 2.72Å
678	L	98.8	Very high	97.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130	174.6	175.5	64.7	0	0	0	109.6	V669 A670 V687 L689 V716 F718 L724	V669-L678 CarbonylContact C-O 3.59Å; V669-L678 VanDerWaalsContact CA-O 3.25Å; V669-L678 WeakPolarHBondContact CA-O 3.23Å; A670-L678 PolarHBondContact N-O 3.41Å; A670-L678 PolarHBondContact O-N 3.4Å; L678-V687 HydrophobicContact CD1-CB 3.92Å; L678-V687 HydrophobicContact CD1-CG2 4.13Å; L678-L689 HydrophobicContact CB-CD1 4.28Å; L678-V716 HydrophobicContact CD2-CB 3.77Å; L678-V716 HydrophobicContact CD2-CG1 4.24Å; L678-V716 HydrophobicContact CD2-CG2 4.47Å; L678-V716 HydrophobicContact CG-CB 4.05Å; L678-V716 HydrophobicContact CG-CG1 4.28Å; L678-V716 HydrophobicContact CG-CG2 4.37Å; L678-F718 HydrophobicContact CB-CE1 4.49Å; L678-F718 HydrophobicContact CB-CE2 3.59Å; L678-F718 HydrophobicContact CB-CZ 3.54Å; L678-F718 HydrophobicContact CD2-CE2 4.42Å; L678-F718 HydrophobicContact CD2-CZ 4.36Å; L678-L724 HydrophobicContact CD1-CB 4.5Å; L678-L724 HydrophobicContact CD1-CD1 3.96Å; L678-L724 HydrophobicContact CD1-CD2 4.36Å; L678-L724 HydrophobicContact CD2-CB 3.81Å; L678-L724 HydrophobicContact CD2-CD2 4.13Å; L678-L724 HydrophobicContact CD2-CG 4.42Å
679	V	98.8	Very high	97.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.9	-177.5	-173.5	0	0	0	0	110.3	V640 F663 P666 D668 V669 I677 D681 V687 Q688 F690	V640-V679 HydrophobicContact CG2-CG1 4.21Å; V640-V679 HydrophobicContact CG2-CG2 3.9Å; F663-V679 HydrophobicContact CD1-CG1 4.3Å; F663-V679 HydrophobicContact CE1-CB 4.06Å; F663-V679 HydrophobicContact CE1-CG1 3.81Å; F663-V679 HydrophobicContact CE1-CG2 4.45Å; F663-V679 HydrophobicContact CZ-CB 4.48Å; F663-V679 HydrophobicContact CZ-CG1 4.3Å; F663-V679 HydrophobicContact CZ-CG2 4.39Å; P666-V679 HydrophobicContact CB-CG1 3.69Å; D668-V679 WeakPolarHBondContact O-CA 3.28Å; V669-V679 HydrophobicContact CG2-CG2 4.24Å; I677-V679 HydrophobicContact CG2-CG2 4.01Å; V679-D681 PolarHBondContact O-N 2.96Å; V679-V687 VanDerWaalsContact O-CA 3.31Å; V679-V687 WeakPolarHBondContact O-CA 3.41Å; V679-Q688 PolarHBondContact N-O 3.43Å; V679-Q688 PolarHBondContact O-N 2.97Å; V679-F690 HydrophobicContact CB-CE2 4.38Å; V679-F690 HydrophobicContact CG2-CD2 4.04Å; V679-F690 HydrophobicContact CG2-CE2 4.04Å
680	S	98.6	Very high	97.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	109.9	169.1	54	0	0	0	0	111.5	P666 W667 D668 T682 R714	P666-S680 CarbonylContact C-O 3.52Å; P666-S680 VanDerWaalsContact CA-O 3.28Å; P666-S680 WeakPolarHBondContact CA-O 3.41Å; W667-S680 PolarHBondContact N-O 3.27Å; D668-S680 WeakPolarHBondContact CA-OG 3.15Å; D668-S680 WeakPolarHBondContact CB-OG 3.5Å; D668-S680 PolarHBondContact N-OG 3.4Å; D668-S680 PolarHBondContact O-N 2.87Å; D668-S680 PolarHBondContact O-OG 2.73Å; S680-T682 PolarHBondContact O-N 3.44Å; S680-R714 WeakPolarHBondContact CB-O 3.43Å; S680-R714 PolarHBondContact OG-O 2.94Å
681	D	98.1	Very high	97.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	73.4	-178	-172	9.4	0	0	0	109.8	F663 N664 V679 R683 N684 H685 R686 Q688	F663-D681 WeakPolarHBondContact CA-OD1 3.36Å; F663-D681 HydrophobicContact CD1-CB 4.19Å; N664-D681 PolarHBondContact N-OD1 3.44Å; V679-D681 PolarHBondContact O-N 2.96Å; D681-R683 PolarHBondContact O-N 3.1Å; D681-N684 HydrophobicContact CB-CB 4.42Å; D681-N684 VanDerWaalsContact CG-ND2 3.31Å; D681-N684 PolarHBondContact O-N 3.46Å; D681-N684 PolarHBondContact OD1-ND2 2.98Å; D681-N684 VanDerWaalsContact OD1-ND2 3.15Å; D681-N684 WeakPolarHBondContact OD2-CB 3.3Å; D681-N684 PolarHBondContact OD2-ND2 2.88Å; D681-H685 PolarHBondContact O-N 2.77Å; D681-R686 CarbonylContact C-O 3.55Å; D681-R686 WeakPolarHBondContact CA-O 3.05Å; D681-R686 HydrophobicContact CB-CG 3.91Å; D681-R686 WeakPolarHBondContact CB-O 3.36Å; D681-R686 PolarHBondContact N-O 3.16Å; D681-R686 IonicContact OD2-CZ 3.85Å; D681-R686 IonicContact OD2-NE 3.16Å; D681-R686 PolarHBondContact OD2-NE 2.89Å; D681-R686 IonicContact OD2-NH2 3.77Å; D681-R686 PolarHBondContact OD2-NH2 2.88Å; D681-R686 VanDerWaalsContact OD2-NH2 3.15Å; D681-Q688 PolarHBondContact OD2-NE2 2.76Å
682	T	96.5	Very high	97.1	Very high	6 Å²	6	29.8 Å²	29.8	4%	0.037	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-58.6	-39.9	-156.2	-53.8	0	0	0	0	114.9	Y665 W667 S680 S712 P713	Y665-T682 PolarHBondContact O-OG1 3.38Å; W667-T682 WeakPolarHBondContact CB-OG1 3.5Å; S680-T682 PolarHBondContact O-N 3.44Å; T682-S712 WeakPolarHBondContact CG2-OG 3.26Å; T682-P713 WeakPolarHBondContact CG2-O 3.44Å; T682-P713 PolarHBondContact OG1-O 3.45Å
683	R	96.3	Very high	97.1	Very high	161 Å²	161	33.8 Å²	33.8	61%	0.608	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-90.2	-2.4	-179.9	-66.5	-65.1	-164.8	153.1	2.8	113.8	N664 Y665 D681	N664-R683 HydrophobicContact CB-CB 3.86Å; N664-R683 VanDerWaalsContact CG-CB 3.48Å; N664-R683 WeakPolarHBondContact ND2-CB 3.46Å; N664-R683 VanDerWaalsContact O-CB 3.31Å; N664-R683 WeakPolarHBondContact O-CB 3.31Å; N664-R683 PolarHBondContact O-N 2.84Å; Y665-R683 HydrophobicContact CD2-CB 4.32Å; Y665-R683 HydrophobicContact CD2-CG 3.64Å; Y665-R683 HydrophobicContact CE2-CG 4.45Å; Y665-R683 HydrophobicContact CG-CG 4.35Å; D681-R683 PolarHBondContact O-N 3.1Å
684	N	96.9	Very high	97.3	Very high	26 Å²	26	30.1 Å²	30.1	14%	0.139	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-101.1	8.3	169.8	-71.1	-25.7	0	0	0	112.1	G657 N664 D681 R686	G657-N684 PolarHBondContact O-ND2 3.49Å; N664-N684 WeakPolarHBondContact CB-OD1 3.13Å; N664-N684 PolarHBondContact N-ND2 3.09Å; D681-N684 HydrophobicContact CB-CB 4.42Å; D681-N684 VanDerWaalsContact CG-ND2 3.31Å; D681-N684 PolarHBondContact O-N 3.46Å; D681-N684 PolarHBondContact OD1-ND2 2.98Å; D681-N684 VanDerWaalsContact OD1-ND2 3.15Å; D681-N684 WeakPolarHBondContact OD2-CB 3.3Å; D681-N684 PolarHBondContact OD2-ND2 2.88Å; N684-R686 HydrophobicContact CB-CG 4.01Å; N684-R686 PolarHBondContact O-N 3.34Å
685	H	97.4	Very high	97.6	Very high	45 Å²	45	27.6 Å²	27.6	21%	0.208	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	36.1	172.5	-46.2	-63.6	0	0	0	112.9	D681 W707 F710 D711	D681-H685 PolarHBondContact O-N 2.77Å; H685-W707 HydrophobicContact CB-CB 4.16Å; H685-W707 HydrophobicContact CB-CE3 4.41Å; H685-W707 AromaticContact CD2-CE3 3.7Å; H685-W707 AromaticContact CE1-CE3 3.33Å; H685-W707 AromaticContact CE1-CZ3 3.29Å; H685-W707 WeakPolarHBondContact CE1-CZ3 3.33Å; H685-W707 AromaticContact CG-CE3 3.58Å; H685-W707 AromaticContact ND1-CE3 3.36Å; H685-W707 AromaticContact ND1-CZ3 3.65Å; H685-W707 AromaticContact NE2-CE3 3.56Å; H685-W707 AromaticContact NE2-CZ3 3.81Å; H685-F710 WeakPolarHBondContact CB-O 3.36Å; H685-F710 WeakPolarHBondContact O-CD1 3.42Å; H685-D711 PolarHBondContact ND1-O 2.85Å
686	R	97.7	Very high	97.7	Very high	18 Å²	18	30.6 Å²	30.6	7%	0.068	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	164.4	-174.4	70.9	-174.6	-178.6	-174.8	2.3	112.5	T658 K659 Q662 D681 N684 Q688 Y700 P713	T658-R686 PolarHBondContact O-NH1 3.16Å; T658-R686 PolarHBondContact O-NH2 3.47Å; K659-R686 PolarHBondContact O-NH2 3.24Å; Q662-R686 PolarHBondContact O-NH2 3.31Å; D681-R686 CarbonylContact C-O 3.55Å; D681-R686 WeakPolarHBondContact CA-O 3.05Å; D681-R686 HydrophobicContact CB-CG 3.91Å; D681-R686 WeakPolarHBondContact CB-O 3.36Å; D681-R686 PolarHBondContact N-O 3.16Å; D681-R686 IonicContact OD2-CZ 3.85Å; D681-R686 IonicContact OD2-NE 3.16Å; D681-R686 PolarHBondContact OD2-NE 2.89Å; D681-R686 IonicContact OD2-NH2 3.77Å; D681-R686 PolarHBondContact OD2-NH2 2.88Å; D681-R686 VanDerWaalsContact OD2-NH2 3.15Å; N684-R686 HydrophobicContact CB-CG 4.01Å; N684-R686 PolarHBondContact O-N 3.34Å; R686-Q688 HydrophobicContact CG-CG 4.38Å; R686-Y700 CarbonylContact C-O 3.59Å; R686-Y700 VanDerWaalsContact CA-O 3.23Å; R686-Y700 WeakPolarHBondContact CA-O 3.34Å; R686-Y700 WeakPolarHBondContact CB-O 3.47Å; R686-P713 VanDerWaalsContact O-CG 3.23Å; R686-P713 WeakPolarHBondContact O-CG 3.15Å
687	V	98.6	Very high	97.7	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	150.7	160.2	-64.1	0	0	0	0	109.5	L678 V679 K699 Y700 F710 P713 V716 L724 V726 I737	L678-V687 HydrophobicContact CD1-CB 3.92Å; L678-V687 HydrophobicContact CD1-CG2 4.13Å; V679-V687 VanDerWaalsContact O-CA 3.31Å; V679-V687 WeakPolarHBondContact O-CA 3.41Å; V687-K699 VanDerWaalsContact O-CA 3.27Å; V687-K699 WeakPolarHBondContact O-CA 3.45Å; V687-K699 WeakPolarHBondContact O-CB 3.41Å; V687-Y700 PolarHBondContact N-O 2.99Å; V687-Y700 PolarHBondContact O-N 2.84Å; V687-F710 HydrophobicContact CG1-CE1 4.16Å; V687-F710 HydrophobicContact CG1-CZ 3.97Å; V687-F710 HydrophobicContact CG2-CE1 4.47Å; V687-P713 HydrophobicContact CG1-CB 3.89Å; V687-V716 HydrophobicContact CG1-CG1 4.26Å; V687-L724 HydrophobicContact CG2-CD1 4.46Å; V687-V726 HydrophobicContact CG1-CG1 3.89Å; V687-V726 HydrophobicContact CG1-CG2 4.01Å; V687-I737 HydrophobicContact CG2-CD1 3.94Å
688	Q	98.6	Very high	97.7	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.3	177.3	-67.6	-171.7	75.8	0	0	110.2	Q662 F663 V679 D681 R686 F690 F696 K699	Q662-Q688 PolarHBondContact O-NE2 3.19Å; F663-Q688 HydrophobicContact CE1-CB 4.46Å; V679-Q688 PolarHBondContact N-O 3.43Å; V679-Q688 PolarHBondContact O-N 2.97Å; D681-Q688 PolarHBondContact OD2-NE2 2.76Å; R686-Q688 HydrophobicContact CG-CG 4.38Å; Q688-F690 HydrophobicContact CB-CD2 4.32Å; Q688-F690 HydrophobicContact CB-CE2 3.37Å; Q688-F690 HydrophobicContact CB-CZ 3.74Å; Q688-F696 HydrophobicContact CB-CE2 4.42Å; Q688-F696 HydrophobicContact CG-CE2 4.26Å; Q688-K699 HydrophobicContact CG-CB 4.21Å
689	L	98.6	Very high	97.6	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.073	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134	179	-172.4	68.3	0	0	0	109.4	K676 I677 L678 L697 N698 F718	K676-L689 HydrophobicContact CB-CD1 4.12Å; I677-L689 CarbonylContact O-C 3.49Å; I677-L689 WeakPolarHBondContact O-CA 3.31Å; L678-L689 HydrophobicContact CB-CD1 4.28Å; L689-L697 HydrophobicContact CG-CB 4.44Å; L689-L697 HydrophobicContact CG-CD1 4.42Å; L689-L697 WeakPolarHBondContact O-CA 3.4Å; L689-L697 WeakPolarHBondContact O-CB 3.47Å; L689-L697 PolarHBondContact O-N 3.22Å; L689-N698 HydrophobicContact CB-CB 4.35Å; L689-N698 PolarHBondContact N-O 3.25Å; L689-N698 PolarHBondContact O-N 2.81Å; L689-F718 HydrophobicContact CD1-CE1 4.14Å; L689-F718 HydrophobicContact CD1-CZ 3.73Å
690	F	98.7	Very high	97.6	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	155.5	-176.4	-61.2	-92.6	0	0	0	111.4	F653 F663 K676 I677 V679 Q688 G694 S695 F696	F653-F690 HydrophobicContact CD2-CD1 4.14Å; F653-F690 HydrophobicContact CD2-CE1 4.22Å; F653-F690 HydrophobicContact CE2-CB 4.29Å; F653-F690 AromaticContact CE2-CD1 3.8Å; F653-F690 HydrophobicContact CE2-CD1 3.8Å; F653-F690 AromaticContact CE2-CD2 3.97Å; F653-F690 HydrophobicContact CE2-CD2 3.97Å; F653-F690 HydrophobicContact CE2-CE1 4.1Å; F653-F690 HydrophobicContact CE2-CE2 4.24Å; F653-F690 AromaticContact CE2-CG 3.75Å; F653-F690 HydrophobicContact CE2-CG 3.75Å; F653-F690 HydrophobicContact CE2-CZ 4.32Å; F653-F690 HydrophobicContact CZ-CB 4.43Å; F653-F690 HydrophobicContact CZ-CG 4.34Å; F663-F690 AromaticContact CE1-CE2 3.7Å; F663-F690 HydrophobicContact CE1-CE2 3.7Å; F663-F690 AromaticContact CE1-CZ 3.7Å; F663-F690 HydrophobicContact CE1-CZ 3.7Å; F663-F690 HydrophobicContact CE2-CZ 4.39Å; F663-F690 HydrophobicContact CZ-CE1 4.29Å; F663-F690 AromaticContact CZ-CE2 3.49Å; F663-F690 HydrophobicContact CZ-CE2 3.49Å; F663-F690 VanDerWaalsContact CZ-CE2 3.49Å; F663-F690 AromaticContact CZ-CZ 3.35Å; F663-F690 HydrophobicContact CZ-CZ 3.35Å; K676-F690 CarbonylContact C-O 3.56Å; K676-F690 VanDerWaalsContact CA-O 3.29Å; K676-F690 WeakPolarHBondContact CA-O 3.33Å; I677-F690 HydrophobicContact CB-CB 4.26Å; I677-F690 PolarHBondContact N-O 3.22Å; I677-F690 PolarHBondContact O-N 2.72Å; V679-F690 HydrophobicContact CB-CE2 4.38Å; V679-F690 HydrophobicContact CG2-CD2 4.04Å; V679-F690 HydrophobicContact CG2-CE2 4.04Å; Q688-F690 HydrophobicContact CB-CD2 4.32Å; Q688-F690 HydrophobicContact CB-CE2 3.37Å; Q688-F690 HydrophobicContact CB-CZ 3.74Å; F690-G694 WeakPolarHBondContact CD1-O 3.35Å; F690-S695 CarbonylContact C-O 3.32Å; F690-S695 WeakPolarHBondContact CA-O 3.37Å; F690-F696 HydrophobicContact CD1-CB 4.18Å; F690-F696 HydrophobicContact CE1-CB 3.98Å; F690-F696 HydrophobicContact CE1-CD2 4.03Å; F690-F696 HydrophobicContact CZ-CD2 4.24Å
691	A	97.8	Very high	97.3	Very high	17 Å²	17	39.2 Å²	39.2	14%	0.14	21%	0.207	C	C	.	.			trans	-74.8	165.6	168.5	0	0	0	0	0	110.9	D693 G694 S695 L697	A691-D693 WeakPolarHBondContact CB-OD1 3.42Å; A691-D693 PolarHBondContact O-N 3.2Å; A691-G694 PolarHBondContact O-N 3.45Å; A691-S695 PolarHBondContact N-O 3.45Å; A691-L697 HydrophobicContact CB-CD1 4.1Å; A691-L697 HydrophobicContact CB-CD2 4.17Å; A691-L697 HydrophobicContact CB-CG 4.15Å
692	P	96.7	Very high	97	Very high	50 Å²	50	42.2 Å²	42.2	33%	0.325	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-17	-177.5	-20.7	28.6	0	0	0	115.5	R629 G675	R629-P692 PolarHBondContact NH1-O 2.8Å; G675-P692 WeakPolarHBondContact O-CA 3.46Å; G675-P692 WeakPolarHBondContact O-CG 3.39Å
693	D	95.8	Very high	96.3	Very high	96 Å²	96	48.8 Å²	48.8	51%	0.513	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-7.2	177.2	67.2	-19.2	0	0	0	113.2	A691 S695	A691-D693 WeakPolarHBondContact CB-OD1 3.42Å; A691-D693 PolarHBondContact O-N 3.2Å; D693-S695 VanDerWaalsContact CG-OG 3.3Å; D693-S695 VanDerWaalsContact OD1-CB 3.28Å; D693-S695 WeakPolarHBondContact OD1-CB 3.33Å; D693-S695 PolarHBondContact OD1-N 3.46Å; D693-S695 PolarHBondContact OD1-OG 2.8Å; D693-S695 PolarHBondContact OD2-OG 3.46Å
694	G	96.1	Very high	95.7	Very high	11 Å²	11	44.3 Å²	44.3	11%	0.113	25%	0.254	C	S	.	.	S	Bend	trans	93	5	-175.9	0	0	0	0	0	114.8	F653 F690 A691	F653-G694 VanDerWaalsContact CD1-CA 3.48Å; F690-G694 WeakPolarHBondContact CD1-O 3.35Å; A691-G694 PolarHBondContact O-N 3.45Å
695	S	97.6	Very high	95	Very high	61 Å²	61	49.3 Å²	49.3	43%	0.427	29%	0.286	S	S	.	.			trans	-69.2	133.2	175	-66	0	0	0	0	111	F690 A691 D693 L697	F690-S695 CarbonylContact C-O 3.32Å; F690-S695 WeakPolarHBondContact CA-O 3.37Å; A691-S695 PolarHBondContact N-O 3.45Å; D693-S695 VanDerWaalsContact CG-OG 3.3Å; D693-S695 VanDerWaalsContact OD1-CB 3.28Å; D693-S695 WeakPolarHBondContact OD1-CB 3.33Å; D693-S695 PolarHBondContact OD1-N 3.46Å; D693-S695 PolarHBondContact OD1-OG 2.8Å; D693-S695 PolarHBondContact OD2-OG 3.46Å; S695-L697 PolarHBondContact O-N 3.19Å
696	F	98.3	Very high	94.7	Very high	68 Å²	68	51.5 Å²	51.5	30%	0.298	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.1	179.3	173.8	-92.1	0	0	0	111.3	N660 Q688 F690 N698 K699	N660-F696 HydrophobicContact CB-CD1 3.89Å; N660-F696 HydrophobicContact CB-CD2 3.89Å; N660-F696 HydrophobicContact CB-CE1 3.82Å; N660-F696 HydrophobicContact CB-CE2 3.81Å; N660-F696 HydrophobicContact CB-CG 3.92Å; N660-F696 HydrophobicContact CB-CZ 3.78Å; N660-F696 WeakPolarHBondContact ND2-CE1 3.36Å; Q688-F696 HydrophobicContact CB-CE2 4.42Å; Q688-F696 HydrophobicContact CG-CE2 4.26Å; F690-F696 HydrophobicContact CD1-CB 4.18Å; F690-F696 HydrophobicContact CE1-CB 3.98Å; F690-F696 HydrophobicContact CE1-CD2 4.03Å; F690-F696 HydrophobicContact CZ-CD2 4.24Å; F696-N698 VanDerWaalsContact CE2-O 3.23Å; F696-N698 WeakPolarHBondContact CE2-O 3.14Å; F696-N698 VanDerWaalsContact CZ-C 3.42Å; F696-K699 HydrophobicContact CE2-CB 4.12Å; F696-K699 HydrophobicContact CZ-CB 4.04Å; F696-K699 HydrophobicContact CZ-CG 4.27Å
697	L	97.6	Very high	94.1	Very high	81 Å²	81	54.6 Å²	54.6	42%	0.424	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-55.4	177.2	-64	177.5	0	0	0	112	K676 L689 A691 S695	K676-L697 HydrophobicContact CD-CD1 4.35Å; K676-L697 HydrophobicContact CG-CD1 4.14Å; L689-L697 HydrophobicContact CG-CB 4.44Å; L689-L697 HydrophobicContact CG-CD1 4.42Å; L689-L697 WeakPolarHBondContact O-CA 3.4Å; L689-L697 WeakPolarHBondContact O-CB 3.47Å; L689-L697 PolarHBondContact O-N 3.22Å; A691-L697 HydrophobicContact CB-CD1 4.1Å; A691-L697 HydrophobicContact CB-CD2 4.17Å; A691-L697 HydrophobicContact CB-CG 4.15Å; S695-L697 PolarHBondContact O-N 3.19Å
698	N	97.4	Very high	93.6	Very high	50 Å²	50	60.8 Å²	60.8	27%	0.267	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	169.1	-173	-149.6	-17.2	0	0	0	112.1	L689 F696 D740	L689-N698 HydrophobicContact CB-CB 4.35Å; L689-N698 PolarHBondContact N-O 3.25Å; L689-N698 PolarHBondContact O-N 2.81Å; F696-N698 VanDerWaalsContact CE2-O 3.23Å; F696-N698 WeakPolarHBondContact CE2-O 3.14Å; F696-N698 VanDerWaalsContact CZ-C 3.42Å; N698-D740 PolarHBondContact ND2-O 3.4Å; N698-D740 VanDerWaalsContact ND2-O 3.13Å
699	K	97.4	Very high	93.2	Very high	63 Å²	63	65.9 Å²	65.9	27%	0.274	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151.3	173.1	68.6	178.6	-174.9	176	0	110.7	V687 Q688 F696 E703	V687-K699 VanDerWaalsContact O-CA 3.27Å; V687-K699 WeakPolarHBondContact O-CA 3.45Å; V687-K699 WeakPolarHBondContact O-CB 3.41Å; Q688-K699 HydrophobicContact CG-CB 4.21Å; F696-K699 HydrophobicContact CE2-CB 4.12Å; F696-K699 HydrophobicContact CZ-CB 4.04Å; F696-K699 HydrophobicContact CZ-CG 4.27Å; K699-E703 IonicContact NZ-OE1 3.15Å; K699-E703 PolarHBondContact NZ-OE1 3.12Å
700	Y	97.9	Very high	93	Very high	22 Å²	22	65.2 Å²	65.2	9%	0.086	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.8	167.7	-175.9	-92.6	0	0	0	110.1	R686 V687 F710 L735 I737 C741 A744	R686-Y700 CarbonylContact C-O 3.59Å; R686-Y700 VanDerWaalsContact CA-O 3.23Å; R686-Y700 WeakPolarHBondContact CA-O 3.34Å; R686-Y700 WeakPolarHBondContact CB-O 3.47Å; V687-Y700 PolarHBondContact N-O 2.99Å; V687-Y700 PolarHBondContact O-N 2.84Å; Y700-F710 HydrophobicContact CD1-CD1 4.34Å; Y700-F710 HydrophobicContact CD1-CE1 4.17Å; Y700-L735 HydrophobicContact CE1-CD2 4.09Å; Y700-I737 HydrophobicContact CD1-CD1 3.43Å; Y700-I737 VanDerWaalsContact CD1-CD1 3.43Å; Y700-I737 HydrophobicContact CD1-CG1 3.86Å; Y700-I737 HydrophobicContact CD1-CG2 4.16Å; Y700-I737 HydrophobicContact CD2-CG2 3.55Å; Y700-I737 HydrophobicContact CE1-CD1 4.05Å; Y700-I737 HydrophobicContact CE1-CG1 4.04Å; Y700-I737 HydrophobicContact CE2-CG2 4.01Å; Y700-I737 HydrophobicContact CG-CD1 3.84Å; Y700-I737 HydrophobicContact CG-CG1 4.2Å; Y700-I737 HydrophobicContact CG-CG2 3.63Å; Y700-C741 HydrophobicContact CD2-CB 4.44Å; Y700-C741 WeakPolarHBondContact CD2-O 3.39Å; Y700-A744 HydrophobicContact CE1-CB 4.02Å; Y700-A744 HydrophobicContact CE2-CB 4.2Å; Y700-A744 VanDerWaalsContact OH-CB 3.26Å; Y700-A744 WeakPolarHBondContact OH-CB 3.04Å
701	G	94.1	Very high	92.8	Very high	31 Å²	31	66.4 Å²	66.4	32%	0.32	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	172.2	168.5	178.5	0	0	0	0	0	110.6
702	F	90.3	Very high	92.7	Very high	63 Å²	63	66 Å²	66	28%	0.276	36%	0.36	S	S	.	.			trans	-100.4	130	-179	-64.6	-88.6	0	0	0	110.5	L706 H709 F710 F746	F702-L706 HydrophobicContact CB-CB 3.95Å; F702-L706 WeakPolarHBondContact CB-O 3.37Å; F702-L706 HydrophobicContact CD1-CB 4.39Å; F702-L706 HydrophobicContact CG-CB 4.47Å; F702-H709 HydrophobicContact CD1-CB 4.43Å; F702-H709 HydrophobicContact CD2-CB 3.65Å; F702-H709 HydrophobicContact CE1-CB 4.39Å; F702-H709 HydrophobicContact CE2-CB 3.6Å; F702-H709 HydrophobicContact CG-CB 4.09Å; F702-H709 HydrophobicContact CZ-CB 3.99Å; F702-F710 HydrophobicContact CD2-CB 3.68Å; F702-F710 HydrophobicContact CE2-CB 3.9Å; F702-F746 HydrophobicContact CE2-CZ 4.34Å; F702-F746 HydrophobicContact CZ-CZ 4.26Å
703	E	83.4	Confident	92.8	Very high	143 Å²	143	63.7 Å²	63.7	67%	0.668	35%	0.345	S	S	*	.			trans	-86.2	159.7	177.6	-60.4	-169.3	165.7	0	0	111.8	K699	K699-E703 IonicContact NZ-OE1 3.15Å; K699-E703 PolarHBondContact NZ-OE1 3.12Å
704	G	82.4	Confident	92.9	Very high	67 Å²	67	60 Å²	60	69%	0.691	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	66.2	-136.7	175.3	0	0	0	0	0	113.5	L706 W707	G704-L706 VanDerWaalsContact C-N 3.27Å; G704-L706 PolarHBondContact O-N 3.42Å; G704-W707 VanDerWaalsContact O-CD1 3.29Å
705	T	83.5	Confident	93	Very high	132 Å²	132	59.5 Å²	59.5	81%	0.81	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-76.1	-11.1	-176	52	0	0	0	0	114	W707	T705-W707 VanDerWaalsContact C-N 3.33Å
706	L	89.3	Confident	93	Very high	91 Å²	91	56.8 Å²	56.8	48%	0.476	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-85.9	-1.7	-176.5	-65.8	173.9	0	0	0	113.7	F702 G704 K708 H709	F702-L706 HydrophobicContact CB-CB 3.95Å; F702-L706 WeakPolarHBondContact CB-O 3.37Å; F702-L706 HydrophobicContact CD1-CB 4.39Å; F702-L706 HydrophobicContact CG-CB 4.47Å; G704-L706 VanDerWaalsContact C-N 3.27Å; G704-L706 PolarHBondContact O-N 3.42Å; L706-K708 PolarHBondContact O-N 3.36Å; L706-H709 WeakPolarHBondContact O-CB 3.26Å; L706-H709 PolarHBondContact O-N 3.38Å; L706-H709 PolarHBondContact O-ND1 3.25Å
707	W	85.6	Confident	93.1	Very high	82 Å²	82	54 Å²	54	31%	0.311	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-49.8	-31.2	-178.1	70.1	-94	0	0	0	114	H685 G704 T705 H709 F710 D711	H685-W707 HydrophobicContact CB-CB 4.16Å; H685-W707 HydrophobicContact CB-CE3 4.41Å; H685-W707 AromaticContact CD2-CE3 3.7Å; H685-W707 AromaticContact CE1-CE3 3.33Å; H685-W707 AromaticContact CE1-CZ3 3.29Å; H685-W707 WeakPolarHBondContact CE1-CZ3 3.33Å; H685-W707 AromaticContact CG-CE3 3.58Å; H685-W707 AromaticContact ND1-CE3 3.36Å; H685-W707 AromaticContact ND1-CZ3 3.65Å; H685-W707 AromaticContact NE2-CE3 3.56Å; H685-W707 AromaticContact NE2-CZ3 3.81Å; G704-W707 VanDerWaalsContact O-CD1 3.29Å; T705-W707 VanDerWaalsContact C-N 3.33Å; W707-H709 PolarHBondContact O-N 3.39Å; W707-H709 VanDerWaalsContact O-N 3.14Å; W707-F710 CarbonylContact O-C 3.53Å; W707-F710 PolarHBondContact O-N 3.46Å; W707-F710 VanDerWaalsContact O-O 3.05Å; W707-D711 HydrophobicContact CZ3-CB 4.38Å
708	K	89.3	Confident	93.1	Very high	131 Å²	131	51.4 Å²	51.4	57%	0.57	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-63.3	-17.1	177.7	-70.6	-170.3	176.7	-175.4	0	114.7	L706 F710 N731	L706-K708 PolarHBondContact O-N 3.36Å; K708-F710 PolarHBondContact O-N 3.44Å; K708-N731 PolarHBondContact O-ND2 3.43Å
709	H	89.8	Confident	92.9	Very high	108 Å²	108	50 Å²	50	50%	0.5	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-69.3	-18.7	173.4	-68.8	76.3	0	0	0	112.3	F702 L706 W707	F702-H709 HydrophobicContact CD1-CB 4.43Å; F702-H709 HydrophobicContact CD2-CB 3.65Å; F702-H709 HydrophobicContact CE1-CB 4.39Å; F702-H709 HydrophobicContact CE2-CB 3.6Å; F702-H709 HydrophobicContact CG-CB 4.09Å; F702-H709 HydrophobicContact CZ-CB 3.99Å; L706-H709 WeakPolarHBondContact O-CB 3.26Å; L706-H709 PolarHBondContact O-N 3.38Å; L706-H709 PolarHBondContact O-ND1 3.25Å; W707-H709 PolarHBondContact O-N 3.39Å; W707-H709 VanDerWaalsContact O-N 3.14Å
710	F	94.4	Very high	92.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-142.4	78.2	171.5	-173.4	-139.6	0	0	0	109.7	H685 V687 Y700 F702 W707 K708 P713 V726 D728 L735	H685-F710 WeakPolarHBondContact CB-O 3.36Å; H685-F710 WeakPolarHBondContact O-CD1 3.42Å; V687-F710 HydrophobicContact CG1-CE1 4.16Å; V687-F710 HydrophobicContact CG1-CZ 3.97Å; V687-F710 HydrophobicContact CG2-CE1 4.47Å; Y700-F710 HydrophobicContact CD1-CD1 4.34Å; Y700-F710 HydrophobicContact CD1-CE1 4.17Å; F702-F710 HydrophobicContact CD2-CB 3.68Å; F702-F710 HydrophobicContact CE2-CB 3.9Å; W707-F710 CarbonylContact O-C 3.53Å; W707-F710 PolarHBondContact O-N 3.46Å; W707-F710 VanDerWaalsContact O-O 3.05Å; K708-F710 PolarHBondContact O-N 3.44Å; F710-P713 HydrophobicContact CE1-CB 4.03Å; F710-P713 HydrophobicContact CE1-CG 4.03Å; F710-P713 HydrophobicContact CE2-CB 3.93Å; F710-P713 HydrophobicContact CE2-CG 4.48Å; F710-P713 HydrophobicContact CZ-CB 3.52Å; F710-P713 HydrophobicContact CZ-CG 4.02Å; F710-V726 HydrophobicContact CE2-CG1 4.08Å; F710-V726 HydrophobicContact CZ-CB 4.41Å; F710-V726 HydrophobicContact CZ-CG1 3.83Å; F710-D728 WeakPolarHBondContact CA-OD2 3.22Å; F710-D728 HydrophobicContact CD2-CB 4.33Å; F710-D728 HydrophobicContact CE2-CB 4.48Å; F710-L735 HydrophobicContact CD2-CD1 4.16Å; F710-L735 HydrophobicContact CD2-CD2 3.53Å; F710-L735 HydrophobicContact CE2-CD1 4.12Å; F710-L735 HydrophobicContact CE2-CD2 3.61Å; F710-L735 HydrophobicContact CE2-CG 4.41Å; F710-L735 HydrophobicContact CG-CD2 4.18Å; F710-L735 HydrophobicContact CZ-CD2 4.29Å
711	D	93.8	Very high	92.1	Very high	28 Å²	28	57.5 Å²	57.5	15%	0.15	30%	0.303	C	S	.	.			trans	-77.9	-57.9	-162.8	-178.4	-25.2	0	0	0	111.4	H685 W707 D728 N730 N731	H685-D711 PolarHBondContact ND1-O 2.85Å; W707-D711 HydrophobicContact CZ3-CB 4.38Å; D711-D728 PolarHBondContact N-OD2 3.37Å; D711-N730 HydrophobicContact CB-CB 3.77Å; D711-N730 VanDerWaalsContact CG-CB 3.41Å; D711-N730 VanDerWaalsContact CG-ND2 3.28Å; D711-N730 PolarHBondContact OD1-ND2 3.38Å; D711-N730 WeakPolarHBondContact OD2-CB 3.4Å; D711-N730 PolarHBondContact OD2-ND2 3.36Å; D711-N731 PolarHBondContact N-ND2 2.93Å
712	S	96.4	Very high	92	Very high	9 Å²	9	58.2 Å²	58.2	6%	0.063	30%	0.3	C	S	.	.			trans	-133.6	80.2	-172.7	-165.5	0	0	0	0	111.7	T682 R714 D728 F729	T682-S712 WeakPolarHBondContact CG2-OG 3.26Å; S712-R714 PolarHBondContact O-N 2.9Å; S712-D728 PolarHBondContact N-OD1 2.89Å; S712-F729 WeakPolarHBondContact O-CB 3.38Å; S712-F729 PolarHBondContact O-N 3.18Å
713	P	97.9	Very high	92.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	130	173.1	17.4	-25.4	0	0	0	110.3	T682 R686 V687 F710 V726 T727	T682-P713 WeakPolarHBondContact CG2-O 3.44Å; T682-P713 PolarHBondContact OG1-O 3.45Å; R686-P713 VanDerWaalsContact O-CG 3.23Å; R686-P713 WeakPolarHBondContact O-CG 3.15Å; V687-P713 HydrophobicContact CG1-CB 3.89Å; F710-P713 HydrophobicContact CE1-CB 4.03Å; F710-P713 HydrophobicContact CE1-CG 4.03Å; F710-P713 HydrophobicContact CE2-CB 3.93Å; F710-P713 HydrophobicContact CE2-CG 4.48Å; F710-P713 HydrophobicContact CZ-CB 3.52Å; F710-P713 HydrophobicContact CZ-CG 4.02Å; P713-V726 HydrophobicContact CB-CG1 3.96Å; P713-T727 WeakPolarHBondContact CA-O 3.4Å
714	R	98.2	Very high	93	Very high	19 Å²	19	50.4 Å²	50.4	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	-88.2	-173.8	-172.6	61.6	59.8	97	10.7	112.3	W573 W667 D668 S680 S712 T727 F729 Q761	W573-R714 HydrophobicContact CH2-CG 4.33Å; W573-R714 HydrophobicContact CZ2-CG 3.76Å; W667-R714 VanDerWaalsContact CD1-CD 3.44Å; D668-R714 WeakPolarHBondContact CB-O 3.2Å; S680-R714 WeakPolarHBondContact CB-O 3.43Å; S680-R714 PolarHBondContact OG-O 2.94Å; S712-R714 PolarHBondContact O-N 2.9Å; R714-T727 PolarHBondContact N-O 2.53Å; R714-F729 HydrophobicContact CB-CB 3.87Å; R714-F729 HydrophobicContact CG-CB 4.4Å; R714-F729 HydrophobicContact CG-CD2 4.48Å; R714-Q761 HydrophobicContact CG-CB 4.46Å; R714-Q761 HydrophobicContact CG-CG 4.46Å
715	G	98.3	Very high	93.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	143.1	178.8	0	0	0	0	0	110.9	D668 V726 T727 Q761	D668-G715 VanDerWaalsContact OD2-CA 3.25Å; D668-G715 WeakPolarHBondContact OD2-CA 3.41Å; G715-V726 WeakPolarHBondContact O-CA 3.32Å; G715-T727 PolarHBondContact N-OG1 3.39Å; G715-T727 PolarHBondContact O-N 3.03Å; G715-Q761 VanDerWaalsContact CA-O 3.26Å; G715-Q761 WeakPolarHBondContact CA-O 3.49Å; G715-Q761 PolarHBondContact N-O 3.44Å
716	V	98.6	Very high	94.5	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.03	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.8	179.3	-63.6	0	0	0	0	111.6	D668 A670 L678 V687 V725 V726	D668-V716 HydrophobicContact CB-CG2 3.98Å; D668-V716 PolarHBondContact OD2-N 3.34Å; A670-V716 HydrophobicContact CB-CB 4.45Å; A670-V716 HydrophobicContact CB-CG2 3.87Å; A670-V716 WeakPolarHBondContact CB-O 3.5Å; L678-V716 HydrophobicContact CD2-CB 3.77Å; L678-V716 HydrophobicContact CD2-CG1 4.24Å; L678-V716 HydrophobicContact CD2-CG2 4.47Å; L678-V716 HydrophobicContact CG-CB 4.05Å; L678-V716 HydrophobicContact CG-CG1 4.28Å; L678-V716 HydrophobicContact CG-CG2 4.37Å; V687-V716 HydrophobicContact CG1-CG1 4.26Å; V716-V725 CarbonylContact C-O 3.38Å; V716-V725 WeakPolarHBondContact CA-O 3.37Å; V716-V726 HydrophobicContact CG1-CG1 4.03Å; V716-V726 HydrophobicContact CG1-CG2 4.15Å
717	A	98.4	Very high	94.9	Very high	9 Å²	9	36.6 Å²	36.6	7%	0.074	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	163.7	172.8	0	0	0	0	0	110.9	V725 V763 V765	A717-V725 HydrophobicContact CB-CB 4.47Å; A717-V725 PolarHBondContact N-O 3.37Å; A717-V725 PolarHBondContact O-N 2.85Å; A717-V763 HydrophobicContact CB-CG1 4.14Å; A717-V765 HydrophobicContact CB-CG2 4.31Å
718	F	97.9	Very high	95.5	Very high	27 Å²	27	32.7 Å²	32.7	12%	0.118	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.5	167.2	-70.5	-86.9	0	0	0	109.8	A670 N672 L678 L689 H723 L724	A670-F718 HydrophobicContact CB-CD2 4.06Å; A670-F718 HydrophobicContact CB-CE2 4.21Å; N672-F718 HydrophobicContact CB-CB 4.18Å; N672-F718 HydrophobicContact CB-CD1 3.86Å; N672-F718 HydrophobicContact CB-CD2 3.71Å; N672-F718 HydrophobicContact CB-CE1 4.07Å; N672-F718 HydrophobicContact CB-CE2 3.94Å; N672-F718 HydrophobicContact CB-CG 3.66Å; N672-F718 HydrophobicContact CB-CZ 4.09Å; L678-F718 HydrophobicContact CB-CE1 4.49Å; L678-F718 HydrophobicContact CB-CE2 3.59Å; L678-F718 HydrophobicContact CB-CZ 3.54Å; L678-F718 HydrophobicContact CD2-CE2 4.42Å; L678-F718 HydrophobicContact CD2-CZ 4.36Å; L689-F718 HydrophobicContact CD1-CE1 4.14Å; L689-F718 HydrophobicContact CD1-CZ 3.73Å; F718-H723 WeakPolarHBondContact CA-O 3.36Å; F718-L724 HydrophobicContact CD1-CD2 3.82Å; F718-L724 HydrophobicContact CE1-CD2 3.3Å; F718-L724 HydrophobicContact CZ-CD2 4.13Å
719	N	94	Very high	95.9	Very high	19 Å²	19	28.3 Å²	28.3	10%	0.102	14%	0.136	C	C	.	.			trans	-89.1	176.8	167.1	88.6	-14.1	0	0	0	110.6	E721 D722 H723 V725 V765 N769	N719-E721 PolarHBondContact O-N 3.36Å; N719-E721 VanDerWaalsContact O-N 3.15Å; N719-E721 VanDerWaalsContact OD1-C 3.28Å; N719-E721 WeakPolarHBondContact OD1-CA 3.08Å; N719-E721 PolarHBondContact OD1-N 2.92Å; N719-D722 PolarHBondContact O-N 3.43Å; N719-D722 VanDerWaalsContact O-N 3.12Å; N719-D722 PolarHBondContact OD1-N 2.94Å; N719-D722 VanDerWaalsContact OD1-N 3.17Å; N719-H723 PolarHBondContact N-O 2.75Å; N719-H723 WeakPolarHBondContact OD1-CB 3.43Å; N719-H723 PolarHBondContact OD1-N 2.71Å; N719-V725 HydrophobicContact CB-CG2 4.07Å; N719-V765 HydrophobicContact CB-CG1 4.29Å; N719-V765 HydrophobicContact CB-CG2 4.23Å; N719-N769 VanDerWaalsContact CB-OD1 3.31Å; N719-N769 WeakPolarHBondContact CB-OD1 3.49Å
720	H	88.4	Confident	96.2	Very high	121 Å²	121	25.8 Å²	25.8	56%	0.56	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-12.5	-177.5	-70.5	-165.6	0	0	0	114.6	D766 Q767 N769	H720-D766 PolarHBondContact NE2-O 2.87Å; H720-Q767 VanDerWaalsContact CE1-C 3.48Å; H720-Q767 PolarHBondContact CE1-O 3.27Å; H720-N769 PolarHBondContact N-OD1 2.89Å
721	E	88.9	Confident	96.3	Very high	123 Å²	123	28 Å²	28	58%	0.575	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	19	177.4	-62.1	172.2	-177.8	0	0	111.3	N719 H723	N719-E721 PolarHBondContact O-N 3.36Å; N719-E721 VanDerWaalsContact O-N 3.15Å; N719-E721 VanDerWaalsContact OD1-C 3.28Å; N719-E721 WeakPolarHBondContact OD1-CA 3.08Å; N719-E721 PolarHBondContact OD1-N 2.92Å; E721-H723 WeakPolarHBondContact CB-ND1 3.46Å; E721-H723 PolarHBondContact O-N 3.01Å; E721-H723 VanDerWaalsContact O-N 3.09Å; E721-H723 PolarHBondContact O-ND1 2.89Å; E721-H723 IonicContact OE2-CE1 3.14Å; E721-H723 PolarHBondContact OE2-CE1 2.98Å; E721-H723 VanDerWaalsContact OE2-CE1 3.28Å; E721-H723 IonicContact OE2-ND1 3.69Å
722	D	93.1	Very high	96.5	Very high	46 Å²	46	27.2 Å²	27.2	25%	0.246	13%	0.133	C	C	.	.			trans	58.8	16.2	-177.1	-71	-49.9	0	0	0	115.9	N672 N719 P739	N672-D722 PolarHBondContact ND2-OD1 3.39Å; N719-D722 PolarHBondContact O-N 3.43Å; N719-D722 VanDerWaalsContact O-N 3.12Å; N719-D722 PolarHBondContact OD1-N 2.94Å; N719-D722 VanDerWaalsContact OD1-N 3.17Å; D722-P739 HydrophobicContact CB-CG 4.29Å
723	H	96.4	Very high	96.5	Very high	40 Å²	40	32.1 Å²	32.1	19%	0.185	15%	0.15	C	C	.	.			trans	-68.4	144	169.6	-65.4	74.6	0	0	0	110.3	F718 N719 E721 V736 I737	F718-H723 WeakPolarHBondContact CA-O 3.36Å; N719-H723 PolarHBondContact N-O 2.75Å; N719-H723 WeakPolarHBondContact OD1-CB 3.43Å; N719-H723 PolarHBondContact OD1-N 2.71Å; E721-H723 WeakPolarHBondContact CB-ND1 3.46Å; E721-H723 PolarHBondContact O-N 3.01Å; E721-H723 VanDerWaalsContact O-N 3.09Å; E721-H723 PolarHBondContact O-ND1 2.89Å; E721-H723 IonicContact OE2-CE1 3.14Å; E721-H723 PolarHBondContact OE2-CE1 2.98Å; E721-H723 VanDerWaalsContact OE2-CE1 3.28Å; E721-H723 IonicContact OE2-ND1 3.69Å; H723-V736 HydrophobicContact CB-CG1 3.87Å; H723-I737 CarbonylContact C-O 3.53Å; H723-I737 VanDerWaalsContact CA-O 3.29Å; H723-I737 WeakPolarHBondContact CA-O 3.41Å; H723-I737 VanDerWaalsContact CB-O 3.29Å; H723-I737 WeakPolarHBondContact CB-O 3.23Å
724	L	98.1	Very high	96.4	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	113	179.8	-32.6	175.5	0	0	0	108.6	L678 V687 F718 V726 V736 I737	L678-L724 HydrophobicContact CD1-CB 4.5Å; L678-L724 HydrophobicContact CD1-CD1 3.96Å; L678-L724 HydrophobicContact CD1-CD2 4.36Å; L678-L724 HydrophobicContact CD2-CB 3.81Å; L678-L724 HydrophobicContact CD2-CD2 4.13Å; L678-L724 HydrophobicContact CD2-CG 4.42Å; V687-L724 HydrophobicContact CG2-CD1 4.46Å; F718-L724 HydrophobicContact CD1-CD2 3.82Å; F718-L724 HydrophobicContact CE1-CD2 3.3Å; F718-L724 HydrophobicContact CZ-CD2 4.13Å; L724-V726 HydrophobicContact CB-CG2 4.37Å; L724-V736 WeakPolarHBondContact O-CA 3.25Å; L724-I737 HydrophobicContact CB-CB 4.02Å; L724-I737 HydrophobicContact CB-CD1 4.28Å; L724-I737 HydrophobicContact CD1-CB 4.32Å; L724-I737 HydrophobicContact CD1-CG2 4.27Å; L724-I737 HydrophobicContact CG-CB 4.29Å; L724-I737 PolarHBondContact N-O 3.48Å; L724-I737 PolarHBondContact O-N 3.26Å
725	V	98.4	Very high	96.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.7	177.6	-174.7	0	0	0	0	108.3	V716 A717 N719 L734 L735 V736 V763 V765 I771	V716-V725 CarbonylContact C-O 3.38Å; V716-V725 WeakPolarHBondContact CA-O 3.37Å; A717-V725 HydrophobicContact CB-CB 4.47Å; A717-V725 PolarHBondContact N-O 3.37Å; A717-V725 PolarHBondContact O-N 2.85Å; N719-V725 HydrophobicContact CB-CG2 4.07Å; V725-L734 HydrophobicContact CG1-CD1 3.66Å; V725-L734 HydrophobicContact CG1-CG 4.43Å; V725-L735 CarbonylContact C-O 3.47Å; V725-L735 WeakPolarHBondContact CA-O 3.41Å; V725-V736 HydrophobicContact CG2-CG2 4.47Å; V725-V763 HydrophobicContact CG1-CG1 4.42Å; V725-V763 HydrophobicContact CG1-CG2 3.66Å; V725-V765 HydrophobicContact CG2-CG2 4.05Å; V725-I771 HydrophobicContact CG1-CD1 4.32Å; V725-I771 HydrophobicContact CG1-CG2 3.82Å
726	V	98.6	Very high	96.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	133.6	-170.3	-171.2	0	0	0	0	111.3	V687 F710 P713 G715 V716 L724 L734 L735 I737	V687-V726 HydrophobicContact CG1-CG1 3.89Å; V687-V726 HydrophobicContact CG1-CG2 4.01Å; F710-V726 HydrophobicContact CE2-CG1 4.08Å; F710-V726 HydrophobicContact CZ-CB 4.41Å; F710-V726 HydrophobicContact CZ-CG1 3.83Å; P713-V726 HydrophobicContact CB-CG1 3.96Å; G715-V726 WeakPolarHBondContact O-CA 3.32Å; V716-V726 HydrophobicContact CG1-CG1 4.03Å; V716-V726 HydrophobicContact CG1-CG2 4.15Å; L724-V726 HydrophobicContact CB-CG2 4.37Å; V726-L734 CarbonylContact O-C 3.51Å; V726-L735 PolarHBondContact N-O 2.97Å; V726-L735 PolarHBondContact O-N 3.38Å; V726-I737 HydrophobicContact CB-CD1 4.48Å; V726-I737 HydrophobicContact CG2-CD1 3.79Å
727	T	98.4	Very high	96.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.6	170.9	57.3	0	0	0	0	111.1	P713 R714 G715 L734 P760 Q761 V763 V773	P713-T727 WeakPolarHBondContact CA-O 3.4Å; R714-T727 PolarHBondContact N-O 2.53Å; G715-T727 PolarHBondContact N-OG1 3.39Å; G715-T727 PolarHBondContact O-N 3.03Å; T727-L734 HydrophobicContact CG2-CD1 4.02Å; T727-P760 HydrophobicContact CG2-CB 3.99Å; T727-Q761 WeakPolarHBondContact CG2-O 3.25Å; T727-Q761 PolarHBondContact OG1-O 3.26Å; T727-V763 HydrophobicContact CG2-CB 4Å; T727-V763 HydrophobicContact CG2-CG1 4.31Å; T727-V773 HydrophobicContact CG2-CG1 3.94Å
728	D	98	Very high	96.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	105.9	168.7	-170.3	-26.9	0	0	0	109.4	F710 D711 S712 N730 N731 H732 R733 L735 P760	F710-D728 WeakPolarHBondContact CA-OD2 3.22Å; F710-D728 HydrophobicContact CD2-CB 4.33Å; F710-D728 HydrophobicContact CE2-CB 4.48Å; D711-D728 PolarHBondContact N-OD2 3.37Å; S712-D728 PolarHBondContact N-OD1 2.89Å; D728-N730 VanDerWaalsContact C-N 3.32Å; D728-N730 PolarHBondContact O-N 3.44Å; D728-N730 PolarHBondContact OD1-N 3.23Å; D728-N730 VanDerWaalsContact OD1-N 3.07Å; D728-N731 HydrophobicContact CB-CB 4.22Å; D728-N731 PolarHBondContact OD1-N 3.1Å; D728-N731 WeakPolarHBondContact OD2-CB 3.43Å; D728-N731 PolarHBondContact OD2-ND2 3.28Å; D728-H732 PolarHBondContact O-N 3Å; D728-R733 PolarHBondContact N-O 3.27Å; D728-R733 PolarHBondContact O-N 3.19Å; D728-L735 HydrophobicContact CB-CD1 3.95Å; D728-P760 WeakPolarHBondContact O-CG 3.47Å
729	F	97.5	Very high	96.1	Very high	39 Å²	39	38.8 Å²	38.8	17%	0.171	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-29.2	-175	176.8	-90.6	0	0	0	113.5	S712 R714 R759 Q761	S712-F729 WeakPolarHBondContact O-CB 3.38Å; S712-F729 PolarHBondContact O-N 3.18Å; R714-F729 HydrophobicContact CB-CB 3.87Å; R714-F729 HydrophobicContact CG-CB 4.4Å; R714-F729 HydrophobicContact CG-CD2 4.48Å; F729-R759 VanDerWaalsContact CD1-NH1 3.33Å; F729-R759 HydrophobicContact CD2-CB 4.02Å; F729-R759 HydrophobicContact CE2-CB 3.61Å; F729-R759 HydrophobicContact CE2-CG 4.18Å; F729-R759 HydrophobicContact CZ-CB 4.05Å; F729-R759 HydrophobicContact CZ-CG 4.09Å; F729-R759 WeakPolarHBondContact O-CD 3.22Å; F729-R759 PolarHBondContact O-NH1 3.28Å; F729-Q761 HydrophobicContact CD2-CG 4.12Å; F729-Q761 HydrophobicContact CE2-CG 4.18Å
730	N	96.3	Very high	96	Very high	54 Å²	54	40.6 Å²	40.6	29%	0.289	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-31.9	-177.4	-85.2	-7.8	0	0	0	112.3	D711 D728 H732 R759	D711-N730 HydrophobicContact CB-CB 3.77Å; D711-N730 VanDerWaalsContact CG-CB 3.41Å; D711-N730 VanDerWaalsContact CG-ND2 3.28Å; D711-N730 PolarHBondContact OD1-ND2 3.38Å; D711-N730 WeakPolarHBondContact OD2-CB 3.4Å; D711-N730 PolarHBondContact OD2-ND2 3.36Å; D728-N730 VanDerWaalsContact C-N 3.32Å; D728-N730 PolarHBondContact O-N 3.44Å; D728-N730 PolarHBondContact OD1-N 3.23Å; D728-N730 VanDerWaalsContact OD1-N 3.07Å; N730-H732 PolarHBondContact O-CD2 3.19Å; N730-H732 PolarHBondContact O-NE2 2.66Å; N730-R759 PolarHBondContact OD1-NH1 3.49Å
731	N	96.8	Very high	96.3	Very high	46 Å²	46	35.3 Å²	35.3	25%	0.246	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-4.1	176.2	-70.4	-40.3	0	0	0	114.2	K708 D711 D728 R733	K708-N731 PolarHBondContact O-ND2 3.43Å; D711-N731 PolarHBondContact N-ND2 2.93Å; D728-N731 HydrophobicContact CB-CB 4.22Å; D728-N731 PolarHBondContact OD1-N 3.1Å; D728-N731 WeakPolarHBondContact OD2-CB 3.43Å; D728-N731 PolarHBondContact OD2-ND2 3.28Å; N731-R733 WeakPolarHBondContact O-CG 3.12Å; N731-R733 PolarHBondContact O-N 3.35Å
732	H	97.6	Very high	96.4	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.056	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	43.3	176.3	-56.2	-110.9	0	0	0	113	D728 N730 S749 E750 F757 L758 R759	D728-H732 PolarHBondContact O-N 3Å; N730-H732 PolarHBondContact O-CD2 3.19Å; N730-H732 PolarHBondContact O-NE2 2.66Å; H732-S749 CarbonylContact O-C 3.48Å; H732-E750 HydrophobicContact CB-CB 3.77Å; H732-E750 HydrophobicContact CB-CG 4.14Å; H732-E750 IonicContact CE1-OE1 2.99Å; H732-E750 IonicContact NE2-OE1 3.5Å; H732-F757 WeakPolarHBondContact CB-O 3.25Å; H732-F757 PolarHBondContact ND1-O 3.33Å; H732-L758 WeakPolarHBondContact ND1-CA 3.48Å; H732-R759 PolarHBondContact ND1-N 3.26Å
733	R	96.2	Very high	96.4	Very high	112 Å²	112	36.8 Å²	36.8	42%	0.423	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	165.8	-173.1	-69.5	176.6	-161.6	-166.2	0.7	111.8	D728 N731	D728-R733 PolarHBondContact N-O 3.27Å; D728-R733 PolarHBondContact O-N 3.19Å; N731-R733 WeakPolarHBondContact O-CG 3.12Å; N731-R733 PolarHBondContact O-N 3.35Å
734	L	96.9	Very high	96.4	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.3	170.5	176.6	73.3	0	0	0	108.8	V725 V726 T727 L747 F757 V763 I771 V773	V725-L734 HydrophobicContact CG1-CD1 3.66Å; V725-L734 HydrophobicContact CG1-CG 4.43Å; V726-L734 CarbonylContact O-C 3.51Å; T727-L734 HydrophobicContact CG2-CD1 4.02Å; L734-L747 HydrophobicContact CB-CB 4.17Å; L734-L747 HydrophobicContact CD2-CB 4.39Å; L734-L747 HydrophobicContact CD2-CD1 3.94Å; L734-L747 PolarHBondContact N-O 3.49Å; L734-L747 PolarHBondContact O-N 3.24Å; L734-F757 HydrophobicContact CB-CE2 4.22Å; L734-V763 HydrophobicContact CD1-CG2 4.18Å; L734-I771 HydrophobicContact CD1-CG2 4.41Å; L734-I771 HydrophobicContact CD2-CD1 4.09Å; L734-I771 HydrophobicContact CD2-CG2 3.85Å; L734-V773 HydrophobicContact CD1-CG2 4.27Å; L734-V773 HydrophobicContact CD2-CG2 4.29Å
735	L	97.7	Very high	96.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.6	175.6	-73.7	75	0	0	0	108.9	Y700 F710 V725 V726 D728 I737 R745 F746	Y700-L735 HydrophobicContact CE1-CD2 4.09Å; F710-L735 HydrophobicContact CD2-CD1 4.16Å; F710-L735 HydrophobicContact CD2-CD2 3.53Å; F710-L735 HydrophobicContact CE2-CD1 4.12Å; F710-L735 HydrophobicContact CE2-CD2 3.61Å; F710-L735 HydrophobicContact CE2-CG 4.41Å; F710-L735 HydrophobicContact CG-CD2 4.18Å; F710-L735 HydrophobicContact CZ-CD2 4.29Å; V725-L735 CarbonylContact C-O 3.47Å; V725-L735 WeakPolarHBondContact CA-O 3.41Å; V726-L735 PolarHBondContact N-O 2.97Å; V726-L735 PolarHBondContact O-N 3.38Å; D728-L735 HydrophobicContact CB-CD1 3.95Å; L735-I737 HydrophobicContact CB-CG1 4.27Å; L735-R745 CarbonylContact C-O 3.54Å; L735-R745 WeakPolarHBondContact CA-O 3.27Å; L735-F746 HydrophobicContact CD1-CD1 4.04Å; L735-F746 HydrophobicContact CD1-CE1 4.16Å; L735-F746 HydrophobicContact CD2-CD1 4.11Å; L735-F746 HydrophobicContact CD2-CE1 3.51Å; L735-F746 HydrophobicContact CD2-CZ 3.97Å; L735-F746 HydrophobicContact CG-CD1 3.72Å; L735-F746 HydrophobicContact CG-CE1 3.68Å; L735-F746 HydrophobicContact CG-CG 4.5Å; L735-F746 HydrophobicContact CG-CZ 4.41Å
736	V	97.5	Very high	96.1	Very high	12 Å²	12	44.5 Å²	44.5	7%	0.073	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	101.7	168.2	-176.4	0	0	0	0	107.3	H723 L724 V725 A744 R745 L747 I771	H723-V736 HydrophobicContact CB-CG1 3.87Å; L724-V736 WeakPolarHBondContact O-CA 3.25Å; V725-V736 HydrophobicContact CG2-CG2 4.47Å; V736-A744 CarbonylContact O-C 3.56Å; V736-A744 WeakPolarHBondContact O-CA 3.2Å; V736-R745 PolarHBondContact N-O 2.86Å; V736-R745 PolarHBondContact O-N 3.33Å; V736-L747 HydrophobicContact CG2-CD1 4.03Å; V736-I771 HydrophobicContact CG2-CD1 4.04Å
737	I	97.9	Very high	95.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	136.1	-172.7	-50.9	160.7	0	0	0	108.7	V687 Y700 H723 L724 V726 L735 A744	V687-I737 HydrophobicContact CG2-CD1 3.94Å; Y700-I737 HydrophobicContact CD1-CD1 3.43Å; Y700-I737 VanDerWaalsContact CD1-CD1 3.43Å; Y700-I737 HydrophobicContact CD1-CG1 3.86Å; Y700-I737 HydrophobicContact CD1-CG2 4.16Å; Y700-I737 HydrophobicContact CD2-CG2 3.55Å; Y700-I737 HydrophobicContact CE1-CD1 4.05Å; Y700-I737 HydrophobicContact CE1-CG1 4.04Å; Y700-I737 HydrophobicContact CE2-CG2 4.01Å; Y700-I737 HydrophobicContact CG-CD1 3.84Å; Y700-I737 HydrophobicContact CG-CG1 4.2Å; Y700-I737 HydrophobicContact CG-CG2 3.63Å; H723-I737 CarbonylContact C-O 3.53Å; H723-I737 VanDerWaalsContact CA-O 3.29Å; H723-I737 WeakPolarHBondContact CA-O 3.41Å; H723-I737 VanDerWaalsContact CB-O 3.29Å; H723-I737 WeakPolarHBondContact CB-O 3.23Å; L724-I737 HydrophobicContact CB-CB 4.02Å; L724-I737 HydrophobicContact CB-CD1 4.28Å; L724-I737 HydrophobicContact CD1-CB 4.32Å; L724-I737 HydrophobicContact CD1-CG2 4.27Å; L724-I737 HydrophobicContact CG-CB 4.29Å; L724-I737 PolarHBondContact N-O 3.48Å; L724-I737 PolarHBondContact O-N 3.26Å; V726-I737 HydrophobicContact CB-CD1 4.48Å; V726-I737 HydrophobicContact CG2-CD1 3.79Å; L735-I737 HydrophobicContact CB-CG1 4.27Å; I737-A744 HydrophobicContact CB-CB 4.15Å; I737-A744 HydrophobicContact CG1-CB 3.71Å; I737-A744 HydrophobicContact CG2-CB 4.38Å
738	R	96.1	Very high	95.7	Very high	128 Å²	128	47.7 Å²	47.7	48%	0.483	24%	0.242	S	C	.	.			trans	-61.3	150.3	175.1	-71.8	174	63.8	115.8	0.8	111.6	D740 C741 A743	R738-D740 WeakPolarHBondContact CB-OD1 3.42Å; R738-D740 IonicContact CZ-OD2 3.96Å; R738-D740 IonicContact NE-OD1 3.72Å; R738-D740 IonicContact NE-OD2 2.7Å; R738-D740 PolarHBondContact NE-OD2 3.3Å; R738-D740 IonicContact NH2-OD2 2.58Å; R738-D740 PolarHBondContact NH2-OD2 3.49Å; R738-D740 VanDerWaalsContact NH2-OD2 3.15Å; R738-D740 PolarHBondContact O-N 2.69Å; R738-D740 VanDerWaalsContact O-N 3.13Å; R738-C741 PolarHBondContact O-N 3.43Å; R738-A743 PolarHBondContact N-O 3.32Å
739	P	94.3	Very high	95.6	Very high	58 Å²	58	49.9 Å²	49.9	38%	0.377	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.7	178	-23	31	0	0	0	113.5	D722 C741	D722-P739 HydrophobicContact CB-CG 4.29Å; P739-C741 PolarHBondContact O-N 2.79Å
740	D	92.8	Very high	95.6	Very high	58 Å²	58	53.9 Å²	53.9	31%	0.31	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-7.8	176.4	59	27.5	0	0	0	114.3	N698 R738 Q742	N698-D740 PolarHBondContact ND2-O 3.4Å; N698-D740 VanDerWaalsContact ND2-O 3.13Å; R738-D740 WeakPolarHBondContact CB-OD1 3.42Å; R738-D740 IonicContact CZ-OD2 3.96Å; R738-D740 IonicContact NE-OD1 3.72Å; R738-D740 IonicContact NE-OD2 2.7Å; R738-D740 PolarHBondContact NE-OD2 3.3Å; R738-D740 IonicContact NH2-OD2 2.58Å; R738-D740 PolarHBondContact NH2-OD2 3.49Å; R738-D740 VanDerWaalsContact NH2-OD2 3.15Å; R738-D740 PolarHBondContact O-N 2.69Å; R738-D740 VanDerWaalsContact O-N 3.13Å; D740-Q742 HydrophobicContact CB-CG 4.09Å; D740-Q742 PolarHBondContact O-N 2.92Å; D740-Q742 WeakPolarHBondContact OD1-CB 3.5Å; D740-Q742 PolarHBondContact OD1-N 3.3Å
741	C	94.3	Very high	95.6	Very high	10 Å²	10	52 Å²	52	7%	0.068	27%	0.27	C	S	.	.	S	Bend	trans	55.4	25.2	-173.6	-59.2	0	0	0	0	114.3	Y700 R738 P739	Y700-C741 HydrophobicContact CD2-CB 4.44Å; Y700-C741 WeakPolarHBondContact CD2-O 3.39Å; R738-C741 PolarHBondContact O-N 3.43Å; P739-C741 PolarHBondContact O-N 2.79Å
742	Q	92.1	Very high	95.6	Very high	153 Å²	153	54.3 Å²	54.3	72%	0.715	29%	0.286	S	S	*	.	S	Bend	trans	-92	-30.4	-179.4	-64.3	-59.7	-41.6	0	0	113.2	D740	D740-Q742 HydrophobicContact CB-CG 4.09Å; D740-Q742 PolarHBondContact O-N 2.92Å; D740-Q742 WeakPolarHBondContact OD1-CB 3.5Å; D740-Q742 PolarHBondContact OD1-N 3.3Å
743	A	93.4	Very high	95.6	Very high	47 Å²	47	60.9 Å²	60.9	39%	0.388	31%	0.314	S	S	.	.			trans	-145.9	158.8	179.9	0	0	0	0	0	111.9	R738	R738-A743 PolarHBondContact N-O 3.32Å
744	A	95.2	Very high	95.6	Very high	24 Å²	24	59.8 Å²	59.8	20%	0.198	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	148.9	175.8	0	0	0	0	0	111.4	Y700 V736 I737 F746	Y700-A744 HydrophobicContact CE1-CB 4.02Å; Y700-A744 HydrophobicContact CE2-CB 4.2Å; Y700-A744 VanDerWaalsContact OH-CB 3.26Å; Y700-A744 WeakPolarHBondContact OH-CB 3.04Å; V736-A744 CarbonylContact O-C 3.56Å; V736-A744 WeakPolarHBondContact O-CA 3.2Å; I737-A744 HydrophobicContact CB-CB 4.15Å; I737-A744 HydrophobicContact CG1-CB 3.71Å; I737-A744 HydrophobicContact CG2-CB 4.38Å; A744-F746 HydrophobicContact CB-CE2 4.32Å
745	R	95.1	Very high	95.4	Very high	95 Å²	95	60.4 Å²	60.4	36%	0.358	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.4	169.4	-173.9	172	63.3	112.3	-4.6	109.3	L735 V736 L747 A786 S787	L735-R745 CarbonylContact C-O 3.54Å; L735-R745 WeakPolarHBondContact CA-O 3.27Å; V736-R745 PolarHBondContact N-O 2.86Å; V736-R745 PolarHBondContact O-N 3.33Å; R745-L747 HydrophobicContact CG-CD2 4.14Å; R745-A786 PolarHBondContact NH2-O 2.87Å; R745-S787 PolarHBondContact NH1-O 3.29Å
746	F	95.6	Very high	95.4	Very high	83 Å²	83	62.7 Å²	62.7	36%	0.364	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.7	179.8	-64.5	-99.9	0	0	0	110	F702 L735 A744	F702-F746 HydrophobicContact CE2-CZ 4.34Å; F702-F746 HydrophobicContact CZ-CZ 4.26Å; L735-F746 HydrophobicContact CD1-CD1 4.04Å; L735-F746 HydrophobicContact CD1-CE1 4.16Å; L735-F746 HydrophobicContact CD2-CD1 4.11Å; L735-F746 HydrophobicContact CD2-CE1 3.51Å; L735-F746 HydrophobicContact CD2-CZ 3.97Å; L735-F746 HydrophobicContact CG-CD1 3.72Å; L735-F746 HydrophobicContact CG-CE1 3.68Å; L735-F746 HydrophobicContact CG-CG 4.5Å; L735-F746 HydrophobicContact CG-CZ 4.41Å; A744-F746 HydrophobicContact CB-CE2 4.32Å
747	L	95.2	Very high	95.5	Very high	28 Å²	28	62.2 Å²	62.2	15%	0.147	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	145	-175.2	-57.7	173.7	0	0	0	111.4	L734 V736 R745	L734-L747 HydrophobicContact CB-CB 4.17Å; L734-L747 HydrophobicContact CD2-CB 4.39Å; L734-L747 HydrophobicContact CD2-CD1 3.94Å; L734-L747 PolarHBondContact N-O 3.49Å; L734-L747 PolarHBondContact O-N 3.24Å; V736-L747 HydrophobicContact CG2-CD1 4.03Å; R745-L747 HydrophobicContact CG-CD2 4.14Å
748	G	93.8	Very high	95.5	Very high	39 Å²	39	64 Å²	64	40%	0.402	34%	0.341	S	S	.	.			trans	69.8	-178.7	-178.4	0	0	0	0	0	114	G755	G748-G755 WeakPolarHBondContact CA-O 3.22Å
749	S	94.9	Very high	95.5	Very high	47 Å²	47	61.6 Å²	61.6	33%	0.329	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	172.6	176.9	60.4	0	0	0	0	110	H732 G751 Q756 F757	H732-S749 CarbonylContact O-C 3.48Å; S749-G751 PolarHBondContact O-N 3.23Å; S749-Q756 CarbonylContact O-C 3.58Å; S749-Q756 WeakPolarHBondContact O-CA 3.26Å; S749-Q756 WeakPolarHBondContact O-CB 3.42Å; S749-F757 PolarHBondContact O-N 2.87Å
750	E	97.9	Very high	95.7	Very high	123 Å²	123	58.9 Å²	58.9	58%	0.575	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	133.5	174.2	-171.8	176.4	-175.5	0	0	111.7	H732 F757 L758	H732-E750 HydrophobicContact CB-CB 3.77Å; H732-E750 HydrophobicContact CB-CG 4.14Å; H732-E750 IonicContact CE1-OE1 2.99Å; H732-E750 IonicContact NE2-OE1 3.5Å; E750-F757 WeakPolarHBondContact CA-O 3.24Å; E750-L758 HydrophobicContact CG-CD2 3.69Å
751	G	97.1	Very high	96	Very high	14 Å²	14	56.9 Å²	56.9	14%	0.144	30%	0.303	C	S	.	.	S	Bend	trans	151.1	-172.8	170.9	0	0	0	0	0	114.6	S749 Q756 F757 N778	S749-G751 PolarHBondContact O-N 3.23Å; G751-Q756 CarbonylContact O-C 3.51Å; G751-F757 PolarHBondContact N-O 3.45Å; G751-F757 VanDerWaalsContact N-O 3.11Å; G751-F757 CarbonylContact O-C 3.38Å; G751-F757 PolarHBondContact O-N 2.86Å; G751-N778 PolarHBondContact O-ND2 3.01Å
752	T	96.9	Very high	96.2	Very high	95 Å²	95	56.5 Å²	56.5	58%	0.583	30%	0.3	S	S	*	.	S	Bend	trans	-107.9	-9.7	-172.6	56.6	0	0	0	0	113.6	L758 R780	T752-L758 HydrophobicContact CG2-CD1 3.97Å; T752-R780 PolarHBondContact O-NH2 2.9Å
753	K	97	Very high	96.5	Very high	150 Å²	150	49.5 Å²	49.5	65%	0.652	27%	0.268	S	S	*	.	S	Bend	trans	-78	170.2	-179.7	-59	-177.2	179.7	-178.5	0	111.8	G755 Q756 R780	K753-G755 PolarHBondContact O-N 2.85Å; K753-Q756 HydrophobicContact CB-CG 4.22Å; K753-Q756 VanDerWaalsContact N-OE1 3.11Å; K753-Q756 WeakPolarHBondContact O-CB 3.42Å; K753-Q756 PolarHBondContact O-N 2.92Å; K753-R780 PolarHBondContact O-NH2 3.01Å
754	D	95.5	Very high	96.7	Very high	89 Å²	89	47.7 Å²	47.7	48%	0.476	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	133.1	174.4	-66.2	-18.8	0	0	0	111.4	Q756 R780 F790 N793	D754-Q756 PolarHBondContact O-N 2.86Å; D754-R780 IonicContact OD1-NH1 2.75Å; D754-R780 PolarHBondContact OD1-NH1 2.96Å; D754-F790 HydrophobicContact CB-CD1 3.81Å; D754-F790 HydrophobicContact CB-CD2 3.95Å; D754-F790 HydrophobicContact CB-CE1 3.69Å; D754-F790 HydrophobicContact CB-CE2 3.83Å; D754-F790 HydrophobicContact CB-CG 3.92Å; D754-F790 HydrophobicContact CB-CZ 3.7Å; D754-F790 WeakPolarHBondContact OD2-CE1 3.29Å; D754-N793 PolarHBondContact OD1-ND2 2.76Å
755	G	94.1	Very high	96.7	Very high	14 Å²	14	47.8 Å²	47.8	14%	0.144	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	-0.4	-173.2	0	0	0	0	0	115.6	G748 K753	G748-G755 WeakPolarHBondContact CA-O 3.22Å; K753-G755 PolarHBondContact O-N 2.85Å
756	Q	97.8	Very high	96.6	Very high	50 Å²	50	43.4 Å²	43.4	23%	0.234	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	151.1	169.4	-58.5	-177.9	-29.4	0	0	110.7	S749 G751 K753 D754 R780 Q782	S749-Q756 CarbonylContact O-C 3.58Å; S749-Q756 WeakPolarHBondContact O-CA 3.26Å; S749-Q756 WeakPolarHBondContact O-CB 3.42Å; G751-Q756 CarbonylContact O-C 3.51Å; K753-Q756 HydrophobicContact CB-CG 4.22Å; K753-Q756 VanDerWaalsContact N-OE1 3.11Å; K753-Q756 WeakPolarHBondContact O-CB 3.42Å; K753-Q756 PolarHBondContact O-N 2.92Å; D754-Q756 PolarHBondContact O-N 2.86Å; Q756-R780 PolarHBondContact O-NH2 3.07Å; Q756-Q782 PolarHBondContact O-NE2 2.98Å
757	F	98.3	Very high	96.1	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.5	-175.5	-55	-70.6	0	0	0	112.3	H732 L734 S749 E750 G751 P760 V773 D775 Q782 F784	H732-F757 WeakPolarHBondContact CB-O 3.25Å; H732-F757 PolarHBondContact ND1-O 3.33Å; L734-F757 HydrophobicContact CB-CE2 4.22Å; S749-F757 PolarHBondContact O-N 2.87Å; E750-F757 WeakPolarHBondContact CA-O 3.24Å; G751-F757 PolarHBondContact N-O 3.45Å; G751-F757 VanDerWaalsContact N-O 3.11Å; G751-F757 CarbonylContact O-C 3.38Å; G751-F757 PolarHBondContact O-N 2.86Å; F757-P760 HydrophobicContact CB-CB 4.14Å; F757-P760 HydrophobicContact CB-CG 4.04Å; F757-P760 HydrophobicContact CD1-CB 4.37Å; F757-P760 HydrophobicContact CG-CB 4.25Å; F757-P760 HydrophobicContact CG-CG 4.42Å; F757-V773 HydrophobicContact CD1-CG1 4.23Å; F757-V773 HydrophobicContact CE1-CB 4.06Å; F757-V773 HydrophobicContact CE1-CG1 3.84Å; F757-V773 HydrophobicContact CE1-CG2 4.43Å; F757-V773 HydrophobicContact CZ-CG1 4.44Å; F757-V773 HydrophobicContact CZ-CG2 4.47Å; F757-D775 WeakPolarHBondContact CA-OD1 3.24Å; F757-D775 HydrophobicContact CD1-CB 4.19Å; F757-Q782 HydrophobicContact CE1-CB 4.48Å; F757-F784 AromaticContact CE1-CE2 3.72Å; F757-F784 HydrophobicContact CE1-CE2 3.72Å; F757-F784 AromaticContact CE1-CZ 3.68Å; F757-F784 HydrophobicContact CE1-CZ 3.68Å; F757-F784 HydrophobicContact CE2-CZ 4.43Å; F757-F784 HydrophobicContact CZ-CE1 4.33Å; F757-F784 AromaticContact CZ-CE2 3.53Å; F757-F784 HydrophobicContact CZ-CE2 3.53Å; F757-F784 AromaticContact CZ-CZ 3.35Å; F757-F784 HydrophobicContact CZ-CZ 3.35Å
758	L	98	Very high	95.6	Very high	39 Å²	39	42.5 Å²	42.5	20%	0.204	23%	0.231	C	C	.	.	S	Bend	trans	-120.6	109.8	160.3	-67.4	-177.4	0	0	0	109.1	H732 E750 T752 D775 R777 N778	H732-L758 WeakPolarHBondContact ND1-CA 3.48Å; E750-L758 HydrophobicContact CG-CD2 3.69Å; T752-L758 HydrophobicContact CG2-CD1 3.97Å; L758-D775 PolarHBondContact N-OD1 3.1Å; L758-R777 HydrophobicContact CB-CB 3.57Å; L758-R777 WeakPolarHBondContact O-CB 3.41Å; L758-R777 PolarHBondContact O-N 3.4Å; L758-N778 WeakPolarHBondContact CD1-OD1 3.13Å; L758-N778 PolarHBondContact N-ND2 3.1Å
759	R	97.4	Very high	95.5	Very high	77 Å²	77	41.7 Å²	41.7	29%	0.291	22%	0.217	S	C	.	.	S	Bend	trans	53.5	61.7	179.9	-56.9	-55.2	-173.5	163	-5.7	112.3	F729 N730 H732 Q761 S776 R777	F729-R759 VanDerWaalsContact CD1-NH1 3.33Å; F729-R759 HydrophobicContact CD2-CB 4.02Å; F729-R759 HydrophobicContact CE2-CB 3.61Å; F729-R759 HydrophobicContact CE2-CG 4.18Å; F729-R759 HydrophobicContact CZ-CB 4.05Å; F729-R759 HydrophobicContact CZ-CG 4.09Å; F729-R759 WeakPolarHBondContact O-CD 3.22Å; F729-R759 PolarHBondContact O-NH1 3.28Å; N730-R759 PolarHBondContact OD1-NH1 3.49Å; H732-R759 PolarHBondContact ND1-N 3.26Å; R759-Q761 PolarHBondContact O-N 2.75Å; R759-S776 WeakPolarHBondContact O-CB 3.28Å; R759-R777 HydrophobicContact CB-CB 4.3Å; R759-R777 HydrophobicContact CB-CG 3.71Å; R759-R777 HydrophobicContact CG-CB 4.35Å; R759-R777 HydrophobicContact CG-CG 3.59Å
760	P	98.3	Very high	95.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	139.3	177.3	28.8	-34.3	0	0	0	110	T727 D728 F757 V773 A774	T727-P760 HydrophobicContact CG2-CB 3.99Å; D728-P760 WeakPolarHBondContact O-CG 3.47Å; F757-P760 HydrophobicContact CB-CB 4.14Å; F757-P760 HydrophobicContact CB-CG 4.04Å; F757-P760 HydrophobicContact CD1-CB 4.37Å; F757-P760 HydrophobicContact CG-CB 4.25Å; F757-P760 HydrophobicContact CG-CG 4.42Å; P760-V773 HydrophobicContact CB-CG1 3.98Å; P760-A774 WeakPolarHBondContact CA-O 3.33Å
761	Q	98.3	Very high	95.4	Very high	17 Å²	17	34 Å²	34	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-111.8	-176.2	-69.1	-153.8	76.8	0	0	111.4	W573 R714 G715 T727 F729 R759 A774 S776	W573-Q761 HydrophobicContact CZ2-CB 4.16Å; R714-Q761 HydrophobicContact CG-CB 4.46Å; R714-Q761 HydrophobicContact CG-CG 4.46Å; G715-Q761 VanDerWaalsContact CA-O 3.26Å; G715-Q761 WeakPolarHBondContact CA-O 3.49Å; G715-Q761 PolarHBondContact N-O 3.44Å; T727-Q761 WeakPolarHBondContact CG2-O 3.25Å; T727-Q761 PolarHBondContact OG1-O 3.26Å; F729-Q761 HydrophobicContact CD2-CG 4.12Å; F729-Q761 HydrophobicContact CE2-CG 4.18Å; R759-Q761 PolarHBondContact O-N 2.75Å; Q761-A774 PolarHBondContact N-O 3.18Å; Q761-S776 PolarHBondContact NE2-OG 3.4Å
762	G	97.9	Very high	95.4	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	150.9	-179.5	0	0	0	0	0	112	A774 S808 V810	G762-A774 PolarHBondContact O-N 2.78Å; G762-S808 WeakPolarHBondContact CA-O 3.36Å; G762-S808 PolarHBondContact N-O 2.86Å; G762-V810 VanDerWaalsContact C-CG1 3.5Å
763	V	98.6	Very high	95.5	Very high	6 Å²	6	28.8 Å²	28.8	4%	0.036	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.2	172.3	61.2	0	0	0	0	109.1	A717 V725 T727 L734 I771 I772 V773	A717-V763 HydrophobicContact CB-CG1 4.14Å; V725-V763 HydrophobicContact CG1-CG1 4.42Å; V725-V763 HydrophobicContact CG1-CG2 3.66Å; T727-V763 HydrophobicContact CG2-CB 4Å; T727-V763 HydrophobicContact CG2-CG1 4.31Å; L734-V763 HydrophobicContact CD1-CG2 4.18Å; V763-I771 HydrophobicContact CG2-CG2 3.53Å; V763-I772 CarbonylContact C-O 3.51Å; V763-I772 VanDerWaalsContact CA-O 3.27Å; V763-I772 WeakPolarHBondContact CA-O 3.33Å; V763-V773 HydrophobicContact CG2-CG2 4.05Å
764	A	97.9	Very high	95.5	Very high	10 Å²	10	21.7 Å²	21.7	8%	0.083	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	158	173.1	0	0	0	0	0	109.7	I772 V810 V812	A764-I772 PolarHBondContact N-O 3.44Å; A764-I772 PolarHBondContact O-N 3.47Å; A764-V810 HydrophobicContact CB-CG1 4.03Å; A764-V812 HydrophobicContact CB-CG2 4.05Å
765	V	96.4	Very high	95.6	Very high	26 Å²	26	17.4 Å²	17.4	16%	0.158	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.4	172.6	-176.6	0	0	0	0	107.8	A717 N719 V725 R770	A717-V765 HydrophobicContact CB-CG2 4.31Å; N719-V765 HydrophobicContact CB-CG1 4.29Å; N719-V765 HydrophobicContact CB-CG2 4.23Å; V725-V765 HydrophobicContact CG2-CG2 4.05Å; V765-R770 VanDerWaalsContact CA-O 3.32Å; V765-R770 WeakPolarHBondContact CA-O 3.26Å
766	D	91.8	Very high	95.8	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.011	8%	0.081	C	C	.	.			trans	-90	-180	-180	83	-15.5	0	0	0	112.8	Y549 H720 E768 N769 R770 I772 V812	Y549-D766 VanDerWaalsContact CE2-OD2 3.3Å; Y549-D766 WeakPolarHBondContact CE2-OD2 2.96Å; Y549-D766 PolarHBondContact OH-OD2 3.07Å; H720-D766 PolarHBondContact NE2-O 2.87Å; D766-E768 PolarHBondContact O-N 3.37Å; D766-E768 WeakPolarHBondContact OD1-CA 3.18Å; D766-E768 PolarHBondContact OD1-N 2.92Å; D766-N769 PolarHBondContact O-N 3.43Å; D766-N769 PolarHBondContact OD1-N 3.33Å; D766-N769 VanDerWaalsContact OD1-N 3.11Å; D766-R770 PolarHBondContact N-O 3.28Å; D766-R770 VanDerWaalsContact N-O 3.07Å; D766-R770 WeakPolarHBondContact OD1-CA 3.47Å; D766-R770 VanDerWaalsContact OD1-CB 3.3Å; D766-R770 WeakPolarHBondContact OD1-CB 3.42Å; D766-R770 PolarHBondContact OD1-N 3.46Å; D766-R770 IonicContact OD1-NE 2.74Å; D766-R770 IonicContact OD2-CZ 3.53Å; D766-R770 IonicContact OD2-NE 3.35Å; D766-R770 PolarHBondContact OD2-NE 3.01Å; D766-R770 IonicContact OD2-NH2 2.65Å; D766-R770 PolarHBondContact OD2-NH2 2.97Å; D766-I772 HydrophobicContact CB-CD1 4.05Å; D766-V812 HydrophobicContact CB-CG1 4.15Å; D766-V812 HydrophobicContact CB-CG2 4.17Å
767	Q	85.6	Confident	95.8	Very high	78 Å²	78	21.5 Å²	21.5	36%	0.364	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-8.9	-179	-56.9	83.9	6.4	0	0	114.1	H720 M813	H720-Q767 VanDerWaalsContact CE1-C 3.48Å; H720-Q767 PolarHBondContact CE1-O 3.27Å; Q767-M813 PolarHBondContact NE2-O 3.16Å
768	E	84.7	Confident	95.8	Very high	15 Å²	15	22.9 Å²	22.9	7%	0.07	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	8.5	175.8	-73.6	-172.8	-116.4	0	0	113	L460 K463 R546 D766 R770	L460-E768 HydrophobicContact CD1-CG 3.45Å; L460-E768 VanDerWaalsContact CD1-CG 3.45Å; K463-E768 IonicContact NZ-OE2 2.81Å; K463-E768 PolarHBondContact NZ-OE2 2.88Å; R546-E768 WeakPolarHBondContact CG-OE1 3.21Å; R546-E768 IonicContact CZ-OE2 3.27Å; R546-E768 IonicContact NE-OE1 2.67Å; R546-E768 IonicContact NE-OE2 3.17Å; R546-E768 PolarHBondContact NE-OE2 3.23Å; R546-E768 IonicContact NH2-OE2 3.6Å; R546-E768 PolarHBondContact NH2-OE2 3.4Å; R546-E768 VanDerWaalsContact NH2-OE2 3.15Å; D766-E768 PolarHBondContact O-N 3.37Å; D766-E768 WeakPolarHBondContact OD1-CA 3.18Å; D766-E768 PolarHBondContact OD1-N 2.92Å; E768-R770 HydrophobicContact CB-CG 4.19Å; E768-R770 VanDerWaalsContact CD-CZ 3.49Å; E768-R770 VanDerWaalsContact CD-NH2 3.34Å; E768-R770 PolarHBondContact O-N 3.23Å; E768-R770 IonicContact OE1-CZ 3.35Å; E768-R770 IonicContact OE1-NH1 3.04Å; E768-R770 PolarHBondContact OE1-NH1 2.9Å; E768-R770 IonicContact OE1-NH2 3.52Å; E768-R770 PolarHBondContact OE1-NH2 3.41Å; E768-R770 IonicContact OE2-CZ 3.48Å; E768-R770 IonicContact OE2-NH1 3.32Å
769	N	91	Very high	95.8	Very high	21 Å²	21	21.9 Å²	21.9	11%	0.112	10%	0.098	C	C	.	.			trans	66.2	20.9	-175.4	-148.3	33.4	0	0	0	113.5	N719 H720 D766 A786	N719-N769 VanDerWaalsContact CB-OD1 3.31Å; N719-N769 WeakPolarHBondContact CB-OD1 3.49Å; H720-N769 PolarHBondContact N-OD1 2.89Å; D766-N769 PolarHBondContact O-N 3.43Å; D766-N769 PolarHBondContact OD1-N 3.33Å; D766-N769 VanDerWaalsContact OD1-N 3.11Å; N769-A786 HydrophobicContact CB-CB 4.2Å; N769-A786 WeakPolarHBondContact O-CA 3.36Å; N769-A786 WeakPolarHBondContact O-CB 3.1Å
770	R	93.4	Very high	95.7	Very high	4 Å²	4	19.2 Å²	19.2	2%	0.015	9%	0.088	C	C	.	.			trans	-79.3	140.3	173.7	-63.2	177.2	-70.1	-154.8	-5	109.6	R547 Y549 V765 D766 E768 V783 F784	R547-R770 PolarHBondContact O-NH1 3.44Å; R547-R770 PolarHBondContact O-NH2 2.92Å; Y549-R770 VanDerWaalsContact CE2-NE 3.27Å; V765-R770 VanDerWaalsContact CA-O 3.32Å; V765-R770 WeakPolarHBondContact CA-O 3.26Å; D766-R770 PolarHBondContact N-O 3.28Å; D766-R770 VanDerWaalsContact N-O 3.07Å; D766-R770 WeakPolarHBondContact OD1-CA 3.47Å; D766-R770 VanDerWaalsContact OD1-CB 3.3Å; D766-R770 WeakPolarHBondContact OD1-CB 3.42Å; D766-R770 PolarHBondContact OD1-N 3.46Å; D766-R770 IonicContact OD1-NE 2.74Å; D766-R770 IonicContact OD2-CZ 3.53Å; D766-R770 IonicContact OD2-NE 3.35Å; D766-R770 PolarHBondContact OD2-NE 3.01Å; D766-R770 IonicContact OD2-NH2 2.65Å; D766-R770 PolarHBondContact OD2-NH2 2.97Å; E768-R770 HydrophobicContact CB-CG 4.19Å; E768-R770 VanDerWaalsContact CD-CZ 3.49Å; E768-R770 VanDerWaalsContact CD-NH2 3.34Å; E768-R770 PolarHBondContact O-N 3.23Å; E768-R770 IonicContact OE1-CZ 3.35Å; E768-R770 IonicContact OE1-NH1 3.04Å; E768-R770 PolarHBondContact OE1-NH1 2.9Å; E768-R770 IonicContact OE1-NH2 3.52Å; E768-R770 PolarHBondContact OE1-NH2 3.41Å; E768-R770 IonicContact OE2-CZ 3.48Å; E768-R770 IonicContact OE2-NH1 3.32Å; R770-V783 HydrophobicContact CB-CG1 4.2Å; R770-F784 CarbonylContact C-O 3.58Å; R770-F784 WeakPolarHBondContact CA-O 3.13Å; R770-F784 VanDerWaalsContact CB-O 3.26Å; R770-F784 WeakPolarHBondContact CB-O 3.41Å
771	I	97.1	Very high	95.7	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.026	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.8	-177.4	-51.8	172.6	0	0	0	108.9	V725 L734 V736 V763 V773 V783 F784	V725-I771 HydrophobicContact CG1-CD1 4.32Å; V725-I771 HydrophobicContact CG1-CG2 3.82Å; L734-I771 HydrophobicContact CD1-CG2 4.41Å; L734-I771 HydrophobicContact CD2-CD1 4.09Å; L734-I771 HydrophobicContact CD2-CG2 3.85Å; V736-I771 HydrophobicContact CG2-CD1 4.04Å; V763-I771 HydrophobicContact CG2-CG2 3.53Å; I771-V773 HydrophobicContact CG2-CG2 3.95Å; I771-V783 CarbonylContact O-C 3.49Å; I771-V783 WeakPolarHBondContact O-CA 3.44Å; I771-F784 HydrophobicContact CB-CB 4.33Å; I771-F784 PolarHBondContact N-O 3.28Å; I771-F784 PolarHBondContact O-N 3.34Å
772	I	97.3	Very high	95.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.7	-178.1	-59.8	156.4	0	0	0	107.8	V763 A764 D766 I781 Q782 V783 V810 V812 I818	V763-I772 CarbonylContact C-O 3.51Å; V763-I772 VanDerWaalsContact CA-O 3.27Å; V763-I772 WeakPolarHBondContact CA-O 3.33Å; A764-I772 PolarHBondContact N-O 3.44Å; A764-I772 PolarHBondContact O-N 3.47Å; D766-I772 HydrophobicContact CB-CD1 4.05Å; I772-I781 HydrophobicContact CG2-CG2 3.46Å; I772-I781 VanDerWaalsContact CG2-CG2 3.46Å; I772-Q782 WeakPolarHBondContact CA-O 3.39Å; I772-V783 HydrophobicContact CG1-CG1 4.08Å; I772-V783 HydrophobicContact CG1-CG2 4.2Å; I772-V810 HydrophobicContact CG2-CG2 3.82Å; I772-V812 HydrophobicContact CD1-CG2 3.42Å; I772-V812 VanDerWaalsContact CD1-CG2 3.42Å; I772-I818 HydrophobicContact CD1-CD1 3.92Å; I772-I818 HydrophobicContact CD1-CG1 4.05Å; I772-I818 HydrophobicContact CG1-CD1 4.31Å; I772-I818 HydrophobicContact CG2-CD1 4.13Å; I772-I818 HydrophobicContact CG2-CG2 4.21Å
773	V	98.4	Very high	95.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.9	-172.9	-175.8	0	0	0	0	110.4	T727 L734 F757 P760 V763 I771 D775 I781 Q782 F784	T727-V773 HydrophobicContact CG2-CG1 3.94Å; L734-V773 HydrophobicContact CD1-CG2 4.27Å; L734-V773 HydrophobicContact CD2-CG2 4.29Å; F757-V773 HydrophobicContact CD1-CG1 4.23Å; F757-V773 HydrophobicContact CE1-CB 4.06Å; F757-V773 HydrophobicContact CE1-CG1 3.84Å; F757-V773 HydrophobicContact CE1-CG2 4.43Å; F757-V773 HydrophobicContact CZ-CG1 4.44Å; F757-V773 HydrophobicContact CZ-CG2 4.47Å; P760-V773 HydrophobicContact CB-CG1 3.98Å; V763-V773 HydrophobicContact CG2-CG2 4.05Å; I771-V773 HydrophobicContact CG2-CG2 3.95Å; V773-D775 PolarHBondContact O-N 3.38Å; V773-I781 WeakPolarHBondContact O-CA 3.49Å; V773-Q782 PolarHBondContact N-O 3.37Å; V773-Q782 PolarHBondContact O-N 3.32Å; V773-F784 HydrophobicContact CB-CE2 4.42Å; V773-F784 HydrophobicContact CG2-CD2 4.22Å; V773-F784 HydrophobicContact CG2-CE2 4.11Å
774	A	98.3	Very high	95.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	101.7	168.7	0	0	0	0	0	110.6	P760 Q761 G762 S776 I781 P807 S808	P760-A774 WeakPolarHBondContact CA-O 3.33Å; Q761-A774 PolarHBondContact N-O 3.18Å; G762-A774 PolarHBondContact O-N 2.78Å; A774-S776 PolarHBondContact O-N 3.27Å; A774-S776 VanDerWaalsContact O-N 3.15Å; A774-I781 HydrophobicContact CB-CD1 3.88Å; A774-P807 HydrophobicContact CB-CB 4.17Å; A774-S808 WeakPolarHBondContact CB-O 3.46Å
775	D	98.1	Very high	95	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	79.3	-179.9	-174.8	12	0	0	0	110.2	F757 L758 V773 R777 N778 H779 R780 Q782	F757-D775 WeakPolarHBondContact CA-OD1 3.24Å; F757-D775 HydrophobicContact CD1-CB 4.19Å; L758-D775 PolarHBondContact N-OD1 3.1Å; V773-D775 PolarHBondContact O-N 3.38Å; D775-R777 PolarHBondContact O-N 3.31Å; D775-N778 HydrophobicContact CB-CB 4.47Å; D775-N778 VanDerWaalsContact CG-ND2 3.32Å; D775-N778 CarbonylContact O-C 3.56Å; D775-N778 PolarHBondContact O-N 3.33Å; D775-N778 PolarHBondContact OD1-ND2 3.25Å; D775-N778 VanDerWaalsContact OD2-CB 3.28Å; D775-N778 WeakPolarHBondContact OD2-CB 3.44Å; D775-N778 PolarHBondContact OD2-ND2 2.81Å; D775-H779 PolarHBondContact O-N 3.25Å; D775-H779 VanDerWaalsContact O-N 3.11Å; D775-R780 WeakPolarHBondContact CA-O 3.14Å; D775-R780 HydrophobicContact CB-CG 3.96Å; D775-R780 WeakPolarHBondContact CB-O 3.07Å; D775-R780 PolarHBondContact N-O 3.01Å; D775-R780 PolarHBondContact O-N 3.3Å; D775-R780 IonicContact OD2-CZ 2.73Å; D775-R780 IonicContact OD2-NE 3.15Å; D775-R780 PolarHBondContact OD2-NE 3Å; D775-R780 IonicContact OD2-NH2 3.93Å; D775-R780 PolarHBondContact OD2-NH2 3.31Å; D775-Q782 HydrophobicContact CB-CG 4.35Å; D775-Q782 PolarHBondContact OD2-NE2 2.85Å
776	S	97.7	Very high	94.7	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.014	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-62.7	-46	-155.8	-159.9	0	0	0	0	114.7	R759 Q761 A774 N778 H779 R806 P807	R759-S776 WeakPolarHBondContact O-CB 3.28Å; Q761-S776 PolarHBondContact NE2-OG 3.4Å; A774-S776 PolarHBondContact O-N 3.27Å; A774-S776 VanDerWaalsContact O-N 3.15Å; S776-N778 VanDerWaalsContact C-N 3.32Å; S776-H779 PolarHBondContact O-N 3.2Å; S776-H779 VanDerWaalsContact O-N 3.15Å; S776-R806 WeakPolarHBondContact O-CA 3.31Å; S776-R806 VanDerWaalsContact OG-C 3.24Å; S776-R806 VanDerWaalsContact OG-CA 3.25Å; S776-R806 WeakPolarHBondContact OG-CA 3.49Å; S776-R806 WeakPolarHBondContact OG-CB 3.26Å; S776-R806 PolarHBondContact OG-O 2.93Å; S776-P807 VanDerWaalsContact CB-O 3.23Å; S776-P807 WeakPolarHBondContact CB-O 3.13Å; S776-P807 PolarHBondContact OG-O 2.67Å
777	R	97.8	Very high	94.5	Very high	147 Å²	147	24.9 Å²	24.9	56%	0.555	13%	0.126	S	C	*	.	G	3₁₀ helix	trans	-82.6	-10	-179.2	-73.4	-70.4	-167.2	167.7	5	113.6	L758 R759 D775 H779	L758-R777 HydrophobicContact CB-CB 3.57Å; L758-R777 WeakPolarHBondContact O-CB 3.41Å; L758-R777 PolarHBondContact O-N 3.4Å; R759-R777 HydrophobicContact CB-CB 4.3Å; R759-R777 HydrophobicContact CB-CG 3.71Å; R759-R777 HydrophobicContact CG-CB 4.35Å; R759-R777 HydrophobicContact CG-CG 3.59Å; D775-R777 PolarHBondContact O-N 3.31Å; R777-H779 VanDerWaalsContact C-N 3.33Å; R777-H779 PolarHBondContact O-CD2 3.07Å; R777-H779 VanDerWaalsContact O-CD2 3.27Å
778	N	97.8	Very high	94.7	Very high	30 Å²	30	22 Å²	22	16%	0.16	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-90.9	0.9	164.8	-71.1	-38	0	0	0	112.3	G751 L758 D775 S776 R780	G751-N778 PolarHBondContact O-ND2 3.01Å; L758-N778 WeakPolarHBondContact CD1-OD1 3.13Å; L758-N778 PolarHBondContact N-ND2 3.1Å; D775-N778 HydrophobicContact CB-CB 4.47Å; D775-N778 VanDerWaalsContact CG-ND2 3.32Å; D775-N778 CarbonylContact O-C 3.56Å; D775-N778 PolarHBondContact O-N 3.33Å; D775-N778 PolarHBondContact OD1-ND2 3.25Å; D775-N778 VanDerWaalsContact OD2-CB 3.28Å; D775-N778 WeakPolarHBondContact OD2-CB 3.44Å; D775-N778 PolarHBondContact OD2-ND2 2.81Å; S776-N778 VanDerWaalsContact C-N 3.32Å; N778-R780 VanDerWaalsContact C-N 3.25Å; N778-R780 HydrophobicContact CB-CG 3.93Å; N778-R780 PolarHBondContact O-N 3.21Å
779	H	97.6	Very high	95.1	Very high	18 Å²	18	24.1 Å²	24.1	8%	0.083	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	38	175.4	-56	-90.5	0	0	0	113.6	D775 S776 R777 G795 S796 Q797 M804 D805 R806	D775-H779 PolarHBondContact O-N 3.25Å; D775-H779 VanDerWaalsContact O-N 3.11Å; S776-H779 PolarHBondContact O-N 3.2Å; S776-H779 VanDerWaalsContact O-N 3.15Å; R777-H779 VanDerWaalsContact C-N 3.33Å; R777-H779 PolarHBondContact O-CD2 3.07Å; R777-H779 VanDerWaalsContact O-CD2 3.27Å; H779-G795 CarbonylContact O-C 3.51Å; H779-S796 PolarHBondContact O-N 3.44Å; H779-Q797 HydrophobicContact CB-CB 3.85Å; H779-M804 PolarHBondContact ND1-O 2.98Å; H779-M804 WeakPolarHBondContact O-CG 3.35Å; H779-D805 IonicContact CE1-OD1 3.86Å; H779-D805 PolarHBondContact CE1-OD1 3.14Å; H779-D805 IonicContact ND1-OD1 3.39Å; H779-R806 PolarHBondContact ND1-N 3.29Å
780	R	96.6	Very high	95.2	Very high	21 Å²	21	26.2 Å²	26.2	8%	0.079	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	163.3	-175.8	68.6	-176	179.9	168.5	-2.4	112.3	T752 K753 D754 Q756 D775 N778 Q782 F794	T752-R780 PolarHBondContact O-NH2 2.9Å; K753-R780 PolarHBondContact O-NH2 3.01Å; D754-R780 IonicContact OD1-NH1 2.75Å; D754-R780 PolarHBondContact OD1-NH1 2.96Å; Q756-R780 PolarHBondContact O-NH2 3.07Å; D775-R780 WeakPolarHBondContact CA-O 3.14Å; D775-R780 HydrophobicContact CB-CG 3.96Å; D775-R780 WeakPolarHBondContact CB-O 3.07Å; D775-R780 PolarHBondContact N-O 3.01Å; D775-R780 PolarHBondContact O-N 3.3Å; D775-R780 IonicContact OD2-CZ 2.73Å; D775-R780 IonicContact OD2-NE 3.15Å; D775-R780 PolarHBondContact OD2-NE 3Å; D775-R780 IonicContact OD2-NH2 3.93Å; D775-R780 PolarHBondContact OD2-NH2 3.31Å; N778-R780 VanDerWaalsContact C-N 3.25Å; N778-R780 HydrophobicContact CB-CG 3.93Å; N778-R780 PolarHBondContact O-N 3.21Å; R780-Q782 HydrophobicContact CG-CG 4.36Å; R780-F794 CarbonylContact C-O 3.59Å; R780-F794 WeakPolarHBondContact CA-O 3.47Å; R780-F794 WeakPolarHBondContact CB-O 3.44Å
781	I	97.1	Very high	95.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.4	164.9	-58.4	-54.6	0	0	0	108.3	I772 V773 A774 N793 F794 M804 P807 V820	I772-I781 HydrophobicContact CG2-CG2 3.46Å; I772-I781 VanDerWaalsContact CG2-CG2 3.46Å; V773-I781 WeakPolarHBondContact O-CA 3.49Å; A774-I781 HydrophobicContact CB-CD1 3.88Å; I781-N793 CarbonylContact O-C 3.58Å; I781-N793 WeakPolarHBondContact O-CA 3.4Å; I781-N793 WeakPolarHBondContact O-CB 3.09Å; I781-F794 HydrophobicContact CB-CD2 4.41Å; I781-F794 HydrophobicContact CB-CE1 4.14Å; I781-F794 HydrophobicContact CB-CE2 3.88Å; I781-F794 HydrophobicContact CB-CZ 3.73Å; I781-F794 HydrophobicContact CG1-CE2 3.98Å; I781-F794 HydrophobicContact CG1-CZ 4.16Å; I781-F794 HydrophobicContact CG2-CE1 4.11Å; I781-F794 HydrophobicContact CG2-CE2 4.47Å; I781-F794 HydrophobicContact CG2-CZ 3.84Å; I781-F794 PolarHBondContact N-O 3.41Å; I781-F794 PolarHBondContact O-N 3.12Å; I781-M804 HydrophobicContact CD1-SD 4.49Å; I781-M804 HydrophobicContact CG1-CE 4.27Å; I781-M804 HydrophobicContact CG1-SD 4.23Å; I781-P807 HydrophobicContact CD1-CB 3.91Å; I781-P807 HydrophobicContact CD1-CG 4.3Å; I781-V820 HydrophobicContact CD1-CG1 3.91Å; I781-V820 HydrophobicContact CD1-CG2 3.93Å; I781-V820 HydrophobicContact CG1-CG2 3.9Å
782	Q	96.8	Very high	94.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.9	172.2	-65.2	-166.9	66	0	0	110.3	Q756 F757 I772 V773 D775 R780 F784 F790 N793	Q756-Q782 PolarHBondContact O-NE2 2.98Å; F757-Q782 HydrophobicContact CE1-CB 4.48Å; I772-Q782 WeakPolarHBondContact CA-O 3.39Å; V773-Q782 PolarHBondContact N-O 3.37Å; V773-Q782 PolarHBondContact O-N 3.32Å; D775-Q782 HydrophobicContact CB-CG 4.35Å; D775-Q782 PolarHBondContact OD2-NE2 2.85Å; R780-Q782 HydrophobicContact CG-CG 4.36Å; Q782-F784 HydrophobicContact CB-CD2 4.47Å; Q782-F784 HydrophobicContact CB-CE2 3.53Å; Q782-F784 HydrophobicContact CB-CZ 3.85Å; Q782-F790 HydrophobicContact CG-CE2 4.43Å; Q782-N793 HydrophobicContact CG-CB 3.86Å
783	V	95.4	Very high	94.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.6	177.5	-170.7	0	0	0	0	109.1	Y549 R770 I771 I772 L791 C792 F794 I818	Y549-V783 HydrophobicContact CD2-CG1 3.97Å; Y549-V783 HydrophobicContact CE2-CG1 4.33Å; R770-V783 HydrophobicContact CB-CG1 4.2Å; I771-V783 CarbonylContact O-C 3.49Å; I771-V783 WeakPolarHBondContact O-CA 3.44Å; I772-V783 HydrophobicContact CG1-CG1 4.08Å; I772-V783 HydrophobicContact CG1-CG2 4.2Å; V783-L791 HydrophobicContact CG1-CD2 4.1Å; V783-L791 WeakPolarHBondContact O-CB 3.48Å; V783-L791 PolarHBondContact O-N 2.97Å; V783-C792 PolarHBondContact N-O 3.08Å; V783-C792 PolarHBondContact O-N 3.26Å; V783-F794 HydrophobicContact CG2-CE1 4.36Å; V783-I818 HydrophobicContact CG2-CD1 4.49Å
784	F	94.9	Very high	94.4	Very high	10 Å²	10	32.1 Å²	32.1	4%	0.044	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.2	-179.2	-59.1	-92.4	0	0	0	110.2	F757 R770 I771 V773 Q782 S789 F790	F757-F784 AromaticContact CE1-CE2 3.72Å; F757-F784 HydrophobicContact CE1-CE2 3.72Å; F757-F784 AromaticContact CE1-CZ 3.68Å; F757-F784 HydrophobicContact CE1-CZ 3.68Å; F757-F784 HydrophobicContact CE2-CZ 4.43Å; F757-F784 HydrophobicContact CZ-CE1 4.33Å; F757-F784 AromaticContact CZ-CE2 3.53Å; F757-F784 HydrophobicContact CZ-CE2 3.53Å; F757-F784 AromaticContact CZ-CZ 3.35Å; F757-F784 HydrophobicContact CZ-CZ 3.35Å; R770-F784 CarbonylContact C-O 3.58Å; R770-F784 WeakPolarHBondContact CA-O 3.13Å; R770-F784 VanDerWaalsContact CB-O 3.26Å; R770-F784 WeakPolarHBondContact CB-O 3.41Å; I771-F784 HydrophobicContact CB-CB 4.33Å; I771-F784 PolarHBondContact N-O 3.28Å; I771-F784 PolarHBondContact O-N 3.34Å; V773-F784 HydrophobicContact CB-CE2 4.42Å; V773-F784 HydrophobicContact CG2-CD2 4.22Å; V773-F784 HydrophobicContact CG2-CE2 4.11Å; Q782-F784 HydrophobicContact CB-CD2 4.47Å; Q782-F784 HydrophobicContact CB-CE2 3.53Å; Q782-F784 HydrophobicContact CB-CZ 3.85Å; F784-S789 CarbonylContact C-O 3.55Å; F784-S789 VanDerWaalsContact CA-O 3.31Å; F784-S789 WeakPolarHBondContact CA-O 3.29Å; F784-F790 HydrophobicContact CD1-CB 4.25Å; F784-F790 HydrophobicContact CE1-CB 4.11Å; F784-F790 HydrophobicContact CE1-CD2 4.03Å; F784-F790 HydrophobicContact CZ-CD2 4.33Å
785	E	91.8	Very high	94.1	Very high	54 Å²	54	33.4 Å²	33.4	25%	0.252	19%	0.188	S	C	.	.			trans	-66.6	163.5	164.9	-64	-68.8	176	0	0	110.5	S787 G788 S789	E785-S787 PolarHBondContact O-N 2.88Å; E785-S787 VanDerWaalsContact O-N 3.13Å; E785-G788 WeakPolarHBondContact O-CA 3.3Å; E785-G788 PolarHBondContact O-N 3.05Å; E785-S789 WeakPolarHBondContact CB-OG 3.4Å; E785-S789 WeakPolarHBondContact CG-OG 3.05Å; E785-S789 PolarHBondContact N-O 3.35Å
786	A	89.3	Confident	93.9	Very high	40 Å²	40	36.2 Å²	36.2	33%	0.331	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-33.6	175.7	0	0	0	0	0	112.5	R745 N769 G788	R745-A786 PolarHBondContact NH2-O 2.87Å; N769-A786 HydrophobicContact CB-CB 4.2Å; N769-A786 WeakPolarHBondContact O-CA 3.36Å; N769-A786 WeakPolarHBondContact O-CB 3.1Å; A786-G788 PolarHBondContact O-N 2.99Å; A786-G788 VanDerWaalsContact O-N 3.15Å
787	S	88.3	Confident	93.9	Very high	78 Å²	78	42.3 Å²	42.3	55%	0.545	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-5	174.4	66.3	0	0	0	0	113.8	R745 E785 S789	R745-S787 PolarHBondContact NH1-O 3.29Å; E785-S787 PolarHBondContact O-N 2.88Å; E785-S787 VanDerWaalsContact O-N 3.13Å; S787-S789 VanDerWaalsContact C-N 3.3Å; S787-S789 PolarHBondContact OG-N 3.07Å; S787-S789 PolarHBondContact OG-OG 3.47Å
788	G	89.5	Confident	93.8	Very high	17 Å²	17	36.4 Å²	36.4	18%	0.175	22%	0.22	C	C	.	.	S	Bend	trans	79.4	4.3	-176.3	0	0	0	0	0	114.7	E785 A786	E785-G788 WeakPolarHBondContact O-CA 3.3Å; E785-G788 PolarHBondContact O-N 3.05Å; A786-G788 PolarHBondContact O-N 2.99Å; A786-G788 VanDerWaalsContact O-N 3.15Å
789	S	92.3	Very high	93.5	Very high	59 Å²	59	38.6 Å²	38.6	41%	0.413	24%	0.238	S	C	.	.			trans	-70.6	135.3	171.7	59.4	0	0	0	0	110.7	F784 E785 S787	F784-S789 CarbonylContact C-O 3.55Å; F784-S789 VanDerWaalsContact CA-O 3.31Å; F784-S789 WeakPolarHBondContact CA-O 3.29Å; E785-S789 WeakPolarHBondContact CB-OG 3.4Å; E785-S789 WeakPolarHBondContact CG-OG 3.05Å; E785-S789 PolarHBondContact N-O 3.35Å; S787-S789 VanDerWaalsContact C-N 3.3Å; S787-S789 PolarHBondContact OG-N 3.07Å; S787-S789 PolarHBondContact OG-OG 3.47Å
790	F	93.6	Very high	93.2	Very high	66 Å²	66	39.1 Å²	39.1	29%	0.289	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	134.7	176	175.2	-97	0	0	0	111.4	D754 Q782 F784 C792 N793	D754-F790 HydrophobicContact CB-CD1 3.81Å; D754-F790 HydrophobicContact CB-CD2 3.95Å; D754-F790 HydrophobicContact CB-CE1 3.69Å; D754-F790 HydrophobicContact CB-CE2 3.83Å; D754-F790 HydrophobicContact CB-CG 3.92Å; D754-F790 HydrophobicContact CB-CZ 3.7Å; D754-F790 WeakPolarHBondContact OD2-CE1 3.29Å; Q782-F790 HydrophobicContact CG-CE2 4.43Å; F784-F790 HydrophobicContact CD1-CB 4.25Å; F784-F790 HydrophobicContact CE1-CB 4.11Å; F784-F790 HydrophobicContact CE1-CD2 4.03Å; F784-F790 HydrophobicContact CZ-CD2 4.33Å; F790-C792 WeakPolarHBondContact CE2-O 3.46Å; F790-C792 VanDerWaalsContact CZ-CA 3.48Å; F790-N793 HydrophobicContact CE2-CB 4Å; F790-N793 HydrophobicContact CZ-CB 4.02Å
791	L	91.4	Very high	92.9	Very high	41 Å²	41	45.9 Å²	45.9	22%	0.215	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-56.8	178.6	-176.9	65.1	0	0	0	111.7	Y549 V783	Y549-L791 HydrophobicContact CD2-CD2 4.49Å; V783-L791 HydrophobicContact CG1-CD2 4.1Å; V783-L791 WeakPolarHBondContact O-CB 3.48Å; V783-L791 PolarHBondContact O-N 2.97Å
792	C	91.6	Very high	92.4	Very high	20 Å²	20	46.4 Å²	46.4	14%	0.135	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	169.2	177.7	63.7	0	0	0	0	111.7	Y549 V783 F790	Y549-C792 PolarHBondContact O-SG 2.92Å; V783-C792 PolarHBondContact N-O 3.08Å; V783-C792 PolarHBondContact O-N 3.26Å; F790-C792 WeakPolarHBondContact CE2-O 3.46Å; F790-C792 VanDerWaalsContact CZ-CA 3.48Å
793	N	93.4	Very high	92.3	Very high	59 Å²	59	49.4 Å²	49.4	32%	0.316	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	156.4	169.1	76.3	80.7	0	0	0	110.4	D754 I781 Q782 F790	D754-N793 PolarHBondContact OD1-ND2 2.76Å; I781-N793 CarbonylContact O-C 3.58Å; I781-N793 WeakPolarHBondContact O-CA 3.4Å; I781-N793 WeakPolarHBondContact O-CB 3.09Å; Q782-N793 HydrophobicContact CG-CB 3.86Å; F790-N793 HydrophobicContact CE2-CB 4Å; F790-N793 HydrophobicContact CZ-CB 4.02Å
794	F	93.3	Very high	92.3	Very high	12 Å²	12	49.4 Å²	49.4	5%	0.053	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	159.4	174.1	59.1	-92.1	0	0	0	111.1	L552 R780 I781 V783 I818 F831	L552-F794 WeakPolarHBondContact O-CD1 3.4Å; R780-F794 CarbonylContact C-O 3.59Å; R780-F794 WeakPolarHBondContact CA-O 3.47Å; R780-F794 WeakPolarHBondContact CB-O 3.44Å; I781-F794 HydrophobicContact CB-CD2 4.41Å; I781-F794 HydrophobicContact CB-CE1 4.14Å; I781-F794 HydrophobicContact CB-CE2 3.88Å; I781-F794 HydrophobicContact CB-CZ 3.73Å; I781-F794 HydrophobicContact CG1-CE2 3.98Å; I781-F794 HydrophobicContact CG1-CZ 4.16Å; I781-F794 HydrophobicContact CG2-CE1 4.11Å; I781-F794 HydrophobicContact CG2-CE2 4.47Å; I781-F794 HydrophobicContact CG2-CZ 3.84Å; I781-F794 PolarHBondContact N-O 3.41Å; I781-F794 PolarHBondContact O-N 3.12Å; V783-F794 HydrophobicContact CG2-CE1 4.36Å; F794-I818 HydrophobicContact CE1-CD1 4.14Å; F794-I818 HydrophobicContact CZ-CD1 3.96Å; F794-F831 AromaticContact CD2-CD1 3.93Å; F794-F831 HydrophobicContact CD2-CD1 3.93Å; F794-F831 HydrophobicContact CD2-CE1 4.01Å; F794-F831 HydrophobicContact CD2-CG 4.26Å; F794-F831 HydrophobicContact CD2-CZ 4.4Å; F794-F831 HydrophobicContact CE2-CB 3.99Å; F794-F831 AromaticContact CE2-CD1 3.67Å; F794-F831 HydrophobicContact CE2-CD1 3.67Å; F794-F831 AromaticContact CE2-CD2 3.71Å; F794-F831 HydrophobicContact CE2-CD2 3.71Å; F794-F831 AromaticContact CE2-CE1 3.99Å; F794-F831 HydrophobicContact CE2-CE1 3.99Å; F794-F831 HydrophobicContact CE2-CE2 4.02Å; F794-F831 AromaticContact CE2-CG 3.52Å; F794-F831 HydrophobicContact CE2-CG 3.52Å; F794-F831 HydrophobicContact CE2-CZ 4.15Å; F794-F831 HydrophobicContact CZ-CB 4.18Å; F794-F831 HydrophobicContact CZ-CD2 4.41Å; F794-F831 HydrophobicContact CZ-CG 4.18Å
795	G	92.4	Very high	92.4	Very high	28 Å²	28	50.4 Å²	50.4	29%	0.289	30%	0.3	S	S	.	.			trans	108.5	153.2	-175.5	0	0	0	0	0	112.6	H779	H779-G795 CarbonylContact O-C 3.51Å
796	S	93.6	Very high	92.7	Very high	58 Å²	58	51.5 Å²	51.5	41%	0.406	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	160.9	173.6	57.8	0	0	0	0	109.7	H779 G798 Q803 M804	H779-S796 PolarHBondContact O-N 3.44Å; S796-G798 PolarHBondContact O-N 2.8Å; S796-Q803 CarbonylContact O-C 3.57Å; S796-Q803 VanDerWaalsContact O-CA 3.25Å; S796-Q803 WeakPolarHBondContact O-CA 3.35Å; S796-Q803 WeakPolarHBondContact O-CB 3.13Å; S796-M804 PolarHBondContact O-N 3.45Å
797	Q	97	Very high	93.1	Very high	131 Å²	131	49.6 Å²	49.6	61%	0.612	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	130.1	-179.4	-173.4	174.6	20.2	0	0	111.8	H779 M804	H779-Q797 HydrophobicContact CB-CB 3.85Å; Q797-M804 WeakPolarHBondContact CA-O 3.4Å
798	G	95.3	Very high	93.5	Very high	22 Å²	22	45.9 Å²	45.9	23%	0.227	26%	0.26	C	S	.	.	S	Bend	trans	150.5	-168.7	172	0	0	0	0	0	112.8	S796 M804 N825	S796-G798 PolarHBondContact O-N 2.8Å; G798-M804 PolarHBondContact N-O 2.77Å; G798-M804 CarbonylContact O-C 3.57Å; G798-M804 PolarHBondContact O-N 3Å; G798-N825 PolarHBondContact O-ND2 3.38Å
799	S	93.5	Very high	93.9	Very high	77 Å²	77	45.2 Å²	45.2	54%	0.538	25%	0.253	S	S	.	.	S	Bend	trans	-119.8	-1.5	179.7	60.2	0	0	0	0	113.3	N825 R827	S799-N825 VanDerWaalsContact CB-OD1 3.31Å; S799-N825 WeakPolarHBondContact CB-OD1 3.19Å; S799-R827 VanDerWaalsContact O-CZ 3.29Å; S799-R827 PolarHBondContact O-NH1 3.4Å; S799-R827 PolarHBondContact O-NH2 3.17Å; S799-R827 VanDerWaalsContact O-NH2 3.13Å
800	G	91.1	Very high	94.2	Very high	29 Å²	29	42.8 Å²	42.8	30%	0.299	24%	0.236	S	C	.	.	S	Bend	trans	-71.2	-175	176	0	0	0	0	0	113.7	G802 Q803 R827	G800-G802 PolarHBondContact O-N 3.34Å; G800-Q803 PolarHBondContact O-N 2.62Å; G800-R827 PolarHBondContact O-NH2 3.38Å
801	Y	89.4	Confident	94.4	Very high	163 Å²	163	40 Å²	40	64%	0.639	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	127.9	177	-176.4	-90.2	0	0	0	111.1	Q555 Q803	Q555-Y801 HydrophobicContact CB-CD1 4.44Å; Q555-Y801 HydrophobicContact CB-CD2 4.28Å; Q555-Y801 HydrophobicContact CB-CE1 4.21Å; Q555-Y801 HydrophobicContact CB-CE2 4.05Å; Q555-Y801 HydrophobicContact CB-CG 4.5Å; Q555-Y801 HydrophobicContact CG-CE2 4.38Å; Q555-Y801 WeakPolarHBondContact O-CE2 3.31Å; Q555-Y801 PolarHBondContact O-OH 3.44Å; Y801-Q803 PolarHBondContact O-N 3.07Å
802	G	86.2	Confident	94.6	Very high	10 Å²	10	39.2 Å²	39.2	10%	0.103	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	-2.7	-176.4	0	0	0	0	0	114.9	G800	G800-G802 PolarHBondContact O-N 3.34Å
803	Q	94.6	Very high	94.6	Very high	64 Å²	64	38.7 Å²	38.7	30%	0.299	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	153.9	175.6	-58.3	-173.2	-41.1	0	0	111.3	S796 G800 Y801 R827	S796-Q803 CarbonylContact O-C 3.57Å; S796-Q803 VanDerWaalsContact O-CA 3.25Å; S796-Q803 WeakPolarHBondContact O-CA 3.35Å; S796-Q803 WeakPolarHBondContact O-CB 3.13Å; G800-Q803 PolarHBondContact O-N 2.62Å; Y801-Q803 PolarHBondContact O-N 3.07Å; Q803-R827 PolarHBondContact O-NH2 3.27Å
804	M	95.4	Very high	94.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	143.5	-179.8	56.4	-171	72.5	0	0	111.4	H779 I781 S796 Q797 G798 P807 L829 F831	H779-M804 PolarHBondContact ND1-O 2.98Å; H779-M804 WeakPolarHBondContact O-CG 3.35Å; I781-M804 HydrophobicContact CD1-SD 4.49Å; I781-M804 HydrophobicContact CG1-CE 4.27Å; I781-M804 HydrophobicContact CG1-SD 4.23Å; S796-M804 PolarHBondContact O-N 3.45Å; Q797-M804 WeakPolarHBondContact CA-O 3.4Å; G798-M804 PolarHBondContact N-O 2.77Å; G798-M804 CarbonylContact O-C 3.57Å; G798-M804 PolarHBondContact O-N 3Å; M804-P807 HydrophobicContact CG-CG 4.25Å; M804-P807 HydrophobicContact SD-CB 3.8Å; M804-P807 HydrophobicContact SD-CG 3.63Å; M804-L829 HydrophobicContact CB-CD1 4.21Å; M804-F831 HydrophobicContact CE-CE1 4.47Å; M804-F831 HydrophobicContact CE-CE2 3.96Å; M804-F831 HydrophobicContact CE-CZ 3.57Å
805	D	97.3	Very high	93.7	Very high	31 Å²	31	42.2 Å²	42.2	17%	0.166	24%	0.24	C	C	.	.	S	Bend	trans	-110.2	110	168.9	178.6	31.3	0	0	0	109.9	H779 D822 G824	H779-D805 IonicContact CE1-OD1 3.86Å; H779-D805 PolarHBondContact CE1-OD1 3.14Å; H779-D805 IonicContact ND1-OD1 3.39Å; D805-D822 PolarHBondContact N-OD1 2.78Å; D805-G824 WeakPolarHBondContact O-CA 3.3Å; D805-G824 PolarHBondContact O-N 2.96Å; D805-G824 VanDerWaalsContact OD2-CA 3.29Å; D805-G824 WeakPolarHBondContact OD2-CA 3.46Å
806	R	97.6	Very high	93.5	Very high	76 Å²	76	41 Å²	41	29%	0.287	23%	0.227	S	C	.	.	S	Bend	trans	54	65.3	178.5	-67.4	168.5	-69.9	158	2.9	112.1	S776 H779 S808 F823	S776-R806 WeakPolarHBondContact O-CA 3.31Å; S776-R806 VanDerWaalsContact OG-C 3.24Å; S776-R806 VanDerWaalsContact OG-CA 3.25Å; S776-R806 WeakPolarHBondContact OG-CA 3.49Å; S776-R806 WeakPolarHBondContact OG-CB 3.26Å; S776-R806 PolarHBondContact OG-O 2.93Å; H779-R806 PolarHBondContact ND1-N 3.29Å; R806-S808 PolarHBondContact O-N 3.44Å; R806-F823 HydrophobicContact CB-CD1 4.42Å; R806-F823 VanDerWaalsContact O-CB 3.22Å; R806-F823 WeakPolarHBondContact O-CB 3.45Å
807	P	98.1	Very high	93.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.4	138.5	173.5	26.4	-36.4	0	0	0	109.9	A774 S776 I781 M804 V820	A774-P807 HydrophobicContact CB-CB 4.17Å; S776-P807 VanDerWaalsContact CB-O 3.23Å; S776-P807 WeakPolarHBondContact CB-O 3.13Å; S776-P807 PolarHBondContact OG-O 2.67Å; I781-P807 HydrophobicContact CD1-CB 3.91Å; I781-P807 HydrophobicContact CD1-CG 4.3Å; M804-P807 HydrophobicContact CG-CG 4.25Å; M804-P807 HydrophobicContact SD-CB 3.8Å; M804-P807 HydrophobicContact SD-CG 3.63Å; P807-V820 HydrophobicContact CB-CG1 3.69Å
808	S	97.9	Very high	93.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	-103.4	-171.4	56.3	0	0	0	0	111.2	W573 G762 A774 R806 V821	W573-S808 PolarHBondContact O-OG 3.13Å; G762-S808 WeakPolarHBondContact CA-O 3.36Å; G762-S808 PolarHBondContact N-O 2.86Å; A774-S808 WeakPolarHBondContact CB-O 3.46Å; R806-S808 PolarHBondContact O-N 3.44Å; S808-V821 PolarHBondContact N-O 3.37Å; S808-V821 VanDerWaalsContact OG-CB 3.3Å; S808-V821 WeakPolarHBondContact OG-CB 3.36Å; S808-V821 VanDerWaalsContact OG-CG1 3.24Å; S808-V821 WeakPolarHBondContact OG-CG1 3.49Å; S808-V821 PolarHBondContact OG-O 2.81Å; S808-V821 VanDerWaalsContact OG-O 3.05Å
809	G	97.5	Very high	93.2	Very high	3 Å²	3	31.9 Å²	31.9	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	144.5	173.9	0	0	0	0	0	111.7	W573 I575 V821	W573-G809 WeakPolarHBondContact O-CA 3.35Å; W573-G809 PolarHBondContact O-N 3.15Å; I575-G809 VanDerWaalsContact CG2-C 3.42Å; G809-V821 PolarHBondContact O-N 3.4Å
810	V	98.1	Very high	93.4	Very high	8 Å²	8	28.2 Å²	28.2	5%	0.048	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.9	173.7	62.9	0	0	0	0	108.9	G762 A764 I772 I818 V819 V820	G762-V810 VanDerWaalsContact C-CG1 3.5Å; A764-V810 HydrophobicContact CB-CG1 4.03Å; I772-V810 HydrophobicContact CG2-CG2 3.82Å; V810-I818 HydrophobicContact CG2-CG2 3.65Å; V810-V819 CarbonylContact C-O 3.48Å; V810-V819 WeakPolarHBondContact CA-O 3.43Å; V810-V820 HydrophobicContact CG2-CG2 4.18Å
811	A	97.6	Very high	93.8	Very high	9 Å²	9	26.9 Å²	26.9	7%	0.074	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	163.9	174.4	0	0	0	0	0	109.8	I575 V577 V819	I575-A811 HydrophobicContact CG2-CB 4.02Å; V577-A811 HydrophobicContact CG2-CB 3.89Å; A811-V819 PolarHBondContact N-O 2.81Å; A811-V819 PolarHBondContact O-N 3.33Å
812	V	94.9	Very high	94.2	Very high	24 Å²	24	19.1 Å²	19.1	15%	0.145	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.8	178.3	-172.8	0	0	0	0	108.6	A764 D766 I772 I817	A764-V812 HydrophobicContact CB-CG2 4.05Å; D766-V812 HydrophobicContact CB-CG1 4.15Å; D766-V812 HydrophobicContact CB-CG2 4.17Å; I772-V812 HydrophobicContact CD1-CG2 3.42Å; I772-V812 VanDerWaalsContact CD1-CG2 3.42Å; V812-I817 WeakPolarHBondContact CA-O 3.43Å
813	M	91.6	Very high	94.7	Very high	9 Å²	9	19.7 Å²	19.7	4%	0.044	10%	0.102	C	C	.	.			trans	-72.7	160.8	175.3	-63.4	-167.9	65.6	0	0	111.2	V577 P598 Q767 D815 G816 I817 V819 K830	V577-M813 HydrophobicContact CG1-CB 4.45Å; V577-M813 HydrophobicContact CG1-CG 4.11Å; V577-M813 HydrophobicContact CG2-CG 4.23Å; P598-M813 HydrophobicContact CB-CE 4.32Å; Q767-M813 PolarHBondContact NE2-O 3.16Å; M813-D815 WeakPolarHBondContact CB-OD1 3.44Å; M813-D815 PolarHBondContact O-N 2.9Å; M813-G816 PolarHBondContact O-N 3.03Å; M813-I817 HydrophobicContact CB-CB 4.11Å; M813-I817 HydrophobicContact CG-CB 4.17Å; M813-I817 HydrophobicContact CG-CG2 4.46Å; M813-I817 PolarHBondContact N-O 3.37Å; M813-I817 HydrophobicContact SD-CB 4.08Å; M813-I817 HydrophobicContact SD-CG2 4.06Å; M813-V819 HydrophobicContact CG-CG2 3.4Å; M813-V819 HydrophobicContact SD-CG2 3.83Å; M813-K830 HydrophobicContact SD-CD 4.48Å
814	P	86.9	Confident	94.8	Very high	49 Å²	49	17.7 Å²	17.7	32%	0.318	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-18.5	178.2	-26.4	35.2	0	0	0	115.8	R579	R579-P814 WeakPolarHBondContact O-CG 3.2Å
815	D	82.7	Confident	94.9	Very high	96 Å²	96	19.6 Å²	19.6	51%	0.513	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	1.6	175.3	60.8	2.1	0	0	0	113.4	M813 I817	M813-D815 WeakPolarHBondContact CB-OD1 3.44Å; M813-D815 PolarHBondContact O-N 2.9Å; D815-I817 WeakPolarHBondContact OD1-CB 3.38Å; D815-I817 WeakPolarHBondContact OD1-CG1 3.32Å; D815-I817 PolarHBondContact OD1-N 3.19Å; D815-I817 WeakPolarHBondContact OD2-CD1 3.28Å
816	G	86.4	Confident	94.9	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.01	10%	0.104	C	C	.	.	S	Bend	trans	87.6	5	177.7	0	0	0	0	0	115.1	Y549 M813	Y549-G816 PolarHBondContact OH-O 2.78Å; M813-G816 PolarHBondContact O-N 3.03Å
817	I	90.1	Very high	94.9	Very high	19 Å²	19	16.6 Å²	16.6	10%	0.097	10%	0.096	C	C	.	.			trans	-67	132.9	173.5	-65.8	175.6	0	0	0	109.7	M556 V812 M813 D815 K830 F831	M556-I817 HydrophobicContact CE-CD1 3.79Å; M556-I817 HydrophobicContact CE-CG1 4.49Å; M556-I817 HydrophobicContact SD-CD1 3.78Å; M556-I817 HydrophobicContact SD-CG1 3.91Å; M556-I817 HydrophobicContact SD-CG2 4.34Å; V812-I817 WeakPolarHBondContact CA-O 3.43Å; M813-I817 HydrophobicContact CB-CB 4.11Å; M813-I817 HydrophobicContact CG-CB 4.17Å; M813-I817 HydrophobicContact CG-CG2 4.46Å; M813-I817 PolarHBondContact N-O 3.37Å; M813-I817 HydrophobicContact SD-CB 4.08Å; M813-I817 HydrophobicContact SD-CG2 4.06Å; D815-I817 WeakPolarHBondContact OD1-CB 3.38Å; D815-I817 WeakPolarHBondContact OD1-CG1 3.32Å; D815-I817 PolarHBondContact OD1-N 3.19Å; D815-I817 WeakPolarHBondContact OD2-CD1 3.28Å; I817-K830 HydrophobicContact CG2-CB 3.96Å; I817-K830 HydrophobicContact CG2-CG 4.29Å; I817-F831 WeakPolarHBondContact CA-O 3.2Å; I817-F831 WeakPolarHBondContact CG2-O 3.2Å
818	I	94.1	Very high	94.9	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.1	177.1	-59	175.6	0	0	0	108.5	Y549 I772 V783 F794 V810 V820 K830 F831	Y549-I818 HydrophobicContact CD1-CD1 4.11Å; Y549-I818 HydrophobicContact CE1-CD1 3.59Å; Y549-I818 HydrophobicContact CE1-CG1 3.95Å; I772-I818 HydrophobicContact CD1-CD1 3.92Å; I772-I818 HydrophobicContact CD1-CG1 4.05Å; I772-I818 HydrophobicContact CG1-CD1 4.31Å; I772-I818 HydrophobicContact CG2-CD1 4.13Å; I772-I818 HydrophobicContact CG2-CG2 4.21Å; V783-I818 HydrophobicContact CG2-CD1 4.49Å; F794-I818 HydrophobicContact CE1-CD1 4.14Å; F794-I818 HydrophobicContact CZ-CD1 3.96Å; V810-I818 HydrophobicContact CG2-CG2 3.65Å; I818-V820 HydrophobicContact CG2-CG2 3.85Å; I818-K830 CarbonylContact O-C 3.6Å; I818-K830 WeakPolarHBondContact O-CA 3.45Å; I818-F831 HydrophobicContact CB-CB 4.37Å; I818-F831 PolarHBondContact N-O 3.21Å; I818-F831 PolarHBondContact O-N 3.1Å
819	V	96.4	Very high	94.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.8	177.1	-160.2	0	0	0	0	109.3	I575 V577 V583 V810 A811 M813 I828 L829 K830	I575-V819 HydrophobicContact CD1-CB 4.07Å; I575-V819 HydrophobicContact CD1-CG1 3.46Å; I575-V819 VanDerWaalsContact CD1-CG1 3.46Å; V577-V819 HydrophobicContact CG2-CG2 4.21Å; V583-V819 HydrophobicContact CG1-CG1 4.36Å; V810-V819 CarbonylContact C-O 3.48Å; V810-V819 WeakPolarHBondContact CA-O 3.43Å; A811-V819 PolarHBondContact N-O 2.81Å; A811-V819 PolarHBondContact O-N 3.33Å; M813-V819 HydrophobicContact CG-CG2 3.4Å; M813-V819 HydrophobicContact SD-CG2 3.83Å; V819-I828 HydrophobicContact CG1-CG2 3.33Å; V819-L829 CarbonylContact C-O 3.58Å; V819-L829 WeakPolarHBondContact CA-O 3.39Å; V819-K830 HydrophobicContact CG1-CG 4.15Å; V819-K830 HydrophobicContact CG2-CG 4.31Å
820	V	97.8	Very high	94.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.5	-172.9	-175.6	0	0	0	0	110.1	I781 P807 V810 I818 D822 I828 L829 F831	I781-V820 HydrophobicContact CD1-CG1 3.91Å; I781-V820 HydrophobicContact CD1-CG2 3.93Å; I781-V820 HydrophobicContact CG1-CG2 3.9Å; P807-V820 HydrophobicContact CB-CG1 3.69Å; V810-V820 HydrophobicContact CG2-CG2 4.18Å; I818-V820 HydrophobicContact CG2-CG2 3.85Å; V820-D822 PolarHBondContact O-N 3.48Å; V820-I828 WeakPolarHBondContact O-CA 3.43Å; V820-L829 PolarHBondContact N-O 3.27Å; V820-L829 PolarHBondContact O-N 3.46Å; V820-F831 HydrophobicContact CB-CE2 4.39Å; V820-F831 HydrophobicContact CG2-CD2 4.06Å; V820-F831 HydrophobicContact CG2-CE2 4.05Å
821	V	98.5	Very high	94.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.4	167.4	-177.8	0	0	0	0	109.1	P572 W573 I575 S808 G809 F823 I828	P572-V821 HydrophobicContact CB-CG1 3.81Å; P572-V821 HydrophobicContact CG-CG1 3.61Å; P572-V821 WeakPolarHBondContact O-CG1 3.16Å; W573-V821 WeakPolarHBondContact O-CG2 3.29Å; I575-V821 HydrophobicContact CB-CG2 3.57Å; I575-V821 HydrophobicContact CD1-CG2 3.95Å; I575-V821 HydrophobicContact CG1-CG2 4.34Å; I575-V821 HydrophobicContact CG2-CG2 3.81Å; S808-V821 PolarHBondContact N-O 3.37Å; S808-V821 VanDerWaalsContact OG-CB 3.3Å; S808-V821 WeakPolarHBondContact OG-CB 3.36Å; S808-V821 VanDerWaalsContact OG-CG1 3.24Å; S808-V821 WeakPolarHBondContact OG-CG1 3.49Å; S808-V821 PolarHBondContact OG-O 2.81Å; S808-V821 VanDerWaalsContact OG-O 3.05Å; G809-V821 PolarHBondContact O-N 3.4Å; V821-F823 PolarHBondContact O-N 3.34Å; V821-F823 VanDerWaalsContact O-N 3.13Å; V821-I828 HydrophobicContact CB-CD1 4.27Å; V821-I828 HydrophobicContact CG1-CD1 4.26Å; V821-I828 HydrophobicContact CG2-CD1 3.78Å
822	D	98	Very high	94.1	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	82.7	173.3	-175.9	6.1	0	0	0	109	D805 V820 G824 N825 N826 R827 L829	D805-D822 PolarHBondContact N-OD1 2.78Å; V820-D822 PolarHBondContact O-N 3.48Å; D822-G824 VanDerWaalsContact C-N 3.31Å; D822-G824 PolarHBondContact O-N 3.47Å; D822-N825 VanDerWaalsContact CG-ND2 3.32Å; D822-N825 PolarHBondContact O-N 3.39Å; D822-N825 PolarHBondContact OD1-ND2 3.4Å; D822-N825 WeakPolarHBondContact OD2-CB 3.38Å; D822-N825 PolarHBondContact OD2-ND2 2.9Å; D822-N826 PolarHBondContact O-N 2.68Å; D822-N826 VanDerWaalsContact O-N 3.08Å; D822-R827 HydrophobicContact CB-CG 3.79Å; D822-R827 WeakPolarHBondContact CB-O 3.4Å; D822-R827 PolarHBondContact N-O 3.08Å; D822-R827 PolarHBondContact O-N 3.41Å; D822-R827 IonicContact OD2-CZ 3.35Å; D822-R827 IonicContact OD2-NE 2.88Å; D822-R827 PolarHBondContact OD2-NE 3.13Å; D822-R827 IonicContact OD2-NH2 3.54Å; D822-R827 PolarHBondContact OD2-NH2 2.76Å; D822-L829 HydrophobicContact CB-CD1 3.95Å; D822-L829 HydrophobicContact CB-CG 4.05Å
823	F	97.8	Very high	94.1	Very high	22 Å²	22	16.6 Å²	16.6	10%	0.096	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-53.8	-45	-169.6	172.3	-93.8	0	0	0	112.9	R571 P572 R806 V821 N825 N826	R571-F823 HydrophobicContact CB-CD2 4.49Å; R571-F823 HydrophobicContact CB-CE2 3.68Å; R571-F823 HydrophobicContact CB-CZ 4.02Å; R571-F823 HydrophobicContact CG-CZ 4.46Å; P572-F823 VanDerWaalsContact O-CD2 3.28Å; P572-F823 WeakPolarHBondContact O-CD2 3.31Å; R806-F823 HydrophobicContact CB-CD1 4.42Å; R806-F823 VanDerWaalsContact O-CB 3.22Å; R806-F823 WeakPolarHBondContact O-CB 3.45Å; V821-F823 PolarHBondContact O-N 3.34Å; V821-F823 VanDerWaalsContact O-N 3.13Å; F823-N825 VanDerWaalsContact C-N 3.3Å; F823-N825 PolarHBondContact O-N 3.34Å; F823-N826 PolarHBondContact O-N 3.31Å
824	G	96.3	Very high	94.2	Very high	22 Å²	22	17 Å²	17	23%	0.227	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-71.7	-25.8	-174.5	0	0	0	0	0	113.8	D805 D822	D805-G824 WeakPolarHBondContact O-CA 3.3Å; D805-G824 PolarHBondContact O-N 2.96Å; D805-G824 VanDerWaalsContact OD2-CA 3.29Å; D805-G824 WeakPolarHBondContact OD2-CA 3.46Å; D822-G824 VanDerWaalsContact C-N 3.31Å; D822-G824 PolarHBondContact O-N 3.47Å
825	N	97.5	Very high	94.7	Very high	41 Å²	41	15.1 Å²	15.1	22%	0.219	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-104.9	7.4	179.6	-60.4	-48.2	0	0	0	113.2	G798 S799 D822 F823 R827	G798-N825 PolarHBondContact O-ND2 3.38Å; S799-N825 VanDerWaalsContact CB-OD1 3.31Å; S799-N825 WeakPolarHBondContact CB-OD1 3.19Å; D822-N825 VanDerWaalsContact CG-ND2 3.32Å; D822-N825 PolarHBondContact O-N 3.39Å; D822-N825 PolarHBondContact OD1-ND2 3.4Å; D822-N825 WeakPolarHBondContact OD2-CB 3.38Å; D822-N825 PolarHBondContact OD2-ND2 2.9Å; F823-N825 VanDerWaalsContact C-N 3.3Å; F823-N825 PolarHBondContact O-N 3.34Å; N825-R827 VanDerWaalsContact C-N 3.25Å; N825-R827 HydrophobicContact CB-CG 4.01Å; N825-R827 PolarHBondContact O-N 3.03Å
826	N	97.8	Very high	95.4	Very high	11 Å²	11	10.1 Å²	10.1	6%	0.059	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	40.2	178.5	-60	-66.1	0	0	0	114	C561 E562 R571 D822 F823	C561-N826 CarbonylContact C-O 3.57Å; C561-N826 WeakPolarHBondContact CA-O 3.48Å; C561-N826 PolarHBondContact N-O 2.85Å; E562-N826 HydrophobicContact CB-CB 3.97Å; E562-N826 PolarHBondContact OE2-ND2 3.14Å; R571-N826 WeakPolarHBondContact CA-OD1 3.17Å; R571-N826 PolarHBondContact N-OD1 3.15Å; D822-N826 PolarHBondContact O-N 2.68Å; D822-N826 VanDerWaalsContact O-N 3.08Å; F823-N826 PolarHBondContact O-N 3.31Å
827	R	97.5	Very high	96	Very high	33 Å²	33	10.7 Å²	10.7	13%	0.125	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	165	-176.3	69.4	-175.5	-179.4	176.3	4.7	112.2	S799 G800 Q803 D822 N825 L829	S799-R827 VanDerWaalsContact O-CZ 3.29Å; S799-R827 PolarHBondContact O-NH1 3.4Å; S799-R827 PolarHBondContact O-NH2 3.17Å; S799-R827 VanDerWaalsContact O-NH2 3.13Å; G800-R827 PolarHBondContact O-NH2 3.38Å; Q803-R827 PolarHBondContact O-NH2 3.27Å; D822-R827 HydrophobicContact CB-CG 3.79Å; D822-R827 WeakPolarHBondContact CB-O 3.4Å; D822-R827 PolarHBondContact N-O 3.08Å; D822-R827 PolarHBondContact O-N 3.41Å; D822-R827 IonicContact OD2-CZ 3.35Å; D822-R827 IonicContact OD2-NE 2.88Å; D822-R827 PolarHBondContact OD2-NE 3.13Å; D822-R827 IonicContact OD2-NH2 3.54Å; D822-R827 PolarHBondContact OD2-NH2 2.76Å; N825-R827 VanDerWaalsContact C-N 3.25Å; N825-R827 HydrophobicContact CB-CG 4.01Å; N825-R827 PolarHBondContact O-N 3.03Å; R827-L829 HydrophobicContact CG-CD2 4.24Å
828	I	98.1	Very high	96.4	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	133.2	173.1	-49.2	-56.1	0	0	0	108.8	S558 F559 L569 I575 V585 V819 V820 V821	S558-I828 VanDerWaalsContact CA-O 3.23Å; S558-I828 WeakPolarHBondContact CA-O 3.47Å; F559-I828 HydrophobicContact CD1-CB 4.33Å; F559-I828 HydrophobicContact CD2-CB 4.17Å; F559-I828 HydrophobicContact CD2-CG1 4.28Å; F559-I828 HydrophobicContact CE1-CB 3.86Å; F559-I828 HydrophobicContact CE1-CG2 3.76Å; F559-I828 HydrophobicContact CE2-CB 3.72Å; F559-I828 HydrophobicContact CE2-CG1 3.75Å; F559-I828 HydrophobicContact CE2-CG2 4.09Å; F559-I828 HydrophobicContact CG-CB 4.46Å; F559-I828 HydrophobicContact CZ-CB 3.56Å; F559-I828 HydrophobicContact CZ-CG1 4.02Å; F559-I828 HydrophobicContact CZ-CG2 3.45Å; F559-I828 VanDerWaalsContact CZ-CG2 3.45Å; F559-I828 PolarHBondContact N-O 3.42Å; F559-I828 VanDerWaalsContact N-O 3.09Å; F559-I828 PolarHBondContact O-N 2.85Å; L569-I828 HydrophobicContact CD1-CD1 3.84Å; L569-I828 HydrophobicContact CD1-CG1 3.83Å; I575-I828 HydrophobicContact CD1-CD1 4.26Å; I575-I828 HydrophobicContact CD1-CG2 3.78Å; V585-I828 HydrophobicContact CG1-CD1 4.14Å; V585-I828 HydrophobicContact CG2-CD1 3.99Å; V585-I828 HydrophobicContact CG2-CG1 4.23Å; V819-I828 HydrophobicContact CG1-CG2 3.33Å; V820-I828 WeakPolarHBondContact O-CA 3.43Å; V821-I828 HydrophobicContact CB-CD1 4.27Å; V821-I828 HydrophobicContact CG1-CD1 4.26Å; V821-I828 HydrophobicContact CG2-CD1 3.78Å
829	L	96.5	Very high	96.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140	178	-59.9	179.9	0	0	0	110.1	Q555 M804 V819 V820 D822 R827 F831	Q555-L829 HydrophobicContact CG-CD2 4.41Å; M804-L829 HydrophobicContact CB-CD1 4.21Å; V819-L829 CarbonylContact C-O 3.58Å; V819-L829 WeakPolarHBondContact CA-O 3.39Å; V820-L829 PolarHBondContact N-O 3.27Å; V820-L829 PolarHBondContact O-N 3.46Å; D822-L829 HydrophobicContact CB-CD1 3.95Å; D822-L829 HydrophobicContact CB-CG 4.05Å; R827-L829 HydrophobicContact CG-CD2 4.24Å; L829-F831 HydrophobicContact CB-CD2 4.26Å; L829-F831 HydrophobicContact CB-CE2 3.52Å; L829-F831 HydrophobicContact CB-CZ 4.04Å; L829-F831 HydrophobicContact CD1-CE2 4.01Å; L829-F831 HydrophobicContact CD1-CZ 3.87Å; L829-F831 HydrophobicContact CG-CE2 4.42Å
830	K	94	Very high	96.6	Very high	8 Å²	8	11.6 Å²	11.6	4%	0.035	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.5	171.9	-73.4	174.6	169.5	162	0	109.9	Q555 M556 S557 F559 P598 M813 I817 I818 V819	Q555-K830 CarbonylContact C-O 3.57Å; M556-K830 HydrophobicContact CB-CB 4.49Å; M556-K830 PolarHBondContact N-O 3.02Å; S557-K830 PolarHBondContact O-N 2.8Å; S557-K830 WeakPolarHBondContact OG-CD 3.32Å; F559-K830 HydrophobicContact CE1-CD 4.08Å; F559-K830 HydrophobicContact CE1-CG 4.32Å; P598-K830 PolarHBondContact O-NZ 3.01Å; M813-K830 HydrophobicContact SD-CD 4.48Å; I817-K830 HydrophobicContact CG2-CB 3.96Å; I817-K830 HydrophobicContact CG2-CG 4.29Å; I818-K830 CarbonylContact O-C 3.6Å; I818-K830 WeakPolarHBondContact O-CA 3.45Å; V819-K830 HydrophobicContact CG1-CG 4.15Å; V819-K830 HydrophobicContact CG2-CG 4.31Å
831	F	89.8	Confident	96.5	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.009	7%	0.07	C	C	.	.			trans	-123.9	0	-178.2	-65	-85.3	0	0	0	112.5	R547 L552 Q555 M556 F794 M804 I817 I818 V820 L829	R547-F831 PolarHBondContact NH2-OXT 3.19Å; L552-F831 WeakPolarHBondContact CD2-OXT 3.48Å; Q555-F831 HydrophobicContact CB-CD1 4.42Å; Q555-F831 HydrophobicContact CB-CE1 4.07Å; M556-F831 WeakPolarHBondContact CG-OXT 3.19Å; F794-F831 AromaticContact CD2-CD1 3.93Å; F794-F831 HydrophobicContact CD2-CD1 3.93Å; F794-F831 HydrophobicContact CD2-CE1 4.01Å; F794-F831 HydrophobicContact CD2-CG 4.26Å; F794-F831 HydrophobicContact CD2-CZ 4.4Å; F794-F831 HydrophobicContact CE2-CB 3.99Å; F794-F831 AromaticContact CE2-CD1 3.67Å; F794-F831 HydrophobicContact CE2-CD1 3.67Å; F794-F831 AromaticContact CE2-CD2 3.71Å; F794-F831 HydrophobicContact CE2-CD2 3.71Å; F794-F831 AromaticContact CE2-CE1 3.99Å; F794-F831 HydrophobicContact CE2-CE1 3.99Å; F794-F831 HydrophobicContact CE2-CE2 4.02Å; F794-F831 AromaticContact CE2-CG 3.52Å; F794-F831 HydrophobicContact CE2-CG 3.52Å; F794-F831 HydrophobicContact CE2-CZ 4.15Å; F794-F831 HydrophobicContact CZ-CB 4.18Å; F794-F831 HydrophobicContact CZ-CD2 4.41Å; F794-F831 HydrophobicContact CZ-CG 4.18Å; M804-F831 HydrophobicContact CE-CE1 4.47Å; M804-F831 HydrophobicContact CE-CE2 3.96Å; M804-F831 HydrophobicContact CE-CZ 3.57Å; I817-F831 WeakPolarHBondContact CA-O 3.2Å; I817-F831 WeakPolarHBondContact CG2-O 3.2Å; I818-F831 HydrophobicContact CB-CB 4.37Å; I818-F831 PolarHBondContact N-O 3.21Å; I818-F831 PolarHBondContact O-N 3.1Å; V820-F831 HydrophobicContact CB-CE2 4.39Å; V820-F831 HydrophobicContact CG2-CD2 4.06Å; V820-F831 HydrophobicContact CG2-CE2 4.05Å; L829-F831 HydrophobicContact CB-CD2 4.26Å; L829-F831 HydrophobicContact CB-CE2 3.52Å; L829-F831 HydrophobicContact CB-CZ 4.04Å; L829-F831 HydrophobicContact CD1-CE2 4.01Å; L829-F831 HydrophobicContact CD1-CZ 3.87Å; L829-F831 HydrophobicContact CG-CE2 4.42Å

Retrieved 831 of 831 residues in 135.6 ms (Link to these results)

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