A0A077ZES5_TRITR Loading...

Doublecortin family protein

AlphaFold DB , UniProt , Accession A0A077ZES5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 999 aa.

						>A0A077ZES5_TRITR|A0A077ZES5
MNDDAEEGAAMNMGYKTDSLHSVREKDGNYMTRMVYFHKDGDKYFPAVKVPVSRAKYRTIEALLDDLSKKVPLHFGVRRLFTPKGRDEIRDIEQLERYGNYICASNRKVQALKINSQLHEPPHRHNYTQKLKTTGTSNEDRSSWEASSSTLVDDWIEMHKSGKAVQELRAPKSKQVEFILNSEPTNRHVMRFKPSELTLSVDEVMNCLSNAFHVGVAKLYTPSGARVLRSEDILNGPDRLIACKKHDRPVVRKRSELPSITERSMELEVSGLQKRLVNDDSLPCLSVQSTAEVPKGKSKKQMELRSPGYAAGIGKFDTRLKSCMKSAKNCLYEVIVYTGNRWAADTDADIYIIFFGSKGHSEIIYLRQNPNDLKFQQNQADFFEVWSPYLGELRKLVIGHNEQGYGAGIFIERVMVSEPTIDDAYYAFPCSKWLDQGQVDGSCERPLKCAGYSNMNAFSKENDSMYSINAENQWKLQIKIGKIYPRDYKPELHVFAYSSVNKARTNYSQQRRLVKVNEAETIYSVMLHQFGNFYKIRLEVDYQKCEAIPMALQIESAELLHIETGDRRHIRCKCCCRLNVDYQCSGSNLQLFREFPVVDLMNDLLPVYKYYGSVTLGDMHNIEQGRFFHCKLYGELGDSGIVYLDQLTSNDGNLEFEVECVSLGRLVCVMFSTFVDTEAEYLCDGFSLLQELYEKHNCMLTAGNGWLIKSIVIRDSLHSPYQYVFTEGRILERQFPGVLRKEMILSDITGQSTKCPTKKKRDGNMEVEVWKVFITSKEQVEFDTVNGCCNLTVYGNLGNTGPIVLEERNNKFMPNKVAVFQVSFKSVGTVFKVRLEMDTTDERQMTWYLRKVKMKNINNGDEFRINVDSLLMKSDRNSRPSIELPVSWPDIPPLPKVLYTIFVYNGHDTVKDQTLSARLTIYGEHGDSGPRVLYSTERGQKLFEPENCNQFEVEAVFLGRLRQIGITADPASDFTCWHVSAIAVKDPESQMLYQFSADR
					

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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	29.1	Very low	28	Very low	236 Å²	236	145.7 Å²	145.7	100%	1.163	86%	0.856	S	S	*	*				0	108.3	0	-85.2	178.4	167.8	0	0	106.2
2	N	30.7	Very low	27.6	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	86%	0.856	S	S	*	*			trans	64.5	129.1	167.6	-71.6	37.2	0	0	0	116.5
3	D	33.2	Very low	27.4	Very low	140 Å²	140	148.2 Å²	148.2	75%	0.749	85%	0.852	S	S	*	*			cis	-149.8	142.8	18	-79.1	-45.3	0	0	0	111.1
4	D	27	Very low	27.1	Very low	171 Å²	171	142.2 Å²	142.2	91%	0.914	84%	0.838	S	S	*	*			trans	-86.2	130.7	156.8	-72.6	-50.7	0	0	0	108.3
5	A	32.1	Very low	26.8	Very low	104 Å²	104	147.1 Å²	147.1	86%	0.86	84%	0.839	S	S	*	*			trans	-151.7	136	158.9	0	0	0	0	0	111.5
6	E	26.1	Very low	26.6	Very low	177 Å²	177	149.6 Å²	149.6	83%	0.827	84%	0.837	S	S	*	*			trans	-80.1	163.8	-164.3	-67.8	169.6	138.6	0	0	116.7
7	E	26.3	Very low	26.3	Very low	181 Å²	181	148.9 Å²	148.9	85%	0.846	84%	0.838	S	S	*	*			trans	61.6	123.5	138	-76.2	-176	165.9	0	0	123.5
8	G	25	Very low	26.2	Very low	77 Å²	77	148.3 Å²	148.3	79%	0.794	83%	0.832	S	S	*	*				78.2	61.9	109.4	0	0	0	0	0	119	A10	G8-A10 PolarHBondContact O-N 3.08Å
9	A	28.1	Very low	26.1	Very low	100 Å²	100	146.3 Å²	146.3	83%	0.826	83%	0.829	S	S	*	*			trans	-77.1	83.5	170	0	0	0	0	0	112.6	M11	A9-M11 PolarHBondContact O-N 3.23Å
10	A	25.7	Very low	26	Very low	95 Å²	95	147.6 Å²	147.6	79%	0.785	83%	0.832	S	S	*	*			trans	-75.8	106.8	159.8	0	0	0	0	0	109.1	G8 N12	G8-A10 PolarHBondContact O-N 3.08Å; A10-N12 PolarHBondContact O-N 3.1Å; A10-N12 VanDerWaalsContact O-N 3.08Å
11	M	25.1	Very low	25.9	Very low	176 Å²	176	149 Å²	149	87%	0.867	83%	0.832	S	S	*	*			trans	-66.3	104.9	179.2	-75.1	-172.8	170.5	0	0	111.3	A9 M13	A9-M11 PolarHBondContact O-N 3.23Å; M11-M13 PolarHBondContact O-N 3.15Å
12	N	23.1	Very low	25.7	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	81%	0.812	S	S	*	*			trans	-86.7	93.3	173.2	-154.6	2	0	0	0	109	A10 G14	A10-N12 PolarHBondContact O-N 3.1Å; A10-N12 VanDerWaalsContact O-N 3.08Å; N12-G14 PolarHBondContact O-N 3.04Å; N12-G14 VanDerWaalsContact O-N 3.15Å
13	M	25.3	Very low	25.4	Very low	162 Å²	162	143 Å²	143	80%	0.798	82%	0.818	S	S	*	*			trans	-78.4	90.6	173.2	-78.6	-86.9	-145	0	0	109.6	M11	M11-M13 PolarHBondContact O-N 3.15Å
14	G	22.6	Very low	24.9	Very low	64 Å²	64	146.7 Å²	146.7	66%	0.66	82%	0.821	S	S	*	*			trans	-73.8	121.2	170	0	0	0	0	0	111.6	N12 K16	N12-G14 PolarHBondContact O-N 3.04Å; N12-G14 VanDerWaalsContact O-N 3.15Å; G14-K16 PolarHBondContact O-N 3.39Å; G14-K16 VanDerWaalsContact O-N 3.1Å
15	Y	23.3	Very low	24.9	Very low	216 Å²	216	146.4 Å²	146.4	85%	0.847	82%	0.815	S	S	*	*			trans	-68.4	100.1	170.5	-68.3	-89.2	0	0	0	109.9
16	K	22.5	Very low	24.7	Very low	186 Å²	186	151.3 Å²	151.3	81%	0.809	82%	0.817	S	S	*	*			trans	-85.4	120.3	165.1	-87.8	-174.8	175.1	-178.9	0	109.7	G14 D18	G14-K16 PolarHBondContact O-N 3.39Å; G14-K16 VanDerWaalsContact O-N 3.1Å; K16-D18 PolarHBondContact O-N 3.08Å
17	T	22.1	Very low	25	Very low	139 Å²	139	150.4 Å²	150.4	85%	0.853	82%	0.818	S	S	*	*			trans	-80.7	84.1	171.5	42.5	0	0	0	0	109.6
18	D	24.7	Very low	25.4	Very low	137 Å²	137	145.3 Å²	145.3	73%	0.733	81%	0.813	S	S	*	*			trans	-90.9	122.2	169.3	-83.4	-28.2	0	0	0	111.2	K16	K16-D18 PolarHBondContact O-N 3.08Å
19	S	23.3	Very low	26	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	81%	0.807	S	S	*	*			trans	-59.2	123.7	170.8	46.2	0	0	0	0	112.2
20	L	25.4	Very low	27	Very low	171 Å²	171	149.8 Å²	149.8	90%	0.895	80%	0.795	S	S	*	*			trans	-131.7	104.5	165.2	-105.8	150.6	0	0	0	110
21	H	22.3	Very low	28.7	Very low	177 Å²	177	150 Å²	150	82%	0.819	78%	0.781	S	S	*	*			trans	-70.5	148.6	159.8	-93.5	-74.1	0	0	0	110.3
22	S	25.1	Very low	31.2	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	76%	0.762	S	S	*	*			trans	66.8	87.6	160.7	72.3	0	0	0	0	119
23	V	25.8	Very low	34	Very low	150 Å²	150	141.4 Å²	141.4	91%	0.909	74%	0.735	S	S	*	*			trans	-126.1	117.8	137	179.1	0	0	0	0	106.9
24	R	22.9	Very low	36.9	Very low	218 Å²	218	136 Å²	136	82%	0.823	71%	0.708	S	S	*	*			trans	-79.1	132.1	176.7	-87.9	-178.1	172.4	169.3	-4.2	110.1
25	E	26.5	Very low	40.3	Very low	166 Å²	166	132.9 Å²	132.9	78%	0.776	68%	0.677	S	S	*	*	S	Bend	trans	59	93.3	134.8	-63.9	174.4	156.2	0	0	118.2
26	K	28.3	Very low	43.7	Very low	207 Å²	207	124.9 Å²	124.9	90%	0.9	65%	0.646	S	S	*	*				-174.1	24.2	119.5	-103.5	178.7	-176.2	-177.9	0	116.3	G28	K26-G28 PolarHBondContact O-N 2.74Å
27	D	30.8	Very low	47.2	Very low	158 Å²	158	116 Å²	116	85%	0.845	61%	0.607	S	S	*	*	S	Bend	trans	-76.7	126.3	167.4	-65.6	-37.7	0	0	0	110.4	N29	D27-N29 PolarHBondContact O-N 3.49Å
28	G	34.9	Very low	50.5	Low	73 Å²	73	110.7 Å²	110.7	75%	0.753	57%	0.572	S	S	*	*			trans	-59.4	84.3	177.8	0	0	0	0	0	111	K26 Y30	K26-G28 PolarHBondContact O-N 2.74Å; G28-Y30 PolarHBondContact O-N 3.39Å; G28-Y30 VanDerWaalsContact O-N 3.09Å
29	N	38.2	Very low	53.7	Low	123 Å²	123	106.3 Å²	106.3	66%	0.658	55%	0.547	S	S	*	.			trans	-71.6	107.2	-169.5	-152.9	-3.9	0	0	0	108.9	D27 M31	D27-N29 PolarHBondContact O-N 3.49Å; N29-M31 HydrophobicContact CB-CG 3.68Å; N29-M31 HydrophobicContact CB-SD 4.41Å; N29-M31 WeakPolarHBondContact ND2-CG 3.24Å; N29-M31 PolarHBondContact O-N 3.33Å
30	Y	50	Low	56.7	Low	148 Å²	148	102.6 Å²	102.6	58%	0.58	52%	0.518	S	S	*	.			trans	-65.3	60	162.5	-71.4	-80.9	0	0	0	109.7	G28 T32 R54	G28-Y30 PolarHBondContact O-N 3.39Å; G28-Y30 VanDerWaalsContact O-N 3.09Å; Y30-T32 PolarHBondContact O-N 3.28Å; Y30-T32 VanDerWaalsContact O-N 3.13Å; Y30-R54 HydrophobicContact CD1-CB 3.74Å; Y30-R54 HydrophobicContact CE1-CB 3.65Å
31	M	60.5	Low	59.3	Low	100 Å²	100	96.7 Å²	96.7	49%	0.493	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-65.8	116.1	-179.4	-68.8	-170.7	74.9	0	0	109.1	N29 R33	N29-M31 HydrophobicContact CB-CG 3.68Å; N29-M31 HydrophobicContact CB-SD 4.41Å; N29-M31 WeakPolarHBondContact ND2-CG 3.24Å; N29-M31 PolarHBondContact O-N 3.33Å; M31-R33 PolarHBondContact O-N 2.74Å
32	T	77	Confident	62	Low	76 Å²	76	90.7 Å²	90.7	47%	0.466	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-65.4	117.8	170.8	-61.1	0	0	0	0	109.7	Y30 P51	Y30-T32 PolarHBondContact O-N 3.28Å; Y30-T32 VanDerWaalsContact O-N 3.13Å; T32-P51 HydrophobicContact CG2-CB 3.49Å; T32-P51 VanDerWaalsContact CG2-CB 3.49Å
33	R	83.3	Confident	64.5	Low	82 Å²	82	92.8 Å²	92.8	31%	0.309	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.1	179.2	-56	175	-165.4	174.6	1.1	108.5	M31 V35 V52 E93 L95 R97	M31-R33 PolarHBondContact O-N 2.74Å; R33-V35 HydrophobicContact CB-CG2 4.26Å; R33-V52 PolarHBondContact N-O 3.13Å; R33-V52 PolarHBondContact O-N 3.09Å; R33-E93 PolarHBondContact NH1-O 3.2Å; R33-L95 WeakPolarHBondContact CD-O 3.43Å; R33-L95 PolarHBondContact NH1-O 3.14Å; R33-R97 HydrophobicContact CB-CB 4.31Å; R33-R97 HydrophobicContact CG-CB 4.45Å
34	M	86.1	Confident	67	Low	47 Å²	47	94.8 Å²	94.8	23%	0.232	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	121.1	171.6	-65.7	-54.9	-66.5	0	0	108.9	K49 P51 Y98	M34-K49 HydrophobicContact CE-CD 3.67Å; M34-K49 HydrophobicContact CE-CG 3.67Å; M34-P51 HydrophobicContact CE-CB 4.3Å; M34-P51 HydrophobicContact SD-CB 3.6Å; M34-P51 VanDerWaalsContact SD-CB 3.6Å; M34-P51 HydrophobicContact SD-CG 4.41Å; M34-Y98 HydrophobicContact CB-CD1 4.15Å; M34-Y98 HydrophobicContact CB-CE1 4.01Å; M34-Y98 HydrophobicContact CG-CE1 4.49Å; M34-Y98 WeakPolarHBondContact O-CA 3.39Å; M34-Y98 PolarHBondContact O-N 2.94Å
35	V	93.7	Very high	69.8	Low	0 Å²	0	86.2 Å²	86.2	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.7	-174.4	-174.6	0	0	0	0	110.1	R33 F37 K49 V50 V52 L95 Y101	R33-V35 HydrophobicContact CB-CG2 4.26Å; V35-F37 HydrophobicContact CB-CE2 3.75Å; V35-F37 HydrophobicContact CB-CZ 4.04Å; V35-F37 HydrophobicContact CG1-CD2 4.3Å; V35-F37 HydrophobicContact CG1-CE1 4.12Å; V35-F37 HydrophobicContact CG1-CE2 3.58Å; V35-F37 HydrophobicContact CG1-CZ 3.48Å; V35-F37 VanDerWaalsContact CG1-CZ 3.48Å; V35-K49 CarbonylContact O-C 3.56Å; V35-K49 WeakPolarHBondContact O-CA 3.1Å; V35-V50 PolarHBondContact N-O 3.32Å; V35-V50 PolarHBondContact O-N 2.77Å; V35-V52 HydrophobicContact CB-CG2 4.12Å; V35-V52 HydrophobicContact CG2-CB 4.11Å; V35-V52 HydrophobicContact CG2-CG2 3.88Å; V35-L95 HydrophobicContact CG1-CD2 4.3Å; V35-L95 HydrophobicContact CG2-CB 4.12Å; V35-Y101 HydrophobicContact CG1-CD2 3.34Å; V35-Y101 HydrophobicContact CG1-CE2 3.57Å
36	Y	94.3	Very high	72.3	Confident	48 Å²	48	83 Å²	83	19%	0.188	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127	-179.4	-65.9	-89	0	0	0	111.5	A47 K49 Y98 G99 N100 Y101	Y36-A47 HydrophobicContact CD1-CB 4.18Å; Y36-K49 HydrophobicContact CD1-CB 4.02Å; Y36-K49 HydrophobicContact CD1-CG 4.1Å; Y36-K49 HydrophobicContact CE1-CB 3.9Å; Y36-K49 HydrophobicContact CE1-CD 3.93Å; Y36-K49 HydrophobicContact CE1-CG 3.68Å; Y36-K49 WeakPolarHBondContact OH-CE 3.5Å; Y36-Y98 HydrophobicContact CE2-CD1 4.05Å; Y36-G99 PolarHBondContact N-O 3.28Å; Y36-N100 CarbonylContact O-C 3.6Å; Y36-N100 WeakPolarHBondContact O-CA 3.39Å; Y36-Y101 PolarHBondContact O-N 3.32Å
37	F	95.1	Very high	75.1	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.5	-176.1	-66.9	-79	0	0	0	111.4	V35 A47 V48 V50 V52 L63 L67 L80 L95 Y101	V35-F37 HydrophobicContact CB-CE2 3.75Å; V35-F37 HydrophobicContact CB-CZ 4.04Å; V35-F37 HydrophobicContact CG1-CD2 4.3Å; V35-F37 HydrophobicContact CG1-CE1 4.12Å; V35-F37 HydrophobicContact CG1-CE2 3.58Å; V35-F37 HydrophobicContact CG1-CZ 3.48Å; V35-F37 VanDerWaalsContact CG1-CZ 3.48Å; F37-A47 CarbonylContact O-C 3.47Å; F37-A47 WeakPolarHBondContact O-CA 3.48Å; F37-V48 HydrophobicContact CB-CB 4.4Å; F37-V48 PolarHBondContact N-O 3.47Å; F37-V48 PolarHBondContact O-N 3.02Å; F37-V50 HydrophobicContact CD2-CB 4.07Å; F37-V50 HydrophobicContact CD2-CG2 3.82Å; F37-V50 HydrophobicContact CE2-CB 3.86Å; F37-V50 HydrophobicContact CE2-CG2 4.09Å; F37-V52 HydrophobicContact CE2-CG2 4.34Å; F37-L63 HydrophobicContact CZ-CD1 4.48Å; F37-L63 HydrophobicContact CZ-CD2 4.01Å; F37-L67 HydrophobicContact CB-CD2 3.97Å; F37-L67 HydrophobicContact CD1-CD1 3.65Å; F37-L67 HydrophobicContact CD1-CD2 4.25Å; F37-L67 HydrophobicContact CD2-CD1 4.23Å; F37-L67 HydrophobicContact CD2-CD2 3.6Å; F37-L67 HydrophobicContact CE1-CD1 3.66Å; F37-L67 HydrophobicContact CE2-CD1 4.23Å; F37-L67 HydrophobicContact CE2-CD2 4.13Å; F37-L67 HydrophobicContact CG-CD1 3.94Å; F37-L67 HydrophobicContact CG-CD2 3.65Å; F37-L67 HydrophobicContact CG-CG 4.48Å; F37-L67 HydrophobicContact CZ-CD1 3.95Å; F37-L80 HydrophobicContact CD1-CD2 3.44Å; F37-L80 VanDerWaalsContact CD1-CD2 3.44Å; F37-L80 HydrophobicContact CE1-CD1 3.71Å; F37-L80 HydrophobicContact CE1-CD2 3.49Å; F37-L80 VanDerWaalsContact CE1-CD2 3.49Å; F37-L80 HydrophobicContact CE1-CG 4.22Å; F37-L80 HydrophobicContact CZ-CD1 4.46Å; F37-L95 HydrophobicContact CE1-CD2 4.4Å; F37-L95 HydrophobicContact CZ-CD1 4.23Å; F37-L95 HydrophobicContact CZ-CD2 4.42Å; F37-Y101 CarbonylContact C-O 3.52Å; F37-Y101 WeakPolarHBondContact CA-O 3.48Å
38	H	92.3	Very high	77.9	Confident	26 Å²	26	68.7 Å²	68.7	12%	0.12	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	153.6	-179.4	-62.6	-100.1	0	0	0	110.3	A47 N100 Y101 C103 L112	H38-A47 VanDerWaalsContact CE1-CB 3.43Å; H38-A47 WeakPolarHBondContact CE1-CB 3.42Å; H38-N100 PolarHBondContact NE2-OD1 2.81Å; H38-Y101 PolarHBondContact N-O 3.08Å; H38-C103 WeakPolarHBondContact O-CB 3.12Å; H38-C103 PolarHBondContact O-N 3.2Å; H38-L112 HydrophobicContact CB-CD1 4.04Å
39	K	91.4	Very high	80.6	Confident	46 Å²	46	70.6 Å²	70.6	20%	0.2	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.7	178.6	-177.6	178.2	168.3	176.3	0	110.5	G41 D42 F45 V71 P72 L73	K39-G41 PolarHBondContact O-N 3.06Å; K39-D42 HydrophobicContact CB-CB 4.28Å; K39-D42 HydrophobicContact CD-CB 4.08Å; K39-D42 HydrophobicContact CG-CB 4.22Å; K39-D42 PolarHBondContact O-N 3.46Å; K39-F45 HydrophobicContact CB-CB 3.94Å; K39-F45 HydrophobicContact CB-CD1 3.55Å; K39-F45 HydrophobicContact CB-CE1 4.16Å; K39-F45 HydrophobicContact CB-CG 3.75Å; K39-F45 HydrophobicContact CD-CB 4.5Å; K39-F45 HydrophobicContact CD-CD2 4.25Å; K39-F45 HydrophobicContact CD-CG 4.22Å; K39-V71 HydrophobicContact CB-CG1 3.85Å; K39-V71 HydrophobicContact CG-CG1 4.06Å; K39-P72 WeakPolarHBondContact CE-O 3.45Å; K39-P72 PolarHBondContact NZ-O 2.66Å; K39-L73 HydrophobicContact CD-CD2 4.47Å; K39-L73 HydrophobicContact CG-CD2 3.81Å
40	D	87.7	Confident	83.2	Confident	32 Å²	32	64.8 Å²	64.8	17%	0.171	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	134.9	174.5	-178.1	34.9	0	0	0	111.7	D42 I102 C103 A104 V109 Q110	D40-D42 PolarHBondContact O-N 3.03Å; D40-I102 HydrophobicContact CB-CG2 3.78Å; D40-C103 WeakPolarHBondContact CB-O 3.39Å; D40-C103 PolarHBondContact N-O 3.36Å; D40-A104 HydrophobicContact CB-CB 4.06Å; D40-V109 WeakPolarHBondContact OD1-CG1 3.36Å; D40-Q110 PolarHBondContact OD1-N 2.89Å
41	G	79.7	Confident	85	Confident	47 Å²	47	59.8 Å²	59.8	49%	0.485	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	-3.6	-178.3	0	0	0	0	0	116.6	K39	K39-G41 PolarHBondContact O-N 3.06Å
42	D	79.5	Confident	86.3	Confident	51 Å²	51	55.1 Å²	55.1	27%	0.273	28%	0.282	S	S	.	.			trans	-124.9	95.4	-176.4	-168.6	-9.7	0	0	0	112.4	K39 D40 Y44 F45	K39-D42 HydrophobicContact CB-CB 4.28Å; K39-D42 HydrophobicContact CD-CB 4.08Å; K39-D42 HydrophobicContact CG-CB 4.22Å; K39-D42 PolarHBondContact O-N 3.46Å; D40-D42 PolarHBondContact O-N 3.03Å; D42-Y44 VanDerWaalsContact C-N 3.25Å; D42-Y44 PolarHBondContact O-N 3.38Å; D42-Y44 PolarHBondContact OD1-N 3.3Å; D42-F45 HydrophobicContact CB-CB 4.07Å; D42-F45 PolarHBondContact OD1-N 3.06Å
43	K	76.2	Confident	86.6	Confident	151 Å²	151	52.1 Å²	52.1	66%	0.657	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.5	178.6	68.9	-178.7	-175.6	178.2	0	114.4	L112	K43-L112 HydrophobicContact CB-CD2 4.11Å
44	Y	78.2	Confident	86.3	Confident	191 Å²	191	54.5 Å²	54.5	75%	0.749	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-11.9	-178.9	-59.3	-69.5	0	0	0	112.1	D42	D42-Y44 VanDerWaalsContact C-N 3.25Å; D42-Y44 PolarHBondContact O-N 3.38Å; D42-Y44 PolarHBondContact OD1-N 3.3Å
45	F	81.6	Confident	85.7	Confident	39 Å²	39	56.3 Å²	56.3	17%	0.171	30%	0.295	C	S	.	.	S	Bend	trans	-65.8	124.6	174.6	-175.4	-99.3	0	0	0	110.8	K39 D42 V48 V71 P72	K39-F45 HydrophobicContact CB-CB 3.94Å; K39-F45 HydrophobicContact CB-CD1 3.55Å; K39-F45 HydrophobicContact CB-CE1 4.16Å; K39-F45 HydrophobicContact CB-CG 3.75Å; K39-F45 HydrophobicContact CD-CB 4.5Å; K39-F45 HydrophobicContact CD-CD2 4.25Å; K39-F45 HydrophobicContact CD-CG 4.22Å; D42-F45 HydrophobicContact CB-CB 4.07Å; D42-F45 PolarHBondContact OD1-N 3.06Å; F45-V48 HydrophobicContact CE1-CG2 3.86Å; F45-V48 HydrophobicContact CZ-CG2 4.04Å; F45-V71 HydrophobicContact CE1-CG1 4.16Å; F45-V71 HydrophobicContact CE1-CG2 4.29Å; F45-V71 HydrophobicContact CZ-CG1 4.46Å; F45-P72 HydrophobicContact CE2-CG 4.19Å
46	P	79.7	Confident	85.1	Confident	99 Å²	99	61.1 Å²	61.1	64%	0.643	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-67.1	137.5	179.3	27.2	-33.3	0	0	0	110.9	V48	P46-V48 PolarHBondContact O-N 3.4Å
47	A	87.5	Confident	84.7	Confident	38 Å²	38	59.3 Å²	59.3	31%	0.314	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-62.7	128.2	-178.3	0	0	0	0	0	112	Y36 F37 H38 K49	Y36-A47 HydrophobicContact CD1-CB 4.18Å; F37-A47 CarbonylContact O-C 3.47Å; F37-A47 WeakPolarHBondContact O-CA 3.48Å; H38-A47 VanDerWaalsContact CE1-CB 3.43Å; H38-A47 WeakPolarHBondContact CE1-CB 3.42Å; A47-K49 PolarHBondContact O-N 3.48Å
48	V	90.1	Very high	83.7	Confident	26 Å²	26	65.4 Å²	65.4	16%	0.158	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	114.8	174.7	177.3	0	0	0	0	108.9	F37 F45 P46 V50 K70 V71	F37-V48 HydrophobicContact CB-CB 4.4Å; F37-V48 PolarHBondContact N-O 3.47Å; F37-V48 PolarHBondContact O-N 3.02Å; F45-V48 HydrophobicContact CE1-CG2 3.86Å; F45-V48 HydrophobicContact CZ-CG2 4.04Å; P46-V48 PolarHBondContact O-N 3.4Å; V48-V50 HydrophobicContact CG1-CG2 3.81Å; V48-K70 HydrophobicContact CG1-CB 3.92Å; V48-K70 HydrophobicContact CG1-CD 4.09Å; V48-K70 HydrophobicContact CG2-CB 4.48Å; V48-V71 HydrophobicContact CB-CG2 4.15Å; V48-V71 HydrophobicContact CG2-CG2 3.75Å
49	K	91.6	Very high	83.3	Confident	112 Å²	112	67.1 Å²	67.1	49%	0.487	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	120.1	177.9	-169.1	-172.1	-168.2	-174	0	110.4	M34 V35 Y36 A47	M34-K49 HydrophobicContact CE-CD 3.67Å; M34-K49 HydrophobicContact CE-CG 3.67Å; V35-K49 CarbonylContact O-C 3.56Å; V35-K49 WeakPolarHBondContact O-CA 3.1Å; Y36-K49 HydrophobicContact CD1-CB 4.02Å; Y36-K49 HydrophobicContact CD1-CG 4.1Å; Y36-K49 HydrophobicContact CE1-CB 3.9Å; Y36-K49 HydrophobicContact CE1-CD 3.93Å; Y36-K49 HydrophobicContact CE1-CG 3.68Å; Y36-K49 WeakPolarHBondContact OH-CE 3.5Å; A47-K49 PolarHBondContact O-N 3.48Å
50	V	90.9	Very high	83.2	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127	-178.9	-176.1	0	0	0	0	110.7	V35 F37 V48 V52 Y57 L63 L67	V35-V50 PolarHBondContact N-O 3.32Å; V35-V50 PolarHBondContact O-N 2.77Å; F37-V50 HydrophobicContact CD2-CB 4.07Å; F37-V50 HydrophobicContact CD2-CG2 3.82Å; F37-V50 HydrophobicContact CE2-CB 3.86Å; F37-V50 HydrophobicContact CE2-CG2 4.09Å; V48-V50 HydrophobicContact CG1-CG2 3.81Å; V50-V52 HydrophobicContact CB-CG2 4.38Å; V50-V52 HydrophobicContact CG1-CG2 4.04Å; V50-V52 PolarHBondContact O-N 3.45Å; V50-Y57 HydrophobicContact CG1-CE2 3.97Å; V50-Y57 VanDerWaalsContact CG1-OH 3.26Å; V50-Y57 WeakPolarHBondContact CG1-OH 3.48Å; V50-L63 HydrophobicContact CG1-CD1 4.22Å; V50-L67 HydrophobicContact CG2-CD2 3.87Å
51	P	88	Confident	83.2	Confident	43 Å²	43	69.3 Å²	69.3	28%	0.279	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	123.1	164.7	24.3	-25.2	0	0	0	109.2	T32 M34 K56 Y57	T32-P51 HydrophobicContact CG2-CB 3.49Å; T32-P51 VanDerWaalsContact CG2-CB 3.49Å; M34-P51 HydrophobicContact CE-CB 4.3Å; M34-P51 HydrophobicContact SD-CB 3.6Å; M34-P51 VanDerWaalsContact SD-CB 3.6Å; M34-P51 HydrophobicContact SD-CG 4.41Å; P51-K56 WeakPolarHBondContact O-CD 3.46Å; P51-K56 PolarHBondContact O-NZ 3.24Å; P51-Y57 WeakPolarHBondContact O-CE2 3.36Å
52	V	88.9	Confident	83.7	Confident	3 Å²	3	69 Å²	69	2%	0.018	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.6	-177.3	-178.3	0	0	0	0	109.5	R33 V35 F37 V50 Y57 L63 I92 L95	R33-V52 PolarHBondContact N-O 3.13Å; R33-V52 PolarHBondContact O-N 3.09Å; V35-V52 HydrophobicContact CB-CG2 4.12Å; V35-V52 HydrophobicContact CG2-CB 4.11Å; V35-V52 HydrophobicContact CG2-CG2 3.88Å; F37-V52 HydrophobicContact CE2-CG2 4.34Å; V50-V52 HydrophobicContact CB-CG2 4.38Å; V50-V52 HydrophobicContact CG1-CG2 4.04Å; V50-V52 PolarHBondContact O-N 3.45Å; V52-Y57 HydrophobicContact CG1-CD2 4.13Å; V52-Y57 HydrophobicContact CG2-CE2 4.28Å; V52-L63 HydrophobicContact CG1-CD2 4.37Å; V52-L63 HydrophobicContact CG2-CD1 4.13Å; V52-L63 HydrophobicContact CG2-CD2 4.33Å; V52-I92 HydrophobicContact CG1-CG2 3.52Å; V52-L95 HydrophobicContact CG1-CD1 4Å; V52-L95 HydrophobicContact CG2-CD1 4.48Å
53	S	83	Confident	84.4	Confident	12 Å²	12	66.6 Å²	66.6	8%	0.084	34%	0.335	C	S	.	.			trans	-149	156.8	171.5	68	0	0	0	0	109.1	A55 K56 Y57	S53-A55 PolarHBondContact O-N 3.15Å; S53-K56 PolarHBondContact O-N 3.42Å; S53-K56 PolarHBondContact OG-N 2.91Å; S53-Y57 PolarHBondContact O-N 3.42Å
54	R	76.8	Confident	85.2	Confident	132 Å²	132	60.3 Å²	60.3	50%	0.498	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.7	172.9	-90.9	-170.1	-171.5	-149.8	2.5	112.9	Y30 K56 Y57 E93	Y30-R54 HydrophobicContact CD1-CB 3.74Å; Y30-R54 HydrophobicContact CE1-CB 3.65Å; R54-K56 VanDerWaalsContact C-N 3.31Å; R54-Y57 WeakPolarHBondContact CA-O 3.21Å; R54-E93 IonicContact CZ-OE1 3.57Å; R54-E93 IonicContact NE-OE1 3.54Å; R54-E93 PolarHBondContact NE-OE1 2.94Å; R54-E93 IonicContact NH2-OE1 2.73Å; R54-E93 PolarHBondContact NH2-OE1 3.28Å
55	A	73.4	Confident	85.8	Confident	85 Å²	85	55.5 Å²	55.5	70%	0.702	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-30.9	175.5	0	0	0	0	0	112.4	S53	S53-A55 PolarHBondContact O-N 3.15Å
56	K	81.1	Confident	86.2	Confident	101 Å²	101	55.3 Å²	55.3	44%	0.439	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-39.2	-178.1	-170.5	-179.4	177.3	-158.9	0	113.2	P51 S53 R54	P51-K56 WeakPolarHBondContact O-CD 3.46Å; P51-K56 PolarHBondContact O-NZ 3.24Å; S53-K56 PolarHBondContact O-N 3.42Å; S53-K56 PolarHBondContact OG-N 2.91Å; R54-K56 VanDerWaalsContact C-N 3.31Å
57	Y	86.4	Confident	86.8	Confident	11 Å²	11	50.6 Å²	50.6	4%	0.043	27%	0.266	C	S	.	.			trans	-125.7	111.6	176.3	-53.7	-76.3	0	0	0	107.7	V50 P51 V52 S53 R54 A62 L63 D66 I92	V50-Y57 HydrophobicContact CG1-CE2 3.97Å; V50-Y57 VanDerWaalsContact CG1-OH 3.26Å; V50-Y57 WeakPolarHBondContact CG1-OH 3.48Å; P51-Y57 WeakPolarHBondContact O-CE2 3.36Å; V52-Y57 HydrophobicContact CG1-CD2 4.13Å; V52-Y57 HydrophobicContact CG2-CE2 4.28Å; S53-Y57 PolarHBondContact O-N 3.42Å; R54-Y57 WeakPolarHBondContact CA-O 3.21Å; Y57-A62 HydrophobicContact CD1-CB 4.43Å; Y57-L63 HydrophobicContact CD1-CB 3.99Å; Y57-L63 HydrophobicContact CD1-CD1 4.3Å; Y57-L63 HydrophobicContact CD2-CB 4.39Å; Y57-L63 HydrophobicContact CD2-CD1 3.95Å; Y57-L63 HydrophobicContact CE1-CB 4.49Å; Y57-L63 HydrophobicContact CE1-CD1 4.07Å; Y57-L63 HydrophobicContact CE2-CD1 3.69Å; Y57-L63 HydrophobicContact CG-CB 3.93Å; Y57-L63 HydrophobicContact CG-CD1 4.24Å; Y57-D66 HydrophobicContact CE1-CB 3.8Å; Y57-D66 PolarHBondContact OH-OD2 2.82Å; Y57-I92 WeakPolarHBondContact O-CD1 3.47Å
58	R	74.4	Confident	87	Confident	128 Å²	128	50.4 Å²	50.4	48%	0.483	26%	0.262	S	S	.	.	S	Bend	trans	-73.4	-33.6	-178.8	-169.2	173.8	179.8	174.1	-1	112
59	T	83.7	Confident	86.8	Confident	61 Å²	61	57.1 Å²	57.1	37%	0.374	29%	0.289	S	S	.	.	S	Bend	trans	-132.6	160	177.8	77.9	0	0	0	0	110.8	E61 A62 L63 I92	T59-E61 WeakPolarHBondContact CB-OE2 3.27Å; T59-E61 PolarHBondContact O-N 3.31Å; T59-E61 PolarHBondContact OG1-N 3.32Å; T59-E61 PolarHBondContact OG1-OE2 3.28Å; T59-A62 PolarHBondContact O-N 2.82Å; T59-A62 PolarHBondContact OG1-N 2.96Å; T59-L63 PolarHBondContact O-N 2.9Å; T59-I92 WeakPolarHBondContact O-CD1 3.04Å
60	I	89.2	Confident	86.6	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.077	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-32.5	177.1	-164.5	68.6	0	0	0	110.9	A62 L63 L64 L80 I89 R90 I92	I60-A62 PolarHBondContact O-N 2.95Å; I60-L63 HydrophobicContact CD1-CD2 4.1Å; I60-L63 WeakPolarHBondContact O-CB 3.37Å; I60-L63 PolarHBondContact O-N 3.07Å; I60-L63 VanDerWaalsContact O-N 3.14Å; I60-L64 VanDerWaalsContact O-CG 3.27Å; I60-L64 WeakPolarHBondContact O-CG 3.05Å; I60-L64 PolarHBondContact O-N 3.13Å; I60-L80 HydrophobicContact CD1-CD1 4.11Å; I60-I89 HydrophobicContact CD1-CG2 4.27Å; I60-R90 WeakPolarHBondContact CG2-O 3.24Å; I60-I92 HydrophobicContact CB-CG1 4.45Å; I60-I92 HydrophobicContact CD1-CG1 3.96Å
61	E	88.5	Confident	86.5	Confident	109 Å²	109	55.9 Å²	55.9	51%	0.509	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-41.4	177.3	-62.4	72.4	-156.7	0	0	112.1	T59 L63 L64 D65	T59-E61 WeakPolarHBondContact CB-OE2 3.27Å; T59-E61 PolarHBondContact O-N 3.31Å; T59-E61 PolarHBondContact OG1-N 3.32Å; T59-E61 PolarHBondContact OG1-OE2 3.28Å; E61-L63 VanDerWaalsContact C-N 3.27Å; E61-L63 PolarHBondContact O-N 2.96Å; E61-L64 WeakPolarHBondContact O-CB 3.42Å; E61-L64 PolarHBondContact O-N 3.05Å; E61-L64 VanDerWaalsContact O-N 3.1Å; E61-D65 PolarHBondContact O-N 3.48Å
62	A	89.3	Confident	86.2	Confident	41 Å²	41	56.4 Å²	56.4	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-62.8	-35.6	175.8	0	0	0	0	0	112.2	Y57 T59 I60 D66	Y57-A62 HydrophobicContact CD1-CB 4.43Å; T59-A62 PolarHBondContact O-N 2.82Å; T59-A62 PolarHBondContact OG1-N 2.96Å; I60-A62 PolarHBondContact O-N 2.95Å; A62-D66 PolarHBondContact O-N 3.48Å
63	L	93.9	Very high	86	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.8	-42	172.3	175.5	64.3	0	0	0	111.1	F37 V50 V52 Y57 T59 I60 E61 D65 D66 L67 L80 L95	F37-L63 HydrophobicContact CZ-CD1 4.48Å; F37-L63 HydrophobicContact CZ-CD2 4.01Å; V50-L63 HydrophobicContact CG1-CD1 4.22Å; V52-L63 HydrophobicContact CG1-CD2 4.37Å; V52-L63 HydrophobicContact CG2-CD1 4.13Å; V52-L63 HydrophobicContact CG2-CD2 4.33Å; Y57-L63 HydrophobicContact CD1-CB 3.99Å; Y57-L63 HydrophobicContact CD1-CD1 4.3Å; Y57-L63 HydrophobicContact CD2-CB 4.39Å; Y57-L63 HydrophobicContact CD2-CD1 3.95Å; Y57-L63 HydrophobicContact CE1-CB 4.49Å; Y57-L63 HydrophobicContact CE1-CD1 4.07Å; Y57-L63 HydrophobicContact CE2-CD1 3.69Å; Y57-L63 HydrophobicContact CG-CB 3.93Å; Y57-L63 HydrophobicContact CG-CD1 4.24Å; T59-L63 PolarHBondContact O-N 2.9Å; I60-L63 HydrophobicContact CD1-CD2 4.1Å; I60-L63 WeakPolarHBondContact O-CB 3.37Å; I60-L63 PolarHBondContact O-N 3.07Å; I60-L63 VanDerWaalsContact O-N 3.14Å; E61-L63 VanDerWaalsContact C-N 3.27Å; E61-L63 PolarHBondContact O-N 2.96Å; L63-D65 VanDerWaalsContact C-N 3.34Å; L63-D65 PolarHBondContact O-N 2.7Å; L63-D66 PolarHBondContact O-N 3.32Å; L63-L67 HydrophobicContact CD1-CD1 4.04Å; L63-L67 HydrophobicContact CD1-CG 4.06Å; L63-L67 HydrophobicContact CD2-CD1 4.47Å; L63-L67 HydrophobicContact CG-CD1 3.85Å; L63-L67 HydrophobicContact CG-CG 4.3Å; L63-L67 WeakPolarHBondContact O-CB 3.47Å; L63-L67 VanDerWaalsContact O-CG 3.24Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3.25Å; L63-L80 HydrophobicContact CD2-CD1 4.08Å; L63-L95 HydrophobicContact CD2-CD1 3.45Å; L63-L95 VanDerWaalsContact CD2-CD1 3.45Å
64	L	93.6	Very high	85.5	Confident	19 Å²	19	63.7 Å²	63.7	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-62	-38.7	177.4	-68.4	171.6	0	0	0	112.1	I60 E61 L67 S68 V77 R78 L80	I60-L64 VanDerWaalsContact O-CG 3.27Å; I60-L64 WeakPolarHBondContact O-CG 3.05Å; I60-L64 PolarHBondContact O-N 3.13Å; E61-L64 WeakPolarHBondContact O-CB 3.42Å; E61-L64 PolarHBondContact O-N 3.05Å; E61-L64 VanDerWaalsContact O-N 3.1Å; L64-L67 PolarHBondContact O-N 3.11Å; L64-S68 WeakPolarHBondContact O-CB 3.44Å; L64-S68 PolarHBondContact O-N 3.41Å; L64-S68 PolarHBondContact O-OG 2.88Å; L64-V77 HydrophobicContact CD2-CG1 3.72Å; L64-R78 WeakPolarHBondContact CD1-O 3.31Å; L64-L80 HydrophobicContact CD2-CD1 3.97Å; L64-L80 HydrophobicContact CD2-CG 3.73Å
65	D	89.5	Confident	85.6	Confident	90 Å²	90	64.6 Å²	64.6	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-67.7	-41.4	176.1	-77.6	-15.1	0	0	0	112.2	E61 L63 S68 K69	E61-D65 PolarHBondContact O-N 3.48Å; L63-D65 VanDerWaalsContact C-N 3.34Å; L63-D65 PolarHBondContact O-N 2.7Å; D65-S68 WeakPolarHBondContact O-CB 3.49Å; D65-S68 PolarHBondContact O-N 3.08Å; D65-K69 PolarHBondContact O-N 3.17Å
66	D	90.2	Very high	86.1	Confident	35 Å²	35	61.3 Å²	61.3	19%	0.187	30%	0.302	C	S	.	.	H	α-helix	trans	-68.1	-38.2	174.6	-174.3	38.9	0	0	0	111.6	Y57 A62 L63 S68 K69 K70	Y57-D66 HydrophobicContact CE1-CB 3.8Å; Y57-D66 PolarHBondContact OH-OD2 2.82Å; A62-D66 PolarHBondContact O-N 3.48Å; L63-D66 PolarHBondContact O-N 3.32Å; D66-S68 VanDerWaalsContact C-N 3.34Å; D66-K69 PolarHBondContact O-N 2.79Å; D66-K70 VanDerWaalsContact CG-NZ 3.26Å; D66-K70 WeakPolarHBondContact O-CG 3.24Å; D66-K70 PolarHBondContact O-N 3.31Å; D66-K70 VanDerWaalsContact OD1-CE 3.29Å; D66-K70 WeakPolarHBondContact OD1-CE 3.39Å; D66-K70 IonicContact OD1-NZ 3.05Å; D66-K70 PolarHBondContact OD1-NZ 2.81Å; D66-K70 VanDerWaalsContact OD1-NZ 3.1Å; D66-K70 IonicContact OD2-NZ 3.46Å; D66-K70 PolarHBondContact OD2-NZ 2.79Å
67	L	93.6	Very high	86.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.8	-33.2	173.4	-72.4	174	0	0	0	112.3	F37 V50 L63 L64 K69 K70 V71 V77 L80	F37-L67 HydrophobicContact CB-CD2 3.97Å; F37-L67 HydrophobicContact CD1-CD1 3.65Å; F37-L67 HydrophobicContact CD1-CD2 4.25Å; F37-L67 HydrophobicContact CD2-CD1 4.23Å; F37-L67 HydrophobicContact CD2-CD2 3.6Å; F37-L67 HydrophobicContact CE1-CD1 3.66Å; F37-L67 HydrophobicContact CE2-CD1 4.23Å; F37-L67 HydrophobicContact CE2-CD2 4.13Å; F37-L67 HydrophobicContact CG-CD1 3.94Å; F37-L67 HydrophobicContact CG-CD2 3.65Å; F37-L67 HydrophobicContact CG-CG 4.48Å; F37-L67 HydrophobicContact CZ-CD1 3.95Å; V50-L67 HydrophobicContact CG2-CD2 3.87Å; L63-L67 HydrophobicContact CD1-CD1 4.04Å; L63-L67 HydrophobicContact CD1-CG 4.06Å; L63-L67 HydrophobicContact CD2-CD1 4.47Å; L63-L67 HydrophobicContact CG-CD1 3.85Å; L63-L67 HydrophobicContact CG-CG 4.3Å; L63-L67 WeakPolarHBondContact O-CB 3.47Å; L63-L67 VanDerWaalsContact O-CG 3.24Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3.25Å; L64-L67 PolarHBondContact O-N 3.11Å; L67-K69 PolarHBondContact O-N 3.02Å; L67-K70 PolarHBondContact O-N 2.79Å; L67-V71 PolarHBondContact O-N 3.25Å; L67-V77 HydrophobicContact CB-CB 4.1Å; L67-V77 HydrophobicContact CB-CG1 4.19Å; L67-V77 HydrophobicContact CB-CG2 3.97Å; L67-L80 HydrophobicContact CD1-CD1 4.05Å; L67-L80 HydrophobicContact CD1-CD2 3.92Å; L67-L80 HydrophobicContact CD1-CG 4.43Å
68	S	90	Very high	86.9	Confident	35 Å²	35	63.1 Å²	63.1	25%	0.245	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-27	175.1	-66.2	0	0	0	0	113	L64 D65 D66 V77	L64-S68 WeakPolarHBondContact O-CB 3.44Å; L64-S68 PolarHBondContact O-N 3.41Å; L64-S68 PolarHBondContact O-OG 2.88Å; D65-S68 WeakPolarHBondContact O-CB 3.49Å; D65-S68 PolarHBondContact O-N 3.08Å; D66-S68 VanDerWaalsContact C-N 3.34Å; S68-V77 PolarHBondContact OG-N 3.34Å; S68-V77 PolarHBondContact OG-O 2.88Å
69	K	87.3	Confident	87.7	Confident	167 Å²	167	60.2 Å²	60.2	73%	0.726	30%	0.295	S	S	*	.	H	α-helix	trans	-81.2	-24.9	173.9	-61.8	173.2	-173.8	174.9	0	113	D65 D66 L67	D65-K69 PolarHBondContact O-N 3.17Å; D66-K69 PolarHBondContact O-N 2.79Å; L67-K69 PolarHBondContact O-N 3.02Å
70	K	86.6	Confident	88.2	Confident	86 Å²	86	57.3 Å²	57.3	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-103	-30.1	-172.1	-67	171.6	-178.6	165.3	0	113.8	V48 D66 L67	V48-K70 HydrophobicContact CG1-CB 3.92Å; V48-K70 HydrophobicContact CG1-CD 4.09Å; V48-K70 HydrophobicContact CG2-CB 4.48Å; D66-K70 VanDerWaalsContact CG-NZ 3.26Å; D66-K70 WeakPolarHBondContact O-CG 3.24Å; D66-K70 PolarHBondContact O-N 3.31Å; D66-K70 VanDerWaalsContact OD1-CE 3.29Å; D66-K70 WeakPolarHBondContact OD1-CE 3.39Å; D66-K70 IonicContact OD1-NZ 3.05Å; D66-K70 PolarHBondContact OD1-NZ 2.81Å; D66-K70 VanDerWaalsContact OD1-NZ 3.1Å; D66-K70 IonicContact OD2-NZ 3.46Å; D66-K70 PolarHBondContact OD2-NZ 2.79Å; L67-K70 PolarHBondContact O-N 2.79Å
71	V	88.9	Confident	88.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-114	106.1	179.3	-176.3	0	0	0	0	108	K39 F45 V48 L67 L73 V77 C103	K39-V71 HydrophobicContact CB-CG1 3.85Å; K39-V71 HydrophobicContact CG-CG1 4.06Å; F45-V71 HydrophobicContact CE1-CG1 4.16Å; F45-V71 HydrophobicContact CE1-CG2 4.29Å; F45-V71 HydrophobicContact CZ-CG1 4.46Å; V48-V71 HydrophobicContact CB-CG2 4.15Å; V48-V71 HydrophobicContact CG2-CG2 3.75Å; L67-V71 PolarHBondContact O-N 3.25Å; V71-L73 HydrophobicContact CG1-CG 4.39Å; V71-L73 PolarHBondContact O-N 2.98Å; V71-L73 VanDerWaalsContact O-N 3.07Å; V71-V77 HydrophobicContact CB-CG2 3.89Å; V71-V77 HydrophobicContact CG1-CG2 4.39Å; V71-C103 HydrophobicContact CB-CB 4.4Å; V71-C103 HydrophobicContact CG1-CB 3.93Å
72	P	82.8	Confident	88.4	Confident	55 Å²	55	53.3 Å²	53.3	36%	0.357	26%	0.26	S	S	.	.			trans	-72.9	105.8	-174.7	27.9	-33	0	0	0	110.7	K39 F45	K39-P72 WeakPolarHBondContact CE-O 3.45Å; K39-P72 PolarHBondContact NZ-O 2.66Å; F45-P72 HydrophobicContact CE2-CG 4.19Å
73	L	84.9	Confident	88.2	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.141	26%	0.256	C	S	.	.			trans	-125	146.7	171	-68.8	172.3	0	0	0	109.9	K39 V71 F75 G76 V77 C103 S105	K39-L73 HydrophobicContact CD-CD2 4.47Å; K39-L73 HydrophobicContact CG-CD2 3.81Å; V71-L73 HydrophobicContact CG1-CG 4.39Å; V71-L73 PolarHBondContact O-N 2.98Å; V71-L73 VanDerWaalsContact O-N 3.07Å; L73-F75 VanDerWaalsContact C-N 3.28Å; L73-F75 PolarHBondContact O-N 2.83Å; L73-F75 VanDerWaalsContact O-N 3.15Å; L73-G76 PolarHBondContact O-N 3.28Å; L73-V77 HydrophobicContact CD1-CB 4.39Å; L73-V77 HydrophobicContact CD1-CG2 3.82Å; L73-C103 HydrophobicContact CD1-CB 4.1Å; L73-C103 WeakPolarHBondContact CD1-O 3.29Å; L73-S105 WeakPolarHBondContact CB-OG 3.43Å
74	H	71.5	Confident	87.5	Confident	141 Å²	141	60.5 Å²	60.5	65%	0.653	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-29.4	-172.2	40.3	62.5	0	0	0	115.3	S105	H74-S105 VanDerWaalsContact CE1-CB 3.4Å; H74-S105 WeakPolarHBondContact CE1-CB 3.36Å; H74-S105 PolarHBondContact CE1-OG 3.26Å; H74-S105 PolarHBondContact ND1-OG 3.4Å
75	F	79.2	Confident	86.8	Confident	151 Å²	151	60.5 Å²	60.5	66%	0.662	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	19	173.3	-60.7	-65.1	0	0	0	112.8	L73 R78 S105	L73-F75 VanDerWaalsContact C-N 3.28Å; L73-F75 PolarHBondContact O-N 2.83Å; L73-F75 VanDerWaalsContact O-N 3.15Å; F75-R78 PolarHBondContact O-NE 3.12Å; F75-S105 PolarHBondContact N-OG 2.82Å
76	G	84.6	Confident	86.2	Confident	15 Å²	15	66.2 Å²	66.2	16%	0.155	31%	0.307	C	S	.	.			trans	71.3	176.1	-165.7	0	0	0	0	0	112.7	L73 R78 S105	L73-G76 PolarHBondContact O-N 3.28Å; G76-R78 PolarHBondContact O-N 3.01Å; G76-S105 PolarHBondContact O-OG 3.26Å
77	V	92.3	Very high	85.8	Confident	0 Å²	0	69 Å²	69	0%	0	32%	0.322	C	S	.	.			trans	-77.4	111.7	172	-174.2	0	0	0	0	107.5	L64 L67 S68 V71 L73 L80 C103	L64-V77 HydrophobicContact CD2-CG1 3.72Å; L67-V77 HydrophobicContact CB-CB 4.1Å; L67-V77 HydrophobicContact CB-CG1 4.19Å; L67-V77 HydrophobicContact CB-CG2 3.97Å; S68-V77 PolarHBondContact OG-N 3.34Å; S68-V77 PolarHBondContact OG-O 2.88Å; V71-V77 HydrophobicContact CB-CG2 3.89Å; V71-V77 HydrophobicContact CG1-CG2 4.39Å; L73-V77 HydrophobicContact CD1-CB 4.39Å; L73-V77 HydrophobicContact CD1-CG2 3.82Å; V77-L80 HydrophobicContact CG1-CD2 4.38Å; V77-C103 HydrophobicContact CB-CB 4.39Å; V77-C103 HydrophobicContact CG1-CB 3.65Å; V77-C103 HydrophobicContact CG2-CB 3.79Å
78	R	91	Very high	85.7	Confident	151 Å²	151	71.3 Å²	71.3	57%	0.57	33%	0.333	S	S	*	.			trans	-109.2	-17.7	-179.8	-62.7	-57.8	-174	164.7	3.1	113	L64 F75 G76 A104	L64-R78 WeakPolarHBondContact CD1-O 3.31Å; F75-R78 PolarHBondContact O-NE 3.12Å; G76-R78 PolarHBondContact O-N 3.01Å; R78-A104 PolarHBondContact N-O 3.1Å
79	R	91	Very high	85.8	Confident	66 Å²	66	70.3 Å²	70.3	25%	0.249	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	152.3	-178.1	-60.4	178.9	-164.5	-99.1	-6.8	110.1	F81 E88 A104 R107	R79-F81 HydrophobicContact CB-CD2 4.2Å; R79-F81 HydrophobicContact CB-CE2 3.53Å; R79-F81 HydrophobicContact CB-CZ 4.28Å; R79-F81 HydrophobicContact CG-CE2 4.41Å; R79-E88 VanDerWaalsContact CD-OE1 3.27Å; R79-E88 WeakPolarHBondContact CD-OE1 3.4Å; R79-E88 IonicContact CZ-OE1 2.68Å; R79-E88 IonicContact NE-OE1 2.92Å; R79-E88 IonicContact NH1-OE1 3.15Å; R79-E88 PolarHBondContact NH1-OE1 3.43Å; R79-A104 PolarHBondContact N-O 3.2Å; R79-A104 PolarHBondContact O-N 3.43Å; R79-R107 VanDerWaalsContact CZ-CG 3.47Å
80	L	93.8	Very high	85.8	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.4	174.5	-74.8	169.8	0	0	0	109.1	F37 I60 L63 L64 L67 V77 E88 I89 I102 C103	F37-L80 HydrophobicContact CD1-CD2 3.44Å; F37-L80 VanDerWaalsContact CD1-CD2 3.44Å; F37-L80 HydrophobicContact CE1-CD1 3.71Å; F37-L80 HydrophobicContact CE1-CD2 3.49Å; F37-L80 VanDerWaalsContact CE1-CD2 3.49Å; F37-L80 HydrophobicContact CE1-CG 4.22Å; F37-L80 HydrophobicContact CZ-CD1 4.46Å; I60-L80 HydrophobicContact CD1-CD1 4.11Å; L63-L80 HydrophobicContact CD2-CD1 4.08Å; L64-L80 HydrophobicContact CD2-CD1 3.97Å; L64-L80 HydrophobicContact CD2-CG 3.73Å; L67-L80 HydrophobicContact CD1-CD1 4.05Å; L67-L80 HydrophobicContact CD1-CD2 3.92Å; L67-L80 HydrophobicContact CD1-CG 4.43Å; V77-L80 HydrophobicContact CG1-CD2 4.38Å; L80-E88 CarbonylContact O-C 3.49Å; L80-E88 WeakPolarHBondContact O-CA 3.39Å; L80-I89 HydrophobicContact CB-CB 3.89Å; L80-I89 HydrophobicContact CB-CG1 4.38Å; L80-I89 PolarHBondContact O-N 2.87Å; L80-I102 CarbonylContact C-O 3.58Å; L80-I102 WeakPolarHBondContact CA-O 3.08Å; L80-C103 HydrophobicContact CD2-CB 4.49Å; L80-C103 VanDerWaalsContact CD2-SG 3.58Å
81	F	92.7	Very high	85.7	Confident	14 Å²	14	70.1 Å²	70.1	6%	0.061	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.4	178.7	-69.3	-96.1	0	0	0	111.6	R79 D87 E88 Y101 I102 A104 V109	R79-F81 HydrophobicContact CB-CD2 4.2Å; R79-F81 HydrophobicContact CB-CE2 3.53Å; R79-F81 HydrophobicContact CB-CZ 4.28Å; R79-F81 HydrophobicContact CG-CE2 4.41Å; F81-D87 CarbonylContact C-O 3.57Å; F81-D87 VanDerWaalsContact CA-O 3.22Å; F81-D87 WeakPolarHBondContact CA-O 3.47Å; F81-E88 HydrophobicContact CD1-CB 4.05Å; F81-E88 HydrophobicContact CE1-CB 3.72Å; F81-E88 HydrophobicContact CE1-CG 4.24Å; F81-E88 HydrophobicContact CZ-CB 4.24Å; F81-E88 HydrophobicContact CZ-CG 4.26Å; F81-Y101 CarbonylContact O-C 3.29Å; F81-Y101 VanDerWaalsContact O-CA 3.29Å; F81-Y101 WeakPolarHBondContact O-CA 3.35Å; F81-I102 PolarHBondContact N-O 3.34Å; F81-I102 PolarHBondContact O-N 2.87Å; F81-A104 HydrophobicContact CD2-CB 4.2Å; F81-A104 HydrophobicContact CE2-CB 4.16Å; F81-V109 HydrophobicContact CB-CG1 4.38Å; F81-V109 HydrophobicContact CD1-CG2 4.42Å; F81-V109 HydrophobicContact CD2-CB 4.29Å; F81-V109 HydrophobicContact CD2-CG2 3.34Å; F81-V109 HydrophobicContact CE1-CG2 4.48Å; F81-V109 HydrophobicContact CE2-CG2 3.38Å; F81-V109 HydrophobicContact CG-CB 4.38Å; F81-V109 HydrophobicContact CG-CG2 3.88Å; F81-V109 HydrophobicContact CZ-CG2 3.99Å
82	T	90.5	Very high	85.7	Confident	26 Å²	26	70.6 Å²	70.6	16%	0.16	33%	0.325	C	S	.	.			trans	-61.6	159.9	167.3	59.4	0	0	0	0	110.7	K84 G85 D87 I89 Y101	T82-K84 PolarHBondContact O-N 3.41Å; T82-G85 PolarHBondContact O-N 3.01Å; T82-D87 HydrophobicContact CG2-CB 3.81Å; T82-D87 PolarHBondContact N-O 2.89Å; T82-D87 PolarHBondContact OG1-N 3.38Å; T82-D87 PolarHBondContact OG1-OD2 3.21Å; T82-D87 VanDerWaalsContact OG1-OD2 3.13Å; T82-I89 HydrophobicContact CG2-CD1 4.18Å; T82-Y101 HydrophobicContact CG2-CE1 4.47Å
83	P	85	Confident	85.7	Confident	38 Å²	38	72.8 Å²	72.8	25%	0.247	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.1	-179	-29.6	39.3	0	0	0	114.3	G85 N100 I102 L112 I114	P83-G85 PolarHBondContact O-N 3.21Å; P83-N100 WeakPolarHBondContact CD-O 3.48Å; P83-N100 HydrophobicContact CG-CB 3.97Å; P83-N100 WeakPolarHBondContact CG-O 3.22Å; P83-I102 WeakPolarHBondContact O-CD1 3.37Å; P83-L112 PolarHBondContact O-N 2.82Å; P83-I114 HydrophobicContact CB-CD1 3.94Å; P83-I114 HydrophobicContact CG-CD1 4.12Å
84	K	78.5	Confident	85.7	Confident	155 Å²	155	75.9 Å²	75.9	67%	0.674	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-8.2	176.8	-64.5	-177.8	-179.6	174.9	0	113.1	T82 R86 A111	T82-K84 PolarHBondContact O-N 3.41Å; K84-R86 HydrophobicContact CB-CG 4.44Å; K84-R86 PolarHBondContact O-N 3.32Å; K84-A111 WeakPolarHBondContact O-CB 3.48Å
85	G	79.2	Confident	86.7	Confident	18 Å²	18	69.2 Å²	69.2	19%	0.186	31%	0.313	C	S	.	.	S	Bend	trans	67.5	12.4	-177.9	0	0	0	0	0	114.5	T82 P83	T82-G85 PolarHBondContact O-N 3.01Å; P83-G85 PolarHBondContact O-N 3.21Å
86	R	75.7	Confident	87	Confident	210 Å²	210	68.6 Å²	68.6	79%	0.792	31%	0.312	S	S	*	.			trans	-98.2	-41.9	-174.1	-67.1	-173.5	-177.8	-168	-1.5	113.2	K84	K84-R86 HydrophobicContact CB-CG 4.44Å; K84-R86 PolarHBondContact O-N 3.32Å
87	D	83.8	Confident	87.2	Confident	95 Å²	95	74.6 Å²	74.6	51%	0.508	33%	0.33	S	S	.	.			trans	-105.8	121.2	-172.1	-42.2	-63	0	0	0	109.9	F81 T82	F81-D87 CarbonylContact C-O 3.57Å; F81-D87 VanDerWaalsContact CA-O 3.22Å; F81-D87 WeakPolarHBondContact CA-O 3.47Å; T82-D87 HydrophobicContact CG2-CB 3.81Å; T82-D87 PolarHBondContact N-O 2.89Å; T82-D87 PolarHBondContact OG1-N 3.38Å; T82-D87 PolarHBondContact OG1-OD2 3.21Å; T82-D87 VanDerWaalsContact OG1-OD2 3.13Å
88	E	90.5	Very high	86.9	Confident	48 Å²	48	80.3 Å²	80.3	22%	0.224	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	128.4	175.1	-176.8	-179.4	-143.8	0	0	109.7	R79 L80 F81 R90	R79-E88 VanDerWaalsContact CD-OE1 3.27Å; R79-E88 WeakPolarHBondContact CD-OE1 3.4Å; R79-E88 IonicContact CZ-OE1 2.68Å; R79-E88 IonicContact NE-OE1 2.92Å; R79-E88 IonicContact NH1-OE1 3.15Å; R79-E88 PolarHBondContact NH1-OE1 3.43Å; L80-E88 CarbonylContact O-C 3.49Å; L80-E88 WeakPolarHBondContact O-CA 3.39Å; F81-E88 HydrophobicContact CD1-CB 4.05Å; F81-E88 HydrophobicContact CE1-CB 3.72Å; F81-E88 HydrophobicContact CE1-CG 4.24Å; F81-E88 HydrophobicContact CZ-CB 4.24Å; F81-E88 HydrophobicContact CZ-CG 4.26Å; E88-R90 HydrophobicContact CG-CG 4.23Å; E88-R90 IonicContact OE2-CZ 3.24Å; E88-R90 IonicContact OE2-NE 3.24Å; E88-R90 PolarHBondContact OE2-NE 3.26Å; E88-R90 IonicContact OE2-NH2 2.69Å; E88-R90 PolarHBondContact OE2-NH2 3.4Å
89	I	92	Very high	86.8	Confident	14 Å²	14	73.6 Å²	73.6	7%	0.072	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	115.8	174.6	-56.5	-59.1	0	0	0	109.1	I60 L80 T82 D91 Q94 L95 Y101	I60-I89 HydrophobicContact CD1-CG2 4.27Å; L80-I89 HydrophobicContact CB-CB 3.89Å; L80-I89 HydrophobicContact CB-CG1 4.38Å; L80-I89 PolarHBondContact O-N 2.87Å; T82-I89 HydrophobicContact CG2-CD1 4.18Å; I89-D91 WeakPolarHBondContact CG2-O 3.41Å; I89-Q94 HydrophobicContact CD1-CB 4.02Å; I89-Q94 HydrophobicContact CG2-CB 4.08Å; I89-L95 HydrophobicContact CG1-CD2 4.37Å; I89-L95 HydrophobicContact CG2-CD2 3.82Å; I89-L95 HydrophobicContact CG2-CG 4.06Å; I89-Y101 HydrophobicContact CD1-CD1 4Å; I89-Y101 HydrophobicContact CD1-CE1 3.61Å; I89-Y101 HydrophobicContact CG1-CD1 3.59Å; I89-Y101 HydrophobicContact CG1-CE1 3.73Å
90	R	87.4	Confident	86.9	Confident	175 Å²	175	72.4 Å²	72.4	66%	0.66	33%	0.329	S	S	*	.			trans	-109.7	-17.4	-177.4	-63.5	-175.4	178.6	177.6	2.5	113.6	I60 E88	I60-R90 WeakPolarHBondContact CG2-O 3.24Å; E88-R90 HydrophobicContact CG-CG 4.23Å; E88-R90 IonicContact OE2-CZ 3.24Å; E88-R90 IonicContact OE2-NE 3.24Å; E88-R90 PolarHBondContact OE2-NE 3.26Å; E88-R90 IonicContact OE2-NH2 2.69Å; E88-R90 PolarHBondContact OE2-NH2 3.4Å
91	D	85.2	Confident	86.9	Confident	73 Å²	73	72.9 Å²	72.9	39%	0.39	33%	0.331	S	S	.	.	S	Bend	trans	-130.3	143.3	-179.4	-163.8	-59.8	0	0	0	109.6	I89 E93 Q94	I89-D91 WeakPolarHBondContact CG2-O 3.41Å; D91-E93 PolarHBondContact O-N 2.88Å; D91-E93 WeakPolarHBondContact OD1-CB 3.26Å; D91-E93 PolarHBondContact OD1-N 2.89Å; D91-Q94 HydrophobicContact CB-CG 4.28Å; D91-Q94 WeakPolarHBondContact O-CB 3.28Å; D91-Q94 PolarHBondContact O-N 2.87Å
92	I	87.2	Confident	86.9	Confident	11 Å²	11	72.2 Å²	72.2	6%	0.056	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-58.7	-31	176.3	-69	170.7	0	0	0	111.1	V52 Y57 T59 I60 Q94 L95	V52-I92 HydrophobicContact CG1-CG2 3.52Å; Y57-I92 WeakPolarHBondContact O-CD1 3.47Å; T59-I92 WeakPolarHBondContact O-CD1 3.04Å; I60-I92 HydrophobicContact CB-CG1 4.45Å; I60-I92 HydrophobicContact CD1-CG1 3.96Å; I92-Q94 PolarHBondContact O-N 3.33Å; I92-L95 VanDerWaalsContact O-CB 3.31Å; I92-L95 WeakPolarHBondContact O-CB 3.41Å; I92-L95 PolarHBondContact O-N 2.99Å; I92-L95 VanDerWaalsContact O-N 3.08Å
93	E	82.8	Confident	87	Confident	101 Å²	101	71 Å²	71	47%	0.472	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-69.1	-19.9	-179.2	-70.2	-175.3	-175.5	0	0	114.1	R33 R54 D91 L95	R33-E93 PolarHBondContact NH1-O 3.2Å; R54-E93 IonicContact CZ-OE1 3.57Å; R54-E93 IonicContact NE-OE1 3.54Å; R54-E93 PolarHBondContact NE-OE1 2.94Å; R54-E93 IonicContact NH2-OE1 2.73Å; R54-E93 PolarHBondContact NH2-OE1 3.28Å; D91-E93 PolarHBondContact O-N 2.88Å; D91-E93 WeakPolarHBondContact OD1-CB 3.26Å; D91-E93 PolarHBondContact OD1-N 2.89Å; E93-L95 PolarHBondContact O-N 2.85Å
94	Q	86.4	Confident	87.3	Confident	92 Å²	92	69.2 Å²	69.2	43%	0.43	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-75.3	-10.9	173.3	-62.5	173	-6.2	0	0	112.4	I89 D91 I92 E96 Y101	I89-Q94 HydrophobicContact CD1-CB 4.02Å; I89-Q94 HydrophobicContact CG2-CB 4.08Å; D91-Q94 HydrophobicContact CB-CG 4.28Å; D91-Q94 WeakPolarHBondContact O-CB 3.28Å; D91-Q94 PolarHBondContact O-N 2.87Å; I92-Q94 PolarHBondContact O-N 3.33Å; Q94-E96 PolarHBondContact O-N 2.9Å; Q94-Y101 PolarHBondContact O-OH 3.24Å; Q94-Y101 VanDerWaalsContact O-OH 3.05Å
95	L	90.9	Very high	87.6	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	28%	0.281	C	S	.	.			trans	-81.3	115.4	176	-61.1	171.3	0	0	0	110.3	R33 V35 F37 V52 L63 I89 I92 E93 Y101	R33-L95 WeakPolarHBondContact CD-O 3.43Å; R33-L95 PolarHBondContact NH1-O 3.14Å; V35-L95 HydrophobicContact CG1-CD2 4.3Å; V35-L95 HydrophobicContact CG2-CB 4.12Å; F37-L95 HydrophobicContact CE1-CD2 4.4Å; F37-L95 HydrophobicContact CZ-CD1 4.23Å; F37-L95 HydrophobicContact CZ-CD2 4.42Å; V52-L95 HydrophobicContact CG1-CD1 4Å; V52-L95 HydrophobicContact CG2-CD1 4.48Å; L63-L95 HydrophobicContact CD2-CD1 3.45Å; L63-L95 VanDerWaalsContact CD2-CD1 3.45Å; I89-L95 HydrophobicContact CG1-CD2 4.37Å; I89-L95 HydrophobicContact CG2-CD2 3.82Å; I89-L95 HydrophobicContact CG2-CG 4.06Å; I92-L95 VanDerWaalsContact O-CB 3.31Å; I92-L95 WeakPolarHBondContact O-CB 3.41Å; I92-L95 PolarHBondContact O-N 2.99Å; I92-L95 VanDerWaalsContact O-N 3.08Å; E93-L95 PolarHBondContact O-N 2.85Å; L95-Y101 WeakPolarHBondContact CA-OH 3.11Å; L95-Y101 HydrophobicContact CB-CE2 4.31Å; L95-Y101 HydrophobicContact CD2-CD1 3.91Å; L95-Y101 HydrophobicContact CD2-CD2 3.53Å; L95-Y101 HydrophobicContact CD2-CE1 3.85Å; L95-Y101 HydrophobicContact CD2-CE2 3.45Å; L95-Y101 VanDerWaalsContact CD2-CE2 3.45Å; L95-Y101 HydrophobicContact CD2-CG 3.75Å; L95-Y101 HydrophobicContact CG-CE2 4.5Å
96	E	86.8	Confident	87.6	Confident	138 Å²	138	65.4 Å²	65.4	65%	0.645	29%	0.292	S	S	*	.			trans	-86	153	-178.6	-64.9	-179.8	174	0	0	111.8	Q94 Y98 G99 Y101	Q94-E96 PolarHBondContact O-N 2.9Å; E96-Y98 PolarHBondContact O-N 3.24Å; E96-G99 PolarHBondContact O-N 3.39Å; E96-Y101 PolarHBondContact N-OH 3.01Å
97	R	88	Confident	87.6	Confident	140 Å²	140	64.6 Å²	64.6	53%	0.528	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	126.5	175.2	-170.7	-178	176.1	168.4	-1.2	109.4	R33 G99	R33-R97 HydrophobicContact CB-CB 4.31Å; R33-R97 HydrophobicContact CG-CB 4.45Å; R97-G99 PolarHBondContact O-N 3.08Å
98	Y	85.9	Confident	87	Confident	120 Å²	120	68.8 Å²	68.8	47%	0.471	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	16.4	-170.7	-49.5	-68.8	0	0	0	114.4	M34 Y36 E96	M34-Y98 HydrophobicContact CB-CD1 4.15Å; M34-Y98 HydrophobicContact CB-CE1 4.01Å; M34-Y98 HydrophobicContact CG-CE1 4.49Å; M34-Y98 WeakPolarHBondContact O-CA 3.39Å; M34-Y98 PolarHBondContact O-N 2.94Å; Y36-Y98 HydrophobicContact CE2-CD1 4.05Å; E96-Y98 PolarHBondContact O-N 3.24Å
99	G	89.1	Confident	86.6	Confident	10 Å²	10	67.8 Å²	67.8	10%	0.103	30%	0.3	C	S	.	.			trans	-65.3	149.2	174.1	0	0	0	0	0	112.4	Y36 E96 R97	Y36-G99 PolarHBondContact N-O 3.28Å; E96-G99 PolarHBondContact O-N 3.39Å; R97-G99 PolarHBondContact O-N 3.08Å
100	N	92.7	Very high	85.7	Confident	41 Å²	41	73.2 Å²	73.2	22%	0.219	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132.7	175.7	-70.3	-90.9	0	0	0	109.1	Y36 H38 P83 I114	Y36-N100 CarbonylContact O-C 3.6Å; Y36-N100 WeakPolarHBondContact O-CA 3.39Å; H38-N100 PolarHBondContact NE2-OD1 2.81Å; P83-N100 WeakPolarHBondContact CD-O 3.48Å; P83-N100 HydrophobicContact CG-CB 3.97Å; P83-N100 WeakPolarHBondContact CG-O 3.22Å; N100-I114 HydrophobicContact CB-CD1 3.8Å
101	Y	94.8	Very high	85.2	Confident	11 Å²	11	68.1 Å²	68.1	4%	0.043	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.9	-178.6	-60.2	-84.7	0	0	0	110.8	V35 Y36 F37 H38 F81 T82 I89 Q94 L95 E96	V35-Y101 HydrophobicContact CG1-CD2 3.34Å; V35-Y101 HydrophobicContact CG1-CE2 3.57Å; Y36-Y101 PolarHBondContact O-N 3.32Å; F37-Y101 CarbonylContact C-O 3.52Å; F37-Y101 WeakPolarHBondContact CA-O 3.48Å; H38-Y101 PolarHBondContact N-O 3.08Å; F81-Y101 CarbonylContact O-C 3.29Å; F81-Y101 VanDerWaalsContact O-CA 3.29Å; F81-Y101 WeakPolarHBondContact O-CA 3.35Å; T82-Y101 HydrophobicContact CG2-CE1 4.47Å; I89-Y101 HydrophobicContact CD1-CD1 4Å; I89-Y101 HydrophobicContact CD1-CE1 3.61Å; I89-Y101 HydrophobicContact CG1-CD1 3.59Å; I89-Y101 HydrophobicContact CG1-CE1 3.73Å; Q94-Y101 PolarHBondContact O-OH 3.24Å; Q94-Y101 VanDerWaalsContact O-OH 3.05Å; L95-Y101 WeakPolarHBondContact CA-OH 3.11Å; L95-Y101 HydrophobicContact CB-CE2 4.31Å; L95-Y101 HydrophobicContact CD2-CD1 3.91Å; L95-Y101 HydrophobicContact CD2-CD2 3.53Å; L95-Y101 HydrophobicContact CD2-CE1 3.85Å; L95-Y101 HydrophobicContact CD2-CE2 3.45Å; L95-Y101 VanDerWaalsContact CD2-CE2 3.45Å; L95-Y101 HydrophobicContact CD2-CG 3.75Å; L95-Y101 HydrophobicContact CG-CE2 4.5Å; E96-Y101 PolarHBondContact N-OH 3.01Å
102	I	92.6	Very high	84.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.2	-179.4	-52.4	179.4	0	0	0	109.1	D40 L80 F81 P83 V109 Q110 L112	D40-I102 HydrophobicContact CB-CG2 3.78Å; L80-I102 CarbonylContact C-O 3.58Å; L80-I102 WeakPolarHBondContact CA-O 3.08Å; F81-I102 PolarHBondContact N-O 3.34Å; F81-I102 PolarHBondContact O-N 2.87Å; P83-I102 WeakPolarHBondContact O-CD1 3.37Å; I102-V109 HydrophobicContact CB-CG1 4.07Å; I102-V109 HydrophobicContact CD1-CG1 4.04Å; I102-V109 HydrophobicContact CG2-CG1 3.65Å; I102-Q110 WeakPolarHBondContact CD1-O 3.32Å; I102-L112 HydrophobicContact CD1-CB 4.01Å; I102-L112 HydrophobicContact CD1-CD1 3.95Å; I102-L112 HydrophobicContact CD1-CG 3.94Å; I102-L112 HydrophobicContact CG1-CD1 4.11Å; I102-L112 HydrophobicContact CG2-CD1 4.43Å
103	C	93.6	Very high	83.8	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123.2	172.4	-70.1	0	0	0	0	110.3	H38 D40 V71 L73 V77 L80	H38-C103 WeakPolarHBondContact O-CB 3.12Å; H38-C103 PolarHBondContact O-N 3.2Å; D40-C103 WeakPolarHBondContact CB-O 3.39Å; D40-C103 PolarHBondContact N-O 3.36Å; V71-C103 HydrophobicContact CB-CB 4.4Å; V71-C103 HydrophobicContact CG1-CB 3.93Å; L73-C103 HydrophobicContact CD1-CB 4.1Å; L73-C103 WeakPolarHBondContact CD1-O 3.29Å; V77-C103 HydrophobicContact CB-CB 4.39Å; V77-C103 HydrophobicContact CG1-CB 3.65Å; V77-C103 HydrophobicContact CG2-CB 3.79Å; L80-C103 HydrophobicContact CD2-CB 4.49Å; L80-C103 VanDerWaalsContact CD2-SG 3.58Å
104	A	90.1	Very high	83.2	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150.6	178.9	0	0	0	0	0	112.3	D40 R78 R79 F81 V109	D40-A104 HydrophobicContact CB-CB 4.06Å; R78-A104 PolarHBondContact N-O 3.1Å; R79-A104 PolarHBondContact N-O 3.2Å; R79-A104 PolarHBondContact O-N 3.43Å; F81-A104 HydrophobicContact CD2-CB 4.2Å; F81-A104 HydrophobicContact CE2-CB 4.16Å; A104-V109 HydrophobicContact CB-CG2 3.38Å
105	S	85.9	Confident	81.5	Confident	14 Å²	14	75.8 Å²	75.8	10%	0.098	36%	0.357	C	S	.	.	S	Bend	trans	-86.5	-24.7	172.3	-68.9	0	0	0	0	113	L73 H74 F75 G76	L73-S105 WeakPolarHBondContact CB-OG 3.43Å; H74-S105 VanDerWaalsContact CE1-CB 3.4Å; H74-S105 WeakPolarHBondContact CE1-CB 3.36Å; H74-S105 PolarHBondContact CE1-OG 3.26Å; H74-S105 PolarHBondContact ND1-OG 3.4Å; F75-S105 PolarHBondContact N-OG 2.82Å; G76-S105 PolarHBondContact O-OG 3.26Å
106	N	78.3	Confident	79.3	Confident	79 Å²	79	81 Å²	81	42%	0.422	39%	0.394	S	S	.	.	S	Bend	trans	-132.8	-179	-175.6	69.3	24.6	0	0	0	111.3	K108	N106-K108 VanDerWaalsContact C-N 3.34Å; N106-K108 PolarHBondContact OD1-N 3Å; N106-K108 VanDerWaalsContact OD1-N 3.1Å; N106-K108 PolarHBondContact OD1-O 2.86Å; N106-K108 VanDerWaalsContact OD1-O 3.07Å
107	R	75.1	Confident	76.7	Confident	193 Å²	193	82.8 Å²	82.8	73%	0.728	40%	0.402	S	S	*	.	S	Bend	trans	-77	-12.5	-177.2	-74.2	-174	179.2	171.2	2.5	114.7	R79	R79-R107 VanDerWaalsContact CZ-CG 3.47Å
108	K	71.4	Confident	74.3	Confident	183 Å²	183	82.8 Å²	82.8	80%	0.796	41%	0.412	S	S	*	.			trans	-99.2	106.1	-176.5	-74.2	-173.4	178.9	-178.3	0	108.7	N106	N106-K108 VanDerWaalsContact C-N 3.34Å; N106-K108 PolarHBondContact OD1-N 3Å; N106-K108 VanDerWaalsContact OD1-N 3.1Å; N106-K108 PolarHBondContact OD1-O 2.86Å; N106-K108 VanDerWaalsContact OD1-O 3.07Å
109	V	81.8	Confident	71.8	Confident	27 Å²	27	85.2 Å²	85.2	16%	0.164	43%	0.427	C	S	.	.			trans	-115.5	137.6	-176.5	179.5	0	0	0	0	110.6	D40 F81 I102 A104	D40-V109 WeakPolarHBondContact OD1-CG1 3.36Å; F81-V109 HydrophobicContact CB-CG1 4.38Å; F81-V109 HydrophobicContact CD1-CG2 4.42Å; F81-V109 HydrophobicContact CD2-CB 4.29Å; F81-V109 HydrophobicContact CD2-CG2 3.34Å; F81-V109 HydrophobicContact CE1-CG2 4.48Å; F81-V109 HydrophobicContact CE2-CG2 3.38Å; F81-V109 HydrophobicContact CG-CB 4.38Å; F81-V109 HydrophobicContact CG-CG2 3.88Å; F81-V109 HydrophobicContact CZ-CG2 3.99Å; I102-V109 HydrophobicContact CB-CG1 4.07Å; I102-V109 HydrophobicContact CD1-CG1 4.04Å; I102-V109 HydrophobicContact CG2-CG1 3.65Å; A104-V109 HydrophobicContact CB-CG2 3.38Å
110	Q	74.8	Confident	68.7	Low	129 Å²	129	93.4 Å²	93.4	60%	0.603	46%	0.463	S	S	*	.			trans	-82	127	172.9	-68.9	-173.9	-1.7	0	0	110.3	D40 I102 L112	D40-Q110 PolarHBondContact OD1-N 2.89Å; I102-Q110 WeakPolarHBondContact CD1-O 3.32Å; Q110-L112 PolarHBondContact O-N 2.87Å
111	A	76.7	Confident	65.5	Low	68 Å²	68	96.4 Å²	96.4	56%	0.562	49%	0.485	S	S	*	.			trans	-63.2	128	174.2	0	0	0	0	0	110.6	K84	K84-A111 WeakPolarHBondContact O-CB 3.48Å
112	L	76.5	Confident	62.2	Low	26 Å²	26	102 Å²	102	14%	0.136	52%	0.522	C	S	.	.			trans	-104.6	122.7	178	-68.6	171.3	0	0	0	109.6	H38 K43 P83 I102 Q110 I114	H38-L112 HydrophobicContact CB-CD1 4.04Å; K43-L112 HydrophobicContact CB-CD2 4.11Å; P83-L112 PolarHBondContact O-N 2.82Å; I102-L112 HydrophobicContact CD1-CB 4.01Å; I102-L112 HydrophobicContact CD1-CD1 3.95Å; I102-L112 HydrophobicContact CD1-CG 3.94Å; I102-L112 HydrophobicContact CG1-CD1 4.11Å; I102-L112 HydrophobicContact CG2-CD1 4.43Å; Q110-L112 PolarHBondContact O-N 2.87Å; L112-I114 VanDerWaalsContact C-N 3.34Å; L112-I114 HydrophobicContact CB-CD1 4.42Å; L112-I114 HydrophobicContact CB-CG1 4.03Å; L112-I114 PolarHBondContact O-N 2.72Å
113	K	66.4	Low	59.1	Low	215 Å²	215	111 Å²	111	94%	0.935	56%	0.564	S	S	*	*			trans	-75	88.7	168.9	-73.6	-173	179.5	-179.3	0	109
114	I	70.1	Confident	55.7	Low	48 Å²	48	122.3 Å²	122.3	25%	0.246	61%	0.607	C	S	.	*			trans	-87.3	114.9	176.8	-56	169.1	0	0	0	107.8	P83 N100 L112 S116	P83-I114 HydrophobicContact CB-CD1 3.94Å; P83-I114 HydrophobicContact CG-CD1 4.12Å; N100-I114 HydrophobicContact CB-CD1 3.8Å; L112-I114 VanDerWaalsContact C-N 3.34Å; L112-I114 HydrophobicContact CB-CD1 4.42Å; L112-I114 HydrophobicContact CB-CG1 4.03Å; L112-I114 PolarHBondContact O-N 2.72Å; I114-S116 PolarHBondContact O-N 3.37Å; I114-S116 VanDerWaalsContact O-N 3.07Å
115	N	50.5	Low	52.4	Low	148 Å²	148	130.3 Å²	130.3	79%	0.791	64%	0.644	S	S	*	*			trans	-66.5	107.7	172.8	-76.7	-12.9	0	0	0	108.9	Q117	N115-Q117 PolarHBondContact O-N 2.9Å
116	S	44.9	Very low	49.4	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	68%	0.682	S	S	*	*			trans	-72.7	76.2	171.5	57.2	0	0	0	0	110	I114	I114-S116 PolarHBondContact O-N 3.37Å; I114-S116 VanDerWaalsContact O-N 3.07Å
117	Q	32.6	Very low	46.6	Very low	175 Å²	175	143.5 Å²	143.5	82%	0.818	70%	0.7	S	S	*	*			trans	-130.7	75.1	168.2	-74.4	-162.5	-6.2	0	0	109.7	N115	N115-Q117 PolarHBondContact O-N 2.9Å
118	L	37.3	Very low	44.2	Very low	140 Å²	140	141 Å²	141	73%	0.733	71%	0.706	S	S	*	*			trans	-143.6	103	166.1	-80.5	175.9	0	0	0	111.4
119	H	31.8	Very low	41.8	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.787	70%	0.701	S	S	*	*			trans	49.6	86.8	140.8	-77.1	-79.1	0	0	0	119.2
120	E	24.4	Very low	38.9	Very low	182 Å²	182	147 Å²	147	85%	0.85	73%	0.732	S	S	*	*			trans	-74.9	142.2	135.9	-78.7	-171.2	149.6	0	0	109.4
121	P	26.2	Very low	36.3	Very low	105 Å²	105	148.3 Å²	148.3	68%	0.682	74%	0.742	S	S	*	*			trans	-64.3	151.7	175.7	-13.1	27.2	0	0	0	111.4	H123	P121-H123 PolarHBondContact O-N 2.88Å; P121-H123 VanDerWaalsContact O-N 3.08Å
122	P	25.2	Very low	33.6	Very low	129 Å²	129	153.9 Å²	153.9	84%	0.838	75%	0.754	S	S	*	*			trans	-74.4	106.2	-164.5	30.3	-33.2	0	0	0	111.3
123	H	27.8	Very low	31	Very low	189 Å²	189	159.5 Å²	159.5	88%	0.875	79%	0.79	S	S	*	*			trans	-84.1	129.4	158.1	-84	-73	0	0	0	110.1	P121	P121-H123 PolarHBondContact O-N 2.88Å; P121-H123 VanDerWaalsContact O-N 3.08Å
124	R	22.6	Very low	28.7	Very low	237 Å²	237	155.8 Å²	155.8	89%	0.894	79%	0.785	S	S	*	*			trans	-45.5	136.3	-175.8	-78.6	175.1	165.2	179.1	-5	113.8
125	H	21.2	Very low	26.4	Very low	168 Å²	168	156.5 Å²	156.5	78%	0.778	80%	0.804	S	S	*	*			trans	11.3	118.5	148.2	-69.9	-75.4	0	0	0	116.8
126	N	22.3	Very low	25	Very low	168 Å²	168	155.9 Å²	155.9	90%	0.898	81%	0.806	S	S	*	*				-147	138.2	125.8	-94.7	-32.2	0	0	0	111.7
127	Y	19.6	Very low	23.8	Very low	202 Å²	202	155.4 Å²	155.4	79%	0.792	80%	0.803	S	S	*	*			trans	-84.2	114.7	-171.8	-143.9	-100.7	0	0	0	108.4	Q129	Y127-Q129 HydrophobicContact CE1-CG 4.32Å
128	T	25.1	Very low	23.2	Very low	140 Å²	140	153.3 Å²	153.3	86%	0.859	80%	0.797	S	S	*	*			trans	-139.3	109.5	159.7	41.2	0	0	0	0	109.5
129	Q	19.6	Very low	22.4	Very low	149 Å²	149	154.1 Å²	154.1	70%	0.696	80%	0.797	S	S	*	*			trans	-64.8	164.7	169.4	-67.1	174.8	-38.6	0	0	111.7	Y127	Y127-Q129 HydrophobicContact CE1-CG 4.32Å
130	K	20.8	Very low	22	Very low	187 Å²	187	154 Å²	154	81%	0.813	80%	0.802	S	S	*	*			trans	88.6	135.7	164.7	-56.1	-179.4	178.3	177.2	0	113.7
131	L	21.5	Very low	21.8	Very low	157 Å²	157	157.2 Å²	157.2	82%	0.822	81%	0.807	S	S	*	*			cis	-144.3	152.7	12.3	-101.6	120.6	0	0	0	110.9
132	K	19.3	Very low	21.8	Very low	184 Å²	184	157.2 Å²	157.2	80%	0.8	81%	0.809	S	S	*	*			trans	-53.5	135.8	161.1	-68.7	162.3	170.6	-178.6	0	111.3
133	T	22.1	Very low	21.6	Very low	145 Å²	145	156 Å²	156	89%	0.89	80%	0.804	S	S	*	*			trans	-132.2	123.3	140.1	51.4	0	0	0	0	109.1
134	T	18.5	Very low	21.3	Very low	136 Å²	136	158.7 Å²	158.7	83%	0.834	81%	0.807	S	S	*	*			trans	-96.9	147.8	179.4	43.1	0	0	0	0	109.9
135	G	21.4	Very low	21.2	Very low	64 Å²	64	156.8 Å²	156.8	66%	0.66	81%	0.808	S	S	*	*			trans	147.9	93.3	161.9	0	0	0	0	0	111.8
136	T	21	Very low	21.3	Very low	134 Å²	134	153 Å²	153	82%	0.822	81%	0.805	S	S	*	*				72.1	103.6	91.2	50.5	0	0	0	0	115.2
137	S	18.6	Very low	21.3	Very low	102 Å²	102	151 Å²	151	71%	0.713	80%	0.804	S	S	*	*				43.1	134.1	125.4	62.9	0	0	0	0	122.2
138	N	20.1	Very low	21.4	Very low	132 Å²	132	147.2 Å²	147.2	71%	0.706	81%	0.808	S	S	*	*			trans	81.8	125.1	145.3	-93.3	27.9	0	0	0	120.5
139	E	21	Very low	21.3	Very low	157 Å²	157	145.8 Å²	145.8	73%	0.734	80%	0.804	S	S	*	*			trans	56.6	109.2	136.5	-65	174.9	144	0	0	117.3
140	D	24.3	Very low	21.5	Very low	167 Å²	167	144.8 Å²	144.8	89%	0.893	81%	0.808	S	S	*	*				-153.8	124.6	119.6	-101.3	-30.9	0	0	0	112.3	S142	D140-S142 PolarHBondContact O-N 2.8Å
141	R	19.6	Very low	21.6	Very low	249 Å²	249	144 Å²	144	94%	0.94	81%	0.811	S	S	*	*			trans	-72.5	113.1	167.8	-79.1	170.7	159.5	162.1	-7.1	107.9
142	S	25.9	Very low	21.7	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	81%	0.81	S	S	*	*			trans	-92.2	103.6	165.9	66.3	0	0	0	0	110.4	D140 W144	D140-S142 PolarHBondContact O-N 2.8Å; S142-W144 PolarHBondContact O-N 2.79Å
143	S	21.2	Very low	22	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	81%	0.812	S	S	*	*			trans	-46.9	102.8	165.2	166.5	0	0	0	0	113.8
144	W	20.8	Very low	22.1	Very low	245 Å²	245	141.5 Å²	141.5	93%	0.928	81%	0.807	S	S	*	*			trans	-139.7	27.9	156.3	-72.2	80.5	0	0	0	112.5	S142	S142-W144 PolarHBondContact O-N 2.79Å
145	E	22	Very low	22.2	Very low	197 Å²	197	146.2 Å²	146.2	92%	0.921	81%	0.81	S	S	*	*			trans	-91.8	86.5	158.8	-80.2	-177.1	163.6	0	0	109
146	A	22.2	Very low	22.4	Very low	87 Å²	87	150.9 Å²	150.9	72%	0.719	82%	0.817	S	S	*	*			trans	-163.9	78.5	160.5	0	0	0	0	0	109.3
147	S	23.1	Very low	22.7	Very low	126 Å²	126	153.3 Å²	153.3	88%	0.881	82%	0.82	S	S	*	*	S	Bend	trans	178.2	80.5	151.4	-80.1	0	0	0	0	109.8
148	S	22.2	Very low	22.9	Very low	123 Å²	123	155.9 Å²	155.9	86%	0.86	82%	0.822	S	S	*	*			trans	176.7	64.4	138.9	-159.4	0	0	0	0	108.3
149	S	21.3	Very low	23.2	Very low	111 Å²	111	158.2 Å²	158.2	78%	0.776	83%	0.829	S	S	*	*			trans	-109.4	88.6	172	58.1	0	0	0	0	108.2
150	T	24.7	Very low	23.5	Very low	128 Å²	128	160.5 Å²	160.5	79%	0.785	84%	0.836	S	S	*	*	S	Bend	trans	-175.3	131	149.5	38	0	0	0	0	106.4
151	L	23.4	Very low	23.4	Very low	169 Å²	169	157.7 Å²	157.7	89%	0.885	83%	0.829	S	S	*	*	S	Bend	trans	109	19	177	-55	-180	0	0	0	117.7
152	V	23.5	Very low	23.7	Very low	130 Å²	130	149.2 Å²	149.2	79%	0.788	82%	0.819	S	S	*	*			trans	-143	68.6	162.4	-163.8	0	0	0	0	110.7
153	D	24.7	Very low	23.7	Very low	157 Å²	157	154.7 Å²	154.7	84%	0.84	83%	0.83	S	S	*	*			trans	-133.3	10.4	168.2	-91.4	-35.8	0	0	0	114.8
154	D	24.5	Very low	23.9	Very low	148 Å²	148	154.4 Å²	154.4	79%	0.791	83%	0.834	S	S	*	*	S	Bend	trans	-105.1	14	179.3	-85.4	-7.1	0	0	0	115.1
155	W	21.9	Very low	24.1	Very low	235 Å²	235	149.1 Å²	149.1	89%	0.89	83%	0.828	S	S	*	*	S	Bend	trans	-108.3	-4.6	-177.4	-98.1	42.7	0	0	0	116.1
156	I	25.7	Very low	24.3	Very low	161 Å²	161	148.9 Å²	148.9	83%	0.826	83%	0.827	S	S	*	*	S	Bend	trans	-101.5	-14.2	-176.5	-64.5	-179.4	0	0	0	113.6
157	E	25.4	Very low	24.6	Very low	186 Å²	186	152.6 Å²	152.6	87%	0.869	83%	0.83	S	S	*	*	S	Bend	trans	-98.3	-9.2	180	-88.6	-168.1	153	0	0	117
158	M	23.1	Very low	24.8	Very low	155 Å²	155	155.5 Å²	155.5	76%	0.764	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	1.8	-175.6	-76.2	-165.1	71.9	0	0	117.2
159	H	26.8	Very low	25.1	Very low	182 Å²	182	159.6 Å²	159.6	84%	0.843	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	34.2	179.8	-75.8	-55.8	0	0	0	115.7
160	K	26.5	Very low	25.9	Very low	205 Å²	205	158.4 Å²	158.4	89%	0.891	83%	0.827	S	S	*	*	S	Bend	trans	-97.5	18.7	164.6	-92.3	-172.9	-178.9	175	0	115.2
161	S	23.4	Very low	26.5	Very low	107 Å²	107	156.5 Å²	156.5	75%	0.748	82%	0.818	S	S	*	*	S	Bend	trans	-153.5	127	168.8	58.6	0	0	0	0	111.6
162	G	25.7	Very low	27.9	Very low	71 Å²	71	156.6 Å²	156.6	73%	0.732	81%	0.811	S	S	*	*			trans	137.2	92.7	168.5	0	0	0	0	0	112.1	A164	G162-A164 PolarHBondContact O-N 2.83Å
163	K	26.6	Very low	30.1	Very low	222 Å²	222	152.3 Å²	152.3	97%	0.965	79%	0.787	S	S	*	*			trans	-52.4	104.4	165.6	-71.1	173.7	174.8	176.1	0	108.6
164	A	25.3	Very low	32.7	Very low	97 Å²	97	145.9 Å²	145.9	80%	0.802	75%	0.751	S	S	*	*			trans	-104.4	130.7	176.3	0	0	0	0	0	110.2	G162	G162-A164 PolarHBondContact O-N 2.83Å
165	V	24.3	Very low	35.5	Very low	134 Å²	134	143.7 Å²	143.7	81%	0.812	74%	0.736	S	S	*	*			trans	-51.2	146.2	178.7	170.3	0	0	0	0	112.1	E167	V165-E167 PolarHBondContact O-N 3.46Å
166	Q	26.2	Very low	38.7	Very low	192 Å²	192	132.5 Å²	132.5	90%	0.897	69%	0.694	S	S	*	*			trans	-64.7	84	179.7	-168.5	170.2	13.3	0	0	111.3
167	E	28	Very low	41.8	Very low	166 Å²	166	127 Å²	127	78%	0.776	66%	0.664	S	S	*	*			trans	-73.9	129.9	164.5	-78.1	-174.4	158.4	0	0	110.2	V165 R169	V165-E167 PolarHBondContact O-N 3.46Å; E167-R169 VanDerWaalsContact C-N 3.25Å; E167-R169 PolarHBondContact O-N 3Å
168	L	28.5	Very low	45	Very low	186 Å²	186	118.1 Å²	118.1	97%	0.974	62%	0.623	S	S	*	*			trans	-59.1	78	175.5	-78.8	139.3	0	0	0	111.4
169	R	28.8	Very low	48.2	Very low	209 Å²	209	112 Å²	112	79%	0.789	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-86.1	124.5	162.5	-114.1	177.4	-177.1	161.8	3	108.4	E167	E167-R169 VanDerWaalsContact C-N 3.25Å; E167-R169 PolarHBondContact O-N 3Å
170	A	36.2	Very low	51.1	Low	86 Å²	86	103.5 Å²	103.5	71%	0.711	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-48.8	128.8	168.4	0	0	0	0	0	109.3	K172	A170-K172 PolarHBondContact O-N 2.85Å
171	P	38	Very low	53.8	Low	89 Å²	89	94.3 Å²	94.3	58%	0.578	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-62.5	127.1	-172.3	21.2	-30.3	0	0	0	110.3	S173	P171-S173 PolarHBondContact O-N 2.97Å
172	K	53.7	Low	56.2	Low	170 Å²	170	93.7 Å²	93.7	74%	0.739	51%	0.51	S	S	*	.	S	Bend	trans	-56.1	-16.9	177.6	-64.7	-178.4	178.2	-179	0	113.2	A170	A170-K172 PolarHBondContact O-N 2.85Å
173	S	68.1	Low	58.6	Low	41 Å²	41	94.6 Å²	94.6	29%	0.287	50%	0.496	S	S	.	.	S	Bend	trans	-161.7	142.6	170.2	60.8	0	0	0	0	109.8	P171 F192	P171-S173 PolarHBondContact O-N 2.97Å; S173-F192 CarbonylContact C-O 3.55Å; S173-F192 VanDerWaalsContact CA-O 3.29Å; S173-F192 WeakPolarHBondContact CA-O 3.26Å
174	K	80.1	Confident	60.7	Low	21 Å²	21	87 Å²	87	9%	0.091	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.4	172.5	-173.4	-179.1	-178.8	-169.4	0	110.4	V176 R191 F192 I233 L234 G236 D238	K174-V176 HydrophobicContact CD-CG2 4.04Å; K174-V176 HydrophobicContact CG-CG2 4.08Å; K174-R191 CarbonylContact O-C 3.52Å; K174-R191 WeakPolarHBondContact O-CA 3.4Å; K174-F192 PolarHBondContact N-O 2.81Å; K174-F192 PolarHBondContact O-N 2.82Å; K174-I233 PolarHBondContact NZ-O 2.69Å; K174-L234 HydrophobicContact CB-CD2 4.05Å; K174-L234 WeakPolarHBondContact CD-O 3.41Å; K174-L234 WeakPolarHBondContact CE-O 3.4Å; K174-L234 PolarHBondContact NZ-O 3.3Å; K174-G236 PolarHBondContact NZ-O 2.93Å; K174-D238 WeakPolarHBondContact CE-OD1 3.37Å
175	Q	83.5	Confident	63.1	Low	103 Å²	103	88.6 Å²	88.6	48%	0.481	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.3	168.2	-74.9	-175.6	-53.6	0	0	109.1	V189 M190 R191	Q175-V189 HydrophobicContact CB-CG1 4.24Å; Q175-M190 WeakPolarHBondContact CA-O 3.45Å; Q175-R191 HydrophobicContact CG-CB 4.1Å; Q175-R191 HydrophobicContact CG-CG 3.95Å
176	V	89.4	Confident	65.8	Low	0 Å²	0	84.6 Å²	84.6	0%	0	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.6	177.4	-176.4	0	0	0	0	108.7	K174 F178 V189 M190 F192 I233 D238 L240	K174-V176 HydrophobicContact CD-CG2 4.04Å; K174-V176 HydrophobicContact CG-CG2 4.08Å; V176-F178 HydrophobicContact CB-CE2 4.21Å; V176-F178 HydrophobicContact CB-CZ 4.46Å; V176-F178 HydrophobicContact CG1-CE1 4.46Å; V176-F178 HydrophobicContact CG1-CE2 4.09Å; V176-F178 HydrophobicContact CG1-CZ 4.05Å; V176-V189 WeakPolarHBondContact O-CA 3.4Å; V176-M190 PolarHBondContact N-O 3.04Å; V176-M190 PolarHBondContact O-N 3.05Å; V176-F192 HydrophobicContact CB-CD2 4.22Å; V176-F192 HydrophobicContact CB-CE2 3.98Å; V176-F192 HydrophobicContact CG2-CD2 3.9Å; V176-F192 HydrophobicContact CG2-CE2 4.11Å; V176-I233 HydrophobicContact CB-CG2 4.41Å; V176-I233 HydrophobicContact CG1-CG2 4.43Å; V176-I233 HydrophobicContact CG2-CG2 3.92Å; V176-D238 CarbonylContact C-O 3.47Å; V176-D238 WeakPolarHBondContact CA-O 3.43Å; V176-L240 HydrophobicContact CG1-CB 4.41Å; V176-L240 HydrophobicContact CG1-CD1 3.88Å; V176-L240 HydrophobicContact CG1-CG 3.88Å
177	E	89.8	Confident	68.6	Low	44 Å²	44	81.4 Å²	81.4	21%	0.206	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.8	175.2	-173.5	-172.3	-147.3	0	0	109.5	I179 R187 V189 D238 R239 L240	E177-I179 HydrophobicContact CG-CG1 4.46Å; E177-R187 HydrophobicContact CG-CB 4.34Å; E177-R187 WeakPolarHBondContact OE1-CD 3.38Å; E177-R187 IonicContact OE1-CZ 2.98Å; E177-R187 IonicContact OE1-NE 2.85Å; E177-R187 IonicContact OE1-NH1 3.9Å; E177-R187 PolarHBondContact OE1-NH1 3.03Å; E177-R187 VanDerWaalsContact OE1-NH1 3.14Å; E177-V189 HydrophobicContact CB-CG2 4.15Å; E177-V189 HydrophobicContact CG-CG2 4.04Å; E177-D238 PolarHBondContact N-O 3.1Å; E177-R239 HydrophobicContact CB-CG 4.44Å; E177-R239 CarbonylContact O-C 3.48Å; E177-R239 WeakPolarHBondContact O-CA 3.47Å; E177-R239 IonicContact OE1-NH2 3.44Å; E177-R239 IonicContact OE2-CZ 2.91Å; E177-R239 IonicContact OE2-NE 3.91Å; E177-R239 PolarHBondContact OE2-NE 2.91Å; E177-R239 IonicContact OE2-NH2 3.49Å; E177-R239 PolarHBondContact OE2-NH2 2.61Å; E177-L240 PolarHBondContact O-N 3.43Å
178	F	92.6	Very high	71.4	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	135.2	172.2	-62.9	-88.2	0	0	0	109.8	V176 R187 H188 M190 F192 V204 L208 F212 L219 I233 L240	V176-F178 HydrophobicContact CB-CE2 4.21Å; V176-F178 HydrophobicContact CB-CZ 4.46Å; V176-F178 HydrophobicContact CG1-CE1 4.46Å; V176-F178 HydrophobicContact CG1-CE2 4.09Å; V176-F178 HydrophobicContact CG1-CZ 4.05Å; F178-R187 CarbonylContact O-C 3.56Å; F178-R187 VanDerWaalsContact O-CA 3.26Å; F178-R187 WeakPolarHBondContact O-CA 3.32Å; F178-H188 PolarHBondContact N-O 3.47Å; F178-H188 PolarHBondContact O-N 3.48Å; F178-M190 HydrophobicContact CD2-CG 4.24Å; F178-M190 HydrophobicContact CD2-SD 4.33Å; F178-M190 HydrophobicContact CE2-CB 4.01Å; F178-M190 HydrophobicContact CE2-CG 4.02Å; F178-M190 HydrophobicContact CE2-SD 3.89Å; F178-F192 AromaticContact CE2-CE2 3.94Å; F178-F192 HydrophobicContact CE2-CE2 3.94Å; F178-F192 HydrophobicContact CE2-CZ 4.09Å; F178-F192 HydrophobicContact CZ-CE2 4.08Å; F178-F192 HydrophobicContact CZ-CZ 4.02Å; F178-V204 HydrophobicContact CE1-CG1 4.17Å; F178-V204 HydrophobicContact CE2-CG1 4.39Å; F178-V204 HydrophobicContact CZ-CG1 3.73Å; F178-L208 HydrophobicContact CB-CD1 4.13Å; F178-L208 HydrophobicContact CB-CD2 3.58Å; F178-L208 HydrophobicContact CD1-CD1 3.32Å; F178-L208 HydrophobicContact CD1-CD2 4.21Å; F178-L208 HydrophobicContact CD1-CG 4.4Å; F178-L208 HydrophobicContact CD2-CD1 4.08Å; F178-L208 HydrophobicContact CD2-CD2 3.61Å; F178-L208 HydrophobicContact CD2-CG 4.4Å; F178-L208 HydrophobicContact CE1-CD1 3.61Å; F178-L208 HydrophobicContact CE2-CD1 4.32Å; F178-L208 HydrophobicContact CE2-CD2 4.32Å; F178-L208 HydrophobicContact CG-CD1 3.57Å; F178-L208 HydrophobicContact CG-CD2 3.52Å; F178-L208 HydrophobicContact CG-CG 4.19Å; F178-L208 HydrophobicContact CZ-CD1 4.1Å; F178-F212 HydrophobicContact CB-CE2 4.16Å; F178-F212 HydrophobicContact CB-CZ 4.17Å; F178-F212 WeakPolarHBondContact O-CZ 3.47Å; F178-L219 HydrophobicContact CD1-CD2 3.71Å; F178-L219 HydrophobicContact CE1-CD1 3.96Å; F178-L219 HydrophobicContact CE1-CD2 3.83Å; F178-I233 HydrophobicContact CZ-CG2 4.37Å; F178-L240 CarbonylContact C-O 3.55Å; F178-L240 VanDerWaalsContact CA-O 3.31Å; F178-L240 WeakPolarHBondContact CA-O 3.44Å; F178-L240 HydrophobicContact CD1-CB 3.73Å; F178-L240 HydrophobicContact CD1-CD1 4.34Å; F178-L240 HydrophobicContact CE1-CB 3.84Å; F178-L240 HydrophobicContact CE1-CD1 3.57Å; F178-L240 HydrophobicContact CE1-CG 4.29Å; F178-L240 HydrophobicContact CZ-CD1 4.11Å
179	I	90.1	Very high	74.3	Confident	28 Å²	28	71.7 Å²	71.7	14%	0.144	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.1	180	-54.1	175.2	0	0	0	108.2	E177 N181 R187 L240 I241 A242	E177-I179 HydrophobicContact CG-CG1 4.46Å; I179-N181 PolarHBondContact O-N 3.39Å; I179-R187 HydrophobicContact CG1-CG 4.17Å; I179-R187 HydrophobicContact CG2-CG 4.46Å; I179-L240 PolarHBondContact N-O 2.85Å; I179-I241 CarbonylContact O-C 3.59Å; I179-I241 WeakPolarHBondContact O-CA 3.44Å; I179-A242 PolarHBondContact O-N 2.89Å
180	L	88.5	Confident	77.1	Confident	3 Å²	3	63 Å²	63	2%	0.016	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	130.4	176.4	-169.3	67.8	0	0	0	110.3	S182 E183 N186 F212 V214 V216	L180-S182 PolarHBondContact O-N 3.49Å; L180-E183 HydrophobicContact CB-CB 4.48Å; L180-E183 HydrophobicContact CD2-CB 4.39Å; L180-E183 CarbonylContact O-C 3.56Å; L180-E183 PolarHBondContact O-N 3.35Å; L180-E183 VanDerWaalsContact O-N 3.17Å; L180-N186 HydrophobicContact CB-CB 4.29Å; L180-N186 PolarHBondContact N-O 3.25Å; L180-N186 VanDerWaalsContact N-O 3.15Å; L180-F212 HydrophobicContact CB-CD1 4.07Å; L180-F212 HydrophobicContact CB-CE1 4.15Å; L180-F212 HydrophobicContact CB-CG 4.32Å; L180-F212 HydrophobicContact CB-CZ 4.44Å; L180-F212 HydrophobicContact CD1-CB 4.19Å; L180-F212 HydrophobicContact CD1-CD2 4.18Å; L180-F212 HydrophobicContact CD1-CG 4.12Å; L180-F212 HydrophobicContact CD2-CB 4.4Å; L180-V214 HydrophobicContact CD1-CB 4.47Å; L180-V214 HydrophobicContact CD1-CG1 4.28Å; L180-V214 HydrophobicContact CD2-CG2 4.22Å; L180-V216 HydrophobicContact CD1-CG2 4.43Å
181	N	84.1	Confident	79.2	Confident	12 Å²	12	66.4 Å²	66.4	6%	0.064	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	137.7	177.9	-165.6	39.7	0	0	0	110.4	I179 E183 I241 A242 C243 R248 V250	I179-N181 PolarHBondContact O-N 3.39Å; N181-E183 PolarHBondContact O-N 2.74Å; N181-I241 HydrophobicContact CB-CG2 3.92Å; N181-A242 WeakPolarHBondContact CB-O 3.37Å; N181-A242 PolarHBondContact N-O 3.3Å; N181-C243 HydrophobicContact CB-CB 4.4Å; N181-C243 VanDerWaalsContact CB-SG 3.6Å; N181-R248 PolarHBondContact ND2-O 3.24Å; N181-V250 PolarHBondContact OD1-N 3.24Å
182	S	73	Confident	81.2	Confident	93 Å²	93	62.8 Å²	62.8	65%	0.65	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	-9.9	-174.5	-47.8	0	0	0	0	116.9	L180	L180-S182 PolarHBondContact O-N 3.49Å
183	E	76.7	Confident	81.9	Confident	91 Å²	91	58.2 Å²	58.2	43%	0.425	30%	0.296	S	S	.	.			trans	-127.1	80.7	177.4	-74.5	-178.1	-165.4	0	0	112.2	L180 N181 T185 N186	L180-E183 HydrophobicContact CB-CB 4.48Å; L180-E183 HydrophobicContact CD2-CB 4.39Å; L180-E183 CarbonylContact O-C 3.56Å; L180-E183 PolarHBondContact O-N 3.35Å; L180-E183 VanDerWaalsContact O-N 3.17Å; N181-E183 PolarHBondContact O-N 2.74Å; E183-T185 PolarHBondContact O-N 3.26Å; E183-T185 VanDerWaalsContact O-N 3.1Å; E183-N186 HydrophobicContact CB-CB 4.07Å; E183-N186 PolarHBondContact O-N 2.79Å; E183-N186 PolarHBondContact OE2-ND2 3.11Å
184	P	70	Confident	81.4	Confident	62 Å²	62	59.7 Å²	59.7	40%	0.403	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-11.3	-173.7	26.9	-34	0	0	0	114.9	R187	P184-R187 PolarHBondContact O-NE 2.93Å; P184-R187 PolarHBondContact O-NH2 3.24Å
185	T	76.4	Confident	80	Confident	130 Å²	130	63.7 Å²	63.7	80%	0.798	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-22.9	172.7	47.1	0	0	0	0	112.3	E183	E183-T185 PolarHBondContact O-N 3.26Å; E183-T185 VanDerWaalsContact O-N 3.1Å
186	N	80.6	Confident	78.3	Confident	51 Å²	51	64 Å²	64	27%	0.273	34%	0.336	S	S	.	.			trans	-93.9	105.1	-175.7	-157.4	-8.5	0	0	0	109.7	L180 E183 F212	L180-N186 HydrophobicContact CB-CB 4.29Å; L180-N186 PolarHBondContact N-O 3.25Å; L180-N186 VanDerWaalsContact N-O 3.15Å; E183-N186 HydrophobicContact CB-CB 4.07Å; E183-N186 PolarHBondContact O-N 2.79Å; E183-N186 PolarHBondContact OE2-ND2 3.11Å; N186-F212 HydrophobicContact CB-CD1 4.49Å; N186-F212 WeakPolarHBondContact O-CE1 3.25Å; N186-F212 WeakPolarHBondContact OD1-CD1 3.34Å
187	R	84.4	Confident	76.5	Confident	124 Å²	124	67.2 Å²	67.2	47%	0.468	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146	-172.3	-48.4	-170.4	-169	165.4	5.9	111.6	E177 F178 I179 P184	E177-R187 HydrophobicContact CG-CB 4.34Å; E177-R187 WeakPolarHBondContact OE1-CD 3.38Å; E177-R187 IonicContact OE1-CZ 2.98Å; E177-R187 IonicContact OE1-NE 2.85Å; E177-R187 IonicContact OE1-NH1 3.9Å; E177-R187 PolarHBondContact OE1-NH1 3.03Å; E177-R187 VanDerWaalsContact OE1-NH1 3.14Å; F178-R187 CarbonylContact O-C 3.56Å; F178-R187 VanDerWaalsContact O-CA 3.26Å; F178-R187 WeakPolarHBondContact O-CA 3.32Å; I179-R187 HydrophobicContact CG1-CG 4.17Å; I179-R187 HydrophobicContact CG2-CG 4.46Å; P184-R187 PolarHBondContact O-NE 2.93Å; P184-R187 PolarHBondContact O-NH2 3.24Å
188	H	87.6	Confident	74.6	Confident	72 Å²	72	69.8 Å²	69.8	33%	0.333	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.2	179.1	-167.2	73.2	0	0	0	110.3	F178 L208 A211 F212	F178-H188 PolarHBondContact N-O 3.47Å; F178-H188 PolarHBondContact O-N 3.48Å; H188-L208 HydrophobicContact CB-CD2 4.23Å; H188-A211 HydrophobicContact CB-CB 4.35Å; H188-F212 HydrophobicContact CB-CE1 4.03Å; H188-F212 HydrophobicContact CB-CE2 4.34Å; H188-F212 HydrophobicContact CB-CZ 3.73Å
189	V	88.7	Confident	73.2	Confident	77 Å²	77	72.9 Å²	72.9	47%	0.467	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.7	-177.3	-179.8	0	0	0	0	109.6	Q175 V176 E177	Q175-V189 HydrophobicContact CB-CG1 4.24Å; V176-V189 WeakPolarHBondContact O-CA 3.4Å; E177-V189 HydrophobicContact CB-CG2 4.15Å; E177-V189 HydrophobicContact CG-CG2 4.04Å
190	M	87.5	Confident	72.4	Confident	26 Å²	26	73.7 Å²	73.7	13%	0.128	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	149.3	172	-58.9	178.7	71.1	0	0	110.4	Q175 V176 F178 F192 V204 C207 L208	Q175-M190 WeakPolarHBondContact CA-O 3.45Å; V176-M190 PolarHBondContact N-O 3.04Å; V176-M190 PolarHBondContact O-N 3.05Å; F178-M190 HydrophobicContact CD2-CG 4.24Å; F178-M190 HydrophobicContact CD2-SD 4.33Å; F178-M190 HydrophobicContact CE2-CB 4.01Å; F178-M190 HydrophobicContact CE2-CG 4.02Å; F178-M190 HydrophobicContact CE2-SD 3.89Å; M190-F192 HydrophobicContact CB-CD2 4.49Å; M190-F192 HydrophobicContact CB-CE2 3.69Å; M190-F192 HydrophobicContact CB-CZ 3.93Å; M190-F192 HydrophobicContact CE-CZ 4.38Å; M190-F192 HydrophobicContact SD-CZ 4.29Å; M190-V204 HydrophobicContact SD-CG1 4.08Å; M190-C207 HydrophobicContact CE-CB 3.96Å; M190-C207 HydrophobicContact SD-CB 4.37Å; M190-L208 HydrophobicContact SD-CD2 4.06Å; M190-L208 HydrophobicContact SD-CG 4.27Å
191	R	80.7	Confident	72.1	Confident	157 Å²	157	74.2 Å²	74.2	59%	0.592	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	122.7	177.5	-171.6	178.9	-66.5	-163.9	-0.6	109.5	K174 Q175	K174-R191 CarbonylContact O-C 3.52Å; K174-R191 WeakPolarHBondContact O-CA 3.4Å; Q175-R191 HydrophobicContact CG-CB 4.1Å; Q175-R191 HydrophobicContact CG-CG 3.95Å
192	F	80.5	Confident	71.9	Confident	13 Å²	13	78.6 Å²	78.6	6%	0.057	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.8	-179.8	-62.1	-88.5	0	0	0	109.3	S173 K174 V176 F178 M190 V204 I233 L234	S173-F192 CarbonylContact C-O 3.55Å; S173-F192 VanDerWaalsContact CA-O 3.29Å; S173-F192 WeakPolarHBondContact CA-O 3.26Å; K174-F192 PolarHBondContact N-O 2.81Å; K174-F192 PolarHBondContact O-N 2.82Å; V176-F192 HydrophobicContact CB-CD2 4.22Å; V176-F192 HydrophobicContact CB-CE2 3.98Å; V176-F192 HydrophobicContact CG2-CD2 3.9Å; V176-F192 HydrophobicContact CG2-CE2 4.11Å; F178-F192 AromaticContact CE2-CE2 3.94Å; F178-F192 HydrophobicContact CE2-CE2 3.94Å; F178-F192 HydrophobicContact CE2-CZ 4.09Å; F178-F192 HydrophobicContact CZ-CE2 4.08Å; F178-F192 HydrophobicContact CZ-CZ 4.02Å; M190-F192 HydrophobicContact CB-CD2 4.49Å; M190-F192 HydrophobicContact CB-CE2 3.69Å; M190-F192 HydrophobicContact CB-CZ 3.93Å; M190-F192 HydrophobicContact CE-CZ 4.38Å; M190-F192 HydrophobicContact SD-CZ 4.29Å; F192-V204 HydrophobicContact CE1-CG2 3.73Å; F192-V204 HydrophobicContact CZ-CG1 4.19Å; F192-V204 HydrophobicContact CZ-CG2 4.04Å; F192-I233 HydrophobicContact CD1-CG2 4.4Å; F192-I233 HydrophobicContact CD2-CG2 3.84Å; F192-I233 HydrophobicContact CE1-CG2 4.16Å; F192-I233 HydrophobicContact CE2-CG2 3.56Å; F192-I233 HydrophobicContact CG-CG2 4.27Å; F192-I233 HydrophobicContact CZ-CG2 3.74Å; F192-L234 HydrophobicContact CB-CD2 3.47Å; F192-L234 VanDerWaalsContact CB-CD2 3.47Å; F192-L234 HydrophobicContact CB-CG 4.35Å
193	K	67.1	Low	72.3	Confident	75 Å²	75	78.2 Å²	78.2	33%	0.326	41%	0.411	S	S	.	.			trans	-101.6	133.2	170.6	-50	-153.9	-163.3	95	0	109.3	S195 E196 L197	K193-S195 PolarHBondContact O-N 2.79Å; K193-S195 VanDerWaalsContact O-N 3.14Å; K193-E196 HydrophobicContact CB-CB 4.13Å; K193-E196 HydrophobicContact CB-CG 4.27Å; K193-E196 IonicContact NZ-OE1 2.61Å; K193-E196 PolarHBondContact NZ-OE1 3.39Å; K193-E196 IonicContact NZ-OE2 2.91Å; K193-E196 PolarHBondContact NZ-OE2 2.81Å; K193-E196 PolarHBondContact O-N 3.02Å; K193-L197 PolarHBondContact O-N 2.84Å
194	P	58.8	Low	72.7	Confident	71 Å²	71	73.9 Å²	73.9	46%	0.461	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-54.9	-32.6	176.4	-25.8	33.8	0	0	0	113.4	E196 L234	P194-E196 VanDerWaalsContact C-N 3.35Å; P194-L234 HydrophobicContact CG-CD1 4.49Å
195	S	49.8	Very low	73.5	Confident	106 Å²	106	72 Å²	72	74%	0.741	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-79.9	-8.2	178.7	58.4	0	0	0	0	115	K193	K193-S195 PolarHBondContact O-N 2.79Å; K193-S195 VanDerWaalsContact O-N 3.14Å
196	E	48.9	Very low	73.8	Confident	109 Å²	109	70.5 Å²	70.5	51%	0.509	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-125.2	19.8	-175.3	-63.6	170.4	-174	0	0	112.3	K193 P194 T198	K193-E196 HydrophobicContact CB-CB 4.13Å; K193-E196 HydrophobicContact CB-CG 4.27Å; K193-E196 IonicContact NZ-OE1 2.61Å; K193-E196 PolarHBondContact NZ-OE1 3.39Å; K193-E196 IonicContact NZ-OE2 2.91Å; K193-E196 PolarHBondContact NZ-OE2 2.81Å; K193-E196 PolarHBondContact O-N 3.02Å; P194-E196 VanDerWaalsContact C-N 3.35Å; E196-T198 PolarHBondContact O-N 3.35Å
197	L	51.4	Low	74	Confident	68 Å²	68	70.5 Å²	70.5	36%	0.356	37%	0.368	S	S	.	.			trans	-68.6	74.6	173.9	-84	169.8	0	0	0	111.2	K193 L234	K193-L197 PolarHBondContact O-N 2.84Å; L197-L234 HydrophobicContact CD1-CD1 3.16Å; L197-L234 HydrophobicContact CD1-CG 4.28Å; L197-L234 HydrophobicContact CD2-CD1 4.01Å; L197-L234 HydrophobicContact CD2-CG 4.35Å; L197-L234 HydrophobicContact CG-CD1 3.75Å
198	T	49.9	Very low	74.1	Confident	98 Å²	98	64.6 Å²	64.6	60%	0.601	35%	0.345	S	S	*	.			trans	-95.5	-12.2	164.3	57	0	0	0	0	111.8	E196	E196-T198 PolarHBondContact O-N 3.35Å
199	L	62.8	Low	74.1	Confident	64 Å²	64	62.1 Å²	62.1	34%	0.335	34%	0.336	S	S	.	.			trans	-86.1	120.6	-172.9	-66.6	169.1	0	0	0	111.9	E203 V204 S230	L199-E203 WeakPolarHBondContact CA-OE2 3.38Å; L199-E203 HydrophobicContact CB-CB 4.46Å; L199-E203 HydrophobicContact CD2-CB 3.89Å; L199-V204 HydrophobicContact CB-CG2 4.4Å; L199-S230 PolarHBondContact O-OG 2.98Å
200	S	74.1	Confident	73.6	Confident	46 Å²	46	62.8 Å²	62.8	32%	0.322	34%	0.337	S	S	.	.			trans	-70.2	161.6	169.5	79.4	0	0	0	0	110.9	D202 E203 V204	S200-D202 PolarHBondContact O-N 2.83Å; S200-D202 PolarHBondContact OG-N 3.3Å; S200-E203 PolarHBondContact N-OE2 3.04Å; S200-E203 PolarHBondContact O-N 2.96Å; S200-E203 VanDerWaalsContact O-N 3.07Å; S200-E203 PolarHBondContact OG-N 2.75Å; S200-E203 VanDerWaalsContact OG-N 3.14Å; S200-V204 PolarHBondContact O-N 3.11Å
201	V	81.1	Confident	73.3	Confident	14 Å²	14	63.1 Å²	63.1	9%	0.085	34%	0.344	C	S	.	.	H	α-helix	trans	-58.4	-34.8	173.5	-177.7	0	0	0	0	110.9	E203 V204 M205 L219 L228 S230	V201-E203 VanDerWaalsContact C-N 3.35Å; V201-E203 PolarHBondContact O-N 3.21Å; V201-V204 PolarHBondContact O-N 3.37Å; V201-M205 HydrophobicContact CG1-CE 4.12Å; V201-M205 HydrophobicContact CG1-CG 4.44Å; V201-M205 HydrophobicContact CG1-SD 4.43Å; V201-M205 WeakPolarHBondContact O-CG 3.25Å; V201-M205 PolarHBondContact O-N 3.06Å; V201-L219 HydrophobicContact CG1-CD1 4.26Å; V201-L228 WeakPolarHBondContact CG2-O 3.41Å; V201-S230 PolarHBondContact N-OG 2.91Å
202	D	79.8	Confident	73.6	Confident	104 Å²	104	56 Å²	56	56%	0.556	32%	0.317	S	S	*	.	H	α-helix	trans	-64.8	-37.4	175.5	-59.8	-46.8	0	0	0	112.3	S200 M205 N206	S200-D202 PolarHBondContact O-N 2.83Å; S200-D202 PolarHBondContact OG-N 3.3Å; D202-M205 HydrophobicContact CB-CE 4.38Å; D202-M205 PolarHBondContact O-N 3.22Å; D202-M205 WeakPolarHBondContact OD1-CE 3.38Å; D202-N206 WeakPolarHBondContact O-CB 3.22Å; D202-N206 PolarHBondContact O-N 3.45Å; D202-N206 PolarHBondContact O-ND2 3.49Å; D202-N206 VanDerWaalsContact O-ND2 3.11Å
203	E	81.6	Confident	73.6	Confident	84 Å²	84	63.5 Å²	63.5	39%	0.393	35%	0.352	S	S	.	.	H	α-helix	trans	-69.3	-37.2	174.8	-70.4	174.7	147.2	0	0	112	L199 S200 V201 N206 C207	L199-E203 WeakPolarHBondContact CA-OE2 3.38Å; L199-E203 HydrophobicContact CB-CB 4.46Å; L199-E203 HydrophobicContact CD2-CB 3.89Å; S200-E203 PolarHBondContact N-OE2 3.04Å; S200-E203 PolarHBondContact O-N 2.96Å; S200-E203 VanDerWaalsContact O-N 3.07Å; S200-E203 PolarHBondContact OG-N 2.75Å; S200-E203 VanDerWaalsContact OG-N 3.14Å; V201-E203 VanDerWaalsContact C-N 3.35Å; V201-E203 PolarHBondContact O-N 3.21Å; E203-N206 PolarHBondContact O-N 2.82Å; E203-C207 PolarHBondContact O-N 3.43Å; E203-C207 PolarHBondContact O-SG 3.46Å
204	V	85.3	Confident	74.3	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-46.9	170.7	177.4	0	0	0	0	110.2	F178 M190 F192 L199 S200 V201 N206 C207 L208 L219 I233	F178-V204 HydrophobicContact CE1-CG1 4.17Å; F178-V204 HydrophobicContact CE2-CG1 4.39Å; F178-V204 HydrophobicContact CZ-CG1 3.73Å; M190-V204 HydrophobicContact SD-CG1 4.08Å; F192-V204 HydrophobicContact CE1-CG2 3.73Å; F192-V204 HydrophobicContact CZ-CG1 4.19Å; F192-V204 HydrophobicContact CZ-CG2 4.04Å; L199-V204 HydrophobicContact CB-CG2 4.4Å; S200-V204 PolarHBondContact O-N 3.11Å; V201-V204 PolarHBondContact O-N 3.37Å; V204-N206 VanDerWaalsContact C-N 3.32Å; V204-N206 PolarHBondContact O-N 3.23Å; V204-C207 PolarHBondContact O-N 2.9Å; V204-L208 HydrophobicContact CG1-CD1 3.87Å; V204-L208 HydrophobicContact CG1-CG 4.38Å; V204-L208 WeakPolarHBondContact O-CB 3.46Å; V204-L208 VanDerWaalsContact O-CG 3.25Å; V204-L208 WeakPolarHBondContact O-CG 3.01Å; V204-L208 PolarHBondContact O-N 3.06Å; V204-L219 HydrophobicContact CG1-CD1 4.15Å; V204-I233 HydrophobicContact CB-CD1 4.34Å; V204-I233 HydrophobicContact CG1-CD1 4.13Å; V204-I233 HydrophobicContact CG2-CD1 4.06Å
205	M	87.1	Confident	75.4	Confident	23 Å²	23	60.8 Å²	60.8	11%	0.113	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-37.1	176.9	-71.8	-173.3	-62.2	0	0	112.3	V201 D202 L208 S209 V216 A217 L219	V201-M205 HydrophobicContact CG1-CE 4.12Å; V201-M205 HydrophobicContact CG1-CG 4.44Å; V201-M205 HydrophobicContact CG1-SD 4.43Å; V201-M205 WeakPolarHBondContact O-CG 3.25Å; V201-M205 PolarHBondContact O-N 3.06Å; D202-M205 HydrophobicContact CB-CE 4.38Å; D202-M205 PolarHBondContact O-N 3.22Å; D202-M205 WeakPolarHBondContact OD1-CE 3.38Å; M205-L208 PolarHBondContact O-N 3.48Å; M205-S209 VanDerWaalsContact O-CB 3.31Å; M205-S209 WeakPolarHBondContact O-CB 3.38Å; M205-S209 PolarHBondContact O-N 3.09Å; M205-S209 PolarHBondContact O-OG 3.07Å; M205-V216 HydrophobicContact CG-CG1 4.45Å; M205-A217 VanDerWaalsContact SD-C 3.57Å; M205-L219 HydrophobicContact CG-CD1 3.9Å; M205-L219 HydrophobicContact CG-CG 4Å
206	N	82.8	Confident	77.1	Confident	97 Å²	97	56.1 Å²	56.1	52%	0.519	32%	0.318	S	S	.	.	H	α-helix	trans	-66.5	-43.3	173.6	-75.4	-34.7	0	0	0	112.1	D202 E203 V204 L208 S209 N210	D202-N206 WeakPolarHBondContact O-CB 3.22Å; D202-N206 PolarHBondContact O-N 3.45Å; D202-N206 PolarHBondContact O-ND2 3.49Å; D202-N206 VanDerWaalsContact O-ND2 3.11Å; E203-N206 PolarHBondContact O-N 2.82Å; V204-N206 VanDerWaalsContact C-N 3.32Å; V204-N206 PolarHBondContact O-N 3.23Å; N206-L208 VanDerWaalsContact C-N 3.33Å; N206-L208 PolarHBondContact O-N 3.17Å; N206-S209 PolarHBondContact O-N 2.69Å; N206-N210 PolarHBondContact O-N 3.18Å; N206-N210 PolarHBondContact O-ND2 2.83Å
207	C	84	Confident	78.7	Confident	52 Å²	52	52.6 Å²	52.6	35%	0.351	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-44.2	174.9	-70	0	0	0	0	111.3	M190 E203 V204 N210 A211	M190-C207 HydrophobicContact CE-CB 3.96Å; M190-C207 HydrophobicContact SD-CB 4.37Å; E203-C207 PolarHBondContact O-N 3.43Å; E203-C207 PolarHBondContact O-SG 3.46Å; V204-C207 PolarHBondContact O-N 2.9Å; C207-N210 PolarHBondContact O-N 3.32Å; C207-A211 WeakPolarHBondContact O-CB 3.42Å; C207-A211 PolarHBondContact O-N 2.8Å
208	L	87.3	Confident	80.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-35.5	176.9	-66.2	171.1	0	0	0	112.2	F178 H188 M190 V204 M205 N206 N210 A211 F212 V216 L219	F178-L208 HydrophobicContact CB-CD1 4.13Å; F178-L208 HydrophobicContact CB-CD2 3.58Å; F178-L208 HydrophobicContact CD1-CD1 3.32Å; F178-L208 HydrophobicContact CD1-CD2 4.21Å; F178-L208 HydrophobicContact CD1-CG 4.4Å; F178-L208 HydrophobicContact CD2-CD1 4.08Å; F178-L208 HydrophobicContact CD2-CD2 3.61Å; F178-L208 HydrophobicContact CD2-CG 4.4Å; F178-L208 HydrophobicContact CE1-CD1 3.61Å; F178-L208 HydrophobicContact CE2-CD1 4.32Å; F178-L208 HydrophobicContact CE2-CD2 4.32Å; F178-L208 HydrophobicContact CG-CD1 3.57Å; F178-L208 HydrophobicContact CG-CD2 3.52Å; F178-L208 HydrophobicContact CG-CG 4.19Å; F178-L208 HydrophobicContact CZ-CD1 4.1Å; H188-L208 HydrophobicContact CB-CD2 4.23Å; M190-L208 HydrophobicContact SD-CD2 4.06Å; M190-L208 HydrophobicContact SD-CG 4.27Å; V204-L208 HydrophobicContact CG1-CD1 3.87Å; V204-L208 HydrophobicContact CG1-CG 4.38Å; V204-L208 WeakPolarHBondContact O-CB 3.46Å; V204-L208 VanDerWaalsContact O-CG 3.25Å; V204-L208 WeakPolarHBondContact O-CG 3.01Å; V204-L208 PolarHBondContact O-N 3.06Å; M205-L208 PolarHBondContact O-N 3.48Å; N206-L208 VanDerWaalsContact C-N 3.33Å; N206-L208 PolarHBondContact O-N 3.17Å; L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.08Å; L208-A211 PolarHBondContact O-N 2.79Å; L208-F212 HydrophobicContact CB-CD2 4.13Å; L208-F212 HydrophobicContact CB-CE2 4.22Å; L208-F212 HydrophobicContact CD2-CE2 3.89Å; L208-F212 WeakPolarHBondContact O-CB 3.2Å; L208-F212 VanDerWaalsContact O-CD2 3.23Å; L208-F212 WeakPolarHBondContact O-CD2 3.46Å; L208-F212 PolarHBondContact O-N 3.35Å; L208-V216 HydrophobicContact CB-CB 4.46Å; L208-V216 HydrophobicContact CB-CG1 4.5Å; L208-V216 HydrophobicContact CB-CG2 4.22Å; L208-L219 HydrophobicContact CD1-CD1 4.32Å; L208-L219 HydrophobicContact CD1-CD2 3.69Å
209	S	86	Confident	82.3	Confident	20 Å²	20	46.5 Å²	46.5	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-41	175.8	-63.3	0	0	0	0	111.6	M205 N206 H213 V214 V216	M205-S209 VanDerWaalsContact O-CB 3.31Å; M205-S209 WeakPolarHBondContact O-CB 3.38Å; M205-S209 PolarHBondContact O-N 3.09Å; M205-S209 PolarHBondContact O-OG 3.07Å; N206-S209 PolarHBondContact O-N 2.69Å; S209-H213 WeakPolarHBondContact O-CA 3.38Å; S209-H213 PolarHBondContact O-N 3.38Å; S209-V214 WeakPolarHBondContact CA-O 3.32Å; S209-V214 WeakPolarHBondContact CB-O 3.31Å; S209-V214 PolarHBondContact O-N 2.78Å; S209-V214 VanDerWaalsContact O-N 3.16Å; S209-V216 WeakPolarHBondContact OG-CB 3.25Å; S209-V216 PolarHBondContact OG-N 3.43Å; S209-V216 PolarHBondContact OG-O 2.79Å
210	N	78.6	Confident	83.5	Confident	90 Å²	90	45 Å²	45	48%	0.481	26%	0.261	S	S	.	.	H	α-helix	trans	-69.4	-42.8	173.9	-66.6	-24.8	0	0	0	111.9	N206 C207 L208 H213	N206-N210 PolarHBondContact O-N 3.18Å; N206-N210 PolarHBondContact O-ND2 2.83Å; C207-N210 PolarHBondContact O-N 3.32Å; L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.08Å; N210-H213 PolarHBondContact O-N 2.85Å
211	A	81.3	Confident	84	Confident	33 Å²	33	43.7 Å²	43.7	27%	0.273	25%	0.251	S	S	.	.	H	α-helix	trans	-65.4	-42.4	-179	0	0	0	0	0	112.7	H188 C207 L208 H213	H188-A211 HydrophobicContact CB-CB 4.35Å; C207-A211 WeakPolarHBondContact O-CB 3.42Å; C207-A211 PolarHBondContact O-N 2.8Å; L208-A211 PolarHBondContact O-N 2.79Å; A211-H213 PolarHBondContact O-ND1 3.34Å
212	F	87.1	Confident	83.7	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.035	26%	0.264	C	S	.	.	H	α-helix	trans	-86.1	-8	179	-67.3	-55.6	0	0	0	113.9	F178 L180 N186 H188 L208 V214 V216 A242	F178-F212 HydrophobicContact CB-CE2 4.16Å; F178-F212 HydrophobicContact CB-CZ 4.17Å; F178-F212 WeakPolarHBondContact O-CZ 3.47Å; L180-F212 HydrophobicContact CB-CD1 4.07Å; L180-F212 HydrophobicContact CB-CE1 4.15Å; L180-F212 HydrophobicContact CB-CG 4.32Å; L180-F212 HydrophobicContact CB-CZ 4.44Å; L180-F212 HydrophobicContact CD1-CB 4.19Å; L180-F212 HydrophobicContact CD1-CD2 4.18Å; L180-F212 HydrophobicContact CD1-CG 4.12Å; L180-F212 HydrophobicContact CD2-CB 4.4Å; N186-F212 HydrophobicContact CB-CD1 4.49Å; N186-F212 WeakPolarHBondContact O-CE1 3.25Å; N186-F212 WeakPolarHBondContact OD1-CD1 3.34Å; H188-F212 HydrophobicContact CB-CE1 4.03Å; H188-F212 HydrophobicContact CB-CE2 4.34Å; H188-F212 HydrophobicContact CB-CZ 3.73Å; L208-F212 HydrophobicContact CB-CD2 4.13Å; L208-F212 HydrophobicContact CB-CE2 4.22Å; L208-F212 HydrophobicContact CD2-CE2 3.89Å; L208-F212 WeakPolarHBondContact O-CB 3.2Å; L208-F212 VanDerWaalsContact O-CD2 3.23Å; L208-F212 WeakPolarHBondContact O-CD2 3.46Å; L208-F212 PolarHBondContact O-N 3.35Å; F212-V214 HydrophobicContact CB-CB 4.39Å; F212-V214 PolarHBondContact O-N 2.97Å; F212-V216 HydrophobicContact CD2-CG2 4.05Å; F212-A242 HydrophobicContact CD2-CB 4.34Å; F212-A242 HydrophobicContact CE2-CB 3.91Å
213	H	81.4	Confident	83.3	Confident	170 Å²	170	45.6 Å²	45.6	79%	0.787	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	36.2	-172.8	-57.3	77.2	0	0	0	112.7	S209 N210 A211	S209-H213 WeakPolarHBondContact O-CA 3.38Å; S209-H213 PolarHBondContact O-N 3.38Å; N210-H213 PolarHBondContact O-N 2.85Å; A211-H213 PolarHBondContact O-ND1 3.34Å
214	V	81.8	Confident	83	Confident	33 Å²	33	43 Å²	43	20%	0.2	27%	0.268	C	S	.	.	S	Bend	trans	-144.9	138.3	-176.3	167.7	0	0	0	0	108.1	L180 S209 F212 V216 K244	L180-V214 HydrophobicContact CD1-CB 4.47Å; L180-V214 HydrophobicContact CD1-CG1 4.28Å; L180-V214 HydrophobicContact CD2-CG2 4.22Å; S209-V214 WeakPolarHBondContact CA-O 3.32Å; S209-V214 WeakPolarHBondContact CB-O 3.31Å; S209-V214 PolarHBondContact O-N 2.78Å; S209-V214 VanDerWaalsContact O-N 3.16Å; F212-V214 HydrophobicContact CB-CB 4.39Å; F212-V214 PolarHBondContact O-N 2.97Å; V214-V216 PolarHBondContact O-N 2.8Å; V214-K244 HydrophobicContact CG1-CD 3.74Å; V214-K244 VanDerWaalsContact CG1-CE 3.44Å; V214-K244 HydrophobicContact CG1-CG 3.59Å
215	G	81.4	Confident	82.5	Confident	56 Å²	56	45.5 Å²	45.5	58%	0.577	29%	0.288	S	S	*	.			trans	-64	95.3	174.9	0	0	0	0	0	112.9
216	V	85.2	Confident	82.2	Confident	8 Å²	8	49.3 Å²	49.3	5%	0.048	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	116.1	173.6	178.1	0	0	0	0	108.1	L180 M205 L208 S209 F212 V214 L219 A242	L180-V216 HydrophobicContact CD1-CG2 4.43Å; M205-V216 HydrophobicContact CG-CG1 4.45Å; L208-V216 HydrophobicContact CB-CB 4.46Å; L208-V216 HydrophobicContact CB-CG1 4.5Å; L208-V216 HydrophobicContact CB-CG2 4.22Å; S209-V216 WeakPolarHBondContact OG-CB 3.25Å; S209-V216 PolarHBondContact OG-N 3.43Å; S209-V216 PolarHBondContact OG-O 2.79Å; F212-V216 HydrophobicContact CD2-CG2 4.05Å; V214-V216 PolarHBondContact O-N 2.8Å; V216-L219 HydrophobicContact CG1-CD2 4.36Å; V216-A242 HydrophobicContact CG1-CB 3.76Å; V216-A242 HydrophobicContact CG2-CB 4.05Å
217	A	81.9	Confident	82.3	Confident	36 Å²	36	45 Å²	45	30%	0.298	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-13	-177.2	0	0	0	0	0	113.1	M205 C243 K245	M205-A217 VanDerWaalsContact SD-C 3.57Å; A217-C243 PolarHBondContact N-O 2.85Å; A217-K245 HydrophobicContact CB-CB 3.83Å; A217-K245 HydrophobicContact CB-CG 4.27Å
218	K	87.2	Confident	82	Confident	38 Å²	38	47.1 Å²	47.1	17%	0.165	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	139.7	-176.4	-60.9	175.8	-179.8	164.7	0	110.5	Y220 C243 K245	K218-Y220 HydrophobicContact CB-CD2 4.28Å; K218-Y220 HydrophobicContact CB-CE2 3.58Å; K218-Y220 HydrophobicContact CD-CE2 4.16Å; K218-Y220 HydrophobicContact CG-CE2 4.48Å; K218-C243 HydrophobicContact CB-CB 4.29Å; K218-C243 PolarHBondContact N-O 3.35Å; K218-C243 PolarHBondContact O-N 3.48Å; K218-K245 WeakPolarHBondContact CE-O 3.36Å; K218-K245 PolarHBondContact NZ-O 3.14Å
219	L	90.5	Very high	81.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.4	172.6	-70.2	173.5	0	0	0	109.6	F178 V201 V204 M205 L208 V216 R226 V227 I241 A242	F178-L219 HydrophobicContact CD1-CD2 3.71Å; F178-L219 HydrophobicContact CE1-CD1 3.96Å; F178-L219 HydrophobicContact CE1-CD2 3.83Å; V201-L219 HydrophobicContact CG1-CD1 4.26Å; V204-L219 HydrophobicContact CG1-CD1 4.15Å; M205-L219 HydrophobicContact CG-CD1 3.9Å; M205-L219 HydrophobicContact CG-CG 4Å; L208-L219 HydrophobicContact CD1-CD1 4.32Å; L208-L219 HydrophobicContact CD1-CD2 3.69Å; V216-L219 HydrophobicContact CG1-CD2 4.36Å; L219-R226 WeakPolarHBondContact O-CA 3.35Å; L219-V227 HydrophobicContact CB-CB 3.87Å; L219-V227 HydrophobicContact CB-CG1 4.48Å; L219-V227 HydrophobicContact CB-CG2 4.31Å; L219-V227 PolarHBondContact O-N 2.8Å; L219-I241 CarbonylContact C-O 3.49Å; L219-I241 WeakPolarHBondContact CA-O 3.3Å; L219-A242 HydrophobicContact CD2-CB 4.01Å
220	Y	87.4	Confident	81	Confident	33 Å²	33	54.1 Å²	54.1	13%	0.129	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148	178.7	-67.2	-88.5	0	0	0	111.3	K218 G224 A225 R226 L240 I241 C243 P249	K218-Y220 HydrophobicContact CB-CD2 4.28Å; K218-Y220 HydrophobicContact CB-CE2 3.58Å; K218-Y220 HydrophobicContact CD-CE2 4.16Å; K218-Y220 HydrophobicContact CG-CE2 4.48Å; Y220-G224 WeakPolarHBondContact CD1-O 3.41Å; Y220-A225 CarbonylContact C-O 3.59Å; Y220-A225 VanDerWaalsContact CA-O 3.23Å; Y220-A225 WeakPolarHBondContact CA-O 3.27Å; Y220-R226 HydrophobicContact CD1-CB 4.01Å; Y220-R226 HydrophobicContact CD1-CG 4.47Å; Y220-R226 HydrophobicContact CE1-CB 3.81Å; Y220-R226 HydrophobicContact CE1-CG 4.13Å; Y220-L240 CarbonylContact O-C 3.54Å; Y220-L240 WeakPolarHBondContact O-CA 3.38Å; Y220-I241 PolarHBondContact N-O 3.1Å; Y220-I241 PolarHBondContact O-N 2.83Å; Y220-C243 HydrophobicContact CD2-CB 4.16Å; Y220-C243 HydrophobicContact CE2-CB 4.06Å; Y220-P249 HydrophobicContact CD1-CG 3.83Å; Y220-P249 HydrophobicContact CD2-CB 4.03Å; Y220-P249 HydrophobicContact CD2-CG 3.95Å; Y220-P249 HydrophobicContact CE1-CG 4.12Å; Y220-P249 HydrophobicContact CE2-CG 4.23Å; Y220-P249 HydrophobicContact CG-CB 3.96Å; Y220-P249 HydrophobicContact CG-CG 3.73Å
221	T	84.6	Confident	80.7	Confident	17 Å²	17	55.2 Å²	55.2	10%	0.104	32%	0.315	C	S	.	.			trans	-68.9	163.1	165.2	67	0	0	0	0	110.2	S223 G224 A225 V227 P237 L240	T221-S223 PolarHBondContact O-N 2.96Å; T221-S223 VanDerWaalsContact O-N 3.16Å; T221-S223 PolarHBondContact OG1-N 2.98Å; T221-S223 PolarHBondContact OG1-OG 3.33Å; T221-G224 PolarHBondContact O-N 2.8Å; T221-G224 PolarHBondContact OG1-N 2.79Å; T221-A225 HydrophobicContact CG2-CB 4.16Å; T221-A225 PolarHBondContact N-O 2.94Å; T221-A225 WeakPolarHBondContact OG1-CB 3.37Å; T221-A225 PolarHBondContact OG1-N 2.78Å; T221-A225 PolarHBondContact OG1-O 2.86Å; T221-V227 HydrophobicContact CG2-CG2 4.3Å; T221-P237 HydrophobicContact CG2-CG 3.93Å; T221-L240 HydrophobicContact CG2-CD2 4.12Å
222	P	76.5	Confident	80.6	Confident	56 Å²	56	56.6 Å²	56.6	36%	0.364	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.4	172.7	-20.7	35.3	0	0	0	112.8	G224 P237 R239 V251	P222-G224 VanDerWaalsContact C-N 3.33Å; P222-P237 VanDerWaalsContact CD-CG 3.42Å; P222-P237 HydrophobicContact CG-CB 4.49Å; P222-P237 HydrophobicContact CG-CG 4.35Å; P222-R239 WeakPolarHBondContact CD-O 3.35Å; P222-R239 HydrophobicContact CG-CB 4.26Å; P222-R239 WeakPolarHBondContact CG-O 3.29Å; P222-V251 WeakPolarHBondContact O-CG1 3.37Å; P222-V251 WeakPolarHBondContact O-CG2 3.41Å
223	S	71.4	Confident	80.4	Confident	103 Å²	103	56.2 Å²	56.2	72%	0.72	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-4.3	171.8	56.3	0	0	0	0	113.7	T221	T221-S223 PolarHBondContact O-N 2.96Å; T221-S223 VanDerWaalsContact O-N 3.16Å; T221-S223 PolarHBondContact OG1-N 2.98Å; T221-S223 PolarHBondContact OG1-OG 3.33Å
224	G	73.8	Confident	80.2	Confident	30 Å²	30	49.4 Å²	49.4	31%	0.309	29%	0.286	S	S	.	.	S	Bend	trans	91.2	4.8	179.1	0	0	0	0	0	115.3	Y220 T221 P222	Y220-G224 WeakPolarHBondContact CD1-O 3.41Å; T221-G224 PolarHBondContact O-N 2.8Å; T221-G224 PolarHBondContact OG1-N 2.79Å; P222-G224 VanDerWaalsContact C-N 3.33Å
225	A	76.3	Confident	80	Confident	52 Å²	52	54.7 Å²	54.7	43%	0.43	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-77.3	136.4	175.8	0	0	0	0	0	110.7	Y220 T221	Y220-A225 CarbonylContact C-O 3.59Å; Y220-A225 VanDerWaalsContact CA-O 3.23Å; Y220-A225 WeakPolarHBondContact CA-O 3.27Å; T221-A225 HydrophobicContact CG2-CB 4.16Å; T221-A225 PolarHBondContact N-O 2.94Å; T221-A225 WeakPolarHBondContact OG1-CB 3.37Å; T221-A225 PolarHBondContact OG1-N 2.78Å; T221-A225 PolarHBondContact OG1-O 2.86Å
226	R	80.9	Confident	79.8	Confident	103 Å²	103	53.4 Å²	53.4	39%	0.389	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.1	179.8	-169.9	174.8	177.1	-169.3	-2.5	110.7	L219 Y220 L228	L219-R226 WeakPolarHBondContact O-CA 3.35Å; Y220-R226 HydrophobicContact CD1-CB 4.01Å; Y220-R226 HydrophobicContact CD1-CG 4.47Å; Y220-R226 HydrophobicContact CE1-CB 3.81Å; Y220-R226 HydrophobicContact CE1-CG 4.13Å; R226-L228 HydrophobicContact CG-CD2 3.98Å; R226-L228 HydrophobicContact CG-CG 4.44Å
227	V	84	Confident	79.6	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120	173.7	177.4	0	0	0	0	108.1	L219 T221 D232 I233 L240	L219-V227 HydrophobicContact CB-CB 3.87Å; L219-V227 HydrophobicContact CB-CG1 4.48Å; L219-V227 HydrophobicContact CB-CG2 4.31Å; L219-V227 PolarHBondContact O-N 2.8Å; T221-V227 HydrophobicContact CG2-CG2 4.3Å; V227-D232 HydrophobicContact CG1-CB 3.9Å; V227-I233 HydrophobicContact CG1-CD1 4.29Å; V227-I233 HydrophobicContact CG1-CG1 3.56Å; V227-L240 HydrophobicContact CG2-CD1 4.11Å; V227-L240 HydrophobicContact CG2-CD2 3.73Å
228	L	77.5	Confident	79.8	Confident	97 Å²	97	58.4 Å²	58.4	51%	0.508	32%	0.324	S	S	.	.			trans	-116.2	-24.6	-177.1	-64.8	177.3	0	0	0	112.6	V201 R226 D232	V201-L228 WeakPolarHBondContact CG2-O 3.41Å; R226-L228 HydrophobicContact CG-CD2 3.98Å; R226-L228 HydrophobicContact CG-CG 4.44Å; L228-D232 PolarHBondContact N-OD2 2.81Å; L228-D232 VanDerWaalsContact N-OD2 3.14Å
229	R	75.3	Confident	79.9	Confident	142 Å²	142	61.5 Å²	61.5	54%	0.536	33%	0.334	S	S	.	.	S	Bend	trans	-121.5	153.2	-177.9	-57.4	-179.9	-176.7	173.1	4.4	112.1	E231 D232	R229-E231 HydrophobicContact CB-CB 4.49Å; R229-E231 PolarHBondContact O-N 2.84Å; R229-D232 PolarHBondContact N-OD2 2.87Å; R229-D232 WeakPolarHBondContact O-CB 3.43Å; R229-D232 PolarHBondContact O-N 2.99Å
230	S	77.2	Confident	80	Confident	26 Å²	26	61.6 Å²	61.6	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-64.5	-27.7	176.2	-54.4	0	0	0	0	111.7	L199 V201 D232 I233 L234	L199-S230 PolarHBondContact O-OG 2.98Å; V201-S230 PolarHBondContact N-OG 2.91Å; S230-D232 VanDerWaalsContact C-N 3.33Å; S230-I233 WeakPolarHBondContact O-CB 3.09Å; S230-I233 PolarHBondContact O-N 2.91Å; S230-L234 PolarHBondContact O-N 3.1Å
231	E	73.3	Confident	80.1	Confident	113 Å²	113	61 Å²	61	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-63.7	-35.4	172.3	-69.2	147.3	-169.4	0	0	112.5	R229 I233 L234 N235	R229-E231 HydrophobicContact CB-CB 4.49Å; R229-E231 PolarHBondContact O-N 2.84Å; E231-I233 PolarHBondContact O-N 2.97Å; E231-L234 PolarHBondContact O-N 2.55Å; E231-N235 WeakPolarHBondContact O-CB 3.39Å; E231-N235 PolarHBondContact O-N 3.03Å
232	D	78.8	Confident	80.4	Confident	61 Å²	61	60.2 Å²	60.2	33%	0.326	33%	0.329	S	S	.	.	H	α-helix	trans	-65.4	-27.8	177.6	-58.2	-29	0	0	0	111.3	V227 L228 R229 S230 G236	V227-D232 HydrophobicContact CG1-CB 3.9Å; L228-D232 PolarHBondContact N-OD2 2.81Å; L228-D232 VanDerWaalsContact N-OD2 3.14Å; R229-D232 PolarHBondContact N-OD2 2.87Å; R229-D232 WeakPolarHBondContact O-CB 3.43Å; R229-D232 PolarHBondContact O-N 2.99Å; S230-D232 VanDerWaalsContact C-N 3.33Å; D232-G236 WeakPolarHBondContact O-CA 3.36Å; D232-G236 PolarHBondContact O-N 3.42Å
233	I	82.7	Confident	80.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-72.3	-42.3	175.5	-58.6	174.1	0	0	0	110.1	K174 V176 F178 F192 V204 V227 S230 E231 L240	K174-I233 PolarHBondContact NZ-O 2.69Å; V176-I233 HydrophobicContact CB-CG2 4.41Å; V176-I233 HydrophobicContact CG1-CG2 4.43Å; V176-I233 HydrophobicContact CG2-CG2 3.92Å; F178-I233 HydrophobicContact CZ-CG2 4.37Å; F192-I233 HydrophobicContact CD1-CG2 4.4Å; F192-I233 HydrophobicContact CD2-CG2 3.84Å; F192-I233 HydrophobicContact CE1-CG2 4.16Å; F192-I233 HydrophobicContact CE2-CG2 3.56Å; F192-I233 HydrophobicContact CG-CG2 4.27Å; F192-I233 HydrophobicContact CZ-CG2 3.74Å; V204-I233 HydrophobicContact CB-CD1 4.34Å; V204-I233 HydrophobicContact CG1-CD1 4.13Å; V204-I233 HydrophobicContact CG2-CD1 4.06Å; V227-I233 HydrophobicContact CG1-CD1 4.29Å; V227-I233 HydrophobicContact CG1-CG1 3.56Å; S230-I233 WeakPolarHBondContact O-CB 3.09Å; S230-I233 PolarHBondContact O-N 2.91Å; E231-I233 PolarHBondContact O-N 2.97Å; I233-L240 HydrophobicContact CB-CD1 4.49Å; I233-L240 HydrophobicContact CG1-CD1 4.11Å; I233-L240 HydrophobicContact CG2-CD1 4.22Å
234	L	76.9	Confident	81.5	Confident	28 Å²	28	57 Å²	57	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-71.2	-44.7	177.4	-79.2	-176.4	0	0	0	112.8	K174 F192 P194 L197 S230 E231	K174-L234 HydrophobicContact CB-CD2 4.05Å; K174-L234 WeakPolarHBondContact CD-O 3.41Å; K174-L234 WeakPolarHBondContact CE-O 3.4Å; K174-L234 PolarHBondContact NZ-O 3.3Å; F192-L234 HydrophobicContact CB-CD2 3.47Å; F192-L234 VanDerWaalsContact CB-CD2 3.47Å; F192-L234 HydrophobicContact CB-CG 4.35Å; P194-L234 HydrophobicContact CG-CD1 4.49Å; L197-L234 HydrophobicContact CD1-CD1 3.16Å; L197-L234 HydrophobicContact CD1-CG 4.28Å; L197-L234 HydrophobicContact CD2-CD1 4.01Å; L197-L234 HydrophobicContact CD2-CG 4.35Å; L197-L234 HydrophobicContact CG-CD1 3.75Å; S230-L234 PolarHBondContact O-N 3.1Å; E231-L234 PolarHBondContact O-N 2.55Å
235	N	76.6	Confident	81.3	Confident	143 Å²	143	59.6 Å²	59.6	77%	0.765	30%	0.299	S	S	*	.	H	α-helix	trans	-88.1	-12.8	-177.3	-65.6	-27.3	0	0	0	113.2	E231	E231-N235 WeakPolarHBondContact O-CB 3.39Å; E231-N235 PolarHBondContact O-N 3.03Å
236	G	78	Confident	80.9	Confident	29 Å²	29	63.4 Å²	63.4	30%	0.299	31%	0.307	S	S	.	.	S	Bend	trans	-80.4	-162	-178.4	0	0	0	0	0	114.6	K174 D232	K174-G236 PolarHBondContact NZ-O 2.93Å; D232-G236 WeakPolarHBondContact O-CA 3.36Å; D232-G236 PolarHBondContact O-N 3.42Å
237	P	81.9	Confident	80.3	Confident	48 Å²	48	61 Å²	61	31%	0.312	30%	0.302	S	S	.	.			trans	-73.6	158.7	176.1	28	-31.2	0	0	0	112.6	T221 P222 R239 L240	T221-P237 HydrophobicContact CG2-CG 3.93Å; P222-P237 VanDerWaalsContact CD-CG 3.42Å; P222-P237 HydrophobicContact CG-CB 4.49Å; P222-P237 HydrophobicContact CG-CG 4.35Å; P237-R239 PolarHBondContact O-N 2.84Å; P237-L240 HydrophobicContact CG-CD2 4Å
238	D	86	Confident	79.4	Confident	102 Å²	102	70 Å²	70	55%	0.545	34%	0.335	S	S	.	.	S	Bend	trans	-71.4	-5.7	177.1	-62.8	-27	0	0	0	113.6	K174 V176 E177	K174-D238 WeakPolarHBondContact CE-OD1 3.37Å; V176-D238 CarbonylContact C-O 3.47Å; V176-D238 WeakPolarHBondContact CA-O 3.43Å; E177-D238 PolarHBondContact N-O 3.1Å
239	R	89	Confident	79	Confident	103 Å²	103	66.8 Å²	66.8	39%	0.389	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	130.2	179.2	-51.7	-179.2	85.3	-172.7	7.8	109.5	E177 P222 P237	E177-R239 HydrophobicContact CB-CG 4.44Å; E177-R239 CarbonylContact O-C 3.48Å; E177-R239 WeakPolarHBondContact O-CA 3.47Å; E177-R239 IonicContact OE1-NH2 3.44Å; E177-R239 IonicContact OE2-CZ 2.91Å; E177-R239 IonicContact OE2-NE 3.91Å; E177-R239 PolarHBondContact OE2-NE 2.91Å; E177-R239 IonicContact OE2-NH2 3.49Å; E177-R239 PolarHBondContact OE2-NH2 2.61Å; P222-R239 WeakPolarHBondContact CD-O 3.35Å; P222-R239 HydrophobicContact CG-CB 4.26Å; P222-R239 WeakPolarHBondContact CG-O 3.29Å; P237-R239 PolarHBondContact O-N 2.84Å
240	L	92	Very high	78.6	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	149.8	176.2	-66.8	178.3	0	0	0	110.3	V176 E177 F178 I179 Y220 T221 V227 I233 P237	V176-L240 HydrophobicContact CG1-CB 4.41Å; V176-L240 HydrophobicContact CG1-CD1 3.88Å; V176-L240 HydrophobicContact CG1-CG 3.88Å; E177-L240 PolarHBondContact O-N 3.43Å; F178-L240 CarbonylContact C-O 3.55Å; F178-L240 VanDerWaalsContact CA-O 3.31Å; F178-L240 WeakPolarHBondContact CA-O 3.44Å; F178-L240 HydrophobicContact CD1-CB 3.73Å; F178-L240 HydrophobicContact CD1-CD1 4.34Å; F178-L240 HydrophobicContact CE1-CB 3.84Å; F178-L240 HydrophobicContact CE1-CD1 3.57Å; F178-L240 HydrophobicContact CE1-CG 4.29Å; F178-L240 HydrophobicContact CZ-CD1 4.11Å; I179-L240 PolarHBondContact N-O 2.85Å; Y220-L240 CarbonylContact O-C 3.54Å; Y220-L240 WeakPolarHBondContact O-CA 3.38Å; T221-L240 HydrophobicContact CG2-CD2 4.12Å; V227-L240 HydrophobicContact CG2-CD1 4.11Å; V227-L240 HydrophobicContact CG2-CD2 3.73Å; I233-L240 HydrophobicContact CB-CD1 4.49Å; I233-L240 HydrophobicContact CG1-CD1 4.11Å; I233-L240 HydrophobicContact CG2-CD1 4.22Å; P237-L240 HydrophobicContact CG-CD2 4Å
241	I	90.1	Very high	77.2	Confident	22 Å²	22	66 Å²	66	11%	0.113	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122.9	178	-55.6	173.8	0	0	0	108.3	I179 N181 L219 Y220 P249	I179-I241 CarbonylContact O-C 3.59Å; I179-I241 WeakPolarHBondContact O-CA 3.44Å; N181-I241 HydrophobicContact CB-CG2 3.92Å; L219-I241 CarbonylContact C-O 3.49Å; L219-I241 WeakPolarHBondContact CA-O 3.3Å; Y220-I241 PolarHBondContact N-O 3.1Å; Y220-I241 PolarHBondContact O-N 2.83Å; I241-P249 HydrophobicContact CD1-CB 4.38Å; I241-P249 HydrophobicContact CG2-CB 4.47Å
242	A	90.7	Very high	75.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	117.9	174.1	0	0	0	0	0	110.3	I179 N181 F212 V216 L219	I179-A242 PolarHBondContact O-N 2.89Å; N181-A242 WeakPolarHBondContact CB-O 3.37Å; N181-A242 PolarHBondContact N-O 3.3Å; F212-A242 HydrophobicContact CD2-CB 4.34Å; F212-A242 HydrophobicContact CE2-CB 3.91Å; V216-A242 HydrophobicContact CG1-CB 3.76Å; V216-A242 HydrophobicContact CG2-CB 4.05Å; L219-A242 HydrophobicContact CD2-CB 4.01Å
243	C	86.8	Confident	73.7	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	145.8	-177.4	-67.2	0	0	0	0	111.7	N181 A217 K218 Y220 D247	N181-C243 HydrophobicContact CB-CB 4.4Å; N181-C243 VanDerWaalsContact CB-SG 3.6Å; A217-C243 PolarHBondContact N-O 2.85Å; K218-C243 HydrophobicContact CB-CB 4.29Å; K218-C243 PolarHBondContact N-O 3.35Å; K218-C243 PolarHBondContact O-N 3.48Å; Y220-C243 HydrophobicContact CD2-CB 4.16Å; Y220-C243 HydrophobicContact CE2-CB 4.06Å; C243-D247 HydrophobicContact CB-CB 4.27Å
244	K	83.8	Confident	71.1	Confident	90 Å²	90	88.3 Å²	88.3	39%	0.391	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	163.3	165.2	-51.1	-175.9	-164.2	-173.3	0	109.9	V214 H246 D247	V214-K244 HydrophobicContact CG1-CD 3.74Å; V214-K244 VanDerWaalsContact CG1-CE 3.44Å; V214-K244 HydrophobicContact CG1-CG 3.59Å; K244-H246 PolarHBondContact O-N 3.48Å; K244-H246 VanDerWaalsContact O-N 3.08Å; K244-D247 HydrophobicContact CB-CB 4.34Å; K244-D247 WeakPolarHBondContact CB-OD2 3.48Å; K244-D247 WeakPolarHBondContact CG-OD2 3.4Å; K244-D247 PolarHBondContact O-N 3.36Å; K244-D247 VanDerWaalsContact O-N 3.09Å
245	K	70.6	Confident	68.8	Low	85 Å²	85	91 Å²	91	37%	0.37	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-37.9	-174.3	-166.7	175	-178.2	178.9	0	114.4	A217 K218	A217-K245 HydrophobicContact CB-CB 3.83Å; A217-K245 HydrophobicContact CB-CG 4.27Å; K218-K245 WeakPolarHBondContact CE-O 3.36Å; K218-K245 PolarHBondContact NZ-O 3.14Å
246	H	66.3	Low	66.5	Low	132 Å²	132	93.2 Å²	93.2	61%	0.611	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-1.5	-176.4	-57.1	-75.6	0	0	0	114.2	K244	K244-H246 PolarHBondContact O-N 3.48Å; K244-H246 VanDerWaalsContact O-N 3.08Å
247	D	68.7	Low	63.9	Low	52 Å²	52	99.1 Å²	99.1	28%	0.278	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-84.7	133.8	-176.9	-73.1	-10.2	0	0	0	111.5	C243 K244	C243-D247 HydrophobicContact CB-CB 4.27Å; K244-D247 HydrophobicContact CB-CB 4.34Å; K244-D247 WeakPolarHBondContact CB-OD2 3.48Å; K244-D247 WeakPolarHBondContact CG-OD2 3.4Å; K244-D247 PolarHBondContact O-N 3.36Å; K244-D247 VanDerWaalsContact O-N 3.09Å
248	R	64.9	Low	61.2	Low	196 Å²	196	102.5 Å²	102.5	74%	0.74	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-85.3	138.4	166.9	-64.8	-172.9	-178	-162.1	2.7	109.5	N181 V250	N181-R248 PolarHBondContact ND2-O 3.24Å; R248-V250 PolarHBondContact O-N 3.25Å
249	P	69.7	Low	58.4	Low	30 Å²	30	102.7 Å²	102.7	20%	0.195	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-63.9	127.4	-179.9	27.2	-34.9	0	0	0	111.1	Y220 I241 V251	Y220-P249 HydrophobicContact CD1-CG 3.83Å; Y220-P249 HydrophobicContact CD2-CB 4.03Å; Y220-P249 HydrophobicContact CD2-CG 3.95Å; Y220-P249 HydrophobicContact CE1-CG 4.12Å; Y220-P249 HydrophobicContact CE2-CG 4.23Å; Y220-P249 HydrophobicContact CG-CB 3.96Å; Y220-P249 HydrophobicContact CG-CG 3.73Å; I241-P249 HydrophobicContact CD1-CB 4.38Å; I241-P249 HydrophobicContact CG2-CB 4.47Å; P249-V251 PolarHBondContact O-N 3.49Å
250	V	66	Low	55.3	Low	83 Å²	83	105.8 Å²	105.8	50%	0.503	52%	0.515	S	S	.	.			trans	-84.3	95.7	174.1	-176.7	0	0	0	0	109.2	N181 R248 R252	N181-V250 PolarHBondContact OD1-N 3.24Å; R248-V250 PolarHBondContact O-N 3.25Å; V250-R252 HydrophobicContact CG1-CG 4.32Å; V250-R252 PolarHBondContact O-N 3.39Å
251	V	48.7	Very low	52	Low	69 Å²	69	111 Å²	111	42%	0.418	55%	0.547	S	S	.	.			trans	-79.5	95.7	174	179.3	0	0	0	0	109	P222 P249 K253	P222-V251 WeakPolarHBondContact O-CG1 3.37Å; P222-V251 WeakPolarHBondContact O-CG2 3.41Å; P249-V251 PolarHBondContact O-N 3.49Å; V251-K253 PolarHBondContact O-N 2.76Å
252	R	46	Very low	48.9	Very low	203 Å²	203	118.3 Å²	118.3	77%	0.766	58%	0.58	S	S	*	*			trans	-70.6	115.2	171	-69.5	-170.3	179.1	-176.4	0	108.9	V250 R254	V250-R252 HydrophobicContact CG1-CG 4.32Å; V250-R252 PolarHBondContact O-N 3.39Å; R252-R254 PolarHBondContact O-N 2.92Å
253	K	31.7	Very low	45.6	Very low	189 Å²	189	129.1 Å²	129.1	82%	0.822	62%	0.621	S	S	*	*			trans	-54.5	137.8	170.4	-73.9	-177.8	177.8	179.5	0	108.8	V251 S255	V251-K253 PolarHBondContact O-N 2.76Å; K253-S255 PolarHBondContact O-N 3.4Å
254	R	28.5	Very low	42.5	Very low	249 Å²	249	134.3 Å²	134.3	94%	0.94	66%	0.657	S	S	*	*	S	Bend	trans	-71.2	44.4	-167.6	-156.8	-178.9	-173.3	174.6	1.1	114.7	R252	R252-R254 PolarHBondContact O-N 2.92Å
255	S	29.5	Very low	39.6	Very low	86 Å²	86	139.4 Å²	139.4	60%	0.601	69%	0.685	S	S	*	*			trans	-110.3	133.2	163.9	51.8	0	0	0	0	107.5	K253	K253-S255 PolarHBondContact O-N 3.4Å
256	E	26.7	Very low	37.2	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	71%	0.706	S	S	*	*			trans	89.3	61.3	-178.9	-49.8	172.8	-159.8	0	0	115.5
257	L	25.1	Very low	35.2	Very low	153 Å²	153	144.3 Å²	144.3	80%	0.801	71%	0.714	S	S	*	*			trans	-95.8	127.8	142.5	-85.7	161.4	0	0	0	107.1	S259	L257-S259 PolarHBondContact O-N 2.91Å
258	P	25.1	Very low	32.9	Very low	119 Å²	119	149.9 Å²	149.9	77%	0.773	74%	0.738	S	S	*	*			trans	-76.1	120	-175.6	29.3	-31.4	0	0	0	110.1	I260	P258-I260 PolarHBondContact O-N 2.86Å
259	S	25.8	Very low	30.8	Very low	107 Å²	107	146.9 Å²	146.9	75%	0.748	74%	0.741	S	S	*	*			trans	-66.4	115.6	166.9	47.5	0	0	0	0	109.4	L257 T261	L257-S259 PolarHBondContact O-N 2.91Å; S259-T261 PolarHBondContact O-N 3.17Å
260	I	23.9	Very low	28.6	Very low	167 Å²	167	151 Å²	151	86%	0.856	77%	0.771	S	S	*	*			trans	-67.3	97.6	161.8	-71.6	171.2	0	0	0	106.7	P258	P258-I260 PolarHBondContact O-N 2.86Å
261	T	23.4	Very low	26.5	Very low	110 Å²	110	150.2 Å²	150.2	68%	0.675	78%	0.779	S	S	*	*			trans	-172.1	120.4	148.4	34.2	0	0	0	0	109.7	S259	S259-T261 PolarHBondContact O-N 3.17Å
262	E	25.1	Very low	25.4	Very low	176 Å²	176	155.9 Å²	155.9	82%	0.822	81%	0.806	S	S	*	*			trans	75.5	106.9	148	-59.5	-172.2	162.3	0	0	120.5
263	R	21.7	Very low	24.2	Very low	228 Å²	228	155 Å²	155	86%	0.86	81%	0.811	S	S	*	*				57.3	116.2	129.8	-75.5	-178.1	174.4	178.2	-0.7	119.5
264	S	21.5	Very low	23.8	Very low	108 Å²	108	155.2 Å²	155.2	76%	0.755	81%	0.812	S	S	*	*				63.5	102.3	127.4	-51.4	0	0	0	0	118
265	M	22.8	Very low	23.5	Very low	198 Å²	198	154.7 Å²	154.7	98%	0.975	81%	0.81	S	S	*	*				-166.5	139.4	122.9	-106.9	169.8	-172	0	0	111.1
266	E	20.5	Very low	23.4	Very low	172 Å²	172	158.9 Å²	158.9	80%	0.804	83%	0.825	S	S	*	*			trans	-74.3	169.5	177.8	-63.4	166.9	139.1	0	0	112.4
267	L	23	Very low	23.1	Very low	148 Å²	148	155.6 Å²	155.6	78%	0.775	82%	0.817	S	S	*	*			trans	74	136.9	164.6	-61.6	132.9	0	0	0	114.7
268	E	21.8	Very low	22.9	Very low	169 Å²	169	154.9 Å²	154.9	79%	0.79	81%	0.814	S	S	*	*			cis	-160.4	148	23.8	-139	170.7	-145.2	0	0	110.5
269	V	20.8	Very low	23	Very low	133 Å²	133	157.2 Å²	157.2	81%	0.806	82%	0.82	S	S	*	*			trans	-82.3	126.4	170	169.9	0	0	0	0	108.3
270	S	22.8	Very low	22.7	Very low	116 Å²	116	159.2 Å²	159.2	81%	0.811	82%	0.823	S	S	*	*			trans	158.9	142.1	132.5	55.4	0	0	0	0	113.4
271	G	23.2	Very low	22.8	Very low	67 Å²	67	156.1 Å²	156.1	69%	0.691	82%	0.816	S	S	*	*			trans	103.8	92.4	148.5	0	0	0	0	0	116.3
272	L	25.3	Very low	22.9	Very low	188 Å²	188	158.5 Å²	158.5	98%	0.984	82%	0.823	S	S	*	*			trans	-176.2	70.6	130.1	-94.7	152.4	0	0	0	109.3
273	Q	20.2	Very low	23.2	Very low	184 Å²	184	155.2 Å²	155.2	86%	0.86	82%	0.817	S	S	*	*			trans	-114	137.7	158.9	-116	-176.8	-3.4	0	0	107.2
274	K	23	Very low	23.3	Very low	194 Å²	194	150.9 Å²	150.9	84%	0.843	82%	0.82	S	S	*	*			trans	84.3	102.7	173.6	-56.5	177.9	177.6	175.8	0	116.7
275	R	22.1	Very low	23.4	Very low	237 Å²	237	153.9 Å²	153.9	89%	0.894	83%	0.827	S	S	*	*				168	127.1	102.6	-92.6	173.4	178.9	-176.4	-0.4	108.4
276	L	27.3	Very low	23.3	Very low	175 Å²	175	149.2 Å²	149.2	92%	0.916	81%	0.814	S	S	*	*				-169.7	123.2	118.5	-94	156	0	0	0	108.3
277	V	20.8	Very low	23.4	Very low	119 Å²	119	147.7 Å²	147.7	72%	0.721	82%	0.816	S	S	*	*			trans	-120.7	143.4	-180	157.6	0	0	0	0	104.3
278	N	21.7	Very low	23.3	Very low	138 Å²	138	149 Å²	149	74%	0.738	82%	0.818	S	S	*	*			trans	80.5	110.2	170.4	-59.4	-16	0	0	0	117.5
279	D	25.3	Very low	23.4	Very low	167 Å²	167	146.5 Å²	146.5	89%	0.893	82%	0.819	S	S	*	*				-139.5	109.1	125.5	-116.1	-21.7	0	0	0	109.3
280	D	21.5	Very low	23.3	Very low	150 Å²	150	146.9 Å²	146.9	80%	0.802	82%	0.822	S	S	*	*			trans	-107	124.2	166.7	-97.3	-31.6	0	0	0	106.7
281	S	25.7	Very low	23.4	Very low	102 Å²	102	145.8 Å²	145.8	71%	0.713	82%	0.82	S	S	*	*			trans	159.4	138.2	158.4	40.6	0	0	0	0	107.9
282	L	25.2	Very low	23.3	Very low	159 Å²	159	151.9 Å²	151.9	83%	0.832	83%	0.83	S	S	*	*			cis	-177.2	-178.3	18.1	-100.3	158.9	0	0	0	105.1
283	P	30.9	Very low	23.2	Very low	108 Å²	108	149 Å²	149	70%	0.701	82%	0.821	S	S	*	*				-123.8	149.8	-75.5	32	-12.2	0	0	0	112.7
284	C	24	Very low	23.4	Very low	136 Å²	136	146 Å²	146	92%	0.919	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-103.7	125.6	168.9	-70.7	0	0	0	0	111.1	S286	C284-S286 PolarHBondContact O-N 3.34Å
285	L	23.7	Very low	23.3	Very low	171 Å²	171	146.2 Å²	146.2	90%	0.895	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-58	127.6	178.3	-85.8	124.2	0	0	0	112.4
286	S	21	Very low	23.4	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.1	127.6	167.5	52.4	0	0	0	0	111.4	C284	C284-S286 PolarHBondContact O-N 3.34Å
287	V	23.1	Very low	23	Very low	139 Å²	139	139.2 Å²	139.2	84%	0.842	81%	0.809	S	S	*	*			trans	-117.7	109	153.2	178.1	0	0	0	0	106.8
288	Q	20	Very low	23.1	Very low	177 Å²	177	138.8 Å²	138.8	83%	0.827	81%	0.812	S	S	*	*			trans	-72.3	129.3	172.4	-69.6	172.5	-14	0	0	108.9
289	S	23.3	Very low	23.3	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	82%	0.82	S	S	*	*			trans	-136.8	99	157.8	-174.5	0	0	0	0	108.2
290	T	19.2	Very low	23	Very low	140 Å²	140	144.3 Å²	144.3	86%	0.859	82%	0.821	S	S	*	*			trans	-88	114.3	162.9	45.9	0	0	0	0	107.7
291	A	24.8	Very low	23.2	Very low	93 Å²	93	146.7 Å²	146.7	77%	0.769	83%	0.828	S	S	*	*			trans	-152.2	116.3	158.3	0	0	0	0	0	109.3
292	E	21.7	Very low	22.9	Very low	195 Å²	195	148.6 Å²	148.6	91%	0.911	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-73.4	147.8	-174.5	-65.8	177.8	139	0	0	112.9
293	V	22.2	Very low	22.7	Very low	128 Å²	128	148.4 Å²	148.4	78%	0.776	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.7	130	175.9	173.4	0	0	0	0	110.4
294	P	24.1	Very low	22.5	Very low	121 Å²	121	151.3 Å²	151.3	79%	0.786	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-82.7	132.1	165.1	4.3	12.8	0	0	0	111.1
295	K	21	Very low	22.3	Very low	198 Å²	198	156 Å²	156	86%	0.861	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-69.7	121.8	178	-65.3	165.2	177.2	167.2	0	111.1
296	G	24.1	Very low	22.3	Very low	81 Å²	81	153.1 Å²	153.1	84%	0.835	82%	0.823	S	S	*	*			trans	-105.1	113.2	160.9	0	0	0	0	0	110.2
297	K	20.6	Very low	22.6	Very low	184 Å²	184	154.3 Å²	154.3	80%	0.8	83%	0.828	S	S	*	*			trans	-95	149.6	180	-73.7	180	175.3	175.4	0	111.5
298	S	21.6	Very low	22.5	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	82%	0.821	S	S	*	*			trans	80.9	117.1	148.2	-58.1	0	0	0	0	119.1
299	K	26.2	Very low	22.8	Very low	210 Å²	210	153.9 Å²	153.9	91%	0.913	83%	0.826	S	S	*	*				-167.9	137.4	92.8	-102.5	175.5	179.2	176.7	0	112
300	K	20.2	Very low	22.8	Very low	212 Å²	212	153.6 Å²	153.6	92%	0.922	83%	0.831	S	S	*	*			trans	-67.8	139.9	172.6	-68.8	171.1	170.8	179.4	0	110.4
301	Q	25.3	Very low	23.1	Very low	200 Å²	200	151.5 Å²	151.5	94%	0.935	83%	0.828	S	S	*	*			trans	-141.9	158.4	144.2	-159.6	164.6	0.4	0	0	109
302	M	18.7	Very low	23.1	Very low	142 Å²	142	150.9 Å²	150.9	70%	0.7	83%	0.831	S	S	*	*			trans	-124.1	157.1	-137.5	174.4	175.5	80.1	0	0	109.2
303	E	21.5	Very low	23.3	Very low	154 Å²	154	148.8 Å²	148.8	72%	0.72	82%	0.824	S	S	*	*			trans	70.5	139.9	165.5	-74.2	156	-169.5	0	0	116.6
304	L	26.6	Very low	23.7	Very low	170 Å²	170	145.5 Å²	145.5	89%	0.89	82%	0.816	S	S	*	*			cis	-137.3	160.4	30.9	-87.8	94	0	0	0	113.5
305	R	19.6	Very low	23.9	Very low	233 Å²	233	149.6 Å²	149.6	88%	0.879	82%	0.822	S	S	*	*			trans	-94.1	139.8	-179.1	-74.6	179.6	168.8	-165.5	-2.5	113.4
306	S	23.5	Very low	24.3	Very low	111 Å²	111	147.9 Å²	147.9	78%	0.776	81%	0.814	S	S	*	*			trans	67	160.5	141.9	-48.3	0	0	0	0	120.3
307	P	27.2	Very low	24.7	Very low	126 Å²	126	147.8 Å²	147.8	82%	0.818	80%	0.795	S	S	*	*			cis	-121.3	154.8	-4.1	36.5	-19.5	0	0	0	112.1
308	G	21.6	Very low	25.6	Very low	66 Å²	66	144.7 Å²	144.7	68%	0.68	79%	0.791	S	S	*	*				104.5	69.1	55.5	0	0	0	0	0	111.2
309	Y	25.3	Very low	26.2	Very low	241 Å²	241	148.7 Å²	148.7	95%	0.945	79%	0.79	S	S	*	*			trans	-146.3	80.4	156.2	-95.2	-80.6	0	0	0	108.3
310	A	23.7	Very low	26.9	Very low	110 Å²	110	142 Å²	142	91%	0.909	76%	0.764	S	S	*	*			trans	-100.8	95.2	170.6	0	0	0	0	0	107.9
311	A	26.5	Very low	27.5	Very low	96 Å²	96	140 Å²	140	79%	0.793	76%	0.755	S	S	*	*			trans	-137.4	111.8	167.9	0	0	0	0	0	108.4
312	G	24.9	Very low	27.9	Very low	80 Å²	80	135 Å²	135	83%	0.825	74%	0.742	S	S	*	*			trans	96.5	32.3	162.2	0	0	0	0	0	117.9	G314	G312-G314 VanDerWaalsContact C-N 3.26Å; G312-G314 PolarHBondContact O-N 2.82Å
313	I	26	Very low	28.9	Very low	151 Å²	151	132.1 Å²	132.1	77%	0.774	74%	0.735	S	S	*	*			trans	-73.3	94.1	155.1	-58.1	177.7	0	0	0	106	K315 F316	I313-K315 PolarHBondContact O-N 2.9Å; I313-F316 HydrophobicContact CG2-CD2 4.34Å
314	G	29.6	Very low	29.7	Very low	59 Å²	59	131.4 Å²	131.4	61%	0.608	73%	0.733	S	S	*	*			trans	-46.2	128.2	167.2	0	0	0	0	0	108.5	G312 F316	G312-G314 VanDerWaalsContact C-N 3.26Å; G312-G314 PolarHBondContact O-N 2.82Å; G314-F316 PolarHBondContact O-N 2.78Å
315	K	29	Very low	30.5	Very low	207 Å²	207	132.7 Å²	132.7	90%	0.9	73%	0.732	S	S	*	*			trans	-47.6	106.6	178.9	-69.7	174.7	177.9	174.6	0	108.2	I313 D317	I313-K315 PolarHBondContact O-N 2.9Å; K315-D317 PolarHBondContact O-N 2.95Å
316	F	28.7	Very low	31.7	Very low	162 Å²	162	124.5 Å²	124.5	71%	0.711	71%	0.71	S	S	*	*			trans	-51	114.8	170	-97.9	-92.7	0	0	0	107.3	I313 G314 T318 L320	I313-F316 HydrophobicContact CG2-CD2 4.34Å; G314-F316 PolarHBondContact O-N 2.78Å; F316-T318 PolarHBondContact O-N 3.41Å; F316-L320 HydrophobicContact CD1-CD1 3.96Å; F316-L320 HydrophobicContact CE1-CD1 4.46Å
317	D	33.6	Very low	33.1	Very low	80 Å²	80	124.6 Å²	124.6	43%	0.428	72%	0.718	S	S	.	*			trans	-51.3	123.8	-178.8	-172.5	-8.8	0	0	0	108.8	K315 R319 L320	K315-D317 PolarHBondContact O-N 2.95Å; D317-R319 PolarHBondContact O-N 2.83Å; D317-R319 WeakPolarHBondContact OD1-CG 3.36Å; D317-R319 PolarHBondContact OD1-N 3.21Å; D317-R319 WeakPolarHBondContact OD2-CD 3.39Å; D317-R319 IonicContact OD2-NE 2.84Å; D317-L320 PolarHBondContact O-N 3.45Å
318	T	38.5	Very low	35.1	Very low	118 Å²	118	125.9 Å²	125.9	72%	0.724	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-14.4	179.4	35.9	0	0	0	0	113.4	F316 L320 K321	F316-T318 PolarHBondContact O-N 3.41Å; T318-L320 VanDerWaalsContact C-N 3.3Å; T318-L320 PolarHBondContact O-N 3.28Å; T318-K321 PolarHBondContact O-N 3.41Å
319	R	35.2	Very low	37.9	Very low	194 Å²	194	127 Å²	127	73%	0.732	70%	0.701	S	S	*	*	H	α-helix	trans	-61.9	-29.2	170.5	-65.8	179.6	-165.8	-173.7	4	114	D317 K321 S322	D317-R319 PolarHBondContact O-N 2.83Å; D317-R319 WeakPolarHBondContact OD1-CG 3.36Å; D317-R319 PolarHBondContact OD1-N 3.21Å; D317-R319 WeakPolarHBondContact OD2-CD 3.39Å; D317-R319 IonicContact OD2-NE 2.84Å; R319-K321 PolarHBondContact O-N 2.76Å; R319-S322 PolarHBondContact O-OG 3.5Å; R319-S322 VanDerWaalsContact O-OG 3.14Å
320	L	39.7	Very low	40.9	Very low	70 Å²	70	116.1 Å²	116.1	37%	0.366	66%	0.66	S	S	.	*	H	α-helix	trans	-69.7	-30.5	179.5	-87.3	147.6	0	0	0	113.1	F316 D317 T318 M324	F316-L320 HydrophobicContact CD1-CD1 3.96Å; F316-L320 HydrophobicContact CE1-CD1 4.46Å; D317-L320 PolarHBondContact O-N 3.45Å; T318-L320 VanDerWaalsContact C-N 3.3Å; T318-L320 PolarHBondContact O-N 3.28Å; L320-M324 WeakPolarHBondContact O-CG 3.22Å
321	K	34	Very low	44.1	Very low	169 Å²	169	112.3 Å²	112.3	74%	0.735	62%	0.624	S	S	*	*	H	α-helix	trans	-78.4	-26.4	179.9	-80.4	-176.1	177	176.2	0	113.6	T318 R319	T318-K321 PolarHBondContact O-N 3.41Å; R319-K321 PolarHBondContact O-N 2.76Å
322	S	33.7	Very low	47.2	Very low	95 Å²	95	107.8 Å²	107.8	66%	0.664	59%	0.587	S	S	*	*	H	α-helix	trans	-79.5	-25.4	178.9	59.8	0	0	0	0	113	R319	R319-S322 PolarHBondContact O-OG 3.5Å; R319-S322 VanDerWaalsContact O-OG 3.14Å
323	C	38.4	Very low	50.5	Low	83 Å²	83	106.7 Å²	106.7	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-80.4	-23.9	177.1	-158.4	0	0	0	0	113.3	K325	C323-K325 PolarHBondContact O-N 2.9Å
324	M	38	Very low	53.8	Low	138 Å²	138	99.6 Å²	99.6	68%	0.68	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.1	-175.6	-77.3	-172.3	154.8	0	0	115.7	L320	L320-M324 WeakPolarHBondContact O-CG 3.22Å
325	K	43.3	Very low	56.9	Low	197 Å²	197	97.6 Å²	97.6	86%	0.857	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	4.1	-170.3	-75	-169.7	177	-175.6	0	115.7	C323	C323-K325 PolarHBondContact O-N 2.9Å
326	S	45	Very low	60.2	Low	61 Å²	61	87.8 Å²	87.8	43%	0.427	46%	0.456	S	S	.	.	S	Bend	trans	-128.3	127.9	170.7	-166.8	0	0	0	0	107.1	K328	S326-K328 PolarHBondContact O-N 3.29Å; S326-K328 VanDerWaalsContact OG-CE 3.29Å; S326-K328 WeakPolarHBondContact OG-CE 3.26Å; S326-K328 WeakPolarHBondContact OG-CG 3.24Å
327	A	52.6	Low	63.4	Low	114 Å²	114	82.8 Å²	82.8	94%	0.942	43%	0.433	S	S	*	.			trans	-67.4	54	175.7	0	0	0	0	0	111.2
328	K	69.9	Low	66.3	Low	152 Å²	152	79.1 Å²	79.1	66%	0.661	41%	0.414	S	S	*	.			trans	-86.2	129.7	-177.1	-77.3	175.3	178.8	-174.6	0	107.8	S326 C330	S326-K328 PolarHBondContact O-N 3.29Å; S326-K328 VanDerWaalsContact OG-CE 3.29Å; S326-K328 WeakPolarHBondContact OG-CE 3.26Å; S326-K328 WeakPolarHBondContact OG-CG 3.24Å; K328-C330 PolarHBondContact O-N 2.81Å
329	N	81.3	Confident	68.9	Low	90 Å²	90	73.6 Å²	73.6	48%	0.481	38%	0.38	S	S	.	.			trans	-45.6	138.3	170	-65.8	-19	0	0	0	110.5	W386 S387	N329-W386 HydrophobicContact CB-CE3 4.03Å; N329-W386 WeakPolarHBondContact O-CZ3 3.33Å; N329-S387 CarbonylContact C-O 3.19Å; N329-S387 WeakPolarHBondContact CA-O 3.22Å
330	C	86.9	Confident	71.6	Confident	13 Å²	13	69.3 Å²	69.3	9%	0.088	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	156.3	172.6	-63.4	0	0	0	0	109.3	K328 Y332 S387	K328-C330 PolarHBondContact O-N 2.81Å; C330-Y332 HydrophobicContact CB-CE2 4.33Å; C330-S387 PolarHBondContact N-O 3.33Å; C330-S387 PolarHBondContact O-N 2.83Å; C330-S387 VanDerWaalsContact O-O 3.08Å
331	L	90.8	Very high	74	Confident	30 Å²	30	67.9 Å²	67.9	16%	0.157	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.6	176	-177	65.1	0	0	0	109.1	E384 W386	L331-E384 HydrophobicContact CD1-CB 3.96Å; L331-E384 HydrophobicContact CD1-CG 4.4Å; L331-W386 HydrophobicContact CB-CE3 4.38Å; L331-W386 HydrophobicContact CB-CH2 4.2Å; L331-W386 HydrophobicContact CB-CZ2 4.38Å; L331-W386 HydrophobicContact CB-CZ3 4.19Å; L331-W386 HydrophobicContact CD1-CD2 4.16Å; L331-W386 HydrophobicContact CD1-CG 4.42Å; L331-W386 HydrophobicContact CD1-CZ2 4.18Å
332	Y	92.8	Very high	76.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.7	170.8	-70.3	-83.5	0	0	0	109.2	C330 F354 V385 L390 L393 V416 S417 E418	C330-Y332 HydrophobicContact CB-CE2 4.33Å; Y332-F354 HydrophobicContact CG-CE2 4.29Å; Y332-V385 PolarHBondContact N-O 2.85Å; Y332-V385 PolarHBondContact O-N 2.82Å; Y332-L390 PolarHBondContact OH-N 2.8Å; Y332-L390 VanDerWaalsContact OH-N 3.09Å; Y332-L393 HydrophobicContact CD1-CD1 4.35Å; Y332-L393 HydrophobicContact CE1-CD1 4.22Å; Y332-L393 HydrophobicContact CE1-CD2 4.35Å; Y332-V416 HydrophobicContact CD1-CG1 3.98Å; Y332-S417 WeakPolarHBondContact CA-O 2.88Å; Y332-E418 HydrophobicContact CD1-CB 4.1Å; Y332-E418 HydrophobicContact CD1-CG 4.28Å; Y332-E418 HydrophobicContact CE1-CB 3.86Å; Y332-E418 HydrophobicContact CE1-CG 3.87Å; Y332-E418 WeakPolarHBondContact CE1-OE2 3.34Å; Y332-E418 PolarHBondContact OH-OE2 2.84Å
333	E	93.7	Very high	79.4	Confident	58 Å²	58	60.1 Å²	60.1	27%	0.271	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.6	170.8	-64.4	177.1	152.5	0	0	108.6	F383 V416 S417 P419	E333-F383 CarbonylContact C-O 3.44Å; E333-F383 WeakPolarHBondContact CA-O 3.47Å; E333-V416 CarbonylContact O-C 3.49Å; E333-V416 VanDerWaalsContact O-CA 3.28Å; E333-V416 WeakPolarHBondContact O-CA 3.02Å; E333-S417 WeakPolarHBondContact CB-OG 2.86Å; E333-S417 PolarHBondContact N-O 3.41Å; E333-S417 PolarHBondContact O-N 2.92Å; E333-S417 PolarHBondContact OE2-OG 2.88Å; E333-P419 HydrophobicContact CG-CG 4.11Å
334	V	95.6	Very high	82	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.2	-179	-174.7	0	0	0	0	109.2	V336 I352 F354 L366 F382 F383 V385 V414 M415	V334-V336 HydrophobicContact CG1-CG2 4.09Å; V334-I352 HydrophobicContact CG1-CD1 4.07Å; V334-F354 HydrophobicContact CG2-CE1 4.3Å; V334-F354 HydrophobicContact CG2-CZ 3.61Å; V334-L366 HydrophobicContact CG1-CD1 4.28Å; V334-F382 CarbonylContact O-C 3.41Å; V334-F382 WeakPolarHBondContact O-CA 3.35Å; V334-F383 HydrophobicContact CB-CB 4.33Å; V334-F383 PolarHBondContact N-O 3.44Å; V334-F383 PolarHBondContact O-N 2.99Å; V334-V385 HydrophobicContact CG2-CG2 4.12Å; V334-V414 HydrophobicContact CG1-CG1 3.78Å; V334-M415 WeakPolarHBondContact CA-O 3.1Å
335	I	95.3	Very high	84.6	Confident	18 Å²	18	49.6 Å²	49.6	9%	0.092	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	114.1	172.3	-44.4	172.1	0	0	0	108.3	Y337 A380 D381 F382 V414 M415	I335-Y337 HydrophobicContact CB-CE2 3.88Å; I335-Y337 HydrophobicContact CG2-CD2 4.06Å; I335-Y337 HydrophobicContact CG2-CE2 3.42Å; I335-Y337 VanDerWaalsContact CG2-CE2 3.42Å; I335-A380 HydrophobicContact CG2-CB 4.25Å; I335-D381 CarbonylContact C-O 3.57Å; I335-D381 VanDerWaalsContact CA-O 3.26Å; I335-D381 WeakPolarHBondContact CA-O 3.09Å; I335-F382 HydrophobicContact CD1-CD1 3.91Å; I335-F382 HydrophobicContact CD1-CE1 3.48Å; I335-F382 VanDerWaalsContact CD1-CE1 3.48Å; I335-F382 HydrophobicContact CD1-CZ 4.35Å; I335-F382 HydrophobicContact CG1-CD1 3.65Å; I335-F382 HydrophobicContact CG1-CE1 3.73Å; I335-F382 HydrophobicContact CG1-CG 4.5Å; I335-F382 HydrophobicContact CG2-CD1 4.24Å; I335-F382 HydrophobicContact CG2-CE1 4.01Å; I335-F382 HydrophobicContact CG2-CE2 4.41Å; I335-F382 HydrophobicContact CG2-CZ 4.08Å; I335-V414 CarbonylContact O-C 3.58Å; I335-V414 WeakPolarHBondContact O-CA 3.17Å; I335-M415 HydrophobicContact CB-CB 4.23Å; I335-M415 PolarHBondContact N-O 3.13Å; I335-M415 PolarHBondContact O-N 2.83Å
336	V	97	Very high	86.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.2	175.4	-177.5	0	0	0	0	108.4	V334 L366 F375 A380 D381 F383 I398 I411	V334-V336 HydrophobicContact CG1-CG2 4.09Å; V336-L366 HydrophobicContact CG2-CD1 3.8Å; V336-F375 HydrophobicContact CB-CD1 4.45Å; V336-F375 HydrophobicContact CB-CE1 4.13Å; V336-F375 HydrophobicContact CG1-CD1 4.21Å; V336-F375 HydrophobicContact CG1-CE1 4.2Å; V336-F375 HydrophobicContact CG2-CE1 4.24Å; V336-A380 WeakPolarHBondContact O-CA 3.36Å; V336-D381 PolarHBondContact N-O 2.81Å; V336-D381 PolarHBondContact O-N 2.96Å; V336-F383 HydrophobicContact CG2-CE2 4.42Å; V336-I398 HydrophobicContact CG2-CD1 4.49Å; V336-I411 HydrophobicContact CG1-CG2 4.35Å
337	Y	96	Very high	89	Confident	58 Å²	58	40.1 Å²	40.1	23%	0.227	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109.6	175	-66.7	-101.1	0	0	0	108.8	I335 A380 E412 R413 M415	I335-Y337 HydrophobicContact CB-CE2 3.88Å; I335-Y337 HydrophobicContact CG2-CD2 4.06Å; I335-Y337 HydrophobicContact CG2-CE2 3.42Å; I335-Y337 VanDerWaalsContact CG2-CE2 3.42Å; Y337-A380 HydrophobicContact CD1-CB 3.71Å; Y337-A380 HydrophobicContact CE1-CB 3.66Å; Y337-A380 HydrophobicContact CG-CB 4.35Å; Y337-E412 PolarHBondContact O-N 2.83Å; Y337-R413 HydrophobicContact CD2-CG 3.75Å; Y337-R413 HydrophobicContact CG-CG 3.91Å; Y337-R413 PolarHBondContact N-O 2.84Å; Y337-M415 HydrophobicContact CD2-CG 4.39Å; Y337-M415 HydrophobicContact CE2-CB 4.33Å; Y337-M415 HydrophobicContact CE2-CG 3.69Å
338	T	95.6	Very high	90.9	Very high	3 Å²	3	35 Å²	35	2%	0.018	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.8	171.9	-57.7	0	0	0	0	108.8	A344 Q376 N378 Q379 I409	T338-A344 HydrophobicContact CG2-CB 4.15Å; T338-A344 WeakPolarHBondContact CG2-O 3.35Å; T338-Q376 WeakPolarHBondContact CB-O 3.42Å; T338-Q376 VanDerWaalsContact CG2-O 3.25Å; T338-Q376 WeakPolarHBondContact CG2-O 3.45Å; T338-N378 WeakPolarHBondContact O-CA 3.44Å; T338-N378 PolarHBondContact O-N 2.87Å; T338-Q379 PolarHBondContact N-O 3.07Å; T338-I409 HydrophobicContact CG2-CD1 4.25Å; T338-I409 HydrophobicContact CG2-CG1 4.1Å
339	G	92.3	Very high	92.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.01	15%	0.151	C	C	.	.			trans	-72.1	165.5	-174.2	0	0	0	0	0	113.5	R341 A344 N378 F410	G339-R341 VanDerWaalsContact C-N 3.33Å; G339-R341 PolarHBondContact O-N 3.23Å; G339-A344 WeakPolarHBondContact O-CB 3.47Å; G339-N378 PolarHBondContact O-N 3.03Å; G339-N378 VanDerWaalsContact O-N 3.09Å; G339-F410 PolarHBondContact N-O 2.81Å
340	N	90.9	Very high	92.9	Very high	104 Å²	104	26.6 Å²	26.6	56%	0.556	13%	0.129	S	C	*	.	S	Bend	trans	-88.6	67.8	175.4	-169.3	15.3	0	0	0	111.4	Q377 N378	N340-Q377 PolarHBondContact OD1-NE2 2.87Å; N340-N378 HydrophobicContact CB-CB 3.8Å
341	R	90	Very high	93.4	Very high	41 Å²	41	27 Å²	27	16%	0.155	13%	0.128	C	C	.	.	S	Bend	trans	-120.6	150.8	178.1	-58.1	-74.1	-71.9	-89.5	-15.9	109.8	G339 A343 A344 Q377 F410 W433 H718 P720 D890	G339-R341 VanDerWaalsContact C-N 3.33Å; G339-R341 PolarHBondContact O-N 3.23Å; R341-A343 PolarHBondContact O-N 2.86Å; R341-A344 HydrophobicContact CB-CB 4Å; R341-A344 WeakPolarHBondContact O-CB 3.27Å; R341-A344 PolarHBondContact O-N 3.47Å; R341-Q377 WeakPolarHBondContact O-CG 3.45Å; R341-Q377 PolarHBondContact O-NE2 3.41Å; R341-Q377 PolarHBondContact O-OE1 2.8Å; R341-F410 HydrophobicContact CB-CB 4.44Å; R341-F410 HydrophobicContact CB-CG 4.39Å; R341-F410 HydrophobicContact CG-CB 4.49Å; R341-F410 HydrophobicContact CG-CD1 3.79Å; R341-F410 HydrophobicContact CG-CD2 4.28Å; R341-F410 HydrophobicContact CG-CE1 4.01Å; R341-F410 HydrophobicContact CG-CE2 4.48Å; R341-F410 HydrophobicContact CG-CG 3.93Å; R341-F410 HydrophobicContact CG-CZ 4.35Å; R341-W433 HydrophobicContact CB-CZ2 4.11Å; R341-H718 PolarHBondContact NH1-O 2.8Å; R341-H718 VanDerWaalsContact NH1-O 3.14Å; R341-H718 PolarHBondContact NH2-O 3.05Å; R341-P720 VanDerWaalsContact CZ-CD 3.45Å; R341-D890 IonicContact CZ-OD1 2.8Å; R341-D890 IonicContact CZ-OD2 3.48Å; R341-D890 IonicContact NE-OD1 2.86Å; R341-D890 PolarHBondContact NE-OD1 3.44Å; R341-D890 IonicContact NH2-OD1 2.96Å; R341-D890 PolarHBondContact NH2-OD1 3.38Å; R341-D890 IonicContact NH2-OD2 3.91Å; R341-D890 PolarHBondContact NH2-OD2 3.02Å
342	W	90.3	Very high	93.7	Very high	98 Å²	98	25.6 Å²	25.6	37%	0.371	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	130.2	177.4	-64.9	117.1	0	0	0	110.2	A344 W433 P889 D890 P892 P893	W342-A344 PolarHBondContact O-N 3.22Å; W342-W433 WeakPolarHBondContact O-CH2 3.11Å; W342-P889 WeakPolarHBondContact O-CA 3.39Å; W342-D890 PolarHBondContact O-N 2.79Å; W342-D890 VanDerWaalsContact O-N 3.17Å; W342-P892 HydrophobicContact CZ2-CB 4.43Å; W342-P893 VanDerWaalsContact CE3-CD 3.49Å; W342-P893 HydrophobicContact CE3-CG 4.06Å; W342-P893 HydrophobicContact CH2-CG 4.1Å; W342-P893 HydrophobicContact CZ3-CG 3.82Å
343	A	91.6	Very high	94	Very high	2 Å²	2	26.8 Å²	26.8	2%	0.017	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	31.8	-173.5	0	0	0	0	0	114.5	R341 D345 W433 R864 P889	R341-A343 PolarHBondContact O-N 2.86Å; A343-D345 PolarHBondContact O-N 3.02Å; A343-W433 WeakPolarHBondContact O-CH2 3.18Å; A343-R864 PolarHBondContact O-NH1 3.28Å; A343-P889 HydrophobicContact CB-CG 4.37Å
344	A	93.6	Very high	94.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.			trans	-68.6	-15	177.5	0	0	0	0	0	114.6	T338 G339 R341 W342 Q377 I409 F410 W433	T338-A344 HydrophobicContact CG2-CB 4.15Å; T338-A344 WeakPolarHBondContact CG2-O 3.35Å; G339-A344 WeakPolarHBondContact O-CB 3.47Å; R341-A344 HydrophobicContact CB-CB 4Å; R341-A344 WeakPolarHBondContact O-CB 3.27Å; R341-A344 PolarHBondContact O-N 3.47Å; W342-A344 PolarHBondContact O-N 3.22Å; A344-Q377 HydrophobicContact CB-CB 4.38Å; A344-Q377 HydrophobicContact CB-CG 4.25Å; A344-I409 WeakPolarHBondContact O-CA 2.79Å; A344-I409 WeakPolarHBondContact O-CG1 3.27Å; A344-F410 HydrophobicContact CB-CB 3.92Å; A344-F410 PolarHBondContact O-N 2.8Å; A344-F410 VanDerWaalsContact O-N 3.14Å; A344-W433 HydrophobicContact CB-CH2 4.4Å
345	D	91.8	Very high	94.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.128	C	C	.	.			trans	-75.6	164.6	-176.1	62	-62.9	0	0	0	113.1	A343 F375 G408 K851 R864	A343-D345 PolarHBondContact O-N 3.02Å; D345-F375 WeakPolarHBondContact CA-O 3.42Å; D345-F375 WeakPolarHBondContact CB-O 2.94Å; D345-G408 VanDerWaalsContact O-O 3.07Å; D345-K851 IonicContact OD2-NZ 3.99Å; D345-K851 PolarHBondContact OD2-NZ 3.31Å; D345-R864 PolarHBondContact O-NH1 2.86Å; D345-R864 PolarHBondContact O-NH2 2.79Å; D345-R864 VanDerWaalsContact O-NH2 3.14Å; D345-R864 IonicContact OD1-NH1 3.69Å; D345-R864 PolarHBondContact OD1-NH1 3.48Å; D345-R864 WeakPolarHBondContact OD2-CD 3.44Å; D345-R864 IonicContact OD2-CZ 3.73Å; D345-R864 IonicContact OD2-NE 3.42Å; D345-R864 PolarHBondContact OD2-NE 2.77Å; D345-R864 IonicContact OD2-NH1 2.72Å
346	T	92.7	Very high	94	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.13	C	C	.	.			trans	-144.8	147.6	166.3	-170.2	0	0	0	0	110.8	A348 I350 Q368 F375 A407 I409	T346-A348 VanDerWaalsContact C-N 3.32Å; T346-A348 HydrophobicContact CG2-CB 4.39Å; T346-A348 WeakPolarHBondContact OG1-CB 3.45Å; T346-A348 PolarHBondContact OG1-N 3.01Å; T346-I350 HydrophobicContact CG2-CD1 4.3Å; T346-I350 HydrophobicContact CG2-CG1 4.48Å; T346-Q368 PolarHBondContact O-NE2 3.47Å; T346-F375 HydrophobicContact CG2-CB 3.92Å; T346-F375 HydrophobicContact CG2-CD2 4.3Å; T346-F375 HydrophobicContact CG2-CG 4.43Å; T346-F375 PolarHBondContact N-O 2.67Å; T346-F375 VanDerWaalsContact N-O 3.15Å; T346-A407 PolarHBondContact OG1-O 3.49Å; T346-I409 HydrophobicContact CG2-CB 3.87Å; T346-I409 HydrophobicContact CG2-CD1 3.94Å; T346-I409 HydrophobicContact CG2-CG1 4.18Å; T346-I409 HydrophobicContact CG2-CG2 4.45Å
347	D	89.2	Confident	93.8	Very high	58 Å²	58	29.5 Å²	29.5	31%	0.31	15%	0.148	S	C	.	.	S	Bend	trans	-93.2	3.9	171.3	-46.4	-51.8	0	0	0	111.5	Q368 K851 K853	D347-Q368 WeakPolarHBondContact O-CG 3.4Å; D347-K851 IonicContact OD1-NZ 3.68Å; D347-K851 PolarHBondContact OD1-NZ 3.09Å; D347-K851 IonicContact OD2-NZ 3.73Å; D347-K853 VanDerWaalsContact OD2-CD 3.3Å; D347-K853 WeakPolarHBondContact OD2-CD 3.37Å; D347-K853 IonicContact OD2-NZ 2.71Å; D347-K853 PolarHBondContact OD2-NZ 3.18Å
348	A	92.1	Very high	93.6	Very high	8 Å²	8	33.4 Å²	33.4	7%	0.066	17%	0.166	C	C	.	.	S	Bend	trans	-84.1	157.1	-178.7	0	0	0	0	0	112.3	T346 Q368 E402	T346-A348 VanDerWaalsContact C-N 3.32Å; T346-A348 HydrophobicContact CG2-CB 4.39Å; T346-A348 WeakPolarHBondContact OG1-CB 3.45Å; T346-A348 PolarHBondContact OG1-N 3.01Å; A348-Q368 WeakPolarHBondContact O-CG 3.36Å; A348-Q368 PolarHBondContact O-NE2 3.47Å; A348-E402 HydrophobicContact CB-CG 3.42Å; A348-E402 VanDerWaalsContact CB-CG 3.42Å
349	D	95	Very high	93.4	Very high	64 Å²	64	34.7 Å²	34.7	34%	0.342	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-72.4	137	162.9	-70.7	-12.8	0	0	0	109.5	Y365 R367 Q368	D349-Y365 HydrophobicContact CB-CD1 4.41Å; D349-R367 VanDerWaalsContact OD1-CA 3.28Å; D349-R367 WeakPolarHBondContact OD1-CA 3.08Å; D349-Q368 PolarHBondContact OD1-N 3.16Å
350	I	97.3	Very high	93.6	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.5	174.3	-63.1	-179.3	0	0	0	107.7	T346 Y365 L366 F375 I398 G399 I409 I411	T346-I350 HydrophobicContact CG2-CD1 4.3Å; T346-I350 HydrophobicContact CG2-CG1 4.48Å; I350-Y365 CarbonylContact O-C 3.58Å; I350-L366 PolarHBondContact N-O 3.26Å; I350-L366 WeakPolarHBondContact O-CA 3.44Å; I350-L366 WeakPolarHBondContact O-CB 3.44Å; I350-L366 PolarHBondContact O-N 2.79Å; I350-F375 HydrophobicContact CB-CE2 4.09Å; I350-F375 HydrophobicContact CB-CZ 3.97Å; I350-F375 HydrophobicContact CD1-CB 4.38Å; I350-F375 HydrophobicContact CD1-CD1 3.63Å; I350-F375 HydrophobicContact CD1-CD2 3.73Å; I350-F375 HydrophobicContact CD1-CE1 3.73Å; I350-F375 HydrophobicContact CD1-CE2 3.86Å; I350-F375 HydrophobicContact CD1-CG 3.64Å; I350-F375 HydrophobicContact CD1-CZ 3.85Å; I350-F375 HydrophobicContact CG1-CD2 3.97Å; I350-F375 HydrophobicContact CG1-CE1 4.41Å; I350-F375 HydrophobicContact CG1-CE2 3.8Å; I350-F375 HydrophobicContact CG1-CG 4.39Å; I350-F375 HydrophobicContact CG1-CZ 4.03Å; I350-I398 HydrophobicContact CG2-CD1 3.91Å; I350-I398 HydrophobicContact CG2-CG1 3.54Å; I350-G399 CarbonylContact C-O 3.57Å; I350-G399 WeakPolarHBondContact CA-O 3.23Å; I350-G399 WeakPolarHBondContact CG2-O 3.22Å; I350-I409 HydrophobicContact CD1-CD1 3.5Å; I350-I409 HydrophobicContact CD1-CG2 4.25Å; I350-I411 HydrophobicContact CD1-CD1 4.43Å
351	Y	97.8	Very high	93.8	Very high	21 Å²	21	36 Å²	36	8%	0.082	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	155	170.9	63.9	-95.1	0	0	0	112.3	I363 I364 Y365 I398 G399 N401 E444	Y351-I363 HydrophobicContact CD2-CG2 3.96Å; Y351-I363 HydrophobicContact CG-CG2 3.9Å; Y351-I364 CarbonylContact C-O 3.53Å; Y351-I364 WeakPolarHBondContact CA-O 3.11Å; Y351-Y365 HydrophobicContact CD1-CE1 4.24Å; Y351-I398 WeakPolarHBondContact O-CA 3.48Å; Y351-G399 VanDerWaalsContact CD1-O 3.25Å; Y351-G399 WeakPolarHBondContact CD1-O 3.37Å; Y351-G399 WeakPolarHBondContact CE1-O 3.35Å; Y351-G399 PolarHBondContact N-O 3.45Å; Y351-G399 PolarHBondContact O-N 3.17Å; Y351-N401 WeakPolarHBondContact CE1-OD1 3.47Å; Y351-E444 HydrophobicContact CE2-CG 4.38Å; Y351-E444 PolarHBondContact OH-OE2 2.8Å; Y351-E444 VanDerWaalsContact OH-OE2 3.11Å
352	I	98	Very high	94	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142.9	179.7	-164	165.9	0	0	0	111.2	V334 F354 I364 L366 L396 V397 V414	V334-I352 HydrophobicContact CG1-CD1 4.07Å; I352-F354 HydrophobicContact CD1-CD1 4.36Å; I352-F354 HydrophobicContact CD1-CE1 3.56Å; I352-F354 HydrophobicContact CD1-CZ 4.08Å; I352-F354 HydrophobicContact CG1-CD1 4.36Å; I352-F354 HydrophobicContact CG1-CE1 3.94Å; I352-F354 HydrophobicContact CG1-CZ 4.43Å; I352-F354 HydrophobicContact CG2-CZ 4.21Å; I352-I364 HydrophobicContact CG2-CB 3.98Å; I352-I364 HydrophobicContact CG2-CG2 4.36Å; I352-I364 PolarHBondContact N-O 2.84Å; I352-I364 PolarHBondContact O-N 2.86Å; I352-L366 HydrophobicContact CB-CD1 4.46Å; I352-L366 HydrophobicContact CG2-CD1 4.32Å; I352-L366 HydrophobicContact CG2-CD2 4.06Å; I352-L366 HydrophobicContact CG2-CG 4.15Å; I352-L396 HydrophobicContact CD1-CD1 4.22Å; I352-L396 HydrophobicContact CD1-CD2 4.14Å; I352-L396 HydrophobicContact CG1-CB 4.43Å; I352-L396 HydrophobicContact CG1-CD1 4.22Å; I352-V397 CarbonylContact C-O 3.53Å; I352-V397 VanDerWaalsContact CA-O 3.26Å; I352-V397 WeakPolarHBondContact CA-O 2.94Å; I352-V414 HydrophobicContact CD1-CG1 4.26Å
353	I	98	Very high	94.3	Very high	25 Å²	25	41.9 Å²	41.9	13%	0.128	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.9	174.6	-48.8	171.4	0	0	0	108.2	F355 S361 I363 L396 V397	I353-F355 HydrophobicContact CB-CE2 4.07Å; I353-F355 HydrophobicContact CG2-CD2 4.41Å; I353-F355 HydrophobicContact CG2-CE2 3.66Å; I353-F355 HydrophobicContact CG2-CZ 3.93Å; I353-S361 WeakPolarHBondContact CG2-O 3.33Å; I353-I363 HydrophobicContact CD1-CG1 3.89Å; I353-I363 HydrophobicContact CG1-CG1 4.06Å; I353-L396 CarbonylContact O-C 3.5Å; I353-L396 WeakPolarHBondContact O-CA 3.46Å; I353-L396 WeakPolarHBondContact O-CB 3.17Å; I353-V397 HydrophobicContact CB-CB 4.21Å; I353-V397 HydrophobicContact CD1-CB 4.43Å; I353-V397 PolarHBondContact N-O 2.8Å; I353-V397 PolarHBondContact O-N 2.89Å
354	F	96.7	Very high	94.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	142	178	-59.5	-53.3	0	0	0	111.6	Y332 V334 I352 H360 S361 I364 V385 L390 L393 L396 V416	Y332-F354 HydrophobicContact CG-CE2 4.29Å; V334-F354 HydrophobicContact CG2-CE1 4.3Å; V334-F354 HydrophobicContact CG2-CZ 3.61Å; I352-F354 HydrophobicContact CD1-CD1 4.36Å; I352-F354 HydrophobicContact CD1-CE1 3.56Å; I352-F354 HydrophobicContact CD1-CZ 4.08Å; I352-F354 HydrophobicContact CG1-CD1 4.36Å; I352-F354 HydrophobicContact CG1-CE1 3.94Å; I352-F354 HydrophobicContact CG1-CZ 4.43Å; I352-F354 HydrophobicContact CG2-CZ 4.21Å; F354-H360 CarbonylContact O-C 3.52Å; F354-H360 WeakPolarHBondContact O-CA 3.29Å; F354-H360 WeakPolarHBondContact O-CB 3.43Å; F354-S361 PolarHBondContact N-OG 3.02Å; F354-S361 PolarHBondContact O-N 3.18Å; F354-I364 HydrophobicContact CD2-CD1 4.09Å; F354-I364 HydrophobicContact CE2-CD1 4.02Å; F354-V385 HydrophobicContact CE2-CG1 4.07Å; F354-L390 HydrophobicContact CB-CD1 3.3Å; F354-L390 HydrophobicContact CD2-CD1 4.41Å; F354-L390 HydrophobicContact CG-CD1 4.3Å; F354-L393 HydrophobicContact CB-CD2 4.27Å; F354-L396 HydrophobicContact CD1-CB 4.22Å; F354-V416 HydrophobicContact CE1-CG1 4.14Å; F354-V416 HydrophobicContact CE1-CG2 3.85Å; F354-V416 HydrophobicContact CZ-CG1 4.31Å
355	F	95.9	Very high	94.7	Very high	67 Å²	67	48 Å²	48	29%	0.294	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	110	171.7	-64.9	-97.4	0	0	0	108.9	I353 H360 R394 K395 V397	I353-F355 HydrophobicContact CB-CE2 4.07Å; I353-F355 HydrophobicContact CG2-CD2 4.41Å; I353-F355 HydrophobicContact CG2-CE2 3.66Å; I353-F355 HydrophobicContact CG2-CZ 3.93Å; F355-H360 HydrophobicContact CD1-CB 3.74Å; F355-H360 HydrophobicContact CE1-CB 3.91Å; F355-H360 HydrophobicContact CG-CB 4.32Å; F355-R394 PolarHBondContact O-N 2.76Å; F355-K395 WeakPolarHBondContact CA-O 3.36Å; F355-K395 HydrophobicContact CB-CB 4.09Å; F355-K395 WeakPolarHBondContact CB-O 3.39Å; F355-K395 HydrophobicContact CD2-CD 4.48Å; F355-K395 HydrophobicContact CD2-CG 4.2Å; F355-K395 PolarHBondContact N-O 2.83Å; F355-K395 PolarHBondContact O-N 3.25Å; F355-K395 VanDerWaalsContact O-N 3.15Å; F355-V397 HydrophobicContact CD2-CG2 4.45Å; F355-V397 HydrophobicContact CE2-CB 4.36Å; F355-V397 HydrophobicContact CE2-CG2 3.66Å; F355-V397 HydrophobicContact CZ-CG2 4.42Å
356	G	93.3	Very high	94.9	Very high	14 Å²	14	48 Å²	48	14%	0.144	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	180	177.9	0	0	0	0	0	113.1	K358 G359 L390 E392	G356-K358 PolarHBondContact O-N 2.8Å; G356-G359 PolarHBondContact N-O 3.48Å; G356-L390 CarbonylContact C-O 3.46Å; G356-L390 VanDerWaalsContact C-O 3.29Å; G356-L390 VanDerWaalsContact CA-O 3.3Å; G356-L390 WeakPolarHBondContact CA-O 3.34Å; G356-E392 CarbonylContact C-O 3.57Å; G356-E392 WeakPolarHBondContact CA-O 3.08Å
357	S	91.1	Very high	94.9	Very high	53 Å²	53	56.3 Å²	56.3	37%	0.371	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.7	177.1	62.2	0	0	0	0	114.8	L390 E392	S357-L390 PolarHBondContact N-O 3.45Å; S357-E392 PolarHBondContact N-O 3.16Å; S357-E392 PolarHBondContact OG-N 2.92Å; S357-E392 VanDerWaalsContact OG-N 3.09Å
358	K	91.7	Very high	94.9	Very high	140 Å²	140	55.3 Å²	55.3	61%	0.609	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-2.7	-175.2	-61.1	-172.1	178.9	-167.1	0	114.1	G356 Y389 L390	G356-K358 PolarHBondContact O-N 2.8Å; K358-Y389 HydrophobicContact CD-CD1 3.81Å; K358-Y389 HydrophobicContact CD-CE1 3.76Å; K358-Y389 VanDerWaalsContact NZ-CE1 3.35Å; K358-L390 PolarHBondContact N-O 3.32Å
359	G	92.8	Very high	94.3	Very high	30 Å²	30	58.2 Å²	58.2	31%	0.309	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	157.2	-163.3	-177.9	0	0	0	0	0	113.2	G356	G356-G359 PolarHBondContact N-O 3.48Å
360	H	95.1	Very high	93.2	Very high	128 Å²	128	60.9 Å²	60.9	59%	0.593	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	156.6	174.8	58.6	-77.6	0	0	0	110.1	F354 F355	F354-H360 CarbonylContact O-C 3.52Å; F354-H360 WeakPolarHBondContact O-CA 3.29Å; F354-H360 WeakPolarHBondContact O-CB 3.43Å; F355-H360 HydrophobicContact CD1-CB 3.74Å; F355-H360 HydrophobicContact CE1-CB 3.91Å; F355-H360 HydrophobicContact CG-CB 4.32Å
361	S	95.4	Very high	92.1	Very high	4 Å²	4	68.3 Å²	68.3	3%	0.028	34%	0.343	C	S	.	.			trans	-82.2	167.2	172.4	71.1	0	0	0	0	111.4	I353 F354 S387	I353-S361 WeakPolarHBondContact CG2-O 3.33Å; F354-S361 PolarHBondContact N-OG 3.02Å; F354-S361 PolarHBondContact O-N 3.18Å; S361-S387 WeakPolarHBondContact CB-OG 3.45Å
362	E	94.2	Very high	91.3	Very high	173 Å²	173	71 Å²	71	81%	0.808	36%	0.359	S	S	*	.			trans	-70	177.7	157.9	-61.9	-178.2	170.5	0	0	110.9	I364	E362-I364 PolarHBondContact O-N 3.37Å
363	I	96.8	Very high	90.6	Very high	90 Å²	90	73.2 Å²	73.2	46%	0.462	37%	0.37	S	S	.	.			trans	-71.1	116.5	173	-57.5	179.7	0	0	0	108.9	Y351 I353 Y365	Y351-I363 HydrophobicContact CD2-CG2 3.96Å; Y351-I363 HydrophobicContact CG-CG2 3.9Å; I353-I363 HydrophobicContact CD1-CG1 3.89Å; I353-I363 HydrophobicContact CG1-CG1 4.06Å; I363-Y365 HydrophobicContact CG2-CD2 4.21Å; I363-Y365 HydrophobicContact CG2-CE2 3.72Å
364	I	97.1	Very high	90.4	Very high	29 Å²	29	73.3 Å²	73.3	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.1	174.7	-62.9	127.2	0	0	0	109.1	Y351 I352 F354 E362 L366 V385	Y351-I364 CarbonylContact C-O 3.53Å; Y351-I364 WeakPolarHBondContact CA-O 3.11Å; I352-I364 HydrophobicContact CG2-CB 3.98Å; I352-I364 HydrophobicContact CG2-CG2 4.36Å; I352-I364 PolarHBondContact N-O 2.84Å; I352-I364 PolarHBondContact O-N 2.86Å; F354-I364 HydrophobicContact CD2-CD1 4.09Å; F354-I364 HydrophobicContact CE2-CD1 4.02Å; E362-I364 PolarHBondContact O-N 3.37Å; I364-L366 HydrophobicContact CG2-CD2 4.39Å; I364-V385 HydrophobicContact CB-CG1 4.07Å; I364-V385 HydrophobicContact CD1-CG1 3.59Å; I364-V385 HydrophobicContact CG1-CG1 3.73Å; I364-V385 HydrophobicContact CG2-CB 4.28Å; I364-V385 HydrophobicContact CG2-CG1 3.51Å; I364-V385 HydrophobicContact CG2-CG2 3.8Å
365	Y	96.4	Very high	90.2	Very high	101 Å²	101	73.3 Å²	73.3	40%	0.396	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	117.9	173.9	-71.2	-93.5	0	0	0	111.3	D349 I350 Y351 I363 R367	D349-Y365 HydrophobicContact CB-CD1 4.41Å; I350-Y365 CarbonylContact O-C 3.58Å; Y351-Y365 HydrophobicContact CD1-CE1 4.24Å; I363-Y365 HydrophobicContact CG2-CD2 4.21Å; I363-Y365 HydrophobicContact CG2-CE2 3.72Å; Y365-R367 PolarHBondContact O-N 3.25Å
366	L	96.4	Very high	90	Very high	2 Å²	2	71.6 Å²	71.6	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	92.8	166.8	-50.8	-177	0	0	0	108	V334 V336 I350 I352 I364 F375 F383 V385	V334-L366 HydrophobicContact CG1-CD1 4.28Å; V336-L366 HydrophobicContact CG2-CD1 3.8Å; I350-L366 PolarHBondContact N-O 3.26Å; I350-L366 WeakPolarHBondContact O-CA 3.44Å; I350-L366 WeakPolarHBondContact O-CB 3.44Å; I350-L366 PolarHBondContact O-N 2.79Å; I352-L366 HydrophobicContact CB-CD1 4.46Å; I352-L366 HydrophobicContact CG2-CD1 4.32Å; I352-L366 HydrophobicContact CG2-CD2 4.06Å; I352-L366 HydrophobicContact CG2-CG 4.15Å; I364-L366 HydrophobicContact CG2-CD2 4.39Å; L366-F375 HydrophobicContact CB-CZ 3.86Å; L366-F375 WeakPolarHBondContact O-CE2 3.42Å; L366-F383 HydrophobicContact CB-CD1 3.99Å; L366-F383 HydrophobicContact CB-CD2 4.32Å; L366-F383 HydrophobicContact CB-CE1 3.91Å; L366-F383 HydrophobicContact CB-CE2 4.25Å; L366-F383 HydrophobicContact CB-CG 4.2Å; L366-F383 HydrophobicContact CB-CZ 4.05Å; L366-F383 HydrophobicContact CD1-CD2 4.15Å; L366-F383 HydrophobicContact CD1-CE2 4.39Å; L366-F383 HydrophobicContact CD2-CB 3.85Å; L366-F383 HydrophobicContact CD2-CD1 4.2Å; L366-F383 HydrophobicContact CD2-CD2 4.3Å; L366-F383 HydrophobicContact CD2-CG 3.86Å; L366-F383 HydrophobicContact CG-CD2 4.5Å; L366-F383 HydrophobicContact CG-CG 4.42Å; L366-V385 HydrophobicContact CD2-CG2 3.78Å
367	R	93.1	Very high	89.9	Confident	174 Å²	174	73.1 Å²	73.1	66%	0.657	37%	0.366	S	S	*	.			trans	-81.6	147.7	-169.2	-61	-172.9	-179	-174.9	-1.2	113.2	D349 Y365	D349-R367 VanDerWaalsContact OD1-CA 3.28Å; D349-R367 WeakPolarHBondContact OD1-CA 3.08Å; Y365-R367 PolarHBondContact O-N 3.25Å
368	Q	89.1	Confident	90	Very high	38 Å²	38	75 Å²	75	18%	0.178	37%	0.372	C	S	.	.			trans	-62.4	152.4	166.7	-72.3	-75	-1.3	0	0	111.7	T346 D347 A348 D349 K374	T346-Q368 PolarHBondContact O-NE2 3.47Å; D347-Q368 WeakPolarHBondContact O-CG 3.4Å; A348-Q368 WeakPolarHBondContact O-CG 3.36Å; A348-Q368 PolarHBondContact O-NE2 3.47Å; D349-Q368 PolarHBondContact OD1-N 3.16Å; Q368-K374 PolarHBondContact NE2-O 3Å; Q368-K374 PolarHBondContact OE1-O 2.75Å
369	N	79.9	Confident	90	Very high	69 Å²	69	70.6 Å²	70.6	37%	0.369	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-121.6	123.4	170.1	-175.2	-17.1	0	0	0	109.3	N371 D372 L373	N369-N371 PolarHBondContact O-N 3.48Å; N369-N371 VanDerWaalsContact O-N 3.15Å; N369-N371 PolarHBondContact OD1-N 3.32Å; N369-D372 HydrophobicContact CB-CB 4.35Å; N369-D372 CarbonylContact O-C 3.6Å; N369-D372 PolarHBondContact O-N 2.82Å; N369-D372 VanDerWaalsContact O-N 3.07Å; N369-D372 VanDerWaalsContact O-O 3.11Å; N369-L373 PolarHBondContact O-N 3.46Å
370	P	71.3	Confident	90.1	Very high	119 Å²	119	70.5 Å²	70.5	77%	0.773	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.7	178.2	-25.8	33.9	0	0	0	114.4
371	N	73.6	Confident	90.1	Very high	158 Å²	158	64.4 Å²	64.4	85%	0.845	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-18.6	-179.3	-65.4	-28.3	0	0	0	113.1	N369	N369-N371 PolarHBondContact O-N 3.48Å; N369-N371 VanDerWaalsContact O-N 3.15Å; N369-N371 PolarHBondContact OD1-N 3.32Å
372	D	80.8	Confident	90.1	Very high	77 Å²	77	69.1 Å²	69.1	41%	0.412	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-145.9	81.9	-173.4	-176.8	12.4	0	0	0	108.2	N369 K374	N369-D372 HydrophobicContact CB-CB 4.35Å; N369-D372 CarbonylContact O-C 3.6Å; N369-D372 PolarHBondContact O-N 2.82Å; N369-D372 VanDerWaalsContact O-N 3.07Å; N369-D372 VanDerWaalsContact O-O 3.11Å; D372-K374 WeakPolarHBondContact O-CG 3.42Å; D372-K374 PolarHBondContact O-N 2.87Å; D372-K374 IonicContact OD1-NZ 2.98Å; D372-K374 PolarHBondContact OD1-NZ 3.16Å; D372-K374 VanDerWaalsContact OD2-CE 3.29Å; D372-K374 WeakPolarHBondContact OD2-CE 3.36Å; D372-K374 IonicContact OD2-NZ 3.28Å; D372-K374 PolarHBondContact OD2-NZ 2.91Å
373	L	84.6	Confident	90.1	Very high	46 Å²	46	62.2 Å²	62.2	24%	0.241	31%	0.309	C	S	.	.			trans	-56	120.2	-177	-64	177	0	0	0	109.6	N369 Q376 Q379	N369-L373 PolarHBondContact O-N 3.46Å; L373-Q376 HydrophobicContact CB-CG 4.16Å; L373-Q379 PolarHBondContact O-NE2 3.1Å
374	K	92.2	Very high	90	Very high	27 Å²	27	63.8 Å²	63.8	12%	0.117	31%	0.314	C	S	.	.			trans	-93.1	162.4	179.2	-58	-60	174	-170.3	0	110.2	Q368 D372 Q376 D381 F383	Q368-K374 PolarHBondContact NE2-O 3Å; Q368-K374 PolarHBondContact OE1-O 2.75Å; D372-K374 WeakPolarHBondContact O-CG 3.42Å; D372-K374 PolarHBondContact O-N 2.87Å; D372-K374 IonicContact OD1-NZ 2.98Å; D372-K374 PolarHBondContact OD1-NZ 3.16Å; D372-K374 VanDerWaalsContact OD2-CE 3.29Å; D372-K374 WeakPolarHBondContact OD2-CE 3.36Å; D372-K374 IonicContact OD2-NZ 3.28Å; D372-K374 PolarHBondContact OD2-NZ 2.91Å; K374-Q376 VanDerWaalsContact C-N 3.33Å; K374-Q376 PolarHBondContact O-N 3.05Å; K374-Q376 PolarHBondContact O-NE2 2.9Å; K374-D381 HydrophobicContact CD-CB 4.06Å; K374-D381 WeakPolarHBondContact CD-OD1 3.42Å; K374-D381 IonicContact NZ-OD1 3.5Å; K374-F383 HydrophobicContact CB-CZ 4.14Å; K374-F383 HydrophobicContact CD-CZ 4.27Å; K374-F383 HydrophobicContact CG-CE1 4.31Å; K374-F383 HydrophobicContact CG-CZ 3.98Å
375	F	94	Very high	89.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	60.8	38.4	175.5	-45	-55.4	0	0	0	113.6	V336 D345 T346 I350 L366 D381 F383 I409	V336-F375 HydrophobicContact CB-CD1 4.45Å; V336-F375 HydrophobicContact CB-CE1 4.13Å; V336-F375 HydrophobicContact CG1-CD1 4.21Å; V336-F375 HydrophobicContact CG1-CE1 4.2Å; V336-F375 HydrophobicContact CG2-CE1 4.24Å; D345-F375 WeakPolarHBondContact CA-O 3.42Å; D345-F375 WeakPolarHBondContact CB-O 2.94Å; T346-F375 HydrophobicContact CG2-CB 3.92Å; T346-F375 HydrophobicContact CG2-CD2 4.3Å; T346-F375 HydrophobicContact CG2-CG 4.43Å; T346-F375 PolarHBondContact N-O 2.67Å; T346-F375 VanDerWaalsContact N-O 3.15Å; I350-F375 HydrophobicContact CB-CE2 4.09Å; I350-F375 HydrophobicContact CB-CZ 3.97Å; I350-F375 HydrophobicContact CD1-CB 4.38Å; I350-F375 HydrophobicContact CD1-CD1 3.63Å; I350-F375 HydrophobicContact CD1-CD2 3.73Å; I350-F375 HydrophobicContact CD1-CE1 3.73Å; I350-F375 HydrophobicContact CD1-CE2 3.86Å; I350-F375 HydrophobicContact CD1-CG 3.64Å; I350-F375 HydrophobicContact CD1-CZ 3.85Å; I350-F375 HydrophobicContact CG1-CD2 3.97Å; I350-F375 HydrophobicContact CG1-CE1 4.41Å; I350-F375 HydrophobicContact CG1-CE2 3.8Å; I350-F375 HydrophobicContact CG1-CG 4.39Å; I350-F375 HydrophobicContact CG1-CZ 4.03Å; L366-F375 HydrophobicContact CB-CZ 3.86Å; L366-F375 WeakPolarHBondContact O-CE2 3.42Å; F375-D381 VanDerWaalsContact CA-OD2 3.3Å; F375-D381 WeakPolarHBondContact CA-OD2 3.25Å; F375-D381 HydrophobicContact CD1-CB 4.46Å; F375-D381 HydrophobicContact CE1-CB 4.45Å; F375-D381 PolarHBondContact N-OD2 3.23Å; F375-F383 AromaticContact CE1-CE2 3.55Å; F375-F383 HydrophobicContact CE1-CE2 3.55Å; F375-F383 AromaticContact CE1-CZ 3.59Å; F375-F383 HydrophobicContact CE1-CZ 3.59Å; F375-F383 HydrophobicContact CE2-CZ 4.17Å; F375-F383 HydrophobicContact CZ-CE1 4.21Å; F375-F383 AromaticContact CZ-CE2 3.71Å; F375-F383 HydrophobicContact CZ-CE2 3.71Å; F375-F383 AromaticContact CZ-CZ 3.29Å; F375-F383 HydrophobicContact CZ-CZ 3.29Å; F375-I409 HydrophobicContact CB-CD1 3.74Å; F375-I409 HydrophobicContact CD1-CD1 4.42Å; F375-I409 HydrophobicContact CG-CD1 4.24Å
376	Q	91.3	Very high	89.6	Confident	31 Å²	31	65.8 Å²	65.8	15%	0.145	32%	0.321	C	S	.	.			trans	-80.6	158	175.8	-52.9	-58.5	-71.9	0	0	111.2	T338 L373 K374 N378 Q379	T338-Q376 WeakPolarHBondContact CB-O 3.42Å; T338-Q376 VanDerWaalsContact CG2-O 3.25Å; T338-Q376 WeakPolarHBondContact CG2-O 3.45Å; L373-Q376 HydrophobicContact CB-CG 4.16Å; K374-Q376 VanDerWaalsContact C-N 3.33Å; K374-Q376 PolarHBondContact O-N 3.05Å; K374-Q376 PolarHBondContact O-NE2 2.9Å; Q376-N378 PolarHBondContact O-N 2.93Å; Q376-Q379 HydrophobicContact CB-CB 4.1Å; Q376-Q379 WeakPolarHBondContact O-CB 3.39Å; Q376-Q379 PolarHBondContact O-N 3.16Å
377	Q	91.3	Very high	89.3	Confident	47 Å²	47	66 Å²	66	22%	0.22	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	132.2	178.9	177.5	-178.9	-8.5	0	0	110.5	N340 R341 A344 Q379	N340-Q377 PolarHBondContact OD1-NE2 2.87Å; R341-Q377 WeakPolarHBondContact O-CG 3.45Å; R341-Q377 PolarHBondContact O-NE2 3.41Å; R341-Q377 PolarHBondContact O-OE1 2.8Å; A344-Q377 HydrophobicContact CB-CB 4.38Å; A344-Q377 HydrophobicContact CB-CG 4.25Å; Q377-Q379 VanDerWaalsContact C-N 3.26Å; Q377-Q379 PolarHBondContact O-N 2.99Å
378	N	92	Very high	89.2	Confident	92 Å²	92	61 Å²	61	49%	0.492	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	34.8	179.8	-164.3	42.9	0	0	0	113.9	T338 G339 N340 Q376	T338-N378 WeakPolarHBondContact O-CA 3.44Å; T338-N378 PolarHBondContact O-N 2.87Å; G339-N378 PolarHBondContact O-N 3.03Å; G339-N378 VanDerWaalsContact O-N 3.09Å; N340-N378 HydrophobicContact CB-CB 3.8Å; Q376-N378 PolarHBondContact O-N 2.93Å
379	Q	92.7	Very high	89.2	Confident	47 Å²	47	62.9 Å²	62.9	22%	0.22	32%	0.318	C	S	.	.			trans	-114.9	151.3	179.8	-171.8	168.8	-60.6	0	0	111.5	T338 L373 Q376 Q377 D381	T338-Q379 PolarHBondContact N-O 3.07Å; L373-Q379 PolarHBondContact O-NE2 3.1Å; Q376-Q379 HydrophobicContact CB-CB 4.1Å; Q376-Q379 WeakPolarHBondContact O-CB 3.39Å; Q376-Q379 PolarHBondContact O-N 3.16Å; Q377-Q379 VanDerWaalsContact C-N 3.26Å; Q377-Q379 PolarHBondContact O-N 2.99Å; Q379-D381 PolarHBondContact NE2-OD1 3.35Å; Q379-D381 PolarHBondContact NE2-OD2 3.01Å
380	A	94.1	Very high	89.8	Confident	28 Å²	28	59.8 Å²	59.8	23%	0.231	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123	170	0	0	0	0	0	110.2	I335 V336 Y337 F382	I335-A380 HydrophobicContact CG2-CB 4.25Å; V336-A380 WeakPolarHBondContact O-CA 3.36Å; Y337-A380 HydrophobicContact CD1-CB 3.71Å; Y337-A380 HydrophobicContact CE1-CB 3.66Å; Y337-A380 HydrophobicContact CG-CB 4.35Å; A380-F382 HydrophobicContact CB-CE2 4.48Å
381	D	95.4	Very high	90.7	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.4	-172.8	-70.9	-61.6	0	0	0	112.6	I335 V336 K374 F375 Q379 F383	I335-D381 CarbonylContact C-O 3.57Å; I335-D381 VanDerWaalsContact CA-O 3.26Å; I335-D381 WeakPolarHBondContact CA-O 3.09Å; V336-D381 PolarHBondContact N-O 2.81Å; V336-D381 PolarHBondContact O-N 2.96Å; K374-D381 HydrophobicContact CD-CB 4.06Å; K374-D381 WeakPolarHBondContact CD-OD1 3.42Å; K374-D381 IonicContact NZ-OD1 3.5Å; F375-D381 VanDerWaalsContact CA-OD2 3.3Å; F375-D381 WeakPolarHBondContact CA-OD2 3.25Å; F375-D381 HydrophobicContact CD1-CB 4.46Å; F375-D381 HydrophobicContact CE1-CB 4.45Å; F375-D381 PolarHBondContact N-OD2 3.23Å; Q379-D381 PolarHBondContact NE2-OD1 3.35Å; Q379-D381 PolarHBondContact NE2-OD2 3.01Å; D381-F383 HydrophobicContact CB-CE2 3.62Å; D381-F383 HydrophobicContact CB-CZ 4.12Å
382	F	94.8	Very high	91.4	Very high	102 Å²	102	49 Å²	49	45%	0.447	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.2	-171.7	-61.7	-101.8	0	0	0	110.7	V334 I335 A380	V334-F382 CarbonylContact O-C 3.41Å; V334-F382 WeakPolarHBondContact O-CA 3.35Å; I335-F382 HydrophobicContact CD1-CD1 3.91Å; I335-F382 HydrophobicContact CD1-CE1 3.48Å; I335-F382 VanDerWaalsContact CD1-CE1 3.48Å; I335-F382 HydrophobicContact CD1-CZ 4.35Å; I335-F382 HydrophobicContact CG1-CD1 3.65Å; I335-F382 HydrophobicContact CG1-CE1 3.73Å; I335-F382 HydrophobicContact CG1-CG 4.5Å; I335-F382 HydrophobicContact CG2-CD1 4.24Å; I335-F382 HydrophobicContact CG2-CE1 4.01Å; I335-F382 HydrophobicContact CG2-CE2 4.41Å; I335-F382 HydrophobicContact CG2-CZ 4.08Å; A380-F382 HydrophobicContact CB-CE2 4.48Å
383	F	95.3	Very high	92	Very high	28 Å²	28	45.4 Å²	45.4	12%	0.123	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.3	179	-58.7	-90.4	0	0	0	111.2	E333 V334 V336 L366 K374 F375 D381 V385	E333-F383 CarbonylContact C-O 3.44Å; E333-F383 WeakPolarHBondContact CA-O 3.47Å; V334-F383 HydrophobicContact CB-CB 4.33Å; V334-F383 PolarHBondContact N-O 3.44Å; V334-F383 PolarHBondContact O-N 2.99Å; V336-F383 HydrophobicContact CG2-CE2 4.42Å; L366-F383 HydrophobicContact CB-CD1 3.99Å; L366-F383 HydrophobicContact CB-CD2 4.32Å; L366-F383 HydrophobicContact CB-CE1 3.91Å; L366-F383 HydrophobicContact CB-CE2 4.25Å; L366-F383 HydrophobicContact CB-CG 4.2Å; L366-F383 HydrophobicContact CB-CZ 4.05Å; L366-F383 HydrophobicContact CD1-CD2 4.15Å; L366-F383 HydrophobicContact CD1-CE2 4.39Å; L366-F383 HydrophobicContact CD2-CB 3.85Å; L366-F383 HydrophobicContact CD2-CD1 4.2Å; L366-F383 HydrophobicContact CD2-CD2 4.3Å; L366-F383 HydrophobicContact CD2-CG 3.86Å; L366-F383 HydrophobicContact CG-CD2 4.5Å; L366-F383 HydrophobicContact CG-CG 4.42Å; K374-F383 HydrophobicContact CB-CZ 4.14Å; K374-F383 HydrophobicContact CD-CZ 4.27Å; K374-F383 HydrophobicContact CG-CE1 4.31Å; K374-F383 HydrophobicContact CG-CZ 3.98Å; F375-F383 AromaticContact CE1-CE2 3.55Å; F375-F383 HydrophobicContact CE1-CE2 3.55Å; F375-F383 AromaticContact CE1-CZ 3.59Å; F375-F383 HydrophobicContact CE1-CZ 3.59Å; F375-F383 HydrophobicContact CE2-CZ 4.17Å; F375-F383 HydrophobicContact CZ-CE1 4.21Å; F375-F383 AromaticContact CZ-CE2 3.71Å; F375-F383 HydrophobicContact CZ-CE2 3.71Å; F375-F383 AromaticContact CZ-CZ 3.29Å; F375-F383 HydrophobicContact CZ-CZ 3.29Å; D381-F383 HydrophobicContact CB-CE2 3.62Å; D381-F383 HydrophobicContact CB-CZ 4.12Å; F383-V385 HydrophobicContact CB-CG2 4.41Å
384	E	93.8	Very high	92.4	Very high	123 Å²	123	48.9 Å²	48.9	58%	0.575	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107	118.1	173.9	-82.7	174.2	-174.1	0	0	108.3	L331	L331-E384 HydrophobicContact CD1-CB 3.96Å; L331-E384 HydrophobicContact CD1-CG 4.4Å
385	V	93.6	Very high	92.5	Very high	8 Å²	8	51.2 Å²	51.2	5%	0.048	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.6	-170.5	171.5	0	0	0	0	110.7	Y332 V334 F354 I364 L366 F383	Y332-V385 PolarHBondContact N-O 2.85Å; Y332-V385 PolarHBondContact O-N 2.82Å; V334-V385 HydrophobicContact CG2-CG2 4.12Å; F354-V385 HydrophobicContact CE2-CG1 4.07Å; I364-V385 HydrophobicContact CB-CG1 4.07Å; I364-V385 HydrophobicContact CD1-CG1 3.59Å; I364-V385 HydrophobicContact CG1-CG1 3.73Å; I364-V385 HydrophobicContact CG2-CB 4.28Å; I364-V385 HydrophobicContact CG2-CG1 3.51Å; I364-V385 HydrophobicContact CG2-CG2 3.8Å; L366-V385 HydrophobicContact CD2-CG2 3.78Å; F383-V385 HydrophobicContact CB-CG2 4.41Å
386	W	91.3	Very high	92.7	Very high	165 Å²	165	51.2 Å²	51.2	63%	0.625	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	128	174.7	-69.6	92.7	0	0	0	111.2	N329 L331	N329-W386 HydrophobicContact CB-CE3 4.03Å; N329-W386 WeakPolarHBondContact O-CZ3 3.33Å; L331-W386 HydrophobicContact CB-CE3 4.38Å; L331-W386 HydrophobicContact CB-CH2 4.2Å; L331-W386 HydrophobicContact CB-CZ2 4.38Å; L331-W386 HydrophobicContact CB-CZ3 4.19Å; L331-W386 HydrophobicContact CD1-CD2 4.16Å; L331-W386 HydrophobicContact CD1-CG 4.42Å; L331-W386 HydrophobicContact CD1-CZ2 4.18Å
387	S	92	Very high	93	Very high	5 Å²	5	50.1 Å²	50.1	4%	0.035	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	153	175.9	-157.5	0	0	0	0	110.8	N329 C330 S361	N329-S387 CarbonylContact C-O 3.19Å; N329-S387 WeakPolarHBondContact CA-O 3.22Å; C330-S387 PolarHBondContact N-O 3.33Å; C330-S387 PolarHBondContact O-N 2.83Å; C330-S387 VanDerWaalsContact O-O 3.08Å; S361-S387 WeakPolarHBondContact CB-OG 3.45Å
388	P	90	Very high	93.3	Very high	70 Å²	70	47.9 Å²	47.9	46%	0.455	22%	0.222	S	C	.	.			trans	-53.6	150.9	170.1	-25.3	35.1	0	0	0	111.5	L390	P388-L390 WeakPolarHBondContact O-CD2 3.41Å; P388-L390 VanDerWaalsContact O-CG 3.26Å; P388-L390 WeakPolarHBondContact O-CG 3.16Å; P388-L390 PolarHBondContact O-N 2.85Å
389	Y	90.2	Very high	93.6	Very high	77 Å²	77	43.5 Å²	43.5	30%	0.302	20%	0.199	S	C	.	.			trans	-60.6	113.8	176.7	178.7	-120.9	0	0	0	111.7	K358 G391 E418 I421	K358-Y389 HydrophobicContact CD-CD1 3.81Å; K358-Y389 HydrophobicContact CD-CE1 3.76Å; K358-Y389 VanDerWaalsContact NZ-CE1 3.35Å; Y389-G391 VanDerWaalsContact CZ-CA 3.47Å; Y389-E418 WeakPolarHBondContact CD2-OE1 3.48Å; Y389-E418 WeakPolarHBondContact CD2-OE2 3.45Å; Y389-E418 VanDerWaalsContact CE2-OE1 3.24Å; Y389-E418 WeakPolarHBondContact CE2-OE1 3.33Å; Y389-E418 VanDerWaalsContact CE2-OE2 3.23Å; Y389-E418 WeakPolarHBondContact CE2-OE2 3.35Å; Y389-I421 HydrophobicContact CD2-CD1 3.65Å; Y389-I421 HydrophobicContact CE2-CD1 3.59Å; Y389-I421 HydrophobicContact CG-CD1 4.18Å
390	L	92.2	Very high	93.8	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	19%	0.189	C	C	.	.			trans	-94.2	-2	-176.7	-55.6	-177.4	0	0	0	113.5	Y332 F354 G356 S357 K358 P388 L393	Y332-L390 PolarHBondContact OH-N 2.8Å; Y332-L390 VanDerWaalsContact OH-N 3.09Å; F354-L390 HydrophobicContact CB-CD1 3.3Å; F354-L390 HydrophobicContact CD2-CD1 4.41Å; F354-L390 HydrophobicContact CG-CD1 4.3Å; G356-L390 CarbonylContact C-O 3.46Å; G356-L390 VanDerWaalsContact C-O 3.29Å; G356-L390 VanDerWaalsContact CA-O 3.3Å; G356-L390 WeakPolarHBondContact CA-O 3.34Å; S357-L390 PolarHBondContact N-O 3.45Å; K358-L390 PolarHBondContact N-O 3.32Å; P388-L390 WeakPolarHBondContact O-CD2 3.41Å; P388-L390 VanDerWaalsContact O-CG 3.26Å; P388-L390 WeakPolarHBondContact O-CG 3.16Å; P388-L390 PolarHBondContact O-N 2.85Å; L390-L393 HydrophobicContact CB-CD2 4.09Å; L390-L393 HydrophobicContact CD1-CD2 4.29Å
391	G	90	Very high	93.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.01	20%	0.202	C	C	.	.			trans	66.9	-151.1	-171.5	0	0	0	0	0	112	Y389 L393	Y389-G391 VanDerWaalsContact CZ-CA 3.47Å; G391-L393 PolarHBondContact O-N 3.15Å; G391-L393 VanDerWaalsContact O-N 3.15Å
392	E	88.8	Confident	93.7	Very high	51 Å²	51	48 Å²	48	24%	0.238	22%	0.218	C	C	.	.	S	Bend	trans	-62.1	117.6	-178.2	-169.3	-160.9	174.3	0	0	110.7	G356 S357 R394 Y426 Y452 R571	G356-E392 CarbonylContact C-O 3.57Å; G356-E392 WeakPolarHBondContact CA-O 3.08Å; S357-E392 PolarHBondContact N-O 3.16Å; S357-E392 PolarHBondContact OG-N 2.92Å; S357-E392 VanDerWaalsContact OG-N 3.09Å; E392-R394 PolarHBondContact O-N 3.07Å; E392-Y426 HydrophobicContact CG-CE1 4.02Å; E392-Y452 HydrophobicContact CG-CE1 4.26Å; E392-R571 VanDerWaalsContact CG-NH2 3.32Å; E392-R571 IonicContact OE1-CZ 3.44Å; E392-R571 IonicContact OE1-NE 3.95Å; E392-R571 IonicContact OE1-NH2 3.49Å; E392-R571 PolarHBondContact OE1-NH2 3.33Å; E392-R571 IonicContact OE2-NH2 3.66Å
393	L	92.2	Very high	93.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.4	179.8	-60	-179.3	0	0	0	110.3	Y332 F354 L390 G391 V416 Y426 F428 R571	Y332-L393 HydrophobicContact CD1-CD1 4.35Å; Y332-L393 HydrophobicContact CE1-CD1 4.22Å; Y332-L393 HydrophobicContact CE1-CD2 4.35Å; F354-L393 HydrophobicContact CB-CD2 4.27Å; L390-L393 HydrophobicContact CB-CD2 4.09Å; L390-L393 HydrophobicContact CD1-CD2 4.29Å; G391-L393 PolarHBondContact O-N 3.15Å; G391-L393 VanDerWaalsContact O-N 3.15Å; L393-V416 HydrophobicContact CD1-CB 3.96Å; L393-V416 HydrophobicContact CD1-CG1 3.54Å; L393-Y426 HydrophobicContact CB-CD1 3.87Å; L393-Y426 HydrophobicContact CB-CD2 4.36Å; L393-Y426 HydrophobicContact CB-CE1 4.11Å; L393-Y426 HydrophobicContact CB-CG 4.01Å; L393-Y426 HydrophobicContact CD1-CD2 4Å; L393-Y426 HydrophobicContact CD1-CE2 4.46Å; L393-Y426 HydrophobicContact CD1-CG 4.23Å; L393-Y426 HydrophobicContact CG-CD2 4.31Å; L393-Y426 HydrophobicContact CG-CE2 4.39Å; L393-Y426 HydrophobicContact CG-CG 4.44Å; L393-F428 HydrophobicContact CB-CZ 3.98Å; L393-R571 VanDerWaalsContact O-CZ 3.29Å; L393-R571 PolarHBondContact O-NH1 3.14Å; L393-R571 PolarHBondContact O-NH2 3.4Å
394	R	92.3	Very high	93.3	Very high	119 Å²	119	46.3 Å²	46.3	45%	0.449	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-39.7	-173.8	-72.3	175.3	176.4	-171.6	-0.5	113	F355 E392 C449	F355-R394 PolarHBondContact O-N 2.76Å; E392-R394 PolarHBondContact O-N 3.07Å; R394-C449 PolarHBondContact O-N 2.92Å
395	K	95.4	Very high	93.2	Very high	76 Å²	76	40.8 Å²	40.8	33%	0.33	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	154.4	-176.9	166.2	-179.3	167.6	179.3	0	108.2	F355 P446 L447	F355-K395 WeakPolarHBondContact CA-O 3.36Å; F355-K395 HydrophobicContact CB-CB 4.09Å; F355-K395 WeakPolarHBondContact CB-O 3.39Å; F355-K395 HydrophobicContact CD2-CD 4.48Å; F355-K395 HydrophobicContact CD2-CG 4.2Å; F355-K395 PolarHBondContact N-O 2.83Å; F355-K395 PolarHBondContact O-N 3.25Å; F355-K395 VanDerWaalsContact O-N 3.15Å; K395-P446 HydrophobicContact CD-CB 4.34Å; K395-L447 CarbonylContact C-O 3.21Å; K395-L447 VanDerWaalsContact CA-O 3.22Å; K395-L447 WeakPolarHBondContact CA-O 3.41Å; K395-L447 WeakPolarHBondContact CG-O 3.45Å
396	L	97.3	Very high	93.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	160.1	160.4	66.6	84.9	0	0	0	109.8	I352 I353 F354 I398 V414 V416 F428 P446 L447	I352-L396 HydrophobicContact CD1-CD1 4.22Å; I352-L396 HydrophobicContact CD1-CD2 4.14Å; I352-L396 HydrophobicContact CG1-CB 4.43Å; I352-L396 HydrophobicContact CG1-CD1 4.22Å; I353-L396 CarbonylContact O-C 3.5Å; I353-L396 WeakPolarHBondContact O-CA 3.46Å; I353-L396 WeakPolarHBondContact O-CB 3.17Å; F354-L396 HydrophobicContact CD1-CB 4.22Å; L396-I398 HydrophobicContact CD1-CB 3.9Å; L396-I398 HydrophobicContact CD1-CG2 4.07Å; L396-V414 HydrophobicContact CD2-CB 4.18Å; L396-V414 HydrophobicContact CD2-CG1 3.98Å; L396-V416 HydrophobicContact CD2-CG2 4.21Å; L396-F428 HydrophobicContact CB-CD1 4.4Å; L396-F428 HydrophobicContact CB-CE1 4.22Å; L396-F428 HydrophobicContact CD2-CB 3.81Å; L396-F428 HydrophobicContact CD2-CD1 3.49Å; L396-F428 VanDerWaalsContact CD2-CD1 3.49Å; L396-F428 HydrophobicContact CD2-CD2 3.38Å; L396-F428 HydrophobicContact CD2-CE1 3.76Å; L396-F428 HydrophobicContact CD2-CE2 3.68Å; L396-F428 HydrophobicContact CD2-CG 3.27Å; L396-F428 HydrophobicContact CD2-CZ 3.86Å; L396-F428 HydrophobicContact CG-CB 4.33Å; L396-F428 HydrophobicContact CG-CD1 3.65Å; L396-F428 HydrophobicContact CG-CD2 4.44Å; L396-F428 HydrophobicContact CG-CE1 3.95Å; L396-F428 HydrophobicContact CG-CG 3.91Å; L396-F428 HydrophobicContact CG-CZ 4.48Å; L396-P446 CarbonylContact O-C 3.53Å; L396-P446 WeakPolarHBondContact O-CA 3.29Å; L396-L447 HydrophobicContact CD1-CB 4.07Å; L396-L447 HydrophobicContact CD1-CD1 3.91Å; L396-L447 HydrophobicContact CD1-CG 4.06Å; L396-L447 HydrophobicContact CG-CB 4.2Å; L396-L447 PolarHBondContact N-O 2.78Å; L396-L447 PolarHBondContact O-N 3.15Å
397	V	98.3	Very high	93.3	Very high	9 Å²	9	32.6 Å²	32.6	6%	0.055	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.4	167.2	175.1	0	0	0	0	106.6	I352 I353 F355 E444 R445 P446	I352-V397 CarbonylContact C-O 3.53Å; I352-V397 VanDerWaalsContact CA-O 3.26Å; I352-V397 WeakPolarHBondContact CA-O 2.94Å; I353-V397 HydrophobicContact CB-CB 4.21Å; I353-V397 HydrophobicContact CD1-CB 4.43Å; I353-V397 PolarHBondContact N-O 2.8Å; I353-V397 PolarHBondContact O-N 2.89Å; F355-V397 HydrophobicContact CD2-CG2 4.45Å; F355-V397 HydrophobicContact CE2-CB 4.36Å; F355-V397 HydrophobicContact CE2-CG2 3.66Å; F355-V397 HydrophobicContact CZ-CG2 4.42Å; V397-E444 HydrophobicContact CG1-CG 3.33Å; V397-R445 WeakPolarHBondContact CA-O 3.43Å; V397-P446 HydrophobicContact CG2-CB 4.34Å
398	I	98.4	Very high	93.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.1	177.2	-174	160.3	0	0	0	109	V336 I350 Y351 L396 I411 V414 L434 E444 R445 L447	V336-I398 HydrophobicContact CG2-CD1 4.49Å; I350-I398 HydrophobicContact CG2-CD1 3.91Å; I350-I398 HydrophobicContact CG2-CG1 3.54Å; Y351-I398 WeakPolarHBondContact O-CA 3.48Å; L396-I398 HydrophobicContact CD1-CB 3.9Å; L396-I398 HydrophobicContact CD1-CG2 4.07Å; I398-I411 HydrophobicContact CD1-CD1 3.52Å; I398-I411 HydrophobicContact CG1-CD1 3.88Å; I398-I411 HydrophobicContact CG2-CD1 4.43Å; I398-V414 HydrophobicContact CD1-CG2 3.71Å; I398-L434 HydrophobicContact CG2-CD2 4.28Å; I398-L434 WeakPolarHBondContact O-CD2 3.3Å; I398-E444 CarbonylContact O-C 3.33Å; I398-E444 WeakPolarHBondContact O-CA 3.29Å; I398-R445 PolarHBondContact N-O 3.25Å; I398-R445 VanDerWaalsContact N-O 3.08Å; I398-R445 PolarHBondContact O-N 3.48Å; I398-L447 HydrophobicContact CG2-CD1 3.84Å; I398-L447 HydrophobicContact CG2-CG 4.11Å
399	G	97.8	Very high	93.8	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	171.4	-175	0	0	0	0	0	114.3	I350 Y351 C443	I350-G399 CarbonylContact C-O 3.57Å; I350-G399 WeakPolarHBondContact CA-O 3.23Å; I350-G399 WeakPolarHBondContact CG2-O 3.22Å; Y351-G399 VanDerWaalsContact CD1-O 3.25Å; Y351-G399 WeakPolarHBondContact CD1-O 3.37Å; Y351-G399 WeakPolarHBondContact CE1-O 3.35Å; Y351-G399 PolarHBondContact N-O 3.45Å; Y351-G399 PolarHBondContact O-N 3.17Å; G399-C443 WeakPolarHBondContact CA-O 3.44Å
400	H	97.2	Very high	94.1	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.019	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	166.6	170.2	68.1	84	0	0	0	110.4	E402 G408 L434 C443	H400-E402 PolarHBondContact CE1-O 2.81Å; H400-E402 PolarHBondContact ND1-N 2.93Å; H400-E402 PolarHBondContact ND1-O 2.78Å; H400-G408 WeakPolarHBondContact NE2-CA 3.27Å; H400-L434 PolarHBondContact NE2-O 2.81Å; H400-C443 PolarHBondContact N-O 2.84Å; H400-C443 VanDerWaalsContact N-O 3.11Å
401	N	94.1	Very high	94.3	Very high	95 Å²	95	25.7 Å²	25.7	51%	0.508	12%	0.118	S	C	.	.			trans	-99.8	-12	-174.4	-64.2	-28.9	0	0	0	114.1	Y351 Q403	Y351-N401 WeakPolarHBondContact CE1-OD1 3.47Å; N401-Q403 PolarHBondContact O-NE2 3.16Å; N401-Q403 VanDerWaalsContact O-NE2 3.11Å
402	E	92.3	Very high	94.6	Very high	71 Å²	71	28.2 Å²	28.2	33%	0.332	13%	0.13	S	C	.	.			trans	-59.5	148	177.2	-63.8	-58.2	135.1	0	0	113.4	A348 H400 A407 K855	A348-E402 HydrophobicContact CB-CG 3.42Å; A348-E402 VanDerWaalsContact CB-CG 3.42Å; H400-E402 PolarHBondContact CE1-O 2.81Å; H400-E402 PolarHBondContact ND1-N 2.93Å; H400-E402 PolarHBondContact ND1-O 2.78Å; E402-A407 HydrophobicContact CB-CB 4Å; E402-K855 IonicContact OE2-NZ 2.78Å; E402-K855 PolarHBondContact OE2-NZ 3.42Å
403	Q	90.9	Very high	94.9	Very high	93 Å²	93	26.6 Å²	26.6	44%	0.435	12%	0.121	S	C	.	.			trans	-124.4	153.5	-176.9	-58.2	-59.9	-49.7	0	0	110.1	N401 A407	N401-Q403 PolarHBondContact O-NE2 3.16Å; N401-Q403 VanDerWaalsContact O-NE2 3.11Å; Q403-A407 VanDerWaalsContact O-CB 3.3Å; Q403-A407 WeakPolarHBondContact O-CB 3.11Å
404	G	90.8	Very high	95.1	Very high	2 Å²	2	26.6 Å²	26.6	2%	0.021	12%	0.121	C	C	.	.	S	Bend	trans	100.5	157.6	-179.9	0	0	0	0	0	114.9	G406 A407 N859	G404-G406 PolarHBondContact O-N 3.05Å; G404-A407 WeakPolarHBondContact O-CB 3.49Å; G404-A407 PolarHBondContact O-N 3.02Å; G404-N859 WeakPolarHBondContact CA-O 3.29Å
405	Y	92.9	Very high	95.2	Very high	7 Å²	7	21.6 Å²	21.6	3%	0.027	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	121.5	178.4	173.5	-119.2	0	0	0	111.1	G437 K754 D861 E862 W888 P889	Y405-G437 WeakPolarHBondContact CD2-O 3.39Å; Y405-K754 HydrophobicContact CD1-CD 4.3Å; Y405-K754 HydrophobicContact CD2-CD 4.33Å; Y405-K754 HydrophobicContact CD2-CG 3.97Å; Y405-K754 HydrophobicContact CE1-CD 4.02Å; Y405-K754 HydrophobicContact CE2-CB 3.89Å; Y405-K754 HydrophobicContact CE2-CD 4.01Å; Y405-K754 HydrophobicContact CE2-CG 3.7Å; Y405-K754 HydrophobicContact CG-CD 4.45Å; Y405-D861 VanDerWaalsContact CB-OD1 3.29Å; Y405-D861 WeakPolarHBondContact CB-OD1 3.38Å; Y405-D861 PolarHBondContact N-OD1 2.87Å; Y405-D861 CarbonylContact O-C 3.53Å; Y405-D861 WeakPolarHBondContact O-CA 3.45Å; Y405-E862 PolarHBondContact O-N 2.76Å; Y405-W888 HydrophobicContact CD1-CD2 4.34Å; Y405-W888 AromaticContact CD1-CE3 3.4Å; Y405-W888 HydrophobicContact CD1-CE3 3.4Å; Y405-W888 HydrophobicContact CD1-CH2 4.27Å; Y405-W888 AromaticContact CD1-CZ3 3.36Å; Y405-W888 HydrophobicContact CD1-CZ3 3.36Å; Y405-W888 HydrophobicContact CE1-CB 4.28Å; Y405-W888 AromaticContact CE1-CD2 3.7Å; Y405-W888 HydrophobicContact CE1-CD2 3.7Å; Y405-W888 AromaticContact CE1-CE3 3.13Å; Y405-W888 HydrophobicContact CE1-CE3 3.13Å; Y405-W888 HydrophobicContact CE1-CG 4.23Å; Y405-W888 AromaticContact CE1-CZ3 3.61Å; Y405-W888 HydrophobicContact CE1-CZ3 3.61Å; Y405-W888 HydrophobicContact CG-CZ3 4.44Å; Y405-P889 HydrophobicContact CD2-CG 4.4Å; Y405-P889 HydrophobicContact CE2-CB 4.03Å; Y405-P889 HydrophobicContact CE2-CG 3.98Å; Y405-P889 PolarHBondContact OH-O 3.46Å
406	G	93.1	Very high	95.1	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	-2.9	-178.8	0	0	0	0	0	114.8	G404 G408 D435 E862 R864 P889	G404-G406 PolarHBondContact O-N 3.05Å; G406-G408 VanDerWaalsContact C-N 3.3Å; G406-D435 VanDerWaalsContact CA-OD2 3.24Å; G406-D435 WeakPolarHBondContact CA-OD2 3.39Å; G406-D435 PolarHBondContact N-OD2 2.79Å; G406-E862 VanDerWaalsContact C-CG 3.42Å; G406-E862 WeakPolarHBondContact CA-O 3.32Å; G406-E862 VanDerWaalsContact O-CG 3.31Å; G406-E862 WeakPolarHBondContact O-CG 3.17Å; G406-R864 PolarHBondContact O-NH1 2.85Å; G406-R864 PolarHBondContact O-NH2 2.79Å; G406-P889 VanDerWaalsContact CA-CG 3.41Å
407	A	93.6	Very high	94.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-79.9	-16.4	175.3	0	0	0	0	0	113.2	T346 E402 Q403 G404 D435 E862	T346-A407 PolarHBondContact OG1-O 3.49Å; E402-A407 HydrophobicContact CB-CB 4Å; Q403-A407 VanDerWaalsContact O-CB 3.3Å; Q403-A407 WeakPolarHBondContact O-CB 3.11Å; G404-A407 WeakPolarHBondContact O-CB 3.49Å; G404-A407 PolarHBondContact O-N 3.02Å; A407-D435 PolarHBondContact N-OD2 3.49Å; A407-E862 HydrophobicContact CB-CG 3.9Å
408	G	94.8	Very high	94.1	Very high	1 Å²	1	18 Å²	18	1%	0.01	9%	0.087	C	C	.	.	S	Bend	trans	-84.1	-160.7	-178.5	0	0	0	0	0	114.7	D345 H400 G406 L434 D435	D345-G408 VanDerWaalsContact O-O 3.07Å; H400-G408 WeakPolarHBondContact NE2-CA 3.27Å; G406-G408 VanDerWaalsContact C-N 3.3Å; G408-L434 CarbonylContact C-O 3.56Å; G408-L434 WeakPolarHBondContact CA-O 3.37Å; G408-D435 WeakPolarHBondContact CA-OD2 3.43Å; G408-D435 PolarHBondContact N-OD2 2.87Å
409	I	96.4	Very high	92.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	145.7	-173.2	-173.8	-177.2	0	0	0	110.6	T338 A344 T346 I350 F375 I411 L434	T338-I409 HydrophobicContact CG2-CD1 4.25Å; T338-I409 HydrophobicContact CG2-CG1 4.1Å; A344-I409 WeakPolarHBondContact O-CA 2.79Å; A344-I409 WeakPolarHBondContact O-CG1 3.27Å; T346-I409 HydrophobicContact CG2-CB 3.87Å; T346-I409 HydrophobicContact CG2-CD1 3.94Å; T346-I409 HydrophobicContact CG2-CG1 4.18Å; T346-I409 HydrophobicContact CG2-CG2 4.45Å; I350-I409 HydrophobicContact CD1-CD1 3.5Å; I350-I409 HydrophobicContact CD1-CG2 4.25Å; F375-I409 HydrophobicContact CB-CD1 3.74Å; F375-I409 HydrophobicContact CD1-CD1 4.42Å; F375-I409 HydrophobicContact CG-CD1 4.24Å; I409-I411 HydrophobicContact CD1-CD1 4.37Å; I409-I411 HydrophobicContact CD1-CG1 3.88Å; I409-I411 HydrophobicContact CG1-CG1 4.13Å; I409-I411 HydrophobicContact CG2-CD1 4.11Å; I409-I411 HydrophobicContact CG2-CG1 3.97Å; I409-L434 HydrophobicContact CG2-CB 4.02Å; I409-L434 PolarHBondContact N-O 2.94Å; I409-L434 PolarHBondContact O-N 2.93Å
410	F	96.7	Very high	91.3	Very high	11 Å²	11	23.8 Å²	23.8	5%	0.048	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	112.1	166.3	-173.3	-87	0	0	0	110.6	G339 R341 A344 S431 W433 H718	G339-F410 PolarHBondContact N-O 2.81Å; R341-F410 HydrophobicContact CB-CB 4.44Å; R341-F410 HydrophobicContact CB-CG 4.39Å; R341-F410 HydrophobicContact CG-CB 4.49Å; R341-F410 HydrophobicContact CG-CD1 3.79Å; R341-F410 HydrophobicContact CG-CD2 4.28Å; R341-F410 HydrophobicContact CG-CE1 4.01Å; R341-F410 HydrophobicContact CG-CE2 4.48Å; R341-F410 HydrophobicContact CG-CG 3.93Å; R341-F410 HydrophobicContact CG-CZ 4.35Å; A344-F410 HydrophobicContact CB-CB 3.92Å; A344-F410 PolarHBondContact O-N 2.8Å; A344-F410 VanDerWaalsContact O-N 3.14Å; F410-S431 VanDerWaalsContact CZ-C 3.4Å; F410-W433 HydrophobicContact CB-CD2 3.87Å; F410-W433 HydrophobicContact CB-CE3 3.78Å; F410-W433 HydrophobicContact CB-CH2 4Å; F410-W433 HydrophobicContact CB-CZ2 4.08Å; F410-W433 HydrophobicContact CB-CZ3 3.85Å; F410-W433 AromaticContact CD2-CD1 3.78Å; F410-W433 AromaticContact CD2-CD2 3.86Å; F410-W433 HydrophobicContact CD2-CD2 3.86Å; F410-W433 AromaticContact CD2-CE2 3.81Å; F410-W433 AromaticContact CD2-CG 3.82Å; F410-W433 HydrophobicContact CD2-CG 3.82Å; F410-W433 HydrophobicContact CD2-CZ2 4.5Å; F410-W433 AromaticContact CD2-NE1 3.76Å; F410-W433 HydrophobicContact CG-CD2 4.36Å; F410-H718 HydrophobicContact CE2-CB 4.46Å
411	I	97.7	Very high	89.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.6	179.2	-59.8	-179	0	0	0	109.1	V336 I350 I398 I409 V414 C430 S431 K432 L434	V336-I411 HydrophobicContact CG1-CG2 4.35Å; I350-I411 HydrophobicContact CD1-CD1 4.43Å; I398-I411 HydrophobicContact CD1-CD1 3.52Å; I398-I411 HydrophobicContact CG1-CD1 3.88Å; I398-I411 HydrophobicContact CG2-CD1 4.43Å; I409-I411 HydrophobicContact CD1-CD1 4.37Å; I409-I411 HydrophobicContact CD1-CG1 3.88Å; I409-I411 HydrophobicContact CG1-CG1 4.13Å; I409-I411 HydrophobicContact CG2-CD1 4.11Å; I409-I411 HydrophobicContact CG2-CG1 3.97Å; I411-V414 HydrophobicContact CG2-CG2 4.2Å; I411-C430 HydrophobicContact CB-CB 4.32Å; I411-C430 HydrophobicContact CG2-CB 4.01Å; I411-C430 WeakPolarHBondContact O-CB 3.46Å; I411-S431 VanDerWaalsContact O-CA 3.28Å; I411-S431 WeakPolarHBondContact O-CA 3.13Å; I411-S431 PolarHBondContact O-N 2.85Å; I411-K432 PolarHBondContact N-O 2.75Å; I411-K432 PolarHBondContact O-N 3.05Å; I411-L434 HydrophobicContact CB-CD1 4.32Å; I411-L434 HydrophobicContact CD1-CD1 4.12Å; I411-L434 HydrophobicContact CD1-CD2 3.97Å; I411-L434 HydrophobicContact CG1-CD1 4.21Å
412	E	95.2	Very high	88.3	Confident	53 Å²	53	25.3 Å²	25.3	25%	0.248	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-54.1	176.1	-173.6	-172.4	130.2	0	0	110.6	Y337 C430 S431	Y337-E412 PolarHBondContact O-N 2.83Å; E412-C430 CarbonylContact O-C 3.47Å; E412-C430 WeakPolarHBondContact O-CA 3.28Å; E412-C430 PolarHBondContact O-N 3.2Å; E412-S431 PolarHBondContact O-N 3.48Å; E412-S431 PolarHBondContact O-OG 3.07Å
413	R	95.3	Very high	87.3	Confident	18 Å²	18	24.4 Å²	24.4	7%	0.068	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	164.1	-179.5	60.2	-176.1	135.1	133.5	2.6	111.8	Y337 F428 D603	Y337-R413 HydrophobicContact CD2-CG 3.75Å; Y337-R413 HydrophobicContact CG-CG 3.91Å; Y337-R413 PolarHBondContact N-O 2.84Å; R413-F428 CarbonylContact C-O 3.43Å; R413-F428 WeakPolarHBondContact CA-O 3.41Å; R413-D603 IonicContact CZ-OD1 3.83Å; R413-D603 IonicContact NH1-OD1 2.7Å; R413-D603 IonicContact NH2-OD1 3.38Å; R413-D603 PolarHBondContact NH2-OD1 2.93Å
414	V	96.6	Very high	86.9	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.1	170.1	-177.5	0	0	0	0	108.8	V334 I335 I352 L396 I398 I411 V416 F428 L447	V334-V414 HydrophobicContact CG1-CG1 3.78Å; I335-V414 CarbonylContact O-C 3.58Å; I335-V414 WeakPolarHBondContact O-CA 3.17Å; I352-V414 HydrophobicContact CD1-CG1 4.26Å; L396-V414 HydrophobicContact CD2-CB 4.18Å; L396-V414 HydrophobicContact CD2-CG1 3.98Å; I398-V414 HydrophobicContact CD1-CG2 3.71Å; I411-V414 HydrophobicContact CG2-CG2 4.2Å; V414-V416 HydrophobicContact CG1-CG2 4.1Å; V414-F428 HydrophobicContact CB-CB 4.25Å; V414-F428 PolarHBondContact N-O 3.42Å; V414-F428 WeakPolarHBondContact O-CB 3.49Å; V414-F428 PolarHBondContact O-N 3.35Å; V414-L447 HydrophobicContact CG2-CD1 4.33Å
415	M	94.4	Very high	86.8	Confident	14 Å²	14	21.1 Å²	21.1	7%	0.069	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.9	170.4	-60.4	-64.5	-60	0	0	108.9	V334 I335 Y337 Y426 A427 V598	V334-M415 WeakPolarHBondContact CA-O 3.1Å; I335-M415 HydrophobicContact CB-CB 4.23Å; I335-M415 PolarHBondContact N-O 3.13Å; I335-M415 PolarHBondContact O-N 2.83Å; Y337-M415 HydrophobicContact CD2-CG 4.39Å; Y337-M415 HydrophobicContact CE2-CB 4.33Å; Y337-M415 HydrophobicContact CE2-CG 3.69Å; M415-Y426 CarbonylContact C-O 3.52Å; M415-Y426 WeakPolarHBondContact CA-O 3.39Å; M415-A427 HydrophobicContact CE-CB 3.89Å; M415-A427 HydrophobicContact SD-CB 3.59Å; M415-A427 VanDerWaalsContact SD-CB 3.59Å; M415-V598 HydrophobicContact CE-CG1 4.36Å
416	V	94.6	Very high	86.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.6	177.4	-174.1	0	0	0	0	109.1	Y332 E333 F354 L393 L396 V414 Y425 Y426 F428	Y332-V416 HydrophobicContact CD1-CG1 3.98Å; E333-V416 CarbonylContact O-C 3.49Å; E333-V416 VanDerWaalsContact O-CA 3.28Å; E333-V416 WeakPolarHBondContact O-CA 3.02Å; F354-V416 HydrophobicContact CE1-CG1 4.14Å; F354-V416 HydrophobicContact CE1-CG2 3.85Å; F354-V416 HydrophobicContact CZ-CG1 4.31Å; L393-V416 HydrophobicContact CD1-CB 3.96Å; L393-V416 HydrophobicContact CD1-CG1 3.54Å; L396-V416 HydrophobicContact CD2-CG2 4.21Å; V414-V416 HydrophobicContact CG1-CG2 4.1Å; V416-Y425 CarbonylContact O-C 3.43Å; V416-Y426 PolarHBondContact N-O 2.87Å; V416-Y426 WeakPolarHBondContact O-CD2 3.26Å; V416-Y426 PolarHBondContact O-N 3.11Å; V416-F428 HydrophobicContact CB-CE2 4.16Å; V416-F428 HydrophobicContact CG2-CD2 4.16Å; V416-F428 HydrophobicContact CG2-CE2 3.82Å
417	S	90.6	Very high	86.9	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.014	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.5	169.6	37.2	0	0	0	0	111.6	Y332 E333 P419 A424 Y425	Y332-S417 WeakPolarHBondContact CA-O 2.88Å; E333-S417 WeakPolarHBondContact CB-OG 2.86Å; E333-S417 PolarHBondContact N-O 3.41Å; E333-S417 PolarHBondContact O-N 2.92Å; E333-S417 PolarHBondContact OE2-OG 2.88Å; S417-P419 WeakPolarHBondContact O-CD 3.46Å; S417-A424 WeakPolarHBondContact CA-O 3.5Å; S417-Y425 VanDerWaalsContact CB-CE1 3.49Å; S417-Y425 VanDerWaalsContact OG-CE1 3.23Å; S417-Y425 WeakPolarHBondContact OG-CE1 3.42Å
418	E	83.5	Confident	87	Confident	8 Å²	8	21.4 Å²	21.4	4%	0.037	11%	0.113	C	C	.	.			trans	-114.2	85.9	167.8	-168.1	-174.7	152.8	0	0	109.3	Y332 Y389 T420 I421	Y332-E418 HydrophobicContact CD1-CB 4.1Å; Y332-E418 HydrophobicContact CD1-CG 4.28Å; Y332-E418 HydrophobicContact CE1-CB 3.86Å; Y332-E418 HydrophobicContact CE1-CG 3.87Å; Y332-E418 WeakPolarHBondContact CE1-OE2 3.34Å; Y332-E418 PolarHBondContact OH-OE2 2.84Å; Y389-E418 WeakPolarHBondContact CD2-OE1 3.48Å; Y389-E418 WeakPolarHBondContact CD2-OE2 3.45Å; Y389-E418 VanDerWaalsContact CE2-OE1 3.24Å; Y389-E418 WeakPolarHBondContact CE2-OE1 3.33Å; Y389-E418 VanDerWaalsContact CE2-OE2 3.23Å; Y389-E418 WeakPolarHBondContact CE2-OE2 3.35Å; E418-T420 PolarHBondContact O-N 3.15Å; E418-T420 VanDerWaalsContact O-N 3.14Å; E418-I421 WeakPolarHBondContact OE1-CD1 3.5Å; E418-I421 WeakPolarHBondContact OE1-CG1 3.18Å
419	P	71.2	Confident	87	Confident	46 Å²	46	22.6 Å²	22.6	30%	0.299	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.6	-175	25.1	-34.5	0	0	0	113.6	E333 S417 I421	E333-P419 HydrophobicContact CG-CG 4.11Å; S417-P419 WeakPolarHBondContact O-CD 3.46Å; P419-I421 PolarHBondContact O-N 2.96Å
420	T	66.1	Low	86.9	Confident	75 Å²	75	23 Å²	23	46%	0.46	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.3	-175.2	48.8	0	0	0	0	114.7	E418	E418-T420 PolarHBondContact O-N 3.15Å; E418-T420 VanDerWaalsContact O-N 3.14Å
421	I	61.5	Low	86.8	Confident	56 Å²	56	22.8 Å²	22.8	29%	0.287	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-38.9	-168.8	-58.8	-171.8	0	0	0	114.6	Y389 E418 P419	Y389-I421 HydrophobicContact CD2-CD1 3.65Å; Y389-I421 HydrophobicContact CE2-CD1 3.59Å; Y389-I421 HydrophobicContact CG-CD1 4.18Å; E418-I421 WeakPolarHBondContact OE1-CD1 3.5Å; E418-I421 WeakPolarHBondContact OE1-CG1 3.18Å; P419-I421 PolarHBondContact O-N 2.96Å
422	D	65.6	Low	86.7	Confident	74 Å²	74	26.8 Å²	26.8	40%	0.396	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-144.8	-0.8	-171.3	-161.9	20.7	0	0	0	115.8	A424 N454	D422-A424 HydrophobicContact CB-CB 4.21Å; D422-A424 PolarHBondContact O-N 2.98Å; D422-N454 PolarHBondContact OD1-ND2 2.91Å; D422-N454 VanDerWaalsContact OD1-ND2 3.14Å
423	D	71.1	Confident	86.8	Confident	53 Å²	53	24.3 Å²	24.3	28%	0.283	13%	0.129	S	C	.	.			trans	46.4	28.9	-173.8	-64.4	-42.5	0	0	0	113.7	M455 N456	D423-M455 HydrophobicContact CB-CB 4.42Å; D423-M455 PolarHBondContact O-N 2.76Å; D423-N456 PolarHBondContact OD2-ND2 2.96Å
424	A	82.8	Confident	86.9	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.008	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	127.3	-177.7	0	0	0	0	0	109.7	S417 D422 Y426 Y452 N454	S417-A424 WeakPolarHBondContact CA-O 3.5Å; D422-A424 HydrophobicContact CB-CB 4.21Å; D422-A424 PolarHBondContact O-N 2.98Å; A424-Y426 HydrophobicContact CB-CE2 3.87Å; A424-Y452 HydrophobicContact CB-CD2 4.12Å; A424-N454 VanDerWaalsContact CB-OD1 3.28Å; A424-N454 WeakPolarHBondContact CB-OD1 2.95Å
425	Y	89.5	Confident	86.8	Confident	25 Å²	25	23.6 Å²	23.6	10%	0.098	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	105.3	176.3	-77.2	-91.7	0	0	0	110.4	V416 S417 Y452 S453 M455 L600	V416-Y425 CarbonylContact O-C 3.43Å; S417-Y425 VanDerWaalsContact CB-CE1 3.49Å; S417-Y425 VanDerWaalsContact OG-CE1 3.23Å; S417-Y425 WeakPolarHBondContact OG-CE1 3.42Å; Y425-Y452 WeakPolarHBondContact O-CA 3.46Å; Y425-Y452 VanDerWaalsContact O-CB 3.29Å; Y425-Y452 WeakPolarHBondContact O-CB 3.45Å; Y425-S453 PolarHBondContact N-O 3.02Å; Y425-S453 PolarHBondContact O-N 2.78Å; Y425-M455 HydrophobicContact CD2-CG 4.26Å; Y425-M455 HydrophobicContact CE2-CB 4.37Å; Y425-M455 HydrophobicContact CE2-CE 3.51Å; Y425-M455 HydrophobicContact CE2-CG 3.8Å; Y425-M455 HydrophobicContact CE2-SD 4.48Å; Y425-M455 WeakPolarHBondContact OH-CE 3.02Å; Y425-L600 HydrophobicContact CD1-CD2 4.19Å; Y425-L600 HydrophobicContact CD2-CD1 4.01Å; Y425-L600 HydrophobicContact CD2-CD2 3.83Å; Y425-L600 HydrophobicContact CG-CD2 3.6Å
426	Y	93.3	Very high	86.8	Confident	13 Å²	13	26.9 Å²	26.9	5%	0.051	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128.3	177.2	-62.2	-93.1	0	0	0	110.9	E392 L393 M415 V416 A424 Y452	E392-Y426 HydrophobicContact CG-CE1 4.02Å; L393-Y426 HydrophobicContact CB-CD1 3.87Å; L393-Y426 HydrophobicContact CB-CD2 4.36Å; L393-Y426 HydrophobicContact CB-CE1 4.11Å; L393-Y426 HydrophobicContact CB-CG 4.01Å; L393-Y426 HydrophobicContact CD1-CD2 4Å; L393-Y426 HydrophobicContact CD1-CE2 4.46Å; L393-Y426 HydrophobicContact CD1-CG 4.23Å; L393-Y426 HydrophobicContact CG-CD2 4.31Å; L393-Y426 HydrophobicContact CG-CE2 4.39Å; L393-Y426 HydrophobicContact CG-CG 4.44Å; M415-Y426 CarbonylContact C-O 3.52Å; M415-Y426 WeakPolarHBondContact CA-O 3.39Å; V416-Y426 PolarHBondContact N-O 2.87Å; V416-Y426 WeakPolarHBondContact O-CD2 3.26Å; V416-Y426 PolarHBondContact O-N 3.11Å; A424-Y426 HydrophobicContact CB-CE2 3.87Å; Y426-Y452 AromaticContact CD1-CD1 3.88Å; Y426-Y452 HydrophobicContact CD1-CD1 3.88Å; Y426-Y452 HydrophobicContact CD1-CG 4.05Å; Y426-Y452 AromaticContact CE1-CD1 3.63Å; Y426-Y452 HydrophobicContact CE1-CD1 3.63Å; Y426-Y452 HydrophobicContact CE1-CE1 4.2Å; Y426-Y452 AromaticContact CE1-CG 3.89Å; Y426-Y452 HydrophobicContact CE1-CG 3.89Å
427	A	94.4	Very high	86.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.3	-179.1	0	0	0	0	0	112.2	M415 C449 A450 G451 V598 L604	M415-A427 HydrophobicContact CE-CB 3.89Å; M415-A427 HydrophobicContact SD-CB 3.59Å; M415-A427 VanDerWaalsContact SD-CB 3.59Å; A427-C449 CarbonylContact O-C 3.29Å; A427-C449 VanDerWaalsContact O-CA 3.29Å; A427-C449 WeakPolarHBondContact O-CA 3.43Å; A427-A450 PolarHBondContact O-N 3.33Å; A427-G451 PolarHBondContact N-O 3.04Å; A427-V598 HydrophobicContact CB-CB 4.47Å; A427-V598 HydrophobicContact CB-CG1 3.99Å; A427-V598 HydrophobicContact CB-CG2 3.61Å; A427-L604 HydrophobicContact CB-CD1 4.43Å; A427-L604 HydrophobicContact CB-CD2 3.85Å
428	F	95.6	Very high	86.8	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	91.3	179.9	-60	-96.8	0	0	0	109.8	L393 L396 R413 V414 V416 L447 C449	L393-F428 HydrophobicContact CB-CZ 3.98Å; L396-F428 HydrophobicContact CB-CD1 4.4Å; L396-F428 HydrophobicContact CB-CE1 4.22Å; L396-F428 HydrophobicContact CD2-CB 3.81Å; L396-F428 HydrophobicContact CD2-CD1 3.49Å; L396-F428 VanDerWaalsContact CD2-CD1 3.49Å; L396-F428 HydrophobicContact CD2-CD2 3.38Å; L396-F428 HydrophobicContact CD2-CE1 3.76Å; L396-F428 HydrophobicContact CD2-CE2 3.68Å; L396-F428 HydrophobicContact CD2-CG 3.27Å; L396-F428 HydrophobicContact CD2-CZ 3.86Å; L396-F428 HydrophobicContact CG-CB 4.33Å; L396-F428 HydrophobicContact CG-CD1 3.65Å; L396-F428 HydrophobicContact CG-CD2 4.44Å; L396-F428 HydrophobicContact CG-CE1 3.95Å; L396-F428 HydrophobicContact CG-CG 3.91Å; L396-F428 HydrophobicContact CG-CZ 4.48Å; R413-F428 CarbonylContact C-O 3.43Å; R413-F428 WeakPolarHBondContact CA-O 3.41Å; V414-F428 HydrophobicContact CB-CB 4.25Å; V414-F428 PolarHBondContact N-O 3.42Å; V414-F428 WeakPolarHBondContact O-CB 3.49Å; V414-F428 PolarHBondContact O-N 3.35Å; V416-F428 HydrophobicContact CB-CE2 4.16Å; V416-F428 HydrophobicContact CG2-CD2 4.16Å; V416-F428 HydrophobicContact CG2-CE2 3.82Å; F428-L447 HydrophobicContact CB-CB 4.1Å; F428-L447 HydrophobicContact CB-CD1 4.24Å; F428-L447 HydrophobicContact CD1-CB 4.36Å; F428-C449 HydrophobicContact CD1-CB 3.78Å; F428-C449 HydrophobicContact CE1-CB 3.39Å; F428-C449 HydrophobicContact CE2-CB 4.42Å; F428-C449 HydrophobicContact CG-CB 4.45Å; F428-C449 HydrophobicContact CZ-CB 3.75Å
429	P	94.4	Very high	87.1	Confident	26 Å²	26	28.5 Å²	28.5	17%	0.169	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	140.5	175.1	27.2	-33.2	0	0	0	110.7	A450 L604	P429-A450 HydrophobicContact CG-CB 4.01Å; P429-L604 HydrophobicContact CB-CD2 4.2Å
430	C	95.3	Very high	88.2	Confident	9 Å²	9	30.6 Å²	30.6	6%	0.061	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	-71.4	176	-174.4	0	0	0	0	110.5	I411 E412 K432 L447	I411-C430 HydrophobicContact CB-CB 4.32Å; I411-C430 HydrophobicContact CG2-CB 4.01Å; I411-C430 WeakPolarHBondContact O-CB 3.46Å; E412-C430 CarbonylContact O-C 3.47Å; E412-C430 WeakPolarHBondContact O-CA 3.28Å; E412-C430 PolarHBondContact O-N 3.2Å; C430-K432 VanDerWaalsContact C-N 3.3Å; C430-K432 WeakPolarHBondContact O-CG 3.47Å; C430-K432 PolarHBondContact O-N 2.99Å; C430-L447 HydrophobicContact CB-CD1 3.7Å; C430-L447 HydrophobicContact CB-CD2 3.87Å; C430-L447 HydrophobicContact CB-CG 4.47Å
431	S	95.1	Very high	89.5	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.042	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.6	44.9	-176.8	-62.4	0	0	0	0	113.8	F410 I411 E412 P606	F410-S431 VanDerWaalsContact CZ-C 3.4Å; I411-S431 VanDerWaalsContact O-CA 3.28Å; I411-S431 WeakPolarHBondContact O-CA 3.13Å; I411-S431 PolarHBondContact O-N 2.85Å; E412-S431 PolarHBondContact O-N 3.48Å; E412-S431 PolarHBondContact O-OG 3.07Å; S431-P606 VanDerWaalsContact OG-CB 3.27Å; S431-P606 WeakPolarHBondContact OG-CB 3.44Å
432	K	95.8	Very high	91.1	Very high	84 Å²	84	27.2 Å²	27.2	37%	0.365	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.8	-177.9	-65.4	177	-176.1	-176	0	111.1	I411 C430	I411-K432 PolarHBondContact N-O 2.75Å; I411-K432 PolarHBondContact O-N 3.05Å; C430-K432 VanDerWaalsContact C-N 3.3Å; C430-K432 WeakPolarHBondContact O-CG 3.47Å; C430-K432 PolarHBondContact O-N 2.99Å
433	W	96.1	Very high	92.5	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133.7	165.5	-75.6	107.6	0	0	0	110	R341 W342 A343 A344 F410 D435 Q438 R445 H718 P889 D890	R341-W433 HydrophobicContact CB-CZ2 4.11Å; W342-W433 WeakPolarHBondContact O-CH2 3.11Å; A343-W433 WeakPolarHBondContact O-CH2 3.18Å; A344-W433 HydrophobicContact CB-CH2 4.4Å; F410-W433 HydrophobicContact CB-CD2 3.87Å; F410-W433 HydrophobicContact CB-CE3 3.78Å; F410-W433 HydrophobicContact CB-CH2 4Å; F410-W433 HydrophobicContact CB-CZ2 4.08Å; F410-W433 HydrophobicContact CB-CZ3 3.85Å; F410-W433 AromaticContact CD2-CD1 3.78Å; F410-W433 AromaticContact CD2-CD2 3.86Å; F410-W433 HydrophobicContact CD2-CD2 3.86Å; F410-W433 AromaticContact CD2-CE2 3.81Å; F410-W433 AromaticContact CD2-CG 3.82Å; F410-W433 HydrophobicContact CD2-CG 3.82Å; F410-W433 HydrophobicContact CD2-CZ2 4.5Å; F410-W433 AromaticContact CD2-NE1 3.76Å; F410-W433 HydrophobicContact CG-CD2 4.36Å; W433-D435 HydrophobicContact CB-CB 4.46Å; W433-D435 HydrophobicContact CE3-CB 4.37Å; W433-Q438 HydrophobicContact CB-CB 3.68Å; W433-Q438 HydrophobicContact CB-CG 4.03Å; W433-Q438 VanDerWaalsContact CD1-OE1 3.28Å; W433-Q438 HydrophobicContact CD2-CG 4.02Å; W433-Q438 HydrophobicContact CE3-CG 4.41Å; W433-Q438 HydrophobicContact CG-CB 3.97Å; W433-Q438 HydrophobicContact CG-CG 3.83Å; W433-R445 PolarHBondContact O-NE 2.71Å; W433-R445 PolarHBondContact O-NH2 2.9Å; W433-H718 AromaticContact CD1-ND1 3.98Å; W433-H718 PolarHBondContact N-ND1 3.07Å; W433-P889 HydrophobicContact CH2-CB 3.83Å; W433-P889 HydrophobicContact CH2-CG 4.38Å; W433-P889 HydrophobicContact CZ2-CB 3.89Å; W433-P889 HydrophobicContact CZ3-CB 4.32Å; W433-D890 WeakPolarHBondContact CZ2-OD1 3.49Å; W433-D890 PolarHBondContact NE1-OD2 3.35Å
434	L	97.4	Very high	93.8	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	90.4	160.1	-74.4	71	0	0	0	104.3	I398 H400 G408 I409 I411 S442 R445	I398-L434 HydrophobicContact CG2-CD2 4.28Å; I398-L434 WeakPolarHBondContact O-CD2 3.3Å; H400-L434 PolarHBondContact NE2-O 2.81Å; G408-L434 CarbonylContact C-O 3.56Å; G408-L434 WeakPolarHBondContact CA-O 3.37Å; I409-L434 HydrophobicContact CG2-CB 4.02Å; I409-L434 PolarHBondContact N-O 2.94Å; I409-L434 PolarHBondContact O-N 2.93Å; I411-L434 HydrophobicContact CB-CD1 4.32Å; I411-L434 HydrophobicContact CD1-CD1 4.12Å; I411-L434 HydrophobicContact CD1-CD2 3.97Å; I411-L434 HydrophobicContact CG1-CD1 4.21Å; L434-S442 CarbonylContact C-O 3.55Å; L434-S442 VanDerWaalsContact CA-O 3.25Å; L434-S442 WeakPolarHBondContact CA-O 3.34Å; L434-R445 HydrophobicContact CD1-CG 4.16Å; L434-R445 HydrophobicContact CG-CG 4.08Å
435	D	95.5	Very high	94.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.145	C	C	.	.			trans	-161.7	134	-174.3	-178.3	-68.9	0	0	0	109.9	G406 A407 G408 W433 G437 Q438 G441 S442	G406-D435 VanDerWaalsContact CA-OD2 3.24Å; G406-D435 WeakPolarHBondContact CA-OD2 3.39Å; G406-D435 PolarHBondContact N-OD2 2.79Å; A407-D435 PolarHBondContact N-OD2 3.49Å; G408-D435 WeakPolarHBondContact CA-OD2 3.43Å; G408-D435 PolarHBondContact N-OD2 2.87Å; W433-D435 HydrophobicContact CB-CB 4.46Å; W433-D435 HydrophobicContact CE3-CB 4.37Å; D435-G437 VanDerWaalsContact C-N 3.28Å; D435-G437 PolarHBondContact O-N 3.37Å; D435-G437 VanDerWaalsContact OD1-CA 3.3Å; D435-G437 WeakPolarHBondContact OD1-CA 3.3Å; D435-G437 PolarHBondContact OD1-N 2.85Å; D435-Q438 HydrophobicContact CB-CB 3.81Å; D435-Q438 HydrophobicContact CB-CG 3.74Å; D435-Q438 PolarHBondContact O-N 2.81Å; D435-Q438 PolarHBondContact OD1-N 3.47Å; D435-G441 CarbonylContact O-C 3.23Å; D435-G441 WeakPolarHBondContact O-CA 3.34Å; D435-S442 PolarHBondContact N-O 3Å
436	Q	93.6	Very high	94.8	Very high	84 Å²	84	29.3 Å²	29.3	39%	0.393	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-29.7	-174.9	-169.3	-176.2	19.7	0	0	113.1	G441 C755	Q436-G441 VanDerWaalsContact O-CA 3.23Å; Q436-G441 WeakPolarHBondContact O-CA 3.28Å; Q436-C755 PolarHBondContact O-SG 2.96Å
437	G	92	Very high	95	Very high	11 Å²	11	29.2 Å²	29.2	11%	0.113	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	7.2	178.2	0	0	0	0	0	113.9	Y405 D435 K754 C755	Y405-G437 WeakPolarHBondContact CD2-O 3.39Å; D435-G437 VanDerWaalsContact C-N 3.28Å; D435-G437 PolarHBondContact O-N 3.37Å; D435-G437 VanDerWaalsContact OD1-CA 3.3Å; D435-G437 WeakPolarHBondContact OD1-CA 3.3Å; D435-G437 PolarHBondContact OD1-N 2.85Å; G437-K754 CarbonylContact O-C 3.15Å; G437-K754 VanDerWaalsContact O-CA 3.31Å; G437-K754 WeakPolarHBondContact O-CA 3.48Å; G437-C755 PolarHBondContact O-N 2.82Å
438	Q	93.6	Very high	94.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-117.1	127.5	-176.6	-77.6	-73.5	-27.8	0	0	112.9	W433 D435 D440 G441 T753 C755 P889	W433-Q438 HydrophobicContact CB-CB 3.68Å; W433-Q438 HydrophobicContact CB-CG 4.03Å; W433-Q438 VanDerWaalsContact CD1-OE1 3.28Å; W433-Q438 HydrophobicContact CD2-CG 4.02Å; W433-Q438 HydrophobicContact CE3-CG 4.41Å; W433-Q438 HydrophobicContact CG-CB 3.97Å; W433-Q438 HydrophobicContact CG-CG 3.83Å; D435-Q438 HydrophobicContact CB-CB 3.81Å; D435-Q438 HydrophobicContact CB-CG 3.74Å; D435-Q438 PolarHBondContact O-N 2.81Å; D435-Q438 PolarHBondContact OD1-N 3.47Å; Q438-D440 PolarHBondContact O-N 2.81Å; Q438-G441 PolarHBondContact O-N 3.39Å; Q438-T753 PolarHBondContact NE2-OG1 2.98Å; Q438-T753 VanDerWaalsContact OE1-C 3.28Å; Q438-T753 PolarHBondContact OE1-O 3.29Å; Q438-T753 PolarHBondContact OE1-OG1 3.27Å; Q438-C755 PolarHBondContact N-SG 3.15Å; Q438-C755 VanDerWaalsContact N-SG 3.36Å; Q438-P889 HydrophobicContact CG-CB 4.34Å
439	V	90.1	Very high	94.8	Very high	32 Å²	32	37.8 Å²	37.8	19%	0.194	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	-91.8	170.6	-171	0	0	0	0	114.1	L717 H718 T753 C755	V439-L717 HydrophobicContact CG1-CB 3.55Å; V439-L717 HydrophobicContact CG1-CD1 4.48Å; V439-L717 WeakPolarHBondContact CG2-O 3.49Å; V439-H718 HydrophobicContact CG2-CB 4.42Å; V439-H718 WeakPolarHBondContact CG2-ND1 3.46Å; V439-T753 WeakPolarHBondContact CG2-O 3.18Å; V439-T753 PolarHBondContact N-O 3.06Å; V439-C755 PolarHBondContact N-SG 3.49Å; V439-C755 PolarHBondContact O-SG 2.84Å
440	D	92.8	Very high	94.7	Very high	91 Å²	91	37.2 Å²	37.2	49%	0.487	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-0.5	-178.2	61.7	0.6	0	0	0	112.7	Q438 S442 R445 H718	Q438-D440 PolarHBondContact O-N 2.81Å; D440-S442 PolarHBondContact O-N 3.38Å; D440-S442 WeakPolarHBondContact OD1-CB 3.15Å; D440-S442 PolarHBondContact OD1-N 3.47Å; D440-R445 VanDerWaalsContact CG-NH2 3.31Å; D440-R445 IonicContact OD1-CZ 2.95Å; D440-R445 IonicContact OD1-NH1 3.9Å; D440-R445 IonicContact OD1-NH2 3.07Å; D440-R445 PolarHBondContact OD1-NH2 3.08Å; D440-R445 IonicContact OD2-CZ 3.72Å; D440-R445 IonicContact OD2-NH1 3.9Å; D440-R445 PolarHBondContact OD2-NH1 2.98Å; D440-R445 IonicContact OD2-NH2 2.83Å; D440-R445 PolarHBondContact OD2-NH2 3.4Å; D440-R445 VanDerWaalsContact OD2-NH2 3.15Å; D440-H718 IonicContact OD1-CE1 2.78Å
441	G	93.2	Very high	94.5	Very high	24 Å²	24	36.8 Å²	36.8	25%	0.247	20%	0.199	C	C	.	.			trans	66.4	18.3	179.6	0	0	0	0	0	114.3	D435 Q436 Q438	D435-G441 CarbonylContact O-C 3.23Å; D435-G441 WeakPolarHBondContact O-CA 3.34Å; Q436-G441 VanDerWaalsContact O-CA 3.23Å; Q436-G441 WeakPolarHBondContact O-CA 3.28Å; Q438-G441 PolarHBondContact O-N 3.39Å
442	S	95.4	Very high	94.3	Very high	36 Å²	36	38.6 Å²	38.6	25%	0.252	21%	0.205	S	C	.	.			trans	-88.7	122.8	-174.2	-173	0	0	0	0	111.7	L434 D435 D440 E444	L434-S442 CarbonylContact C-O 3.55Å; L434-S442 VanDerWaalsContact CA-O 3.25Å; L434-S442 WeakPolarHBondContact CA-O 3.34Å; D435-S442 PolarHBondContact N-O 3Å; D440-S442 PolarHBondContact O-N 3.38Å; D440-S442 WeakPolarHBondContact OD1-CB 3.15Å; D440-S442 PolarHBondContact OD1-N 3.47Å; S442-E444 PolarHBondContact OG-O 3.01Å
443	C	96.2	Very high	93.9	Very high	17 Å²	17	34.7 Å²	34.7	12%	0.115	19%	0.188	C	C	.	.	S	Bend	trans	-95.6	3.3	173.2	-57.4	0	0	0	0	113.5	G399 H400	G399-C443 WeakPolarHBondContact CA-O 3.44Å; H400-C443 PolarHBondContact N-O 2.84Å; H400-C443 VanDerWaalsContact N-O 3.11Å
444	E	97.5	Very high	93.1	Very high	86 Å²	86	36.4 Å²	36.4	40%	0.402	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	130.2	179.9	-174.3	-168.8	87.6	0	0	110	Y351 V397 I398 S442	Y351-E444 HydrophobicContact CE2-CG 4.38Å; Y351-E444 PolarHBondContact OH-OE2 2.8Å; Y351-E444 VanDerWaalsContact OH-OE2 3.11Å; V397-E444 HydrophobicContact CG1-CG 3.33Å; I398-E444 CarbonylContact O-C 3.33Å; I398-E444 WeakPolarHBondContact O-CA 3.29Å; S442-E444 PolarHBondContact OG-O 3.01Å
445	R	97.3	Very high	91.5	Very high	14 Å²	14	38.5 Å²	38.5	5%	0.053	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.8	-178	-65.8	-167.8	-178.2	-74.7	-2.4	114	V397 I398 W433 L434 D440 L447 H718	V397-R445 WeakPolarHBondContact CA-O 3.43Å; I398-R445 PolarHBondContact N-O 3.25Å; I398-R445 VanDerWaalsContact N-O 3.08Å; I398-R445 PolarHBondContact O-N 3.48Å; W433-R445 PolarHBondContact O-NE 2.71Å; W433-R445 PolarHBondContact O-NH2 2.9Å; L434-R445 HydrophobicContact CD1-CG 4.16Å; L434-R445 HydrophobicContact CG-CG 4.08Å; D440-R445 VanDerWaalsContact CG-NH2 3.31Å; D440-R445 IonicContact OD1-CZ 2.95Å; D440-R445 IonicContact OD1-NH1 3.9Å; D440-R445 IonicContact OD1-NH2 3.07Å; D440-R445 PolarHBondContact OD1-NH2 3.08Å; D440-R445 IonicContact OD2-CZ 3.72Å; D440-R445 IonicContact OD2-NH1 3.9Å; D440-R445 PolarHBondContact OD2-NH1 2.98Å; D440-R445 IonicContact OD2-NH2 2.83Å; D440-R445 PolarHBondContact OD2-NH2 3.4Å; D440-R445 VanDerWaalsContact OD2-NH2 3.15Å; R445-L447 HydrophobicContact CB-CD2 4.13Å; R445-L447 PolarHBondContact O-N 3.04Å; R445-H718 PolarHBondContact NH2-CE1 3.48Å; R445-H718 PolarHBondContact NH2-NE2 3.49Å
446	P	97.4	Very high	89.5	Confident	80 Å²	80	42.9 Å²	42.9	52%	0.519	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.8	166.9	30.7	-32.3	0	0	0	110.9	K395 L396 V397	K395-P446 HydrophobicContact CD-CB 4.34Å; L396-P446 CarbonylContact O-C 3.53Å; L396-P446 WeakPolarHBondContact O-CA 3.29Å; V397-P446 HydrophobicContact CG2-CB 4.34Å
447	L	96	Very high	87.4	Confident	10 Å²	10	40 Å²	40	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.6	177.4	-51.7	-173.1	0	0	0	110.8	K395 L396 I398 V414 F428 C430 R445	K395-L447 CarbonylContact C-O 3.21Å; K395-L447 VanDerWaalsContact CA-O 3.22Å; K395-L447 WeakPolarHBondContact CA-O 3.41Å; K395-L447 WeakPolarHBondContact CG-O 3.45Å; L396-L447 HydrophobicContact CD1-CB 4.07Å; L396-L447 HydrophobicContact CD1-CD1 3.91Å; L396-L447 HydrophobicContact CD1-CG 4.06Å; L396-L447 HydrophobicContact CG-CB 4.2Å; L396-L447 PolarHBondContact N-O 2.78Å; L396-L447 PolarHBondContact O-N 3.15Å; I398-L447 HydrophobicContact CG2-CD1 3.84Å; I398-L447 HydrophobicContact CG2-CG 4.11Å; V414-L447 HydrophobicContact CG2-CD1 4.33Å; F428-L447 HydrophobicContact CB-CB 4.1Å; F428-L447 HydrophobicContact CB-CD1 4.24Å; F428-L447 HydrophobicContact CD1-CB 4.36Å; C430-L447 HydrophobicContact CB-CD1 3.7Å; C430-L447 HydrophobicContact CB-CD2 3.87Å; C430-L447 HydrophobicContact CB-CG 4.47Å; R445-L447 HydrophobicContact CB-CD2 4.13Å; R445-L447 PolarHBondContact O-N 3.04Å
448	K	93.3	Very high	85.2	Confident	175 Å²	175	45.3 Å²	45.3	76%	0.761	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	140.9	172.1	-64.6	176.8	-175.4	169.8	0	108.9	A450	K448-A450 PolarHBondContact O-N 2.75Å
449	C	93.4	Very high	82.7	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.034	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-72.6	125.8	173	161.6	0	0	0	0	109.9	R394 A427 F428 G451 R571	R394-C449 PolarHBondContact O-N 2.92Å; A427-C449 CarbonylContact O-C 3.29Å; A427-C449 VanDerWaalsContact O-CA 3.29Å; A427-C449 WeakPolarHBondContact O-CA 3.43Å; F428-C449 HydrophobicContact CD1-CB 3.78Å; F428-C449 HydrophobicContact CE1-CB 3.39Å; F428-C449 HydrophobicContact CE2-CB 4.42Å; F428-C449 HydrophobicContact CG-CB 4.45Å; F428-C449 HydrophobicContact CZ-CB 3.75Å; C449-G451 PolarHBondContact SG-N 2.97Å; C449-G451 VanDerWaalsContact SG-N 3.43Å; C449-G451 PolarHBondContact SG-O 2.85Å; C449-R571 PolarHBondContact SG-NH1 2.82Å
450	A	92.1	Very high	80.2	Confident	14 Å²	14	56.1 Å²	56.1	12%	0.116	30%	0.297	C	S	.	.			trans	-74.6	-34.9	177.6	0	0	0	0	0	112	A427 P429 K448 R571 P596	A427-A450 PolarHBondContact O-N 3.33Å; P429-A450 HydrophobicContact CG-CB 4.01Å; K448-A450 PolarHBondContact O-N 2.75Å; A450-R571 PolarHBondContact O-N 2.98Å; A450-P596 HydrophobicContact CB-CG 4.06Å
451	G	91.4	Very high	77.5	Confident	1 Å²	1	61 Å²	61	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.1	-177.8	-177.4	0	0	0	0	0	111.9	A427 C449 H569	A427-G451 PolarHBondContact N-O 3.04Å; C449-G451 PolarHBondContact SG-N 2.97Å; C449-G451 VanDerWaalsContact SG-N 3.43Å; C449-G451 PolarHBondContact SG-O 2.85Å; G451-H569 CarbonylContact C-O 3.37Å; G451-H569 WeakPolarHBondContact CA-O 3.25Å
452	Y	90.7	Very high	74.6	Confident	43 Å²	43	66.1 Å²	66.1	17%	0.169	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157.9	172.2	62	-91.9	0	0	0	111.8	E392 A424 Y425 Y426 H569	E392-Y452 HydrophobicContact CG-CE1 4.26Å; A424-Y452 HydrophobicContact CB-CD2 4.12Å; Y425-Y452 WeakPolarHBondContact O-CA 3.46Å; Y425-Y452 VanDerWaalsContact O-CB 3.29Å; Y425-Y452 WeakPolarHBondContact O-CB 3.45Å; Y426-Y452 AromaticContact CD1-CD1 3.88Å; Y426-Y452 HydrophobicContact CD1-CD1 3.88Å; Y426-Y452 HydrophobicContact CD1-CG 4.05Å; Y426-Y452 AromaticContact CE1-CD1 3.63Å; Y426-Y452 HydrophobicContact CE1-CD1 3.63Å; Y426-Y452 HydrophobicContact CE1-CE1 4.2Å; Y426-Y452 AromaticContact CE1-CG 3.89Å; Y426-Y452 HydrophobicContact CE1-CG 3.89Å; Y452-H569 HydrophobicContact CD1-CB 3.88Å; Y452-H569 AromaticContact CD1-CG 3.99Å; Y452-H569 AromaticContact CD1-ND1 3.67Å; Y452-H569 HydrophobicContact CD2-CB 4.06Å; Y452-H569 HydrophobicContact CE1-CB 3.6Å; Y452-H569 AromaticContact CE1-CE1 3.88Å; Y452-H569 AromaticContact CE1-CG 3.38Å; Y452-H569 AromaticContact CE1-ND1 3.2Å; Y452-H569 WeakPolarHBondContact CE1-ND1 3.39Å; Y452-H569 HydrophobicContact CE2-CB 3.79Å; Y452-H569 HydrophobicContact CG-CB 4.1Å; Y452-H569 AromaticContact CZ-CG 3.57Å; Y452-H569 AromaticContact CZ-ND1 3.89Å; Y452-H569 PolarHBondContact N-O 3.27Å; Y452-H569 PolarHBondContact O-N 3.28Å
453	S	87.1	Confident	71.9	Confident	3 Å²	3	73 Å²	73	2%	0.021	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.1	177	172.3	0	0	0	0	109.7	Y425	Y425-S453 PolarHBondContact N-O 3.02Å; Y425-S453 PolarHBondContact O-N 2.78Å
454	N	78.6	Confident	69	Low	36 Å²	36	75.9 Å²	75.9	19%	0.193	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	128.5	-177.6	-67.3	10.7	0	0	0	109.9	D422 A424 N456	D422-N454 PolarHBondContact OD1-ND2 2.91Å; D422-N454 VanDerWaalsContact OD1-ND2 3.14Å; A424-N454 VanDerWaalsContact CB-OD1 3.28Å; A424-N454 WeakPolarHBondContact CB-OD1 2.95Å; N454-N456 PolarHBondContact O-N 2.9Å
455	M	63.9	Low	66.1	Low	45 Å²	45	79 Å²	79	22%	0.222	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-67	-20.7	-178.4	-103.4	-139.3	-93.1	0	0	114.4	D423 Y425 A457 F458 L600	D423-M455 HydrophobicContact CB-CB 4.42Å; D423-M455 PolarHBondContact O-N 2.76Å; Y425-M455 HydrophobicContact CD2-CG 4.26Å; Y425-M455 HydrophobicContact CE2-CB 4.37Å; Y425-M455 HydrophobicContact CE2-CE 3.51Å; Y425-M455 HydrophobicContact CE2-CG 3.8Å; Y425-M455 HydrophobicContact CE2-SD 4.48Å; Y425-M455 WeakPolarHBondContact OH-CE 3.02Å; M455-A457 PolarHBondContact O-N 3.42Å; M455-F458 PolarHBondContact O-N 2.97Å; M455-F458 VanDerWaalsContact O-N 3.09Å; M455-L600 HydrophobicContact CB-CD1 4.37Å; M455-L600 HydrophobicContact CG-CD1 3.35Å
456	N	54.4	Low	63.3	Low	93 Å²	93	87 Å²	87	50%	0.497	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-63.1	-0.1	-175.3	-77.9	-40.7	0	0	0	115.5	D423 N454 F458 S459	D423-N456 PolarHBondContact OD2-ND2 2.96Å; N454-N456 PolarHBondContact O-N 2.9Å; N456-F458 VanDerWaalsContact C-N 3.33Å; N456-S459 PolarHBondContact O-OG 3.32Å
457	A	48.3	Very low	60.3	Low	25 Å²	25	87.2 Å²	87.2	21%	0.207	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-73.2	-20.6	169.2	0	0	0	0	0	113.8	M455 D566	M455-A457 PolarHBondContact O-N 3.42Å; A457-D566 HydrophobicContact CB-CB 3.77Å
458	F	46.8	Very low	57.7	Low	121 Å²	121	93 Å²	93	53%	0.531	47%	0.473	S	S	.	.	S	Bend	trans	-99.8	-3.6	-175.7	-67.2	-79	0	0	0	114.9	M455 N456 M601	M455-F458 PolarHBondContact O-N 2.97Å; M455-F458 VanDerWaalsContact O-N 3.09Å; N456-F458 VanDerWaalsContact C-N 3.33Å; F458-M601 HydrophobicContact CD1-CE 4.47Å; F458-M601 HydrophobicContact CE1-CE 4.09Å; F458-M601 HydrophobicContact CE2-CE 4.14Å; F458-M601 HydrophobicContact CZ-CE 3.91Å
459	S	40.3	Very low	55.1	Low	84 Å²	84	92.4 Å²	92.4	59%	0.587	48%	0.479	S	S	*	.			trans	-94.9	9.6	-172.7	55.9	0	0	0	0	115.5	N456	N456-S459 PolarHBondContact O-OG 3.32Å
460	K	37.8	Very low	52.8	Low	175 Å²	175	94.1 Å²	94.1	76%	0.761	49%	0.493	S	S	*	.	S	Bend	trans	-82.7	118.7	166.2	-76.4	-175.7	179.6	174.8	0	109.3	N462	K460-N462 PolarHBondContact O-N 3.48Å
461	E	37.4	Very low	51	Low	195 Å²	195	99.2 Å²	99.2	91%	0.911	52%	0.515	S	S	*	.			trans	-54.5	55.2	179	-63.3	174.1	140.7	0	0	115.5
462	N	31.1	Very low	49.8	Very low	131 Å²	131	100.8 Å²	100.8	70%	0.701	52%	0.523	S	S	*	.			trans	-111	99.9	168.6	-75.7	-12.4	0	0	0	108.9	K460 S464	K460-N462 PolarHBondContact O-N 3.48Å; N462-S464 PolarHBondContact O-N 2.69Å
463	D	39.3	Very low	49.3	Very low	181 Å²	181	101.1 Å²	101.1	97%	0.968	53%	0.526	S	S	*	.			trans	-59.3	27.5	169.6	-99.4	-24.6	0	0	0	114.3
464	S	34.9	Very low	49.4	Very low	76 Å²	76	101.3 Å²	101.3	53%	0.531	53%	0.526	S	S	.	.			trans	-106.7	48.2	177	66.3	0	0	0	0	111.7	N462 Y466 S467	N462-S464 PolarHBondContact O-N 2.69Å; S464-Y466 PolarHBondContact O-N 3.42Å; S464-S467 PolarHBondContact O-N 3.44Å
465	M	37.7	Very low	50	Low	151 Å²	151	102.5 Å²	102.5	74%	0.744	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.6	177.2	-164.7	163.4	74.9	0	0	113.4
466	Y	37.9	Very low	51.5	Low	184 Å²	184	100.4 Å²	100.4	72%	0.722	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	12	-179.4	-75.9	-75.3	0	0	0	115.7	S464 I468	S464-Y466 PolarHBondContact O-N 3.42Å; Y466-I468 PolarHBondContact O-N 3.38Å
467	S	33.9	Very low	53.4	Low	84 Å²	84	98 Å²	98	59%	0.587	51%	0.505	S	S	*	.			trans	-98.3	49.9	172.9	-176.4	0	0	0	0	112.7	S464 N469	S464-S467 PolarHBondContact O-N 3.44Å; S467-N469 PolarHBondContact O-N 2.82Å
468	I	40.5	Very low	55.5	Low	130 Å²	130	96.9 Å²	96.9	67%	0.667	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	65.4	171.5	-51	174	0	0	0	108.7	Y466	Y466-I468 PolarHBondContact O-N 3.38Å
469	N	39.3	Very low	57.7	Low	163 Å²	163	94.3 Å²	94.3	87%	0.872	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	1.5	154.1	-81.6	-19.7	0	0	0	110.7	S467	S467-N469 PolarHBondContact O-N 2.82Å
470	A	45.8	Very low	60.2	Low	41 Å²	41	90.3 Å²	90.3	34%	0.339	46%	0.456	S	S	.	.	S	Bend	trans	-69.4	130.2	169.4	0	0	0	0	0	108.6	N472 E563	A470-N472 PolarHBondContact O-N 2.93Å; A470-N472 VanDerWaalsContact O-N 3.09Å; A470-E563 WeakPolarHBondContact CB-OE2 3.16Å
471	E	54.3	Low	62.7	Low	122 Å²	122	82.3 Å²	82.3	57%	0.57	42%	0.423	S	S	*	.			trans	-53.1	117.2	177.4	-66	178.3	166	0	0	109.2	Q473	E471-Q473 HydrophobicContact CB-CG 3.92Å; E471-Q473 PolarHBondContact O-N 3.15Å; E471-Q473 PolarHBondContact OE2-NE2 3.07Å
472	N	65	Low	65.1	Low	33 Å²	33	77.7 Å²	77.7	18%	0.176	40%	0.4	C	S	.	.			trans	-62.8	81.8	172.4	-94.3	0.9	0	0	0	109.1	A470 Q529 G531	A470-N472 PolarHBondContact O-N 2.93Å; A470-N472 VanDerWaalsContact O-N 3.09Å; N472-Q529 WeakPolarHBondContact CB-O 3.27Å; N472-G531 PolarHBondContact ND2-O 3.47Å; N472-G531 VanDerWaalsContact ND2-O 3.08Å
473	Q	81.7	Confident	67.8	Low	50 Å²	50	71.8 Å²	71.8	23%	0.234	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	112.8	177.9	-63.2	-165	-2.3	0	0	109	E471 I562	E471-Q473 HydrophobicContact CB-CG 3.92Å; E471-Q473 PolarHBondContact O-N 3.15Å; E471-Q473 PolarHBondContact OE2-NE2 3.07Å; Q473-I562 HydrophobicContact CB-CD1 3.89Å; Q473-I562 WeakPolarHBondContact O-CG1 3.24Å; Q473-I562 PolarHBondContact O-N 3.23Å
474	W	88.5	Confident	69.9	Low	8 Å²	8	68.2 Å²	68.2	3%	0.03	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.7	178.3	-69.3	82.9	0	0	0	110	L527 F533 L559 H561 D566	W474-L527 HydrophobicContact CB-CB 4.28Å; W474-L527 PolarHBondContact N-O 3.07Å; W474-L527 VanDerWaalsContact N-O 3.08Å; W474-L527 PolarHBondContact O-N 2.83Å; W474-F533 HydrophobicContact CB-CD2 4.24Å; W474-F533 HydrophobicContact CB-CE2 3.86Å; W474-F533 AromaticContact CD1-CD2 3.72Å; W474-F533 AromaticContact CD1-CE2 3.45Å; W474-F533 VanDerWaalsContact CD1-CE2 3.45Å; W474-F533 HydrophobicContact CD2-CD2 4.35Å; W474-F533 AromaticContact CG-CD2 3.85Å; W474-F533 HydrophobicContact CG-CD2 3.85Å; W474-F533 AromaticContact CG-CE2 3.73Å; W474-F533 HydrophobicContact CG-CE2 3.73Å; W474-L559 HydrophobicContact CB-CD1 4.06Å; W474-L559 HydrophobicContact CB-CG 4.33Å; W474-L559 HydrophobicContact CD2-CD2 3.83Å; W474-L559 HydrophobicContact CD2-CG 4.07Å; W474-L559 HydrophobicContact CE3-CB 4.4Å; W474-L559 HydrophobicContact CE3-CD1 4.38Å; W474-L559 HydrophobicContact CE3-CD2 3.45Å; W474-L559 VanDerWaalsContact CE3-CD2 3.45Å; W474-L559 HydrophobicContact CE3-CG 3.42Å; W474-L559 VanDerWaalsContact CE3-CG 3.42Å; W474-L559 HydrophobicContact CG-CD2 4.42Å; W474-L559 HydrophobicContact CH2-CD2 4.41Å; W474-L559 HydrophobicContact CZ3-CD2 3.74Å; W474-L559 HydrophobicContact CZ3-CG 3.96Å; W474-H561 AromaticContact CD1-CD2 3.87Å; W474-H561 HydrophobicContact CD2-CB 4.1Å; W474-H561 AromaticContact CD2-CD2 3.68Å; W474-H561 AromaticContact CE2-CD2 3.39Å; W474-H561 HydrophobicContact CE3-CB 3.69Å; W474-H561 VanDerWaalsContact CE3-N 3.32Å; W474-H561 HydrophobicContact CH2-CB 3.8Å; W474-H561 HydrophobicContact CZ2-CB 4.13Å; W474-H561 AromaticContact CZ2-CD2 3.73Å; W474-H561 HydrophobicContact CZ3-CB 3.57Å; W474-H561 AromaticContact NE1-CD2 3.48Å; W474-H561 PolarHBondContact NE1-CD2 2.9Å; W474-D566 HydrophobicContact CH2-CB 4.23Å; W474-D566 WeakPolarHBondContact CH2-OD2 3.2Å; W474-D566 HydrophobicContact CZ3-CB 4.43Å
475	K	91.4	Very high	72.3	Confident	61 Å²	61	66.1 Å²	66.1	27%	0.265	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116.6	173.3	-176	-176.1	-178.4	-173.1	0	108.7	Q477 S524 M526 L560 I562	K475-Q477 HydrophobicContact CD-CG 4.37Å; K475-Q477 HydrophobicContact CG-CG 4.28Å; K475-S524 WeakPolarHBondContact CE-OG 3.28Å; K475-M526 HydrophobicContact CB-SD 4.28Å; K475-M526 HydrophobicContact CG-SD 4.28Å; K475-L560 HydrophobicContact CB-CB 4.43Å; K475-L560 PolarHBondContact N-O 2.99Å; K475-L560 PolarHBondContact O-N 3.31Å; K475-I562 HydrophobicContact CB-CD1 4.47Å; K475-I562 HydrophobicContact CB-CG1 4.33Å
476	L	94.4	Very high	74.4	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.8	171.4	-176.9	71	0	0	0	109.4	I478 V494 S524 V525 L527 I536 A557 E558 L559 I570	L476-I478 HydrophobicContact CD2-CD1 3.9Å; L476-I478 HydrophobicContact CD2-CG1 3.98Å; L476-I478 HydrophobicContact CG-CD1 4.41Å; L476-I478 HydrophobicContact CG-CG1 3.97Å; L476-V494 HydrophobicContact CD2-CG1 3.52Å; L476-S524 CarbonylContact O-C 3.46Å; L476-S524 WeakPolarHBondContact O-CA 2.99Å; L476-V525 HydrophobicContact CB-CB 4.42Å; L476-V525 PolarHBondContact N-O 3.27Å; L476-V525 PolarHBondContact O-N 3.49Å; L476-L527 HydrophobicContact CB-CD1 3.95Å; L476-L527 HydrophobicContact CB-CG 4.4Å; L476-I536 HydrophobicContact CD2-CG2 4.1Å; L476-A557 HydrophobicContact CD1-CB 4.17Å; L476-E558 CarbonylContact C-O 3.52Å; L476-E558 WeakPolarHBondContact CA-O 3.33Å; L476-L559 HydrophobicContact CB-CD1 4.1Å; L476-L559 HydrophobicContact CD1-CB 4.46Å; L476-L559 HydrophobicContact CD1-CD1 3.99Å; L476-I570 HydrophobicContact CD1-CD1 4.38Å
477	Q	94.3	Very high	76.5	Confident	44 Å²	44	67.6 Å²	67.6	21%	0.206	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.3	174.7	-58.1	-165.5	-70.2	0	0	109.3	K475 I522 Y523 A557 E558	K475-Q477 HydrophobicContact CD-CG 4.37Å; K475-Q477 HydrophobicContact CG-CG 4.28Å; Q477-I522 HydrophobicContact CB-CG2 3.94Å; Q477-Y523 CarbonylContact C-O 3.54Å; Q477-Y523 WeakPolarHBondContact CA-O 3.2Å; Q477-A557 CarbonylContact O-C 3.58Å; Q477-A557 WeakPolarHBondContact O-CA 3.25Å; Q477-E558 PolarHBondContact N-O 2.98Å; Q477-E558 PolarHBondContact O-N 3.16Å
478	I	94.4	Very high	78.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.5	-177.4	-54.6	172.7	0	0	0	108.1	L476 I480 L492 V494 I522 Y523 L538 I554 A557	L476-I478 HydrophobicContact CD2-CD1 3.9Å; L476-I478 HydrophobicContact CD2-CG1 3.98Å; L476-I478 HydrophobicContact CG-CD1 4.41Å; L476-I478 HydrophobicContact CG-CG1 3.97Å; I478-I480 HydrophobicContact CG2-CD1 3.93Å; I478-L492 HydrophobicContact CD1-CD2 4.1Å; I478-L492 HydrophobicContact CG2-CD2 4.39Å; I478-V494 HydrophobicContact CD1-CG2 3.58Å; I478-I522 CarbonylContact O-C 3.54Å; I478-I522 WeakPolarHBondContact O-CA 3.29Å; I478-Y523 PolarHBondContact N-O 3.14Å; I478-Y523 PolarHBondContact O-N 3.2Å; I478-L538 HydrophobicContact CD1-CD2 3.84Å; I478-I554 HydrophobicContact CG2-CG2 3.91Å; I478-A557 HydrophobicContact CG1-CB 4.35Å
479	K	92.8	Very high	80.9	Confident	68 Å²	68	65.3 Å²	65.3	30%	0.296	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	112.4	175.1	-171.6	-179.1	-178.7	-161.4	0	109.6	I522 E555 S556	K479-I522 HydrophobicContact CB-CG1 4.21Å; K479-I522 HydrophobicContact CG-CG1 4.09Å; K479-E555 HydrophobicContact CB-CB 4.42Å; K479-E555 HydrophobicContact CD-CB 4.23Å; K479-E555 HydrophobicContact CD-CG 4.37Å; K479-E555 WeakPolarHBondContact CD-OE2 3.4Å; K479-E555 WeakPolarHBondContact CE-OE2 3.44Å; K479-E555 HydrophobicContact CG-CB 4.25Å; K479-E555 IonicContact NZ-OE1 2.9Å; K479-E555 PolarHBondContact NZ-OE1 3.04Å; K479-E555 IonicContact NZ-OE2 3.88Å; K479-E555 PolarHBondContact NZ-OE2 3.29Å; K479-E555 PolarHBondContact O-N 3.16Å; K479-S556 PolarHBondContact N-O 2.86Å
480	I	92.4	Very high	83.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.7	172.6	-58.4	-55.7	0	0	0	108.4	I478 I483 L492 V516 E520 T521 Y523 L552 I554	I478-I480 HydrophobicContact CG2-CD1 3.93Å; I480-I483 HydrophobicContact CG2-CD1 4.49Å; I480-I483 HydrophobicContact CG2-CG1 4.09Å; I480-L492 HydrophobicContact CD1-CD2 4.34Å; I480-V516 HydrophobicContact CG1-CG1 4.13Å; I480-V516 HydrophobicContact CG1-CG2 4.48Å; I480-V516 HydrophobicContact CG2-CG1 4.13Å; I480-E520 CarbonylContact O-C 3.55Å; I480-E520 WeakPolarHBondContact O-CA 3.39Å; I480-E520 PolarHBondContact O-N 2.9Å; I480-T521 PolarHBondContact N-O 2.84Å; I480-T521 PolarHBondContact O-N 3.23Å; I480-Y523 HydrophobicContact CB-CE2 4.28Å; I480-Y523 HydrophobicContact CG1-CD2 3.69Å; I480-Y523 HydrophobicContact CG1-CE2 3.76Å; I480-L552 HydrophobicContact CD1-CD1 4.19Å; I480-L552 HydrophobicContact CD1-CD2 4.39Å; I480-L552 HydrophobicContact CD1-CG 4.46Å; I480-L552 HydrophobicContact CG2-CD1 3.6Å; I480-I554 HydrophobicContact CD1-CG1 4.19Å
481	G	89.5	Confident	85.2	Confident	6 Å²	6	58.8 Å²	58.8	6%	0.062	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-66.4	178.2	0	0	0	0	0	111.6	E520 Q553	G481-E520 WeakPolarHBondContact O-CG 3.28Å; G481-E520 PolarHBondContact O-N 3.38Å; G481-E520 VanDerWaalsContact O-N 3.16Å; G481-Q553 PolarHBondContact N-O 3.15Å
482	K	88.4	Confident	87	Confident	99 Å²	99	53 Å²	53	43%	0.43	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.2	-173.3	-59.3	-173	-174.8	178.9	0	111.6	Y484 Q553	K482-Y484 HydrophobicContact CB-CD2 4.33Å; K482-Y484 HydrophobicContact CB-CE2 3.59Å; K482-Y484 HydrophobicContact CD-CE2 4.1Å; K482-Y484 WeakPolarHBondContact CD-OH 3.35Å; K482-Q553 HydrophobicContact CB-CB 4.02Å; K482-Q553 PolarHBondContact N-O 2.66Å; K482-Q553 PolarHBondContact O-N 2.83Å
483	I	88	Confident	88.3	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.036	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.2	175.7	-51	171	0	0	0	107.8	I480 P485 Y488 P490 V516 A519 L552	I480-I483 HydrophobicContact CG2-CD1 4.49Å; I480-I483 HydrophobicContact CG2-CG1 4.09Å; I483-P485 CarbonylContact C-O 3.54Å; I483-Y488 HydrophobicContact CG2-CD1 4.02Å; I483-Y488 WeakPolarHBondContact CG2-O 3.48Å; I483-P490 HydrophobicContact CG2-CG 4.25Å; I483-V516 HydrophobicContact CD1-CG1 3.56Å; I483-V516 HydrophobicContact CG1-CG1 4.32Å; I483-A519 HydrophobicContact CD1-CB 4.23Å; I483-A519 HydrophobicContact CG1-CB 4.13Å; I483-L552 HydrophobicContact CG1-CD1 3.94Å
484	Y	83.8	Confident	88.9	Confident	105 Å²	105	49.3 Å²	49.3	41%	0.412	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.6	180	-63.2	-84.6	0	0	0	109.8	K482 M550 A551	K482-Y484 HydrophobicContact CB-CD2 4.33Å; K482-Y484 HydrophobicContact CB-CE2 3.59Å; K482-Y484 HydrophobicContact CD-CE2 4.1Å; K482-Y484 WeakPolarHBondContact CD-OH 3.35Å; Y484-M550 CarbonylContact O-C 3.44Å; Y484-M550 VanDerWaalsContact O-CA 3.23Å; Y484-M550 WeakPolarHBondContact O-CA 3.49Å; Y484-A551 HydrophobicContact CD2-CB 4.11Å; Y484-A551 PolarHBondContact N-O 3.2Å; Y484-A551 PolarHBondContact O-N 2.59Å
485	P	85	Confident	89.2	Confident	32 Å²	32	49.9 Å²	49.9	21%	0.208	22%	0.221	C	C	.	.	S	Bend	cis	-62.8	167.4	-20.3	33.3	-38.1	0	0	0	111.2	I483 D487 Y488 I548	I483-P485 CarbonylContact C-O 3.54Å; P485-D487 VanDerWaalsContact C-N 3.26Å; P485-D487 VanDerWaalsContact CB-OD1 3.22Å; P485-D487 WeakPolarHBondContact CB-OD1 3.32Å; P485-D487 WeakPolarHBondContact CG-OD1 3.27Å; P485-D487 PolarHBondContact O-N 2.84Å; P485-Y488 WeakPolarHBondContact O-CB 3.43Å; P485-Y488 PolarHBondContact O-N 2.86Å; P485-Y488 VanDerWaalsContact O-N 3.11Å; P485-I548 HydrophobicContact CB-CG2 4.16Å; P485-I548 HydrophobicContact CG-CG2 4.03Å
486	R	80.9	Confident	89.2	Confident	235 Å²	235	47 Å²	47	89%	0.887	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-27.9	-170.3	-73.3	-170.9	-168.7	-175.4	3.8	114.4	Y488	R486-Y488 VanDerWaalsContact C-N 3.3Å
487	D	82	Confident	89.2	Confident	132 Å²	132	47 Å²	47	71%	0.706	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13.1	178.2	56.6	-46.2	0	0	0	113	P485	P485-D487 VanDerWaalsContact C-N 3.26Å; P485-D487 VanDerWaalsContact CB-OD1 3.22Å; P485-D487 WeakPolarHBondContact CB-OD1 3.32Å; P485-D487 WeakPolarHBondContact CG-OD1 3.27Å; P485-D487 PolarHBondContact O-N 2.84Å
488	Y	82	Confident	88.8	Confident	25 Å²	25	44.9 Å²	44.9	10%	0.098	20%	0.199	C	C	.	.			trans	-66.2	135	176.2	-179	-121.7	0	0	0	111.4	I483 P485 R486 P490 Q543 M550 L578	I483-Y488 HydrophobicContact CG2-CD1 4.02Å; I483-Y488 WeakPolarHBondContact CG2-O 3.48Å; P485-Y488 WeakPolarHBondContact O-CB 3.43Å; P485-Y488 PolarHBondContact O-N 2.86Å; P485-Y488 VanDerWaalsContact O-N 3.11Å; R486-Y488 VanDerWaalsContact C-N 3.3Å; Y488-P490 HydrophobicContact CD1-CB 4.18Å; Y488-P490 HydrophobicContact CD1-CG 3.78Å; Y488-P490 HydrophobicContact CE1-CB 3.39Å; Y488-P490 HydrophobicContact CE1-CG 3.5Å; Y488-P490 VanDerWaalsContact CE1-CG 3.5Å; Y488-P490 WeakPolarHBondContact O-CD 2.9Å; Y488-Q543 PolarHBondContact OH-OE1 2.9Å; Y488-M550 HydrophobicContact CD2-SD 4.15Å; Y488-M550 HydrophobicContact CE2-SD 4.04Å; Y488-L578 HydrophobicContact CD1-CD1 4.29Å; Y488-L578 HydrophobicContact CE1-CD1 3.45Å; Y488-L578 VanDerWaalsContact CE1-CD1 3.45Å; Y488-L578 HydrophobicContact CE1-CD2 4.15Å; Y488-L578 HydrophobicContact CE1-CG 4.38Å; Y488-L578 VanDerWaalsContact OH-CD2 3.25Å; Y488-L578 WeakPolarHBondContact OH-CD2 3.49Å
489	K	84.4	Confident	88.1	Confident	140 Å²	140	45.5 Å²	45.5	61%	0.609	20%	0.203	S	C	*	.			trans	-117.8	82.9	178.7	-66.3	-178.3	-176.8	175.8	0	110.3	V516	K489-V516 WeakPolarHBondContact CA-O 3.31Å
490	P	86.1	Confident	86.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.21	C	C	.	.			trans	-66.2	144.4	-178.6	10.5	-12	0	0	0	112.7	I483 Y488 V516 L552	I483-P490 HydrophobicContact CG2-CG 4.25Å; Y488-P490 HydrophobicContact CD1-CB 4.18Å; Y488-P490 HydrophobicContact CD1-CG 3.78Å; Y488-P490 HydrophobicContact CE1-CB 3.39Å; Y488-P490 HydrophobicContact CE1-CG 3.5Å; Y488-P490 VanDerWaalsContact CE1-CG 3.5Å; Y488-P490 WeakPolarHBondContact O-CD 2.9Å; P490-V516 HydrophobicContact CG-CB 4.03Å; P490-V516 HydrophobicContact CG-CG1 4.44Å; P490-V516 PolarHBondContact O-N 3.24Å; P490-L552 HydrophobicContact CB-CD2 4.42Å; P490-L552 HydrophobicContact CG-CB 4.47Å; P490-L552 HydrophobicContact CG-CD1 3.98Å; P490-L552 HydrophobicContact CG-CD2 4.26Å; P490-L552 HydrophobicContact CG-CG 4.47Å
491	E	89.6	Confident	85.4	Confident	68 Å²	68	50.2 Å²	50.2	32%	0.318	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	112.1	163.4	-71	-153.7	163.8	0	0	109.2	L513 K515	E491-L513 HydrophobicContact CB-CD1 3.6Å; E491-L513 HydrophobicContact CG-CD1 4.13Å; E491-K515 VanDerWaalsContact OE1-CE 3.27Å; E491-K515 WeakPolarHBondContact OE1-CE 3.39Å; E491-K515 IonicContact OE1-NZ 3.59Å
492	L	91.9	Very high	83.6	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	113.7	179.7	177.7	68.5	0	0	0	110	I478 I480 V494 V514 V516 L538 V540 L552 I554	I478-L492 HydrophobicContact CD1-CD2 4.1Å; I478-L492 HydrophobicContact CG2-CD2 4.39Å; I480-L492 HydrophobicContact CD1-CD2 4.34Å; L492-V494 HydrophobicContact CD2-CG2 4.45Å; L492-V494 HydrophobicContact CG-CG2 4.33Å; L492-V514 HydrophobicContact CB-CB 4.25Å; L492-V514 PolarHBondContact N-O 2.86Å; L492-V514 PolarHBondContact O-N 3.09Å; L492-V516 HydrophobicContact CB-CG2 4Å; L492-L538 HydrophobicContact CD1-CB 4.27Å; L492-V540 HydrophobicContact CD1-CG1 3.83Å; L492-L552 HydrophobicContact CD1-CD2 4.15Å; L492-I554 HydrophobicContact CD1-CD1 4.38Å
493	H	92.8	Very high	81.9	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.019	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	120.5	171.6	-63.3	-51.9	0	0	0	111	F495 R511 L513 E539 D541	H493-F495 HydrophobicContact CB-CD2 4.32Å; H493-F495 HydrophobicContact CB-CE2 3.62Å; H493-F495 HydrophobicContact CB-CZ 4.29Å; H493-R511 PolarHBondContact CE1-NH2 3.38Å; H493-R511 PolarHBondContact ND1-NE 2.89Å; H493-R511 PolarHBondContact ND1-NH2 3.27Å; H493-R511 VanDerWaalsContact ND1-NH2 3.11Å; H493-R511 PolarHBondContact NE2-NH2 3.39Å; H493-L513 VanDerWaalsContact CE1-CD1 3.42Å; H493-L513 WeakPolarHBondContact CE1-CD1 3.37Å; H493-E539 WeakPolarHBondContact CA-O 3.49Å; H493-E539 HydrophobicContact CB-CB 4.22Å; H493-E539 WeakPolarHBondContact CB-O 3.35Å; H493-E539 PolarHBondContact N-O 2.73Å; H493-E539 PolarHBondContact O-N 2.81Å; H493-D541 IonicContact CD2-OD1 3.79Å; H493-D541 PolarHBondContact CD2-OD1 2.93Å; H493-D541 IonicContact NE2-OD1 2.66Å; H493-D541 PolarHBondContact NE2-OD1 2.83Å; H493-D541 IonicContact NE2-OD2 2.98Å; H493-D541 PolarHBondContact NE2-OD2 3.08Å
494	V	94.3	Very high	80.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.3	176.8	179.9	0	0	0	0	108	L476 I478 L492 R511 R512 V514 V525 L538	L476-V494 HydrophobicContact CD2-CG1 3.52Å; I478-V494 HydrophobicContact CD1-CG2 3.58Å; L492-V494 HydrophobicContact CD2-CG2 4.45Å; L492-V494 HydrophobicContact CG-CG2 4.33Å; V494-R511 CarbonylContact O-C 3.55Å; V494-R511 WeakPolarHBondContact O-CA 3.49Å; V494-R512 HydrophobicContact CB-CB 4.37Å; V494-R512 PolarHBondContact N-O 3.03Å; V494-R512 PolarHBondContact O-N 3.45Å; V494-V514 HydrophobicContact CG2-CG2 3.96Å; V494-V525 HydrophobicContact CG2-CG2 4.43Å; V494-L538 HydrophobicContact CB-CD2 4.33Å; V494-L538 HydrophobicContact CG1-CD2 4.11Å; V494-L538 HydrophobicContact CG2-CD2 3.9Å
495	F	94.3	Very high	79.1	Confident	20 Å²	20	59.5 Å²	59.5	9%	0.088	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.6	173	-60.9	-93.1	0	0	0	110	H493 Y497 Q509 Q510 R511 I536 R537 E539	H493-F495 HydrophobicContact CB-CD2 4.32Å; H493-F495 HydrophobicContact CB-CE2 3.62Å; H493-F495 HydrophobicContact CB-CZ 4.29Å; F495-Y497 HydrophobicContact CB-CE2 3.83Å; F495-Q509 HydrophobicContact CB-CG 4.5Å; F495-Q509 HydrophobicContact CD1-CG 4.03Å; F495-Q510 CarbonylContact C-O 3.54Å; F495-Q510 VanDerWaalsContact CA-O 3.26Å; F495-Q510 WeakPolarHBondContact CA-O 3.36Å; F495-R511 HydrophobicContact CD1-CB 3.74Å; F495-R511 HydrophobicContact CD1-CG 3.91Å; F495-R511 HydrophobicContact CE1-CB 3.67Å; F495-R511 HydrophobicContact CE1-CG 3.52Å; F495-R511 HydrophobicContact CE2-CG 4.41Å; F495-R511 HydrophobicContact CZ-CB 4.46Å; F495-R511 HydrophobicContact CZ-CG 3.8Å; F495-I536 CarbonylContact O-C 3.55Å; F495-I536 WeakPolarHBondContact O-CA 3.32Å; F495-R537 HydrophobicContact CB-CB 4.14Å; F495-R537 PolarHBondContact N-O 2.89Å; F495-R537 PolarHBondContact O-N 2.84Å; F495-E539 HydrophobicContact CD2-CB 4.35Å; F495-E539 HydrophobicContact CE2-CB 4.02Å; F495-E539 HydrophobicContact CE2-CG 4.44Å; F495-E539 WeakPolarHBondContact CE2-OE2 3.37Å
496	A	93.2	Very high	78.3	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.2	175.5	0	0	0	0	0	110.1	Q509 Q510 L527 F533 I536	A496-Q509 WeakPolarHBondContact O-CA 3.5Å; A496-Q510 PolarHBondContact N-O 3.43Å; A496-Q510 PolarHBondContact O-N 3.42Å; A496-L527 HydrophobicContact CB-CD1 3.81Å; A496-L527 HydrophobicContact CB-CD2 3.94Å; A496-L527 HydrophobicContact CB-CG 4.45Å; A496-F533 HydrophobicContact CB-CD1 3.74Å; A496-F533 HydrophobicContact CB-CE1 3.51Å; A496-F533 HydrophobicContact CB-CZ 4.41Å; A496-I536 HydrophobicContact CB-CD1 3.68Å
497	Y	92.6	Very high	78.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.8	-177.3	-66.3	-100.9	0	0	0	109.9	F495 Y507 S508 Q509 F533 Y534 K535 R537 D638	F495-Y497 HydrophobicContact CB-CE2 3.83Å; Y497-Y507 AromaticContact CD1-CD2 3.74Å; Y497-Y507 HydrophobicContact CD1-CD2 3.74Å; Y497-Y507 HydrophobicContact CD1-CE2 4.02Å; Y497-Y507 HydrophobicContact CE1-CD2 4.1Å; Y497-Y507 AromaticContact CE1-CE2 3.88Å; Y497-Y507 HydrophobicContact CE1-CE2 3.88Å; Y497-S508 WeakPolarHBondContact CA-O 3.35Å; Y497-Q509 HydrophobicContact CD1-CB 4.34Å; Y497-Q509 HydrophobicContact CD1-CG 4.41Å; Y497-Q509 HydrophobicContact CE1-CB 4.16Å; Y497-Q509 HydrophobicContact CE1-CG 3.91Å; Y497-Q509 HydrophobicContact CE2-CG 4.41Å; Y497-Q509 PolarHBondContact OH-NE2 2.85Å; Y497-F533 WeakPolarHBondContact O-CA 3.22Å; Y497-Y534 PolarHBondContact O-N 2.94Å; Y497-K535 HydrophobicContact CD2-CB 4.23Å; Y497-K535 HydrophobicContact CD2-CD 4.14Å; Y497-K535 HydrophobicContact CD2-CG 3.81Å; Y497-K535 HydrophobicContact CE2-CD 4.44Å; Y497-K535 VanDerWaalsContact CE2-CE 3.45Å; Y497-K535 HydrophobicContact CE2-CG 4.41Å; Y497-K535 HydrophobicContact CG-CB 4.31Å; Y497-K535 HydrophobicContact CG-CD 4.41Å; Y497-K535 VanDerWaalsContact CG-CE 3.5Å; Y497-K535 HydrophobicContact CG-CG 4.27Å; Y497-K535 PolarHBondContact N-O 3.42Å; Y497-R537 HydrophobicContact CE2-CB 4.19Å; Y497-R537 PolarHBondContact OH-NH1 2.88Å; Y497-D638 WeakPolarHBondContact CE1-OD2 3.45Å; Y497-D638 VanDerWaalsContact OH-CG 3.29Å; Y497-D638 PolarHBondContact OH-OD1 2.8Å; Y497-D638 PolarHBondContact OH-OD2 2.82Å
498	S	87.4	Confident	78.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	152.9	-178.8	57.4	0	0	0	0	112.1	Y507 S508 Q529 N532 Y534	S498-Y507 CarbonylContact O-C 3.6Å; S498-Y507 WeakPolarHBondContact O-CA 3.25Å; S498-S508 PolarHBondContact N-O 3.14Å; S498-S508 PolarHBondContact O-N 2.87Å; S498-Q529 VanDerWaalsContact OG-CG 3.29Å; S498-Q529 WeakPolarHBondContact OG-CG 3.28Å; S498-Q529 PolarHBondContact OG-NE2 2.84Å; S498-Q529 PolarHBondContact OG-OE1 2.94Å; S498-N532 WeakPolarHBondContact CA-O 3.49Å; S498-Y534 VanDerWaalsContact C-CE1 3.41Å
499	S	79.7	Confident	78.5	Confident	13 Å²	13	52.1 Å²	52.1	9%	0.091	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.4	177.5	59.4	0	0	0	0	110.3	N501 G531 N532	S499-N501 VanDerWaalsContact C-N 3.31Å; S499-N501 WeakPolarHBondContact CB-O 3.26Å; S499-N501 PolarHBondContact O-N 2.79Å; S499-N501 PolarHBondContact OG-O 2.8Å; S499-G531 WeakPolarHBondContact O-CA 3.26Å; S499-N532 PolarHBondContact N-O 3.4Å
500	V	67	Low	78.8	Confident	74 Å²	74	46.8 Å²	46.8	45%	0.448	24%	0.243	S	C	.	.	S	Bend	trans	-69.6	-32.4	178.6	-178.8	0	0	0	0	111.6	N506	V500-N506 HydrophobicContact CB-CB 4.17Å; V500-N506 HydrophobicContact CG2-CB 4.33Å; V500-N506 WeakPolarHBondContact CG2-O 3.47Å; V500-N506 PolarHBondContact N-O 3.42Å
501	N	60	Low	79.1	Confident	94 Å²	94	53.7 Å²	53.7	50%	0.503	27%	0.268	S	S	.	.	S	Bend	trans	-124.6	175.9	179.7	-67.1	-20.3	0	0	0	110.5	S499 A503	S499-N501 VanDerWaalsContact C-N 3.31Å; S499-N501 WeakPolarHBondContact CB-O 3.26Å; S499-N501 PolarHBondContact O-N 2.79Å; S499-N501 PolarHBondContact OG-O 2.8Å; N501-A503 PolarHBondContact O-N 3.28Å; N501-A503 VanDerWaalsContact O-N 3.16Å
502	K	51.9	Low	79.3	Confident	222 Å²	222	54.9 Å²	54.9	97%	0.965	27%	0.27	S	S	*	.	S	Bend	trans	-55	-29.3	169.6	-70.3	-172.3	177.9	-175.8	0	112.8
503	A	52.6	Low	79.4	Confident	51 Å²	51	58.7 Å²	58.7	42%	0.421	29%	0.29	S	S	.	.	S	Bend	trans	-89.1	135.2	170.4	0	0	0	0	0	110.7	N501 T505	N501-A503 PolarHBondContact O-N 3.28Å; N501-A503 VanDerWaalsContact O-N 3.16Å; A503-T505 HydrophobicContact CB-CG2 4.46Å; A503-T505 PolarHBondContact O-N 2.93Å; A503-T505 VanDerWaalsContact O-N 3.16Å
504	R	56.7	Low	79.4	Confident	53 Å²	53	59.1 Å²	59.1	20%	0.2	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	1.7	178	-64.8	-176.9	172.8	162.2	-3.8	114.6	N506 D603 L636	R504-N506 PolarHBondContact O-N 3.44Å; R504-N506 VanDerWaalsContact O-N 3.15Å; R504-D603 VanDerWaalsContact CZ-O 3.31Å; R504-D603 PolarHBondContact NH1-O 3.34Å; R504-D603 PolarHBondContact NH2-O 2.78Å; R504-L636 HydrophobicContact CB-CD2 3.32Å; R504-L636 HydrophobicContact CG-CD2 4.25Å
505	T	57.2	Low	79.2	Confident	86 Å²	86	65.3 Å²	65.3	53%	0.528	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-13	-173.8	60.6	0	0	0	0	114.5	A503	A503-T505 HydrophobicContact CB-CG2 4.46Å; A503-T505 PolarHBondContact O-N 2.93Å; A503-T505 VanDerWaalsContact O-N 3.16Å
506	N	67.2	Low	79	Confident	92 Å²	92	64.3 Å²	64.3	49%	0.492	32%	0.316	S	S	.	.	S	Bend	trans	-124.3	114.3	168	-70.5	-34.4	0	0	0	107.7	V500 R504	V500-N506 HydrophobicContact CB-CB 4.17Å; V500-N506 HydrophobicContact CG2-CB 4.33Å; V500-N506 WeakPolarHBondContact CG2-O 3.47Å; V500-N506 PolarHBondContact N-O 3.42Å; R504-N506 PolarHBondContact O-N 3.44Å; R504-N506 VanDerWaalsContact O-N 3.15Å
507	Y	79.3	Confident	78.8	Confident	64 Å²	64	68.8 Å²	68.8	25%	0.251	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	152.9	174.3	73.5	-91.5	0	0	0	111.5	Y497 S498 Q509 Y534 G637	Y497-Y507 AromaticContact CD1-CD2 3.74Å; Y497-Y507 HydrophobicContact CD1-CD2 3.74Å; Y497-Y507 HydrophobicContact CD1-CE2 4.02Å; Y497-Y507 HydrophobicContact CE1-CD2 4.1Å; Y497-Y507 AromaticContact CE1-CE2 3.88Å; Y497-Y507 HydrophobicContact CE1-CE2 3.88Å; S498-Y507 CarbonylContact O-C 3.6Å; S498-Y507 WeakPolarHBondContact O-CA 3.25Å; Y507-Q509 HydrophobicContact CD2-CB 4.4Å; Y507-Q509 HydrophobicContact CE2-CB 4.28Å; Y507-Y534 WeakPolarHBondContact CB-OH 3.35Å; Y507-G637 VanDerWaalsContact CZ-CA 3.46Å
508	S	82.7	Confident	78.6	Confident	46 Å²	46	75 Å²	75	32%	0.322	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.6	167.6	-165.2	0	0	0	0	108.7	Y497 S498 Q529	Y497-S508 WeakPolarHBondContact CA-O 3.35Å; S498-S508 PolarHBondContact N-O 3.14Å; S498-S508 PolarHBondContact O-N 2.87Å; S508-Q529 PolarHBondContact O-NE2 2.76Å; S508-Q529 PolarHBondContact OG-NE2 3Å
509	Q	88.1	Confident	78.7	Confident	66 Å²	66	77 Å²	77	31%	0.308	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124.7	-175.8	-179	-176.1	3.1	0	0	109.3	F495 A496 Y497 Y507 D638	F495-Q509 HydrophobicContact CB-CG 4.5Å; F495-Q509 HydrophobicContact CD1-CG 4.03Å; A496-Q509 WeakPolarHBondContact O-CA 3.5Å; Y497-Q509 HydrophobicContact CD1-CB 4.34Å; Y497-Q509 HydrophobicContact CD1-CG 4.41Å; Y497-Q509 HydrophobicContact CE1-CB 4.16Å; Y497-Q509 HydrophobicContact CE1-CG 3.91Å; Y497-Q509 HydrophobicContact CE2-CG 4.41Å; Y497-Q509 PolarHBondContact OH-NE2 2.85Å; Y507-Q509 HydrophobicContact CD2-CB 4.4Å; Y507-Q509 HydrophobicContact CE2-CB 4.28Å; Q509-D638 PolarHBondContact OE1-OD2 3.38Å
510	Q	90.1	Very high	79.2	Confident	29 Å²	29	84 Å²	84	14%	0.136	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.6	173.1	-177.5	172	45.8	0	0	109.7	F495 A496 L527 H528	F495-Q510 CarbonylContact C-O 3.54Å; F495-Q510 VanDerWaalsContact CA-O 3.26Å; F495-Q510 WeakPolarHBondContact CA-O 3.36Å; A496-Q510 PolarHBondContact N-O 3.43Å; A496-Q510 PolarHBondContact O-N 3.42Å; Q510-L527 VanDerWaalsContact OE1-CA 3.28Å; Q510-H528 PolarHBondContact NE2-O 3.36Å; Q510-H528 VanDerWaalsContact NE2-O 3.1Å; Q510-H528 PolarHBondContact OE1-O 2.88Å
511	R	92.9	Very high	80.4	Confident	144 Å²	144	82.3 Å²	82.3	54%	0.543	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	136.4	172.5	-174.7	-176.5	176.6	-140.6	14.5	110.6	H493 V494 F495	H493-R511 PolarHBondContact CE1-NH2 3.38Å; H493-R511 PolarHBondContact ND1-NE 2.89Å; H493-R511 PolarHBondContact ND1-NH2 3.27Å; H493-R511 VanDerWaalsContact ND1-NH2 3.11Å; H493-R511 PolarHBondContact NE2-NH2 3.39Å; V494-R511 CarbonylContact O-C 3.55Å; V494-R511 WeakPolarHBondContact O-CA 3.49Å; F495-R511 HydrophobicContact CD1-CB 3.74Å; F495-R511 HydrophobicContact CD1-CG 3.91Å; F495-R511 HydrophobicContact CE1-CB 3.67Å; F495-R511 HydrophobicContact CE1-CG 3.52Å; F495-R511 HydrophobicContact CE2-CG 4.41Å; F495-R511 HydrophobicContact CZ-CB 4.46Å; F495-R511 HydrophobicContact CZ-CG 3.8Å
512	R	93.5	Very high	82	Confident	94 Å²	94	82.4 Å²	82.4	36%	0.355	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.8	168.9	-66.2	-69	-172.2	-177	-6.4	108.9	V494 V525 M526 L527 H528	V494-R512 HydrophobicContact CB-CB 4.37Å; V494-R512 PolarHBondContact N-O 3.03Å; V494-R512 PolarHBondContact O-N 3.45Å; R512-V525 HydrophobicContact CB-CG1 3.46Å; R512-V525 VanDerWaalsContact CB-CG1 3.46Å; R512-V525 HydrophobicContact CG-CG1 3.49Å; R512-V525 VanDerWaalsContact CG-CG1 3.49Å; R512-M526 PolarHBondContact NE-O 3.14Å; R512-L527 HydrophobicContact CG-CD2 4.27Å; R512-H528 PolarHBondContact NH2-ND1 3.3Å
513	L	93.4	Very high	84	Confident	80 Å²	80	73.5 Å²	73.5	42%	0.419	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.6	175.1	170.7	62.4	0	0	0	109	E491 H493	E491-L513 HydrophobicContact CB-CD1 3.6Å; E491-L513 HydrophobicContact CG-CD1 4.13Å; H493-L513 VanDerWaalsContact CE1-CD1 3.42Å; H493-L513 WeakPolarHBondContact CE1-CD1 3.37Å
514	V	92.6	Very high	85.9	Confident	14 Å²	14	74 Å²	74	9%	0.085	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117	175.7	-178.9	0	0	0	0	108.1	L492 V494 V516 Y523 V525	L492-V514 HydrophobicContact CB-CB 4.25Å; L492-V514 PolarHBondContact N-O 2.86Å; L492-V514 PolarHBondContact O-N 3.09Å; V494-V514 HydrophobicContact CG2-CG2 3.96Å; V514-V516 HydrophobicContact CG1-CG2 4.41Å; V514-V516 PolarHBondContact O-N 3.19Å; V514-Y523 HydrophobicContact CG1-CD1 3.51Å; V514-Y523 HydrophobicContact CG1-CE1 4.34Å; V514-Y523 HydrophobicContact CG1-CG 3.72Å; V514-V525 HydrophobicContact CG2-CG2 3.28Å
515	K	91.6	Very high	87.7	Confident	129 Å²	129	72 Å²	72	56%	0.561	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	112.7	172.4	-64.3	-169.2	175.8	-162	0	108.8	E491 Y523	E491-K515 VanDerWaalsContact OE1-CE 3.27Å; E491-K515 WeakPolarHBondContact OE1-CE 3.39Å; E491-K515 IonicContact OE1-NZ 3.59Å; K515-Y523 WeakPolarHBondContact O-CE1 3.17Å
516	V	90.2	Very high	89.3	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.352	C	S	.	.			trans	-89.2	113	-178.3	-176.3	0	0	0	0	108.5	I480 I483 K489 P490 L492 V514 Y523 L552	I480-V516 HydrophobicContact CG1-CG1 4.13Å; I480-V516 HydrophobicContact CG1-CG2 4.48Å; I480-V516 HydrophobicContact CG2-CG1 4.13Å; I483-V516 HydrophobicContact CD1-CG1 3.56Å; I483-V516 HydrophobicContact CG1-CG1 4.32Å; K489-V516 WeakPolarHBondContact CA-O 3.31Å; P490-V516 HydrophobicContact CG-CB 4.03Å; P490-V516 HydrophobicContact CG-CG1 4.44Å; P490-V516 PolarHBondContact O-N 3.24Å; L492-V516 HydrophobicContact CB-CG2 4Å; V514-V516 HydrophobicContact CG1-CG2 4.41Å; V514-V516 PolarHBondContact O-N 3.19Å; V516-Y523 HydrophobicContact CG1-CE2 4.01Å; V516-L552 HydrophobicContact CG1-CD1 4.2Å
517	N	88.8	Confident	90.4	Very high	93 Å²	93	66.9 Å²	66.9	50%	0.497	33%	0.329	S	S	.	.			trans	-104.6	-31.5	-177.6	-64.5	-28.7	0	0	0	112.9	Y523	N517-Y523 PolarHBondContact N-OH 2.71Å
518	E	88.7	Confident	90.4	Very high	130 Å²	130	67.7 Å²	67.7	61%	0.607	34%	0.335	S	S	*	.			trans	-132	139.4	-171.8	-67.2	176.6	-166.2	0	0	110.8	T521 Y523	E518-T521 WeakPolarHBondContact CB-OG1 3.41Å; E518-Y523 PolarHBondContact N-OH 2.73Å; E518-Y523 PolarHBondContact O-OH 3.11Å; E518-Y523 VanDerWaalsContact O-OH 3.1Å
519	A	88.3	Confident	89.7	Confident	44 Å²	44	66.8 Å²	66.8	36%	0.364	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	167.6	168.9	0	0	0	0	0	110.7	I483 T521	I483-A519 HydrophobicContact CD1-CB 4.23Å; I483-A519 HydrophobicContact CG1-CB 4.13Å; A519-T521 PolarHBondContact O-N 3.47Å; A519-T521 PolarHBondContact O-OG1 3.41Å
520	E	90.1	Very high	88.4	Confident	158 Å²	158	71.6 Å²	71.6	74%	0.738	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	21.8	179.7	-57	-174.9	173.2	0	0	114.9	I480 G481	I480-E520 CarbonylContact O-C 3.55Å; I480-E520 WeakPolarHBondContact O-CA 3.39Å; I480-E520 PolarHBondContact O-N 2.9Å; G481-E520 WeakPolarHBondContact O-CG 3.28Å; G481-E520 PolarHBondContact O-N 3.38Å; G481-E520 VanDerWaalsContact O-N 3.16Å
521	T	92.8	Very high	87.4	Confident	39 Å²	39	71.3 Å²	71.3	24%	0.239	35%	0.35	C	S	.	.			trans	-112.1	144.9	-172.7	-61.1	0	0	0	0	111.3	I480 E518 A519 Y523	I480-T521 PolarHBondContact N-O 2.84Å; I480-T521 PolarHBondContact O-N 3.23Å; E518-T521 WeakPolarHBondContact CB-OG1 3.41Å; A519-T521 PolarHBondContact O-N 3.47Å; A519-T521 PolarHBondContact O-OG1 3.41Å; T521-Y523 HydrophobicContact CG2-CD2 4.37Å; T521-Y523 HydrophobicContact CG2-CE2 3.87Å
522	I	93.5	Very high	86.8	Confident	97 Å²	97	67.2 Å²	67.2	50%	0.497	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115.9	176.1	-58.7	173.8	0	0	0	109.5	Q477 I478 K479	Q477-I522 HydrophobicContact CB-CG2 3.94Å; I478-I522 CarbonylContact O-C 3.54Å; I478-I522 WeakPolarHBondContact O-CA 3.29Å; K479-I522 HydrophobicContact CB-CG1 4.21Å; K479-I522 HydrophobicContact CG-CG1 4.09Å
523	Y	94	Very high	86.6	Confident	35 Å²	35	62.8 Å²	62.8	14%	0.137	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	138.1	174.6	-65.3	-97.6	0	0	0	109.7	Q477 I478 I480 V514 K515 V516 N517 E518 T521	Q477-Y523 CarbonylContact C-O 3.54Å; Q477-Y523 WeakPolarHBondContact CA-O 3.2Å; I478-Y523 PolarHBondContact N-O 3.14Å; I478-Y523 PolarHBondContact O-N 3.2Å; I480-Y523 HydrophobicContact CB-CE2 4.28Å; I480-Y523 HydrophobicContact CG1-CD2 3.69Å; I480-Y523 HydrophobicContact CG1-CE2 3.76Å; V514-Y523 HydrophobicContact CG1-CD1 3.51Å; V514-Y523 HydrophobicContact CG1-CE1 4.34Å; V514-Y523 HydrophobicContact CG1-CG 3.72Å; K515-Y523 WeakPolarHBondContact O-CE1 3.17Å; V516-Y523 HydrophobicContact CG1-CE2 4.01Å; N517-Y523 PolarHBondContact N-OH 2.71Å; E518-Y523 PolarHBondContact N-OH 2.73Å; E518-Y523 PolarHBondContact O-OH 3.11Å; E518-Y523 VanDerWaalsContact O-OH 3.1Å; T521-Y523 HydrophobicContact CG2-CD2 4.37Å; T521-Y523 HydrophobicContact CG2-CE2 3.87Å
524	S	93.3	Very high	86.4	Confident	62 Å²	62	59.3 Å²	59.3	43%	0.434	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.6	179.9	-66.6	0	0	0	0	110.8	K475 L476	K475-S524 WeakPolarHBondContact CE-OG 3.28Å; L476-S524 CarbonylContact O-C 3.46Å; L476-S524 WeakPolarHBondContact O-CA 2.99Å
525	V	93.1	Very high	86.4	Confident	10 Å²	10	58.7 Å²	58.7	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.2	-178.6	-178.1	0	0	0	0	109.4	L476 V494 R512 V514 L527	L476-V525 HydrophobicContact CB-CB 4.42Å; L476-V525 PolarHBondContact N-O 3.27Å; L476-V525 PolarHBondContact O-N 3.49Å; V494-V525 HydrophobicContact CG2-CG2 4.43Å; R512-V525 HydrophobicContact CB-CG1 3.46Å; R512-V525 VanDerWaalsContact CB-CG1 3.46Å; R512-V525 HydrophobicContact CG-CG1 3.49Å; R512-V525 VanDerWaalsContact CG-CG1 3.49Å; V514-V525 HydrophobicContact CG2-CG2 3.28Å; V525-L527 HydrophobicContact CG1-CD2 4.06Å
526	M	92	Very high	86.5	Confident	70 Å²	70	52.6 Å²	52.6	35%	0.345	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	118.9	175.4	-63.9	-66.5	-64	0	0	110.4	K475 R512 I562	K475-M526 HydrophobicContact CB-SD 4.28Å; K475-M526 HydrophobicContact CG-SD 4.28Å; R512-M526 PolarHBondContact NE-O 3.14Å; M526-I562 HydrophobicContact CE-CD1 3.27Å; M526-I562 HydrophobicContact SD-CD1 3.97Å
527	L	89.7	Confident	86.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126	176.3	-57.6	178.1	0	0	0	108.7	W474 L476 A496 Q510 R512 V525 F533 I536 L559	W474-L527 HydrophobicContact CB-CB 4.28Å; W474-L527 PolarHBondContact N-O 3.07Å; W474-L527 VanDerWaalsContact N-O 3.08Å; W474-L527 PolarHBondContact O-N 2.83Å; L476-L527 HydrophobicContact CB-CD1 3.95Å; L476-L527 HydrophobicContact CB-CG 4.4Å; A496-L527 HydrophobicContact CB-CD1 3.81Å; A496-L527 HydrophobicContact CB-CD2 3.94Å; A496-L527 HydrophobicContact CB-CG 4.45Å; Q510-L527 VanDerWaalsContact OE1-CA 3.28Å; R512-L527 HydrophobicContact CG-CD2 4.27Å; V525-L527 HydrophobicContact CG1-CD2 4.06Å; L527-F533 HydrophobicContact CB-CE2 4.07Å; L527-F533 HydrophobicContact CB-CZ 3.77Å; L527-F533 HydrophobicContact CD1-CE2 4.45Å; L527-F533 HydrophobicContact CD1-CZ 4.32Å; L527-I536 HydrophobicContact CD1-CD1 4.37Å; L527-L559 HydrophobicContact CD1-CD1 3.78Å
528	H	78.8	Confident	86.9	Confident	82 Å²	82	48.3 Å²	48.3	38%	0.38	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	107.2	-178	-56.4	79.7	0	0	0	107	Q510 R512	Q510-H528 PolarHBondContact NE2-O 3.36Å; Q510-H528 VanDerWaalsContact NE2-O 3.1Å; Q510-H528 PolarHBondContact OE1-O 2.88Å; R512-H528 PolarHBondContact NH2-ND1 3.3Å
529	Q	68.8	Low	87	Confident	27 Å²	27	43 Å²	43	13%	0.126	23%	0.225	C	C	.	.			trans	-162	153.3	178.3	-147.2	160.9	21.4	0	0	112.3	N472 S498 S508 F533	N472-Q529 WeakPolarHBondContact CB-O 3.27Å; S498-Q529 VanDerWaalsContact OG-CG 3.29Å; S498-Q529 WeakPolarHBondContact OG-CG 3.28Å; S498-Q529 PolarHBondContact OG-NE2 2.84Å; S498-Q529 PolarHBondContact OG-OE1 2.94Å; S508-Q529 PolarHBondContact O-NE2 2.76Å; S508-Q529 PolarHBondContact OG-NE2 3Å; Q529-F533 HydrophobicContact CB-CE1 4.15Å; Q529-F533 HydrophobicContact CB-CZ 3.8Å; Q529-F533 VanDerWaalsContact OE1-CE1 3.31Å
530	F	60.2	Low	86.9	Confident	166 Å²	166	40.9 Å²	40.9	73%	0.728	21%	0.208	S	C	*	.	S	Bend	trans	-80.2	135.7	170.1	-65.3	-80.6	0	0	0	110.1
531	G	70.3	Confident	86.5	Confident	23 Å²	23	36.6 Å²	36.6	24%	0.237	19%	0.191	C	C	.	.	S	Bend	trans	102.3	-176.7	176.2	0	0	0	0	0	114.9	N472 S499	N472-G531 PolarHBondContact ND2-O 3.47Å; N472-G531 VanDerWaalsContact ND2-O 3.08Å; S499-G531 WeakPolarHBondContact O-CA 3.26Å
532	N	80.2	Confident	85.7	Confident	59 Å²	59	38.5 Å²	38.5	32%	0.316	19%	0.194	S	C	.	.			trans	-93.7	127.3	-178.9	-67.6	-26.3	0	0	0	110.1	S498 S499 Y534 N602	S498-N532 WeakPolarHBondContact CA-O 3.49Å; S499-N532 PolarHBondContact N-O 3.4Å; N532-Y534 PolarHBondContact O-N 3.01Å; N532-N602 PolarHBondContact ND2-ND2 3.2Å; N532-N602 VanDerWaalsContact ND2-ND2 3.15Å
533	F	88	Confident	84.6	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	128.8	170.1	-67.2	-68.9	0	0	0	110.2	W474 A496 Y497 L527 Q529 L559 V597	W474-F533 HydrophobicContact CB-CD2 4.24Å; W474-F533 HydrophobicContact CB-CE2 3.86Å; W474-F533 AromaticContact CD1-CD2 3.72Å; W474-F533 AromaticContact CD1-CE2 3.45Å; W474-F533 VanDerWaalsContact CD1-CE2 3.45Å; W474-F533 HydrophobicContact CD2-CD2 4.35Å; W474-F533 AromaticContact CG-CD2 3.85Å; W474-F533 HydrophobicContact CG-CD2 3.85Å; W474-F533 AromaticContact CG-CE2 3.73Å; W474-F533 HydrophobicContact CG-CE2 3.73Å; A496-F533 HydrophobicContact CB-CD1 3.74Å; A496-F533 HydrophobicContact CB-CE1 3.51Å; A496-F533 HydrophobicContact CB-CZ 4.41Å; Y497-F533 WeakPolarHBondContact O-CA 3.22Å; L527-F533 HydrophobicContact CB-CE2 4.07Å; L527-F533 HydrophobicContact CB-CZ 3.77Å; L527-F533 HydrophobicContact CD1-CE2 4.45Å; L527-F533 HydrophobicContact CD1-CZ 4.32Å; Q529-F533 HydrophobicContact CB-CE1 4.15Å; Q529-F533 HydrophobicContact CB-CZ 3.8Å; Q529-F533 VanDerWaalsContact OE1-CE1 3.31Å; F533-L559 HydrophobicContact CB-CD2 4.22Å; F533-L559 HydrophobicContact CD2-CD2 4.23Å; F533-V597 HydrophobicContact CB-CG2 4.44Å; F533-V597 WeakPolarHBondContact O-CB 3.16Å
534	Y	89	Confident	83.2	Confident	6 Å²	6	43.6 Å²	43.6	2%	0.024	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	-14.9	179.9	59	-103.3	0	0	0	113	Y497 S498 Y507 N532 V597 L605 L636	Y497-Y534 PolarHBondContact O-N 2.94Å; S498-Y534 VanDerWaalsContact C-CE1 3.41Å; Y507-Y534 WeakPolarHBondContact CB-OH 3.35Å; N532-Y534 PolarHBondContact O-N 3.01Å; Y534-V597 PolarHBondContact O-N 2.74Å; Y534-L605 HydrophobicContact CD2-CD1 3.44Å; Y534-L605 VanDerWaalsContact CD2-CD1 3.44Å; Y534-L605 HydrophobicContact CE2-CD1 3.94Å; Y534-L605 HydrophobicContact CG-CD1 4.32Å; Y534-L636 VanDerWaalsContact CE2-O 3.29Å; Y534-L636 WeakPolarHBondContact CE2-O 3.39Å; Y534-L636 PolarHBondContact OH-O 3.43Å
535	K	92.8	Very high	81.8	Confident	1 Å²	1	43 Å²	43	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136.8	179.5	168.9	173.7	93.8	151.5	0	111	Y497 E594 F595 D638 V661	Y497-K535 HydrophobicContact CD2-CB 4.23Å; Y497-K535 HydrophobicContact CD2-CD 4.14Å; Y497-K535 HydrophobicContact CD2-CG 3.81Å; Y497-K535 HydrophobicContact CE2-CD 4.44Å; Y497-K535 VanDerWaalsContact CE2-CE 3.45Å; Y497-K535 HydrophobicContact CE2-CG 4.41Å; Y497-K535 HydrophobicContact CG-CB 4.31Å; Y497-K535 HydrophobicContact CG-CD 4.41Å; Y497-K535 VanDerWaalsContact CG-CE 3.5Å; Y497-K535 HydrophobicContact CG-CG 4.27Å; Y497-K535 PolarHBondContact N-O 3.42Å; K535-E594 WeakPolarHBondContact CD-OE2 2.99Å; K535-E594 VanDerWaalsContact NZ-CD 3.31Å; K535-E594 IonicContact NZ-OE1 3.86Å; K535-E594 PolarHBondContact NZ-OE1 2.62Å; K535-E594 IonicContact NZ-OE2 3.1Å; K535-E594 PolarHBondContact NZ-OE2 3.37Å; K535-F595 WeakPolarHBondContact CA-O 3.41Å; K535-D638 PolarHBondContact NZ-O 3.4Å; K535-V661 HydrophobicContact CB-CG1 4.36Å; K535-V661 HydrophobicContact CD-CB 3.63Å; K535-V661 HydrophobicContact CD-CG1 3.96Å; K535-V661 HydrophobicContact CD-CG2 4.25Å; K535-V661 HydrophobicContact CG-CB 4.14Å; K535-V661 HydrophobicContact CG-CG1 4.33Å; K535-V661 HydrophobicContact CG-CG2 4.27Å
536	I	94.2	Very high	80.2	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.2	169.9	-59.2	-61.8	0	0	0	108.3	L476 F495 A496 L527 L538 I570 E594 F595 V597	L476-I536 HydrophobicContact CD2-CG2 4.1Å; F495-I536 CarbonylContact O-C 3.55Å; F495-I536 WeakPolarHBondContact O-CA 3.32Å; A496-I536 HydrophobicContact CB-CD1 3.68Å; L527-I536 HydrophobicContact CD1-CD1 4.37Å; I536-L538 HydrophobicContact CG2-CD2 4.01Å; I536-L538 HydrophobicContact CG2-CG 4.34Å; I536-I570 HydrophobicContact CB-CD1 4.36Å; I536-I570 HydrophobicContact CG1-CD1 3.84Å; I536-E594 CarbonylContact O-C 3.55Å; I536-E594 WeakPolarHBondContact O-CA 3.41Å; I536-F595 PolarHBondContact N-O 2.9Å; I536-F595 PolarHBondContact O-N 3.5Å; I536-V597 HydrophobicContact CG1-CG2 3.94Å
537	R	93.9	Very high	79.1	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130	169.9	178	177.3	82.8	-148.2	5.5	109.8	F495 Y497 E539 F592 R593 E594 D638	F495-R537 HydrophobicContact CB-CB 4.14Å; F495-R537 PolarHBondContact N-O 2.89Å; F495-R537 PolarHBondContact O-N 2.84Å; Y497-R537 HydrophobicContact CE2-CB 4.19Å; Y497-R537 PolarHBondContact OH-NH1 2.88Å; R537-E539 HydrophobicContact CG-CB 4.48Å; R537-E539 IonicContact CZ-OE2 3.25Å; R537-E539 VanDerWaalsContact CZ-OE2 3.23Å; R537-E539 IonicContact NE-OE2 3.65Å; R537-E539 PolarHBondContact NE-OE2 3.41Å; R537-E539 IonicContact NH2-OE2 2.82Å; R537-E539 PolarHBondContact NH2-OE2 2.98Å; R537-F592 HydrophobicContact CG-CB 3.91Å; R537-F592 HydrophobicContact CG-CD2 4.15Å; R537-F592 HydrophobicContact CG-CG 4.34Å; R537-R593 WeakPolarHBondContact CA-O 3.31Å; R537-E594 HydrophobicContact CB-CG 3.9Å; R537-E594 WeakPolarHBondContact CD-OE1 3.42Å; R537-E594 HydrophobicContact CG-CG 3.84Å; R537-E594 IonicContact NH1-OE1 2.81Å; R537-D638 IonicContact CZ-OD1 3.12Å; R537-D638 IonicContact NH1-OD1 3.93Å; R537-D638 PolarHBondContact NH1-OD1 3.29Å; R537-D638 IonicContact NH1-OD2 3.82Å; R537-D638 IonicContact NH2-OD1 2.7Å
538	L	92.9	Very high	78.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	118.2	173.3	-58.2	-178.1	0	0	0	107.4	I478 L492 V494 I536 I554 F592 R593 F595	I478-L538 HydrophobicContact CD1-CD2 3.84Å; L492-L538 HydrophobicContact CD1-CB 4.27Å; V494-L538 HydrophobicContact CB-CD2 4.33Å; V494-L538 HydrophobicContact CG1-CD2 4.11Å; V494-L538 HydrophobicContact CG2-CD2 3.9Å; I536-L538 HydrophobicContact CG2-CD2 4.01Å; I536-L538 HydrophobicContact CG2-CG 4.34Å; L538-I554 HydrophobicContact CB-CD1 4.06Å; L538-I554 HydrophobicContact CD1-CD1 3.64Å; L538-I554 HydrophobicContact CD1-CG2 4.21Å; L538-I554 HydrophobicContact CG-CD1 4.48Å; L538-F592 CarbonylContact O-C 3.51Å; L538-F592 WeakPolarHBondContact O-CA 3.35Å; L538-R593 PolarHBondContact N-O 3.41Å; L538-R593 PolarHBondContact O-N 3.48Å; L538-F595 HydrophobicContact CD1-CD2 4.44Å; L538-F595 HydrophobicContact CD1-CE2 3.92Å; L538-F595 HydrophobicContact CG-CE2 4.2Å
539	E	90.6	Very high	77.9	Confident	17 Å²	17	55.5 Å²	55.5	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.5	-170.7	178.4	170.1	-176	0	0	109.6	H493 F495 R537 F592	H493-E539 WeakPolarHBondContact CA-O 3.49Å; H493-E539 HydrophobicContact CB-CB 4.22Å; H493-E539 WeakPolarHBondContact CB-O 3.35Å; H493-E539 PolarHBondContact N-O 2.73Å; H493-E539 PolarHBondContact O-N 2.81Å; F495-E539 HydrophobicContact CD2-CB 4.35Å; F495-E539 HydrophobicContact CE2-CB 4.02Å; F495-E539 HydrophobicContact CE2-CG 4.44Å; F495-E539 WeakPolarHBondContact CE2-OE2 3.37Å; R537-E539 HydrophobicContact CG-CB 4.48Å; R537-E539 IonicContact CZ-OE2 3.25Å; R537-E539 VanDerWaalsContact CZ-OE2 3.23Å; R537-E539 IonicContact NE-OE2 3.65Å; R537-E539 PolarHBondContact NE-OE2 3.41Å; R537-E539 IonicContact NH2-OE2 2.82Å; R537-E539 PolarHBondContact NH2-OE2 2.98Å; E539-F592 HydrophobicContact CB-CB 3.75Å; E539-F592 HydrophobicContact CG-CB 3.96Å
540	V	87.7	Confident	78.4	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148.8	175.7	-67.5	0	0	0	0	109.5	L492 L552 C576 L578 L591	L492-V540 HydrophobicContact CD1-CG1 3.83Å; V540-L552 HydrophobicContact CG1-CD2 3.97Å; V540-C576 HydrophobicContact CG2-CB 4.12Å; V540-L578 HydrophobicContact CB-CD2 3.54Å; V540-L578 HydrophobicContact CB-CG 4.34Å; V540-L578 HydrophobicContact CG1-CD2 4.33Å; V540-L578 HydrophobicContact CG2-CD2 3.49Å; V540-L578 VanDerWaalsContact CG2-CD2 3.49Å; V540-L578 HydrophobicContact CG2-CG 3.79Å; V540-L591 HydrophobicContact CG2-CB 4.4Å; V540-L591 WeakPolarHBondContact CG2-O 3.43Å; V540-L591 PolarHBondContact N-O 2.92Å; V540-L591 WeakPolarHBondContact O-CB 3.39Å
541	D	81.5	Confident	79.4	Confident	68 Å²	68	47.5 Å²	47.5	36%	0.364	26%	0.258	S	S	.	.			trans	-72.7	142.8	-179.4	-72.5	-25.5	0	0	0	112	H493 Q543 L578	H493-D541 IonicContact CD2-OD1 3.79Å; H493-D541 PolarHBondContact CD2-OD1 2.93Å; H493-D541 IonicContact NE2-OD1 2.66Å; H493-D541 PolarHBondContact NE2-OD1 2.83Å; H493-D541 IonicContact NE2-OD2 2.98Å; H493-D541 PolarHBondContact NE2-OD2 3.08Å; D541-Q543 PolarHBondContact O-N 2.96Å; D541-L578 WeakPolarHBondContact O-CD2 3.46Å
542	Y	75.7	Confident	80.2	Confident	78 Å²	78	46.4 Å²	46.4	31%	0.306	25%	0.247	S	C	.	.			trans	-66	132	171.5	-178.5	-114.5	0	0	0	110.4	K544 L589 L591	Y542-K544 HydrophobicContact CE1-CB 4.07Å; Y542-L589 HydrophobicContact CD2-CD2 3.64Å; Y542-L589 HydrophobicContact CE2-CD2 3.7Å; Y542-L591 VanDerWaalsContact CB-CD1 3.44Å; Y542-L591 HydrophobicContact CD2-CD1 4.05Å; Y542-L591 HydrophobicContact CG-CD1 4.21Å
543	Q	70.4	Confident	80.5	Confident	82 Å²	82	46 Å²	46	38%	0.383	24%	0.243	S	C	.	.			trans	-129.1	120.2	170.9	-68.3	-174.3	-2.8	0	0	109.8	Y488 D541 C545 M550	Y488-Q543 PolarHBondContact OH-OE1 2.9Å; D541-Q543 PolarHBondContact O-N 2.96Å; Q543-C545 PolarHBondContact O-N 2.78Å; Q543-M550 HydrophobicContact CB-CE 3.68Å; Q543-M550 WeakPolarHBondContact O-CE 3.23Å
544	K	64.8	Low	80.6	Confident	157 Å²	157	45.9 Å²	45.9	68%	0.683	24%	0.243	S	C	*	.			trans	-73.5	96.8	175.1	-168.6	179.5	178.9	-175.2	0	108.8	Y542 E546	Y542-K544 HydrophobicContact CE1-CB 4.07Å; K544-E546 VanDerWaalsContact CE-OE1 3.27Å; K544-E546 WeakPolarHBondContact CE-OE1 3.13Å; K544-E546 IonicContact NZ-OE1 3.35Å
545	C	63.3	Low	80.6	Confident	51 Å²	51	49.4 Å²	49.4	35%	0.345	26%	0.259	S	S	.	.			trans	-126.1	117	170.1	-170.4	0	0	0	0	109	Q543 M550 N579	Q543-C545 PolarHBondContact O-N 2.78Å; C545-M550 HydrophobicContact CB-CE 3.37Å; C545-M550 HydrophobicContact CB-SD 4.03Å; C545-N579 PolarHBondContact O-ND2 2.89Å
546	E	60.5	Low	80.4	Confident	168 Å²	168	50.7 Å²	50.7	79%	0.785	27%	0.268	S	S	*	.	S	Bend	trans	-85.7	-17.7	-173	-67	179.3	-179.4	0	0	113.2	K544	K544-E546 VanDerWaalsContact CE-OE1 3.27Å; K544-E546 WeakPolarHBondContact CE-OE1 3.13Å; K544-E546 IonicContact NZ-OE1 3.35Å
547	A	67.9	Low	80.4	Confident	92 Å²	92	50.7 Å²	50.7	76%	0.76	27%	0.269	S	S	*	.	S	Bend	trans	-99.9	-28.9	-168.7	0	0	0	0	0	115.3
548	I	70.9	Confident	80.3	Confident	86 Å²	86	52.7 Å²	52.7	44%	0.441	28%	0.278	S	S	.	.	S	Bend	trans	-136.6	127.6	-170.9	-55.6	176.2	0	0	0	110.3	P485 M550 N579	P485-I548 HydrophobicContact CB-CG2 4.16Å; P485-I548 HydrophobicContact CG-CG2 4.03Å; I548-M550 PolarHBondContact O-N 2.88Å; I548-N579 PolarHBondContact O-ND2 2.76Å
549	P	72.3	Confident	80.2	Confident	77 Å²	77	52.7 Å²	52.7	50%	0.5	28%	0.278	S	S	.	.			trans	-63.4	125.8	173.8	26	-32.9	0	0	0	110.5	N579	P549-N579 WeakPolarHBondContact CA-ND2 3.45Å; P549-N579 WeakPolarHBondContact CA-OD1 3.26Å
550	M	79.4	Confident	80.2	Confident	12 Å²	12	53.4 Å²	53.4	6%	0.059	28%	0.282	C	S	.	.			trans	-107.1	126.7	179.5	-67.1	-179.2	-61.2	0	0	109.5	Y484 Y488 Q543 C545 I548 L578 N579	Y484-M550 CarbonylContact O-C 3.44Å; Y484-M550 VanDerWaalsContact O-CA 3.23Å; Y484-M550 WeakPolarHBondContact O-CA 3.49Å; Y488-M550 HydrophobicContact CD2-SD 4.15Å; Y488-M550 HydrophobicContact CE2-SD 4.04Å; Q543-M550 HydrophobicContact CB-CE 3.68Å; Q543-M550 WeakPolarHBondContact O-CE 3.23Å; C545-M550 HydrophobicContact CB-CE 3.37Å; C545-M550 HydrophobicContact CB-SD 4.03Å; I548-M550 PolarHBondContact O-N 2.88Å; M550-L578 HydrophobicContact CB-CB 3.86Å; M550-L578 HydrophobicContact CB-CD1 4.07Å; M550-L578 PolarHBondContact O-N 2.81Å; M550-N579 HydrophobicContact CE-CB 4.27Å; M550-N579 PolarHBondContact N-OD1 2.81Å
551	A	81.5	Confident	80.1	Confident	13 Å²	13	53.9 Å²	53.9	11%	0.107	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	142.2	-177.7	0	0	0	0	0	113	Y484 C576	Y484-A551 HydrophobicContact CD2-CB 4.11Å; Y484-A551 PolarHBondContact N-O 3.2Å; Y484-A551 PolarHBondContact O-N 2.59Å; A551-C576 CarbonylContact C-O 3.56Å; A551-C576 WeakPolarHBondContact CA-O 3.4Å
552	L	85.9	Confident	80.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.4	173.9	179.7	65.3	0	0	0	109.6	I480 I483 P490 L492 V516 V540 I554 C576 L578	I480-L552 HydrophobicContact CD1-CD1 4.19Å; I480-L552 HydrophobicContact CD1-CD2 4.39Å; I480-L552 HydrophobicContact CD1-CG 4.46Å; I480-L552 HydrophobicContact CG2-CD1 3.6Å; I483-L552 HydrophobicContact CG1-CD1 3.94Å; P490-L552 HydrophobicContact CB-CD2 4.42Å; P490-L552 HydrophobicContact CG-CB 4.47Å; P490-L552 HydrophobicContact CG-CD1 3.98Å; P490-L552 HydrophobicContact CG-CD2 4.26Å; P490-L552 HydrophobicContact CG-CG 4.47Å; L492-L552 HydrophobicContact CD1-CD2 4.15Å; V516-L552 HydrophobicContact CG1-CD1 4.2Å; V540-L552 HydrophobicContact CG1-CD2 3.97Å; L552-I554 HydrophobicContact CG-CG1 4.42Å; L552-C576 HydrophobicContact CB-CB 4.43Å; L552-C576 PolarHBondContact N-O 2.73Å; L552-C576 PolarHBondContact O-N 2.85Å; L552-L578 HydrophobicContact CB-CD1 4.45Å
553	Q	88.4	Confident	80.3	Confident	50 Å²	50	56.6 Å²	56.6	23%	0.234	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	117.1	173.5	-175.4	-177.7	-4.3	0	0	110	G481 K482	G481-Q553 PolarHBondContact N-O 3.15Å; K482-Q553 HydrophobicContact CB-CB 4.02Å; K482-Q553 PolarHBondContact N-O 2.66Å; K482-Q553 PolarHBondContact O-N 2.83Å
554	I	90	Very high	80.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	136.7	170.2	-50	179.7	0	0	0	106.4	I478 I480 L492 L538 L552 C572 C574	I478-I554 HydrophobicContact CG2-CG2 3.91Å; I480-I554 HydrophobicContact CD1-CG1 4.19Å; L492-I554 HydrophobicContact CD1-CD1 4.38Å; L538-I554 HydrophobicContact CB-CD1 4.06Å; L538-I554 HydrophobicContact CD1-CD1 3.64Å; L538-I554 HydrophobicContact CD1-CG2 4.21Å; L538-I554 HydrophobicContact CG-CD1 4.48Å; L552-I554 HydrophobicContact CG-CG1 4.42Å; I554-C572 CarbonylContact C-O 3.6Å; I554-C572 HydrophobicContact CB-CB 4.45Å; I554-C572 HydrophobicContact CG2-CB 3.74Å; I554-C574 PolarHBondContact N-O 3.22Å; I554-C574 PolarHBondContact O-N 3.18Å; I554-C574 VanDerWaalsContact O-O 3.1Å
555	E	88.2	Confident	81.4	Confident	79 Å²	79	50.9 Å²	50.9	37%	0.369	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-47.1	-177.9	-169.2	-177.2	153	0	0	111.7	K479 C572	K479-E555 HydrophobicContact CB-CB 4.42Å; K479-E555 HydrophobicContact CD-CB 4.23Å; K479-E555 HydrophobicContact CD-CG 4.37Å; K479-E555 WeakPolarHBondContact CD-OE2 3.4Å; K479-E555 WeakPolarHBondContact CE-OE2 3.44Å; K479-E555 HydrophobicContact CG-CB 4.25Å; K479-E555 IonicContact NZ-OE1 2.9Å; K479-E555 PolarHBondContact NZ-OE1 3.04Å; K479-E555 IonicContact NZ-OE2 3.88Å; K479-E555 PolarHBondContact NZ-OE2 3.29Å; K479-E555 PolarHBondContact O-N 3.16Å; E555-C572 CarbonylContact C-O 3.59Å; E555-C572 VanDerWaalsContact C-O 3.23Å; E555-C572 CarbonylContact O-C 3.51Å; E555-C572 VanDerWaalsContact O-O 3.13Å
556	S	89.5	Confident	82.3	Confident	28 Å²	28	48.8 Å²	48.8	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	162.9	178.1	59.5	0	0	0	0	110.7	K479	K479-S556 PolarHBondContact N-O 2.86Å
557	A	93.1	Very high	83.5	Confident	2 Å²	2	47 Å²	47	2%	0.017	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.2	165.3	0	0	0	0	0	110.1	L476 Q477 I478 I570	L476-A557 HydrophobicContact CD1-CB 4.17Å; Q477-A557 CarbonylContact O-C 3.58Å; Q477-A557 WeakPolarHBondContact O-CA 3.25Å; I478-A557 HydrophobicContact CG1-CB 4.35Å; A557-I570 HydrophobicContact CB-CB 4.25Å; A557-I570 PolarHBondContact N-O 2.77Å; A557-I570 CarbonylContact O-C 3.5Å; A557-I570 WeakPolarHBondContact O-CA 3.25Å; A557-I570 WeakPolarHBondContact O-CB 3.3Å; A557-I570 PolarHBondContact O-N 3.35Å
558	E	92.1	Very high	84.6	Confident	45 Å²	45	43.1 Å²	43.1	21%	0.21	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.1	178.8	-173.1	177.8	-170.9	0	0	109.2	L476 Q477 R567	L476-E558 CarbonylContact C-O 3.52Å; L476-E558 WeakPolarHBondContact CA-O 3.33Å; Q477-E558 PolarHBondContact N-O 2.98Å; Q477-E558 PolarHBondContact O-N 3.16Å; E558-R567 VanDerWaalsContact OE1-CD 3.29Å; E558-R567 WeakPolarHBondContact OE1-CD 3.5Å; E558-R567 WeakPolarHBondContact OE1-CG 3.29Å; E558-R567 IonicContact OE1-CZ 3.68Å; E558-R567 IonicContact OE1-NE 3.23Å; E558-R567 IonicContact OE1-NH1 2.76Å
559	L	91.6	Very high	85.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.8	174.1	-164.4	77	0	0	0	108.4	W474 L476 L527 F533 R567 R568 V597	W474-L559 HydrophobicContact CB-CD1 4.06Å; W474-L559 HydrophobicContact CB-CG 4.33Å; W474-L559 HydrophobicContact CD2-CD2 3.83Å; W474-L559 HydrophobicContact CD2-CG 4.07Å; W474-L559 HydrophobicContact CE3-CB 4.4Å; W474-L559 HydrophobicContact CE3-CD1 4.38Å; W474-L559 HydrophobicContact CE3-CD2 3.45Å; W474-L559 VanDerWaalsContact CE3-CD2 3.45Å; W474-L559 HydrophobicContact CE3-CG 3.42Å; W474-L559 VanDerWaalsContact CE3-CG 3.42Å; W474-L559 HydrophobicContact CG-CD2 4.42Å; W474-L559 HydrophobicContact CH2-CD2 4.41Å; W474-L559 HydrophobicContact CZ3-CD2 3.74Å; W474-L559 HydrophobicContact CZ3-CG 3.96Å; L476-L559 HydrophobicContact CB-CD1 4.1Å; L476-L559 HydrophobicContact CD1-CB 4.46Å; L476-L559 HydrophobicContact CD1-CD1 3.99Å; L527-L559 HydrophobicContact CD1-CD1 3.78Å; F533-L559 HydrophobicContact CB-CD2 4.22Å; F533-L559 HydrophobicContact CD2-CD2 4.23Å; L559-R567 WeakPolarHBondContact O-CA 3.35Å; L559-R568 HydrophobicContact CB-CB 4.23Å; L559-R568 PolarHBondContact N-O 2.79Å; L559-R568 PolarHBondContact O-N 3.25Å; L559-V597 HydrophobicContact CD2-CG1 4.37Å
560	L	89.2	Confident	86.4	Confident	32 Å²	32	36.4 Å²	36.4	17%	0.168	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.7	-178.7	177.2	70.7	0	0	0	109.9	K475 D566 R567	K475-L560 HydrophobicContact CB-CB 4.43Å; K475-L560 PolarHBondContact N-O 2.99Å; K475-L560 PolarHBondContact O-N 3.31Å; L560-D566 CarbonylContact C-O 3.55Å; L560-D566 WeakPolarHBondContact CA-O 3.35Å; L560-R567 HydrophobicContact CD1-CG 3.51Å
561	H	86.2	Confident	86.6	Confident	11 Å²	11	37.8 Å²	37.8	5%	0.051	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	126.6	170.3	-165.7	-111.5	0	0	0	109.5	W474 E563 T564 G565 D566	W474-H561 AromaticContact CD1-CD2 3.87Å; W474-H561 HydrophobicContact CD2-CB 4.1Å; W474-H561 AromaticContact CD2-CD2 3.68Å; W474-H561 AromaticContact CE2-CD2 3.39Å; W474-H561 HydrophobicContact CE3-CB 3.69Å; W474-H561 VanDerWaalsContact CE3-N 3.32Å; W474-H561 HydrophobicContact CH2-CB 3.8Å; W474-H561 HydrophobicContact CZ2-CB 4.13Å; W474-H561 AromaticContact CZ2-CD2 3.73Å; W474-H561 HydrophobicContact CZ3-CB 3.57Å; W474-H561 AromaticContact NE1-CD2 3.48Å; W474-H561 PolarHBondContact NE1-CD2 2.9Å; H561-E563 PolarHBondContact O-N 2.91Å; H561-T564 WeakPolarHBondContact CB-OG1 3.49Å; H561-T564 WeakPolarHBondContact ND1-CG2 3.05Å; H561-T564 PolarHBondContact ND1-N 3.47Å; H561-T564 VanDerWaalsContact ND1-N 3.17Å; H561-T564 PolarHBondContact ND1-OG1 2.85Å; H561-G565 VanDerWaalsContact O-CA 3.25Å; H561-G565 WeakPolarHBondContact O-CA 3.36Å; H561-G565 PolarHBondContact O-N 3.02Å; H561-D566 HydrophobicContact CB-CB 3.87Å; H561-D566 PolarHBondContact N-O 2.88Å
562	I	82.7	Confident	86.6	Confident	79 Å²	79	37.2 Å²	37.2	41%	0.405	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-37.8	-169.2	-64.2	178.4	0	0	0	111.6	Q473 K475 M526	Q473-I562 HydrophobicContact CB-CD1 3.89Å; Q473-I562 WeakPolarHBondContact O-CG1 3.24Å; Q473-I562 PolarHBondContact O-N 3.23Å; K475-I562 HydrophobicContact CB-CD1 4.47Å; K475-I562 HydrophobicContact CB-CG1 4.33Å; M526-I562 HydrophobicContact CE-CD1 3.27Å; M526-I562 HydrophobicContact SD-CD1 3.97Å
563	E	79.1	Confident	86.2	Confident	125 Å²	125	44.9 Å²	44.9	58%	0.584	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-48.3	-174.9	-60.3	-174	159.8	0	0	112.7	A470 H561	A470-E563 WeakPolarHBondContact CB-OE2 3.16Å; H561-E563 PolarHBondContact O-N 2.91Å
564	T	78.7	Confident	85.5	Confident	79 Å²	79	43.8 Å²	43.8	49%	0.485	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-20.5	-175.6	63.6	0	0	0	0	112.4	H561 D566	H561-T564 WeakPolarHBondContact CB-OG1 3.49Å; H561-T564 WeakPolarHBondContact ND1-CG2 3.05Å; H561-T564 PolarHBondContact ND1-N 3.47Å; H561-T564 VanDerWaalsContact ND1-N 3.17Å; H561-T564 PolarHBondContact ND1-OG1 2.85Å; T564-D566 PolarHBondContact O-N 2.73Å; T564-D566 WeakPolarHBondContact OG1-CB 3.13Å; T564-D566 PolarHBondContact OG1-N 3.37Å
565	G	79.3	Confident	84.5	Confident	39 Å²	39	46.5 Å²	46.5	40%	0.402	24%	0.237	S	C	.	.			trans	71.6	13.1	-170.7	0	0	0	0	0	113.9	H561 R567	H561-G565 VanDerWaalsContact O-CA 3.25Å; H561-G565 WeakPolarHBondContact O-CA 3.36Å; H561-G565 PolarHBondContact O-N 3.02Å; G565-R567 PolarHBondContact O-N 3.03Å
566	D	82.7	Confident	83.6	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.037	22%	0.22	C	C	.	.			trans	-55.8	131.7	173.2	-177.4	13.3	0	0	0	110.1	A457 W474 L560 H561 T564 R568	A457-D566 HydrophobicContact CB-CB 3.77Å; W474-D566 HydrophobicContact CH2-CB 4.23Å; W474-D566 WeakPolarHBondContact CH2-OD2 3.2Å; W474-D566 HydrophobicContact CZ3-CB 4.43Å; L560-D566 CarbonylContact C-O 3.55Å; L560-D566 WeakPolarHBondContact CA-O 3.35Å; H561-D566 HydrophobicContact CB-CB 3.87Å; H561-D566 PolarHBondContact N-O 2.88Å; T564-D566 PolarHBondContact O-N 2.73Å; T564-D566 WeakPolarHBondContact OG1-CB 3.13Å; T564-D566 PolarHBondContact OG1-N 3.37Å; D566-R568 IonicContact OD2-CZ 3.92Å; D566-R568 IonicContact OD2-NE 3.14Å; D566-R568 PolarHBondContact OD2-NE 3.33Å; D566-R568 IonicContact OD2-NH2 3.91Å; D566-R568 PolarHBondContact OD2-NH2 2.91Å; D566-R568 VanDerWaalsContact OD2-NH2 3.08Å
567	R	86	Confident	82.7	Confident	130 Å²	130	47.4 Å²	47.4	49%	0.491	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.6	-177.1	-76.7	176.8	168.5	-145	-4.1	109.4	E558 L559 L560 G565	E558-R567 VanDerWaalsContact OE1-CD 3.29Å; E558-R567 WeakPolarHBondContact OE1-CD 3.5Å; E558-R567 WeakPolarHBondContact OE1-CG 3.29Å; E558-R567 IonicContact OE1-CZ 3.68Å; E558-R567 IonicContact OE1-NE 3.23Å; E558-R567 IonicContact OE1-NH1 2.76Å; L559-R567 WeakPolarHBondContact O-CA 3.35Å; L560-R567 HydrophobicContact CD1-CG 3.51Å; G565-R567 PolarHBondContact O-N 3.03Å
568	R	90.1	Very high	81.3	Confident	12 Å²	12	47.3 Å²	47.3	5%	0.045	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	105.9	176.8	-52.7	178	-175.7	-161.4	-3.9	108.2	L559 D566 V597 V598 D599	L559-R568 HydrophobicContact CB-CB 4.23Å; L559-R568 PolarHBondContact N-O 2.79Å; L559-R568 PolarHBondContact O-N 3.25Å; D566-R568 IonicContact OD2-CZ 3.92Å; D566-R568 IonicContact OD2-NE 3.14Å; D566-R568 PolarHBondContact OD2-NE 3.33Å; D566-R568 IonicContact OD2-NH2 3.91Å; D566-R568 PolarHBondContact OD2-NH2 2.91Å; D566-R568 VanDerWaalsContact OD2-NH2 3.08Å; R568-V597 HydrophobicContact CB-CG1 4.43Å; R568-V598 WeakPolarHBondContact CD-O 3.4Å; R568-D599 IonicContact CZ-OD2 2.7Å; R568-D599 VanDerWaalsContact NH1-CG 3.27Å; R568-D599 IonicContact NH1-OD1 2.75Å; R568-D599 IonicContact NH1-OD2 3.22Å; R568-D599 PolarHBondContact NH1-OD2 3.45Å; R568-D599 IonicContact NH2-OD1 3.7Å; R568-D599 IonicContact NH2-OD2 3.83Å
569	H	90	Very high	80	Confident	21 Å²	21	45.8 Å²	45.8	10%	0.097	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.3	178.9	-176.9	-91	0	0	0	110.2	G451 Y452	G451-H569 CarbonylContact C-O 3.37Å; G451-H569 WeakPolarHBondContact CA-O 3.25Å; Y452-H569 HydrophobicContact CD1-CB 3.88Å; Y452-H569 AromaticContact CD1-CG 3.99Å; Y452-H569 AromaticContact CD1-ND1 3.67Å; Y452-H569 HydrophobicContact CD2-CB 4.06Å; Y452-H569 HydrophobicContact CE1-CB 3.6Å; Y452-H569 AromaticContact CE1-CE1 3.88Å; Y452-H569 AromaticContact CE1-CG 3.38Å; Y452-H569 AromaticContact CE1-ND1 3.2Å; Y452-H569 WeakPolarHBondContact CE1-ND1 3.39Å; Y452-H569 HydrophobicContact CE2-CB 3.79Å; Y452-H569 HydrophobicContact CG-CB 4.1Å; Y452-H569 AromaticContact CZ-CG 3.57Å; Y452-H569 AromaticContact CZ-ND1 3.89Å; Y452-H569 PolarHBondContact N-O 3.27Å; Y452-H569 PolarHBondContact O-N 3.28Å
570	I	90	Very high	78.3	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.2	177.2	-53.2	177.1	0	0	0	107.7	L476 I536 A557 C572 F595 V597	L476-I570 HydrophobicContact CD1-CD1 4.38Å; I536-I570 HydrophobicContact CB-CD1 4.36Å; I536-I570 HydrophobicContact CG1-CD1 3.84Å; A557-I570 HydrophobicContact CB-CB 4.25Å; A557-I570 PolarHBondContact N-O 2.77Å; A557-I570 CarbonylContact O-C 3.5Å; A557-I570 WeakPolarHBondContact O-CA 3.25Å; A557-I570 WeakPolarHBondContact O-CB 3.3Å; A557-I570 PolarHBondContact O-N 3.35Å; I570-C572 VanDerWaalsContact CG2-SG 3.51Å; I570-C572 PolarHBondContact O-N 3.09Å; I570-F595 HydrophobicContact CG2-CB 3.33Å; I570-F595 HydrophobicContact CG2-CD1 3.96Å; I570-F595 HydrophobicContact CG2-CD2 4.38Å; I570-F595 HydrophobicContact CG2-CG 3.63Å; I570-V597 HydrophobicContact CD1-CG2 4.37Å
571	R	85.1	Confident	76.5	Confident	41 Å²	41	49.9 Å²	49.9	16%	0.155	25%	0.25	C	C	.	.			trans	-83.2	92	-178.6	-174.5	170.3	-79.6	139.2	-18.8	110.9	E392 L393 C449 A450 K573	E392-R571 VanDerWaalsContact CG-NH2 3.32Å; E392-R571 IonicContact OE1-CZ 3.44Å; E392-R571 IonicContact OE1-NE 3.95Å; E392-R571 IonicContact OE1-NH2 3.49Å; E392-R571 PolarHBondContact OE1-NH2 3.33Å; E392-R571 IonicContact OE2-NH2 3.66Å; L393-R571 VanDerWaalsContact O-CZ 3.29Å; L393-R571 PolarHBondContact O-NH1 3.14Å; L393-R571 PolarHBondContact O-NH2 3.4Å; C449-R571 PolarHBondContact SG-NH1 2.82Å; A450-R571 PolarHBondContact O-N 2.98Å; R571-K573 PolarHBondContact O-N 3.39Å
572	C	81.2	Confident	74.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.29	C	S	.	.			trans	-96.1	58.1	177.5	-53.1	0	0	0	0	111.9	I554 E555 I570 C574 F595	I554-C572 CarbonylContact C-O 3.6Å; I554-C572 HydrophobicContact CB-CB 4.45Å; I554-C572 HydrophobicContact CG2-CB 3.74Å; E555-C572 CarbonylContact C-O 3.59Å; E555-C572 VanDerWaalsContact C-O 3.23Å; E555-C572 CarbonylContact O-C 3.51Å; E555-C572 VanDerWaalsContact O-O 3.13Å; I570-C572 VanDerWaalsContact CG2-SG 3.51Å; I570-C572 PolarHBondContact O-N 3.09Å; C572-C574 PolarHBondContact O-N 2.76Å; C572-F595 HydrophobicContact CB-CE1 3.93Å; C572-F595 HydrophobicContact CB-CE2 4.15Å; C572-F595 HydrophobicContact CB-CZ 3.66Å; C572-F595 VanDerWaalsContact SG-CE2 3.56Å; C572-F595 VanDerWaalsContact SG-CZ 3.57Å
573	K	76.4	Confident	72.7	Confident	162 Å²	162	65 Å²	65	70%	0.704	31%	0.311	S	S	*	.			trans	-82.6	64.6	175.9	-164	177	-178.1	177.4	0	110.9	R571	R571-K573 PolarHBondContact O-N 3.39Å
574	C	74	Confident	71	Confident	26 Å²	26	62.1 Å²	62.1	18%	0.176	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.1	-173.4	63.4	0	0	0	0	112.7	I554 C572 R593	I554-C574 PolarHBondContact N-O 3.22Å; I554-C574 PolarHBondContact O-N 3.18Å; I554-C574 VanDerWaalsContact O-O 3.1Å; C572-C574 PolarHBondContact O-N 2.76Å; C574-R593 HydrophobicContact CB-CG 4.28Å
575	C	70.3	Confident	69.3	Low	57 Å²	57	64 Å²	64	39%	0.385	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	116.5	169.9	-166.6	0	0	0	0	108.8	R577	C575-R577 PolarHBondContact O-N 2.91Å
576	C	69.2	Low	67.8	Low	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	103.1	172	-56.3	0	0	0	0	108.9	V540 A551 L552 R593	V540-C576 HydrophobicContact CG2-CB 4.12Å; A551-C576 CarbonylContact C-O 3.56Å; A551-C576 WeakPolarHBondContact CA-O 3.4Å; L552-C576 HydrophobicContact CB-CB 4.43Å; L552-C576 PolarHBondContact N-O 2.73Å; L552-C576 PolarHBondContact O-N 2.85Å; C576-R593 VanDerWaalsContact CB-NH1 3.35Å; C576-R593 WeakPolarHBondContact SG-CD 3.38Å; C576-R593 PolarHBondContact SG-NH1 3.12Å
577	R	70.1	Confident	66.4	Low	127 Å²	127	69 Å²	69	48%	0.479	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	136.4	170.5	-62.5	-173	-173.9	-178.4	7.4	109.2	C575 D581 L591	C575-R577 PolarHBondContact O-N 2.91Å; R577-D581 IonicContact CZ-OD2 2.77Å; R577-D581 IonicContact NH1-OD2 3.76Å; R577-D581 PolarHBondContact NH1-OD2 2.84Å; R577-L591 WeakPolarHBondContact O-CD2 3.46Å
578	L	64.4	Low	65.3	Low	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.345	C	S	.	.			trans	-102.9	-15.9	-176.2	-68.2	121.4	0	0	0	113.3	Y488 V540 D541 M550 L552	Y488-L578 HydrophobicContact CD1-CD1 4.29Å; Y488-L578 HydrophobicContact CE1-CD1 3.45Å; Y488-L578 VanDerWaalsContact CE1-CD1 3.45Å; Y488-L578 HydrophobicContact CE1-CD2 4.15Å; Y488-L578 HydrophobicContact CE1-CG 4.38Å; Y488-L578 VanDerWaalsContact OH-CD2 3.25Å; Y488-L578 WeakPolarHBondContact OH-CD2 3.49Å; V540-L578 HydrophobicContact CB-CD2 3.54Å; V540-L578 HydrophobicContact CB-CG 4.34Å; V540-L578 HydrophobicContact CG1-CD2 4.33Å; V540-L578 HydrophobicContact CG2-CD2 3.49Å; V540-L578 VanDerWaalsContact CG2-CD2 3.49Å; V540-L578 HydrophobicContact CG2-CG 3.79Å; D541-L578 WeakPolarHBondContact O-CD2 3.46Å; M550-L578 HydrophobicContact CB-CB 3.86Å; M550-L578 HydrophobicContact CB-CD1 4.07Å; M550-L578 PolarHBondContact O-N 2.81Å; L552-L578 HydrophobicContact CB-CD1 4.45Å
579	N	63.1	Low	64.6	Low	12 Å²	12	65 Å²	65	6%	0.064	35%	0.348	C	S	.	.	S	Bend	trans	-127	158.6	172.6	60.7	-10.3	0	0	0	111.9	C545 I548 P549 M550	C545-N579 PolarHBondContact O-ND2 2.89Å; I548-N579 PolarHBondContact O-ND2 2.76Å; P549-N579 WeakPolarHBondContact CA-ND2 3.45Å; P549-N579 WeakPolarHBondContact CA-OD1 3.26Å; M550-N579 HydrophobicContact CE-CB 4.27Å; M550-N579 PolarHBondContact N-OD1 2.81Å
580	V	56.7	Low	64.2	Low	61 Å²	61	65.6 Å²	65.6	37%	0.37	35%	0.351	S	S	.	.			trans	-80.9	114.7	172.2	-174.3	0	0	0	0	106.7	Y582 L589 F627	V580-Y582 PolarHBondContact O-N 3.47Å; V580-L589 HydrophobicContact CG2-CB 4.2Å; V580-L589 HydrophobicContact CG2-CD1 3.98Å; V580-L589 HydrophobicContact CG2-CD2 3.74Å; V580-L589 HydrophobicContact CG2-CG 4.18Å; V580-F627 HydrophobicContact CG2-CZ 4.03Å
581	D	50.9	Low	64	Low	58 Å²	58	65.6 Å²	65.6	31%	0.31	35%	0.351	S	S	.	.			trans	-60.8	121.9	162.1	-69.9	-48.4	0	0	0	106.9	R577 Q583 C584	R577-D581 IonicContact CZ-OD2 2.77Å; R577-D581 IonicContact NH1-OD2 3.76Å; R577-D581 PolarHBondContact NH1-OD2 2.84Å; D581-Q583 PolarHBondContact O-N 2.91Å; D581-C584 PolarHBondContact O-N 2.89Å
582	Y	43.9	Very low	64.2	Low	229 Å²	229	63.7 Å²	63.7	90%	0.898	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-18.2	177.8	-180	-98.3	0	0	0	113.4	V580	V580-Y582 PolarHBondContact O-N 3.47Å
583	Q	46.5	Very low	64.7	Low	179 Å²	179	66 Å²	66	84%	0.836	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	0.7	-178.3	-62.3	-174.4	-8.4	0	0	115.1	D581	D581-Q583 PolarHBondContact O-N 2.91Å
584	C	43	Very low	65.6	Low	64 Å²	64	58.9 Å²	58.9	43%	0.432	32%	0.322	S	S	.	.			trans	-106.2	63.5	170.5	-79.2	0	0	0	0	110.8	D581 G586	D581-C584 PolarHBondContact O-N 2.89Å; C584-G586 PolarHBondContact O-N 3.04Å
585	S	41.7	Very low	66.5	Low	117 Å²	117	58.8 Å²	58.8	82%	0.818	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	117.9	165.6	44.5	0	0	0	0	109.3
586	G	49.6	Very low	67.6	Low	64 Å²	64	56.2 Å²	56.2	66%	0.66	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.6	-5.5	168.3	0	0	0	0	0	117.8	C584	C584-G586 PolarHBondContact O-N 3.04Å
587	S	52.9	Low	68.7	Low	87 Å²	87	56.4 Å²	56.4	61%	0.608	30%	0.302	S	S	*	.	S	Bend	trans	-109.2	125.8	172.3	63.1	0	0	0	0	111.2	L589	S587-L589 PolarHBondContact O-N 3.36Å
588	N	62.8	Low	69.6	Low	37 Å²	37	50.6 Å²	50.6	20%	0.198	28%	0.281	C	S	.	.			trans	-53.8	135.5	177.2	-57.8	-69.7	0	0	0	111.4	Q590 F656 E657	N588-Q590 PolarHBondContact O-N 2.86Å; N588-Q590 VanDerWaalsContact O-N 3.15Å; N588-F656 WeakPolarHBondContact ND2-CA 3.34Å; N588-F656 WeakPolarHBondContact OD1-CB 2.93Å; N588-E657 PolarHBondContact ND2-N 2.66Å; N588-E657 PolarHBondContact ND2-O 2.75Å
589	L	74.4	Confident	70.5	Confident	21 Å²	21	51.4 Å²	51.4	11%	0.11	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	109.9	175	-179.8	69.1	0	0	0	109.1	Y542 V580 S587 L591 Y643	Y542-L589 HydrophobicContact CD2-CD2 3.64Å; Y542-L589 HydrophobicContact CE2-CD2 3.7Å; V580-L589 HydrophobicContact CG2-CB 4.2Å; V580-L589 HydrophobicContact CG2-CD1 3.98Å; V580-L589 HydrophobicContact CG2-CD2 3.74Å; V580-L589 HydrophobicContact CG2-CG 4.18Å; S587-L589 PolarHBondContact O-N 3.36Å; L589-L591 HydrophobicContact CD1-CD2 3.71Å; L589-L591 HydrophobicContact CD1-CG 4.49Å; L589-L591 HydrophobicContact CD2-CD1 4.26Å; L589-L591 HydrophobicContact CD2-CD2 3.98Å; L589-L591 HydrophobicContact CD2-CG 4.14Å; L589-L591 HydrophobicContact CG-CD2 3.77Å; L589-L591 HydrophobicContact CG-CG 4.02Å; L589-Y643 HydrophobicContact CD2-CG 4.48Å; L589-Y643 WeakPolarHBondContact O-CD2 3.39Å
590	Q	82.9	Confident	71.1	Confident	35 Å²	35	52.8 Å²	52.8	16%	0.164	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	109.3	174.3	-166.3	179.8	-20.6	0	0	110	N588 F592 R593 V658 E659	N588-Q590 PolarHBondContact O-N 2.86Å; N588-Q590 VanDerWaalsContact O-N 3.15Å; Q590-F592 HydrophobicContact CG-CD1 4.07Å; Q590-F592 HydrophobicContact CG-CD2 4.44Å; Q590-F592 HydrophobicContact CG-CE1 3.78Å; Q590-F592 HydrophobicContact CG-CE2 4.17Å; Q590-F592 HydrophobicContact CG-CG 4.39Å; Q590-F592 HydrophobicContact CG-CZ 3.83Å; Q590-F592 WeakPolarHBondContact CG-O 3.47Å; Q590-F592 PolarHBondContact NE2-O 3.14Å; Q590-R593 PolarHBondContact O-NH1 2.88Å; Q590-R593 PolarHBondContact O-NH2 3.2Å; Q590-V658 HydrophobicContact CG-CG2 4.37Å; Q590-E659 PolarHBondContact NE2-O 2.68Å; Q590-E659 VanDerWaalsContact OE1-N 3.07Å
591	L	85.2	Confident	71.9	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	30%	0.303	C	S	.	.			trans	-91.5	0.4	-176.9	-61	-177.9	0	0	0	114	V540 Y542 R577 L589 R593 Y643	V540-L591 HydrophobicContact CG2-CB 4.4Å; V540-L591 WeakPolarHBondContact CG2-O 3.43Å; V540-L591 PolarHBondContact N-O 2.92Å; V540-L591 WeakPolarHBondContact O-CB 3.39Å; Y542-L591 VanDerWaalsContact CB-CD1 3.44Å; Y542-L591 HydrophobicContact CD2-CD1 4.05Å; Y542-L591 HydrophobicContact CG-CD1 4.21Å; R577-L591 WeakPolarHBondContact O-CD2 3.46Å; L589-L591 HydrophobicContact CD1-CD2 3.71Å; L589-L591 HydrophobicContact CD1-CG 4.49Å; L589-L591 HydrophobicContact CD2-CD1 4.26Å; L589-L591 HydrophobicContact CD2-CD2 3.98Å; L589-L591 HydrophobicContact CD2-CG 4.14Å; L589-L591 HydrophobicContact CG-CD2 3.77Å; L589-L591 HydrophobicContact CG-CG 4.02Å; L591-R593 PolarHBondContact O-NH1 2.88Å; L591-Y643 HydrophobicContact CB-CE2 4.44Å; L591-Y643 HydrophobicContact CD1-CD2 4.38Å; L591-Y643 HydrophobicContact CD1-CE2 3.64Å; L591-Y643 HydrophobicContact CG-CD2 4.42Å; L591-Y643 HydrophobicContact CG-CE2 4Å
592	F	90.2	Very high	73.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	159.2	178.3	65.6	-91.6	0	0	0	111.8	R537 L538 E539 Q590 E594 S639 I641 V658 C660	R537-F592 HydrophobicContact CG-CB 3.91Å; R537-F592 HydrophobicContact CG-CD2 4.15Å; R537-F592 HydrophobicContact CG-CG 4.34Å; L538-F592 CarbonylContact O-C 3.51Å; L538-F592 WeakPolarHBondContact O-CA 3.35Å; E539-F592 HydrophobicContact CB-CB 3.75Å; E539-F592 HydrophobicContact CG-CB 3.96Å; Q590-F592 HydrophobicContact CG-CD1 4.07Å; Q590-F592 HydrophobicContact CG-CD2 4.44Å; Q590-F592 HydrophobicContact CG-CE1 3.78Å; Q590-F592 HydrophobicContact CG-CE2 4.17Å; Q590-F592 HydrophobicContact CG-CG 4.39Å; Q590-F592 HydrophobicContact CG-CZ 3.83Å; Q590-F592 WeakPolarHBondContact CG-O 3.47Å; Q590-F592 PolarHBondContact NE2-O 3.14Å; F592-E594 HydrophobicContact CD2-CG 3.92Å; F592-E594 HydrophobicContact CE2-CG 4.1Å; F592-S639 WeakPolarHBondContact CD2-O 3.28Å; F592-S639 WeakPolarHBondContact CE2-O 3.33Å; F592-S639 WeakPolarHBondContact CZ-O 3.49Å; F592-I641 VanDerWaalsContact CE1-O 3.29Å; F592-I641 WeakPolarHBondContact CE1-O 3.28Å; F592-V658 HydrophobicContact CE1-CG2 4.47Å; F592-V658 HydrophobicContact CE2-CG2 4.25Å; F592-V658 HydrophobicContact CZ-CG2 3.57Å; F592-C660 HydrophobicContact CE2-CB 4.22Å
593	R	91.6	Very high	75.1	Confident	50 Å²	50	49.5 Å²	49.5	19%	0.189	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.1	166.6	-71.8	88.3	-163.7	139.8	6.7	108.9	R537 L538 C574 C576 Q590 L591 F595	R537-R593 WeakPolarHBondContact CA-O 3.31Å; L538-R593 PolarHBondContact N-O 3.41Å; L538-R593 PolarHBondContact O-N 3.48Å; C574-R593 HydrophobicContact CB-CG 4.28Å; C576-R593 VanDerWaalsContact CB-NH1 3.35Å; C576-R593 WeakPolarHBondContact SG-CD 3.38Å; C576-R593 PolarHBondContact SG-NH1 3.12Å; Q590-R593 PolarHBondContact O-NH1 2.88Å; Q590-R593 PolarHBondContact O-NH2 3.2Å; L591-R593 PolarHBondContact O-NH1 2.88Å; R593-F595 HydrophobicContact CB-CE2 3.78Å; R593-F595 HydrophobicContact CB-CZ 3.71Å
594	E	93.5	Very high	77.1	Confident	11 Å²	11	41.5 Å²	41.5	5%	0.051	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.1	177.3	-55.9	-157.7	140.4	0	0	110.6	K535 I536 R537 F592 C660 V661	K535-E594 WeakPolarHBondContact CD-OE2 2.99Å; K535-E594 VanDerWaalsContact NZ-CD 3.31Å; K535-E594 IonicContact NZ-OE1 3.86Å; K535-E594 PolarHBondContact NZ-OE1 2.62Å; K535-E594 IonicContact NZ-OE2 3.1Å; K535-E594 PolarHBondContact NZ-OE2 3.37Å; I536-E594 CarbonylContact O-C 3.55Å; I536-E594 WeakPolarHBondContact O-CA 3.41Å; R537-E594 HydrophobicContact CB-CG 3.9Å; R537-E594 WeakPolarHBondContact CD-OE1 3.42Å; R537-E594 HydrophobicContact CG-CG 3.84Å; R537-E594 IonicContact NH1-OE1 2.81Å; F592-E594 HydrophobicContact CD2-CG 3.92Å; F592-E594 HydrophobicContact CE2-CG 4.1Å; E594-C660 HydrophobicContact CG-CB 4.12Å; E594-C660 WeakPolarHBondContact OE2-CB 3.43Å; E594-V661 HydrophobicContact CB-CB 4.2Å; E594-V661 HydrophobicContact CB-CG2 3.68Å; E594-V661 PolarHBondContact OE2-N 3.12Å
595	F	93.7	Very high	79.4	Confident	24 Å²	24	39 Å²	39	11%	0.105	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.7	-179	-55.4	-83.6	0	0	0	110	K535 I536 L538 I570 C572 R593	K535-F595 WeakPolarHBondContact CA-O 3.41Å; I536-F595 PolarHBondContact N-O 2.9Å; I536-F595 PolarHBondContact O-N 3.5Å; L538-F595 HydrophobicContact CD1-CD2 4.44Å; L538-F595 HydrophobicContact CD1-CE2 3.92Å; L538-F595 HydrophobicContact CG-CE2 4.2Å; I570-F595 HydrophobicContact CG2-CB 3.33Å; I570-F595 HydrophobicContact CG2-CD1 3.96Å; I570-F595 HydrophobicContact CG2-CD2 4.38Å; I570-F595 HydrophobicContact CG2-CG 3.63Å; C572-F595 HydrophobicContact CB-CE1 3.93Å; C572-F595 HydrophobicContact CB-CE2 4.15Å; C572-F595 HydrophobicContact CB-CZ 3.66Å; C572-F595 VanDerWaalsContact SG-CE2 3.56Å; C572-F595 VanDerWaalsContact SG-CZ 3.57Å; R593-F595 HydrophobicContact CB-CE2 3.78Å; R593-F595 HydrophobicContact CB-CZ 3.71Å
596	P	94	Very high	81.8	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.019	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	141.1	172.4	32.4	-32.3	0	0	0	109	A450 L604 L605 V607 V661	A450-P596 HydrophobicContact CB-CG 4.06Å; P596-L604 HydrophobicContact CB-CD1 3.95Å; P596-L604 HydrophobicContact CB-CG 4.44Å; P596-L604 HydrophobicContact CG-CD1 4.17Å; P596-L605 HydrophobicContact CB-CB 4.41Å; P596-L605 VanDerWaalsContact CB-O 3.24Å; P596-L605 WeakPolarHBondContact CB-O 3.38Å; P596-V607 HydrophobicContact CG-CG2 3.88Å; P596-V661 HydrophobicContact CB-CG1 4.32Å; P596-V661 HydrophobicContact CB-CG2 4.24Å; P596-V661 HydrophobicContact CG-CG2 4.47Å
597	V	91.8	Very high	83.9	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.024	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-85.9	124.2	175	179.7	0	0	0	0	108.3	F533 Y534 I536 L559 R568 I570 D599	F533-V597 HydrophobicContact CB-CG2 4.44Å; F533-V597 WeakPolarHBondContact O-CB 3.16Å; Y534-V597 PolarHBondContact O-N 2.74Å; I536-V597 HydrophobicContact CG1-CG2 3.94Å; L559-V597 HydrophobicContact CD2-CG1 4.37Å; R568-V597 HydrophobicContact CB-CG1 4.43Å; I570-V597 HydrophobicContact CD1-CG2 4.37Å; V597-D599 PolarHBondContact O-N 2.94Å
598	V	89.5	Confident	85.7	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.03	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-73.8	116.7	175.2	-176.3	0	0	0	0	108.7	M415 A427 R568 L604	M415-V598 HydrophobicContact CE-CG1 4.36Å; A427-V598 HydrophobicContact CB-CB 4.47Å; A427-V598 HydrophobicContact CB-CG1 3.99Å; A427-V598 HydrophobicContact CB-CG2 3.61Å; R568-V598 WeakPolarHBondContact CD-O 3.4Å; V598-L604 HydrophobicContact CB-CD1 4.47Å; V598-L604 HydrophobicContact CG2-CD1 3.92Å
599	D	82	Confident	87.1	Confident	18 Å²	18	34.9 Å²	34.9	10%	0.096	17%	0.172	C	C	.	.			trans	-126.8	127.3	177.3	-170.8	-21.1	0	0	0	108.7	R568 V597 M601 N602	R568-D599 IonicContact CZ-OD2 2.7Å; R568-D599 VanDerWaalsContact NH1-CG 3.27Å; R568-D599 IonicContact NH1-OD1 2.75Å; R568-D599 IonicContact NH1-OD2 3.22Å; R568-D599 PolarHBondContact NH1-OD2 3.45Å; R568-D599 IonicContact NH2-OD1 3.7Å; R568-D599 IonicContact NH2-OD2 3.83Å; V597-D599 PolarHBondContact O-N 2.94Å; D599-M601 PolarHBondContact O-N 3.02Å; D599-M601 PolarHBondContact OD1-N 2.78Å; D599-N602 HydrophobicContact CB-CB 4.15Å; D599-N602 PolarHBondContact OD2-ND2 3.2Å
600	L	75.5	Confident	88.1	Confident	40 Å²	40	33.9 Å²	33.9	21%	0.209	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-14.7	-179.3	-66.3	176.4	0	0	0	113.5	Y425 M455	Y425-L600 HydrophobicContact CD1-CD2 4.19Å; Y425-L600 HydrophobicContact CD2-CD1 4.01Å; Y425-L600 HydrophobicContact CD2-CD2 3.83Å; Y425-L600 HydrophobicContact CG-CD2 3.6Å; M455-L600 HydrophobicContact CB-CD1 4.37Å; M455-L600 HydrophobicContact CG-CD1 3.35Å
601	M	74.9	Confident	88.6	Confident	121 Å²	121	34.6 Å²	34.6	60%	0.596	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-12.7	-179.4	-56.8	-59.2	-173.1	0	0	113.1	F458 D599	F458-M601 HydrophobicContact CD1-CE 4.47Å; F458-M601 HydrophobicContact CE1-CE 4.09Å; F458-M601 HydrophobicContact CE2-CE 4.14Å; F458-M601 HydrophobicContact CZ-CE 3.91Å; D599-M601 PolarHBondContact O-N 3.02Å; D599-M601 PolarHBondContact OD1-N 2.78Å
602	N	78.9	Confident	89	Confident	56 Å²	56	34.5 Å²	34.5	30%	0.299	17%	0.168	S	C	.	.	S	Bend	trans	-132.2	153.5	-174	-64.5	-67.1	0	0	0	111.5	N532 D599 L604	N532-N602 PolarHBondContact ND2-ND2 3.2Å; N532-N602 VanDerWaalsContact ND2-ND2 3.15Å; D599-N602 HydrophobicContact CB-CB 4.15Å; D599-N602 PolarHBondContact OD2-ND2 3.2Å; N602-L604 PolarHBondContact O-N 3.29Å
603	D	82.3	Confident	89.1	Confident	102 Å²	102	35.6 Å²	35.6	55%	0.545	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-66.3	131.8	178.3	-69.4	-44.4	0	0	0	112.6	R413 R504 L605	R413-D603 IonicContact CZ-OD1 3.83Å; R413-D603 IonicContact NH1-OD1 2.7Å; R413-D603 IonicContact NH2-OD1 3.38Å; R413-D603 PolarHBondContact NH2-OD1 2.93Å; R504-D603 VanDerWaalsContact CZ-O 3.31Å; R504-D603 PolarHBondContact NH1-O 3.34Å; R504-D603 PolarHBondContact NH2-O 2.78Å; D603-L605 PolarHBondContact O-N 3.44Å
604	L	89.2	Confident	89.2	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.063	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-65.4	124.9	174	-175.4	77.5	0	0	0	109.4	A427 P429 P596 V598 N602	A427-L604 HydrophobicContact CB-CD1 4.43Å; A427-L604 HydrophobicContact CB-CD2 3.85Å; P429-L604 HydrophobicContact CB-CD2 4.2Å; P596-L604 HydrophobicContact CB-CD1 3.95Å; P596-L604 HydrophobicContact CB-CG 4.44Å; P596-L604 HydrophobicContact CG-CD1 4.17Å; V598-L604 HydrophobicContact CB-CD1 4.47Å; V598-L604 HydrophobicContact CG2-CD1 3.92Å; N602-L604 PolarHBondContact O-N 3.29Å
605	L	91.5	Very high	89.2	Confident	12 Å²	12	34.6 Å²	34.6	6%	0.063	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-71.5	133.2	172.9	-66.9	-177.4	0	0	0	110.6	Y534 P596 D603 L636 V661	Y534-L605 HydrophobicContact CD2-CD1 3.44Å; Y534-L605 VanDerWaalsContact CD2-CD1 3.44Å; Y534-L605 HydrophobicContact CE2-CD1 3.94Å; Y534-L605 HydrophobicContact CG-CD1 4.32Å; P596-L605 HydrophobicContact CB-CB 4.41Å; P596-L605 VanDerWaalsContact CB-O 3.24Å; P596-L605 WeakPolarHBondContact CB-O 3.38Å; D603-L605 PolarHBondContact O-N 3.44Å; L605-L636 HydrophobicContact CD1-CD1 4.04Å; L605-L636 HydrophobicContact CD2-CD1 3.58Å; L605-L636 HydrophobicContact CG-CD1 4.5Å; L605-V661 HydrophobicContact CB-CG1 3.47Å; L605-V661 VanDerWaalsContact CB-CG1 3.47Å; L605-V661 HydrophobicContact CD1-CG1 3.81Å; L605-V661 HydrophobicContact CG-CG1 4.31Å
606	P	91.8	Very high	89.2	Confident	19 Å²	19	34.2 Å²	34.2	12%	0.123	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-70.3	153.1	176.6	27.5	-31	0	0	0	110.9	S431 Y608 S662	S431-P606 VanDerWaalsContact OG-CB 3.27Å; S431-P606 WeakPolarHBondContact OG-CB 3.44Å; P606-Y608 HydrophobicContact CB-CE1 3.98Å; P606-Y608 HydrophobicContact CB-CE2 4.37Å; P606-Y608 HydrophobicContact CG-CD2 4.41Å; P606-Y608 HydrophobicContact CG-CE1 4.01Å; P606-Y608 HydrophobicContact CG-CE2 3.64Å; P606-Y608 VanDerWaalsContact CG-OH 3.28Å; P606-Y608 WeakPolarHBondContact CG-OH 3.35Å; P606-S662 PolarHBondContact O-N 2.91Å
607	V	92.5	Very high	88.9	Confident	41 Å²	41	34.7 Å²	34.7	25%	0.248	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.5	169.7	-176.4	0	0	0	0	107.5	P596 E659 V661	P596-V607 HydrophobicContact CG-CG2 3.88Å; V607-E659 HydrophobicContact CG1-CG 3.72Å; V607-V661 HydrophobicContact CG2-CG2 4.14Å
608	Y	92.6	Very high	88.6	Confident	46 Å²	46	39.8 Å²	39.8	18%	0.18	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	144.7	-174.3	-77.9	-37.9	0	0	0	110.5	P606 Y610 E659 C660 D715	P606-Y608 HydrophobicContact CB-CE1 3.98Å; P606-Y608 HydrophobicContact CB-CE2 4.37Å; P606-Y608 HydrophobicContact CG-CD2 4.41Å; P606-Y608 HydrophobicContact CG-CE1 4.01Å; P606-Y608 HydrophobicContact CG-CE2 3.64Å; P606-Y608 VanDerWaalsContact CG-OH 3.28Å; P606-Y608 WeakPolarHBondContact CG-OH 3.35Å; Y608-Y610 HydrophobicContact CD2-CE2 4.06Å; Y608-Y610 HydrophobicContact CG-CE2 4.3Å; Y608-E659 CarbonylContact O-C 3.57Å; Y608-E659 VanDerWaalsContact O-CA 3.27Å; Y608-E659 WeakPolarHBondContact O-CA 3.04Å; Y608-C660 PolarHBondContact N-O 2.77Å; Y608-C660 PolarHBondContact O-N 3.15Å; Y608-D715 VanDerWaalsContact CB-O 3.28Å; Y608-D715 WeakPolarHBondContact CB-O 3.44Å; Y608-D715 HydrophobicContact CD2-CB 3.92Å; Y608-D715 HydrophobicContact CE2-CB 4.1Å; Y608-D715 HydrophobicContact CG-CB 4.23Å
609	K	92	Very high	88.1	Confident	111 Å²	111	40.7 Å²	40.7	48%	0.483	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	87.4	165.1	-166.4	-173.7	-173.3	-150.1	0	106.8	E657 V658 D715	K609-E657 VanDerWaalsContact CE-CD 3.46Å; K609-E657 WeakPolarHBondContact CE-OE2 3.38Å; K609-E657 IonicContact NZ-OE1 3.96Å; K609-E657 PolarHBondContact NZ-OE1 2.7Å; K609-E657 IonicContact NZ-OE2 3.92Å; K609-E657 PolarHBondContact NZ-OE2 2.73Å; K609-V658 CarbonylContact C-O 3.56Å; K609-V658 WeakPolarHBondContact CA-O 3.41Å; K609-D715 CarbonylContact C-O 3.33Å
610	Y	94.3	Very high	87.9	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	136.6	178.5	-77	-100.5	0	0	0	109.3	Y608 L632 E657 V658 C660 L663 L666 I713 R714 D715	Y608-Y610 HydrophobicContact CD2-CE2 4.06Å; Y608-Y610 HydrophobicContact CG-CE2 4.3Å; Y610-L632 HydrophobicContact CD1-CD1 4.27Å; Y610-L632 HydrophobicContact CG-CD1 4.44Å; Y610-E657 CarbonylContact O-C 3.54Å; Y610-E657 WeakPolarHBondContact O-CA 3.39Å; Y610-V658 PolarHBondContact N-O 3.02Å; Y610-V658 PolarHBondContact O-N 3.4Å; Y610-C660 WeakPolarHBondContact CD2-SG 3.44Å; Y610-C660 WeakPolarHBondContact CE2-SG 3.41Å; Y610-L663 PolarHBondContact OH-N 3.44Å; Y610-L663 VanDerWaalsContact OH-N 3.16Å; Y610-L666 HydrophobicContact CE1-CD1 4.43Å; Y610-L666 HydrophobicContact CE1-CD2 4.29Å; Y610-I713 HydrophobicContact CD1-CG2 3.91Å; Y610-R714 CarbonylContact C-O 3.29Å; Y610-R714 VanDerWaalsContact CA-O 3.26Å; Y610-R714 WeakPolarHBondContact CA-O 3.39Å; Y610-D715 WeakPolarHBondContact CA-O 3.41Å; Y610-D715 HydrophobicContact CE1-CB 4.15Å; Y610-D715 WeakPolarHBondContact CE1-OD1 3.35Å; Y610-D715 PolarHBondContact N-O 3.39Å; Y610-D715 PolarHBondContact OH-OD1 3.43Å
611	Y	92.8	Very high	87.9	Confident	50 Å²	50	47 Å²	47	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	127.4	173.5	175.8	-92.4	0	0	0	108.6	E655 F656 E657 I713 R714	Y611-E655 HydrophobicContact CE2-CB 4.49Å; Y611-E655 PolarHBondContact OH-OE1 2.89Å; Y611-E655 PolarHBondContact OH-OE2 3.15Å; Y611-F656 WeakPolarHBondContact CA-O 3.21Å; Y611-E657 HydrophobicContact CD2-CG 3.88Å; Y611-I713 CarbonylContact O-C 3.59Å; Y611-I713 WeakPolarHBondContact O-CA 3.07Å; Y611-R714 PolarHBondContact N-O 3.48Å; Y611-R714 PolarHBondContact O-N 3.3Å
612	G	93.7	Very high	88.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.7	-179.8	0	0	0	0	0	111.9	E655 F656 V712	G612-E655 CarbonylContact O-C 3.52Å; G612-E655 WeakPolarHBondContact O-CA 3.38Å; G612-F656 PolarHBondContact N-O 2.72Å; G612-F656 PolarHBondContact O-N 3.31Å; G612-V712 CarbonylContact C-O 3.55Å; G612-V712 VanDerWaalsContact CA-O 3.26Å; G612-V712 WeakPolarHBondContact CA-O 3.17Å
613	S	93.7	Very high	88.4	Confident	23 Å²	23	42.5 Å²	42.5	16%	0.161	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.9	170.7	-174.7	0	0	0	0	108.6	L654 I711 V712	S613-L654 WeakPolarHBondContact CA-O 3.15Å; S613-I711 CarbonylContact O-C 3.56Å; S613-I711 WeakPolarHBondContact O-CA 3.46Å; S613-V712 PolarHBondContact N-O 2.97Å; S613-V712 PolarHBondContact O-N 2.81Å
614	V	94.1	Very high	88.2	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	113.5	179.6	-177.1	0	0	0	0	107.9	L616 L644 N653 L654 F656 F671 I708 I711	V614-L616 HydrophobicContact CG1-CD2 3.66Å; V614-L616 PolarHBondContact O-N 3.14Å; V614-L644 HydrophobicContact CG2-CD1 4.24Å; V614-N653 CarbonylContact O-C 3.55Å; V614-N653 WeakPolarHBondContact O-CA 3.24Å; V614-L654 HydrophobicContact CB-CB 4.3Å; V614-L654 PolarHBondContact N-O 2.84Å; V614-L654 PolarHBondContact O-N 3.47Å; V614-F656 HydrophobicContact CG2-CD1 4.18Å; V614-F656 HydrophobicContact CG2-CE1 3.79Å; V614-F671 HydrophobicContact CG1-CE2 4.43Å; V614-I708 HydrophobicContact CG1-CD1 4.08Å; V614-I708 HydrophobicContact CG1-CG1 4.07Å; V614-I708 HydrophobicContact CG1-CG2 4.17Å; V614-I711 HydrophobicContact CG1-CG1 4.16Å; V614-I711 HydrophobicContact CG2-CD1 4.39Å; V614-I711 HydrophobicContact CG2-CG1 4.26Å; V614-I711 HydrophobicContact CG2-CG2 4.16Å
615	T	93.5	Very high	87.6	Confident	40 Å²	40	48.1 Å²	48.1	25%	0.245	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.4	171.6	-53.4	0	0	0	0	109.2	N653 K709 S710	T615-N653 WeakPolarHBondContact CA-OD1 3.09Å; T615-N653 VanDerWaalsContact CB-OD1 3.3Å; T615-N653 WeakPolarHBondContact CB-OD1 3.23Å; T615-N653 WeakPolarHBondContact CG2-OD1 3.39Å; T615-N653 PolarHBondContact OG1-OD1 2.76Å; T615-K709 HydrophobicContact CG2-CB 4.06Å; T615-K709 HydrophobicContact CG2-CD 4.23Å; T615-K709 PolarHBondContact O-N 3.22Å; T615-S710 PolarHBondContact N-O 3.17Å; T615-S710 PolarHBondContact O-N 2.77Å; T615-S710 PolarHBondContact OG1-OG 2.81Å
616	L	91.8	Very high	87.1	Confident	16 Å²	16	53.8 Å²	53.8	8%	0.084	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	151.7	-177.4	-56.8	177.9	0	0	0	111.6	V614 M619 F628 G652 L654 I708	V614-L616 HydrophobicContact CG1-CD2 3.66Å; V614-L616 PolarHBondContact O-N 3.14Å; L616-M619 HydrophobicContact CB-SD 3.64Å; L616-M619 HydrophobicContact CD1-SD 3.85Å; L616-M619 HydrophobicContact CD2-CE 4.29Å; L616-M619 HydrophobicContact CD2-SD 3.67Å; L616-M619 HydrophobicContact CG-SD 3.89Å; L616-F628 HydrophobicContact CD1-CE2 4.08Å; L616-F628 HydrophobicContact CD2-CE2 4.46Å; L616-G652 VanDerWaalsContact CB-O 3.3Å; L616-G652 WeakPolarHBondContact CB-O 3.42Å; L616-G652 PolarHBondContact N-O 2.75Å; L616-L654 HydrophobicContact CD1-CB 4.41Å; L616-I708 HydrophobicContact CD2-CG1 4.4Å
617	G	88.9	Confident	86.8	Confident	12 Å²	12	54.9 Å²	54.9	12%	0.124	28%	0.284	C	S	.	.			trans	-83.2	-167.2	167.4	0	0	0	0	0	112.1	M619 G705 W706 L707	G617-M619 PolarHBondContact O-N 2.84Å; G617-G705 CarbonylContact C-O 3.45Å; G617-G705 WeakPolarHBondContact CA-O 3.46Å; G617-W706 CarbonylContact C-O 3.56Å; G617-W706 WeakPolarHBondContact CA-O 3.46Å; G617-L707 PolarHBondContact N-O 2.85Å
618	D	85.1	Confident	86.6	Confident	111 Å²	111	53.2 Å²	53.2	59%	0.594	27%	0.273	S	S	*	.			trans	-68.3	-22.3	-177.6	-60.4	-9.4	0	0	0	112.9	H620 G705 W706 K709	D618-H620 PolarHBondContact O-N 3.08Å; D618-G705 PolarHBondContact N-O 3.21Å; D618-W706 PolarHBondContact N-O 3.19Å; D618-K709 IonicContact OD1-NZ 3.66Å
619	M	79.7	Confident	86.5	Confident	25 Å²	25	53 Å²	53	12%	0.123	27%	0.274	C	S	.	.			trans	51.4	25.6	164.2	-76.7	-171.6	98.3	0	0	116.2	L616 G617 I622 F628 F671 W706 L707	L616-M619 HydrophobicContact CB-SD 3.64Å; L616-M619 HydrophobicContact CD1-SD 3.85Å; L616-M619 HydrophobicContact CD2-CE 4.29Å; L616-M619 HydrophobicContact CD2-SD 3.67Å; L616-M619 HydrophobicContact CG-SD 3.89Å; G617-M619 PolarHBondContact O-N 2.84Å; M619-I622 HydrophobicContact CB-CD1 3.63Å; M619-I622 HydrophobicContact CB-CG1 4.45Å; M619-I622 HydrophobicContact CE-CD1 3.2Å; M619-I622 HydrophobicContact CG-CD1 3.59Å; M619-I622 WeakPolarHBondContact O-CG1 3.42Å; M619-I622 HydrophobicContact SD-CD1 4.13Å; M619-F628 HydrophobicContact CE-CD1 4.39Å; M619-F628 HydrophobicContact CE-CE1 3.57Å; M619-F628 HydrophobicContact CE-CE2 3.79Å; M619-F628 HydrophobicContact CE-CZ 3.21Å; M619-F628 HydrophobicContact SD-CE2 4.43Å; M619-F628 HydrophobicContact SD-CZ 4.16Å; M619-F671 HydrophobicContact CE-CE1 4.44Å; M619-F671 HydrophobicContact CE-CZ 4.35Å; M619-W706 WeakPolarHBondContact CA-O 3.29Å; M619-W706 WeakPolarHBondContact CG-O 3.33Å; M619-W706 PolarHBondContact N-O 3.19Å; M619-L707 HydrophobicContact CE-CD1 4.17Å; M619-L707 WeakPolarHBondContact CG-O 3.25Å
620	H	76.6	Confident	86.6	Confident	129 Å²	129	47.8 Å²	47.8	60%	0.597	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	144.5	171.5	-72.4	-63.4	0	0	0	110.9	D618 I622 W706	D618-H620 PolarHBondContact O-N 3.08Å; H620-I622 VanDerWaalsContact C-N 3.35Å; H620-I622 PolarHBondContact O-N 3.09Å; H620-W706 PolarHBondContact O-NE1 2.83Å
621	N	75.4	Confident	86.6	Confident	60 Å²	60	49.9 Å²	49.9	32%	0.321	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	25.6	174.8	-62.3	3.6	0	0	0	115.2	D676 E678 A679	N621-D676 WeakPolarHBondContact CA-OD2 3.45Å; N621-D676 VanDerWaalsContact CB-OD2 3.28Å; N621-D676 WeakPolarHBondContact CB-OD2 3.23Å; N621-D676 VanDerWaalsContact O-CG 3.25Å; N621-D676 PolarHBondContact O-N 3.46Å; N621-E678 WeakPolarHBondContact ND2-CB 3.42Å; N621-E678 PolarHBondContact ND2-OE2 2.82Å; N621-A679 HydrophobicContact CB-CB 3.8Å; N621-A679 VanDerWaalsContact O-CB 3.26Å; N621-A679 WeakPolarHBondContact O-CB 3.41Å
622	I	83.4	Confident	86.7	Confident	10 Å²	10	47.5 Å²	47.5	5%	0.051	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-93.4	136.7	172	-66.1	-174.6	0	0	0	110.3	M619 H620 Q624 F628 T673 V675 L707	M619-I622 HydrophobicContact CB-CD1 3.63Å; M619-I622 HydrophobicContact CB-CG1 4.45Å; M619-I622 HydrophobicContact CE-CD1 3.2Å; M619-I622 HydrophobicContact CG-CD1 3.59Å; M619-I622 WeakPolarHBondContact O-CG1 3.42Å; M619-I622 HydrophobicContact SD-CD1 4.13Å; H620-I622 VanDerWaalsContact C-N 3.35Å; H620-I622 PolarHBondContact O-N 3.09Å; I622-Q624 PolarHBondContact O-N 3.49Å; I622-Q624 PolarHBondContact O-NE2 2.87Å; I622-F628 HydrophobicContact CG2-CE1 3.87Å; I622-F628 HydrophobicContact CG2-CZ 4.42Å; I622-T673 HydrophobicContact CD1-CG2 4.49Å; I622-V675 HydrophobicContact CG1-CG1 4.41Å; I622-L707 HydrophobicContact CD1-CD1 3.87Å
623	E	80.8	Confident	86.8	Confident	74 Å²	74	50.6 Å²	50.6	35%	0.346	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-59.8	122.2	-179.4	-73.5	-164.3	174.7	0	0	111.4	R626 Q646 F674	E623-R626 HydrophobicContact CB-CG 4.32Å; E623-R626 IonicContact OE2-NE 3.17Å; E623-Q646 PolarHBondContact O-NE2 2.82Å; E623-Q646 VanDerWaalsContact O-NE2 3.07Å; E623-F674 HydrophobicContact CB-CB 4.13Å; E623-F674 HydrophobicContact CG-CB 4.23Å; E623-F674 PolarHBondContact N-O 3.23Å
624	Q	79.6	Confident	86.7	Confident	153 Å²	153	49.8 Å²	49.8	72%	0.715	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	148.1	178.4	-61.9	-62.2	-47.8	0	0	111.5	I622 R626	I622-Q624 PolarHBondContact O-N 3.49Å; I622-Q624 PolarHBondContact O-NE2 2.87Å; Q624-R626 VanDerWaalsContact C-N 3.32Å; Q624-R626 PolarHBondContact O-N 2.96Å
625	G	76	Confident	86.4	Confident	79 Å²	79	53.5 Å²	53.5	81%	0.814	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	11.4	175.6	0	0	0	0	0	115.4
626	R	81.8	Confident	86.3	Confident	130 Å²	130	52.7 Å²	52.7	49%	0.491	27%	0.27	S	S	.	.			trans	-107.2	141.9	171.9	-64.8	-68.1	-166.3	146.7	2.7	110.2	E623 Q624 Q646 F674	E623-R626 HydrophobicContact CB-CG 4.32Å; E623-R626 IonicContact OE2-NE 3.17Å; Q624-R626 VanDerWaalsContact C-N 3.32Å; Q624-R626 PolarHBondContact O-N 2.96Å; R626-Q646 WeakPolarHBondContact O-CG 3.48Å; R626-Q646 PolarHBondContact O-NE2 3.23Å; R626-F674 HydrophobicContact CB-CD2 4.03Å; R626-F674 HydrophobicContact CG-CD2 4.19Å
627	F	83.7	Confident	86.3	Confident	42 Å²	42	51.9 Å²	51.9	18%	0.184	27%	0.266	C	S	.	.			trans	-65.6	142.9	171.9	-69.8	-84	0	0	0	110.8	V580 Y643 L644 D645	V580-F627 HydrophobicContact CG2-CZ 4.03Å; F627-Y643 HydrophobicContact CB-CD1 4.07Å; F627-Y643 HydrophobicContact CG-CD1 4.38Å; F627-L644 WeakPolarHBondContact CA-O 3.49Å; F627-D645 HydrophobicContact CD1-CB 4.23Å; F627-D645 HydrophobicContact CE1-CB 3.91Å
628	F	90	Very high	86.5	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	150.9	158.7	-57.1	-40.7	0	0	0	109.5	L616 M619 I622 L644 Q646 L654 F671 T673	L616-F628 HydrophobicContact CD1-CE2 4.08Å; L616-F628 HydrophobicContact CD2-CE2 4.46Å; M619-F628 HydrophobicContact CE-CD1 4.39Å; M619-F628 HydrophobicContact CE-CE1 3.57Å; M619-F628 HydrophobicContact CE-CE2 3.79Å; M619-F628 HydrophobicContact CE-CZ 3.21Å; M619-F628 HydrophobicContact SD-CE2 4.43Å; M619-F628 HydrophobicContact SD-CZ 4.16Å; I622-F628 HydrophobicContact CG2-CE1 3.87Å; I622-F628 HydrophobicContact CG2-CZ 4.42Å; F628-L644 HydrophobicContact CB-CB 4.16Å; F628-L644 HydrophobicContact CB-CD1 4.39Å; F628-L644 PolarHBondContact N-O 2.86Å; F628-L644 PolarHBondContact O-N 2.8Å; F628-Q646 HydrophobicContact CD1-CG 4.3Å; F628-Q646 HydrophobicContact CD2-CG 4.1Å; F628-Q646 HydrophobicContact CE1-CG 3.87Å; F628-Q646 VanDerWaalsContact CE1-NE2 3.3Å; F628-Q646 HydrophobicContact CE2-CB 4.36Å; F628-Q646 HydrophobicContact CE2-CG 3.67Å; F628-Q646 HydrophobicContact CG-CG 4.4Å; F628-Q646 HydrophobicContact CZ-CB 4.46Å; F628-Q646 HydrophobicContact CZ-CG 3.53Å; F628-L654 HydrophobicContact CD2-CD2 3.66Å; F628-L654 HydrophobicContact CE2-CD2 4.32Å; F628-F671 HydrophobicContact CB-CE2 3.7Å; F628-F671 HydrophobicContact CB-CZ 3.58Å; F628-F671 HydrophobicContact CD1-CE1 4.42Å; F628-F671 AromaticContact CD1-CZ 3.9Å; F628-F671 HydrophobicContact CD1-CZ 3.9Å; F628-F671 HydrophobicContact CD2-CE2 4.29Å; F628-F671 AromaticContact CD2-CZ 3.84Å; F628-F671 HydrophobicContact CD2-CZ 3.84Å; F628-F671 HydrophobicContact CE2-CZ 4.49Å; F628-F671 HydrophobicContact CG-CE1 4.42Å; F628-F671 HydrophobicContact CG-CE2 4.06Å; F628-F671 AromaticContact CG-CZ 3.5Å; F628-F671 HydrophobicContact CG-CZ 3.5Å; F628-T673 VanDerWaalsContact CD1-OG1 3.25Å; F628-T673 WeakPolarHBondContact CD1-OG1 3.42Å; F628-T673 VanDerWaalsContact CE1-OG1 3.3Å; F628-T673 WeakPolarHBondContact CE1-OG1 3.28Å
629	H	90.7	Very high	86.8	Confident	43 Å²	43	46 Å²	46	20%	0.199	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.7	178.3	-57.1	145	0	0	0	110	I641 V642 Y643 F671 S672 F674	H629-I641 HydrophobicContact CB-CG2 3.99Å; H629-V642 CarbonylContact C-O 3.52Å; H629-V642 WeakPolarHBondContact CA-O 3.35Å; H629-Y643 AromaticContact CD2-CD1 3.42Å; H629-Y643 VanDerWaalsContact CD2-CD1 3.42Å; H629-Y643 WeakPolarHBondContact CD2-CD1 3.3Å; H629-Y643 AromaticContact CD2-CE1 3.6Å; H629-Y643 AromaticContact NE2-CD1 3.46Å; H629-Y643 WeakPolarHBondContact NE2-CD1 3.32Å; H629-Y643 AromaticContact NE2-CE1 3.34Å; H629-Y643 VanDerWaalsContact NE2-CE1 3.34Å; H629-Y643 WeakPolarHBondContact NE2-CE1 3.45Å; H629-F671 CarbonylContact O-C 3.53Å; H629-F671 WeakPolarHBondContact O-CA 3.11Å; H629-S672 PolarHBondContact N-O 2.94Å; H629-S672 PolarHBondContact O-N 3.17Å; H629-F674 AromaticContact CE1-CE2 3.82Å
630	C	93.2	Very high	87.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.3	174.1	-176.7	0	0	0	0	109.4	V642 L644 V669 M670	C630-V642 HydrophobicContact CB-CB 4.31Å; C630-V642 PolarHBondContact N-O 3.14Å; C630-V642 WeakPolarHBondContact O-CA 3.49Å; C630-V642 WeakPolarHBondContact O-CB 3.38Å; C630-V642 PolarHBondContact O-N 2.96Å; C630-L644 HydrophobicContact CB-CD1 3.84Å; C630-L644 HydrophobicContact CB-CD2 4.44Å; C630-L644 HydrophobicContact CB-CG 4.23Å; C630-V669 WeakPolarHBondContact SG-CG1 3.06Å; C630-M670 CarbonylContact C-O 3.52Å; C630-M670 WeakPolarHBondContact CA-O 3.43Å
631	K	94.6	Very high	88	Confident	43 Å²	43	41.4 Å²	41.4	19%	0.187	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	120.6	175.8	178.8	172.2	178.8	-179.2	0	109.4	Y633 D638 M670	K631-Y633 HydrophobicContact CB-CE2 4.25Å; K631-Y633 HydrophobicContact CD-CE2 3.98Å; K631-Y633 WeakPolarHBondContact CD-OH 3.22Å; K631-Y633 VanDerWaalsContact CE-OH 3.27Å; K631-Y633 WeakPolarHBondContact CE-OH 3.36Å; K631-Y633 HydrophobicContact CG-CD2 4.42Å; K631-Y633 HydrophobicContact CG-CE2 3.73Å; K631-Y633 PolarHBondContact NZ-OH 2.78Å; K631-D638 VanDerWaalsContact CE-CB 3.47Å; K631-D638 VanDerWaalsContact CE-CG 3.4Å; K631-D638 WeakPolarHBondContact CE-OD1 3.33Å; K631-D638 IonicContact NZ-OD1 2.72Å; K631-D638 PolarHBondContact NZ-OD1 3.07Å; K631-M670 HydrophobicContact CB-CB 4.31Å; K631-M670 PolarHBondContact N-O 3.14Å; K631-M670 PolarHBondContact O-N 2.77Å
632	L	95.6	Very high	88.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.3	-176.8	-45.5	-173.8	0	0	0	109.3	Y610 D638 S639 F656 V658 L663 V669 I713	Y610-L632 HydrophobicContact CD1-CD1 4.27Å; Y610-L632 HydrophobicContact CG-CD1 4.44Å; L632-D638 CarbonylContact O-C 3.58Å; L632-D638 WeakPolarHBondContact O-CA 3.41Å; L632-D638 WeakPolarHBondContact O-CB 3.45Å; L632-S639 WeakPolarHBondContact CB-OG 3.42Å; L632-S639 PolarHBondContact N-OG 2.89Å; L632-S639 PolarHBondContact O-N 2.89Å; L632-F656 HydrophobicContact CD2-CZ 4.37Å; L632-V658 HydrophobicContact CD1-CG1 4.28Å; L632-L663 HydrophobicContact CB-CD1 3.62Å; L632-V669 HydrophobicContact CD2-CB 4.49Å; L632-V669 HydrophobicContact CD2-CG1 3.87Å; L632-V669 HydrophobicContact CD2-CG2 3.94Å; L632-I713 HydrophobicContact CD1-CD1 4.24Å; L632-I713 HydrophobicContact CD1-CG2 4.45Å; L632-I713 HydrophobicContact CD2-CD1 3.36Å; L632-I713 HydrophobicContact CG-CD1 4.41Å
633	Y	94.2	Very high	89	Confident	65 Å²	65	39.3 Å²	39.3	26%	0.255	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.2	173.6	-66.8	-95.3	0	0	0	110	K631 D638 V667 C668 M670	K631-Y633 HydrophobicContact CB-CE2 4.25Å; K631-Y633 HydrophobicContact CD-CE2 3.98Å; K631-Y633 WeakPolarHBondContact CD-OH 3.22Å; K631-Y633 VanDerWaalsContact CE-OH 3.27Å; K631-Y633 WeakPolarHBondContact CE-OH 3.36Å; K631-Y633 HydrophobicContact CG-CD2 4.42Å; K631-Y633 HydrophobicContact CG-CE2 3.73Å; K631-Y633 PolarHBondContact NZ-OH 2.78Å; Y633-D638 HydrophobicContact CD1-CB 3.87Å; Y633-D638 HydrophobicContact CE1-CB 3.95Å; Y633-D638 HydrophobicContact CG-CB 4.45Å; Y633-V667 PolarHBondContact O-N 3.5Å; Y633-C668 WeakPolarHBondContact CB-O 3.46Å; Y633-C668 PolarHBondContact N-O 3.35Å; Y633-C668 PolarHBondContact O-N 3.1Å; Y633-M670 HydrophobicContact CD2-CB 4.5Å; Y633-M670 HydrophobicContact CE2-CB 3.8Å
634	G	91.9	Very high	89.4	Confident	7 Å²	7	35.8 Å²	35.8	7%	0.072	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	-179.7	173.1	0	0	0	0	0	112.3	L636 G637 L663 R665	G634-L636 PolarHBondContact O-N 3.05Å; G634-L636 VanDerWaalsContact O-N 3.16Å; G634-G637 PolarHBondContact N-O 2.89Å; G634-G637 PolarHBondContact O-N 3.24Å; G634-L663 CarbonylContact C-O 3.44Å; G634-L663 VanDerWaalsContact CA-O 3.28Å; G634-L663 WeakPolarHBondContact CA-O 3.41Å; G634-R665 CarbonylContact C-O 3.58Å; G634-R665 WeakPolarHBondContact CA-O 3.15Å
635	E	88.9	Confident	89.5	Confident	77 Å²	77	31.1 Å²	31.1	36%	0.36	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.9	-178.5	-66.6	176.3	172.7	0	0	113.7	L663 R665 V667	E635-L663 PolarHBondContact N-O 2.97Å; E635-R665 HydrophobicContact CG-CB 4.11Å; E635-R665 PolarHBondContact N-O 3.15Å; E635-V667 HydrophobicContact CG-CG2 4.25Å
636	L	89.8	Confident	89.5	Confident	23 Å²	23	28.6 Å²	28.6	12%	0.12	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-0.8	-175.4	-55.5	-179.8	0	0	0	114.3	R504 Y534 L605 G634 L663	R504-L636 HydrophobicContact CB-CD2 3.32Å; R504-L636 HydrophobicContact CG-CD2 4.25Å; Y534-L636 VanDerWaalsContact CE2-O 3.29Å; Y534-L636 WeakPolarHBondContact CE2-O 3.39Å; Y534-L636 PolarHBondContact OH-O 3.43Å; L605-L636 HydrophobicContact CD1-CD1 4.04Å; L605-L636 HydrophobicContact CD2-CD1 3.58Å; L605-L636 HydrophobicContact CG-CD1 4.5Å; G634-L636 PolarHBondContact O-N 3.05Å; G634-L636 VanDerWaalsContact O-N 3.16Å; L636-L663 PolarHBondContact N-O 2.88Å
637	G	91.9	Very high	89.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.2	-170.6	-176.1	0	0	0	0	0	113.6	Y507 G634	Y507-G637 VanDerWaalsContact CZ-CA 3.46Å; G634-G637 PolarHBondContact N-O 2.89Å; G634-G637 PolarHBondContact O-N 3.24Å
638	D	94.3	Very high	88.6	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	156.3	170.7	62.6	115.5	0	0	0	112.2	Y497 Q509 K535 R537 K631 L632 Y633 G640 L663	Y497-D638 WeakPolarHBondContact CE1-OD2 3.45Å; Y497-D638 VanDerWaalsContact OH-CG 3.29Å; Y497-D638 PolarHBondContact OH-OD1 2.8Å; Y497-D638 PolarHBondContact OH-OD2 2.82Å; Q509-D638 PolarHBondContact OE1-OD2 3.38Å; K535-D638 PolarHBondContact NZ-O 3.4Å; R537-D638 IonicContact CZ-OD1 3.12Å; R537-D638 IonicContact NH1-OD1 3.93Å; R537-D638 PolarHBondContact NH1-OD1 3.29Å; R537-D638 IonicContact NH1-OD2 3.82Å; R537-D638 IonicContact NH2-OD1 2.7Å; K631-D638 VanDerWaalsContact CE-CB 3.47Å; K631-D638 VanDerWaalsContact CE-CG 3.4Å; K631-D638 WeakPolarHBondContact CE-OD1 3.33Å; K631-D638 IonicContact NZ-OD1 2.72Å; K631-D638 PolarHBondContact NZ-OD1 3.07Å; L632-D638 CarbonylContact O-C 3.58Å; L632-D638 WeakPolarHBondContact O-CA 3.41Å; L632-D638 WeakPolarHBondContact O-CB 3.45Å; Y633-D638 HydrophobicContact CD1-CB 3.87Å; Y633-D638 HydrophobicContact CE1-CB 3.95Å; Y633-D638 HydrophobicContact CG-CB 4.45Å; D638-G640 VanDerWaalsContact C-N 3.32Å; D638-G640 PolarHBondContact O-N 2.82Å; D638-G640 PolarHBondContact OD1-N 2.87Å; D638-L663 VanDerWaalsContact C-CD2 3.47Å
639	S	91.8	Very high	88.1	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.			trans	-70.9	-23.6	177.4	58.5	0	0	0	0	113.7	F592 L632	F592-S639 WeakPolarHBondContact CD2-O 3.28Å; F592-S639 WeakPolarHBondContact CE2-O 3.33Å; F592-S639 WeakPolarHBondContact CZ-O 3.49Å; L632-S639 WeakPolarHBondContact CB-OG 3.42Å; L632-S639 PolarHBondContact N-OG 2.89Å; L632-S639 PolarHBondContact O-N 2.89Å
640	G	91	Very high	87.3	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.			trans	84.3	-177.6	-157.9	0	0	0	0	0	111.6	D638 V642	D638-G640 VanDerWaalsContact C-N 3.32Å; D638-G640 PolarHBondContact O-N 2.82Å; D638-G640 PolarHBondContact OD1-N 2.87Å; G640-V642 PolarHBondContact O-N 3.32Å
641	I	90.7	Very high	86.7	Confident	57 Å²	57	43.9 Å²	43.9	29%	0.292	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-83.6	117.7	-173.1	-57.4	175.2	0	0	0	110.4	F592 H629 Y643	F592-I641 VanDerWaalsContact CE1-O 3.29Å; F592-I641 WeakPolarHBondContact CE1-O 3.28Å; H629-I641 HydrophobicContact CB-CG2 3.99Å; I641-Y643 HydrophobicContact CB-CE2 4.22Å; I641-Y643 HydrophobicContact CG2-CD2 4.25Å; I641-Y643 HydrophobicContact CG2-CE1 4.32Å; I641-Y643 HydrophobicContact CG2-CE2 3.81Å
642	V	91.4	Very high	86.2	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.4	171.5	-171.7	0	0	0	0	108.5	H629 C630 G640 L644 F656 V658	H629-V642 CarbonylContact C-O 3.52Å; H629-V642 WeakPolarHBondContact CA-O 3.35Å; C630-V642 HydrophobicContact CB-CB 4.31Å; C630-V642 PolarHBondContact N-O 3.14Å; C630-V642 WeakPolarHBondContact O-CA 3.49Å; C630-V642 WeakPolarHBondContact O-CB 3.38Å; C630-V642 PolarHBondContact O-N 2.96Å; G640-V642 PolarHBondContact O-N 3.32Å; V642-L644 HydrophobicContact CG1-CD2 3.84Å; V642-F656 HydrophobicContact CG1-CD2 3.98Å; V642-F656 HydrophobicContact CG1-CE2 4.48Å; V642-V658 HydrophobicContact CG1-CB 4.33Å; V642-V658 HydrophobicContact CG2-CB 4Å; V642-V658 HydrophobicContact CG2-CG1 4.13Å; V642-V658 HydrophobicContact CG2-CG2 3.74Å
643	Y	88	Confident	85.9	Confident	24 Å²	24	45.9 Å²	45.9	9%	0.094	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.6	179.5	-63.7	-98.3	0	0	0	109.4	L589 L591 F627 H629 I641	L589-Y643 HydrophobicContact CD2-CG 4.48Å; L589-Y643 WeakPolarHBondContact O-CD2 3.39Å; L591-Y643 HydrophobicContact CB-CE2 4.44Å; L591-Y643 HydrophobicContact CD1-CD2 4.38Å; L591-Y643 HydrophobicContact CD1-CE2 3.64Å; L591-Y643 HydrophobicContact CG-CD2 4.42Å; L591-Y643 HydrophobicContact CG-CE2 4Å; F627-Y643 HydrophobicContact CB-CD1 4.07Å; F627-Y643 HydrophobicContact CG-CD1 4.38Å; H629-Y643 AromaticContact CD2-CD1 3.42Å; H629-Y643 VanDerWaalsContact CD2-CD1 3.42Å; H629-Y643 WeakPolarHBondContact CD2-CD1 3.3Å; H629-Y643 AromaticContact CD2-CE1 3.6Å; H629-Y643 AromaticContact NE2-CD1 3.46Å; H629-Y643 WeakPolarHBondContact NE2-CD1 3.32Å; H629-Y643 AromaticContact NE2-CE1 3.34Å; H629-Y643 VanDerWaalsContact NE2-CE1 3.34Å; H629-Y643 WeakPolarHBondContact NE2-CE1 3.45Å; I641-Y643 HydrophobicContact CB-CE2 4.22Å; I641-Y643 HydrophobicContact CG2-CD2 4.25Å; I641-Y643 HydrophobicContact CG2-CE1 4.32Å; I641-Y643 HydrophobicContact CG2-CE2 3.81Å
644	L	88.4	Confident	85.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.5	-179	-38.3	173.5	0	0	0	109.1	V614 F627 F628 C630 V642 L654 F656 F671	V614-L644 HydrophobicContact CG2-CD1 4.24Å; F627-L644 WeakPolarHBondContact CA-O 3.49Å; F628-L644 HydrophobicContact CB-CB 4.16Å; F628-L644 HydrophobicContact CB-CD1 4.39Å; F628-L644 PolarHBondContact N-O 2.86Å; F628-L644 PolarHBondContact O-N 2.8Å; C630-L644 HydrophobicContact CB-CD1 3.84Å; C630-L644 HydrophobicContact CB-CD2 4.44Å; C630-L644 HydrophobicContact CB-CG 4.23Å; V642-L644 HydrophobicContact CG1-CD2 3.84Å; L644-L654 HydrophobicContact CB-CD2 3.41Å; L644-L654 VanDerWaalsContact CB-CD2 3.41Å; L644-L654 HydrophobicContact CB-CG 4.09Å; L644-L654 HydrophobicContact CD1-CD2 3.82Å; L644-L654 HydrophobicContact CD1-CG 4.46Å; L644-L654 HydrophobicContact CG-CD2 4.24Å; L644-F656 HydrophobicContact CD1-CD1 4.32Å; L644-F656 HydrophobicContact CD2-CB 3.42Å; L644-F656 VanDerWaalsContact CD2-CB 3.42Å; L644-F656 HydrophobicContact CD2-CD1 3.61Å; L644-F656 HydrophobicContact CD2-CD2 4.24Å; L644-F656 HydrophobicContact CD2-CE1 4.41Å; L644-F656 HydrophobicContact CD2-CG 3.5Å; L644-F656 VanDerWaalsContact CD2-CG 3.5Å; L644-F671 HydrophobicContact CD1-CE2 4.19Å
645	D	81.2	Confident	85.7	Confident	54 Å²	54	47.4 Å²	47.4	29%	0.289	26%	0.256	S	S	.	.			trans	-79.3	131.1	179.8	-170.8	-5.1	0	0	0	110.3	F627 L647 T648 L654	F627-D645 HydrophobicContact CD1-CB 4.23Å; F627-D645 HydrophobicContact CE1-CB 3.91Å; D645-L647 PolarHBondContact O-N 3.15Å; D645-L647 PolarHBondContact OD1-N 2.99Å; D645-T648 HydrophobicContact CB-CG2 4.06Å; D645-T648 PolarHBondContact O-N 2.86Å; D645-T648 PolarHBondContact O-OG1 3.17Å; D645-L654 WeakPolarHBondContact O-CD1 3.5Å
646	Q	77.6	Confident	85.8	Confident	26 Å²	26	43.9 Å²	43.9	12%	0.121	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-66.3	-29.7	176.6	-54.9	-169.8	13.4	0	0	111.4	E623 R626 F628 T648 S649	E623-Q646 PolarHBondContact O-NE2 2.82Å; E623-Q646 VanDerWaalsContact O-NE2 3.07Å; R626-Q646 WeakPolarHBondContact O-CG 3.48Å; R626-Q646 PolarHBondContact O-NE2 3.23Å; F628-Q646 HydrophobicContact CD1-CG 4.3Å; F628-Q646 HydrophobicContact CD2-CG 4.1Å; F628-Q646 HydrophobicContact CE1-CG 3.87Å; F628-Q646 VanDerWaalsContact CE1-NE2 3.3Å; F628-Q646 HydrophobicContact CE2-CB 4.36Å; F628-Q646 HydrophobicContact CE2-CG 3.67Å; F628-Q646 HydrophobicContact CG-CG 4.4Å; F628-Q646 HydrophobicContact CZ-CB 4.46Å; F628-Q646 HydrophobicContact CZ-CG 3.53Å; Q646-T648 PolarHBondContact O-N 2.95Å; Q646-S649 PolarHBondContact O-N 2.95Å; Q646-S649 PolarHBondContact O-OG 2.94Å
647	L	71.9	Confident	85.8	Confident	156 Å²	156	46.5 Å²	46.5	82%	0.817	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-72.1	-13.5	-175.8	-61.6	175.3	0	0	0	113.5	D645	D645-L647 PolarHBondContact O-N 3.15Å; D645-L647 PolarHBondContact OD1-N 2.99Å
648	T	74.5	Confident	85.8	Confident	47 Å²	47	46.5 Å²	46.5	29%	0.288	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-93.4	3.2	-180	59.2	0	0	0	0	113.5	D645 Q646 N650 L654	D645-T648 HydrophobicContact CB-CG2 4.06Å; D645-T648 PolarHBondContact O-N 2.86Å; D645-T648 PolarHBondContact O-OG1 3.17Å; Q646-T648 PolarHBondContact O-N 2.95Å; T648-N650 PolarHBondContact O-N 3.09Å; T648-L654 WeakPolarHBondContact OG1-CD1 3.45Å
649	S	78.1	Confident	85.7	Confident	48 Å²	48	52.1 Å²	52.1	34%	0.336	28%	0.278	S	S	.	.			trans	-70.8	126.5	179.1	71.1	0	0	0	0	111.8	Q646 N653	Q646-S649 PolarHBondContact O-N 2.95Å; Q646-S649 PolarHBondContact O-OG 2.94Å; S649-N653 CarbonylContact C-O 3.59Å; S649-N653 VanDerWaalsContact CA-O 3.28Å; S649-N653 WeakPolarHBondContact CA-O 3.47Å
650	N	75.4	Confident	85.7	Confident	126 Å²	126	52.1 Å²	52.1	67%	0.674	28%	0.278	S	S	*	.	B	Isolated β-bridge	trans	-110.9	124.4	173	-68.7	-36.4	0	0	0	109.1	T648 G652 N653	T648-N650 PolarHBondContact O-N 3.09Å; N650-G652 PolarHBondContact O-N 3.37Å; N650-G652 VanDerWaalsContact O-N 3.14Å; N650-N653 PolarHBondContact N-O 2.77Å; N650-N653 WeakPolarHBondContact O-CB 3.38Å; N650-N653 PolarHBondContact O-N 3.29Å
651	D	79.7	Confident	85.9	Confident	167 Å²	167	52.1 Å²	52.1	89%	0.893	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	34.9	180	-61.3	-29	0	0	0	114.3	N653	D651-N653 VanDerWaalsContact C-N 3.28Å; D651-N653 PolarHBondContact O-N 3.46Å
652	G	83.5	Confident	86.1	Confident	30 Å²	30	50 Å²	50	31%	0.309	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	9.1	-176.7	0	0	0	0	0	114.7	L616 N650	L616-G652 VanDerWaalsContact CB-O 3.3Å; L616-G652 WeakPolarHBondContact CB-O 3.42Å; L616-G652 PolarHBondContact N-O 2.75Å; N650-G652 PolarHBondContact O-N 3.37Å; N650-G652 VanDerWaalsContact O-N 3.14Å
653	N	90	Very high	86.2	Confident	54 Å²	54	50 Å²	50	29%	0.289	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.9	172.1	-66	-51.8	0	0	0	111	V614 T615 S649 N650 D651	V614-N653 CarbonylContact O-C 3.55Å; V614-N653 WeakPolarHBondContact O-CA 3.24Å; T615-N653 WeakPolarHBondContact CA-OD1 3.09Å; T615-N653 VanDerWaalsContact CB-OD1 3.3Å; T615-N653 WeakPolarHBondContact CB-OD1 3.23Å; T615-N653 WeakPolarHBondContact CG2-OD1 3.39Å; T615-N653 PolarHBondContact OG1-OD1 2.76Å; S649-N653 CarbonylContact C-O 3.59Å; S649-N653 VanDerWaalsContact CA-O 3.28Å; S649-N653 WeakPolarHBondContact CA-O 3.47Å; N650-N653 PolarHBondContact N-O 2.77Å; N650-N653 WeakPolarHBondContact O-CB 3.38Å; N650-N653 PolarHBondContact O-N 3.29Å; D651-N653 VanDerWaalsContact C-N 3.28Å; D651-N653 PolarHBondContact O-N 3.46Å
654	L	90.5	Very high	86.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	112.2	177.3	-179.2	59.7	0	0	0	109.7	S613 V614 L616 F628 L644 D645 T648	S613-L654 WeakPolarHBondContact CA-O 3.15Å; V614-L654 HydrophobicContact CB-CB 4.3Å; V614-L654 PolarHBondContact N-O 2.84Å; V614-L654 PolarHBondContact O-N 3.47Å; L616-L654 HydrophobicContact CD1-CB 4.41Å; F628-L654 HydrophobicContact CD2-CD2 3.66Å; F628-L654 HydrophobicContact CE2-CD2 4.32Å; L644-L654 HydrophobicContact CB-CD2 3.41Å; L644-L654 VanDerWaalsContact CB-CD2 3.41Å; L644-L654 HydrophobicContact CB-CG 4.09Å; L644-L654 HydrophobicContact CD1-CD2 3.82Å; L644-L654 HydrophobicContact CD1-CG 4.46Å; L644-L654 HydrophobicContact CG-CD2 4.24Å; D645-L654 WeakPolarHBondContact O-CD1 3.5Å; T648-L654 WeakPolarHBondContact OG1-CD1 3.45Å
655	E	91	Very high	86.4	Confident	105 Å²	105	55 Å²	55	49%	0.491	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.5	180	-62	-174	180	0	0	111.2	Y611 G612	Y611-E655 HydrophobicContact CE2-CB 4.49Å; Y611-E655 PolarHBondContact OH-OE1 2.89Å; Y611-E655 PolarHBondContact OH-OE2 3.15Å; G612-E655 CarbonylContact O-C 3.52Å; G612-E655 WeakPolarHBondContact O-CA 3.38Å
656	F	90.6	Very high	87	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	158.8	175.8	70.5	-90.7	0	0	0	113.4	N588 Y611 G612 V614 L632 V642 L644 V658 I713	N588-F656 WeakPolarHBondContact ND2-CA 3.34Å; N588-F656 WeakPolarHBondContact OD1-CB 2.93Å; Y611-F656 WeakPolarHBondContact CA-O 3.21Å; G612-F656 PolarHBondContact N-O 2.72Å; G612-F656 PolarHBondContact O-N 3.31Å; V614-F656 HydrophobicContact CG2-CD1 4.18Å; V614-F656 HydrophobicContact CG2-CE1 3.79Å; L632-F656 HydrophobicContact CD2-CZ 4.37Å; V642-F656 HydrophobicContact CG1-CD2 3.98Å; V642-F656 HydrophobicContact CG1-CE2 4.48Å; L644-F656 HydrophobicContact CD1-CD1 4.32Å; L644-F656 HydrophobicContact CD2-CB 3.42Å; L644-F656 VanDerWaalsContact CD2-CB 3.42Å; L644-F656 HydrophobicContact CD2-CD1 3.61Å; L644-F656 HydrophobicContact CD2-CD2 4.24Å; L644-F656 HydrophobicContact CD2-CE1 4.41Å; L644-F656 HydrophobicContact CD2-CG 3.5Å; L644-F656 VanDerWaalsContact CD2-CG 3.5Å; F656-V658 HydrophobicContact CD2-CG1 4.34Å; F656-V658 HydrophobicContact CE2-CG1 4.14Å; F656-I713 HydrophobicContact CZ-CD1 4.32Å
657	E	90.8	Very high	87.6	Confident	78 Å²	78	54.7 Å²	54.7	36%	0.364	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.4	175.1	-67.1	-176.6	128.9	0	0	108.7	N588 K609 Y610 Y611	N588-E657 PolarHBondContact ND2-N 2.66Å; N588-E657 PolarHBondContact ND2-O 2.75Å; K609-E657 VanDerWaalsContact CE-CD 3.46Å; K609-E657 WeakPolarHBondContact CE-OE2 3.38Å; K609-E657 IonicContact NZ-OE1 3.96Å; K609-E657 PolarHBondContact NZ-OE1 2.7Å; K609-E657 IonicContact NZ-OE2 3.92Å; K609-E657 PolarHBondContact NZ-OE2 2.73Å; Y610-E657 CarbonylContact O-C 3.54Å; Y610-E657 WeakPolarHBondContact O-CA 3.39Å; Y611-E657 HydrophobicContact CD2-CG 3.88Å
658	V	91.9	Very high	88.6	Confident	1 Å²	1	48 Å²	48	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	128.7	179.1	59.5	0	0	0	0	110.5	Q590 F592 K609 Y610 L632 V642 F656	Q590-V658 HydrophobicContact CG-CG2 4.37Å; F592-V658 HydrophobicContact CE1-CG2 4.47Å; F592-V658 HydrophobicContact CE2-CG2 4.25Å; F592-V658 HydrophobicContact CZ-CG2 3.57Å; K609-V658 CarbonylContact C-O 3.56Å; K609-V658 WeakPolarHBondContact CA-O 3.41Å; Y610-V658 PolarHBondContact N-O 3.02Å; Y610-V658 PolarHBondContact O-N 3.4Å; L632-V658 HydrophobicContact CD1-CG1 4.28Å; V642-V658 HydrophobicContact CG1-CB 4.33Å; V642-V658 HydrophobicContact CG2-CB 4Å; V642-V658 HydrophobicContact CG2-CG1 4.13Å; V642-V658 HydrophobicContact CG2-CG2 3.74Å; F656-V658 HydrophobicContact CD2-CG1 4.34Å; F656-V658 HydrophobicContact CE2-CG1 4.14Å
659	E	91.3	Very high	89.7	Confident	118 Å²	118	45.7 Å²	45.7	55%	0.551	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92	111.8	176.8	-172.4	178	-174	0	0	110.2	Q590 V607 Y608	Q590-E659 PolarHBondContact NE2-O 2.68Å; Q590-E659 VanDerWaalsContact OE1-N 3.07Å; V607-E659 HydrophobicContact CG1-CG 3.72Å; Y608-E659 CarbonylContact O-C 3.57Å; Y608-E659 VanDerWaalsContact O-CA 3.27Å; Y608-E659 WeakPolarHBondContact O-CA 3.04Å
660	C	93.5	Very high	90.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.8	179	64	0	0	0	0	111.8	F592 E594 Y608 Y610	F592-C660 HydrophobicContact CE2-CB 4.22Å; E594-C660 HydrophobicContact CG-CB 4.12Å; E594-C660 WeakPolarHBondContact OE2-CB 3.43Å; Y608-C660 PolarHBondContact N-O 2.77Å; Y608-C660 PolarHBondContact O-N 3.15Å; Y610-C660 WeakPolarHBondContact CD2-SG 3.44Å; Y610-C660 WeakPolarHBondContact CE2-SG 3.41Å
661	V	94.8	Very high	91.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	143.3	176.5	173.4	0	0	0	0	107.9	K535 E594 P596 L605 V607 L663	K535-V661 HydrophobicContact CB-CG1 4.36Å; K535-V661 HydrophobicContact CD-CB 3.63Å; K535-V661 HydrophobicContact CD-CG1 3.96Å; K535-V661 HydrophobicContact CD-CG2 4.25Å; K535-V661 HydrophobicContact CG-CB 4.14Å; K535-V661 HydrophobicContact CG-CG1 4.33Å; K535-V661 HydrophobicContact CG-CG2 4.27Å; E594-V661 HydrophobicContact CB-CB 4.2Å; E594-V661 HydrophobicContact CB-CG2 3.68Å; E594-V661 PolarHBondContact OE2-N 3.12Å; P596-V661 HydrophobicContact CB-CG1 4.32Å; P596-V661 HydrophobicContact CB-CG2 4.24Å; P596-V661 HydrophobicContact CG-CG2 4.47Å; L605-V661 HydrophobicContact CB-CG1 3.47Å; L605-V661 VanDerWaalsContact CB-CG1 3.47Å; L605-V661 HydrophobicContact CD1-CG1 3.81Å; L605-V661 HydrophobicContact CG-CG1 4.31Å; V607-V661 HydrophobicContact CG2-CG2 4.14Å; V661-L663 WeakPolarHBondContact O-CD2 3.13Å; V661-L663 PolarHBondContact O-N 3.42Å
662	S	94.6	Very high	91.9	Very high	13 Å²	13	31.3 Å²	31.3	9%	0.091	17%	0.166	C	C	.	.			trans	-45.4	125.8	-178.6	-179.9	0	0	0	0	112.3	P606 G664	P606-S662 PolarHBondContact O-N 2.91Å; S662-G664 PolarHBondContact OG-N 2.97Å
663	L	93.6	Very high	92.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.			trans	-86.5	3.1	176.6	-55	-178.6	0	0	0	111.9	Y610 L632 G634 E635 L636 D638 V661 L666	Y610-L663 PolarHBondContact OH-N 3.44Å; Y610-L663 VanDerWaalsContact OH-N 3.16Å; L632-L663 HydrophobicContact CB-CD1 3.62Å; G634-L663 CarbonylContact C-O 3.44Å; G634-L663 VanDerWaalsContact CA-O 3.28Å; G634-L663 WeakPolarHBondContact CA-O 3.41Å; E635-L663 PolarHBondContact N-O 2.97Å; L636-L663 PolarHBondContact N-O 2.88Å; D638-L663 VanDerWaalsContact C-CD2 3.47Å; V661-L663 WeakPolarHBondContact O-CD2 3.13Å; V661-L663 PolarHBondContact O-N 3.42Å; L663-L666 HydrophobicContact CB-CD2 3.91Å; L663-L666 HydrophobicContact CD1-CD2 3.92Å; L663-L666 HydrophobicContact CG-CD2 4.5Å
664	G	90.5	Very high	92.2	Very high	16 Å²	16	30 Å²	30	17%	0.165	15%	0.149	C	C	.	.	S	Bend	trans	66.9	-150.4	-167.8	0	0	0	0	0	110.7	S662 L666	S662-G664 PolarHBondContact OG-N 2.97Å; G664-L666 PolarHBondContact O-N 3.3Å
665	R	90	Very high	92.2	Very high	114 Å²	114	30.2 Å²	30.2	43%	0.43	15%	0.15	S	C	.	.	S	Bend	trans	-63.4	126.8	173	-171.1	-173.2	175.4	171.8	1.3	109.3	G634 E635 Y723	G634-R665 CarbonylContact C-O 3.58Å; G634-R665 WeakPolarHBondContact CA-O 3.15Å; E635-R665 HydrophobicContact CG-CB 4.11Å; E635-R665 PolarHBondContact N-O 3.15Å; R665-Y723 HydrophobicContact CG-CE1 3.98Å
666	L	93	Very high	92	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	138.2	172.8	-59.4	-176.1	0	0	0	110.1	Y610 L663 G664 I713 Y723 F725 L745	Y610-L666 HydrophobicContact CE1-CD1 4.43Å; Y610-L666 HydrophobicContact CE1-CD2 4.29Å; L663-L666 HydrophobicContact CB-CD2 3.91Å; L663-L666 HydrophobicContact CD1-CD2 3.92Å; L663-L666 HydrophobicContact CG-CD2 4.5Å; G664-L666 PolarHBondContact O-N 3.3Å; L666-I713 HydrophobicContact CD1-CB 3.95Å; L666-I713 HydrophobicContact CD1-CD1 4.26Å; L666-I713 HydrophobicContact CD1-CG2 3.63Å; L666-Y723 HydrophobicContact CB-CD1 3.87Å; L666-Y723 HydrophobicContact CB-CD2 4.36Å; L666-Y723 HydrophobicContact CB-CE1 4.06Å; L666-Y723 HydrophobicContact CB-CG 4.03Å; L666-Y723 HydrophobicContact CD1-CD2 3.65Å; L666-Y723 HydrophobicContact CD1-CE2 4.1Å; L666-Y723 HydrophobicContact CD1-CG 3.92Å; L666-Y723 HydrophobicContact CG-CD1 4.36Å; L666-Y723 HydrophobicContact CG-CD2 3.99Å; L666-Y723 HydrophobicContact CG-CE1 4.38Å; L666-Y723 HydrophobicContact CG-CE2 4.01Å; L666-Y723 HydrophobicContact CG-CG 4.17Å; L666-F725 HydrophobicContact CB-CZ 3.96Å; L666-F725 HydrophobicContact CD1-CZ 4.32Å; L666-L745 WeakPolarHBondContact O-CD2 3.4Å
667	V	89.9	Confident	91.8	Very high	73 Å²	73	32 Å²	32	44%	0.442	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-49.3	-177	178.2	0	0	0	0	110.2	Y633 E635 L745	Y633-V667 PolarHBondContact O-N 3.5Å; E635-V667 HydrophobicContact CG-CG2 4.25Å; V667-L745 WeakPolarHBondContact O-CB 3.18Å; V667-L745 PolarHBondContact O-N 2.61Å; V667-L745 VanDerWaalsContact O-N 3.13Å
668	C	94.4	Very high	91.7	Very high	14 Å²	14	34.5 Å²	34.5	10%	0.095	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	164.5	177.6	67.8	0	0	0	0	111.4	Y633 E742 M743	Y633-C668 WeakPolarHBondContact CB-O 3.46Å; Y633-C668 PolarHBondContact N-O 3.35Å; Y633-C668 PolarHBondContact O-N 3.1Å; C668-E742 HydrophobicContact CB-CG 4.27Å; C668-M743 CarbonylContact C-O 3.56Å; C668-M743 WeakPolarHBondContact CA-O 3.23Å; C668-M743 VanDerWaalsContact CB-O 3.22Å; C668-M743 WeakPolarHBondContact CB-O 3.44Å
669	V	96.4	Very high	91.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.2	175.4	179.3	0	0	0	0	107.8	C630 L632 I711 I713 F725 M743	C630-V669 WeakPolarHBondContact SG-CG1 3.06Å; L632-V669 HydrophobicContact CD2-CB 4.49Å; L632-V669 HydrophobicContact CD2-CG1 3.87Å; L632-V669 HydrophobicContact CD2-CG2 3.94Å; V669-I711 HydrophobicContact CB-CD1 4.25Å; V669-I711 HydrophobicContact CG1-CD1 3.78Å; V669-I713 HydrophobicContact CG2-CD1 3.6Å; V669-F725 HydrophobicContact CG2-CD1 4.09Å; V669-F725 HydrophobicContact CG2-CD2 4.16Å; V669-F725 HydrophobicContact CG2-CE1 3.8Å; V669-F725 HydrophobicContact CG2-CE2 3.83Å; V669-F725 HydrophobicContact CG2-CG 4.31Å; V669-F725 HydrophobicContact CG2-CZ 3.67Å; V669-M743 HydrophobicContact CB-CB 4.27Å; V669-M743 PolarHBondContact N-O 2.98Å; V669-M743 PolarHBondContact O-N 3.42Å
670	M	95.2	Very high	91.2	Very high	19 Å²	19	30.1 Å²	30.1	9%	0.094	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.4	171.9	-167.2	59.8	36.4	0	0	109.4	C630 K631 Y633 L731 R740 E742	C630-M670 CarbonylContact C-O 3.52Å; C630-M670 WeakPolarHBondContact CA-O 3.43Å; K631-M670 HydrophobicContact CB-CB 4.31Å; K631-M670 PolarHBondContact N-O 3.14Å; K631-M670 PolarHBondContact O-N 2.77Å; Y633-M670 HydrophobicContact CD2-CB 4.5Å; Y633-M670 HydrophobicContact CE2-CB 3.8Å; M670-L731 HydrophobicContact CE-CD1 3.87Å; M670-L731 HydrophobicContact SD-CD1 3.66Å; M670-R740 HydrophobicContact SD-CB 4.07Å; M670-E742 HydrophobicContact CE-CB 3.5Å; M670-E742 VanDerWaalsContact CE-CB 3.5Å; M670-E742 HydrophobicContact CE-CG 3.66Å; M670-E742 HydrophobicContact SD-CB 4.4Å
671	F	93.3	Very high	90.9	Very high	1 Å²	1	38 Å²	38	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.3	169.3	-174.6	-92.2	0	0	0	109.6	V614 M619 F628 H629 L644 T673 L707 I708 R740 K741	V614-F671 HydrophobicContact CG1-CE2 4.43Å; M619-F671 HydrophobicContact CE-CE1 4.44Å; M619-F671 HydrophobicContact CE-CZ 4.35Å; F628-F671 HydrophobicContact CB-CE2 3.7Å; F628-F671 HydrophobicContact CB-CZ 3.58Å; F628-F671 HydrophobicContact CD1-CE1 4.42Å; F628-F671 AromaticContact CD1-CZ 3.9Å; F628-F671 HydrophobicContact CD1-CZ 3.9Å; F628-F671 HydrophobicContact CD2-CE2 4.29Å; F628-F671 AromaticContact CD2-CZ 3.84Å; F628-F671 HydrophobicContact CD2-CZ 3.84Å; F628-F671 HydrophobicContact CE2-CZ 4.49Å; F628-F671 HydrophobicContact CG-CE1 4.42Å; F628-F671 HydrophobicContact CG-CE2 4.06Å; F628-F671 AromaticContact CG-CZ 3.5Å; F628-F671 HydrophobicContact CG-CZ 3.5Å; H629-F671 CarbonylContact O-C 3.53Å; H629-F671 WeakPolarHBondContact O-CA 3.11Å; L644-F671 HydrophobicContact CD1-CE2 4.19Å; F671-T673 HydrophobicContact CE1-CG2 4.21Å; F671-L707 HydrophobicContact CD1-CD2 4.48Å; F671-I708 HydrophobicContact CB-CD1 3.49Å; F671-I708 VanDerWaalsContact CB-CD1 3.49Å; F671-I708 HydrophobicContact CD1-CD1 3.32Å; F671-I708 HydrophobicContact CD1-CG1 4.36Å; F671-I708 HydrophobicContact CD2-CD1 3.37Å; F671-I708 HydrophobicContact CE1-CD1 3.72Å; F671-I708 HydrophobicContact CE1-CG1 4.38Å; F671-I708 HydrophobicContact CE2-CD1 3.76Å; F671-I708 HydrophobicContact CG-CD1 3.1Å; F671-I708 HydrophobicContact CG-CG1 4.44Å; F671-I708 HydrophobicContact CZ-CD1 3.91Å; F671-I708 HydrophobicContact CZ-CG1 4.5Å; F671-R740 CarbonylContact O-C 3.58Å; F671-R740 VanDerWaalsContact O-CA 3.31Å; F671-R740 WeakPolarHBondContact O-CA 3.48Å; F671-K741 PolarHBondContact N-O 3.16Å; F671-K741 PolarHBondContact O-N 2.83Å
672	S	91.9	Very high	90.6	Very high	19 Å²	19	41.8 Å²	41.8	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.3	177.9	-40.8	0	0	0	0	110.9	H629 L739 R740	H629-S672 PolarHBondContact N-O 2.94Å; H629-S672 PolarHBondContact O-N 3.17Å; S672-L739 CarbonylContact C-O 3.49Å; S672-L739 WeakPolarHBondContact CA-O 3.4Å; S672-R740 WeakPolarHBondContact OG-CG 3.44Å
673	T	90.7	Very high	90.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	167	177.2	-173	0	0	0	0	110.7	I622 F628 F671 V675 L707 L739	I622-T673 HydrophobicContact CD1-CG2 4.49Å; F628-T673 VanDerWaalsContact CD1-OG1 3.25Å; F628-T673 WeakPolarHBondContact CD1-OG1 3.42Å; F628-T673 VanDerWaalsContact CE1-OG1 3.3Å; F628-T673 WeakPolarHBondContact CE1-OG1 3.28Å; F671-T673 HydrophobicContact CE1-CG2 4.21Å; T673-V675 HydrophobicContact CG2-CG1 4.14Å; T673-L707 HydrophobicContact CG2-CD1 4.16Å; T673-L739 HydrophobicContact CG2-CB 4Å; T673-L739 HydrophobicContact CG2-CD2 4.05Å; T673-L739 HydrophobicContact CG2-CG 4.39Å; T673-L739 PolarHBondContact N-O 3.37Å; T673-L739 PolarHBondContact O-N 2.92Å
674	F	89.3	Confident	89.9	Confident	55 Å²	55	45 Å²	45	24%	0.241	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	139.8	170.9	-61.7	-87.3	0	0	0	110.4	E623 R626 H629 G737 V738	E623-F674 HydrophobicContact CB-CB 4.13Å; E623-F674 HydrophobicContact CG-CB 4.23Å; E623-F674 PolarHBondContact N-O 3.23Å; R626-F674 HydrophobicContact CB-CD2 4.03Å; R626-F674 HydrophobicContact CG-CD2 4.19Å; H629-F674 AromaticContact CE1-CE2 3.82Å; F674-G737 CarbonylContact C-O 3.53Å; F674-G737 VanDerWaalsContact CA-O 3.22Å; F674-G737 WeakPolarHBondContact CA-O 3.39Å; F674-V738 HydrophobicContact CD1-CG2 3.96Å; F674-V738 HydrophobicContact CE1-CG2 3.73Å
675	V	88.6	Confident	89.9	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.03	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-133.2	148.7	-174.3	-67.9	0	0	0	0	110.6	I622 T673 A679 E680 G737 L739	I622-V675 HydrophobicContact CG1-CG1 4.41Å; T673-V675 HydrophobicContact CG2-CG1 4.14Å; V675-A679 HydrophobicContact CB-CB 3.78Å; V675-A679 HydrophobicContact CG1-CB 4.18Å; V675-E680 HydrophobicContact CG2-CG 3.89Å; V675-G737 PolarHBondContact N-O 3.35Å; V675-L739 HydrophobicContact CG1-CB 3.77Å; V675-L739 HydrophobicContact CG1-CD2 3.93Å; V675-L739 HydrophobicContact CG2-CB 4.13Å
676	D	88	Confident	89.9	Confident	57 Å²	57	42.9 Å²	42.9	31%	0.305	23%	0.226	S	C	.	.			trans	-77.8	174.7	171.8	69.5	32.1	0	0	0	112.2	N621 E678 A679 E680	N621-D676 WeakPolarHBondContact CA-OD2 3.45Å; N621-D676 VanDerWaalsContact CB-OD2 3.28Å; N621-D676 WeakPolarHBondContact CB-OD2 3.23Å; N621-D676 VanDerWaalsContact O-CG 3.25Å; N621-D676 PolarHBondContact O-N 3.46Å; D676-E678 VanDerWaalsContact C-N 3.3Å; D676-E678 PolarHBondContact O-N 2.83Å; D676-E678 PolarHBondContact OD1-N 2.7Å; D676-A679 PolarHBondContact O-N 3.47Å; D676-A679 WeakPolarHBondContact OD1-CB 3.26Å; D676-A679 PolarHBondContact OD1-N 2.86Å; D676-E680 WeakPolarHBondContact O-CG 3.33Å; D676-E680 PolarHBondContact O-N 2.81Å
677	T	86.7	Confident	89.6	Confident	86 Å²	86	43.8 Å²	43.8	53%	0.528	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-30	-177.9	-49.2	0	0	0	0	113.8	E680 Y681	T677-E680 WeakPolarHBondContact O-CB 3.26Å; T677-Y681 HydrophobicContact CG2-CE2 3.98Å; T677-Y681 WeakPolarHBondContact O-CD2 3.3Å; T677-Y681 PolarHBondContact O-N 2.7Å
678	E	87.2	Confident	89.6	Confident	131 Å²	131	45.3 Å²	45.3	61%	0.612	24%	0.238	S	C	*	.	H	α-helix	trans	-73.4	-43.8	177.4	-68.5	-172.5	172	0	0	111	N621 D676 E680 Y681 L682	N621-E678 WeakPolarHBondContact ND2-CB 3.42Å; N621-E678 PolarHBondContact ND2-OE2 2.82Å; D676-E678 VanDerWaalsContact C-N 3.3Å; D676-E678 PolarHBondContact O-N 2.83Å; D676-E678 PolarHBondContact OD1-N 2.7Å; E678-E680 VanDerWaalsContact C-N 3.26Å; E678-E680 PolarHBondContact O-N 2.98Å; E678-Y681 PolarHBondContact O-N 3.2Å; E678-L682 PolarHBondContact O-N 2.75Å
679	A	86.7	Confident	89.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-32.5	172.8	0	0	0	0	0	112	N621 V675 D676 Y681 L682 C683 W706	N621-A679 HydrophobicContact CB-CB 3.8Å; N621-A679 VanDerWaalsContact O-CB 3.26Å; N621-A679 WeakPolarHBondContact O-CB 3.41Å; V675-A679 HydrophobicContact CB-CB 3.78Å; V675-A679 HydrophobicContact CG1-CB 4.18Å; D676-A679 PolarHBondContact O-N 3.47Å; D676-A679 WeakPolarHBondContact OD1-CB 3.26Å; D676-A679 PolarHBondContact OD1-N 2.86Å; A679-Y681 PolarHBondContact O-N 2.87Å; A679-L682 WeakPolarHBondContact O-CB 3.37Å; A679-L682 PolarHBondContact O-N 2.87Å; A679-C683 PolarHBondContact O-N 2.83Å; A679-C683 PolarHBondContact O-SG 2.76Å; A679-W706 HydrophobicContact CB-CH2 3.97Å; A679-W706 HydrophobicContact CB-CZ2 3.85Å
680	E	86.5	Confident	89.1	Confident	27 Å²	27	48.1 Å²	48.1	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-57	-46.6	172.2	-74.7	-173.6	130.4	0	0	112	V675 D676 T677 E678 L682 C683 D684 R733 G737	V675-E680 HydrophobicContact CG2-CG 3.89Å; D676-E680 WeakPolarHBondContact O-CG 3.33Å; D676-E680 PolarHBondContact O-N 2.81Å; T677-E680 WeakPolarHBondContact O-CB 3.26Å; E678-E680 VanDerWaalsContact C-N 3.26Å; E678-E680 PolarHBondContact O-N 2.98Å; E680-L682 VanDerWaalsContact C-N 3.32Å; E680-L682 PolarHBondContact O-N 2.83Å; E680-C683 WeakPolarHBondContact O-CB 3.12Å; E680-C683 PolarHBondContact O-N 3.41Å; E680-C683 VanDerWaalsContact O-N 3.15Å; E680-D684 PolarHBondContact O-N 3.18Å; E680-R733 IonicContact OE1-NH1 3.28Å; E680-R733 PolarHBondContact OE1-NH1 2.75Å; E680-R733 IonicContact OE2-NH1 3.79Å; E680-G737 PolarHBondContact OE1-N 3.26Å
681	Y	88.5	Confident	88.8	Confident	167 Å²	167	53.1 Å²	53.1	66%	0.655	27%	0.274	S	S	*	.	H	α-helix	trans	-63.9	-37	177.2	-68	-63.1	0	0	0	112.8	T677 E678 A679 C683 D684 G685	T677-Y681 HydrophobicContact CG2-CE2 3.98Å; T677-Y681 WeakPolarHBondContact O-CD2 3.3Å; T677-Y681 PolarHBondContact O-N 2.7Å; E678-Y681 PolarHBondContact O-N 3.2Å; A679-Y681 PolarHBondContact O-N 2.87Å; Y681-C683 VanDerWaalsContact C-N 3.32Å; Y681-D684 PolarHBondContact O-N 3.43Å; Y681-G685 PolarHBondContact O-N 2.63Å
682	L	87.8	Confident	88.7	Confident	78 Å²	78	56.8 Å²	56.8	41%	0.408	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-42.2	173.5	-70.7	174.1	0	0	0	111.1	E678 A679 E680 G685 F686 W706	E678-L682 PolarHBondContact O-N 2.75Å; A679-L682 WeakPolarHBondContact O-CB 3.37Å; A679-L682 PolarHBondContact O-N 2.87Å; E680-L682 VanDerWaalsContact C-N 3.32Å; E680-L682 PolarHBondContact O-N 2.83Å; L682-G685 PolarHBondContact O-N 3.27Å; L682-F686 HydrophobicContact CB-CD2 4.48Å; L682-F686 HydrophobicContact CB-CE2 4.13Å; L682-F686 WeakPolarHBondContact O-CD2 3.18Å; L682-F686 WeakPolarHBondContact O-CG 3.25Å; L682-F686 PolarHBondContact O-N 2.86Å; L682-W706 HydrophobicContact CB-CH2 4.12Å; L682-W706 HydrophobicContact CB-CZ2 4.35Å; L682-W706 HydrophobicContact CB-CZ3 4.45Å; L682-W706 HydrophobicContact CD1-CZ2 3.94Å
683	C	86.5	Confident	88.6	Confident	9 Å²	9	58.8 Å²	58.8	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-62.2	-46.8	178	-64.5	0	0	0	0	111.9	A679 E680 Y681 G685 F686 S687 W706 L739	A679-C683 PolarHBondContact O-N 2.83Å; A679-C683 PolarHBondContact O-SG 2.76Å; E680-C683 WeakPolarHBondContact O-CB 3.12Å; E680-C683 PolarHBondContact O-N 3.41Å; E680-C683 VanDerWaalsContact O-N 3.15Å; Y681-C683 VanDerWaalsContact C-N 3.32Å; C683-G685 VanDerWaalsContact C-N 3.28Å; C683-G685 PolarHBondContact O-N 3.31Å; C683-F686 PolarHBondContact O-N 2.82Å; C683-F686 VanDerWaalsContact O-N 3.14Å; C683-S687 PolarHBondContact O-N 2.82Å; C683-S687 PolarHBondContact O-OG 3.09Å; C683-W706 VanDerWaalsContact SG-CH2 3.55Å; C683-W706 VanDerWaalsContact SG-CZ3 3.55Å; C683-L739 HydrophobicContact CB-CD1 3.92Å; C683-L739 WeakPolarHBondContact SG-CD1 3.46Å; C683-L739 VanDerWaalsContact SG-CD2 3.59Å
684	D	86.7	Confident	88.3	Confident	71 Å²	71	61.6 Å²	61.6	38%	0.38	31%	0.312	S	S	.	.	H	α-helix	trans	-58.9	-42.2	176.8	-72	-13.8	0	0	0	110.8	E680 Y681 S687 L688 R733	E680-D684 PolarHBondContact O-N 3.18Å; Y681-D684 PolarHBondContact O-N 3.43Å; D684-S687 PolarHBondContact O-N 2.84Å; D684-L688 PolarHBondContact O-N 3.05Å; D684-R733 IonicContact OD2-NH2 3.87Å
685	G	90.6	Very high	88.3	Confident	41 Å²	41	66.7 Å²	66.7	42%	0.423	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-42.6	174.2	0	0	0	0	0	113.4	Y681 L682 C683 L689	Y681-G685 PolarHBondContact O-N 2.63Å; L682-G685 PolarHBondContact O-N 3.27Å; C683-G685 VanDerWaalsContact C-N 3.28Å; C683-G685 PolarHBondContact O-N 3.31Å; G685-L689 WeakPolarHBondContact O-CB 3.26Å; G685-L689 PolarHBondContact O-N 2.9Å
686	F	90.5	Very high	88.4	Confident	45 Å²	45	72.7 Å²	72.7	20%	0.197	36%	0.361	C	S	.	.	H	α-helix	trans	-68.4	-38.1	176.3	-69.8	-50.9	0	0	0	112.9	L682 C683 L689 Q690 A702 W706 I730	L682-F686 HydrophobicContact CB-CD2 4.48Å; L682-F686 HydrophobicContact CB-CE2 4.13Å; L682-F686 WeakPolarHBondContact O-CD2 3.18Å; L682-F686 WeakPolarHBondContact O-CG 3.25Å; L682-F686 PolarHBondContact O-N 2.86Å; C683-F686 PolarHBondContact O-N 2.82Å; C683-F686 VanDerWaalsContact O-N 3.14Å; F686-L689 PolarHBondContact O-N 2.88Å; F686-Q690 WeakPolarHBondContact O-CB 3.44Å; F686-Q690 PolarHBondContact O-N 2.94Å; F686-A702 HydrophobicContact CB-CB 4.17Å; F686-A702 HydrophobicContact CD1-CB 4.28Å; F686-A702 VanDerWaalsContact O-CB 3.24Å; F686-A702 WeakPolarHBondContact O-CB 3.2Å; F686-W706 AromaticContact CD2-CE3 3.74Å; F686-W706 HydrophobicContact CD2-CE3 3.74Å; F686-W706 AromaticContact CD2-CZ3 3.95Å; F686-W706 HydrophobicContact CD2-CZ3 3.95Å; F686-W706 HydrophobicContact CE2-CB 4.27Å; F686-W706 AromaticContact CE2-CD2 3.8Å; F686-W706 HydrophobicContact CE2-CD2 3.8Å; F686-W706 AromaticContact CE2-CE3 3.29Å; F686-W706 HydrophobicContact CE2-CE3 3.29Å; F686-W706 HydrophobicContact CE2-CG 4.24Å; F686-W706 AromaticContact CE2-CZ3 3.84Å; F686-W706 HydrophobicContact CE2-CZ3 3.84Å; F686-W706 HydrophobicContact CZ-CB 4.24Å; F686-W706 HydrophobicContact CZ-CE3 4.33Å; F686-I730 HydrophobicContact CB-CD1 3.68Å; F686-I730 HydrophobicContact CD2-CD1 4.1Å; F686-I730 HydrophobicContact CG-CD1 4.21Å
687	S	87.1	Confident	88.3	Confident	20 Å²	20	75.7 Å²	75.7	14%	0.14	38%	0.377	C	S	.	.	H	α-helix	trans	-61.9	-46.3	174.7	-74.4	0	0	0	0	111.2	C683 D684 L689 Q690 E691 I730	C683-S687 PolarHBondContact O-N 2.82Å; C683-S687 PolarHBondContact O-OG 3.09Å; D684-S687 PolarHBondContact O-N 2.84Å; S687-L689 VanDerWaalsContact C-N 3.34Å; S687-L689 PolarHBondContact O-N 2.82Å; S687-Q690 WeakPolarHBondContact O-CB 3.43Å; S687-Q690 PolarHBondContact O-N 2.78Å; S687-E691 WeakPolarHBondContact O-CG 3.48Å; S687-E691 PolarHBondContact O-N 3.34Å; S687-I730 WeakPolarHBondContact OG-CG2 3.49Å; S687-I730 PolarHBondContact OG-O 3.24Å
688	L	90	Very high	88.1	Confident	106 Å²	106	73.8 Å²	73.8	56%	0.555	37%	0.367	S	S	*	.	H	α-helix	trans	-60.4	-43.2	174.6	-177.5	68.8	0	0	0	112	D684 Q690 E691 L692	D684-L688 PolarHBondContact O-N 3.05Å; L688-Q690 VanDerWaalsContact C-N 3.31Å; L688-Q690 PolarHBondContact O-N 2.82Å; L688-E691 PolarHBondContact O-N 3.34Å; L688-L692 WeakPolarHBondContact O-CG 3.42Å; L688-L692 PolarHBondContact O-N 3.14Å
689	L	91.2	Very high	87.6	Confident	59 Å²	59	75.1 Å²	75.1	31%	0.309	38%	0.375	S	S	.	.	H	α-helix	trans	-64.1	-38.1	177.8	-174.8	62.6	0	0	0	111.9	G685 F686 S687 L692 Y693 A702	G685-L689 WeakPolarHBondContact O-CB 3.26Å; G685-L689 PolarHBondContact O-N 2.9Å; F686-L689 PolarHBondContact O-N 2.88Å; S687-L689 VanDerWaalsContact C-N 3.34Å; S687-L689 PolarHBondContact O-N 2.82Å; L689-L692 WeakPolarHBondContact O-CB 3.16Å; L689-L692 PolarHBondContact O-N 2.85Å; L689-Y693 HydrophobicContact CD1-CD1 4.48Å; L689-Y693 HydrophobicContact CD1-CE1 3.81Å; L689-Y693 HydrophobicContact CD1-CE2 4.41Å; L689-Y693 HydrophobicContact CD2-CE2 4.08Å; L689-Y693 HydrophobicContact CG-CD2 4.39Å; L689-Y693 HydrophobicContact CG-CE1 4.1Å; L689-Y693 HydrophobicContact CG-CE2 3.78Å; L689-Y693 PolarHBondContact O-N 2.83Å; L689-A702 HydrophobicContact CB-CB 4.2Å; L689-A702 HydrophobicContact CD2-CB 4.21Å; L689-A702 HydrophobicContact CG-CB 4.28Å
690	Q	88.9	Confident	87.5	Confident	13 Å²	13	79.9 Å²	79.9	6%	0.061	40%	0.4	C	S	.	.	H	α-helix	trans	-63.5	-44.1	175.5	-172.2	60.6	41.8	0	0	111.3	F686 S687 L688 L692 Y693 E694 L700 A702 R729	F686-Q690 WeakPolarHBondContact O-CB 3.44Å; F686-Q690 PolarHBondContact O-N 2.94Å; S687-Q690 WeakPolarHBondContact O-CB 3.43Å; S687-Q690 PolarHBondContact O-N 2.78Å; L688-Q690 VanDerWaalsContact C-N 3.31Å; L688-Q690 PolarHBondContact O-N 2.82Å; Q690-L692 VanDerWaalsContact C-N 3.27Å; Q690-L692 PolarHBondContact O-N 2.69Å; Q690-Y693 PolarHBondContact O-N 2.91Å; Q690-E694 PolarHBondContact NE2-OE1 3.47Å; Q690-E694 WeakPolarHBondContact O-CG 3.39Å; Q690-E694 PolarHBondContact O-N 3.14Å; Q690-L700 PolarHBondContact NE2-O 3.18Å; Q690-L700 PolarHBondContact OE1-O 2.85Å; Q690-A702 HydrophobicContact CB-CB 4.03Å; Q690-R729 HydrophobicContact CG-CB 3.85Å
691	E	88	Confident	87.5	Confident	125 Å²	125	79.9 Å²	79.9	58%	0.584	40%	0.402	S	S	*	.	H	α-helix	trans	-59.4	-39.3	174.7	-71.2	179.6	-175.9	0	0	112	S687 L688 E694 K695	S687-E691 WeakPolarHBondContact O-CG 3.48Å; S687-E691 PolarHBondContact O-N 3.34Å; L688-E691 PolarHBondContact O-N 3.34Å; E691-E694 PolarHBondContact O-N 3.2Å; E691-K695 VanDerWaalsContact O-CB 3.24Å; E691-K695 WeakPolarHBondContact O-CB 3.45Å; E691-K695 PolarHBondContact O-N 3.23Å
692	L	90.7	Very high	87.4	Confident	78 Å²	78	72.2 Å²	72.2	41%	0.408	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-46.4	174.7	-70.1	173.1	0	0	0	111.7	L688 L689 Q690 E694 K695 H696	L688-L692 WeakPolarHBondContact O-CG 3.42Å; L688-L692 PolarHBondContact O-N 3.14Å; L689-L692 WeakPolarHBondContact O-CB 3.16Å; L689-L692 PolarHBondContact O-N 2.85Å; Q690-L692 VanDerWaalsContact C-N 3.27Å; Q690-L692 PolarHBondContact O-N 2.69Å; L692-E694 VanDerWaalsContact C-N 3.3Å; L692-E694 PolarHBondContact O-N 3.08Å; L692-K695 PolarHBondContact O-N 3.31Å; L692-H696 WeakPolarHBondContact O-CB 3.43Å; L692-H696 PolarHBondContact O-CD2 2.72Å; L692-H696 PolarHBondContact O-N 3.03Å
693	Y	90	Very high	87.4	Confident	60 Å²	60	68.9 Å²	68.9	24%	0.235	36%	0.358	C	S	.	.	H	α-helix	trans	-57.7	-44.4	174.8	-68.4	-21.3	0	0	0	111.7	L689 Q690 H696 N697 C698 L700 A702	L689-Y693 HydrophobicContact CD1-CD1 4.48Å; L689-Y693 HydrophobicContact CD1-CE1 3.81Å; L689-Y693 HydrophobicContact CD1-CE2 4.41Å; L689-Y693 HydrophobicContact CD2-CE2 4.08Å; L689-Y693 HydrophobicContact CG-CD2 4.39Å; L689-Y693 HydrophobicContact CG-CE1 4.1Å; L689-Y693 HydrophobicContact CG-CE2 3.78Å; L689-Y693 PolarHBondContact O-N 2.83Å; Q690-Y693 PolarHBondContact O-N 2.91Å; Y693-H696 CarbonylContact O-C 3.57Å; Y693-H696 PolarHBondContact O-N 3.26Å; Y693-N697 PolarHBondContact O-N 2.85Å; Y693-C698 HydrophobicContact CD1-CB 4.13Å; Y693-C698 HydrophobicContact CG-CB 4.22Å; Y693-C698 PolarHBondContact O-N 3Å; Y693-L700 HydrophobicContact CD2-CB 3.74Å; Y693-L700 HydrophobicContact CE1-CD1 4.28Å; Y693-L700 HydrophobicContact CE2-CB 3.8Å; Y693-L700 HydrophobicContact CG-CB 4.21Å; Y693-A702 HydrophobicContact CD2-CB 4.48Å; Y693-A702 HydrophobicContact CE2-CB 4.22Å
694	E	85.6	Confident	87.3	Confident	61 Å²	61	70.7 Å²	70.7	29%	0.285	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-45.4	178.5	-73.4	176.1	-170.9	0	0	112.2	Q690 E691 L692 H696 N697	Q690-E694 PolarHBondContact NE2-OE1 3.47Å; Q690-E694 WeakPolarHBondContact O-CG 3.39Å; Q690-E694 PolarHBondContact O-N 3.14Å; E691-E694 PolarHBondContact O-N 3.2Å; L692-E694 VanDerWaalsContact C-N 3.3Å; L692-E694 PolarHBondContact O-N 3.08Å; E694-H696 PolarHBondContact O-N 3.17Å; E694-N697 PolarHBondContact O-N 2.81Å; E694-N697 VanDerWaalsContact O-N 3.12Å
695	K	89.6	Confident	87.3	Confident	162 Å²	162	69.2 Å²	69.2	70%	0.704	37%	0.368	S	S	*	.	H	α-helix	trans	-58.5	-32.9	175.6	-176.1	178.3	179.9	-179.1	0	112.5	E691 L692	E691-K695 VanDerWaalsContact O-CB 3.24Å; E691-K695 WeakPolarHBondContact O-CB 3.45Å; E691-K695 PolarHBondContact O-N 3.23Å; L692-K695 PolarHBondContact O-N 3.31Å
696	H	90.8	Very high	87.1	Confident	131 Å²	131	68.5 Å²	68.5	61%	0.606	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	10.1	179.7	-71.3	-73.7	0	0	0	114.1	L692 Y693 E694 C698	L692-H696 WeakPolarHBondContact O-CB 3.43Å; L692-H696 PolarHBondContact O-CD2 2.72Å; L692-H696 PolarHBondContact O-N 3.03Å; Y693-H696 CarbonylContact O-C 3.57Å; Y693-H696 PolarHBondContact O-N 3.26Å; E694-H696 PolarHBondContact O-N 3.17Å; H696-C698 PolarHBondContact O-N 2.8Å
697	N	85.1	Confident	87	Confident	119 Å²	119	66.3 Å²	66.3	64%	0.636	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	31.1	-177.3	-71	-26.3	0	0	0	114.3	Y693 E694	Y693-N697 PolarHBondContact O-N 2.85Å; E694-N697 PolarHBondContact O-N 2.81Å; E694-N697 VanDerWaalsContact O-N 3.12Å
698	C	81.8	Confident	87.2	Confident	46 Å²	46	65.4 Å²	65.4	31%	0.311	34%	0.336	S	S	.	.			trans	-75.8	127.8	170.8	-56.2	0	0	0	0	109.5	Y693 H696 L700	Y693-C698 HydrophobicContact CD1-CB 4.13Å; Y693-C698 HydrophobicContact CG-CB 4.22Å; Y693-C698 PolarHBondContact O-N 3Å; H696-C698 PolarHBondContact O-N 2.8Å; C698-L700 HydrophobicContact CB-CD1 4.46Å; C698-L700 HydrophobicContact CB-CG 4.47Å; C698-L700 PolarHBondContact O-N 2.79Å
699	M	78.2	Confident	87.3	Confident	160 Å²	160	64.4 Å²	64.4	79%	0.788	33%	0.328	S	S	*	.			trans	-83.7	58.8	172.6	-57.2	-163.1	-45.1	0	0	110.4
700	L	84.2	Confident	87.4	Confident	99 Å²	99	62.6 Å²	62.6	52%	0.518	32%	0.32	S	S	.	.			trans	-124.5	145.6	179.8	-65.2	175.3	0	0	0	109.9	Q690 Y693 C698	Q690-L700 PolarHBondContact NE2-O 3.18Å; Q690-L700 PolarHBondContact OE1-O 2.85Å; Y693-L700 HydrophobicContact CD2-CB 3.74Å; Y693-L700 HydrophobicContact CE1-CD1 4.28Å; Y693-L700 HydrophobicContact CE2-CB 3.8Å; Y693-L700 HydrophobicContact CG-CB 4.21Å; C698-L700 HydrophobicContact CB-CD1 4.46Å; C698-L700 HydrophobicContact CB-CG 4.47Å; C698-L700 PolarHBondContact O-N 2.79Å
701	T	85.6	Confident	87.8	Confident	28 Å²	28	62 Å²	62	17%	0.172	32%	0.317	C	S	.	.			trans	-106.7	116.5	174.3	-65.5	0	0	0	0	109.3	N704 E727 G728	T701-N704 HydrophobicContact CG2-CB 4.18Å; T701-E727 WeakPolarHBondContact OG1-CA 3.15Å; T701-G728 VanDerWaalsContact CG2-O 3.25Å; T701-G728 WeakPolarHBondContact CG2-O 3.35Å; T701-G728 PolarHBondContact OG1-N 2.89Å; T701-G728 PolarHBondContact OG1-O 3.25Å
702	A	87.7	Confident	88.2	Confident	5 Å²	5	57.7 Å²	57.7	4%	0.041	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	144	174.9	0	0	0	0	0	111.1	F686 L689 Q690 Y693 N704	F686-A702 HydrophobicContact CB-CB 4.17Å; F686-A702 HydrophobicContact CD1-CB 4.28Å; F686-A702 VanDerWaalsContact O-CB 3.24Å; F686-A702 WeakPolarHBondContact O-CB 3.2Å; L689-A702 HydrophobicContact CB-CB 4.2Å; L689-A702 HydrophobicContact CD2-CB 4.21Å; L689-A702 HydrophobicContact CG-CB 4.28Å; Q690-A702 HydrophobicContact CB-CB 4.03Å; Y693-A702 HydrophobicContact CD2-CB 4.48Å; Y693-A702 HydrophobicContact CE2-CB 4.22Å; A702-N704 PolarHBondContact O-N 3.16Å
703	G	86.3	Confident	88.4	Confident	9 Å²	9	54 Å²	54	9%	0.093	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	13.3	177.1	0	0	0	0	0	115.5	G705 W706 L707	G703-G705 VanDerWaalsContact C-N 3.34Å; G703-G705 PolarHBondContact O-N 2.97Å; G703-W706 PolarHBondContact O-N 3.11Å; G703-W706 VanDerWaalsContact O-N 3.11Å; G703-L707 PolarHBondContact O-N 3.4Å
704	N	85.8	Confident	88.6	Confident	47 Å²	47	52.9 Å²	52.9	25%	0.251	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-38.9	-175.4	-149.7	40.2	0	0	0	113.6	T701 A702 W706 I708 K709 T726 K741	T701-N704 HydrophobicContact CG2-CB 4.18Å; A702-N704 PolarHBondContact O-N 3.16Å; N704-W706 VanDerWaalsContact C-N 3.32Å; N704-I708 CarbonylContact O-C 3.57Å; N704-I708 VanDerWaalsContact O-C 3.29Å; N704-I708 VanDerWaalsContact O-O 3.11Å; N704-I708 PolarHBondContact OD1-O 3.37Å; N704-K709 PolarHBondContact ND2-O 3.03Å; N704-K709 WeakPolarHBondContact O-CG 3.08Å; N704-K709 PolarHBondContact O-N 3.29Å; N704-T726 PolarHBondContact ND2-O 2.87Å; N704-K741 PolarHBondContact OD1-NZ 2.76Å
705	G	85.7	Confident	88.9	Confident	40 Å²	40	50.8 Å²	50.8	41%	0.412	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-23.1	176	0	0	0	0	0	114.2	G617 D618 G703	G617-G705 CarbonylContact C-O 3.45Å; G617-G705 WeakPolarHBondContact CA-O 3.46Å; D618-G705 PolarHBondContact N-O 3.21Å; G703-G705 VanDerWaalsContact C-N 3.34Å; G703-G705 PolarHBondContact O-N 2.97Å
706	W	87.2	Confident	89	Confident	25 Å²	25	43.7 Å²	43.7	10%	0.095	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-47.4	-174.7	177.5	63.3	0	0	0	113.1	G617 D618 M619 H620 A679 L682 C683 F686 G703 N704 L739	G617-W706 CarbonylContact C-O 3.56Å; G617-W706 WeakPolarHBondContact CA-O 3.46Å; D618-W706 PolarHBondContact N-O 3.19Å; M619-W706 WeakPolarHBondContact CA-O 3.29Å; M619-W706 WeakPolarHBondContact CG-O 3.33Å; M619-W706 PolarHBondContact N-O 3.19Å; H620-W706 PolarHBondContact O-NE1 2.83Å; A679-W706 HydrophobicContact CB-CH2 3.97Å; A679-W706 HydrophobicContact CB-CZ2 3.85Å; L682-W706 HydrophobicContact CB-CH2 4.12Å; L682-W706 HydrophobicContact CB-CZ2 4.35Å; L682-W706 HydrophobicContact CB-CZ3 4.45Å; L682-W706 HydrophobicContact CD1-CZ2 3.94Å; C683-W706 VanDerWaalsContact SG-CH2 3.55Å; C683-W706 VanDerWaalsContact SG-CZ3 3.55Å; F686-W706 AromaticContact CD2-CE3 3.74Å; F686-W706 HydrophobicContact CD2-CE3 3.74Å; F686-W706 AromaticContact CD2-CZ3 3.95Å; F686-W706 HydrophobicContact CD2-CZ3 3.95Å; F686-W706 HydrophobicContact CE2-CB 4.27Å; F686-W706 AromaticContact CE2-CD2 3.8Å; F686-W706 HydrophobicContact CE2-CD2 3.8Å; F686-W706 AromaticContact CE2-CE3 3.29Å; F686-W706 HydrophobicContact CE2-CE3 3.29Å; F686-W706 HydrophobicContact CE2-CG 4.24Å; F686-W706 AromaticContact CE2-CZ3 3.84Å; F686-W706 HydrophobicContact CE2-CZ3 3.84Å; F686-W706 HydrophobicContact CZ-CB 4.24Å; F686-W706 HydrophobicContact CZ-CE3 4.33Å; G703-W706 PolarHBondContact O-N 3.11Å; G703-W706 VanDerWaalsContact O-N 3.11Å; N704-W706 VanDerWaalsContact C-N 3.32Å; W706-L739 HydrophobicContact CZ3-CD2 4.29Å
707	L	87.3	Confident	88.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-94.3	-73.5	-175.4	-169.6	70.4	0	0	0	113.5	G617 M619 I622 F671 T673 G703 L739 K741	G617-L707 PolarHBondContact N-O 2.85Å; M619-L707 HydrophobicContact CE-CD1 4.17Å; M619-L707 WeakPolarHBondContact CG-O 3.25Å; I622-L707 HydrophobicContact CD1-CD1 3.87Å; F671-L707 HydrophobicContact CD1-CD2 4.48Å; T673-L707 HydrophobicContact CG2-CD1 4.16Å; G703-L707 PolarHBondContact O-N 3.4Å; L707-L739 HydrophobicContact CD1-CD2 3.63Å; L707-L739 HydrophobicContact CD2-CD2 3.7Å; L707-L739 HydrophobicContact CD2-CG 4.3Å; L707-L739 HydrophobicContact CG-CD2 4.27Å; L707-K741 HydrophobicContact CD2-CB 3.6Å; L707-K741 HydrophobicContact CD2-CD 3.73Å; L707-K741 HydrophobicContact CD2-CG 4.25Å
708	I	91.3	Very high	89.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126	-178.9	-71.3	169.2	0	0	0	107.7	V614 L616 F671 N704 I711 K741 M743	V614-I708 HydrophobicContact CG1-CD1 4.08Å; V614-I708 HydrophobicContact CG1-CG1 4.07Å; V614-I708 HydrophobicContact CG1-CG2 4.17Å; L616-I708 HydrophobicContact CD2-CG1 4.4Å; F671-I708 HydrophobicContact CB-CD1 3.49Å; F671-I708 VanDerWaalsContact CB-CD1 3.49Å; F671-I708 HydrophobicContact CD1-CD1 3.32Å; F671-I708 HydrophobicContact CD1-CG1 4.36Å; F671-I708 HydrophobicContact CD2-CD1 3.37Å; F671-I708 HydrophobicContact CE1-CD1 3.72Å; F671-I708 HydrophobicContact CE1-CG1 4.38Å; F671-I708 HydrophobicContact CE2-CD1 3.76Å; F671-I708 HydrophobicContact CG-CD1 3.1Å; F671-I708 HydrophobicContact CG-CG1 4.44Å; F671-I708 HydrophobicContact CZ-CD1 3.91Å; F671-I708 HydrophobicContact CZ-CG1 4.5Å; N704-I708 CarbonylContact O-C 3.57Å; N704-I708 VanDerWaalsContact O-C 3.29Å; N704-I708 VanDerWaalsContact O-O 3.11Å; N704-I708 PolarHBondContact OD1-O 3.37Å; I708-I711 HydrophobicContact CD1-CD1 4.47Å; I708-I711 HydrophobicContact CG2-CD1 4.41Å; I708-I711 HydrophobicContact CG2-CG1 3.86Å; I708-K741 PolarHBondContact O-NZ 3.02Å; I708-M743 HydrophobicContact CB-SD 4.4Å; I708-M743 HydrophobicContact CG2-CE 4.11Å; I708-M743 HydrophobicContact CG2-SD 4.03Å
709	K	92.1	Very high	89.7	Confident	85 Å²	85	34.6 Å²	34.6	37%	0.37	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-44.6	176.7	-69	172.3	178.4	150.6	0	111.5	T615 D618 N704	T615-K709 HydrophobicContact CG2-CB 4.06Å; T615-K709 HydrophobicContact CG2-CD 4.23Å; T615-K709 PolarHBondContact O-N 3.22Å; D618-K709 IonicContact OD1-NZ 3.66Å; N704-K709 PolarHBondContact ND2-O 3.03Å; N704-K709 WeakPolarHBondContact O-CG 3.08Å; N704-K709 PolarHBondContact O-N 3.29Å
710	S	94.5	Very high	90.3	Very high	22 Å²	22	27.3 Å²	27.3	15%	0.154	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	157.9	177.1	78.1	0	0	0	0	112.9	T615 F725	T615-S710 PolarHBondContact N-O 3.17Å; T615-S710 PolarHBondContact O-N 2.77Å; T615-S710 PolarHBondContact OG1-OG 2.81Å; S710-F725 CarbonylContact C-O 3.58Å; S710-F725 WeakPolarHBondContact CA-O 3.47Å
711	I	95.9	Very high	90.6	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135	165.7	-51.8	-176.6	0	0	0	107.7	S613 V614 V669 I708 I713 F725 M743	S613-I711 CarbonylContact O-C 3.56Å; S613-I711 WeakPolarHBondContact O-CA 3.46Å; V614-I711 HydrophobicContact CG1-CG1 4.16Å; V614-I711 HydrophobicContact CG2-CD1 4.39Å; V614-I711 HydrophobicContact CG2-CG1 4.26Å; V614-I711 HydrophobicContact CG2-CG2 4.16Å; V669-I711 HydrophobicContact CB-CD1 4.25Å; V669-I711 HydrophobicContact CG1-CD1 3.78Å; I708-I711 HydrophobicContact CD1-CD1 4.47Å; I708-I711 HydrophobicContact CG2-CD1 4.41Å; I708-I711 HydrophobicContact CG2-CG1 3.86Å; I711-I713 HydrophobicContact CG2-CD1 3.96Å; I711-I713 HydrophobicContact CG2-CG1 3.74Å; I711-F725 HydrophobicContact CB-CB 4.13Å; I711-F725 HydrophobicContact CB-CD2 4.25Å; I711-F725 HydrophobicContact CG2-CD2 4.49Å; I711-F725 PolarHBondContact N-O 2.95Å; I711-F725 WeakPolarHBondContact O-CD2 3.47Å; I711-F725 PolarHBondContact O-N 2.87Å; I711-M743 HydrophobicContact CD1-CB 4.27Å; I711-M743 HydrophobicContact CD1-CG 3.76Å; I711-M743 HydrophobicContact CG1-CE 4.45Å; I711-M743 HydrophobicContact CG1-CG 4.31Å
712	V	96.1	Very high	91	Very high	34 Å²	34	28.3 Å²	28.3	21%	0.206	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.5	172.7	-178.2	0	0	0	0	108.7	G612 S613 Q722 Y723 V724	G612-V712 CarbonylContact C-O 3.55Å; G612-V712 VanDerWaalsContact CA-O 3.26Å; G612-V712 WeakPolarHBondContact CA-O 3.17Å; S613-V712 PolarHBondContact N-O 2.97Å; S613-V712 PolarHBondContact O-N 2.81Å; V712-Q722 HydrophobicContact CG1-CB 3.96Å; V712-Q722 HydrophobicContact CG1-CG 4.05Å; V712-Y723 CarbonylContact C-O 3.52Å; V712-Y723 VanDerWaalsContact CA-O 3.32Å; V712-Y723 WeakPolarHBondContact CA-O 3.4Å; V712-V724 HydrophobicContact CG2-CG2 4.47Å
713	I	96.5	Very high	91.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.7	-177.3	-55	-174.6	0	0	0	110.8	Y610 Y611 L632 F656 L666 V669 I711 Q722 Y723 F725	Y610-I713 HydrophobicContact CD1-CG2 3.91Å; Y611-I713 CarbonylContact O-C 3.59Å; Y611-I713 WeakPolarHBondContact O-CA 3.07Å; L632-I713 HydrophobicContact CD1-CD1 4.24Å; L632-I713 HydrophobicContact CD1-CG2 4.45Å; L632-I713 HydrophobicContact CD2-CD1 3.36Å; L632-I713 HydrophobicContact CG-CD1 4.41Å; F656-I713 HydrophobicContact CZ-CD1 4.32Å; L666-I713 HydrophobicContact CD1-CB 3.95Å; L666-I713 HydrophobicContact CD1-CD1 4.26Å; L666-I713 HydrophobicContact CD1-CG2 3.63Å; V669-I713 HydrophobicContact CG2-CD1 3.6Å; I711-I713 HydrophobicContact CG2-CD1 3.96Å; I711-I713 HydrophobicContact CG2-CG1 3.74Å; I713-Q722 CarbonylContact O-C 3.48Å; I713-Q722 WeakPolarHBondContact O-CA 3.31Å; I713-Y723 PolarHBondContact N-O 2.78Å; I713-Y723 WeakPolarHBondContact O-CD2 3.23Å; I713-Y723 PolarHBondContact O-N 2.84Å; I713-F725 HydrophobicContact CB-CE2 4.36Å; I713-F725 HydrophobicContact CD1-CE2 4.09Å; I713-F725 HydrophobicContact CG1-CE2 4.14Å
714	R	93.8	Very high	91.9	Very high	38 Å²	38	29.8 Å²	29.8	14%	0.143	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.7	170.4	-60.2	-174.5	-165	135.5	5.8	109.9	Y610 Y611 S716 Q722 Q751	Y610-R714 CarbonylContact C-O 3.29Å; Y610-R714 VanDerWaalsContact CA-O 3.26Å; Y610-R714 WeakPolarHBondContact CA-O 3.39Å; Y611-R714 PolarHBondContact N-O 3.48Å; Y611-R714 PolarHBondContact O-N 3.3Å; R714-S716 PolarHBondContact O-N 2.78Å; R714-Q722 HydrophobicContact CG-CB 3.59Å; R714-Q722 VanDerWaalsContact NE-OE1 3.14Å; R714-Q751 VanDerWaalsContact NH1-CD 3.29Å; R714-Q751 VanDerWaalsContact NH1-NE2 3.11Å
715	D	92.5	Very high	92.3	Very high	16 Å²	16	27.5 Å²	27.5	9%	0.086	14%	0.143	C	C	.	.	S	Bend	trans	-59.7	-39.9	172.6	-65	-56.7	0	0	0	110.9	Y608 K609 Y610 Y723	Y608-D715 VanDerWaalsContact CB-O 3.28Å; Y608-D715 WeakPolarHBondContact CB-O 3.44Å; Y608-D715 HydrophobicContact CD2-CB 3.92Å; Y608-D715 HydrophobicContact CE2-CB 4.1Å; Y608-D715 HydrophobicContact CG-CB 4.23Å; K609-D715 CarbonylContact C-O 3.33Å; Y610-D715 WeakPolarHBondContact CA-O 3.41Å; Y610-D715 HydrophobicContact CE1-CB 4.15Å; Y610-D715 WeakPolarHBondContact CE1-OD1 3.35Å; Y610-D715 PolarHBondContact N-O 3.39Å; Y610-D715 PolarHBondContact OH-OD1 3.43Å; D715-Y723 PolarHBondContact OD2-OH 3.19Å
716	S	91.4	Very high	92.7	Very high	13 Å²	13	28.3 Å²	28.3	9%	0.091	14%	0.14	C	C	.	.			trans	-162.6	159.7	-177.8	172.4	0	0	0	0	108.8	R714 H718 S719	R714-S716 PolarHBondContact O-N 2.78Å; S716-H718 PolarHBondContact O-N 3.19Å; S716-H718 PolarHBondContact OG-N 2.8Å; S716-H718 VanDerWaalsContact OG-N 3.12Å; S716-S719 VanDerWaalsContact O-CB 3.25Å; S716-S719 WeakPolarHBondContact O-CB 3.42Å; S716-S719 PolarHBondContact O-N 3.36Å
717	L	89.1	Confident	92.8	Very high	88 Å²	88	31.4 Å²	31.4	46%	0.461	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-18.2	167.9	-61.5	177.3	0	0	0	112.5	V439 S719	V439-L717 HydrophobicContact CG1-CB 3.55Å; V439-L717 HydrophobicContact CG1-CD1 4.48Å; V439-L717 WeakPolarHBondContact CG2-O 3.49Å; L717-S719 VanDerWaalsContact C-N 3.34Å
718	H	91.9	Very high	92.8	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.037	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	3.4	170.1	-61	-85.7	0	0	0	113.4	R341 F410 W433 V439 D440 R445 S716	R341-H718 PolarHBondContact NH1-O 2.8Å; R341-H718 VanDerWaalsContact NH1-O 3.14Å; R341-H718 PolarHBondContact NH2-O 3.05Å; F410-H718 HydrophobicContact CE2-CB 4.46Å; W433-H718 AromaticContact CD1-ND1 3.98Å; W433-H718 PolarHBondContact N-ND1 3.07Å; V439-H718 HydrophobicContact CG2-CB 4.42Å; V439-H718 WeakPolarHBondContact CG2-ND1 3.46Å; D440-H718 IonicContact OD1-CE1 2.78Å; R445-H718 PolarHBondContact NH2-CE1 3.48Å; R445-H718 PolarHBondContact NH2-NE2 3.49Å; S716-H718 PolarHBondContact O-N 3.19Å; S716-H718 PolarHBondContact OG-N 2.8Å; S716-H718 VanDerWaalsContact OG-N 3.12Å
719	S	90.7	Very high	92.6	Very high	10 Å²	10	36.2 Å²	36.2	7%	0.07	18%	0.175	C	C	.	.			trans	-88.6	134.4	171.7	-167.4	0	0	0	0	109	S716 L717 Y721	S716-S719 VanDerWaalsContact O-CB 3.25Å; S716-S719 WeakPolarHBondContact O-CB 3.42Å; S716-S719 PolarHBondContact O-N 3.36Å; L717-S719 VanDerWaalsContact C-N 3.34Å; S719-Y721 PolarHBondContact O-N 3.48Å
720	P	90.4	Very high	92.4	Very high	7 Å²	7	32.6 Å²	32.6	5%	0.045	16%	0.16	C	C	.	.	S	Bend	trans	-90.1	7.7	-179.9	37.8	-24.4	0	0	0	111.4	R341 G750 Q751 T753 D890	R341-P720 VanDerWaalsContact CZ-CD 3.45Å; P720-G750 CarbonylContact O-C 3.55Å; P720-G750 VanDerWaalsContact O-CA 3.3Å; P720-G750 WeakPolarHBondContact O-CA 3.09Å; P720-Q751 WeakPolarHBondContact CA-O 3.29Å; P720-Q751 PolarHBondContact O-N 3.39Å; P720-T753 HydrophobicContact CB-CG2 3.99Å; P720-D890 HydrophobicContact CB-CB 3.69Å; P720-D890 HydrophobicContact CG-CB 4.19Å
721	Y	90.9	Very high	91.9	Very high	113 Å²	113	33.7 Å²	33.7	44%	0.443	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.2	-176.5	-55.6	-63.4	0	0	0	109.6	S719 I748 T749	S719-Y721 PolarHBondContact O-N 3.48Å; Y721-I748 HydrophobicContact CD1-CG2 4.31Å; Y721-I748 HydrophobicContact CG-CG2 4.36Å; Y721-T749 WeakPolarHBondContact CA-O 3.4Å
722	Q	93.6	Very high	91	Very high	34 Å²	34	41.9 Å²	41.9	16%	0.159	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.6	170.1	69.4	-174.4	0.8	0	0	109.9	V712 I713 R714 V724 I748 T749	V712-Q722 HydrophobicContact CG1-CB 3.96Å; V712-Q722 HydrophobicContact CG1-CG 4.05Å; I713-Q722 CarbonylContact O-C 3.48Å; I713-Q722 WeakPolarHBondContact O-CA 3.31Å; R714-Q722 HydrophobicContact CG-CB 3.59Å; R714-Q722 VanDerWaalsContact NE-OE1 3.14Å; Q722-V724 HydrophobicContact CG-CG2 4.25Å; Q722-I748 WeakPolarHBondContact O-CA 3.37Å; Q722-T749 WeakPolarHBondContact CG-OG1 3.15Å; Q722-T749 PolarHBondContact N-O 2.83Å; Q722-T749 PolarHBondContact NE2-OG1 2.84Å; Q722-T749 PolarHBondContact O-N 2.87Å
723	Y	96.7	Very high	90	Very high	20 Å²	20	45.8 Å²	45.8	8%	0.078	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	123.5	174.1	-58.7	-88.8	0	0	0	108.5	R665 L666 V712 I713 D715 L745 I748	R665-Y723 HydrophobicContact CG-CE1 3.98Å; L666-Y723 HydrophobicContact CB-CD1 3.87Å; L666-Y723 HydrophobicContact CB-CD2 4.36Å; L666-Y723 HydrophobicContact CB-CE1 4.06Å; L666-Y723 HydrophobicContact CB-CG 4.03Å; L666-Y723 HydrophobicContact CD1-CD2 3.65Å; L666-Y723 HydrophobicContact CD1-CE2 4.1Å; L666-Y723 HydrophobicContact CD1-CG 3.92Å; L666-Y723 HydrophobicContact CG-CD1 4.36Å; L666-Y723 HydrophobicContact CG-CD2 3.99Å; L666-Y723 HydrophobicContact CG-CE1 4.38Å; L666-Y723 HydrophobicContact CG-CE2 4.01Å; L666-Y723 HydrophobicContact CG-CG 4.17Å; V712-Y723 CarbonylContact C-O 3.52Å; V712-Y723 VanDerWaalsContact CA-O 3.32Å; V712-Y723 WeakPolarHBondContact CA-O 3.4Å; I713-Y723 PolarHBondContact N-O 2.78Å; I713-Y723 WeakPolarHBondContact O-CD2 3.23Å; I713-Y723 PolarHBondContact O-N 2.84Å; D715-Y723 PolarHBondContact OD2-OH 3.19Å; Y723-L745 HydrophobicContact CD1-CD1 3.79Å; Y723-L745 HydrophobicContact CD1-CD2 4.37Å; Y723-L745 HydrophobicContact CG-CD1 4.31Å; Y723-I748 HydrophobicContact CD1-CD1 4.13Å; Y723-I748 HydrophobicContact CD1-CG1 3.98Å; Y723-I748 HydrophobicContact CE1-CD1 3.96Å; Y723-I748 HydrophobicContact CE1-CG1 4.29Å
724	V	96.1	Very high	89.1	Confident	25 Å²	25	52.1 Å²	52.1	15%	0.152	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.4	-179.3	-178.1	0	0	0	0	108.5	V712 Q722 T726 S746 D747 T749	V712-V724 HydrophobicContact CG2-CG2 4.47Å; Q722-V724 HydrophobicContact CG-CG2 4.25Å; V724-T726 HydrophobicContact CG1-CG2 4Å; V724-S746 WeakPolarHBondContact O-CA 3.5Å; V724-S746 WeakPolarHBondContact O-CB 3.42Å; V724-S746 PolarHBondContact O-N 2.93Å; V724-D747 HydrophobicContact CB-CB 4.43Å; V724-D747 PolarHBondContact N-O 3.34Å; V724-D747 PolarHBondContact O-N 3.44Å; V724-D747 VanDerWaalsContact O-N 3.08Å; V724-T749 HydrophobicContact CG2-CG2 4.26Å
725	F	95.5	Very high	88.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	102.5	178.9	-53.8	-100	0	0	0	108.5	L666 V669 S710 I711 I713 M743 I744 L745	L666-F725 HydrophobicContact CB-CZ 3.96Å; L666-F725 HydrophobicContact CD1-CZ 4.32Å; V669-F725 HydrophobicContact CG2-CD1 4.09Å; V669-F725 HydrophobicContact CG2-CD2 4.16Å; V669-F725 HydrophobicContact CG2-CE1 3.8Å; V669-F725 HydrophobicContact CG2-CE2 3.83Å; V669-F725 HydrophobicContact CG2-CG 4.31Å; V669-F725 HydrophobicContact CG2-CZ 3.67Å; S710-F725 CarbonylContact C-O 3.58Å; S710-F725 WeakPolarHBondContact CA-O 3.47Å; I711-F725 HydrophobicContact CB-CB 4.13Å; I711-F725 HydrophobicContact CB-CD2 4.25Å; I711-F725 HydrophobicContact CG2-CD2 4.49Å; I711-F725 PolarHBondContact N-O 2.95Å; I711-F725 WeakPolarHBondContact O-CD2 3.47Å; I711-F725 PolarHBondContact O-N 2.87Å; I713-F725 HydrophobicContact CB-CE2 4.36Å; I713-F725 HydrophobicContact CD1-CE2 4.09Å; I713-F725 HydrophobicContact CG1-CE2 4.14Å; F725-M743 HydrophobicContact CB-CB 4.05Å; F725-M743 HydrophobicContact CB-CE 4.04Å; F725-M743 HydrophobicContact CD1-CB 4.46Å; F725-M743 WeakPolarHBondContact O-CE 3.04Å; F725-I744 VanDerWaalsContact CD1-C 3.42Å; F725-I744 WeakPolarHBondContact CD1-O 3.47Å; F725-L745 HydrophobicContact CD1-CB 4.33Å; F725-L745 HydrophobicContact CE1-CB 3.89Å; F725-L745 HydrophobicContact CE1-CD1 4.15Å; F725-L745 HydrophobicContact CZ-CD1 4.07Å
726	T	92.8	Very high	88.1	Confident	57 Å²	57	60.3 Å²	60.3	35%	0.35	29%	0.29	S	S	.	.			trans	-112.7	-13.7	175.7	48.1	0	0	0	0	112.3	N704 V724 S746	N704-T726 PolarHBondContact ND2-O 2.87Å; V724-T726 HydrophobicContact CG1-CG2 4Å; T726-S746 PolarHBondContact N-OG 2.73Å; T726-S746 VanDerWaalsContact OG1-CB 3.26Å; T726-S746 WeakPolarHBondContact OG1-CB 3.37Å; T726-S746 PolarHBondContact OG1-OG 2.99Å; T726-S746 VanDerWaalsContact OG1-OG 3.07Å
727	E	89.1	Confident	87.8	Confident	90 Å²	90	60.4 Å²	60.4	42%	0.421	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	152.2	-178.2	-63.2	-179.1	-168	0	0	110.9	T701 M743 I744 S746	T701-E727 WeakPolarHBondContact OG1-CA 3.15Å; E727-M743 CarbonylContact O-C 3.57Å; E727-M743 WeakPolarHBondContact O-CA 3.29Å; E727-I744 PolarHBondContact O-N 2.76Å; E727-S746 PolarHBondContact N-OG 3.38Å
728	G	87.8	Confident	87.8	Confident	5 Å²	5	57.9 Å²	57.9	5%	0.052	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.1	-170.2	178.6	0	0	0	0	0	114.1	T701 E742	T701-G728 VanDerWaalsContact CG2-O 3.25Å; T701-G728 WeakPolarHBondContact CG2-O 3.35Å; T701-G728 PolarHBondContact OG1-N 2.89Å; T701-G728 PolarHBondContact OG1-O 3.25Å; G728-E742 CarbonylContact C-O 3.5Å; G728-E742 WeakPolarHBondContact CA-O 3.35Å
729	R	87.8	Confident	87.6	Confident	95 Å²	95	57.9 Å²	57.9	36%	0.358	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	148.6	175.3	60.4	178	178.9	176.9	1.3	111.3	Q690 L731 K741 E742	Q690-R729 HydrophobicContact CG-CB 3.85Å; R729-L731 HydrophobicContact CG-CD2 4.18Å; R729-K741 CarbonylContact O-C 3.56Å; R729-K741 WeakPolarHBondContact O-CA 3.44Å; R729-K741 WeakPolarHBondContact O-CG 3.41Å; R729-E742 HydrophobicContact CG-CB 4.12Å; R729-E742 IonicContact CZ-OE2 2.76Å; R729-E742 VanDerWaalsContact CZ-OE2 3.25Å; R729-E742 PolarHBondContact N-O 2.79Å; R729-E742 IonicContact NE-OE2 3.41Å; R729-E742 PolarHBondContact NE-OE2 3.46Å; R729-E742 IonicContact NH2-OE2 3.64Å; R729-E742 PolarHBondContact NH2-OE2 2.97Å; R729-E742 PolarHBondContact O-N 2.77Å
730	I	87.2	Confident	87.6	Confident	10 Å²	10	60.2 Å²	60.2	5%	0.051	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.7	169.1	-67.1	170.7	0	0	0	107.7	F686 S687 L739 K741	F686-I730 HydrophobicContact CB-CD1 3.68Å; F686-I730 HydrophobicContact CD2-CD1 4.1Å; F686-I730 HydrophobicContact CG-CD1 4.21Å; S687-I730 WeakPolarHBondContact OG-CG2 3.49Å; S687-I730 PolarHBondContact OG-O 3.24Å; I730-L739 HydrophobicContact CG2-CD1 3.48Å; I730-L739 VanDerWaalsContact CG2-CD1 3.48Å; I730-K741 HydrophobicContact CG1-CB 4.43Å; I730-K741 HydrophobicContact CG1-CD 4.48Å; I730-K741 HydrophobicContact CG1-CG 4.3Å
731	L	83.5	Confident	87.6	Confident	45 Å²	45	59.9 Å²	59.9	24%	0.236	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-80.5	149.7	-179.3	-62.3	-177.8	0	0	0	110.7	M670 R729 R740 E742	M670-L731 HydrophobicContact CE-CD1 3.87Å; M670-L731 HydrophobicContact SD-CD1 3.66Å; R729-L731 HydrophobicContact CG-CD2 4.18Å; L731-R740 HydrophobicContact CB-CB 4.41Å; L731-R740 HydrophobicContact CD1-CB 4.38Å; L731-R740 PolarHBondContact N-O 3.23Å; L731-E742 HydrophobicContact CD2-CB 4.22Å; L731-E742 HydrophobicContact CG-CB 4.32Å
732	E	77.5	Confident	87.7	Confident	172 Å²	172	56.1 Å²	56.1	80%	0.804	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-56.1	139.9	173.6	-168	-177.3	-179.4	0	0	111.5	Q734	E732-Q734 PolarHBondContact O-N 3.11Å
733	R	75.6	Confident	87.7	Confident	116 Å²	116	54.5 Å²	54.5	44%	0.438	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-64.8	121.3	-178	-176.6	176.6	56.2	-161	-18.7	110.9	E680 D684 F735	E680-R733 IonicContact OE1-NH1 3.28Å; E680-R733 PolarHBondContact OE1-NH1 2.75Å; E680-R733 IonicContact OE2-NH1 3.79Å; D684-R733 IonicContact OD2-NH2 3.87Å; R733-F735 WeakPolarHBondContact CG-O 3.29Å
734	Q	77.1	Confident	87.4	Confident	132 Å²	132	57.2 Å²	57.2	62%	0.617	28%	0.281	S	S	*	.	S	Bend	trans	-95.5	-26.5	169	-75.7	-179.5	-10.5	0	0	112.9	E732 R740	E732-Q734 PolarHBondContact O-N 3.11Å; Q734-R740 VanDerWaalsContact CG-NH2 3.29Å
735	F	82.6	Confident	87.3	Confident	113 Å²	113	57.5 Å²	57.5	50%	0.496	28%	0.281	S	S	.	.	S	Bend	trans	-137.8	140.8	-177.6	-57.2	-75.7	0	0	0	110.1	R733 V738	R733-F735 WeakPolarHBondContact CG-O 3.29Å; F735-V738 HydrophobicContact CB-CB 4.33Å; F735-V738 HydrophobicContact CB-CG2 4.14Å; F735-V738 PolarHBondContact O-N 2.9Å
736	P	82	Confident	87.1	Confident	113 Å²	113	59.3 Å²	59.3	73%	0.734	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	139.6	172.9	-24.1	33.9	0	0	0	112.2	V738	P736-V738 PolarHBondContact O-N 3.19Å
737	G	85.8	Confident	87.1	Confident	15 Å²	15	61 Å²	61	16%	0.155	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	1.5	177.6	0	0	0	0	0	115.8	F674 V675 E680	F674-G737 CarbonylContact C-O 3.53Å; F674-G737 VanDerWaalsContact CA-O 3.22Å; F674-G737 WeakPolarHBondContact CA-O 3.39Å; V675-G737 PolarHBondContact N-O 3.35Å; E680-G737 PolarHBondContact OE1-N 3.26Å
738	V	88.9	Confident	87.1	Confident	36 Å²	36	59.7 Å²	59.7	22%	0.218	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.1	-179.3	-177	0	0	0	0	110.7	F674 F735 P736 R740	F674-V738 HydrophobicContact CD1-CG2 3.96Å; F674-V738 HydrophobicContact CE1-CG2 3.73Å; F735-V738 HydrophobicContact CB-CB 4.33Å; F735-V738 HydrophobicContact CB-CG2 4.14Å; F735-V738 PolarHBondContact O-N 2.9Å; P736-V738 PolarHBondContact O-N 3.19Å; V738-R740 HydrophobicContact CG1-CG 4.34Å
739	L	88.4	Confident	87.2	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.4	173.8	178.5	60	0	0	0	110.6	S672 T673 V675 C683 W706 L707 I730	S672-L739 CarbonylContact C-O 3.49Å; S672-L739 WeakPolarHBondContact CA-O 3.4Å; T673-L739 HydrophobicContact CG2-CB 4Å; T673-L739 HydrophobicContact CG2-CD2 4.05Å; T673-L739 HydrophobicContact CG2-CG 4.39Å; T673-L739 PolarHBondContact N-O 3.37Å; T673-L739 PolarHBondContact O-N 2.92Å; V675-L739 HydrophobicContact CG1-CB 3.77Å; V675-L739 HydrophobicContact CG1-CD2 3.93Å; V675-L739 HydrophobicContact CG2-CB 4.13Å; C683-L739 HydrophobicContact CB-CD1 3.92Å; C683-L739 WeakPolarHBondContact SG-CD1 3.46Å; C683-L739 VanDerWaalsContact SG-CD2 3.59Å; W706-L739 HydrophobicContact CZ3-CD2 4.29Å; L707-L739 HydrophobicContact CD1-CD2 3.63Å; L707-L739 HydrophobicContact CD2-CD2 3.7Å; L707-L739 HydrophobicContact CD2-CG 4.3Å; L707-L739 HydrophobicContact CG-CD2 4.27Å; I730-L739 HydrophobicContact CG2-CD1 3.48Å; I730-L739 VanDerWaalsContact CG2-CD1 3.48Å
740	R	90.6	Very high	87	Confident	59 Å²	59	59.8 Å²	59.8	22%	0.223	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.7	171.2	-62.9	-170.1	-66.1	-159.4	-4.5	111.4	M670 F671 S672 L731 Q734 V738	M670-R740 HydrophobicContact SD-CB 4.07Å; F671-R740 CarbonylContact O-C 3.58Å; F671-R740 VanDerWaalsContact O-CA 3.31Å; F671-R740 WeakPolarHBondContact O-CA 3.48Å; S672-R740 WeakPolarHBondContact OG-CG 3.44Å; L731-R740 HydrophobicContact CB-CB 4.41Å; L731-R740 HydrophobicContact CD1-CB 4.38Å; L731-R740 PolarHBondContact N-O 3.23Å; Q734-R740 VanDerWaalsContact CG-NH2 3.29Å; V738-R740 HydrophobicContact CG1-CG 4.34Å
741	K	91.2	Very high	86.8	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.1	172.8	-173.6	175.9	179.4	-174.6	0	109.3	F671 N704 L707 I708 R729 I730 M743	F671-K741 PolarHBondContact N-O 3.16Å; F671-K741 PolarHBondContact O-N 2.83Å; N704-K741 PolarHBondContact OD1-NZ 2.76Å; L707-K741 HydrophobicContact CD2-CB 3.6Å; L707-K741 HydrophobicContact CD2-CD 3.73Å; L707-K741 HydrophobicContact CD2-CG 4.25Å; I708-K741 PolarHBondContact O-NZ 3.02Å; R729-K741 CarbonylContact O-C 3.56Å; R729-K741 WeakPolarHBondContact O-CA 3.44Å; R729-K741 WeakPolarHBondContact O-CG 3.41Å; I730-K741 HydrophobicContact CG1-CB 4.43Å; I730-K741 HydrophobicContact CG1-CD 4.48Å; I730-K741 HydrophobicContact CG1-CG 4.3Å; K741-M743 HydrophobicContact CD-SD 3.89Å; K741-M743 WeakPolarHBondContact CE-SD 3.16Å; K741-M743 HydrophobicContact CG-SD 4.22Å
742	E	92.5	Very high	86.8	Confident	34 Å²	34	64.7 Å²	64.7	16%	0.159	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.1	168.6	-173.1	170	-133.9	0	0	108.7	C668 M670 G728 R729 L731 I744	C668-E742 HydrophobicContact CB-CG 4.27Å; M670-E742 HydrophobicContact CE-CB 3.5Å; M670-E742 VanDerWaalsContact CE-CB 3.5Å; M670-E742 HydrophobicContact CE-CG 3.66Å; M670-E742 HydrophobicContact SD-CB 4.4Å; G728-E742 CarbonylContact C-O 3.5Å; G728-E742 WeakPolarHBondContact CA-O 3.35Å; R729-E742 HydrophobicContact CG-CB 4.12Å; R729-E742 IonicContact CZ-OE2 2.76Å; R729-E742 VanDerWaalsContact CZ-OE2 3.25Å; R729-E742 PolarHBondContact N-O 2.79Å; R729-E742 IonicContact NE-OE2 3.41Å; R729-E742 PolarHBondContact NE-OE2 3.46Å; R729-E742 IonicContact NH2-OE2 3.64Å; R729-E742 PolarHBondContact NH2-OE2 2.97Å; R729-E742 PolarHBondContact O-N 2.77Å; L731-E742 HydrophobicContact CD2-CB 4.22Å; L731-E742 HydrophobicContact CG-CB 4.32Å; E742-I744 HydrophobicContact CG-CG1 4.32Å
743	M	93.1	Very high	87.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124	171.7	-64.1	-69.4	-57	0	0	108.4	C668 V669 I708 I711 F725 E727 K741	C668-M743 CarbonylContact C-O 3.56Å; C668-M743 WeakPolarHBondContact CA-O 3.23Å; C668-M743 VanDerWaalsContact CB-O 3.22Å; C668-M743 WeakPolarHBondContact CB-O 3.44Å; V669-M743 HydrophobicContact CB-CB 4.27Å; V669-M743 PolarHBondContact N-O 2.98Å; V669-M743 PolarHBondContact O-N 3.42Å; I708-M743 HydrophobicContact CB-SD 4.4Å; I708-M743 HydrophobicContact CG2-CE 4.11Å; I708-M743 HydrophobicContact CG2-SD 4.03Å; I711-M743 HydrophobicContact CD1-CB 4.27Å; I711-M743 HydrophobicContact CD1-CG 3.76Å; I711-M743 HydrophobicContact CG1-CE 4.45Å; I711-M743 HydrophobicContact CG1-CG 4.31Å; F725-M743 HydrophobicContact CB-CB 4.05Å; F725-M743 HydrophobicContact CB-CE 4.04Å; F725-M743 HydrophobicContact CD1-CB 4.46Å; F725-M743 WeakPolarHBondContact O-CE 3.04Å; E727-M743 CarbonylContact O-C 3.57Å; E727-M743 WeakPolarHBondContact O-CA 3.29Å; K741-M743 HydrophobicContact CD-SD 3.89Å; K741-M743 WeakPolarHBondContact CE-SD 3.16Å; K741-M743 HydrophobicContact CG-SD 4.22Å
744	I	91.5	Very high	88	Confident	77 Å²	77	54.8 Å²	54.8	40%	0.395	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.1	-176.6	-57.9	170.5	0	0	0	108.8	F725 E727 E742 S746	F725-I744 VanDerWaalsContact CD1-C 3.42Å; F725-I744 WeakPolarHBondContact CD1-O 3.47Å; E727-I744 PolarHBondContact O-N 2.76Å; E742-I744 HydrophobicContact CG-CG1 4.32Å; I744-S746 PolarHBondContact O-N 2.78Å; I744-S746 VanDerWaalsContact O-N 3.11Å; I744-S746 PolarHBondContact O-OG 2.61Å
745	L	92.6	Very high	88.3	Confident	30 Å²	30	49.8 Å²	49.8	16%	0.157	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-56.9	117.4	178.1	179.5	67.9	0	0	0	110.4	L666 V667 Y723 F725 D747 I748	L666-L745 WeakPolarHBondContact O-CD2 3.4Å; V667-L745 WeakPolarHBondContact O-CB 3.18Å; V667-L745 PolarHBondContact O-N 2.61Å; V667-L745 VanDerWaalsContact O-N 3.13Å; Y723-L745 HydrophobicContact CD1-CD1 3.79Å; Y723-L745 HydrophobicContact CD1-CD2 4.37Å; Y723-L745 HydrophobicContact CG-CD1 4.31Å; F725-L745 HydrophobicContact CD1-CB 4.33Å; F725-L745 HydrophobicContact CE1-CB 3.89Å; F725-L745 HydrophobicContact CE1-CD1 4.15Å; F725-L745 HydrophobicContact CZ-CD1 4.07Å; L745-D747 WeakPolarHBondContact CD1-O 3.42Å; L745-I748 HydrophobicContact CD1-CG1 4.23Å; L745-I748 HydrophobicContact CD2-CD1 4.12Å; L745-I748 HydrophobicContact CD2-CG1 4.08Å
746	S	92.1	Very high	87.7	Confident	39 Å²	39	50.3 Å²	50.3	27%	0.273	30%	0.302	S	S	.	.			trans	-94	-45.3	179.3	-50.9	0	0	0	0	111.3	V724 T726 E727 I744	V724-S746 WeakPolarHBondContact O-CA 3.5Å; V724-S746 WeakPolarHBondContact O-CB 3.42Å; V724-S746 PolarHBondContact O-N 2.93Å; T726-S746 PolarHBondContact N-OG 2.73Å; T726-S746 VanDerWaalsContact OG1-CB 3.26Å; T726-S746 WeakPolarHBondContact OG1-CB 3.37Å; T726-S746 PolarHBondContact OG1-OG 2.99Å; T726-S746 VanDerWaalsContact OG1-OG 3.07Å; E727-S746 PolarHBondContact N-OG 3.38Å; I744-S746 PolarHBondContact O-N 2.78Å; I744-S746 VanDerWaalsContact O-N 3.11Å; I744-S746 PolarHBondContact O-OG 2.61Å
747	D	91.5	Very high	86.9	Confident	93 Å²	93	49.9 Å²	49.9	50%	0.497	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.2	-179.9	-162.1	10.9	0	0	0	112.5	V724 L745 T749	V724-D747 HydrophobicContact CB-CB 4.43Å; V724-D747 PolarHBondContact N-O 3.34Å; V724-D747 PolarHBondContact O-N 3.44Å; V724-D747 VanDerWaalsContact O-N 3.08Å; L745-D747 WeakPolarHBondContact CD1-O 3.42Å; D747-T749 WeakPolarHBondContact OD2-CG2 3.17Å
748	I	90.9	Very high	85.2	Confident	61 Å²	61	58.6 Å²	58.6	31%	0.313	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	111.8	168.4	-58.6	175.4	0	0	0	107.5	Y721 Q722 Y723 L745	Y721-I748 HydrophobicContact CD1-CG2 4.31Å; Y721-I748 HydrophobicContact CG-CG2 4.36Å; Q722-I748 WeakPolarHBondContact O-CA 3.37Å; Y723-I748 HydrophobicContact CD1-CD1 4.13Å; Y723-I748 HydrophobicContact CD1-CG1 3.98Å; Y723-I748 HydrophobicContact CE1-CD1 3.96Å; Y723-I748 HydrophobicContact CE1-CG1 4.29Å; L745-I748 HydrophobicContact CD1-CG1 4.23Å; L745-I748 HydrophobicContact CD2-CD1 4.12Å; L745-I748 HydrophobicContact CD2-CG1 4.08Å
749	T	88.9	Confident	83	Confident	40 Å²	40	66.6 Å²	66.6	25%	0.245	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	151.3	-177.9	54.5	0	0	0	0	111.1	Y721 Q722 V724 D747	Y721-T749 WeakPolarHBondContact CA-O 3.4Å; Q722-T749 WeakPolarHBondContact CG-OG1 3.15Å; Q722-T749 PolarHBondContact N-O 2.83Å; Q722-T749 PolarHBondContact NE2-OG1 2.84Å; Q722-T749 PolarHBondContact O-N 2.87Å; V724-T749 HydrophobicContact CG2-CG2 4.26Å; D747-T749 WeakPolarHBondContact OD2-CG2 3.17Å
750	G	84.1	Confident	81.2	Confident	62 Å²	62	74.4 Å²	74.4	64%	0.639	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	143.4	176.2	0	0	0	0	0	111.8	P720	P720-G750 CarbonylContact O-C 3.55Å; P720-G750 VanDerWaalsContact O-CA 3.3Å; P720-G750 WeakPolarHBondContact O-CA 3.09Å
751	Q	83	Confident	78.8	Confident	71 Å²	71	82.9 Å²	82.9	33%	0.332	43%	0.428	S	S	.	.			trans	-134.3	136.5	169.8	-157.8	-156.8	18.8	0	0	110.9	R714 P720 T753	R714-Q751 VanDerWaalsContact NH1-CD 3.29Å; R714-Q751 VanDerWaalsContact NH1-NE2 3.11Å; P720-Q751 WeakPolarHBondContact CA-O 3.29Å; P720-Q751 PolarHBondContact O-N 3.39Å; Q751-T753 PolarHBondContact O-N 3.34Å
752	S	83.1	Confident	76.6	Confident	87 Å²	87	91.3 Å²	91.3	61%	0.608	47%	0.473	S	S	*	.			trans	-61	124.3	175.8	173.8	0	0	0	0	111.3	K754	S752-K754 VanDerWaalsContact C-N 3.34Å; S752-K754 VanDerWaalsContact OG-CB 3.29Å; S752-K754 WeakPolarHBondContact OG-CB 3.25Å; S752-K754 PolarHBondContact OG-N 2.69Å
753	T	88.5	Confident	74.4	Confident	7 Å²	7	92.6 Å²	92.6	4%	0.043	50%	0.496	C	S	.	.			trans	-87	-8.5	168.4	52.5	0	0	0	0	112.2	Q438 V439 P720 Q751 C755 D890	Q438-T753 PolarHBondContact NE2-OG1 2.98Å; Q438-T753 VanDerWaalsContact OE1-C 3.28Å; Q438-T753 PolarHBondContact OE1-O 3.29Å; Q438-T753 PolarHBondContact OE1-OG1 3.27Å; V439-T753 WeakPolarHBondContact CG2-O 3.18Å; V439-T753 PolarHBondContact N-O 3.06Å; P720-T753 HydrophobicContact CB-CG2 3.99Å; Q751-T753 PolarHBondContact O-N 3.34Å; T753-C755 PolarHBondContact O-N 3.02Å; T753-D890 WeakPolarHBondContact CB-OD2 3.05Å; T753-D890 VanDerWaalsContact CG2-OD2 3.28Å; T753-D890 WeakPolarHBondContact CG2-OD2 3.06Å; T753-D890 WeakPolarHBondContact OG1-CB 3.23Å; T753-D890 PolarHBondContact OG1-OD2 3.07Å
754	K	88.7	Confident	72.5	Confident	73 Å²	73	99.7 Å²	99.7	32%	0.317	53%	0.534	S	S	.	.	B	Isolated β-bridge	trans	-56.8	133.1	172.6	-170.4	173.3	-175	166.1	0	110.5	Y405 G437 S752	Y405-K754 HydrophobicContact CD1-CD 4.3Å; Y405-K754 HydrophobicContact CD2-CD 4.33Å; Y405-K754 HydrophobicContact CD2-CG 3.97Å; Y405-K754 HydrophobicContact CE1-CD 4.02Å; Y405-K754 HydrophobicContact CE2-CB 3.89Å; Y405-K754 HydrophobicContact CE2-CD 4.01Å; Y405-K754 HydrophobicContact CE2-CG 3.7Å; Y405-K754 HydrophobicContact CG-CD 4.45Å; G437-K754 CarbonylContact O-C 3.15Å; G437-K754 VanDerWaalsContact O-CA 3.31Å; G437-K754 WeakPolarHBondContact O-CA 3.48Å; S752-K754 VanDerWaalsContact C-N 3.34Å; S752-K754 VanDerWaalsContact OG-CB 3.29Å; S752-K754 WeakPolarHBondContact OG-CB 3.25Å; S752-K754 PolarHBondContact OG-N 2.69Å
755	C	83.6	Confident	70.8	Confident	28 Å²	28	102.1 Å²	102.1	19%	0.189	55%	0.545	C	S	.	.			trans	-47.7	129.5	172.9	-77.6	0	0	0	0	110	Q436 G437 Q438 V439 T753 T757	Q436-C755 PolarHBondContact O-SG 2.96Å; G437-C755 PolarHBondContact O-N 2.82Å; Q438-C755 PolarHBondContact N-SG 3.15Å; Q438-C755 VanDerWaalsContact N-SG 3.36Å; V439-C755 PolarHBondContact N-SG 3.49Å; V439-C755 PolarHBondContact O-SG 2.84Å; T753-C755 PolarHBondContact O-N 3.02Å; C755-T757 PolarHBondContact O-N 2.81Å
756	P	71.1	Confident	69.8	Low	123 Å²	123	107.6 Å²	107.6	80%	0.799	57%	0.57	S	S	*	*			trans	-59.5	104.1	171.1	-21.4	32	0	0	0	109.4	K758	P756-K758 PolarHBondContact O-N 3.32Å
757	T	64.1	Low	69.6	Low	104 Å²	104	109.7 Å²	109.7	64%	0.638	58%	0.581	S	S	*	*			trans	-63.5	124.9	174.6	42.9	0	0	0	0	108.5	C755 K759	C755-T757 PolarHBondContact O-N 2.81Å; T757-K759 PolarHBondContact O-N 3.11Å; T757-K759 VanDerWaalsContact O-N 3.11Å
758	K	51.7	Low	69.5	Low	198 Å²	198	107 Å²	107	86%	0.861	57%	0.566	S	S	*	*			trans	-49.5	123.1	162.4	-68.6	-179.7	179.7	176.6	0	106.6	P756 K760	P756-K758 PolarHBondContact O-N 3.32Å; K758-K760 PolarHBondContact O-N 3.11Å
759	K	42.2	Very low	69.6	Low	205 Å²	205	105.8 Å²	105.8	89%	0.891	56%	0.56	S	S	*	*			trans	-35.8	109.4	-178.3	-78	-178.8	176.3	178.3	0	109.1	T757 R761	T757-K759 PolarHBondContact O-N 3.11Å; T757-K759 VanDerWaalsContact O-N 3.11Å; K759-R761 PolarHBondContact O-N 2.95Å
760	K	50.8	Low	69.9	Low	170 Å²	170	104.3 Å²	104.3	74%	0.739	55%	0.55	S	S	*	*			trans	-55.4	127.9	171	-81.8	-173.5	175.6	-175.9	0	105.6	K758 D762	K758-K760 PolarHBondContact O-N 3.11Å; K760-D762 PolarHBondContact O-N 3.14Å
761	R	40.1	Very low	70.4	Confident	237 Å²	237	105.5 Å²	105.5	89%	0.894	54%	0.538	S	S	*	.			trans	-53.1	135.3	175	-78.3	-179.6	173.2	175.7	-2.8	107.6	K759 G763	K759-R761 PolarHBondContact O-N 2.95Å; R761-G763 PolarHBondContact O-N 2.7Å
762	D	44.1	Very low	70.8	Confident	178 Å²	178	102.1 Å²	102.1	95%	0.952	52%	0.522	S	S	*	.	S	Bend	trans	-42.5	111.9	169.8	-155	11.4	0	0	0	108.5	K760	K760-D762 PolarHBondContact O-N 3.14Å
763	G	46.7	Very low	71.1	Confident	61 Å²	61	100.3 Å²	100.3	63%	0.629	50%	0.503	S	S	*	.			trans	-172	114.5	-163.5	0	0	0	0	0	110.1	R761	R761-G763 PolarHBondContact O-N 2.7Å
764	N	53.3	Low	71.1	Confident	149 Å²	149	100 Å²	100	80%	0.797	50%	0.502	S	S	*	.			trans	2.3	132.7	170.2	-72.3	-17.9	0	0	0	116.6	E766	N764-E766 PolarHBondContact O-N 2.92Å
765	M	55.5	Low	70.8	Confident	128 Å²	128	97.9 Å²	97.9	63%	0.631	50%	0.495	S	S	*	.			trans	-52.5	89.5	162.9	-77.4	179.7	153.3	0	0	109.9	L797	M765-L797 HydrophobicContact CE-CD1 4.35Å
766	E	72.7	Confident	70.6	Confident	146 Å²	146	96.6 Å²	96.6	68%	0.682	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-65.7	141.4	176.8	-78.8	-179.4	163.9	0	0	108.4	N764 E768	N764-E766 PolarHBondContact O-N 2.92Å; E766-E768 PolarHBondContact O-N 3.48Å
767	V	87.4	Confident	70.6	Confident	83 Å²	83	95 Å²	95	50%	0.503	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	119.5	169.8	177.2	0	0	0	0	107
768	E	89.4	Confident	70.5	Confident	37 Å²	37	97 Å²	97	17%	0.173	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	141.1	175.1	-63.2	178.7	177.7	0	0	109.2	E766 W770 S823 F824 S826	E766-E768 PolarHBondContact O-N 3.48Å; E768-W770 VanDerWaalsContact CB-NE1 3.32Å; E768-W770 WeakPolarHBondContact OE2-CZ2 3.46Å; E768-W770 PolarHBondContact OE2-NE1 3.21Å; E768-S823 VanDerWaalsContact O-CA 3.29Å; E768-S823 WeakPolarHBondContact O-CA 3.37Å; E768-F824 PolarHBondContact N-O 3.41Å; E768-F824 PolarHBondContact O-N 3.34Å; E768-F824 VanDerWaalsContact O-N 3.09Å; E768-S826 WeakPolarHBondContact OE1-CB 3.13Å; E768-S826 PolarHBondContact OE1-OG 2.72Å
769	V	93.3	Very high	70.7	Confident	34 Å²	34	94 Å²	94	21%	0.206	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.2	175.6	-168.6	0	0	0	0	108.5	Q821 I857	V769-Q821 HydrophobicContact CG1-CG 3.72Å; V769-I857 HydrophobicContact CB-CD1 4.29Å; V769-I857 HydrophobicContact CG1-CD1 3.61Å; V769-I857 HydrophobicContact CG1-CG1 4.35Å; V769-I857 PolarHBondContact O-N 3.36Å
770	W	94.6	Very high	71	Confident	9 Å²	9	85.7 Å²	85.7	3%	0.034	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.7	-174.5	-67.8	85.8	0	0	0	110.6	E768 Q821 V822 F824 M854 K855 N856 D861 F863 W888	E768-W770 VanDerWaalsContact CB-NE1 3.32Å; E768-W770 WeakPolarHBondContact OE2-CZ2 3.46Å; E768-W770 PolarHBondContact OE2-NE1 3.21Å; W770-Q821 WeakPolarHBondContact O-CA 3.4Å; W770-V822 HydrophobicContact CB-CG2 3.92Å; W770-V822 PolarHBondContact N-O 3.47Å; W770-V822 PolarHBondContact O-N 2.84Å; W770-F824 AromaticContact CD1-CE1 3.81Å; W770-F824 AromaticContact CD1-CE2 3.94Å; W770-F824 AromaticContact CD1-CZ 3.43Å; W770-F824 VanDerWaalsContact CD1-CZ 3.43Å; W770-F824 HydrophobicContact CG-CE1 4.33Å; W770-F824 HydrophobicContact CG-CZ 4.07Å; W770-F824 AromaticContact NE1-CE2 3.85Å; W770-F824 AromaticContact NE1-CZ 3.7Å; W770-M854 HydrophobicContact CB-CE 3.99Å; W770-M854 HydrophobicContact CD2-CE 4.46Å; W770-M854 HydrophobicContact CE3-CB 4.01Å; W770-M854 HydrophobicContact CG-CE 4.24Å; W770-M854 HydrophobicContact CZ3-CB 4.49Å; W770-K855 CarbonylContact C-O 3.53Å; W770-K855 WeakPolarHBondContact CA-O 3.41Å; W770-K855 VanDerWaalsContact CE3-C 3.44Å; W770-N856 HydrophobicContact CD2-CB 3.94Å; W770-N856 HydrophobicContact CE3-CB 3.8Å; W770-N856 HydrophobicContact CH2-CB 3.72Å; W770-N856 HydrophobicContact CZ2-CB 3.87Å; W770-N856 WeakPolarHBondContact CZ2-ND2 3.39Å; W770-N856 HydrophobicContact CZ3-CB 3.68Å; W770-D861 WeakPolarHBondContact CZ3-O 3.14Å; W770-F863 HydrophobicContact CE3-CE1 4.18Å; W770-F863 HydrophobicContact CH2-CD1 4.18Å; W770-F863 AromaticContact CH2-CE1 3.99Å; W770-F863 HydrophobicContact CH2-CE1 3.99Å; W770-F863 AromaticContact CZ3-CD1 3.89Å; W770-F863 HydrophobicContact CZ3-CD1 3.89Å; W770-F863 AromaticContact CZ3-CE1 3.68Å; W770-F863 HydrophobicContact CZ3-CE1 3.68Å; W770-W888 HydrophobicContact CH2-CH2 4.33Å
771	K	93.8	Very high	70.8	Confident	87 Å²	87	86.1 Å²	86.1	38%	0.378	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.6	162.9	-71.8	-173.9	179.5	-178.8	0	109.5	F773 F820 M854 K855 I857	K771-F773 HydrophobicContact CB-CD2 4.41Å; K771-F773 HydrophobicContact CB-CE2 3.59Å; K771-F773 HydrophobicContact CB-CZ 3.95Å; K771-F773 HydrophobicContact CD-CZ 4.23Å; K771-F820 CarbonylContact C-O 3.59Å; K771-F820 VanDerWaalsContact CA-O 3.25Å; K771-F820 WeakPolarHBondContact CA-O 3.38Å; K771-M854 CarbonylContact O-C 3.57Å; K771-M854 VanDerWaalsContact O-CA 3.26Å; K771-M854 WeakPolarHBondContact O-CA 3.3Å; K771-K855 PolarHBondContact N-O 3.3Å; K771-K855 PolarHBondContact O-N 3.21Å; K771-I857 HydrophobicContact CD-CD1 4.42Å; K771-I857 HydrophobicContact CD-CG1 4.45Å; K771-I857 HydrophobicContact CG-CD1 3.82Å; K771-I857 HydrophobicContact CG-CG1 3.9Å
772	V	92.9	Very high	71.3	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.5	178.5	-170.4	0	0	0	0	108.3	I774 L791 V819 F820 V822 V852 K853 M854	V772-I774 HydrophobicContact CG1-CD1 4.24Å; V772-I774 HydrophobicContact CG1-CG1 3.98Å; V772-L791 HydrophobicContact CG1-CD2 4.39Å; V772-L791 HydrophobicContact CG2-CD2 3.81Å; V772-V819 CarbonylContact O-C 3.57Å; V772-V819 VanDerWaalsContact O-CA 3.28Å; V772-V819 WeakPolarHBondContact O-CA 3.29Å; V772-F820 HydrophobicContact CB-CB 4.23Å; V772-F820 HydrophobicContact CB-CD2 4.48Å; V772-F820 PolarHBondContact N-O 2.83Å; V772-F820 PolarHBondContact O-N 2.85Å; V772-V822 HydrophobicContact CG2-CG1 4.17Å; V772-V822 HydrophobicContact CG2-CG2 3.69Å; V772-V852 HydrophobicContact CG1-CG1 4.42Å; V772-K853 CarbonylContact C-O 3.45Å; V772-M854 HydrophobicContact CB-CG 4.35Å; V772-M854 HydrophobicContact CG1-CG 4.03Å; V772-M854 HydrophobicContact CG1-SD 4.48Å; V772-M854 HydrophobicContact CG2-CE 3.97Å; V772-M854 HydrophobicContact CG2-CG 4.14Å; V772-M854 HydrophobicContact CG2-SD 4.29Å
773	F	89.7	Confident	71.4	Confident	49 Å²	49	76.3 Å²	76.3	22%	0.215	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.8	178.5	-58.5	-97.8	0	0	0	108.4	K771 V817 A818 V819 V852 K853 K855	K771-F773 HydrophobicContact CB-CD2 4.41Å; K771-F773 HydrophobicContact CB-CE2 3.59Å; K771-F773 HydrophobicContact CB-CZ 3.95Å; K771-F773 HydrophobicContact CD-CZ 4.23Å; F773-V817 HydrophobicContact CB-CG1 3.99Å; F773-V817 HydrophobicContact CD1-CG1 4.09Å; F773-A818 CarbonylContact C-O 3.57Å; F773-A818 WeakPolarHBondContact CA-O 3.45Å; F773-V819 HydrophobicContact CD1-CB 4.49Å; F773-V819 HydrophobicContact CD1-CG1 4.19Å; F773-V819 HydrophobicContact CD1-CG2 3.64Å; F773-V819 HydrophobicContact CE1-CG1 3.94Å; F773-V819 HydrophobicContact CE1-CG2 3.92Å; F773-V819 HydrophobicContact CZ-CG1 4.39Å; F773-V852 CarbonylContact O-C 3.56Å; F773-V852 VanDerWaalsContact O-CA 3.29Å; F773-V852 WeakPolarHBondContact O-CA 3.13Å; F773-K853 HydrophobicContact CB-CB 4.15Å; F773-K853 HydrophobicContact CD2-CB 4.47Å; F773-K853 HydrophobicContact CD2-CG 4Å; F773-K853 PolarHBondContact N-O 2.8Å; F773-K853 PolarHBondContact O-N 3.32Å; F773-K855 HydrophobicContact CE2-CB 4.07Å
774	I	87	Confident	71.4	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.005	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.2	-178.7	-59.1	-172.8	0	0	0	108.5	V772 L805 F812 V817 A818 F820 W847 L849 V852	V772-I774 HydrophobicContact CG1-CD1 4.24Å; V772-I774 HydrophobicContact CG1-CG1 3.98Å; I774-L805 HydrophobicContact CD1-CD1 3.74Å; I774-F812 HydrophobicContact CB-CE1 4.49Å; I774-F812 HydrophobicContact CD1-CE1 4.31Å; I774-F812 HydrophobicContact CG2-CD1 4.34Å; I774-F812 HydrophobicContact CG2-CE1 4.13Å; I774-V817 WeakPolarHBondContact O-CA 3.43Å; I774-A818 HydrophobicContact CB-CB 4.46Å; I774-A818 PolarHBondContact N-O 3.24Å; I774-A818 PolarHBondContact O-N 3.37Å; I774-F820 HydrophobicContact CD1-CD2 4.24Å; I774-F820 HydrophobicContact CD1-CE2 3.9Å; I774-F820 HydrophobicContact CG1-CD2 4.49Å; I774-F820 HydrophobicContact CG1-CE2 4.28Å; I774-W847 HydrophobicContact CG2-CH2 3.97Å; I774-W847 HydrophobicContact CG2-CZ2 3.55Å; I774-L849 HydrophobicContact CG2-CD1 3.43Å; I774-L849 VanDerWaalsContact CG2-CD1 3.43Å; I774-V852 HydrophobicContact CG1-CG1 4.5Å
775	T	83	Confident	71.3	Confident	29 Å²	29	69.4 Å²	69.4	18%	0.178	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121	-178.3	-51.4	0	0	0	0	110.2	V817 L849 R850 K851	T775-V817 HydrophobicContact CG2-CG2 4.29Å; T775-L849 WeakPolarHBondContact O-CD1 3.36Å; T775-R850 HydrophobicContact CG2-CB 4.26Å; T775-R850 WeakPolarHBondContact O-CA 3.5Å; T775-R850 WeakPolarHBondContact O-CB 3.44Å; T775-R850 PolarHBondContact O-N 3.24Å; T775-K851 PolarHBondContact N-O 3.42Å; T775-K851 PolarHBondContact O-N 3.12Å
776	S	79.1	Confident	71.3	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	146.8	178.1	-59.6	0	0	0	0	112.2	N815 W847	S776-N815 WeakPolarHBondContact O-CA 3.05Å; S776-N815 PolarHBondContact O-N 2.93Å; S776-W847 PolarHBondContact OG-NE1 2.81Å
777	K	72.2	Confident	70.7	Confident	89 Å²	89	62.1 Å²	62.1	39%	0.387	31%	0.312	S	S	.	.			trans	-77.1	165.4	178.8	-163.6	174.6	-179.7	176.1	0	112	V780 Y848	K777-V780 WeakPolarHBondContact O-CG2 3.49Å; K777-Y848 PolarHBondContact N-O 2.87Å
778	E	62	Low	70	Confident	145 Å²	145	60.6 Å²	60.6	68%	0.678	31%	0.305	S	S	*	.	S	Bend	trans	-67.4	-34.3	-177.4	-169.9	175.8	178.5	0	0	115	V780 N815	E778-V780 VanDerWaalsContact C-N 3.26Å; E778-V780 PolarHBondContact O-N 3.37Å; E778-N815 PolarHBondContact N-OD1 2.82Å
779	Q	54	Low	69.6	Low	135 Å²	135	58.9 Å²	58.9	63%	0.631	30%	0.297	S	S	*	.			trans	-83.1	61.7	-169.7	-161.7	178.8	8.7	0	0	112.2	Y848	Q779-Y848 WeakPolarHBondContact O-CD2 3.39Å; Q779-Y848 WeakPolarHBondContact O-CE2 3.31Å
780	V	48.9	Very low	69.5	Low	32 Å²	32	58.1 Å²	58.1	19%	0.194	29%	0.292	C	S	.	.			trans	-106.1	111.2	179.9	-168.5	0	0	0	0	108.7	K777 E778 F782 P814	K777-V780 WeakPolarHBondContact O-CG2 3.49Å; E778-V780 VanDerWaalsContact C-N 3.26Å; E778-V780 PolarHBondContact O-N 3.37Å; V780-F782 HydrophobicContact CG1-CB 3.79Å; V780-F782 HydrophobicContact CG1-CD2 3.71Å; V780-F782 HydrophobicContact CG1-CG 4.26Å; V780-F782 PolarHBondContact O-N 3.49Å; V780-F782 VanDerWaalsContact O-N 3.15Å; V780-P814 HydrophobicContact CB-CG 4.01Å; V780-P814 HydrophobicContact CG2-CB 4.31Å; V780-P814 HydrophobicContact CG2-CG 3.94Å
781	E	46.6	Very low	69.4	Low	179 Å²	179	57.7 Å²	57.7	84%	0.836	29%	0.29	S	S	*	.			trans	-81.8	51.1	165.9	-72.7	-176	162.3	0	0	110.7
782	F	51.6	Low	69.5	Low	54 Å²	54	54 Å²	54	24%	0.237	27%	0.274	C	S	.	.			trans	-136.4	124.9	174.3	-66.1	-74.5	0	0	0	112.1	V780 T784 Q844 M845 T846	V780-F782 HydrophobicContact CG1-CB 3.79Å; V780-F782 HydrophobicContact CG1-CD2 3.71Å; V780-F782 HydrophobicContact CG1-CG 4.26Å; V780-F782 PolarHBondContact O-N 3.49Å; V780-F782 VanDerWaalsContact O-N 3.15Å; F782-T784 VanDerWaalsContact C-N 3.29Å; F782-T784 PolarHBondContact O-N 3.24Å; F782-Q844 WeakPolarHBondContact CE1-O 3.28Å; F782-Q844 WeakPolarHBondContact CZ-O 3.48Å; F782-M845 HydrophobicContact CD1-CG 4.45Å; F782-M845 HydrophobicContact CE1-CB 4.28Å; F782-T846 WeakPolarHBondContact CD2-O 3.13Å; F782-T846 VanDerWaalsContact CE2-CA 3.49Å; F782-T846 VanDerWaalsContact CE2-CB 3.49Å; F782-T846 WeakPolarHBondContact CE2-O 3.28Å
783	D	45	Very low	69.6	Low	154 Å²	154	54 Å²	54	82%	0.824	27%	0.274	S	S	*	.	S	Bend	trans	-69.6	90.5	153.4	-78.6	-29	0	0	0	107.7
784	T	48.5	Very low	70	Confident	52 Å²	52	51.8 Å²	51.8	32%	0.319	27%	0.265	S	S	.	.			trans	57	117.4	167.8	47.5	0	0	0	0	117	F782 N786 K811	F782-T784 VanDerWaalsContact C-N 3.29Å; F782-T784 PolarHBondContact O-N 3.24Å; T784-N786 PolarHBondContact O-N 3.25Å; T784-K811 HydrophobicContact CG2-CB 4.1Å; T784-K811 HydrophobicContact CG2-CD 3.62Å; T784-K811 HydrophobicContact CG2-CG 3.61Å
785	V	51.3	Low	70.4	Confident	13 Å²	13	52 Å²	52	8%	0.079	27%	0.266	C	S	.	.			trans	-64.2	101.4	169.1	178.3	0	0	0	0	109.8	G787 F812 M837 M845	V785-G787 PolarHBondContact O-N 2.88Å; V785-G787 VanDerWaalsContact O-N 3.15Å; V785-F812 HydrophobicContact CB-CD2 4.17Å; V785-F812 HydrophobicContact CG1-CD2 4.35Å; V785-M837 HydrophobicContact CG1-CE 3.33Å; V785-M845 HydrophobicContact CB-CE 4.13Å; V785-M845 HydrophobicContact CG1-CE 3.62Å; V785-M845 HydrophobicContact CG2-CE 3.35Å
786	N	54.1	Low	70.8	Confident	117 Å²	117	55.7 Å²	55.7	63%	0.626	29%	0.285	S	S	*	.			trans	-83.1	44.9	171	-77.3	-18.1	0	0	0	111.5	T784	T784-N786 PolarHBondContact O-N 3.25Å
787	G	59.4	Low	71.4	Confident	4 Å²	4	61 Å²	61	4%	0.041	31%	0.313	C	S	.	.	S	Bend	trans	-126.6	147.3	-178.4	0	0	0	0	0	112.3	V785 D838	V785-G787 PolarHBondContact O-N 2.88Å; V785-G787 VanDerWaalsContact O-N 3.15Å; G787-D838 WeakPolarHBondContact CA-O 3.31Å
788	C	73	Confident	72.4	Confident	52 Å²	52	58.4 Å²	58.4	35%	0.351	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127	172.1	-67.8	0	0	0	0	109.3	V804 D838	C788-V804 HydrophobicContact CB-CG1 4.14Å; C788-D838 PolarHBondContact N-O 3.17Å; C788-D838 PolarHBondContact O-N 3.43Å
789	C	82.5	Confident	74	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	123.4	174.8	-174.2	0	0	0	0	109.2	L805 F812 E836 M837	C789-L805 HydrophobicContact CB-CB 4.4Å; C789-L805 HydrophobicContact CB-CD1 4.44Å; C789-L805 VanDerWaalsContact O-CB 3.31Å; C789-L805 WeakPolarHBondContact O-CB 3.46Å; C789-L805 PolarHBondContact O-N 3.25Å; C789-F812 HydrophobicContact CB-CE2 4.11Å; C789-F812 HydrophobicContact CB-CZ 3.85Å; C789-E836 CarbonylContact C-O 3.6Å; C789-M837 HydrophobicContact CB-CE 4.2Å; C789-M837 HydrophobicContact CB-SD 3.48Å; C789-M837 WeakPolarHBondContact CB-SD 3.21Å; C789-M837 VanDerWaalsContact SG-SD 3.63Å
790	N	89.5	Confident	75.9	Confident	18 Å²	18	50.4 Å²	50.4	10%	0.096	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.1	175.8	-65	-31.3	0	0	0	109.9	P802 I803 L835 E836	N790-P802 HydrophobicContact CB-CB 4.19Å; N790-I803 CarbonylContact C-O 3.47Å; N790-I803 WeakPolarHBondContact CA-O 3.24Å; N790-L835 WeakPolarHBondContact O-CA 3.48Å; N790-E836 HydrophobicContact CB-CB 4.28Å; N790-E836 PolarHBondContact N-O 3.39Å; N790-E836 PolarHBondContact O-N 3.5Å
791	L	93.4	Very high	78	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.5	176.6	177.2	71.3	0	0	0	109.9	V772 V793 I803 L805 V822 V833 L835 M854	V772-L791 HydrophobicContact CG1-CD2 4.39Å; V772-L791 HydrophobicContact CG2-CD2 3.81Å; L791-V793 HydrophobicContact CD1-CG2 4.47Å; L791-V793 HydrophobicContact CD2-CG2 4.12Å; L791-V793 HydrophobicContact CG-CG2 4.06Å; L791-I803 PolarHBondContact N-O 2.98Å; L791-I803 PolarHBondContact O-N 2.83Å; L791-L805 HydrophobicContact CB-CD1 4.06Å; L791-L805 HydrophobicContact CB-CD2 4Å; L791-L805 HydrophobicContact CB-CG 3.98Å; L791-L805 HydrophobicContact CD2-CD2 4.12Å; L791-V822 HydrophobicContact CD2-CG1 4.46Å; L791-V822 HydrophobicContact CD2-CG2 4.39Å; L791-V833 HydrophobicContact CD1-CG1 3.18Å; L791-V833 HydrophobicContact CG-CG1 4.47Å; L791-L835 HydrophobicContact CB-CD2 4.45Å; L791-L835 HydrophobicContact CD1-CD2 3.59Å; L791-M854 HydrophobicContact CD2-CE 4.28Å; L791-M854 HydrophobicContact CD2-SD 4.32Å
792	T	95.5	Very high	80.2	Confident	8 Å²	8	45.7 Å²	45.7	5%	0.049	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.7	166.7	-55.8	0	0	0	0	109.7	Y794 N799 G801 P802 V833 R834	T792-Y794 HydrophobicContact CG2-CD2 4.2Å; T792-Y794 HydrophobicContact CG2-CE2 3.52Å; T792-N799 HydrophobicContact CG2-CB 4.21Å; T792-G801 WeakPolarHBondContact CG2-O 3.3Å; T792-G801 PolarHBondContact OG1-O 2.82Å; T792-P802 WeakPolarHBondContact OG1-CA 3.32Å; T792-V833 CarbonylContact O-C 3.57Å; T792-V833 WeakPolarHBondContact O-CA 3.28Å; T792-R834 PolarHBondContact N-O 2.81Å; T792-R834 PolarHBondContact O-N 3.25Å
793	V	96.3	Very high	82.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.5	-178.5	-173.9	0	0	0	0	109.1	L791 N799 T800 F824 V827 V830 V833 M854	L791-V793 HydrophobicContact CD1-CG2 4.47Å; L791-V793 HydrophobicContact CD2-CG2 4.12Å; L791-V793 HydrophobicContact CG-CG2 4.06Å; V793-N799 CarbonylContact O-C 3.59Å; V793-N799 WeakPolarHBondContact O-CA 3.25Å; V793-N799 WeakPolarHBondContact O-CB 3.27Å; V793-T800 HydrophobicContact CB-CG2 3.84Å; V793-T800 HydrophobicContact CG2-CG2 4.43Å; V793-T800 PolarHBondContact N-OG1 2.95Å; V793-T800 PolarHBondContact O-N 3.38Å; V793-F824 HydrophobicContact CB-CZ 4.22Å; V793-F824 HydrophobicContact CG1-CZ 4.24Å; V793-F824 HydrophobicContact CG2-CE1 4.05Å; V793-F824 HydrophobicContact CG2-CZ 3.98Å; V793-V827 HydrophobicContact CG1-CG2 4.11Å; V793-V830 HydrophobicContact CG1-CB 4.3Å; V793-V830 HydrophobicContact CG1-CG1 3.52Å; V793-V830 HydrophobicContact CG1-CG2 3.72Å; V793-V833 HydrophobicContact CG1-CG2 4.46Å; V793-M854 HydrophobicContact CG2-CE 3.96Å; V793-M854 HydrophobicContact CG2-SD 4.29Å
794	Y	96.8	Very high	84.2	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.7	-179.4	-69.1	-99.2	0	0	0	110.6	T792 N799 V830 F831 K832 R834 D927	T792-Y794 HydrophobicContact CG2-CD2 4.2Å; T792-Y794 HydrophobicContact CG2-CE2 3.52Å; Y794-N799 HydrophobicContact CD1-CB 3.65Å; Y794-N799 HydrophobicContact CE1-CB 3.75Å; Y794-N799 HydrophobicContact CG-CB 4.06Å; Y794-V830 CarbonylContact O-C 3.48Å; Y794-V830 VanDerWaalsContact O-CA 3.31Å; Y794-V830 WeakPolarHBondContact O-CA 3.23Å; Y794-V830 WeakPolarHBondContact O-CG1 3.39Å; Y794-F831 PolarHBondContact O-N 3.47Å; Y794-K832 WeakPolarHBondContact CB-O 3.24Å; Y794-K832 HydrophobicContact CD2-CD 4.48Å; Y794-K832 HydrophobicContact CD2-CG 4.13Å; Y794-K832 HydrophobicContact CG-CB 4.45Å; Y794-K832 HydrophobicContact CG-CG 4.43Å; Y794-K832 PolarHBondContact N-O 2.85Å; Y794-K832 PolarHBondContact O-N 3.08Å; Y794-R834 HydrophobicContact CE2-CB 3.97Å; Y794-R834 PolarHBondContact OH-NH1 2.89Å; Y794-R834 PolarHBondContact OH-NH2 3.21Å; Y794-D927 WeakPolarHBondContact CE1-OD2 3.19Å; Y794-D927 PolarHBondContact OH-OD1 2.87Å; Y794-D927 PolarHBondContact OH-OD2 3Å
795	G	94.9	Very high	86	Confident	4 Å²	4	38.4 Å²	38.4	4%	0.041	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	177.8	172.5	0	0	0	0	0	112.2	L797 G798 V827 T829 F831	G795-L797 PolarHBondContact O-N 3.23Å; G795-L797 VanDerWaalsContact O-N 3.13Å; G795-G798 PolarHBondContact N-O 3.36Å; G795-G798 PolarHBondContact O-N 2.92Å; G795-V827 CarbonylContact C-O 3.54Å; G795-V827 VanDerWaalsContact CA-O 3.26Å; G795-V827 WeakPolarHBondContact CA-O 3.48Å; G795-T829 WeakPolarHBondContact CA-O 3.29Å; G795-F831 VanDerWaalsContact O-CE1 3.31Å; G795-F831 WeakPolarHBondContact O-CE1 3.44Å
796	N	92.6	Very high	86.9	Confident	107 Å²	107	44.7 Å²	44.7	57%	0.572	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-12.7	-175	69.1	-35.3	0	0	0	114.6	V827 G828 T829	N796-V827 PolarHBondContact N-O 3.23Å; N796-G828 VanDerWaalsContact OD1-CA 3.28Å; N796-G828 WeakPolarHBondContact OD1-CA 3.36Å; N796-T829 PolarHBondContact N-O 2.82Å; N796-T829 PolarHBondContact OD1-N 2.79Å
797	L	92.5	Very high	87.2	Confident	113 Å²	113	43.4 Å²	43.4	59%	0.592	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	1.5	174.1	-57.7	179.3	0	0	0	113.7	M765 G795 V827	M765-L797 HydrophobicContact CE-CD1 4.35Å; G795-L797 PolarHBondContact O-N 3.23Å; G795-L797 VanDerWaalsContact O-N 3.13Å; L797-V827 WeakPolarHBondContact CB-O 3.45Å; L797-V827 PolarHBondContact N-O 2.75Å
798	G	92.9	Very high	86.7	Confident	35 Å²	35	55.4 Å²	55.4	36%	0.361	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.4	-153.1	179.6	0	0	0	0	0	113.2	G795	G795-G798 PolarHBondContact N-O 3.36Å; G795-G798 PolarHBondContact O-N 2.92Å
799	N	95.1	Very high	85.6	Confident	75 Å²	75	59.3 Å²	59.3	40%	0.401	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	162.4	178	73.6	82.4	0	0	0	111.9	T792 V793 Y794 G801	T792-N799 HydrophobicContact CG2-CB 4.21Å; V793-N799 CarbonylContact O-C 3.59Å; V793-N799 WeakPolarHBondContact O-CA 3.25Å; V793-N799 WeakPolarHBondContact O-CB 3.27Å; Y794-N799 HydrophobicContact CD1-CB 3.65Å; Y794-N799 HydrophobicContact CE1-CB 3.75Å; Y794-N799 HydrophobicContact CG-CB 4.06Å; N799-G801 PolarHBondContact OD1-N 3.3Å
800	T	94.6	Very high	84.1	Confident	37 Å²	37	62 Å²	62	23%	0.227	33%	0.326	C	S	.	.			trans	-80.1	-13.4	-176	57.7	0	0	0	0	114.7	V793 I803 F824 V827	V793-T800 HydrophobicContact CB-CG2 3.84Å; V793-T800 HydrophobicContact CG2-CG2 4.43Å; V793-T800 PolarHBondContact N-OG1 2.95Å; V793-T800 PolarHBondContact O-N 3.38Å; T800-I803 HydrophobicContact CG2-CD1 4.43Å; T800-F824 HydrophobicContact CG2-CB 3.85Å; T800-F824 HydrophobicContact CG2-CD1 3.92Å; T800-F824 HydrophobicContact CG2-CD2 3.37Å; T800-F824 HydrophobicContact CG2-CE1 4.27Å; T800-F824 HydrophobicContact CG2-CE2 3.8Å; T800-F824 HydrophobicContact CG2-CG 3.44Å; T800-F824 VanDerWaalsContact CG2-CG 3.44Å; T800-F824 HydrophobicContact CG2-CZ 4.22Å; T800-V827 HydrophobicContact CG2-CG1 3.74Å
801	G	92.4	Very high	82.6	Confident	20 Å²	20	66.8 Å²	66.8	21%	0.206	35%	0.346	C	S	.	.			trans	67.3	-179.4	-156.6	0	0	0	0	0	112.8	T792 N799 I803	T792-G801 WeakPolarHBondContact CG2-O 3.3Å; T792-G801 PolarHBondContact OG1-O 2.82Å; N799-G801 PolarHBondContact OD1-N 3.3Å; G801-I803 PolarHBondContact O-N 2.86Å
802	P	92	Very high	81.4	Confident	91 Å²	91	67.7 Å²	67.7	59%	0.591	35%	0.35	S	S	*	.			trans	-73.3	122.9	-179.6	29.3	-33.1	0	0	0	111.7	N790 T792	N790-P802 HydrophobicContact CB-CB 4.19Å; T792-P802 WeakPolarHBondContact OG1-CA 3.32Å
803	I	92.7	Very high	79.9	Confident	35 Å²	35	70.3 Å²	70.3	18%	0.179	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.7	173	-57.9	172.6	0	0	0	107.6	N790 L791 T800 G801 L805 V822 F824	N790-I803 CarbonylContact C-O 3.47Å; N790-I803 WeakPolarHBondContact CA-O 3.24Å; L791-I803 PolarHBondContact N-O 2.98Å; L791-I803 PolarHBondContact O-N 2.83Å; T800-I803 HydrophobicContact CG2-CD1 4.43Å; G801-I803 PolarHBondContact O-N 2.86Å; I803-L805 PolarHBondContact O-N 2.83Å; I803-V822 HydrophobicContact CG2-CB 4.24Å; I803-V822 HydrophobicContact CG2-CG1 3.85Å; I803-F824 HydrophobicContact CD1-CB 4.28Å; I803-F824 HydrophobicContact CD1-CD1 3.53Å; I803-F824 HydrophobicContact CD1-CE1 4.24Å; I803-F824 HydrophobicContact CD1-CG 4.24Å
804	V	88.6	Confident	78.5	Confident	68 Å²	68	73.1 Å²	73.1	41%	0.412	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	122.5	178.1	-164.4	0	0	0	0	109.4	C788 E806	C788-V804 HydrophobicContact CB-CG1 4.14Å; V804-E806 HydrophobicContact CB-CG 4.07Å; V804-E806 HydrophobicContact CG1-CG 3.42Å; V804-E806 VanDerWaalsContact CG1-CG 3.42Å; V804-E806 PolarHBondContact O-N 2.9Å
805	L	86	Confident	77.1	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.021	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	82.1	173.1	-58.7	-177.6	0	0	0	109	I774 C789 L791 I803 F820 V822	I774-L805 HydrophobicContact CD1-CD1 3.74Å; C789-L805 HydrophobicContact CB-CB 4.4Å; C789-L805 HydrophobicContact CB-CD1 4.44Å; C789-L805 VanDerWaalsContact O-CB 3.31Å; C789-L805 WeakPolarHBondContact O-CB 3.46Å; C789-L805 PolarHBondContact O-N 3.25Å; L791-L805 HydrophobicContact CB-CD1 4.06Å; L791-L805 HydrophobicContact CB-CD2 4Å; L791-L805 HydrophobicContact CB-CG 3.98Å; L791-L805 HydrophobicContact CD2-CD2 4.12Å; I803-L805 PolarHBondContact O-N 2.83Å; L805-F820 HydrophobicContact CB-CD1 3.79Å; L805-F820 HydrophobicContact CB-CD2 4.37Å; L805-F820 HydrophobicContact CB-CE1 3.89Å; L805-F820 HydrophobicContact CB-CE2 4.46Å; L805-F820 HydrophobicContact CB-CG 4.03Å; L805-F820 HydrophobicContact CB-CZ 4.23Å; L805-F820 HydrophobicContact CD1-CD2 4.04Å; L805-F820 HydrophobicContact CD1-CE2 4.22Å; L805-F820 HydrophobicContact CD1-CG 4.39Å; L805-F820 HydrophobicContact CD2-CB 3.95Å; L805-F820 HydrophobicContact CD2-CD2 4.44Å; L805-F820 HydrophobicContact CD2-CG 4.05Å; L805-F820 HydrophobicContact CG-CG 4.39Å; L805-V822 HydrophobicContact CD2-CG1 3.6Å
806	E	71.3	Confident	76.2	Confident	146 Å²	146	82.8 Å²	82.8	68%	0.682	43%	0.426	S	S	*	.			trans	-92	126.2	178.2	-59.3	-172	167.9	0	0	111.7	V804	V804-E806 HydrophobicContact CB-CG 4.07Å; V804-E806 HydrophobicContact CG1-CG 3.42Å; V804-E806 VanDerWaalsContact CG1-CG 3.42Å; V804-E806 PolarHBondContact O-N 2.9Å
807	E	59.9	Low	75.6	Confident	90 Å²	90	81.4 Å²	81.4	42%	0.421	42%	0.421	S	S	.	.			trans	-122.4	146.9	159.9	-96.9	-165.8	158.3	0	0	110.6	N809 N810 F820	E807-N809 PolarHBondContact O-N 2.82Å; E807-N810 PolarHBondContact N-OD1 3.04Å; E807-N810 PolarHBondContact O-N 3.1Å; E807-N810 PolarHBondContact O-OD1 2.95Å; E807-N810 VanDerWaalsContact O-OD1 3.13Å; E807-F820 HydrophobicContact CB-CE1 4.29Å; E807-F820 HydrophobicContact CG-CD1 4.17Å; E807-F820 HydrophobicContact CG-CE1 4.04Å
808	R	49.2	Very low	75.2	Confident	256 Å²	256	76.7 Å²	76.7	97%	0.966	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-19.7	174.6	-70.9	-175.6	178.9	-174.9	-0.4	113.4
809	N	50.1	Low	75	Confident	134 Å²	134	77.7 Å²	77.7	72%	0.717	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	61.5	179.9	-71.9	-27	0	0	0	110.7	E807 K811	E807-N809 PolarHBondContact O-N 2.82Å; N809-K811 VanDerWaalsContact C-N 3.28Å; N809-K811 PolarHBondContact O-N 2.8Å
810	N	50.4	Low	74.7	Confident	56 Å²	56	74.8 Å²	74.8	30%	0.299	38%	0.381	S	S	.	.			trans	-52.6	77.2	175.6	-84.6	-11.8	0	0	0	113.9	E807	E807-N810 PolarHBondContact N-OD1 3.04Å; E807-N810 PolarHBondContact O-N 3.1Å; E807-N810 PolarHBondContact O-OD1 2.95Å; E807-N810 VanDerWaalsContact O-OD1 3.13Å
811	K	58.2	Low	74.6	Confident	120 Å²	120	79.5 Å²	79.5	52%	0.522	40%	0.401	S	S	.	.			trans	-137	90.5	172	-60	-171.7	176.8	-171.5	0	108.3	T784 N809 M813	T784-K811 HydrophobicContact CG2-CB 4.1Å; T784-K811 HydrophobicContact CG2-CD 3.62Å; T784-K811 HydrophobicContact CG2-CG 3.61Å; N809-K811 VanDerWaalsContact C-N 3.28Å; N809-K811 PolarHBondContact O-N 2.8Å; K811-M813 HydrophobicContact CB-CE 3.82Å; K811-M813 HydrophobicContact CB-CG 3.75Å; K811-M813 HydrophobicContact CD-CE 3.42Å; K811-M813 VanDerWaalsContact CD-CE 3.42Å; K811-M813 HydrophobicContact CG-CE 4.22Å; K811-M813 PolarHBondContact O-N 2.87Å
812	F	68.4	Low	74.6	Confident	18 Å²	18	79 Å²	79	8%	0.079	39%	0.394	C	S	.	.			trans	-60.6	81.3	159	-65.3	-75.9	0	0	0	108	I774 V785 C789 A818 F820 W847	I774-F812 HydrophobicContact CB-CE1 4.49Å; I774-F812 HydrophobicContact CD1-CE1 4.31Å; I774-F812 HydrophobicContact CG2-CD1 4.34Å; I774-F812 HydrophobicContact CG2-CE1 4.13Å; V785-F812 HydrophobicContact CB-CD2 4.17Å; V785-F812 HydrophobicContact CG1-CD2 4.35Å; C789-F812 HydrophobicContact CB-CE2 4.11Å; C789-F812 HydrophobicContact CB-CZ 3.85Å; F812-A818 HydrophobicContact CD1-CB 4.06Å; F812-A818 HydrophobicContact CE1-CB 4.1Å; F812-F820 AromaticContact CE1-CE2 3.97Å; F812-F820 HydrophobicContact CE1-CE2 3.97Å; F812-F820 AromaticContact CE1-CZ 3.83Å; F812-F820 HydrophobicContact CE1-CZ 3.83Å; F812-F820 HydrophobicContact CZ-CE2 4.34Å; F812-F820 AromaticContact CZ-CZ 3.89Å; F812-F820 HydrophobicContact CZ-CZ 3.89Å; F812-W847 HydrophobicContact CD1-CZ2 4.24Å; F812-W847 HydrophobicContact CE1-CZ2 4.35Å
813	M	64.2	Low	74.7	Confident	64 Å²	64	78.3 Å²	78.3	32%	0.315	39%	0.391	S	S	.	.			trans	-80.5	145.2	-177.5	-69.6	-173.5	172.4	0	0	109.9	K811 N815 K816	K811-M813 HydrophobicContact CB-CE 3.82Å; K811-M813 HydrophobicContact CB-CG 3.75Å; K811-M813 HydrophobicContact CD-CE 3.42Å; K811-M813 VanDerWaalsContact CD-CE 3.42Å; K811-M813 HydrophobicContact CG-CE 4.22Å; K811-M813 PolarHBondContact O-N 2.87Å; M813-N815 PolarHBondContact O-N 3.06Å; M813-K816 HydrophobicContact CB-CB 4.02Å; M813-K816 HydrophobicContact CB-CD 3.81Å; M813-K816 HydrophobicContact CB-CG 3.85Å; M813-K816 HydrophobicContact CG-CD 4.3Å; M813-K816 PolarHBondContact O-N 2.98Å; M813-K816 VanDerWaalsContact O-N 3.16Å; M813-K816 HydrophobicContact SD-CD 3.74Å; M813-K816 VanDerWaalsContact SD-CE 3.58Å; M813-K816 PolarHBondContact SD-NZ 3.1Å
814	P	65.4	Low	74.8	Confident	58 Å²	58	77.5 Å²	77.5	38%	0.377	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	136.6	173	-23.4	32.6	0	0	0	111.6	V780 K816	V780-P814 HydrophobicContact CB-CG 4.01Å; V780-P814 HydrophobicContact CG2-CB 4.31Å; V780-P814 HydrophobicContact CG2-CG 3.94Å; P814-K816 PolarHBondContact O-N 2.94Å
815	N	68	Low	74.9	Confident	88 Å²	88	81.3 Å²	81.3	47%	0.471	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	12.4	-179.5	-62.3	-29.6	0	0	0	115.7	S776 E778 M813	S776-N815 WeakPolarHBondContact O-CA 3.05Å; S776-N815 PolarHBondContact O-N 2.93Å; E778-N815 PolarHBondContact N-OD1 2.82Å; M813-N815 PolarHBondContact O-N 3.06Å
816	K	74.9	Confident	75.1	Confident	124 Å²	124	82.5 Å²	82.5	54%	0.539	41%	0.406	S	S	.	.			trans	-100.8	148.1	169.9	-63.4	-159.9	-176.7	175.1	0	110.8	M813 P814	M813-K816 HydrophobicContact CB-CB 4.02Å; M813-K816 HydrophobicContact CB-CD 3.81Å; M813-K816 HydrophobicContact CB-CG 3.85Å; M813-K816 HydrophobicContact CG-CD 4.3Å; M813-K816 PolarHBondContact O-N 2.98Å; M813-K816 VanDerWaalsContact O-N 3.16Å; M813-K816 HydrophobicContact SD-CD 3.74Å; M813-K816 VanDerWaalsContact SD-CE 3.58Å; M813-K816 PolarHBondContact SD-NZ 3.1Å; P814-K816 PolarHBondContact O-N 2.94Å
817	V	81.6	Confident	76	Confident	78 Å²	78	76 Å²	76	47%	0.473	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	115.1	172.2	-173.7	0	0	0	0	107.6	F773 I774 T775 V819	F773-V817 HydrophobicContact CB-CG1 3.99Å; F773-V817 HydrophobicContact CD1-CG1 4.09Å; I774-V817 WeakPolarHBondContact O-CA 3.43Å; T775-V817 HydrophobicContact CG2-CG2 4.29Å; V817-V819 HydrophobicContact CG1-CG2 4.15Å
818	A	83.2	Confident	77.5	Confident	14 Å²	14	72.9 Å²	72.9	12%	0.116	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.3	168.5	0	0	0	0	0	109	F773 I774 F812 F820	F773-A818 CarbonylContact C-O 3.57Å; F773-A818 WeakPolarHBondContact CA-O 3.45Å; I774-A818 HydrophobicContact CB-CB 4.46Å; I774-A818 PolarHBondContact N-O 3.24Å; I774-A818 PolarHBondContact O-N 3.37Å; F812-A818 HydrophobicContact CD1-CB 4.06Å; F812-A818 HydrophobicContact CE1-CB 4.1Å; A818-F820 HydrophobicContact CB-CE2 3.66Å; A818-F820 HydrophobicContact CB-CZ 3.88Å
819	V	88.5	Confident	79.4	Confident	56 Å²	56	64 Å²	64	34%	0.339	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	118	-174.7	-176.3	0	0	0	0	109.6	V772 F773 V817	V772-V819 CarbonylContact O-C 3.57Å; V772-V819 VanDerWaalsContact O-CA 3.28Å; V772-V819 WeakPolarHBondContact O-CA 3.29Å; F773-V819 HydrophobicContact CD1-CB 4.49Å; F773-V819 HydrophobicContact CD1-CG1 4.19Å; F773-V819 HydrophobicContact CD1-CG2 3.64Å; F773-V819 HydrophobicContact CE1-CG1 3.94Å; F773-V819 HydrophobicContact CE1-CG2 3.92Å; F773-V819 HydrophobicContact CZ-CG1 4.39Å; V817-V819 HydrophobicContact CG1-CG2 4.15Å
820	F	90.1	Very high	81.5	Confident	13 Å²	13	57.7 Å²	57.7	6%	0.057	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	153.2	178.5	-51.8	-86.6	0	0	0	110.2	K771 V772 I774 L805 E807 F812 A818	K771-F820 CarbonylContact C-O 3.59Å; K771-F820 VanDerWaalsContact CA-O 3.25Å; K771-F820 WeakPolarHBondContact CA-O 3.38Å; V772-F820 HydrophobicContact CB-CB 4.23Å; V772-F820 HydrophobicContact CB-CD2 4.48Å; V772-F820 PolarHBondContact N-O 2.83Å; V772-F820 PolarHBondContact O-N 2.85Å; I774-F820 HydrophobicContact CD1-CD2 4.24Å; I774-F820 HydrophobicContact CD1-CE2 3.9Å; I774-F820 HydrophobicContact CG1-CD2 4.49Å; I774-F820 HydrophobicContact CG1-CE2 4.28Å; L805-F820 HydrophobicContact CB-CD1 3.79Å; L805-F820 HydrophobicContact CB-CD2 4.37Å; L805-F820 HydrophobicContact CB-CE1 3.89Å; L805-F820 HydrophobicContact CB-CE2 4.46Å; L805-F820 HydrophobicContact CB-CG 4.03Å; L805-F820 HydrophobicContact CB-CZ 4.23Å; L805-F820 HydrophobicContact CD1-CD2 4.04Å; L805-F820 HydrophobicContact CD1-CE2 4.22Å; L805-F820 HydrophobicContact CD1-CG 4.39Å; L805-F820 HydrophobicContact CD2-CB 3.95Å; L805-F820 HydrophobicContact CD2-CD2 4.44Å; L805-F820 HydrophobicContact CD2-CG 4.05Å; L805-F820 HydrophobicContact CG-CG 4.39Å; E807-F820 HydrophobicContact CB-CE1 4.29Å; E807-F820 HydrophobicContact CG-CD1 4.17Å; E807-F820 HydrophobicContact CG-CE1 4.04Å; F812-F820 AromaticContact CE1-CE2 3.97Å; F812-F820 HydrophobicContact CE1-CE2 3.97Å; F812-F820 AromaticContact CE1-CZ 3.83Å; F812-F820 HydrophobicContact CE1-CZ 3.83Å; F812-F820 HydrophobicContact CZ-CE2 4.34Å; F812-F820 AromaticContact CZ-CZ 3.89Å; F812-F820 HydrophobicContact CZ-CZ 3.89Å; A818-F820 HydrophobicContact CB-CE2 3.66Å; A818-F820 HydrophobicContact CB-CZ 3.88Å
821	Q	91.7	Very high	83.6	Confident	137 Å²	137	56.6 Å²	56.6	64%	0.64	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.1	169.4	-174.5	176	-62.1	0	0	108.8	V769 W770 I857	V769-Q821 HydrophobicContact CG1-CG 3.72Å; W770-Q821 WeakPolarHBondContact O-CA 3.4Å; Q821-I857 HydrophobicContact CG-CD1 4.05Å
822	V	93.2	Very high	85.4	Confident	8 Å²	8	50.9 Å²	50.9	5%	0.048	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.9	-179.7	-60	0	0	0	0	109.8	W770 V772 L791 I803 L805 F824 M854	W770-V822 HydrophobicContact CB-CG2 3.92Å; W770-V822 PolarHBondContact N-O 3.47Å; W770-V822 PolarHBondContact O-N 2.84Å; V772-V822 HydrophobicContact CG2-CG1 4.17Å; V772-V822 HydrophobicContact CG2-CG2 3.69Å; L791-V822 HydrophobicContact CD2-CG1 4.46Å; L791-V822 HydrophobicContact CD2-CG2 4.39Å; I803-V822 HydrophobicContact CG2-CB 4.24Å; I803-V822 HydrophobicContact CG2-CG1 3.85Å; L805-V822 HydrophobicContact CD2-CG1 3.6Å; V822-F824 HydrophobicContact CG2-CD1 4.14Å; V822-F824 HydrophobicContact CG2-CE1 3.76Å; V822-M854 HydrophobicContact CG2-CE 4.44Å
823	S	92.8	Very high	86.6	Confident	78 Å²	78	50 Å²	50	55%	0.545	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133	176.4	55.9	0	0	0	0	110.7	E768	E768-S823 VanDerWaalsContact O-CA 3.29Å; E768-S823 WeakPolarHBondContact O-CA 3.37Å
824	F	94.2	Very high	88	Confident	18 Å²	18	48 Å²	48	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	162.1	-180	51.1	-99.4	0	0	0	111	E768 W770 V793 T800 I803 V822 V827 M854	E768-F824 PolarHBondContact N-O 3.41Å; E768-F824 PolarHBondContact O-N 3.34Å; E768-F824 VanDerWaalsContact O-N 3.09Å; W770-F824 AromaticContact CD1-CE1 3.81Å; W770-F824 AromaticContact CD1-CE2 3.94Å; W770-F824 AromaticContact CD1-CZ 3.43Å; W770-F824 VanDerWaalsContact CD1-CZ 3.43Å; W770-F824 HydrophobicContact CG-CE1 4.33Å; W770-F824 HydrophobicContact CG-CZ 4.07Å; W770-F824 AromaticContact NE1-CE2 3.85Å; W770-F824 AromaticContact NE1-CZ 3.7Å; V793-F824 HydrophobicContact CB-CZ 4.22Å; V793-F824 HydrophobicContact CG1-CZ 4.24Å; V793-F824 HydrophobicContact CG2-CE1 4.05Å; V793-F824 HydrophobicContact CG2-CZ 3.98Å; T800-F824 HydrophobicContact CG2-CB 3.85Å; T800-F824 HydrophobicContact CG2-CD1 3.92Å; T800-F824 HydrophobicContact CG2-CD2 3.37Å; T800-F824 HydrophobicContact CG2-CE1 4.27Å; T800-F824 HydrophobicContact CG2-CE2 3.8Å; T800-F824 HydrophobicContact CG2-CG 3.44Å; T800-F824 VanDerWaalsContact CG2-CG 3.44Å; T800-F824 HydrophobicContact CG2-CZ 4.22Å; I803-F824 HydrophobicContact CD1-CB 4.28Å; I803-F824 HydrophobicContact CD1-CD1 3.53Å; I803-F824 HydrophobicContact CD1-CE1 4.24Å; I803-F824 HydrophobicContact CD1-CG 4.24Å; V822-F824 HydrophobicContact CG2-CD1 4.14Å; V822-F824 HydrophobicContact CG2-CE1 3.76Å; F824-V827 HydrophobicContact CE2-CG2 4.43Å; F824-M854 HydrophobicContact CE1-CE 4.3Å; F824-M854 HydrophobicContact CZ-CE 4.27Å
825	K	90.9	Very high	89.2	Confident	147 Å²	147	45.2 Å²	45.2	64%	0.639	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	139.3	173.1	-67.8	-177.3	179.2	179.8	0	109.8	V827	K825-V827 PolarHBondContact O-N 3.28Å
826	S	90.2	Very high	90.1	Very high	30 Å²	30	41.9 Å²	41.9	21%	0.21	23%	0.226	C	C	.	.			trans	-49.3	124.1	179.2	-167.2	0	0	0	0	112.3	E768 G828	E768-S826 WeakPolarHBondContact OE1-CB 3.13Å; E768-S826 PolarHBondContact OE1-OG 2.72Å; S826-G828 VanDerWaalsContact C-N 3.28Å; S826-G828 PolarHBondContact OG-N 3.2Å
827	V	91.7	Very high	90.3	Very high	8 Å²	8	36 Å²	36	5%	0.048	20%	0.2	C	C	.	.			trans	-93	12	173.1	-64.1	0	0	0	0	112	V793 G795 N796 L797 T800 F824 K825 V830	V793-V827 HydrophobicContact CG1-CG2 4.11Å; G795-V827 CarbonylContact C-O 3.54Å; G795-V827 VanDerWaalsContact CA-O 3.26Å; G795-V827 WeakPolarHBondContact CA-O 3.48Å; N796-V827 PolarHBondContact N-O 3.23Å; L797-V827 WeakPolarHBondContact CB-O 3.45Å; L797-V827 PolarHBondContact N-O 2.75Å; T800-V827 HydrophobicContact CG2-CG1 3.74Å; F824-V827 HydrophobicContact CE2-CG2 4.43Å; K825-V827 PolarHBondContact O-N 3.28Å; V827-V830 HydrophobicContact CG2-CG2 3.91Å
828	G	89.7	Confident	89.9	Confident	25 Å²	25	35.6 Å²	35.6	26%	0.258	20%	0.195	S	C	.	.	S	Bend	trans	73.9	-143.5	-174	0	0	0	0	0	112.5	N796 S826 V830	N796-G828 VanDerWaalsContact OD1-CA 3.28Å; N796-G828 WeakPolarHBondContact OD1-CA 3.36Å; S826-G828 VanDerWaalsContact C-N 3.28Å; S826-G828 PolarHBondContact OG-N 3.2Å; G828-V830 PolarHBondContact O-N 2.79Å
829	T	90.3	Very high	89.1	Confident	70 Å²	70	36 Å²	36	43%	0.429	20%	0.196	S	C	.	.	S	Bend	trans	-74.5	110.9	179.1	-56.3	0	0	0	0	109.4	G795 N796	G795-T829 WeakPolarHBondContact CA-O 3.29Å; N796-T829 PolarHBondContact N-O 2.82Å; N796-T829 PolarHBondContact OD1-N 2.79Å
830	V	94.3	Very high	87.6	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.4	178.3	-176.4	0	0	0	0	109.9	V793 Y794 V827 G828 V833 F863 V886 W888	V793-V830 HydrophobicContact CG1-CB 4.3Å; V793-V830 HydrophobicContact CG1-CG1 3.52Å; V793-V830 HydrophobicContact CG1-CG2 3.72Å; Y794-V830 CarbonylContact O-C 3.48Å; Y794-V830 VanDerWaalsContact O-CA 3.31Å; Y794-V830 WeakPolarHBondContact O-CA 3.23Å; Y794-V830 WeakPolarHBondContact O-CG1 3.39Å; V827-V830 HydrophobicContact CG2-CG2 3.91Å; G828-V830 PolarHBondContact O-N 2.79Å; V830-V833 HydrophobicContact CG1-CG2 4.45Å; V830-F863 HydrophobicContact CB-CE1 4.03Å; V830-F863 HydrophobicContact CB-CZ 4.19Å; V830-F863 HydrophobicContact CG1-CE1 4.12Å; V830-F863 HydrophobicContact CG1-CE2 4.21Å; V830-F863 HydrophobicContact CG1-CZ 3.75Å; V830-F863 HydrophobicContact CG2-CE1 3.99Å; V830-F863 HydrophobicContact CG2-CZ 4.33Å; V830-V886 HydrophobicContact CG1-CB 4.48Å; V830-V886 HydrophobicContact CG1-CG2 3.92Å; V830-W888 PolarHBondContact O-NE1 3Å
831	F	94.5	Very high	86	Confident	32 Å²	32	42.3 Å²	42.3	14%	0.14	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	-14.3	177.4	56.5	-109.4	0	0	0	113.4	Y794 G795 V886 L894 H925	Y794-F831 PolarHBondContact O-N 3.47Å; G795-F831 VanDerWaalsContact O-CE1 3.31Å; G795-F831 WeakPolarHBondContact O-CE1 3.44Å; F831-V886 PolarHBondContact O-N 3.25Å; F831-L894 HydrophobicContact CB-CD1 4.07Å; F831-L894 HydrophobicContact CB-CG 4.45Å; F831-L894 HydrophobicContact CD2-CD1 3.51Å; F831-L894 HydrophobicContact CE2-CD1 4.23Å; F831-L894 HydrophobicContact CG-CD1 3.97Å; F831-H925 HydrophobicContact CD2-CB 4.5Å; F831-H925 HydrophobicContact CE2-CB 3.81Å; F831-H925 WeakPolarHBondContact CE2-O 3.43Å; F831-H925 HydrophobicContact CZ-CB 3.92Å; F831-H925 WeakPolarHBondContact CZ-O 3.4Å
832	K	95.1	Very high	84.3	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	148.7	-178.1	171.2	174.6	91.5	171.7	0	111.3	Y794 E883 L884 D927 V956	Y794-K832 WeakPolarHBondContact CB-O 3.24Å; Y794-K832 HydrophobicContact CD2-CD 4.48Å; Y794-K832 HydrophobicContact CD2-CG 4.13Å; Y794-K832 HydrophobicContact CG-CB 4.45Å; Y794-K832 HydrophobicContact CG-CG 4.43Å; Y794-K832 PolarHBondContact N-O 2.85Å; Y794-K832 PolarHBondContact O-N 3.08Å; K832-E883 HydrophobicContact CD-CB 4.16Å; K832-E883 HydrophobicContact CD-CG 4.38Å; K832-E883 WeakPolarHBondContact CD-OE2 3.18Å; K832-E883 VanDerWaalsContact NZ-CD 3.3Å; K832-E883 IonicContact NZ-OE1 2.87Å; K832-E883 PolarHBondContact NZ-OE1 2.86Å; K832-E883 IonicContact NZ-OE2 2.87Å; K832-E883 PolarHBondContact NZ-OE2 3.21Å; K832-L884 WeakPolarHBondContact CA-O 3.26Å; K832-D927 PolarHBondContact NZ-O 2.83Å; K832-V956 HydrophobicContact CB-CG1 4.38Å; K832-V956 HydrophobicContact CD-CB 3.51Å; K832-V956 HydrophobicContact CD-CG1 3.88Å; K832-V956 HydrophobicContact CD-CG2 3.94Å; K832-V956 HydrophobicContact CG-CB 4.27Å; K832-V956 HydrophobicContact CG-CG1 4.39Å; K832-V956 HydrophobicContact CG-CG2 4.27Å
833	V	94.9	Very high	82.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.2	170	171.8	0	0	0	0	108.7	L791 T792 V793 V830 L835 M854 F863 I865 L884 V886	L791-V833 HydrophobicContact CD1-CG1 3.18Å; L791-V833 HydrophobicContact CG-CG1 4.47Å; T792-V833 CarbonylContact O-C 3.57Å; T792-V833 WeakPolarHBondContact O-CA 3.28Å; V793-V833 HydrophobicContact CG1-CG2 4.46Å; V830-V833 HydrophobicContact CG1-CG2 4.45Å; V833-L835 HydrophobicContact CG1-CD2 4.48Å; V833-M854 HydrophobicContact CG2-SD 4.26Å; V833-F863 HydrophobicContact CG2-CE2 4.11Å; V833-F863 HydrophobicContact CG2-CZ 4.42Å; V833-I865 HydrophobicContact CB-CD1 3.91Å; V833-I865 HydrophobicContact CG2-CD1 4.03Å; V833-L884 PolarHBondContact N-O 3.2Å; V833-L884 PolarHBondContact O-N 3.25Å; V833-V886 HydrophobicContact CG2-CG2 3.91Å
834	R	92.8	Very high	80.9	Confident	20 Å²	20	55.9 Å²	55.9	8%	0.075	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.1	168.9	-178.8	-176.4	-63	156.5	7.9	109.5	T792 Y794 I882 E883 D927 S928 G929	T792-R834 PolarHBondContact N-O 2.81Å; T792-R834 PolarHBondContact O-N 3.25Å; Y794-R834 HydrophobicContact CE2-CB 3.97Å; Y794-R834 PolarHBondContact OH-NH1 2.89Å; Y794-R834 PolarHBondContact OH-NH2 3.21Å; R834-I882 CarbonylContact C-O 3.55Å; R834-I882 VanDerWaalsContact CA-O 3.27Å; R834-I882 WeakPolarHBondContact CA-O 3.15Å; R834-E883 HydrophobicContact CG-CG 4.49Å; R834-E883 IonicContact CZ-OE1 3.63Å; R834-E883 IonicContact NE-OE1 3.55Å; R834-E883 PolarHBondContact NE-OE1 3.06Å; R834-E883 IonicContact NH2-OE1 3.66Å; R834-E883 PolarHBondContact NH2-OE1 3.13Å; R834-D927 IonicContact CZ-OD1 2.73Å; R834-D927 VanDerWaalsContact CZ-OD1 3.24Å; R834-D927 IonicContact NH1-OD1 3.75Å; R834-D927 PolarHBondContact NH1-OD1 3.21Å; R834-D927 PolarHBondContact NH2-O 3.3Å; R834-D927 IonicContact NH2-OD1 2.85Å; R834-D927 PolarHBondContact NH2-OD1 3.26Å; R834-D927 IonicContact NH2-OD2 3.94Å; R834-S928 PolarHBondContact NH2-O 3.3Å; R834-G929 VanDerWaalsContact NH1-CA 3.28Å
835	L	90	Very high	79.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.8	166.5	-63.6	177.2	0	0	0	108.2	N790 L791 V833 W847 L849 V852 S881 I882 L884	N790-L835 WeakPolarHBondContact O-CA 3.48Å; L791-L835 HydrophobicContact CB-CD2 4.45Å; L791-L835 HydrophobicContact CD1-CD2 3.59Å; V833-L835 HydrophobicContact CG1-CD2 4.48Å; L835-W847 HydrophobicContact CD1-CH2 3.92Å; L835-W847 HydrophobicContact CD1-CZ3 4.08Å; L835-L849 HydrophobicContact CD1-CD2 3.89Å; L835-V852 HydrophobicContact CD1-CG2 4.33Å; L835-S881 CarbonylContact O-C 3.53Å; L835-S881 VanDerWaalsContact O-CA 3.3Å; L835-S881 WeakPolarHBondContact O-CA 3.32Å; L835-I882 HydrophobicContact CB-CG2 4.11Å; L835-I882 PolarHBondContact N-O 3.45Å; L835-I882 PolarHBondContact O-N 2.72Å; L835-L884 HydrophobicContact CD1-CD1 3.87Å; L835-L884 HydrophobicContact CG-CD1 4.34Å
836	E	86.8	Confident	78.4	Confident	19 Å²	19	49.4 Å²	49.4	9%	0.089	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.2	176.6	177.4	177.3	-144.9	0	0	108.8	C789 N790 R879 P880	C789-E836 CarbonylContact C-O 3.6Å; N790-E836 HydrophobicContact CB-CB 4.28Å; N790-E836 PolarHBondContact N-O 3.39Å; N790-E836 PolarHBondContact O-N 3.5Å; E836-R879 IonicContact OE1-CZ 3.44Å; E836-R879 IonicContact OE1-NE 3.56Å; E836-R879 IonicContact OE1-NH1 2.59Å; E836-R879 PolarHBondContact OE1-NH1 3.33Å; E836-R879 IonicContact OE1-NH2 3.74Å; E836-R879 PolarHBondContact OE1-NH2 3.07Å; E836-R879 IonicContact OE2-CZ 3.57Å; E836-R879 IonicContact OE2-NH1 2.62Å; E836-R879 IonicContact OE2-NH2 2.85Å; E836-R879 PolarHBondContact OE2-NH2 2.85Å; E836-P880 WeakPolarHBondContact CA-O 3.11Å
837	M	79.8	Confident	77.5	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	135	176.6	-66	-63.9	-50.3	0	0	109.2	V785 C789 T839 M845 W847 M872 R879 P880	V785-M837 HydrophobicContact CG1-CE 3.33Å; C789-M837 HydrophobicContact CB-CE 4.2Å; C789-M837 HydrophobicContact CB-SD 3.48Å; C789-M837 WeakPolarHBondContact CB-SD 3.21Å; C789-M837 VanDerWaalsContact SG-SD 3.63Å; M837-T839 HydrophobicContact CB-CG2 4.45Å; M837-M845 HydrophobicContact CE-CE 4.41Å; M837-W847 HydrophobicContact CG-CE3 4.31Å; M837-W847 HydrophobicContact CG-CZ3 4.41Å; M837-W847 HydrophobicContact SD-CE3 4.31Å; M837-W847 HydrophobicContact SD-CZ3 4.05Å; M837-M872 HydrophobicContact CB-CE 3.96Å; M837-M872 HydrophobicContact CG-CE 3.57Å; M837-M872 HydrophobicContact CG-SD 4.05Å; M837-R879 WeakPolarHBondContact O-CA 3.22Å; M837-P880 HydrophobicContact CB-CG 4.16Å; M837-P880 PolarHBondContact N-O 2.82Å; M837-P880 WeakPolarHBondContact O-CD 3.37Å
838	D	73.9	Confident	76.7	Confident	69 Å²	69	50.3 Å²	50.3	37%	0.369	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	109	165.8	-164.3	5.2	0	0	0	108.8	G787 C788	G787-D838 WeakPolarHBondContact CA-O 3.31Å; C788-D838 PolarHBondContact N-O 3.17Å; C788-D838 PolarHBondContact O-N 3.43Å
839	T	65.2	Low	76.2	Confident	21 Å²	21	49.1 Å²	49.1	13%	0.129	24%	0.24	C	C	.	.			trans	-106.6	111.3	177.8	60	0	0	0	0	109.1	M837 D841 M845 S878	M837-T839 HydrophobicContact CB-CG2 4.45Å; T839-D841 VanDerWaalsContact C-N 3.3Å; T839-M845 HydrophobicContact CG2-SD 4.2Å; T839-S878 PolarHBondContact N-O 3.07Å; T839-S878 PolarHBondContact OG1-O 3.15Å
840	T	57.4	Low	75.7	Confident	126 Å²	126	50.7 Å²	50.7	77%	0.773	24%	0.238	S	C	*	.			trans	-80.4	-14.4	169.3	49	0	0	0	0	112.7
841	D	57	Low	75.2	Confident	77 Å²	77	51.3 Å²	51.3	41%	0.412	24%	0.241	S	C	.	.			trans	-83.8	129.3	-177.5	-161.3	-13.7	0	0	0	110.9	T839 R843	T839-D841 VanDerWaalsContact C-N 3.3Å; D841-R843 PolarHBondContact O-N 3.34Å; D841-R843 WeakPolarHBondContact OD1-CG 3.16Å; D841-R843 PolarHBondContact OD1-N 3.28Å
842	E	54.7	Low	75	Confident	198 Å²	198	49.8 Å²	49.8	93%	0.925	23%	0.234	S	C	*	.			trans	-68.9	-8.4	176.6	-66.9	-171.2	167	0	0	112.9
843	R	58.2	Low	74.8	Confident	180 Å²	180	50.9 Å²	50.9	68%	0.679	24%	0.239	S	C	*	.	S	Bend	trans	-69.5	133.6	177.3	-66.9	176.2	-177.5	-165.3	1	111.2	D841 M845 S874	D841-R843 PolarHBondContact O-N 3.34Å; D841-R843 WeakPolarHBondContact OD1-CG 3.16Å; D841-R843 PolarHBondContact OD1-N 3.28Å; R843-M845 PolarHBondContact O-N 2.92Å; R843-S874 PolarHBondContact O-OG 2.72Å
844	Q	57.6	Low	74.8	Confident	129 Å²	129	50.9 Å²	50.9	60%	0.603	24%	0.239	S	C	*	.			trans	-57.7	107.5	171.8	-73	-171.5	-17.7	0	0	110.2	F782 S874 D875	F782-Q844 WeakPolarHBondContact CE1-O 3.28Å; F782-Q844 WeakPolarHBondContact CZ-O 3.48Å; Q844-S874 WeakPolarHBondContact CA-OG 3.28Å; Q844-D875 WeakPolarHBondContact CB-OD1 3.47Å; Q844-D875 VanDerWaalsContact CG-OD1 3.23Å; Q844-D875 WeakPolarHBondContact CG-OD1 3.37Å
845	M	64.5	Low	74.9	Confident	11 Å²	11	52 Å²	52	5%	0.054	24%	0.244	C	C	.	.			trans	-95.1	135.5	-179.8	-177.1	-115	-176.8	0	0	110.4	F782 V785 M837 T839 R843 W847 K873 S874	F782-M845 HydrophobicContact CD1-CG 4.45Å; F782-M845 HydrophobicContact CE1-CB 4.28Å; V785-M845 HydrophobicContact CB-CE 4.13Å; V785-M845 HydrophobicContact CG1-CE 3.62Å; V785-M845 HydrophobicContact CG2-CE 3.35Å; M837-M845 HydrophobicContact CE-CE 4.41Å; T839-M845 HydrophobicContact CG2-SD 4.2Å; R843-M845 PolarHBondContact O-N 2.92Å; M845-W847 HydrophobicContact CE-CB 3.75Å; M845-W847 HydrophobicContact CE-CG 4.35Å; M845-K873 CarbonylContact O-C 3.53Å; M845-K873 WeakPolarHBondContact O-CA 3.42Å; M845-S874 PolarHBondContact N-OG 2.84Å; M845-S874 PolarHBondContact O-N 2.98Å
846	T	67.5	Low	75	Confident	19 Å²	19	52.2 Å²	52.2	12%	0.117	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	111.6	178.5	-57.5	0	0	0	0	110	F782 Y848 L870 M872 K873	F782-T846 WeakPolarHBondContact CD2-O 3.13Å; F782-T846 VanDerWaalsContact CE2-CA 3.49Å; F782-T846 VanDerWaalsContact CE2-CB 3.49Å; F782-T846 WeakPolarHBondContact CE2-O 3.28Å; T846-Y848 HydrophobicContact CG2-CD2 4.24Å; T846-Y848 HydrophobicContact CG2-CE2 3.49Å; T846-Y848 VanDerWaalsContact CG2-CE2 3.49Å; T846-L870 HydrophobicContact CG2-CD1 3.14Å; T846-L870 HydrophobicContact CG2-CD2 4.14Å; T846-L870 HydrophobicContact CG2-CG 4.27Å; T846-M872 CarbonylContact C-O 3.6Å; T846-M872 VanDerWaalsContact CA-O 3.26Å; T846-M872 WeakPolarHBondContact CA-O 3.31Å; T846-K873 HydrophobicContact CG2-CG 3.99Å
847	W	72	Confident	75.3	Confident	6 Å²	6	54.9 Å²	54.9	2%	0.023	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.1	-179.7	-172.5	24	0	0	0	112.9	I774 S776 F812 L835 M837 M845 L849 L870 L871 M872	I774-W847 HydrophobicContact CG2-CH2 3.97Å; I774-W847 HydrophobicContact CG2-CZ2 3.55Å; S776-W847 PolarHBondContact OG-NE1 2.81Å; F812-W847 HydrophobicContact CD1-CZ2 4.24Å; F812-W847 HydrophobicContact CE1-CZ2 4.35Å; L835-W847 HydrophobicContact CD1-CH2 3.92Å; L835-W847 HydrophobicContact CD1-CZ3 4.08Å; M837-W847 HydrophobicContact CG-CE3 4.31Å; M837-W847 HydrophobicContact CG-CZ3 4.41Å; M837-W847 HydrophobicContact SD-CE3 4.31Å; M837-W847 HydrophobicContact SD-CZ3 4.05Å; M845-W847 HydrophobicContact CE-CB 3.75Å; M845-W847 HydrophobicContact CE-CG 4.35Å; W847-L849 HydrophobicContact CH2-CD1 4.31Å; W847-L849 HydrophobicContact CZ2-CD1 3.72Å; W847-L870 WeakPolarHBondContact O-CD1 3.35Å; W847-L871 PolarHBondContact O-N 2.86Å; W847-L871 VanDerWaalsContact O-N 3.12Å; W847-M872 HydrophobicContact CB-CB 4.32Å; W847-M872 HydrophobicContact CE3-SD 3.6Å; W847-M872 VanDerWaalsContact CE3-SD 3.6Å; W847-M872 HydrophobicContact CZ3-SD 3.94Å; W847-M872 PolarHBondContact N-O 3.42Å; W847-M872 PolarHBondContact O-N 3.28Å
848	Y	74.8	Confident	75.7	Confident	50 Å²	50	60 Å²	60	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	97.3	172.4	-61.4	-95	0	0	0	110	K777 Q779 T846 L870	K777-Y848 PolarHBondContact N-O 2.87Å; Q779-Y848 WeakPolarHBondContact O-CD2 3.39Å; Q779-Y848 WeakPolarHBondContact O-CE2 3.31Å; T846-Y848 HydrophobicContact CG2-CD2 4.24Å; T846-Y848 HydrophobicContact CG2-CE2 3.49Å; T846-Y848 VanDerWaalsContact CG2-CE2 3.49Å; Y848-L870 HydrophobicContact CD1-CB 3.82Å; Y848-L870 HydrophobicContact CD1-CD1 3.83Å; Y848-L870 HydrophobicContact CD1-CG 4.43Å; Y848-L870 HydrophobicContact CD2-CD1 4.2Å; Y848-L870 HydrophobicContact CE1-CB 3.59Å; Y848-L870 HydrophobicContact CE1-CD1 3.63Å; Y848-L870 HydrophobicContact CE1-CD2 4.45Å; Y848-L870 HydrophobicContact CE1-CG 4.06Å; Y848-L870 HydrophobicContact CE2-CD1 4Å; Y848-L870 HydrophobicContact CG-CD1 4.13Å
849	L	79.6	Confident	76.4	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142.4	171.8	-172	59.6	0	0	0	109.4	I774 T775 L835 W847 V852 V867 L871 L884	I774-L849 HydrophobicContact CG2-CD1 3.43Å; I774-L849 VanDerWaalsContact CG2-CD1 3.43Å; T775-L849 WeakPolarHBondContact O-CD1 3.36Å; L835-L849 HydrophobicContact CD1-CD2 3.89Å; W847-L849 HydrophobicContact CH2-CD1 4.31Å; W847-L849 HydrophobicContact CZ2-CD1 3.72Å; L849-V852 HydrophobicContact CD1-CG2 3.93Å; L849-V852 HydrophobicContact CD2-CG2 3.42Å; L849-V852 VanDerWaalsContact CD2-CG2 3.42Å; L849-V852 HydrophobicContact CG-CG2 4.03Å; L849-V867 HydrophobicContact CB-CG1 4.33Å; L849-V867 HydrophobicContact CD2-CG2 4.28Å; L849-V867 HydrophobicContact CG-CB 4.4Å; L849-L871 HydrophobicContact CB-CD1 3.21Å; L849-L871 HydrophobicContact CB-CG 3.9Å; L849-L871 HydrophobicContact CD2-CD1 3.27Å; L849-L871 HydrophobicContact CG-CD1 3.82Å; L849-L884 HydrophobicContact CD2-CD1 3.76Å
850	R	78.9	Confident	77.6	Confident	103 Å²	103	59.2 Å²	59.2	39%	0.389	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-45.6	176.9	-178.1	178.3	179.5	151.2	1.8	112.2	T775 V867	T775-R850 HydrophobicContact CG2-CB 4.26Å; T775-R850 WeakPolarHBondContact O-CA 3.5Å; T775-R850 WeakPolarHBondContact O-CB 3.44Å; T775-R850 PolarHBondContact O-N 3.24Å; R850-V867 CarbonylContact C-O 3.54Å; R850-V867 WeakPolarHBondContact CA-O 3.39Å; R850-V867 CarbonylContact O-C 3.59Å; R850-V867 PolarHBondContact O-N 3.43Å; R850-V867 VanDerWaalsContact O-N 3.09Å
851	K	84.4	Confident	79.2	Confident	15 Å²	15	54.6 Å²	54.6	7%	0.065	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	138.5	-174	-166	173.1	-173.9	173.1	0	109.7	D345 D347 T775	D345-K851 IonicContact OD2-NZ 3.99Å; D345-K851 PolarHBondContact OD2-NZ 3.31Å; D347-K851 IonicContact OD1-NZ 3.68Å; D347-K851 PolarHBondContact OD1-NZ 3.09Å; D347-K851 IonicContact OD2-NZ 3.73Å; T775-K851 PolarHBondContact N-O 3.42Å; T775-K851 PolarHBondContact O-N 3.12Å
852	V	89.6	Confident	81	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.6	163.5	-177.4	0	0	0	0	108.5	V772 F773 I774 L835 L849 I865 L884	V772-V852 HydrophobicContact CG1-CG1 4.42Å; F773-V852 CarbonylContact O-C 3.56Å; F773-V852 VanDerWaalsContact O-CA 3.29Å; F773-V852 WeakPolarHBondContact O-CA 3.13Å; I774-V852 HydrophobicContact CG1-CG1 4.5Å; L835-V852 HydrophobicContact CD1-CG2 4.33Å; L849-V852 HydrophobicContact CD1-CG2 3.93Å; L849-V852 HydrophobicContact CD2-CG2 3.42Å; L849-V852 VanDerWaalsContact CD2-CG2 3.42Å; L849-V852 HydrophobicContact CG-CG2 4.03Å; V852-I865 HydrophobicContact CB-CB 4.08Å; V852-I865 HydrophobicContact CB-CD1 4.11Å; V852-I865 HydrophobicContact CB-CG1 4.44Å; V852-I865 HydrophobicContact CG1-CD1 4.22Å; V852-I865 PolarHBondContact N-O 2.9Å; V852-I865 PolarHBondContact O-N 2.84Å; V852-L884 HydrophobicContact CG2-CD1 4.24Å
853	K	91.2	Very high	82.8	Confident	24 Å²	24	41.6 Å²	41.6	10%	0.104	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139	175.3	160.1	172.4	160.3	160.1	0	108.7	D347 V772 F773 E862 F863	D347-K853 VanDerWaalsContact OD2-CD 3.3Å; D347-K853 WeakPolarHBondContact OD2-CD 3.37Å; D347-K853 IonicContact OD2-NZ 2.71Å; D347-K853 PolarHBondContact OD2-NZ 3.18Å; V772-K853 CarbonylContact C-O 3.45Å; F773-K853 HydrophobicContact CB-CB 4.15Å; F773-K853 HydrophobicContact CD2-CB 4.47Å; F773-K853 HydrophobicContact CD2-CG 4Å; F773-K853 PolarHBondContact N-O 2.8Å; F773-K853 PolarHBondContact O-N 3.32Å; K853-E862 VanDerWaalsContact CE-CD 3.47Å; K853-E862 WeakPolarHBondContact CE-OE1 3.43Å; K853-E862 WeakPolarHBondContact CE-OE2 3.41Å; K853-E862 VanDerWaalsContact NZ-CD 3.26Å; K853-E862 IonicContact NZ-OE1 2.61Å; K853-E862 PolarHBondContact NZ-OE1 2.78Å; K853-E862 IonicContact NZ-OE2 3.77Å; K853-E862 PolarHBondContact NZ-OE2 2.96Å; K853-F863 WeakPolarHBondContact CA-O 3.48Å
854	M	94.9	Very high	84.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.8	173.4	-68.8	-175	57.2	0	0	109	W770 K771 V772 L791 V793 V822 F824 V833 E862 F863	W770-M854 HydrophobicContact CB-CE 3.99Å; W770-M854 HydrophobicContact CD2-CE 4.46Å; W770-M854 HydrophobicContact CE3-CB 4.01Å; W770-M854 HydrophobicContact CG-CE 4.24Å; W770-M854 HydrophobicContact CZ3-CB 4.49Å; K771-M854 CarbonylContact O-C 3.57Å; K771-M854 VanDerWaalsContact O-CA 3.26Å; K771-M854 WeakPolarHBondContact O-CA 3.3Å; V772-M854 HydrophobicContact CB-CG 4.35Å; V772-M854 HydrophobicContact CG1-CG 4.03Å; V772-M854 HydrophobicContact CG1-SD 4.48Å; V772-M854 HydrophobicContact CG2-CE 3.97Å; V772-M854 HydrophobicContact CG2-CG 4.14Å; V772-M854 HydrophobicContact CG2-SD 4.29Å; L791-M854 HydrophobicContact CD2-CE 4.28Å; L791-M854 HydrophobicContact CD2-SD 4.32Å; V793-M854 HydrophobicContact CG2-CE 3.96Å; V793-M854 HydrophobicContact CG2-SD 4.29Å; V822-M854 HydrophobicContact CG2-CE 4.44Å; F824-M854 HydrophobicContact CE1-CE 4.3Å; F824-M854 HydrophobicContact CZ-CE 4.27Å; V833-M854 HydrophobicContact CG2-SD 4.26Å; M854-E862 WeakPolarHBondContact O-CA 3.32Å; M854-E862 VanDerWaalsContact O-CB 3.3Å; M854-E862 WeakPolarHBondContact O-CB 3.47Å; M854-F863 HydrophobicContact CB-CD1 4.32Å; M854-F863 HydrophobicContact CB-CD2 4.29Å; M854-F863 HydrophobicContact CB-CE1 3.77Å; M854-F863 HydrophobicContact CB-CE2 3.72Å; M854-F863 HydrophobicContact CB-CZ 3.46Å; M854-F863 VanDerWaalsContact CB-CZ 3.46Å; M854-F863 HydrophobicContact CE-CZ 4.05Å; M854-F863 HydrophobicContact CG-CE2 3.92Å; M854-F863 HydrophobicContact CG-CZ 3.84Å; M854-F863 PolarHBondContact N-O 3.04Å; M854-F863 VanDerWaalsContact N-O 3.07Å; M854-F863 PolarHBondContact O-N 3.07Å; M854-F863 HydrophobicContact SD-CE1 4.47Å; M854-F863 HydrophobicContact SD-CE2 3.82Å; M854-F863 HydrophobicContact SD-CZ 3.46Å; M854-F863 WeakPolarHBondContact SD-CZ 3.39Å
855	K	94.5	Very high	85.7	Confident	42 Å²	42	27.1 Å²	27.1	18%	0.183	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.6	-179.7	-176.5	171.2	-170.2	162.3	0	110.9	E402 W770 K771 F773 D861 E862	E402-K855 IonicContact OE2-NZ 2.78Å; E402-K855 PolarHBondContact OE2-NZ 3.42Å; W770-K855 CarbonylContact C-O 3.53Å; W770-K855 WeakPolarHBondContact CA-O 3.41Å; W770-K855 VanDerWaalsContact CE3-C 3.44Å; K771-K855 PolarHBondContact N-O 3.3Å; K771-K855 PolarHBondContact O-N 3.21Å; F773-K855 HydrophobicContact CE2-CB 4.07Å; K855-D861 CarbonylContact C-O 3.57Å; K855-D861 WeakPolarHBondContact CA-O 3.42Å; K855-E862 HydrophobicContact CB-CB 3.97Å; K855-E862 HydrophobicContact CG-CB 4.12Å; K855-E862 IonicContact NZ-OE2 3.24Å
856	N	93.1	Very high	86.2	Confident	5 Å²	5	30 Å²	30	3%	0.027	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	128	175	-172.3	-52	0	0	0	109.3	W770 N858 N859 G860 D861	W770-N856 HydrophobicContact CD2-CB 3.94Å; W770-N856 HydrophobicContact CE3-CB 3.8Å; W770-N856 HydrophobicContact CH2-CB 3.72Å; W770-N856 HydrophobicContact CZ2-CB 3.87Å; W770-N856 WeakPolarHBondContact CZ2-ND2 3.39Å; W770-N856 HydrophobicContact CZ3-CB 3.68Å; N856-N858 VanDerWaalsContact C-N 3.32Å; N856-N858 PolarHBondContact O-N 3.19Å; N856-N858 WeakPolarHBondContact OD1-CB 3.45Å; N856-N858 PolarHBondContact OD1-N 3.17Å; N856-N859 WeakPolarHBondContact CB-OD1 3.04Å; N856-N859 PolarHBondContact OD1-N 2.57Å; N856-N859 PolarHBondContact OD1-OD1 2.97Å; N856-G860 WeakPolarHBondContact O-CA 3.24Å; N856-G860 PolarHBondContact O-N 2.82Å; N856-D861 HydrophobicContact CB-CB 4.34Å; N856-D861 WeakPolarHBondContact CB-O 3.3Å; N856-D861 PolarHBondContact N-O 2.91Å
857	I	92	Very high	86.6	Confident	75 Å²	75	29.5 Å²	29.5	39%	0.385	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-30.8	-175.9	-61.2	-176.5	0	0	0	111.5	V769 K771 Q821	V769-I857 HydrophobicContact CB-CD1 4.29Å; V769-I857 HydrophobicContact CG1-CD1 3.61Å; V769-I857 HydrophobicContact CG1-CG1 4.35Å; V769-I857 PolarHBondContact O-N 3.36Å; K771-I857 HydrophobicContact CD-CD1 4.42Å; K771-I857 HydrophobicContact CD-CG1 4.45Å; K771-I857 HydrophobicContact CG-CD1 3.82Å; K771-I857 HydrophobicContact CG-CG1 3.9Å; Q821-I857 HydrophobicContact CG-CD1 4.05Å
858	N	88.9	Confident	86.3	Confident	110 Å²	110	35.5 Å²	35.5	59%	0.588	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-42.9	-170.1	-62.9	-16	0	0	0	112.3	N856	N856-N858 VanDerWaalsContact C-N 3.32Å; N856-N858 PolarHBondContact O-N 3.19Å; N856-N858 WeakPolarHBondContact OD1-CB 3.45Å; N856-N858 PolarHBondContact OD1-N 3.17Å
859	N	88.5	Confident	85.9	Confident	63 Å²	63	36.2 Å²	36.2	34%	0.337	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-4.6	-177.1	68	-4	0	0	0	114.2	G404 N856 D861	G404-N859 WeakPolarHBondContact CA-O 3.29Å; N856-N859 WeakPolarHBondContact CB-OD1 3.04Å; N856-N859 PolarHBondContact OD1-N 2.57Å; N856-N859 PolarHBondContact OD1-OD1 2.97Å; N859-D861 VanDerWaalsContact CG-CG 3.42Å; N859-D861 PolarHBondContact ND2-OD1 3.11Å; N859-D861 PolarHBondContact ND2-OD2 3.47Å; N859-D861 PolarHBondContact O-N 3.44Å; N859-D861 WeakPolarHBondContact OD1-CB 3.3Å; N859-D861 PolarHBondContact OD1-N 2.85Å; N859-D861 VanDerWaalsContact OD1-N 3.07Å
860	G	89.5	Confident	85.1	Confident	9 Å²	9	39.1 Å²	39.1	9%	0.093	20%	0.204	C	C	.	.			trans	78.2	-3.7	-179.2	0	0	0	0	0	114.7	N856 E862	N856-G860 WeakPolarHBondContact O-CA 3.24Å; N856-G860 PolarHBondContact O-N 2.82Å; G860-E862 PolarHBondContact O-N 2.88Å
861	D	92.6	Very high	84.4	Confident	29 Å²	29	35.3 Å²	35.3	16%	0.155	19%	0.191	C	C	.	.			trans	-56.3	132.4	-178.4	-71.5	0.1	0	0	0	109.8	Y405 W770 K855 N856 N859 W888	Y405-D861 VanDerWaalsContact CB-OD1 3.29Å; Y405-D861 WeakPolarHBondContact CB-OD1 3.38Å; Y405-D861 PolarHBondContact N-OD1 2.87Å; Y405-D861 CarbonylContact O-C 3.53Å; Y405-D861 WeakPolarHBondContact O-CA 3.45Å; W770-D861 WeakPolarHBondContact CZ3-O 3.14Å; K855-D861 CarbonylContact C-O 3.57Å; K855-D861 WeakPolarHBondContact CA-O 3.42Å; N856-D861 HydrophobicContact CB-CB 4.34Å; N856-D861 WeakPolarHBondContact CB-O 3.3Å; N856-D861 PolarHBondContact N-O 2.91Å; N859-D861 VanDerWaalsContact CG-CG 3.42Å; N859-D861 PolarHBondContact ND2-OD1 3.11Å; N859-D861 PolarHBondContact ND2-OD2 3.47Å; N859-D861 PolarHBondContact O-N 3.44Å; N859-D861 WeakPolarHBondContact OD1-CB 3.3Å; N859-D861 PolarHBondContact OD1-N 2.85Å; N859-D861 VanDerWaalsContact OD1-N 3.07Å; D861-W888 HydrophobicContact CB-CH2 4.5Å
862	E	93.5	Very high	83.8	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.009	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.7	178.2	67.8	177.2	-129.7	0	0	112.7	Y405 G406 A407 K853 M854 K855 G860 R864 W888	Y405-E862 PolarHBondContact O-N 2.76Å; G406-E862 VanDerWaalsContact C-CG 3.42Å; G406-E862 WeakPolarHBondContact CA-O 3.32Å; G406-E862 VanDerWaalsContact O-CG 3.31Å; G406-E862 WeakPolarHBondContact O-CG 3.17Å; A407-E862 HydrophobicContact CB-CG 3.9Å; K853-E862 VanDerWaalsContact CE-CD 3.47Å; K853-E862 WeakPolarHBondContact CE-OE1 3.43Å; K853-E862 WeakPolarHBondContact CE-OE2 3.41Å; K853-E862 VanDerWaalsContact NZ-CD 3.26Å; K853-E862 IonicContact NZ-OE1 2.61Å; K853-E862 PolarHBondContact NZ-OE1 2.78Å; K853-E862 IonicContact NZ-OE2 3.77Å; K853-E862 PolarHBondContact NZ-OE2 2.96Å; M854-E862 WeakPolarHBondContact O-CA 3.32Å; M854-E862 VanDerWaalsContact O-CB 3.3Å; M854-E862 WeakPolarHBondContact O-CB 3.47Å; K855-E862 HydrophobicContact CB-CB 3.97Å; K855-E862 HydrophobicContact CG-CB 4.12Å; K855-E862 IonicContact NZ-OE2 3.24Å; G860-E862 PolarHBondContact O-N 2.88Å; E862-R864 IonicContact OE1-CZ 3.08Å; E862-R864 IonicContact OE1-NE 3.04Å; E862-R864 PolarHBondContact OE1-NE 3.35Å; E862-R864 IonicContact OE1-NH2 3.88Å; E862-R864 PolarHBondContact OE1-NH2 3.34Å; E862-W888 VanDerWaalsContact O-CZ3 3.24Å; E862-W888 WeakPolarHBondContact O-CZ3 3.22Å
863	F	93.1	Very high	82.8	Confident	1 Å²	1	39.9 Å²	39.9	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.8	172.3	62.5	-100.1	0	0	0	110.3	W770 V830 V833 K853 M854 V886 W888	W770-F863 HydrophobicContact CE3-CE1 4.18Å; W770-F863 HydrophobicContact CH2-CD1 4.18Å; W770-F863 AromaticContact CH2-CE1 3.99Å; W770-F863 HydrophobicContact CH2-CE1 3.99Å; W770-F863 AromaticContact CZ3-CD1 3.89Å; W770-F863 HydrophobicContact CZ3-CD1 3.89Å; W770-F863 AromaticContact CZ3-CE1 3.68Å; W770-F863 HydrophobicContact CZ3-CE1 3.68Å; V830-F863 HydrophobicContact CB-CE1 4.03Å; V830-F863 HydrophobicContact CB-CZ 4.19Å; V830-F863 HydrophobicContact CG1-CE1 4.12Å; V830-F863 HydrophobicContact CG1-CE2 4.21Å; V830-F863 HydrophobicContact CG1-CZ 3.75Å; V830-F863 HydrophobicContact CG2-CE1 3.99Å; V830-F863 HydrophobicContact CG2-CZ 4.33Å; V833-F863 HydrophobicContact CG2-CE2 4.11Å; V833-F863 HydrophobicContact CG2-CZ 4.42Å; K853-F863 WeakPolarHBondContact CA-O 3.48Å; M854-F863 HydrophobicContact CB-CD1 4.32Å; M854-F863 HydrophobicContact CB-CD2 4.29Å; M854-F863 HydrophobicContact CB-CE1 3.77Å; M854-F863 HydrophobicContact CB-CE2 3.72Å; M854-F863 HydrophobicContact CB-CZ 3.46Å; M854-F863 VanDerWaalsContact CB-CZ 3.46Å; M854-F863 HydrophobicContact CE-CZ 4.05Å; M854-F863 HydrophobicContact CG-CE2 3.92Å; M854-F863 HydrophobicContact CG-CZ 3.84Å; M854-F863 PolarHBondContact N-O 3.04Å; M854-F863 VanDerWaalsContact N-O 3.07Å; M854-F863 PolarHBondContact O-N 3.07Å; M854-F863 HydrophobicContact SD-CE1 4.47Å; M854-F863 HydrophobicContact SD-CE2 3.82Å; M854-F863 HydrophobicContact SD-CZ 3.46Å; M854-F863 WeakPolarHBondContact SD-CZ 3.39Å; F863-V886 HydrophobicContact CB-CG1 3.56Å; F863-V886 HydrophobicContact CD1-CG1 4.41Å; F863-V886 HydrophobicContact CD2-CB 4.13Å; F863-V886 HydrophobicContact CD2-CG1 3.27Å; F863-V886 HydrophobicContact CD2-CG2 3.7Å; F863-V886 HydrophobicContact CE2-CB 4.48Å; F863-V886 HydrophobicContact CE2-CG1 3.99Å; F863-V886 HydrophobicContact CE2-CG2 3.61Å; F863-V886 HydrophobicContact CG-CG1 3.5Å; F863-W888 HydrophobicContact CB-CD2 3.79Å; F863-W888 HydrophobicContact CB-CE3 3.83Å; F863-W888 HydrophobicContact CB-CG 4.48Å; F863-W888 HydrophobicContact CB-CH2 3.97Å; F863-W888 HydrophobicContact CB-CZ2 3.87Å; F863-W888 HydrophobicContact CB-CZ3 3.93Å; F863-W888 AromaticContact CD1-CH2 3.64Å; F863-W888 HydrophobicContact CD1-CH2 3.64Å; F863-W888 AromaticContact CD1-CZ2 3.44Å; F863-W888 HydrophobicContact CD1-CZ2 3.44Å; F863-W888 VanDerWaalsContact CD1-CZ2 3.44Å; F863-W888 HydrophobicContact CD1-CZ3 4.4Å; F863-W888 HydrophobicContact CE1-CZ2 4.3Å; F863-W888 HydrophobicContact CG-CH2 4.3Å; F863-W888 HydrophobicContact CG-CZ2 4.03Å
864	R	87.9	Confident	81.7	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	153.7	-172.3	-57.5	-172.3	-170.5	102.4	2.2	111.4	A343 D345 G406 E862 S887	A343-R864 PolarHBondContact O-NH1 3.28Å; D345-R864 PolarHBondContact O-NH1 2.86Å; D345-R864 PolarHBondContact O-NH2 2.79Å; D345-R864 VanDerWaalsContact O-NH2 3.14Å; D345-R864 IonicContact OD1-NH1 3.69Å; D345-R864 PolarHBondContact OD1-NH1 3.48Å; D345-R864 WeakPolarHBondContact OD2-CD 3.44Å; D345-R864 IonicContact OD2-CZ 3.73Å; D345-R864 IonicContact OD2-NE 3.42Å; D345-R864 PolarHBondContact OD2-NE 2.77Å; D345-R864 IonicContact OD2-NH1 2.72Å; G406-R864 PolarHBondContact O-NH1 2.85Å; G406-R864 PolarHBondContact O-NH2 2.79Å; E862-R864 IonicContact OE1-CZ 3.08Å; E862-R864 IonicContact OE1-NE 3.04Å; E862-R864 PolarHBondContact OE1-NE 3.35Å; E862-R864 IonicContact OE1-NH2 3.88Å; E862-R864 PolarHBondContact OE1-NH2 3.34Å; R864-S887 PolarHBondContact N-O 3.12Å; R864-S887 PolarHBondContact O-N 3.18Å
865	I	88.1	Confident	80	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	104.4	174.3	-52.5	174.4	0	0	0	105.7	V833 V852 V867 L884 V886	V833-I865 HydrophobicContact CB-CD1 3.91Å; V833-I865 HydrophobicContact CG2-CD1 4.03Å; V852-I865 HydrophobicContact CB-CB 4.08Å; V852-I865 HydrophobicContact CB-CD1 4.11Å; V852-I865 HydrophobicContact CB-CG1 4.44Å; V852-I865 HydrophobicContact CG1-CD1 4.22Å; V852-I865 PolarHBondContact N-O 2.9Å; V852-I865 PolarHBondContact O-N 2.84Å; I865-V867 HydrophobicContact CG2-CG2 3.54Å; I865-L884 HydrophobicContact CD1-CB 3.93Å; I865-L884 HydrophobicContact CG2-CB 3.67Å; I865-L884 HydrophobicContact CG2-CD1 4.2Å; I865-L884 HydrophobicContact CG2-CD2 4.34Å; I865-L884 HydrophobicContact CG2-CG 4.28Å; I865-V886 HydrophobicContact CD1-CG2 3.96Å; I865-V886 HydrophobicContact CG1-CG2 4.03Å
866	N	76.5	Confident	78.4	Confident	72 Å²	72	49.3 Å²	49.3	39%	0.385	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	124.8	174.5	-67.3	-24.8	0	0	0	108.4
867	V	75.3	Confident	77.1	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.042	26%	0.261	C	S	.	.			trans	-133.5	100.8	-174.3	-172.3	0	0	0	0	109.5	L849 R850 I865 L871 L884	L849-V867 HydrophobicContact CB-CG1 4.33Å; L849-V867 HydrophobicContact CD2-CG2 4.28Å; L849-V867 HydrophobicContact CG-CB 4.4Å; R850-V867 CarbonylContact C-O 3.54Å; R850-V867 WeakPolarHBondContact CA-O 3.39Å; R850-V867 CarbonylContact O-C 3.59Å; R850-V867 PolarHBondContact O-N 3.43Å; R850-V867 VanDerWaalsContact O-N 3.09Å; I865-V867 HydrophobicContact CG2-CG2 3.54Å; V867-L871 HydrophobicContact CG1-CD1 3.59Å; V867-L871 HydrophobicContact CG1-CD2 3.19Å; V867-L871 HydrophobicContact CG1-CG 3.6Å; V867-L884 HydrophobicContact CG1-CD2 4.5Å; V867-L884 HydrophobicContact CG2-CD1 4.39Å; V867-L884 HydrophobicContact CG2-CD2 3.88Å
868	D	66.3	Low	75.8	Confident	133 Å²	133	50.5 Å²	50.5	71%	0.711	27%	0.265	S	S	*	.			trans	-98.6	6.2	-175.9	-72.8	-34.3	0	0	0	114.2
869	S	64.6	Low	75.2	Confident	64 Å²	64	49.1 Å²	49.1	45%	0.448	25%	0.251	S	S	.	.	S	Bend	trans	-117.4	159.9	-172.5	68.5	0	0	0	0	113.7	L871	S869-L871 PolarHBondContact O-N 2.74Å
870	L	64	Low	74.7	Confident	62 Å²	62	46.4 Å²	46.4	33%	0.325	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	133	161.7	171.2	60.3	0	0	0	109.7	T846 W847 Y848 K873	T846-L870 HydrophobicContact CG2-CD1 3.14Å; T846-L870 HydrophobicContact CG2-CD2 4.14Å; T846-L870 HydrophobicContact CG2-CG 4.27Å; W847-L870 WeakPolarHBondContact O-CD1 3.35Å; Y848-L870 HydrophobicContact CD1-CB 3.82Å; Y848-L870 HydrophobicContact CD1-CD1 3.83Å; Y848-L870 HydrophobicContact CD1-CG 4.43Å; Y848-L870 HydrophobicContact CD2-CD1 4.2Å; Y848-L870 HydrophobicContact CE1-CB 3.59Å; Y848-L870 HydrophobicContact CE1-CD1 3.63Å; Y848-L870 HydrophobicContact CE1-CD2 4.45Å; Y848-L870 HydrophobicContact CE1-CG 4.06Å; Y848-L870 HydrophobicContact CE2-CD1 4Å; Y848-L870 HydrophobicContact CG-CD1 4.13Å; L870-K873 HydrophobicContact CD2-CD 4Å; L870-K873 VanDerWaalsContact CD2-CE 3.47Å; L870-K873 HydrophobicContact CD2-CG 4.25Å
871	L	64.1	Low	74.5	Confident	24 Å²	24	47 Å²	47	13%	0.126	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-43.8	-175.4	-67.5	-167.8	0	0	0	115.8	W847 L849 V867 S869 I882 L884	W847-L871 PolarHBondContact O-N 2.86Å; W847-L871 VanDerWaalsContact O-N 3.12Å; L849-L871 HydrophobicContact CB-CD1 3.21Å; L849-L871 HydrophobicContact CB-CG 3.9Å; L849-L871 HydrophobicContact CD2-CD1 3.27Å; L849-L871 HydrophobicContact CG-CD1 3.82Å; V867-L871 HydrophobicContact CG1-CD1 3.59Å; V867-L871 HydrophobicContact CG1-CD2 3.19Å; V867-L871 HydrophobicContact CG1-CG 3.6Å; S869-L871 PolarHBondContact O-N 2.74Å; L871-I882 HydrophobicContact CB-CD1 3.62Å; L871-I882 HydrophobicContact CD1-CD1 3.93Å; L871-I882 HydrophobicContact CD1-CG2 4.29Å; L871-I882 HydrophobicContact CD2-CD1 3.24Å; L871-I882 HydrophobicContact CG-CD1 3.76Å; L871-L884 HydrophobicContact CD1-CD2 4.15Å; L871-L884 HydrophobicContact CD2-CD2 4.43Å
872	M	71	Confident	74.2	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.02	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	128.9	-166.5	-60.9	177.1	74.2	0	0	110.3	M837 T846 W847 P880 I882	M837-M872 HydrophobicContact CB-CE 3.96Å; M837-M872 HydrophobicContact CG-CE 3.57Å; M837-M872 HydrophobicContact CG-SD 4.05Å; T846-M872 CarbonylContact C-O 3.6Å; T846-M872 VanDerWaalsContact CA-O 3.26Å; T846-M872 WeakPolarHBondContact CA-O 3.31Å; W847-M872 HydrophobicContact CB-CB 4.32Å; W847-M872 HydrophobicContact CE3-SD 3.6Å; W847-M872 VanDerWaalsContact CE3-SD 3.6Å; W847-M872 HydrophobicContact CZ3-SD 3.94Å; W847-M872 PolarHBondContact N-O 3.42Å; W847-M872 PolarHBondContact O-N 3.28Å; M872-P880 HydrophobicContact CB-CB 4.32Å; M872-P880 HydrophobicContact CE-CB 3.67Å; M872-P880 HydrophobicContact CE-CG 3.91Å; M872-P880 WeakPolarHBondContact CE-O 3.5Å; M872-I882 HydrophobicContact CG-CB 4.23Å; M872-I882 HydrophobicContact CG-CG2 3.98Å; M872-I882 HydrophobicContact SD-CB 4.45Å; M872-I882 HydrophobicContact SD-CG2 3.71Å
873	K	69.8	Low	74.1	Confident	107 Å²	107	46.9 Å²	46.9	47%	0.465	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.2	173.9	-78.6	-179	157.8	177.6	0	109.8	M845 T846 L870	M845-K873 CarbonylContact O-C 3.53Å; M845-K873 WeakPolarHBondContact O-CA 3.42Å; T846-K873 HydrophobicContact CG2-CG 3.99Å; L870-K873 HydrophobicContact CD2-CD 4Å; L870-K873 VanDerWaalsContact CD2-CE 3.47Å; L870-K873 HydrophobicContact CD2-CG 4.25Å
874	S	67	Low	74.1	Confident	16 Å²	16	46.9 Å²	46.9	11%	0.112	24%	0.239	C	C	.	.			trans	-87.7	-0.6	178.7	72.9	0	0	0	0	114.3	R843 Q844 M845 R876 N877	R843-S874 PolarHBondContact O-OG 2.72Å; Q844-S874 WeakPolarHBondContact CA-OG 3.28Å; M845-S874 PolarHBondContact N-OG 2.84Å; M845-S874 PolarHBondContact O-N 2.98Å; S874-R876 PolarHBondContact O-N 2.7Å; S874-N877 PolarHBondContact O-N 2.85Å; S874-N877 VanDerWaalsContact O-N 3.15Å
875	D	59.9	Low	74.4	Confident	72 Å²	72	47.9 Å²	47.9	39%	0.385	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.6	-26.6	-171.1	-60.7	-13.4	0	0	0	116.3	Q844	Q844-D875 WeakPolarHBondContact CB-OD1 3.47Å; Q844-D875 VanDerWaalsContact CG-OD1 3.23Å; Q844-D875 WeakPolarHBondContact CG-OD1 3.37Å
876	R	60.2	Low	74.7	Confident	175 Å²	175	47.9 Å²	47.9	66%	0.66	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-143.1	6.9	179.2	-60.7	-172.5	180	-169.5	0.1	115.1	S874	S874-R876 PolarHBondContact O-N 2.7Å
877	N	66.8	Low	75.4	Confident	38 Å²	38	45 Å²	45	20%	0.203	23%	0.232	C	C	.	.			trans	-138.8	118.9	-173.5	-176.5	7.1	0	0	0	109.6	S874 R879 P880	S874-N877 PolarHBondContact O-N 2.85Å; S874-N877 VanDerWaalsContact O-N 3.15Å; N877-R879 PolarHBondContact ND2-O 2.76Å; N877-R879 PolarHBondContact O-N 3.38Å; N877-R879 PolarHBondContact OD1-N 2.8Å; N877-R879 PolarHBondContact OD1-O 3.49Å; N877-P880 WeakPolarHBondContact ND2-CA 3.38Å; N877-P880 WeakPolarHBondContact O-CD 3.45Å
878	S	65	Low	76.3	Confident	67 Å²	67	45.5 Å²	45.5	47%	0.469	23%	0.233	S	C	.	.	S	Bend	trans	-68.5	-20.2	176.8	54.5	0	0	0	0	113.3	T839	T839-S878 PolarHBondContact N-O 3.07Å; T839-S878 PolarHBondContact OG1-O 3.15Å
879	R	74.8	Confident	77.6	Confident	81 Å²	81	39.1 Å²	39.1	31%	0.306	20%	0.199	S	C	.	.	S	Bend	trans	-130.9	73.1	177.9	-59.2	-179	82	-125.6	-6.1	110.2	E836 M837 N877 S881	E836-R879 IonicContact OE1-CZ 3.44Å; E836-R879 IonicContact OE1-NE 3.56Å; E836-R879 IonicContact OE1-NH1 2.59Å; E836-R879 PolarHBondContact OE1-NH1 3.33Å; E836-R879 IonicContact OE1-NH2 3.74Å; E836-R879 PolarHBondContact OE1-NH2 3.07Å; E836-R879 IonicContact OE2-CZ 3.57Å; E836-R879 IonicContact OE2-NH1 2.62Å; E836-R879 IonicContact OE2-NH2 2.85Å; E836-R879 PolarHBondContact OE2-NH2 2.85Å; M837-R879 WeakPolarHBondContact O-CA 3.22Å; N877-R879 PolarHBondContact ND2-O 2.76Å; N877-R879 PolarHBondContact O-N 3.38Å; N877-R879 PolarHBondContact OD1-N 2.8Å; N877-R879 PolarHBondContact OD1-O 3.49Å; R879-S881 PolarHBondContact O-N 2.82Å
880	P	78.8	Confident	78.8	Confident	6 Å²	6	36.8 Å²	36.8	4%	0.039	18%	0.181	C	C	.	.			trans	-60	136.9	174.9	24.3	-27.9	0	0	0	108.7	E836 M837 M872 N877	E836-P880 WeakPolarHBondContact CA-O 3.11Å; M837-P880 HydrophobicContact CB-CG 4.16Å; M837-P880 PolarHBondContact N-O 2.82Å; M837-P880 WeakPolarHBondContact O-CD 3.37Å; M872-P880 HydrophobicContact CB-CB 4.32Å; M872-P880 HydrophobicContact CE-CB 3.67Å; M872-P880 HydrophobicContact CE-CG 3.91Å; M872-P880 WeakPolarHBondContact CE-O 3.5Å; N877-P880 WeakPolarHBondContact ND2-CA 3.38Å; N877-P880 WeakPolarHBondContact O-CD 3.45Å
881	S	85.2	Confident	80	Confident	23 Å²	23	37.4 Å²	37.4	16%	0.161	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.6	174.6	60	0	0	0	0	110	L835 R879 R931	L835-S881 CarbonylContact O-C 3.53Å; L835-S881 VanDerWaalsContact O-CA 3.3Å; L835-S881 WeakPolarHBondContact O-CA 3.32Å; R879-S881 PolarHBondContact O-N 2.82Å; S881-R931 PolarHBondContact OG-NH1 2.84Å; S881-R931 VanDerWaalsContact OG-NH1 3.17Å
882	I	86.8	Confident	81.1	Confident	20 Å²	20	40 Å²	40	10%	0.103	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.9	175.2	-171.3	162.2	0	0	0	110.8	R834 L835 L871 M872 L884	R834-I882 CarbonylContact C-O 3.55Å; R834-I882 VanDerWaalsContact CA-O 3.27Å; R834-I882 WeakPolarHBondContact CA-O 3.15Å; L835-I882 HydrophobicContact CB-CG2 4.11Å; L835-I882 PolarHBondContact N-O 3.45Å; L835-I882 PolarHBondContact O-N 2.72Å; L871-I882 HydrophobicContact CB-CD1 3.62Å; L871-I882 HydrophobicContact CD1-CD1 3.93Å; L871-I882 HydrophobicContact CD1-CG2 4.29Å; L871-I882 HydrophobicContact CD2-CD1 3.24Å; L871-I882 HydrophobicContact CG-CD1 3.76Å; M872-I882 HydrophobicContact CG-CB 4.23Å; M872-I882 HydrophobicContact CG-CG2 3.98Å; M872-I882 HydrophobicContact SD-CB 4.45Å; M872-I882 HydrophobicContact SD-CG2 3.71Å; I882-L884 HydrophobicContact CD1-CD2 4.15Å; I882-L884 HydrophobicContact CG1-CD2 4.18Å; I882-L884 HydrophobicContact CG2-CG 4.44Å
883	E	91.4	Very high	82.1	Confident	7 Å²	7	41.1 Å²	41.1	3%	0.033	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.6	172.5	-60.5	-167.4	167	0	0	110.9	K832 R834 S928 R931 V956	K832-E883 HydrophobicContact CD-CB 4.16Å; K832-E883 HydrophobicContact CD-CG 4.38Å; K832-E883 WeakPolarHBondContact CD-OE2 3.18Å; K832-E883 VanDerWaalsContact NZ-CD 3.3Å; K832-E883 IonicContact NZ-OE1 2.87Å; K832-E883 PolarHBondContact NZ-OE1 2.86Å; K832-E883 IonicContact NZ-OE2 2.87Å; K832-E883 PolarHBondContact NZ-OE2 3.21Å; R834-E883 HydrophobicContact CG-CG 4.49Å; R834-E883 IonicContact CZ-OE1 3.63Å; R834-E883 IonicContact NE-OE1 3.55Å; R834-E883 PolarHBondContact NE-OE1 3.06Å; R834-E883 IonicContact NH2-OE1 3.66Å; R834-E883 PolarHBondContact NH2-OE1 3.13Å; E883-S928 WeakPolarHBondContact OE1-CA 3.36Å; E883-R931 IonicContact OE1-NH2 3.74Å; E883-V956 HydrophobicContact CB-CB 4.39Å; E883-V956 HydrophobicContact CB-CG2 3.7Å; E883-V956 PolarHBondContact OE2-N 2.85Å
884	L	92.3	Very high	83.1	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.5	-173.9	-65.2	177.6	0	0	0	108.6	K832 V833 L835 L849 V852 I865 V867 L871 I882	K832-L884 WeakPolarHBondContact CA-O 3.26Å; V833-L884 PolarHBondContact N-O 3.2Å; V833-L884 PolarHBondContact O-N 3.25Å; L835-L884 HydrophobicContact CD1-CD1 3.87Å; L835-L884 HydrophobicContact CG-CD1 4.34Å; L849-L884 HydrophobicContact CD2-CD1 3.76Å; V852-L884 HydrophobicContact CG2-CD1 4.24Å; I865-L884 HydrophobicContact CD1-CB 3.93Å; I865-L884 HydrophobicContact CG2-CB 3.67Å; I865-L884 HydrophobicContact CG2-CD1 4.2Å; I865-L884 HydrophobicContact CG2-CD2 4.34Å; I865-L884 HydrophobicContact CG2-CG 4.28Å; V867-L884 HydrophobicContact CG1-CD2 4.5Å; V867-L884 HydrophobicContact CG2-CD1 4.39Å; V867-L884 HydrophobicContact CG2-CD2 3.88Å; L871-L884 HydrophobicContact CD1-CD2 4.15Å; L871-L884 HydrophobicContact CD2-CD2 4.43Å; I882-L884 HydrophobicContact CD1-CD2 4.15Å; I882-L884 HydrophobicContact CG1-CD2 4.18Å; I882-L884 HydrophobicContact CG2-CG 4.44Å
885	P	93.8	Very high	84.3	Confident	21 Å²	21	39.3 Å²	39.3	14%	0.136	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	141.5	178.8	33.5	-35.7	0	0	0	110.1	P893 L894 V956	P885-P893 HydrophobicContact CB-CB 3.88Å; P885-P893 HydrophobicContact CG-CB 4.21Å; P885-L894 WeakPolarHBondContact CB-O 3.2Å; P885-V956 HydrophobicContact CB-CG1 4.15Å; P885-V956 HydrophobicContact CB-CG2 4.13Å; P885-V956 HydrophobicContact CG-CG2 4.44Å
886	V	94.6	Very high	85.8	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.024	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-91.7	134.2	-177.1	168	0	0	0	0	110.5	V830 F831 V833 F863 I865	V830-V886 HydrophobicContact CG1-CB 4.48Å; V830-V886 HydrophobicContact CG1-CG2 3.92Å; F831-V886 PolarHBondContact O-N 3.25Å; V833-V886 HydrophobicContact CG2-CG2 3.91Å; F863-V886 HydrophobicContact CB-CG1 3.56Å; F863-V886 HydrophobicContact CD1-CG1 4.41Å; F863-V886 HydrophobicContact CD2-CB 4.13Å; F863-V886 HydrophobicContact CD2-CG1 3.27Å; F863-V886 HydrophobicContact CD2-CG2 3.7Å; F863-V886 HydrophobicContact CE2-CB 4.48Å; F863-V886 HydrophobicContact CE2-CG1 3.99Å; F863-V886 HydrophobicContact CE2-CG2 3.61Å; F863-V886 HydrophobicContact CG-CG1 3.5Å; I865-V886 HydrophobicContact CD1-CG2 3.96Å; I865-V886 HydrophobicContact CG1-CG2 4.03Å
887	S	92.3	Very high	87.3	Confident	13 Å²	13	31.7 Å²	31.7	9%	0.091	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-102.9	123.2	172.1	-57	0	0	0	0	110	R864	R864-S887 PolarHBondContact N-O 3.12Å; R864-S887 PolarHBondContact O-N 3.18Å
888	W	93.2	Very high	88.6	Confident	16 Å²	16	33.7 Å²	33.7	6%	0.061	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-104.7	162.1	165.1	-71.4	101.5	0	0	0	109.6	Y405 W770 V830 D861 E862 F863 D890 I891	Y405-W888 HydrophobicContact CD1-CD2 4.34Å; Y405-W888 AromaticContact CD1-CE3 3.4Å; Y405-W888 HydrophobicContact CD1-CE3 3.4Å; Y405-W888 HydrophobicContact CD1-CH2 4.27Å; Y405-W888 AromaticContact CD1-CZ3 3.36Å; Y405-W888 HydrophobicContact CD1-CZ3 3.36Å; Y405-W888 HydrophobicContact CE1-CB 4.28Å; Y405-W888 AromaticContact CE1-CD2 3.7Å; Y405-W888 HydrophobicContact CE1-CD2 3.7Å; Y405-W888 AromaticContact CE1-CE3 3.13Å; Y405-W888 HydrophobicContact CE1-CE3 3.13Å; Y405-W888 HydrophobicContact CE1-CG 4.23Å; Y405-W888 AromaticContact CE1-CZ3 3.61Å; Y405-W888 HydrophobicContact CE1-CZ3 3.61Å; Y405-W888 HydrophobicContact CG-CZ3 4.44Å; W770-W888 HydrophobicContact CH2-CH2 4.33Å; V830-W888 PolarHBondContact O-NE1 3Å; D861-W888 HydrophobicContact CB-CH2 4.5Å; E862-W888 VanDerWaalsContact O-CZ3 3.24Å; E862-W888 WeakPolarHBondContact O-CZ3 3.22Å; F863-W888 HydrophobicContact CB-CD2 3.79Å; F863-W888 HydrophobicContact CB-CE3 3.83Å; F863-W888 HydrophobicContact CB-CG 4.48Å; F863-W888 HydrophobicContact CB-CH2 3.97Å; F863-W888 HydrophobicContact CB-CZ2 3.87Å; F863-W888 HydrophobicContact CB-CZ3 3.93Å; F863-W888 AromaticContact CD1-CH2 3.64Å; F863-W888 HydrophobicContact CD1-CH2 3.64Å; F863-W888 AromaticContact CD1-CZ2 3.44Å; F863-W888 HydrophobicContact CD1-CZ2 3.44Å; F863-W888 VanDerWaalsContact CD1-CZ2 3.44Å; F863-W888 HydrophobicContact CD1-CZ3 4.4Å; F863-W888 HydrophobicContact CE1-CZ2 4.3Å; F863-W888 HydrophobicContact CG-CH2 4.3Å; F863-W888 HydrophobicContact CG-CZ2 4.03Å; W888-D890 PolarHBondContact O-N 2.97Å; W888-D890 VanDerWaalsContact O-N 3.11Å; W888-I891 HydrophobicContact CB-CB 4.06Å; W888-I891 HydrophobicContact CB-CD1 3.98Å; W888-I891 HydrophobicContact CB-CG1 4.26Å; W888-I891 PolarHBondContact O-N 3.36Å; W888-I891 VanDerWaalsContact O-N 3.16Å
889	P	93.1	Very high	90	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	119.8	171	-33.6	39.7	0	0	0	112.2	W342 A343 Y405 G406 W433 Q438 I891	W342-P889 WeakPolarHBondContact O-CA 3.39Å; A343-P889 HydrophobicContact CB-CG 4.37Å; Y405-P889 HydrophobicContact CD2-CG 4.4Å; Y405-P889 HydrophobicContact CE2-CB 4.03Å; Y405-P889 HydrophobicContact CE2-CG 3.98Å; Y405-P889 PolarHBondContact OH-O 3.46Å; G406-P889 VanDerWaalsContact CA-CG 3.41Å; W433-P889 HydrophobicContact CH2-CB 3.83Å; W433-P889 HydrophobicContact CH2-CG 4.38Å; W433-P889 HydrophobicContact CZ2-CB 3.89Å; W433-P889 HydrophobicContact CZ3-CB 4.32Å; Q438-P889 HydrophobicContact CG-CB 4.34Å; P889-I891 PolarHBondContact O-N 2.8Å
890	D	91	Very high	91	Very high	14 Å²	14	27.9 Å²	27.9	8%	0.075	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	2.4	179.2	-63.3	-34.8	0	0	0	118.3	R341 W342 W433 P720 T753 W888	R341-D890 IonicContact CZ-OD1 2.8Å; R341-D890 IonicContact CZ-OD2 3.48Å; R341-D890 IonicContact NE-OD1 2.86Å; R341-D890 PolarHBondContact NE-OD1 3.44Å; R341-D890 IonicContact NH2-OD1 2.96Å; R341-D890 PolarHBondContact NH2-OD1 3.38Å; R341-D890 IonicContact NH2-OD2 3.91Å; R341-D890 PolarHBondContact NH2-OD2 3.02Å; W342-D890 PolarHBondContact O-N 2.79Å; W342-D890 VanDerWaalsContact O-N 3.17Å; W433-D890 WeakPolarHBondContact CZ2-OD1 3.49Å; W433-D890 PolarHBondContact NE1-OD2 3.35Å; P720-D890 HydrophobicContact CB-CB 3.69Å; P720-D890 HydrophobicContact CG-CB 4.19Å; T753-D890 WeakPolarHBondContact CB-OD2 3.05Å; T753-D890 VanDerWaalsContact CG2-OD2 3.28Å; T753-D890 WeakPolarHBondContact CG2-OD2 3.06Å; T753-D890 WeakPolarHBondContact OG1-CB 3.23Å; T753-D890 PolarHBondContact OG1-OD2 3.07Å; W888-D890 PolarHBondContact O-N 2.97Å; W888-D890 VanDerWaalsContact O-N 3.11Å
891	I	89.2	Confident	91.8	Very high	75 Å²	75	27.6 Å²	27.6	39%	0.385	15%	0.154	S	C	.	.	B	Isolated β-bridge	trans	-99.3	114.2	174.3	-56.6	175.8	0	0	0	107	W888 P889	W888-I891 HydrophobicContact CB-CB 4.06Å; W888-I891 HydrophobicContact CB-CD1 3.98Å; W888-I891 HydrophobicContact CB-CG1 4.26Å; W888-I891 PolarHBondContact O-N 3.36Å; W888-I891 VanDerWaalsContact O-N 3.16Å; P889-I891 PolarHBondContact O-N 2.8Å
892	P	86.7	Confident	92.3	Very high	78 Å²	78	28.5 Å²	28.5	51%	0.506	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-59.6	137.1	177.2	23.9	-31.9	0	0	0	110.3	W342	W342-P892 HydrophobicContact CZ2-CB 4.43Å
893	P	91.7	Very high	92.6	Very high	29 Å²	29	27.6 Å²	27.6	19%	0.188	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-61.5	146.9	171.6	25.4	-32.2	0	0	0	110.2	W342 P885	W342-P893 VanDerWaalsContact CE3-CD 3.49Å; W342-P893 HydrophobicContact CE3-CG 4.06Å; W342-P893 HydrophobicContact CH2-CG 4.1Å; W342-P893 HydrophobicContact CZ3-CG 3.82Å; P885-P893 HydrophobicContact CB-CB 3.88Å; P885-P893 HydrophobicContact CG-CB 4.21Å
894	L	92.2	Very high	92.7	Very high	35 Å²	35	31.7 Å²	31.7	18%	0.183	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-58.5	135.5	171.9	-69.4	-178.6	0	0	0	110	F831 P885 H925 V956 F957	F831-L894 HydrophobicContact CB-CD1 4.07Å; F831-L894 HydrophobicContact CB-CG 4.45Å; F831-L894 HydrophobicContact CD2-CD1 3.51Å; F831-L894 HydrophobicContact CE2-CD1 4.23Å; F831-L894 HydrophobicContact CG-CD1 3.97Å; P885-L894 WeakPolarHBondContact CB-O 3.2Å; L894-H925 HydrophobicContact CD1-CB 4.14Å; L894-V956 HydrophobicContact CB-CG1 3.46Å; L894-V956 VanDerWaalsContact CB-CG1 3.46Å; L894-V956 HydrophobicContact CD1-CG1 4.01Å; L894-V956 HydrophobicContact CG-CG1 4.39Å; L894-F957 HydrophobicContact CB-CB 4.49Å; L894-F957 HydrophobicContact CD2-CD1 4.42Å
895	P	91.6	Very high	92.8	Very high	49 Å²	49	31.8 Å²	31.8	32%	0.318	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-67.2	150.7	-178.4	26.1	-31.3	0	0	0	110.7	V897 F957	P895-V897 HydrophobicContact CG-CG2 4.4Å; P895-F957 HydrophobicContact CG-CB 3.97Å; P895-F957 HydrophobicContact CG-CG 4.47Å; P895-F957 PolarHBondContact O-N 3.47Å
896	K	90.3	Very high	92.6	Very high	84 Å²	84	31.1 Å²	31.1	37%	0.365	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.9	166.3	-69.8	-178.2	167.1	-162.6	0	108.4	E954 V956	K896-E954 WeakPolarHBondContact CD-OE1 3.19Å; K896-E954 IonicContact NZ-OE1 3.38Å; K896-V956 HydrophobicContact CG-CG2 4.39Å
897	V	93.2	Very high	92.4	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.9	-173.4	179	0	0	0	0	109.4	P895 Y899 E954 A955 F957 P987 E988	P895-V897 HydrophobicContact CG-CG2 4.4Å; V897-Y899 HydrophobicContact CB-CD2 4.27Å; V897-Y899 HydrophobicContact CB-CE2 3.71Å; V897-Y899 HydrophobicContact CG1-CD1 4.23Å; V897-Y899 HydrophobicContact CG1-CD2 4.02Å; V897-Y899 HydrophobicContact CG1-CE1 3.94Å; V897-Y899 HydrophobicContact CG1-CE2 3.72Å; V897-Y899 HydrophobicContact CG1-CG 4.26Å; V897-E954 WeakPolarHBondContact O-CA 3.43Å; V897-A955 PolarHBondContact N-O 3.02Å; V897-A955 PolarHBondContact O-N 2.88Å; V897-A955 VanDerWaalsContact O-O 3.1Å; V897-F957 HydrophobicContact CG2-CB 3.93Å; V897-F957 HydrophobicContact CG2-CD2 4.01Å; V897-F957 HydrophobicContact CG2-CG 4.43Å; V897-P987 HydrophobicContact CG1-CG 3.75Å; V897-E988 HydrophobicContact CG2-CB 4.22Å
898	L	93.6	Very high	92.2	Very high	81 Å²	81	39.5 Å²	39.5	42%	0.424	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	96	173.1	-170.6	66.6	0	0	0	108.8	E952 E954	L898-E952 HydrophobicContact CD1-CB 3.92Å; L898-E952 HydrophobicContact CD2-CB 4.49Å; L898-E952 HydrophobicContact CG-CB 4.17Å; L898-E954 HydrophobicContact CD1-CB 4.12Å
899	Y	94.7	Very high	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	130.9	178.6	-66.8	-84.9	0	0	0	110.3	V897 I921 E952 V953 A955 L958 L961 V984 D986	V897-Y899 HydrophobicContact CB-CD2 4.27Å; V897-Y899 HydrophobicContact CB-CE2 3.71Å; V897-Y899 HydrophobicContact CG1-CD1 4.23Å; V897-Y899 HydrophobicContact CG1-CD2 4.02Å; V897-Y899 HydrophobicContact CG1-CE1 3.94Å; V897-Y899 HydrophobicContact CG1-CE2 3.72Å; V897-Y899 HydrophobicContact CG1-CG 4.26Å; Y899-I921 HydrophobicContact CG-CD1 4.24Å; Y899-E952 WeakPolarHBondContact O-CA 3.18Å; Y899-V953 PolarHBondContact N-O 3.15Å; Y899-V953 PolarHBondContact O-N 3.36Å; Y899-A955 HydrophobicContact CD2-CB 4.26Å; Y899-A955 HydrophobicContact CE2-CB 4.09Å; Y899-L958 HydrophobicContact CE2-CD1 4.26Å; Y899-L958 HydrophobicContact CE2-CG 4.3Å; Y899-L958 PolarHBondContact OH-N 3Å; Y899-L961 HydrophobicContact CE1-CD2 4.43Å; Y899-V984 HydrophobicContact CD1-CG1 3.94Å; Y899-V984 HydrophobicContact CG-CG1 4.4Å; Y899-D986 HydrophobicContact CD1-CB 4.14Å; Y899-D986 HydrophobicContact CE1-CB 3.85Å
900	T	95.4	Very high	91.9	Very high	26 Å²	26	41.8 Å²	41.8	16%	0.16	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	123	171.4	-47.3	0	0	0	0	109.3	F902 Q950 F951 V984 K985	T900-F902 HydrophobicContact CG2-CE1 4.39Å; T900-F902 HydrophobicContact CG2-CE2 3.81Å; T900-F902 HydrophobicContact CG2-CZ 3.68Å; T900-Q950 HydrophobicContact CG2-CG 3.65Å; T900-F951 CarbonylContact C-O 3.53Å; T900-F951 WeakPolarHBondContact CA-O 3.19Å; T900-V984 WeakPolarHBondContact O-CA 3.26Å; T900-K985 PolarHBondContact N-O 3.37Å; T900-K985 PolarHBondContact O-N 2.87Å
901	I	95.5	Very high	91.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.5	-177	-54.8	169.4	0	0	0	108.9	V903 L919 I921 Q950 F951 V953 I982 A983 V984	I901-V903 HydrophobicContact CG2-CG2 4.13Å; I901-L919 HydrophobicContact CD1-CD1 4.07Å; I901-L919 HydrophobicContact CD1-CD2 3.6Å; I901-L919 HydrophobicContact CD1-CG 4.42Å; I901-L919 HydrophobicContact CG2-CD1 3.86Å; I901-I921 HydrophobicContact CD1-CD1 4.16Å; I901-I921 HydrophobicContact CG1-CD1 4.47Å; I901-Q950 CarbonylContact O-C 3.55Å; I901-Q950 VanDerWaalsContact O-CA 3.27Å; I901-Q950 WeakPolarHBondContact O-CA 2.88Å; I901-F951 HydrophobicContact CB-CB 4.38Å; I901-F951 PolarHBondContact N-O 3.43Å; I901-F951 PolarHBondContact O-N 2.85Å; I901-V953 HydrophobicContact CD1-CB 3.81Å; I901-V953 HydrophobicContact CD1-CG2 3.37Å; I901-I982 HydrophobicContact CG2-CG2 3.7Å; I901-A983 CarbonylContact C-O 3.21Å; I901-A983 WeakPolarHBondContact CA-O 3.48Å; I901-V984 HydrophobicContact CG1-CG2 4.49Å
902	F	94.9	Very high	91.5	Very high	42 Å²	42	49.4 Å²	49.4	18%	0.184	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.2	173.7	-59	-86.2	0	0	0	108.5	T900 Y904 N949 Q950 I982 A983 K985	T900-F902 HydrophobicContact CG2-CE1 4.39Å; T900-F902 HydrophobicContact CG2-CE2 3.81Å; T900-F902 HydrophobicContact CG2-CZ 3.68Å; F902-Y904 HydrophobicContact CB-CE2 3.82Å; F902-N949 CarbonylContact C-O 3.56Å; F902-N949 WeakPolarHBondContact CA-O 3.37Å; F902-Q950 HydrophobicContact CD1-CB 4.23Å; F902-Q950 HydrophobicContact CD1-CG 4.18Å; F902-Q950 HydrophobicContact CE1-CB 4.21Å; F902-Q950 HydrophobicContact CE1-CG 3.81Å; F902-Q950 HydrophobicContact CZ-CG 4.35Å; F902-I982 CarbonylContact O-C 3.49Å; F902-I982 VanDerWaalsContact O-CA 3.28Å; F902-I982 WeakPolarHBondContact O-CA 3.42Å; F902-A983 HydrophobicContact CB-CB 4.21Å; F902-A983 HydrophobicContact CD2-CB 4.37Å; F902-A983 PolarHBondContact N-O 2.85Å; F902-A983 PolarHBondContact O-N 2.96Å; F902-K985 HydrophobicContact CE2-CB 4.32Å
903	V	94.5	Very high	91.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	113.4	175.4	-177.9	0	0	0	0	107.9	I901 L933 F943 C948 N949 F951 W977 V979 I982	I901-V903 HydrophobicContact CG2-CG2 4.13Å; V903-L933 HydrophobicContact CG2-CD1 4.34Å; V903-F943 HydrophobicContact CB-CE1 4.48Å; V903-F943 HydrophobicContact CG1-CD1 4.32Å; V903-F943 HydrophobicContact CG1-CE1 4.17Å; V903-C948 CarbonylContact O-C 3.41Å; V903-C948 WeakPolarHBondContact O-CA 3.15Å; V903-N949 PolarHBondContact N-O 2.9Å; V903-N949 PolarHBondContact O-N 3.27Å; V903-F951 HydrophobicContact CB-CE2 4.22Å; V903-F951 HydrophobicContact CG2-CD2 3.99Å; V903-F951 HydrophobicContact CG2-CE2 3.81Å; V903-W977 HydrophobicContact CG1-CZ2 4.32Å; V903-V979 HydrophobicContact CG1-CG1 4.2Å; V903-I982 HydrophobicContact CG2-CG2 4.46Å
904	Y	93.9	Very high	91.1	Very high	93 Å²	93	49.9 Å²	49.9	37%	0.365	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.9	176.1	-60.9	-90.9	0	0	0	108.8	F902 C948 S980 A981 A983	F902-Y904 HydrophobicContact CB-CE2 3.82Å; Y904-C948 HydrophobicContact CD1-CB 3.88Å; Y904-C948 HydrophobicContact CE1-CB 3.95Å; Y904-C948 WeakPolarHBondContact CE1-SG 3.13Å; Y904-S980 VanDerWaalsContact CB-OG 3.24Å; Y904-S980 WeakPolarHBondContact CB-OG 2.85Å; Y904-S980 PolarHBondContact O-N 3.15Å; Y904-S980 PolarHBondContact O-OG 3.48Å; Y904-S980 VanDerWaalsContact O-OG 3.08Å; Y904-A981 WeakPolarHBondContact CB-O 3.29Å; Y904-A981 HydrophobicContact CD2-CB 3.99Å; Y904-A981 WeakPolarHBondContact CD2-O 3.49Å; Y904-A981 HydrophobicContact CG-CB 4.46Å; Y904-A981 PolarHBondContact N-O 2.79Å; Y904-A981 PolarHBondContact O-N 3.47Å; Y904-A983 HydrophobicContact CE2-CB 4Å
905	N	92.6	Very high	90.8	Very high	5 Å²	5	49.1 Å²	49.1	3%	0.027	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134.6	-179.3	-55	-80.9	0	0	0	109.6	E944 E946 N947 N949 W977 H978	N905-E944 WeakPolarHBondContact CB-O 3.14Å; N905-E946 VanDerWaalsContact O-CA 3.23Å; N905-E946 WeakPolarHBondContact O-CA 3.36Å; N905-E946 PolarHBondContact O-N 3.03Å; N905-E946 VanDerWaalsContact O-N 3.1Å; N905-N947 PolarHBondContact N-O 3.42Å; N905-N947 PolarHBondContact ND2-O 2.78Å; N905-N949 PolarHBondContact ND2-OD1 3.02Å; N905-W977 PolarHBondContact OD1-NE1 2.73Å; N905-H978 CarbonylContact C-O 3.52Å; N905-H978 WeakPolarHBondContact CA-O 3.39Å
906	G	90.9	Very high	90.5	Very high	6 Å²	6	48.9 Å²	48.9	6%	0.062	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-76.7	165	177.1	0	0	0	0	0	113	D908 T909 H978	G906-D908 PolarHBondContact O-N 2.9Å; G906-T909 WeakPolarHBondContact O-CB 3.5Å; G906-T909 PolarHBondContact O-N 3.17Å; G906-T909 PolarHBondContact O-OG1 2.9Å; G906-H978 PolarHBondContact N-O 2.74Å
907	H	89.7	Confident	90.5	Very high	123 Å²	123	44.9 Å²	44.9	57%	0.569	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-27	-179.4	62.1	-83.8	0	0	0	114.3	T909 E946	H907-T909 PolarHBondContact O-N 3.38Å; H907-E946 HydrophobicContact CB-CG 3.95Å
908	D	89.1	Confident	90.4	Very high	70 Å²	70	48 Å²	48	37%	0.374	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	2.1	179.2	-59.3	-46.4	0	0	0	114.1	G906 C976 H978	G906-D908 PolarHBondContact O-N 2.9Å; D908-C976 PolarHBondContact O-SG 2.71Å; D908-H978 HydrophobicContact CB-CB 4.08Å; D908-H978 IonicContact OD2-CE1 2.88Å; D908-H978 IonicContact OD2-ND1 3.73Å; D908-H978 PolarHBondContact OD2-ND1 2.61Å
909	T	90.6	Very high	90.4	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.043	22%	0.222	C	C	.	.	S	Bend	trans	-74.9	130.3	177.8	-57.4	0	0	0	0	110.6	G906 H907 F943 P945 H978	G906-T909 WeakPolarHBondContact O-CB 3.5Å; G906-T909 PolarHBondContact O-N 3.17Å; G906-T909 PolarHBondContact O-OG1 2.9Å; H907-T909 PolarHBondContact O-N 3.38Å; T909-F943 WeakPolarHBondContact CG2-O 3.46Å; T909-P945 WeakPolarHBondContact O-CB 3.42Å; T909-P945 WeakPolarHBondContact O-CG 3.39Å; T909-H978 PolarHBondContact OG1-N 3.27Å; T909-H978 VanDerWaalsContact OG1-N 3.12Å; T909-H978 PolarHBondContact OG1-O 3.21Å
910	V	89.5	Confident	90.4	Very high	58 Å²	58	44.9 Å²	44.9	35%	0.352	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-72.4	131.7	178.9	171.4	0	0	0	0	110.2	Q913 C976	V910-Q913 VanDerWaalsContact O-CD 3.24Å; V910-Q913 WeakPolarHBondContact O-CG 3.41Å; V910-Q913 PolarHBondContact O-NE2 2.85Å; V910-C976 HydrophobicContact CG2-CB 3.9Å; V910-C976 PolarHBondContact N-O 2.93Å; V910-C976 VanDerWaalsContact N-O 3.14Å
911	K	88.2	Confident	90.4	Very high	141 Å²	141	43.7 Å²	43.7	61%	0.613	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	154.9	178.2	-68.4	-170.6	173.9	-178.2	0	111.9	Q913 E944 P945	K911-Q913 PolarHBondContact O-N 2.88Å; K911-Q913 VanDerWaalsContact O-N 3.15Å; K911-E944 WeakPolarHBondContact CA-OE2 3.39Å; K911-P945 HydrophobicContact CD-CG 4.08Å; K911-P945 HydrophobicContact CG-CG 3.42Å; K911-P945 VanDerWaalsContact CG-CG 3.42Å
912	D	83.8	Confident	90.5	Very high	108 Å²	108	48.1 Å²	48.1	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	22.5	168.8	-59.3	-42.6	0	0	0	115.3	K941 E944	D912-K941 WeakPolarHBondContact OD1-CE 3.42Å; D912-K941 IonicContact OD1-NZ 2.71Å; D912-K941 PolarHBondContact OD1-NZ 2.66Å; D912-E944 PolarHBondContact N-OE1 3.15Å
913	Q	85.1	Confident	90.5	Very high	24 Å²	24	46.8 Å²	46.8	11%	0.112	24%	0.235	C	C	.	.			trans	-90.4	156.4	175.9	65.2	-171.5	-15	0	0	112.3	V910 K911 F974 C976	V910-Q913 VanDerWaalsContact O-CD 3.24Å; V910-Q913 WeakPolarHBondContact O-CG 3.41Å; V910-Q913 PolarHBondContact O-NE2 2.85Å; K911-Q913 PolarHBondContact O-N 2.88Å; K911-Q913 VanDerWaalsContact O-N 3.15Å; Q913-F974 HydrophobicContact CB-CB 4.19Å; Q913-F974 HydrophobicContact CG-CB 4.07Å; Q913-F974 VanDerWaalsContact OE1-CB 3.23Å; Q913-C976 PolarHBondContact NE2-O 3.04Å; Q913-C976 PolarHBondContact OE1-O 3.21Å
914	T	83.5	Confident	90.5	Very high	92 Å²	92	51.7 Å²	51.7	56%	0.564	26%	0.258	S	S	*	.	B	Isolated β-bridge	trans	-99.5	103.8	176.4	61.4	0	0	0	0	110.3	S972 D973	T914-S972 WeakPolarHBondContact O-CB 3.27Å; T914-D973 PolarHBondContact N-O 3.09Å; T914-D973 CarbonylContact O-C 3.42Å; T914-D973 PolarHBondContact O-N 2.89Å; T914-D973 VanDerWaalsContact O-N 3.07Å; T914-D973 WeakPolarHBondContact OG1-CB 3.3Å; T914-D973 PolarHBondContact OG1-O 3.28Å
915	L	85.9	Confident	90.5	Very high	19 Å²	19	50 Å²	50	10%	0.099	25%	0.253	C	S	.	.			trans	-116.2	123.4	-179.3	177.3	65.9	0	0	0	111.3	F943 A968 F974 W977	L915-F943 HydrophobicContact CB-CD2 4Å; L915-F943 HydrophobicContact CD2-CB 3.9Å; L915-F943 HydrophobicContact CD2-CD1 4.48Å; L915-F943 HydrophobicContact CD2-CD2 3.67Å; L915-F943 HydrophobicContact CD2-CE2 4.31Å; L915-F943 HydrophobicContact CD2-CG 3.77Å; L915-F943 HydrophobicContact CG-CD2 3.94Å; L915-F943 HydrophobicContact CG-CE2 4.34Å; L915-A968 HydrophobicContact CD1-CB 3.69Å; L915-F974 HydrophobicContact CB-CB 4.41Å; L915-F974 HydrophobicContact CD1-CB 4.37Å; L915-F974 HydrophobicContact CD1-CD1 3.67Å; L915-F974 HydrophobicContact CD1-CD2 4.12Å; L915-F974 HydrophobicContact CD1-CE1 3.85Å; L915-F974 HydrophobicContact CD1-CE2 4.29Å; L915-F974 HydrophobicContact CD1-CG 3.8Å; L915-F974 HydrophobicContact CD1-CZ 4.16Å; L915-W977 HydrophobicContact CD1-CE3 4.32Å; L915-W977 HydrophobicContact CD2-CB 4.17Å; L915-W977 HydrophobicContact CD2-CD2 3.26Å; L915-W977 HydrophobicContact CD2-CE3 3.49Å; L915-W977 VanDerWaalsContact CD2-CE3 3.49Å; L915-W977 HydrophobicContact CD2-CG 3.6Å; L915-W977 HydrophobicContact CD2-CH2 4.09Å; L915-W977 HydrophobicContact CD2-CZ2 3.95Å; L915-W977 HydrophobicContact CD2-CZ3 3.89Å; L915-W977 HydrophobicContact CG-CE3 4.5Å
916	S	85.9	Confident	90.6	Very high	44 Å²	44	50.9 Å²	50.9	31%	0.308	26%	0.264	S	S	.	.			trans	-103.8	127	166	-179	0	0	0	0	108.8	D969 S972	S916-D969 WeakPolarHBondContact O-CB 3.42Å; S916-D969 PolarHBondContact O-N 2.85Å; S916-S972 PolarHBondContact N-OG 2.78Å; S916-S972 PolarHBondContact O-OG 3.15Å
917	A	89.7	Confident	90.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	147.8	-178.9	0	0	0	0	0	111.2	L933 F943 T967 W977	A917-L933 HydrophobicContact CB-CD1 4.25Å; A917-L933 PolarHBondContact O-N 3.42Å; A917-F943 HydrophobicContact CB-CE2 4.26Å; A917-F943 HydrophobicContact CB-CZ 3.94Å; A917-T967 CarbonylContact C-O 3.52Å; A917-T967 WeakPolarHBondContact CA-O 3.46Å; A917-W977 HydrophobicContact CB-CH2 3.73Å; A917-W977 HydrophobicContact CB-CZ3 4.16Å
918	R	91.2	Very high	91.1	Very high	68 Å²	68	45.7 Å²	45.7	26%	0.257	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.5	171.8	-57.2	-176.5	-165.9	-172.6	5.6	109.5	P930 R931 V932 I966 T967 D969	R918-P930 HydrophobicContact CB-CB 4.46Å; R918-R931 CarbonylContact C-O 3.54Å; R918-R931 VanDerWaalsContact CA-O 3.25Å; R918-R931 WeakPolarHBondContact CA-O 3.25Å; R918-V932 HydrophobicContact CG-CG2 4.25Å; R918-I966 CarbonylContact O-C 3.59Å; R918-I966 WeakPolarHBondContact O-CA 3.39Å; R918-T967 PolarHBondContact N-O 2.95Å; R918-T967 PolarHBondContact O-N 2.77Å; R918-D969 IonicContact CZ-OD2 2.77Å; R918-D969 IonicContact NE-OD2 3.05Å; R918-D969 IonicContact NH2-OD2 2.84Å; R918-D969 PolarHBondContact NH2-OD2 2.84Å
919	L	93.7	Very high	91.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.9	-177.7	-174.9	152.7	0	0	0	110.7	I901 I921 R931 L933 I964 G965 I966 I982	I901-L919 HydrophobicContact CD1-CD1 4.07Å; I901-L919 HydrophobicContact CD1-CD2 3.6Å; I901-L919 HydrophobicContact CD1-CG 4.42Å; I901-L919 HydrophobicContact CG2-CD1 3.86Å; L919-I921 HydrophobicContact CD2-CD1 4.25Å; L919-I921 HydrophobicContact CD2-CG1 3.51Å; L919-R931 PolarHBondContact N-O 2.86Å; L919-R931 PolarHBondContact O-N 2.8Å; L919-L933 HydrophobicContact CB-CD1 4.05Å; L919-L933 HydrophobicContact CB-CD2 3.99Å; L919-L933 HydrophobicContact CB-CG 4.09Å; L919-L933 HydrophobicContact CD1-CD1 4.07Å; L919-L933 HydrophobicContact CD1-CD2 4.44Å; L919-I964 HydrophobicContact CD1-CD1 3.97Å; L919-I964 HydrophobicContact CD1-CG1 4.21Å; L919-I964 HydrophobicContact CD2-CD1 3.95Å; L919-I964 HydrophobicContact CD2-CG1 4Å; L919-I964 HydrophobicContact CG-CD1 4.15Å; L919-I964 HydrophobicContact CG-CG1 3.98Å; L919-G965 CarbonylContact C-O 3.55Å; L919-G965 VanDerWaalsContact CA-O 3.32Å; L919-G965 WeakPolarHBondContact CA-O 3.45Å; L919-I966 HydrophobicContact CD1-CD1 4.3Å; L919-I982 HydrophobicContact CD1-CG2 4.47Å
920	T	95.2	Very high	91.1	Very high	17 Å²	17	44.2 Å²	44.2	10%	0.104	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125	175.2	-55.3	0	0	0	0	109.2	Y922 D927 P930 G965	T920-Y922 HydrophobicContact CG2-CD2 4.19Å; T920-Y922 HydrophobicContact CG2-CE1 4.12Å; T920-Y922 HydrophobicContact CG2-CE2 3.56Å; T920-D927 HydrophobicContact CG2-CB 4.01Å; T920-P930 WeakPolarHBondContact OG1-CA 3.46Å; T920-G965 PolarHBondContact N-O 2.87Å; T920-G965 PolarHBondContact O-N 2.79Å
921	I	95.9	Very high	91.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	133.2	175.5	-51.8	173.9	0	0	0	108.1	Y899 I901 L919 D927 S928 V953 L958 L961 I964 V984	Y899-I921 HydrophobicContact CG-CD1 4.24Å; I901-I921 HydrophobicContact CD1-CD1 4.16Å; I901-I921 HydrophobicContact CG1-CD1 4.47Å; L919-I921 HydrophobicContact CD2-CD1 4.25Å; L919-I921 HydrophobicContact CD2-CG1 3.51Å; I921-D927 CarbonylContact O-C 3.49Å; I921-D927 WeakPolarHBondContact O-CA 3.26Å; I921-S928 PolarHBondContact N-OG 3.43Å; I921-S928 PolarHBondContact O-N 3.27Å; I921-V953 HydrophobicContact CD1-CG1 4.39Å; I921-L958 HydrophobicContact CB-CD1 3.68Å; I921-L958 HydrophobicContact CG2-CD1 3.6Å; I921-L961 HydrophobicContact CG2-CD1 3.96Å; I921-L961 HydrophobicContact CG2-CD2 3.7Å; I921-L961 HydrophobicContact CG2-CG 4.33Å; I921-I964 HydrophobicContact CG1-CD1 4.44Å; I921-V984 HydrophobicContact CD1-CG1 4.16Å
922	Y	96.2	Very high	91	Very high	93 Å²	93	38.1 Å²	38.1	37%	0.365	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.9	176.1	-61	-94.7	0	0	0	110.3	T920 D927 R962 Q963	T920-Y922 HydrophobicContact CG2-CD2 4.19Å; T920-Y922 HydrophobicContact CG2-CE1 4.12Å; T920-Y922 HydrophobicContact CG2-CE2 3.56Å; Y922-D927 HydrophobicContact CD1-CB 3.52Å; Y922-D927 HydrophobicContact CE1-CB 3.67Å; Y922-D927 HydrophobicContact CG-CB 4.23Å; Y922-R962 PolarHBondContact O-N 3.07Å; Y922-Q963 WeakPolarHBondContact CB-O 3.36Å; Y922-Q963 HydrophobicContact CD2-CB 4.32Å; Y922-Q963 HydrophobicContact CD2-CG 4.28Å; Y922-Q963 PolarHBondContact N-O 2.86Å; Y922-Q963 PolarHBondContact O-N 2.83Å
923	G	95.2	Very high	91.2	Very high	14 Å²	14	33.3 Å²	33.3	14%	0.144	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	-170.4	177.4	0	0	0	0	0	113	H925 G926 L958 R960	G923-H925 VanDerWaalsContact C-N 3.29Å; G923-H925 PolarHBondContact O-N 2.87Å; G923-G926 PolarHBondContact N-O 3Å; G923-G926 PolarHBondContact O-N 2.8Å; G923-L958 CarbonylContact C-O 3.09Å; G923-L958 VanDerWaalsContact C-O 3.29Å; G923-L958 WeakPolarHBondContact CA-O 3.49Å; G923-R960 WeakPolarHBondContact CA-O 3.28Å
924	E	94.4	Very high	91	Very high	104 Å²	104	38.7 Å²	38.7	49%	0.486	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-33.3	179	-72.8	173.3	164.9	0	0	113.3	G926 L958 R960 R962	E924-G926 VanDerWaalsContact C-N 3.34Å; E924-G926 PolarHBondContact O-N 3.21Å; E924-L958 PolarHBondContact N-O 2.74Å; E924-R960 VanDerWaalsContact CD-CB 3.45Å; E924-R960 HydrophobicContact CG-CB 4.09Å; E924-R960 PolarHBondContact N-O 3.01Å; E924-R960 WeakPolarHBondContact OE1-CB 3.45Å; E924-R960 WeakPolarHBondContact OE2-CB 3.48Å; E924-R960 PolarHBondContact OE2-N 3.42Å; E924-R962 IonicContact OE1-CZ 3.8Å; E924-R962 IonicContact OE1-NE 2.74Å; E924-R962 IonicContact OE1-NH2 2.86Å; E924-R962 PolarHBondContact OE1-NH2 2.99Å
925	H	94.9	Very high	90.6	Very high	57 Å²	57	35.2 Å²	35.2	26%	0.264	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	34.2	178.4	-56.1	135.5	0	0	0	112.8	F831 L894 G923 F957 L958	F831-H925 HydrophobicContact CD2-CB 4.5Å; F831-H925 HydrophobicContact CE2-CB 3.81Å; F831-H925 WeakPolarHBondContact CE2-O 3.43Å; F831-H925 HydrophobicContact CZ-CB 3.92Å; F831-H925 WeakPolarHBondContact CZ-O 3.4Å; L894-H925 HydrophobicContact CD1-CB 4.14Å; G923-H925 VanDerWaalsContact C-N 3.29Å; G923-H925 PolarHBondContact O-N 2.87Å; H925-F957 WeakPolarHBondContact CB-O 3.46Å; H925-F957 AromaticContact ND1-CD1 3.83Å; H925-F957 PolarHBondContact ND1-O 2.97Å; H925-L958 PolarHBondContact N-O 2.88Å
926	G	94.9	Very high	89.8	Confident	24 Å²	24	41 Å²	41	25%	0.247	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.4	-150.9	178.5	0	0	0	0	0	113.3	G923 E924	G923-G926 PolarHBondContact N-O 3Å; G923-G926 PolarHBondContact O-N 2.8Å; E924-G926 VanDerWaalsContact C-N 3.34Å; E924-G926 PolarHBondContact O-N 3.21Å
927	D	95.4	Very high	89.2	Confident	19 Å²	19	44.9 Å²	44.9	10%	0.102	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	160.8	-174.1	67.6	98.6	0	0	0	112.7	Y794 K832 R834 T920 I921 Y922 G929	Y794-D927 WeakPolarHBondContact CE1-OD2 3.19Å; Y794-D927 PolarHBondContact OH-OD1 2.87Å; Y794-D927 PolarHBondContact OH-OD2 3Å; K832-D927 PolarHBondContact NZ-O 2.83Å; R834-D927 IonicContact CZ-OD1 2.73Å; R834-D927 VanDerWaalsContact CZ-OD1 3.24Å; R834-D927 IonicContact NH1-OD1 3.75Å; R834-D927 PolarHBondContact NH1-OD1 3.21Å; R834-D927 PolarHBondContact NH2-O 3.3Å; R834-D927 IonicContact NH2-OD1 2.85Å; R834-D927 PolarHBondContact NH2-OD1 3.26Å; R834-D927 IonicContact NH2-OD2 3.94Å; T920-D927 HydrophobicContact CG2-CB 4.01Å; I921-D927 CarbonylContact O-C 3.49Å; I921-D927 WeakPolarHBondContact O-CA 3.26Å; Y922-D927 HydrophobicContact CD1-CB 3.52Å; Y922-D927 HydrophobicContact CE1-CB 3.67Å; Y922-D927 HydrophobicContact CG-CB 4.23Å; D927-G929 VanDerWaalsContact C-N 3.3Å; D927-G929 VanDerWaalsContact OD1-CA 3.22Å; D927-G929 WeakPolarHBondContact OD1-CA 3.4Å; D927-G929 PolarHBondContact OD1-N 2.87Å
928	S	94.2	Very high	88.1	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.269	C	S	.	.			trans	-75.9	-19.1	171.8	66	0	0	0	0	113.1	R834 E883 I921 R931	R834-S928 PolarHBondContact NH2-O 3.3Å; E883-S928 WeakPolarHBondContact OE1-CA 3.36Å; I921-S928 PolarHBondContact N-OG 3.43Å; I921-S928 PolarHBondContact O-N 3.27Å; S928-R931 PolarHBondContact O-NH1 3.01Å; S928-R931 PolarHBondContact O-NH2 3.14Å
929	G	90.4	Very high	87	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.295	C	S	.	.			trans	72.8	171.4	-164.6	0	0	0	0	0	111.5	R834 D927 R931	R834-G929 VanDerWaalsContact NH1-CA 3.28Å; D927-G929 VanDerWaalsContact C-N 3.3Å; D927-G929 VanDerWaalsContact OD1-CA 3.22Å; D927-G929 WeakPolarHBondContact OD1-CA 3.4Å; D927-G929 PolarHBondContact OD1-N 2.87Å; G929-R931 PolarHBondContact O-N 3.49Å
930	P	90	Very high	86.1	Confident	47 Å²	47	60.8 Å²	60.8	31%	0.305	32%	0.316	S	S	.	.			trans	-67.1	126.4	-178.4	27.3	-33.3	0	0	0	110.4	R918 T920	R918-P930 HydrophobicContact CB-CB 4.46Å; T920-P930 WeakPolarHBondContact OG1-CA 3.46Å
931	R	89.1	Confident	85.3	Confident	34 Å²	34	66.1 Å²	66.1	13%	0.128	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.4	175	-66.7	-76.4	-173.3	-71.8	-12.2	109.2	S881 E883 R918 L919 S928 G929 L933 V953 E954	S881-R931 PolarHBondContact OG-NH1 2.84Å; S881-R931 VanDerWaalsContact OG-NH1 3.17Å; E883-R931 IonicContact OE1-NH2 3.74Å; R918-R931 CarbonylContact C-O 3.54Å; R918-R931 VanDerWaalsContact CA-O 3.25Å; R918-R931 WeakPolarHBondContact CA-O 3.25Å; L919-R931 PolarHBondContact N-O 2.86Å; L919-R931 PolarHBondContact O-N 2.8Å; S928-R931 PolarHBondContact O-NH1 3.01Å; S928-R931 PolarHBondContact O-NH2 3.14Å; G929-R931 PolarHBondContact O-N 3.49Å; R931-L933 PolarHBondContact O-N 2.85Å; R931-V953 HydrophobicContact CB-CG1 4.3Å; R931-V953 HydrophobicContact CB-CG2 3.91Å; R931-V953 HydrophobicContact CG-CG1 3.71Å; R931-V953 HydrophobicContact CG-CG2 4.24Å; R931-E954 PolarHBondContact NE-O 2.76Å; R931-E954 PolarHBondContact NH2-O 2.83Å
932	V	86.7	Confident	84.8	Confident	36 Å²	36	67.5 Å²	67.5	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	128.1	176.8	-177.3	0	0	0	0	108.8	R918 Y934	R918-V932 HydrophobicContact CG-CG2 4.25Å; V932-Y934 HydrophobicContact CG1-CD1 4.48Å; V932-Y934 WeakPolarHBondContact O-CD1 3.38Å
933	L	88.3	Confident	84.5	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.037	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.2	174.9	-58.5	-176.8	0	0	0	108.7	V903 A917 L919 R931 F943 F951 I966	V903-L933 HydrophobicContact CG2-CD1 4.34Å; A917-L933 HydrophobicContact CB-CD1 4.25Å; A917-L933 PolarHBondContact O-N 3.42Å; L919-L933 HydrophobicContact CB-CD1 4.05Å; L919-L933 HydrophobicContact CB-CD2 3.99Å; L919-L933 HydrophobicContact CB-CG 4.09Å; L919-L933 HydrophobicContact CD1-CD1 4.07Å; L919-L933 HydrophobicContact CD1-CD2 4.44Å; R931-L933 PolarHBondContact O-N 2.85Å; L933-F943 HydrophobicContact CB-CZ 4.24Å; L933-F943 HydrophobicContact CD1-CE1 4.48Å; L933-F943 HydrophobicContact CD1-CZ 4.19Å; L933-F951 HydrophobicContact CB-CD1 3.93Å; L933-F951 HydrophobicContact CB-CD2 4.44Å; L933-F951 HydrophobicContact CB-CE1 3.81Å; L933-F951 HydrophobicContact CB-CE2 4.33Å; L933-F951 HydrophobicContact CB-CG 4.24Å; L933-F951 HydrophobicContact CB-CZ 4.01Å; L933-F951 HydrophobicContact CD1-CD2 4.12Å; L933-F951 HydrophobicContact CD1-CE2 4.04Å; L933-F951 HydrophobicContact CD1-CZ 4.46Å; L933-F951 HydrophobicContact CD2-CB 3.96Å; L933-F951 HydrophobicContact CD2-CD1 4.31Å; L933-F951 HydrophobicContact CD2-CD2 4.11Å; L933-F951 HydrophobicContact CD2-CG 3.87Å; L933-F951 HydrophobicContact CG-CD2 4.46Å; L933-F951 HydrophobicContact CG-CG 4.46Å; L933-I966 HydrophobicContact CD1-CD1 4.28Å
934	Y	80.4	Confident	84.2	Confident	138 Å²	138	63.9 Å²	63.9	54%	0.541	33%	0.327	S	S	.	.			trans	-132.5	155.9	178.3	61.6	-90.7	0	0	0	110.9	V932	V932-Y934 HydrophobicContact CG1-CD1 4.48Å; V932-Y934 WeakPolarHBondContact O-CD1 3.38Å
935	S	74.6	Confident	84	Confident	18 Å²	18	60 Å²	60	13%	0.126	31%	0.311	C	S	.	.			trans	-81.8	140.5	175.6	178.9	0	0	0	0	111.3	E937 Q940	S935-E937 VanDerWaalsContact C-N 3.29Å; S935-E937 PolarHBondContact OG-N 2.95Å; S935-E937 PolarHBondContact OG-O 3.04Å; S935-Q940 WeakPolarHBondContact OG-CB 3.22Å; S935-Q940 PolarHBondContact OG-OE1 2.84Å
936	T	69	Low	83.7	Confident	140 Å²	140	65 Å²	65	86%	0.859	34%	0.335	S	S	*	.	S	Bend	trans	-70.4	-25.5	166.8	8.6	0	0	0	0	112.3
937	E	72.9	Confident	83.6	Confident	127 Å²	127	67 Å²	67	59%	0.593	34%	0.34	S	S	*	.	S	Bend	trans	-94.2	125.9	-177.3	-66	178.9	-178.1	0	0	110.9	S935 G939 Q940	S935-E937 VanDerWaalsContact C-N 3.29Å; S935-E937 PolarHBondContact OG-N 2.95Å; S935-E937 PolarHBondContact OG-O 3.04Å; E937-G939 PolarHBondContact O-N 2.64Å; E937-Q940 HydrophobicContact CB-CB 4.07Å; E937-Q940 PolarHBondContact O-N 3.21Å
938	R	66.7	Low	83.4	Confident	233 Å²	233	68.5 Å²	68.5	88%	0.879	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	119.3	176.9	-68.5	-171.1	-154.4	-140.9	4.9	109.9
939	G	69.5	Low	83.3	Confident	78 Å²	78	68.7 Å²	68.7	80%	0.804	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	4.4	175.3	0	0	0	0	0	115.2	E937 K941	E937-G939 PolarHBondContact O-N 2.64Å; G939-K941 PolarHBondContact O-N 3.32Å
940	Q	74.8	Confident	83.5	Confident	91 Å²	91	74.3 Å²	74.3	43%	0.425	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-66.2	125	171.4	-169.9	-177.9	34.2	0	0	110	S935 E937 L942	S935-Q940 WeakPolarHBondContact OG-CB 3.22Å; S935-Q940 PolarHBondContact OG-OE1 2.84Å; E937-Q940 HydrophobicContact CB-CB 4.07Å; E937-Q940 PolarHBondContact O-N 3.21Å; Q940-L942 PolarHBondContact O-N 3.49Å
941	K	77.7	Confident	83.7	Confident	128 Å²	128	72.6 Å²	72.6	56%	0.557	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-74.9	120.7	171.4	-64.1	-176.9	-179.9	179.2	0	109.1	D912 G939 E944	D912-K941 WeakPolarHBondContact OD1-CE 3.42Å; D912-K941 IonicContact OD1-NZ 2.71Å; D912-K941 PolarHBondContact OD1-NZ 2.66Å; G939-K941 PolarHBondContact O-N 3.32Å; K941-E944 HydrophobicContact CB-CG 4.19Å
942	L	84.9	Confident	83.8	Confident	29 Å²	29	76.7 Å²	76.7	15%	0.152	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-97.5	153.1	178.9	-66.2	175.7	0	0	0	110	Q940 F951	Q940-L942 PolarHBondContact O-N 3.49Å; L942-F951 HydrophobicContact CD1-CE1 4.07Å; L942-F951 HydrophobicContact CD1-CZ 4.4Å; L942-F951 HydrophobicContact CD2-CE1 4.04Å; L942-F951 HydrophobicContact CD2-CZ 4.09Å
943	F	89.9	Confident	84	Confident	1 Å²	1	75.2 Å²	75.2	0%	0.004	38%	0.378	C	S	.	.	S	Bend	trans	61.1	43.4	173.4	-45.4	-70.5	0	0	0	114.5	V903 T909 L915 A917 L933 N949 F951 W977	V903-F943 HydrophobicContact CB-CE1 4.48Å; V903-F943 HydrophobicContact CG1-CD1 4.32Å; V903-F943 HydrophobicContact CG1-CE1 4.17Å; T909-F943 WeakPolarHBondContact CG2-O 3.46Å; L915-F943 HydrophobicContact CB-CD2 4Å; L915-F943 HydrophobicContact CD2-CB 3.9Å; L915-F943 HydrophobicContact CD2-CD1 4.48Å; L915-F943 HydrophobicContact CD2-CD2 3.67Å; L915-F943 HydrophobicContact CD2-CE2 4.31Å; L915-F943 HydrophobicContact CD2-CG 3.77Å; L915-F943 HydrophobicContact CG-CD2 3.94Å; L915-F943 HydrophobicContact CG-CE2 4.34Å; A917-F943 HydrophobicContact CB-CE2 4.26Å; A917-F943 HydrophobicContact CB-CZ 3.94Å; L933-F943 HydrophobicContact CB-CZ 4.24Å; L933-F943 HydrophobicContact CD1-CE1 4.48Å; L933-F943 HydrophobicContact CD1-CZ 4.19Å; F943-N949 VanDerWaalsContact CA-OD1 3.29Å; F943-N949 WeakPolarHBondContact CA-OD1 2.95Å; F943-N949 PolarHBondContact N-OD1 3.04Å; F943-F951 AromaticContact CE1-CE2 3.94Å; F943-F951 HydrophobicContact CE1-CE2 3.94Å; F943-F951 AromaticContact CE1-CZ 3.83Å; F943-F951 HydrophobicContact CE1-CZ 3.83Å; F943-F951 HydrophobicContact CE2-CZ 4.44Å; F943-F951 HydrophobicContact CZ-CE2 4.11Å; F943-F951 AromaticContact CZ-CZ 3.62Å; F943-F951 HydrophobicContact CZ-CZ 3.62Å; F943-W977 AromaticContact CD1-CE2 3.93Å; F943-W977 AromaticContact CD1-CZ2 3.58Å; F943-W977 HydrophobicContact CD1-CZ2 3.58Å; F943-W977 AromaticContact CD1-NE1 3.9Å; F943-W977 HydrophobicContact CE1-CH2 4.38Å; F943-W977 AromaticContact CE1-CZ2 3.73Å; F943-W977 HydrophobicContact CE1-CZ2 3.73Å; F943-W977 HydrophobicContact CG-CZ2 4.24Å; F943-W977 HydrophobicContact CZ-CZ2 4.47Å
944	E	90.5	Very high	84.1	Confident	30 Å²	30	79.9 Å²	79.9	14%	0.14	40%	0.399	C	S	.	.			trans	-77.9	151.5	171	-69.1	-64.9	153.3	0	0	111.3	N905 K911 D912 K941 N947	N905-E944 WeakPolarHBondContact CB-O 3.14Å; K911-E944 WeakPolarHBondContact CA-OE2 3.39Å; D912-E944 PolarHBondContact N-OE1 3.15Å; K941-E944 HydrophobicContact CB-CG 4.19Å; E944-N947 HydrophobicContact CB-CB 4.02Å; E944-N947 VanDerWaalsContact O-CB 3.25Å; E944-N947 WeakPolarHBondContact O-CB 3.49Å; E944-N947 PolarHBondContact O-N 3.16Å
945	P	90.2	Very high	84.7	Confident	23 Å²	23	73.4 Å²	73.4	15%	0.149	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	141.8	178.3	24.3	-32.9	0	0	0	112	T909 K911 N947	T909-P945 WeakPolarHBondContact O-CB 3.42Å; T909-P945 WeakPolarHBondContact O-CG 3.39Å; K911-P945 HydrophobicContact CD-CG 4.08Å; K911-P945 HydrophobicContact CG-CG 3.42Å; K911-P945 VanDerWaalsContact CG-CG 3.42Å; P945-N947 PolarHBondContact O-N 2.91Å
946	E	88.6	Confident	85.6	Confident	163 Å²	163	72.6 Å²	72.6	76%	0.762	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	15.4	-178.8	-52.7	-170.6	130.4	0	0	114.3	N905 H907	N905-E946 VanDerWaalsContact O-CA 3.23Å; N905-E946 WeakPolarHBondContact O-CA 3.36Å; N905-E946 PolarHBondContact O-N 3.03Å; N905-E946 VanDerWaalsContact O-N 3.1Å; H907-E946 HydrophobicContact CB-CG 3.95Å
947	N	91.2	Very high	86.9	Confident	66 Å²	66	67.9 Å²	67.9	35%	0.353	34%	0.336	S	S	.	.			trans	-97.6	154	177.9	-167.1	16.7	0	0	0	112	N905 E944 P945	N905-N947 PolarHBondContact N-O 3.42Å; N905-N947 PolarHBondContact ND2-O 2.78Å; E944-N947 HydrophobicContact CB-CB 4.02Å; E944-N947 VanDerWaalsContact O-CB 3.25Å; E944-N947 WeakPolarHBondContact O-CB 3.49Å; E944-N947 PolarHBondContact O-N 3.16Å; P945-N947 PolarHBondContact O-N 2.91Å
948	C	91.7	Very high	87.9	Confident	50 Å²	50	61.9 Å²	61.9	34%	0.338	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	113.1	170.7	-175.7	0	0	0	0	109.7	V903 Y904	V903-C948 CarbonylContact O-C 3.41Å; V903-C948 WeakPolarHBondContact O-CA 3.15Å; Y904-C948 HydrophobicContact CD1-CB 3.88Å; Y904-C948 HydrophobicContact CE1-CB 3.95Å; Y904-C948 WeakPolarHBondContact CE1-SG 3.13Å
949	N	93.3	Very high	89.2	Confident	3 Å²	3	51 Å²	51	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133	174.7	-60.9	113.5	0	0	0	110.5	F902 V903 N905 F943 F951	F902-N949 CarbonylContact C-O 3.56Å; F902-N949 WeakPolarHBondContact CA-O 3.37Å; V903-N949 PolarHBondContact N-O 2.9Å; V903-N949 PolarHBondContact O-N 3.27Å; N905-N949 PolarHBondContact ND2-OD1 3.02Å; F943-N949 VanDerWaalsContact CA-OD1 3.29Å; F943-N949 WeakPolarHBondContact CA-OD1 2.95Å; F943-N949 PolarHBondContact N-OD1 3.04Å; N949-F951 HydrophobicContact CB-CD2 4.46Å; N949-F951 HydrophobicContact CB-CE2 3.52Å; N949-F951 HydrophobicContact CB-CZ 3.66Å
950	Q	92.9	Very high	90.4	Very high	118 Å²	118	54.1 Å²	54.1	55%	0.551	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.5	176.6	-175	-177.9	-40.2	0	0	110.6	T900 I901 F902	T900-Q950 HydrophobicContact CG2-CG 3.65Å; I901-Q950 CarbonylContact O-C 3.55Å; I901-Q950 VanDerWaalsContact O-CA 3.27Å; I901-Q950 WeakPolarHBondContact O-CA 2.88Å; F902-Q950 HydrophobicContact CD1-CB 4.23Å; F902-Q950 HydrophobicContact CD1-CG 4.18Å; F902-Q950 HydrophobicContact CE1-CB 4.21Å; F902-Q950 HydrophobicContact CE1-CG 3.81Å; F902-Q950 HydrophobicContact CZ-CG 4.35Å
951	F	93.8	Very high	91.4	Very high	12 Å²	12	50.1 Å²	50.1	5%	0.053	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	161.8	176.1	-53.8	-81	0	0	0	111	T900 I901 V903 L933 L942 F943 N949	T900-F951 CarbonylContact C-O 3.53Å; T900-F951 WeakPolarHBondContact CA-O 3.19Å; I901-F951 HydrophobicContact CB-CB 4.38Å; I901-F951 PolarHBondContact N-O 3.43Å; I901-F951 PolarHBondContact O-N 2.85Å; V903-F951 HydrophobicContact CB-CE2 4.22Å; V903-F951 HydrophobicContact CG2-CD2 3.99Å; V903-F951 HydrophobicContact CG2-CE2 3.81Å; L933-F951 HydrophobicContact CB-CD1 3.93Å; L933-F951 HydrophobicContact CB-CD2 4.44Å; L933-F951 HydrophobicContact CB-CE1 3.81Å; L933-F951 HydrophobicContact CB-CE2 4.33Å; L933-F951 HydrophobicContact CB-CG 4.24Å; L933-F951 HydrophobicContact CB-CZ 4.01Å; L933-F951 HydrophobicContact CD1-CD2 4.12Å; L933-F951 HydrophobicContact CD1-CE2 4.04Å; L933-F951 HydrophobicContact CD1-CZ 4.46Å; L933-F951 HydrophobicContact CD2-CB 3.96Å; L933-F951 HydrophobicContact CD2-CD1 4.31Å; L933-F951 HydrophobicContact CD2-CD2 4.11Å; L933-F951 HydrophobicContact CD2-CG 3.87Å; L933-F951 HydrophobicContact CG-CD2 4.46Å; L933-F951 HydrophobicContact CG-CG 4.46Å; L942-F951 HydrophobicContact CD1-CE1 4.07Å; L942-F951 HydrophobicContact CD1-CZ 4.4Å; L942-F951 HydrophobicContact CD2-CE1 4.04Å; L942-F951 HydrophobicContact CD2-CZ 4.09Å; F943-F951 AromaticContact CE1-CE2 3.94Å; F943-F951 HydrophobicContact CE1-CE2 3.94Å; F943-F951 AromaticContact CE1-CZ 3.83Å; F943-F951 HydrophobicContact CE1-CZ 3.83Å; F943-F951 HydrophobicContact CE2-CZ 4.44Å; F943-F951 HydrophobicContact CZ-CE2 4.11Å; F943-F951 AromaticContact CZ-CZ 3.62Å; F943-F951 HydrophobicContact CZ-CZ 3.62Å; N949-F951 HydrophobicContact CB-CD2 4.46Å; N949-F951 HydrophobicContact CB-CE2 3.52Å; N949-F951 HydrophobicContact CB-CZ 3.66Å
952	E	92	Very high	92.2	Very high	120 Å²	120	50.9 Å²	50.9	56%	0.561	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.2	174.8	-64.6	-177.2	165.1	0	0	109.7	L898 Y899	L898-E952 HydrophobicContact CD1-CB 3.92Å; L898-E952 HydrophobicContact CD2-CB 4.49Å; L898-E952 HydrophobicContact CG-CB 4.17Å; Y899-E952 WeakPolarHBondContact O-CA 3.18Å
953	V	91.4	Very high	92.7	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	117.7	-179.6	163.7	0	0	0	0	109.9	Y899 I901 I921 R931	Y899-V953 PolarHBondContact N-O 3.15Å; Y899-V953 PolarHBondContact O-N 3.36Å; I901-V953 HydrophobicContact CD1-CB 3.81Å; I901-V953 HydrophobicContact CD1-CG2 3.37Å; I921-V953 HydrophobicContact CD1-CG1 4.39Å; R931-V953 HydrophobicContact CB-CG1 4.3Å; R931-V953 HydrophobicContact CB-CG2 3.91Å; R931-V953 HydrophobicContact CG-CG1 3.71Å; R931-V953 HydrophobicContact CG-CG2 4.24Å
954	E	90.6	Very high	92.9	Very high	105 Å²	105	56.4 Å²	56.4	49%	0.491	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	125.1	170.9	-167	-174.1	167.4	0	0	110.4	K896 V897 L898 R931	K896-E954 WeakPolarHBondContact CD-OE1 3.19Å; K896-E954 IonicContact NZ-OE1 3.38Å; V897-E954 WeakPolarHBondContact O-CA 3.43Å; L898-E954 HydrophobicContact CD1-CB 4.12Å; R931-E954 PolarHBondContact NE-O 2.76Å; R931-E954 PolarHBondContact NH2-O 2.83Å
955	A	92.8	Very high	93.1	Very high	2 Å²	2	56 Å²	56	2%	0.017	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	157.9	173.1	0	0	0	0	0	110.3	V897 Y899 L958	V897-A955 PolarHBondContact N-O 3.02Å; V897-A955 PolarHBondContact O-N 2.88Å; V897-A955 VanDerWaalsContact O-O 3.1Å; Y899-A955 HydrophobicContact CD2-CB 4.26Å; Y899-A955 HydrophobicContact CE2-CB 4.09Å; A955-L958 HydrophobicContact CB-CD1 4.47Å
956	V	94.2	Very high	93.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	140.2	168.8	171.5	0	0	0	0	108.4	K832 E883 P885 L894 K896 L958	K832-V956 HydrophobicContact CB-CG1 4.38Å; K832-V956 HydrophobicContact CD-CB 3.51Å; K832-V956 HydrophobicContact CD-CG1 3.88Å; K832-V956 HydrophobicContact CD-CG2 3.94Å; K832-V956 HydrophobicContact CG-CB 4.27Å; K832-V956 HydrophobicContact CG-CG1 4.39Å; K832-V956 HydrophobicContact CG-CG2 4.27Å; E883-V956 HydrophobicContact CB-CB 4.39Å; E883-V956 HydrophobicContact CB-CG2 3.7Å; E883-V956 PolarHBondContact OE2-N 2.85Å; P885-V956 HydrophobicContact CB-CG1 4.15Å; P885-V956 HydrophobicContact CB-CG2 4.13Å; P885-V956 HydrophobicContact CG-CG2 4.44Å; L894-V956 HydrophobicContact CB-CG1 3.46Å; L894-V956 VanDerWaalsContact CB-CG1 3.46Å; L894-V956 HydrophobicContact CD1-CG1 4.01Å; L894-V956 HydrophobicContact CG-CG1 4.39Å; K896-V956 HydrophobicContact CG-CG2 4.39Å; V956-L958 WeakPolarHBondContact O-CD2 3.44Å; V956-L958 WeakPolarHBondContact O-CG 3.23Å; V956-L958 PolarHBondContact O-N 3.26Å; V956-L958 VanDerWaalsContact O-N 3.1Å
957	F	95.1	Very high	93.3	Very high	41 Å²	41	54 Å²	54	18%	0.18	26%	0.263	C	S	.	.			trans	-44	114.6	-172.4	179.1	-118	0	0	0	113.4	L894 P895 V897 H925 G959 E988	L894-F957 HydrophobicContact CB-CB 4.49Å; L894-F957 HydrophobicContact CD2-CD1 4.42Å; P895-F957 HydrophobicContact CG-CB 3.97Å; P895-F957 HydrophobicContact CG-CG 4.47Å; P895-F957 PolarHBondContact O-N 3.47Å; V897-F957 HydrophobicContact CG2-CB 3.93Å; V897-F957 HydrophobicContact CG2-CD2 4.01Å; V897-F957 HydrophobicContact CG2-CG 4.43Å; H925-F957 WeakPolarHBondContact CB-O 3.46Å; H925-F957 AromaticContact ND1-CD1 3.83Å; H925-F957 PolarHBondContact ND1-O 2.97Å; F957-G959 VanDerWaalsContact C-N 3.34Å; F957-G959 PolarHBondContact O-N 2.97Å; F957-E988 HydrophobicContact CD2-CB 4.21Å; F957-E988 HydrophobicContact CD2-CG 4.3Å; F957-E988 HydrophobicContact CE2-CB 4.08Å; F957-E988 HydrophobicContact CE2-CG 4.21Å
958	L	95.2	Very high	93.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.			trans	-85.3	-3.5	-172.7	-60.8	175.7	0	0	0	113.5	Y899 I921 G923 E924 H925 A955 V956 L961	Y899-L958 HydrophobicContact CE2-CD1 4.26Å; Y899-L958 HydrophobicContact CE2-CG 4.3Å; Y899-L958 PolarHBondContact OH-N 3Å; I921-L958 HydrophobicContact CB-CD1 3.68Å; I921-L958 HydrophobicContact CG2-CD1 3.6Å; G923-L958 CarbonylContact C-O 3.09Å; G923-L958 VanDerWaalsContact C-O 3.29Å; G923-L958 WeakPolarHBondContact CA-O 3.49Å; E924-L958 PolarHBondContact N-O 2.74Å; H925-L958 PolarHBondContact N-O 2.88Å; A955-L958 HydrophobicContact CB-CD1 4.47Å; V956-L958 WeakPolarHBondContact O-CD2 3.44Å; V956-L958 WeakPolarHBondContact O-CG 3.23Å; V956-L958 PolarHBondContact O-N 3.26Å; V956-L958 VanDerWaalsContact O-N 3.1Å; L958-L961 HydrophobicContact CB-CD2 3.9Å; L958-L961 HydrophobicContact CD1-CD2 4.33Å
959	G	94	Very high	92.9	Very high	4 Å²	4	51.3 Å²	51.3	4%	0.041	25%	0.248	C	C	.	.			trans	67.7	-154	-172.7	0	0	0	0	0	111.9	F957 L961	F957-G959 VanDerWaalsContact C-N 3.34Å; F957-G959 PolarHBondContact O-N 2.97Å; G959-L961 PolarHBondContact O-N 2.77Å
960	R	94.4	Very high	92.2	Very high	144 Å²	144	57.3 Å²	57.3	54%	0.543	29%	0.287	S	S	.	.	S	Bend	trans	-63.4	121.9	177.9	-174.6	179.8	177.4	173.2	2	110.4	G923 E924 Y993	G923-R960 WeakPolarHBondContact CA-O 3.28Å; E924-R960 VanDerWaalsContact CD-CB 3.45Å; E924-R960 HydrophobicContact CG-CB 4.09Å; E924-R960 PolarHBondContact N-O 3.01Å; E924-R960 WeakPolarHBondContact OE1-CB 3.45Å; E924-R960 WeakPolarHBondContact OE2-CB 3.48Å; E924-R960 PolarHBondContact OE2-N 3.42Å; R960-Y993 HydrophobicContact CG-CE1 4.13Å
961	L	95.9	Very high	91.6	Very high	7 Å²	7	56 Å²	56	4%	0.037	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	139	179.3	-50.6	-172.3	0	0	0	110.9	Y899 I921 L958 G959 V984 Y993 F995	Y899-L961 HydrophobicContact CE1-CD2 4.43Å; I921-L961 HydrophobicContact CG2-CD1 3.96Å; I921-L961 HydrophobicContact CG2-CD2 3.7Å; I921-L961 HydrophobicContact CG2-CG 4.33Å; L958-L961 HydrophobicContact CB-CD2 3.9Å; L958-L961 HydrophobicContact CD1-CD2 4.33Å; G959-L961 PolarHBondContact O-N 2.77Å; L961-V984 HydrophobicContact CD1-CB 3.82Å; L961-V984 HydrophobicContact CD1-CG1 3.56Å; L961-V984 HydrophobicContact CD1-CG2 4.47Å; L961-Y993 HydrophobicContact CB-CD1 3.83Å; L961-Y993 HydrophobicContact CB-CD2 4.18Å; L961-Y993 HydrophobicContact CB-CE1 3.99Å; L961-Y993 HydrophobicContact CB-CE2 4.32Å; L961-Y993 HydrophobicContact CB-CG 3.93Å; L961-Y993 HydrophobicContact CD1-CD2 3.57Å; L961-Y993 HydrophobicContact CD1-CE2 4.05Å; L961-Y993 HydrophobicContact CD1-CG 3.89Å; L961-Y993 HydrophobicContact CG-CD1 4.37Å; L961-Y993 HydrophobicContact CG-CD2 3.81Å; L961-Y993 HydrophobicContact CG-CE1 4.39Å; L961-Y993 HydrophobicContact CG-CE2 3.83Å; L961-Y993 HydrophobicContact CG-CG 4.09Å; L961-F995 HydrophobicContact CB-CZ 4.09Å
962	R	94.4	Very high	91.2	Very high	145 Å²	145	56.4 Å²	56.4	55%	0.547	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-41.6	-174.5	-62.3	-61.8	-179.9	161.4	-1	112.6	Y922 E924	Y922-R962 PolarHBondContact O-N 3.07Å; E924-R962 IonicContact OE1-CZ 3.8Å; E924-R962 IonicContact OE1-NE 2.74Å; E924-R962 IonicContact OE1-NH2 2.86Å; E924-R962 PolarHBondContact OE1-NH2 2.99Å
963	Q	94.7	Very high	90.8	Very high	118 Å²	118	56.6 Å²	56.6	55%	0.551	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.8	-174.1	178	178.2	-8	0	0	110.2	Y922	Y922-Q963 WeakPolarHBondContact CB-O 3.36Å; Y922-Q963 HydrophobicContact CD2-CB 4.32Å; Y922-Q963 HydrophobicContact CD2-CG 4.28Å; Y922-Q963 PolarHBondContact N-O 2.86Å; Y922-Q963 PolarHBondContact O-N 2.83Å
964	I	94.9	Very high	90.6	Very high	27 Å²	27	59.6 Å²	59.6	14%	0.138	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.8	169.6	-161.6	150.6	0	0	0	108.9	L919 I921 I982 V984 F995	L919-I964 HydrophobicContact CD1-CD1 3.97Å; L919-I964 HydrophobicContact CD1-CG1 4.21Å; L919-I964 HydrophobicContact CD2-CD1 3.95Å; L919-I964 HydrophobicContact CD2-CG1 4Å; L919-I964 HydrophobicContact CG-CD1 4.15Å; L919-I964 HydrophobicContact CG-CG1 3.98Å; I921-I964 HydrophobicContact CG1-CD1 4.44Å; I964-I982 HydrophobicContact CD1-CB 4.32Å; I964-I982 HydrophobicContact CD1-CD1 4.49Å; I964-I982 HydrophobicContact CD1-CG2 3.58Å; I964-I982 HydrophobicContact CG2-CD1 4.19Å; I964-V984 HydrophobicContact CD1-CG2 3.58Å; I964-F995 HydrophobicContact CB-CD2 4.26Å; I964-F995 HydrophobicContact CB-CE2 4.45Å; I964-F995 HydrophobicContact CB-CG 4.37Å; I964-F995 HydrophobicContact CD1-CD2 4.44Å; I964-F995 HydrophobicContact CG2-CB 3.82Å; I964-F995 HydrophobicContact CG2-CD1 4.18Å; I964-F995 HydrophobicContact CG2-CD2 3.98Å; I964-F995 HydrophobicContact CG2-CG 3.73Å
965	G	93.6	Very high	90.4	Very high	22 Å²	22	60 Å²	60	23%	0.227	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.7	170.8	0	0	0	0	0	108.8	L919 T920	L919-G965 CarbonylContact C-O 3.55Å; L919-G965 VanDerWaalsContact CA-O 3.32Å; L919-G965 WeakPolarHBondContact CA-O 3.45Å; T920-G965 PolarHBondContact N-O 2.87Å; T920-G965 PolarHBondContact O-N 2.79Å
966	I	92.9	Very high	90.2	Very high	50 Å²	50	62.6 Å²	62.6	26%	0.256	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.8	173.2	-163.8	165.1	0	0	0	108.8	R918 L919 L933 W977 I982	R918-I966 CarbonylContact O-C 3.59Å; R918-I966 WeakPolarHBondContact O-CA 3.39Å; L919-I966 HydrophobicContact CD1-CD1 4.3Å; L933-I966 HydrophobicContact CD1-CD1 4.28Å; I966-W977 HydrophobicContact CD1-CH2 3.41Å; I966-W977 VanDerWaalsContact CD1-CH2 3.41Å; I966-W977 HydrophobicContact CD1-CZ2 3.95Å; I966-W977 HydrophobicContact CD1-CZ3 4.38Å; I966-W977 HydrophobicContact CG1-CH2 3.78Å; I966-W977 HydrophobicContact CG1-CZ3 4.35Å; I966-I982 HydrophobicContact CB-CD1 4.16Å; I966-I982 HydrophobicContact CD1-CD1 3.83Å; I966-I982 HydrophobicContact CG2-CD1 4.14Å
967	T	90.9	Very high	90.1	Very high	95 Å²	95	64.2 Å²	64.2	58%	0.583	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	125.2	-175.8	-53.1	0	0	0	0	109.3	A917 R918	A917-T967 CarbonylContact C-O 3.52Å; A917-T967 WeakPolarHBondContact CA-O 3.46Å; R918-T967 PolarHBondContact N-O 2.95Å; R918-T967 PolarHBondContact O-N 2.77Å
968	A	89	Confident	89.9	Confident	25 Å²	25	63.6 Å²	63.6	21%	0.207	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	135.8	170.3	0	0	0	0	0	110.1	L915 F974 W977	L915-A968 HydrophobicContact CD1-CB 3.69Å; A968-F974 HydrophobicContact CB-CE1 3.69Å; A968-F974 HydrophobicContact CB-CE2 4.36Å; A968-F974 HydrophobicContact CB-CZ 3.46Å; A968-F974 VanDerWaalsContact CB-CZ 3.46Å; A968-W977 HydrophobicContact CB-CE3 4.35Å; A968-W977 HydrophobicContact CB-CZ3 4.25Å
969	D	83.9	Confident	89.7	Confident	33 Å²	33	64 Å²	64	18%	0.176	35%	0.352	C	S	.	.			trans	-68.1	127.5	176	-161.3	-49.3	0	0	0	109.1	S916 R918 A971 S972	S916-D969 WeakPolarHBondContact O-CB 3.42Å; S916-D969 PolarHBondContact O-N 2.85Å; R918-D969 IonicContact CZ-OD2 2.77Å; R918-D969 IonicContact NE-OD2 3.05Å; R918-D969 IonicContact NH2-OD2 2.84Å; R918-D969 PolarHBondContact NH2-OD2 2.84Å; D969-A971 PolarHBondContact O-N 3.05Å; D969-A971 PolarHBondContact OD1-N 2.82Å; D969-A971 VanDerWaalsContact OD1-N 3.16Å; D969-S972 WeakPolarHBondContact O-CB 3.25Å; D969-S972 PolarHBondContact O-N 2.79Å; D969-S972 PolarHBondContact O-OG 2.86Å
970	P	79.9	Confident	89.6	Confident	129 Å²	129	66.1 Å²	66.1	84%	0.838	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.7	179.3	-25.8	34.2	0	0	0	114.8	S972	P970-S972 VanDerWaalsContact C-N 3.25Å; P970-S972 PolarHBondContact O-N 3.47Å
971	A	80.7	Confident	89.6	Confident	92 Å²	92	59.7 Å²	59.7	76%	0.76	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-2	176.2	0	0	0	0	0	113.9	D969	D969-A971 PolarHBondContact O-N 3.05Å; D969-A971 PolarHBondContact OD1-N 2.82Å; D969-A971 VanDerWaalsContact OD1-N 3.16Å
972	S	83.7	Confident	89.6	Confident	19 Å²	19	59.6 Å²	59.6	13%	0.133	34%	0.343	C	S	.	.			trans	-73.4	134.7	179.2	-58.2	0	0	0	0	111.3	T914 S916 D969 P970 F974	T914-S972 WeakPolarHBondContact O-CB 3.27Å; S916-S972 PolarHBondContact N-OG 2.78Å; S916-S972 PolarHBondContact O-OG 3.15Å; D969-S972 WeakPolarHBondContact O-CB 3.25Å; D969-S972 PolarHBondContact O-N 2.79Å; D969-S972 PolarHBondContact O-OG 2.86Å; P970-S972 VanDerWaalsContact C-N 3.25Å; P970-S972 PolarHBondContact O-N 3.47Å; S972-F974 VanDerWaalsContact CB-CD1 3.5Å; S972-F974 PolarHBondContact O-N 2.82Å
973	D	84.3	Confident	89.6	Confident	125 Å²	125	52.8 Å²	52.8	67%	0.668	32%	0.318	S	S	*	.	B	Isolated β-bridge	trans	-89.6	84.1	172.8	-173.8	23.8	0	0	0	109.3	T914	T914-D973 PolarHBondContact N-O 3.09Å; T914-D973 CarbonylContact O-C 3.42Å; T914-D973 PolarHBondContact O-N 2.89Å; T914-D973 VanDerWaalsContact O-N 3.07Å; T914-D973 WeakPolarHBondContact OG1-CB 3.3Å; T914-D973 PolarHBondContact OG1-O 3.28Å
974	F	87.5	Confident	89.7	Confident	68 Å²	68	47.2 Å²	47.2	30%	0.298	29%	0.292	S	S	.	.			trans	-141	149.4	-179.3	86	-79.7	0	0	0	110.3	Q913 L915 A968 S972 W977	Q913-F974 HydrophobicContact CB-CB 4.19Å; Q913-F974 HydrophobicContact CG-CB 4.07Å; Q913-F974 VanDerWaalsContact OE1-CB 3.23Å; L915-F974 HydrophobicContact CB-CB 4.41Å; L915-F974 HydrophobicContact CD1-CB 4.37Å; L915-F974 HydrophobicContact CD1-CD1 3.67Å; L915-F974 HydrophobicContact CD1-CD2 4.12Å; L915-F974 HydrophobicContact CD1-CE1 3.85Å; L915-F974 HydrophobicContact CD1-CE2 4.29Å; L915-F974 HydrophobicContact CD1-CG 3.8Å; L915-F974 HydrophobicContact CD1-CZ 4.16Å; A968-F974 HydrophobicContact CB-CE1 3.69Å; A968-F974 HydrophobicContact CB-CE2 4.36Å; A968-F974 HydrophobicContact CB-CZ 3.46Å; A968-F974 VanDerWaalsContact CB-CZ 3.46Å; S972-F974 VanDerWaalsContact CB-CD1 3.5Å; S972-F974 PolarHBondContact O-N 2.82Å; F974-W977 HydrophobicContact CD2-CB 4.05Å; F974-W977 HydrophobicContact CE2-CB 4.09Å
975	T	86.8	Confident	89.8	Confident	113 Å²	113	50.6 Å²	50.6	69%	0.693	31%	0.306	S	S	*	.	S	Bend	trans	-112.2	-36.4	-175.8	50.6	0	0	0	0	113
976	C	88.9	Confident	89.7	Confident	56 Å²	56	49.6 Å²	49.6	38%	0.378	30%	0.295	S	S	.	.			trans	-152.9	130	177.2	-179.5	0	0	0	0	110.2	D908 V910 Q913	D908-C976 PolarHBondContact O-SG 2.71Å; V910-C976 HydrophobicContact CG2-CB 3.9Å; V910-C976 PolarHBondContact N-O 2.93Å; V910-C976 VanDerWaalsContact N-O 3.14Å; Q913-C976 PolarHBondContact NE2-O 3.04Å; Q913-C976 PolarHBondContact OE1-O 3.21Å
977	W	90.5	Very high	89.6	Confident	36 Å²	36	49.9 Å²	49.9	14%	0.136	30%	0.3	C	S	.	.			trans	-134.5	121.9	176	176.6	38.9	0	0	0	109	V903 N905 L915 A917 F943 I966 A968 F974 V979	V903-W977 HydrophobicContact CG1-CZ2 4.32Å; N905-W977 PolarHBondContact OD1-NE1 2.73Å; L915-W977 HydrophobicContact CD1-CE3 4.32Å; L915-W977 HydrophobicContact CD2-CB 4.17Å; L915-W977 HydrophobicContact CD2-CD2 3.26Å; L915-W977 HydrophobicContact CD2-CE3 3.49Å; L915-W977 VanDerWaalsContact CD2-CE3 3.49Å; L915-W977 HydrophobicContact CD2-CG 3.6Å; L915-W977 HydrophobicContact CD2-CH2 4.09Å; L915-W977 HydrophobicContact CD2-CZ2 3.95Å; L915-W977 HydrophobicContact CD2-CZ3 3.89Å; L915-W977 HydrophobicContact CG-CE3 4.5Å; A917-W977 HydrophobicContact CB-CH2 3.73Å; A917-W977 HydrophobicContact CB-CZ3 4.16Å; F943-W977 AromaticContact CD1-CE2 3.93Å; F943-W977 AromaticContact CD1-CZ2 3.58Å; F943-W977 HydrophobicContact CD1-CZ2 3.58Å; F943-W977 AromaticContact CD1-NE1 3.9Å; F943-W977 HydrophobicContact CE1-CH2 4.38Å; F943-W977 AromaticContact CE1-CZ2 3.73Å; F943-W977 HydrophobicContact CE1-CZ2 3.73Å; F943-W977 HydrophobicContact CG-CZ2 4.24Å; F943-W977 HydrophobicContact CZ-CZ2 4.47Å; I966-W977 HydrophobicContact CD1-CH2 3.41Å; I966-W977 VanDerWaalsContact CD1-CH2 3.41Å; I966-W977 HydrophobicContact CD1-CZ2 3.95Å; I966-W977 HydrophobicContact CD1-CZ3 4.38Å; I966-W977 HydrophobicContact CG1-CH2 3.78Å; I966-W977 HydrophobicContact CG1-CZ3 4.35Å; A968-W977 HydrophobicContact CB-CE3 4.35Å; A968-W977 HydrophobicContact CB-CZ3 4.25Å; F974-W977 HydrophobicContact CD2-CB 4.05Å; F974-W977 HydrophobicContact CE2-CB 4.09Å; W977-V979 HydrophobicContact CD2-CG2 3.87Å; W977-V979 HydrophobicContact CE3-CG2 4.33Å; W977-V979 HydrophobicContact CH2-CG2 3.99Å; W977-V979 HydrophobicContact CZ2-CG2 3.43Å; W977-V979 VanDerWaalsContact CZ2-CG2 3.43Å; W977-V979 HydrophobicContact CZ3-CG2 4.39Å
978	H	91.3	Very high	89.4	Confident	27 Å²	27	50.9 Å²	50.9	13%	0.125	30%	0.298	C	S	.	.			trans	-110.9	117.3	178	172.3	-168.8	0	0	0	108.3	N905 G906 D908 T909	N905-H978 CarbonylContact C-O 3.52Å; N905-H978 WeakPolarHBondContact CA-O 3.39Å; G906-H978 PolarHBondContact N-O 2.74Å; D908-H978 HydrophobicContact CB-CB 4.08Å; D908-H978 IonicContact OD2-CE1 2.88Å; D908-H978 IonicContact OD2-ND1 3.73Å; D908-H978 PolarHBondContact OD2-ND1 2.61Å; T909-H978 PolarHBondContact OG1-N 3.27Å; T909-H978 VanDerWaalsContact OG1-N 3.12Å; T909-H978 PolarHBondContact OG1-O 3.21Å
979	V	92.5	Very high	89.2	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.055	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113.6	172.9	-178.4	0	0	0	0	108.1	V903 W977 I982 A997	V903-V979 HydrophobicContact CG1-CG1 4.2Å; W977-V979 HydrophobicContact CD2-CG2 3.87Å; W977-V979 HydrophobicContact CE3-CG2 4.33Å; W977-V979 HydrophobicContact CH2-CG2 3.99Å; W977-V979 HydrophobicContact CZ2-CG2 3.43Å; W977-V979 VanDerWaalsContact CZ2-CG2 3.43Å; W977-V979 HydrophobicContact CZ3-CG2 4.39Å; V979-I982 HydrophobicContact CG1-CD1 4.12Å; V979-I982 HydrophobicContact CG1-CG1 3.71Å; V979-A997 VanDerWaalsContact O-CB 3.23Å; V979-A997 WeakPolarHBondContact O-CB 3.39Å
980	S	91.4	Very high	89.3	Confident	48 Å²	48	57 Å²	57	34%	0.336	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-37.6	-179.1	64.4	0	0	0	0	112.2	Y904 A997	Y904-S980 VanDerWaalsContact CB-OG 3.24Å; Y904-S980 WeakPolarHBondContact CB-OG 2.85Å; Y904-S980 PolarHBondContact O-N 3.15Å; Y904-S980 PolarHBondContact O-OG 3.48Å; Y904-S980 VanDerWaalsContact O-OG 3.08Å; S980-A997 PolarHBondContact O-N 3.28Å
981	A	93.8	Very high	89.9	Confident	9 Å²	9	55.9 Å²	55.9	7%	0.074	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	156.8	176.9	0	0	0	0	0	110.8	Y904 F995	Y904-A981 WeakPolarHBondContact CB-O 3.29Å; Y904-A981 HydrophobicContact CD2-CB 3.99Å; Y904-A981 WeakPolarHBondContact CD2-O 3.49Å; Y904-A981 HydrophobicContact CG-CB 4.46Å; Y904-A981 PolarHBondContact N-O 2.79Å; Y904-A981 PolarHBondContact O-N 3.47Å; A981-F995 CarbonylContact C-O 3.55Å; A981-F995 VanDerWaalsContact CA-O 3.28Å; A981-F995 WeakPolarHBondContact CA-O 3.44Å
982	I	95.5	Very high	90.6	Very high	6 Å²	6	56.8 Å²	56.8	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.1	166.4	-54.4	174.4	0	0	0	108.1	I901 F902 V903 L919 I964 I966 V979 F995	I901-I982 HydrophobicContact CG2-CG2 3.7Å; F902-I982 CarbonylContact O-C 3.49Å; F902-I982 VanDerWaalsContact O-CA 3.28Å; F902-I982 WeakPolarHBondContact O-CA 3.42Å; V903-I982 HydrophobicContact CG2-CG2 4.46Å; L919-I982 HydrophobicContact CD1-CG2 4.47Å; I964-I982 HydrophobicContact CD1-CB 4.32Å; I964-I982 HydrophobicContact CD1-CD1 4.49Å; I964-I982 HydrophobicContact CD1-CG2 3.58Å; I964-I982 HydrophobicContact CG2-CD1 4.19Å; I966-I982 HydrophobicContact CB-CD1 4.16Å; I966-I982 HydrophobicContact CD1-CD1 3.83Å; I966-I982 HydrophobicContact CG2-CD1 4.14Å; V979-I982 HydrophobicContact CG1-CD1 4.12Å; V979-I982 HydrophobicContact CG1-CG1 3.71Å; I982-F995 PolarHBondContact N-O 3.01Å; I982-F995 PolarHBondContact O-N 3.46Å
983	A	95.6	Very high	91.1	Very high	2 Å²	2	58 Å²	58	2%	0.017	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.4	171.1	0	0	0	0	0	111	I901 F902 Y904 L992 Y993	I901-A983 CarbonylContact C-O 3.21Å; I901-A983 WeakPolarHBondContact CA-O 3.48Å; F902-A983 HydrophobicContact CB-CB 4.21Å; F902-A983 HydrophobicContact CD2-CB 4.37Å; F902-A983 PolarHBondContact N-O 2.85Å; F902-A983 PolarHBondContact O-N 2.96Å; Y904-A983 HydrophobicContact CE2-CB 4Å; A983-L992 HydrophobicContact CB-CD1 4.07Å; A983-Y993 CarbonylContact C-O 3.55Å; A983-Y993 WeakPolarHBondContact CA-O 3.14Å
984	V	96.7	Very high	91.6	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120.9	177.7	-175.2	0	0	0	0	108.7	Y899 T900 I901 I921 L961 I964 Y993 F995	Y899-V984 HydrophobicContact CD1-CG1 3.94Å; Y899-V984 HydrophobicContact CG-CG1 4.4Å; T900-V984 WeakPolarHBondContact O-CA 3.26Å; I901-V984 HydrophobicContact CG1-CG2 4.49Å; I921-V984 HydrophobicContact CD1-CG1 4.16Å; L961-V984 HydrophobicContact CD1-CB 3.82Å; L961-V984 HydrophobicContact CD1-CG1 3.56Å; L961-V984 HydrophobicContact CD1-CG2 4.47Å; I964-V984 HydrophobicContact CD1-CG2 3.58Å; V984-Y993 PolarHBondContact N-O 2.81Å; V984-Y993 PolarHBondContact O-N 3.26Å; V984-F995 HydrophobicContact CG2-CD2 4.46Å; V984-F995 HydrophobicContact CG2-CE2 4.09Å
985	K	95.8	Very high	92	Very high	99 Å²	99	57.7 Å²	57.7	43%	0.43	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.6	174.3	-173.5	-178.9	179.6	-177.8	0	109.3	T900 F902 L992	T900-K985 PolarHBondContact N-O 3.37Å; T900-K985 PolarHBondContact O-N 2.87Å; F902-K985 HydrophobicContact CE2-CB 4.32Å; K985-L992 HydrophobicContact CB-CD1 4.04Å
986	D	92.7	Very high	92.2	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	112.1	174.1	177.5	5.1	0	0	0	109.7	Y899 E988 S989 Q990 M991 Y993	Y899-D986 HydrophobicContact CD1-CB 4.14Å; Y899-D986 HydrophobicContact CE1-CB 3.85Å; D986-E988 VanDerWaalsContact C-N 3.28Å; D986-E988 PolarHBondContact O-N 2.93Å; D986-E988 WeakPolarHBondContact OD1-CB 3.29Å; D986-E988 PolarHBondContact OD1-N 3.07Å; D986-S989 WeakPolarHBondContact CB-OG 3.31Å; D986-S989 WeakPolarHBondContact OD2-CB 3.18Å; D986-S989 PolarHBondContact OD2-OG 2.94Å; D986-Q990 VanDerWaalsContact O-CA 3.25Å; D986-Q990 WeakPolarHBondContact O-CA 3.43Å; D986-Q990 PolarHBondContact O-N 2.71Å; D986-M991 PolarHBondContact N-O 3.26Å; D986-M991 PolarHBondContact O-N 3.49Å; D986-Y993 HydrophobicContact CB-CE2 4.36Å
987	P	90.1	Very high	91.9	Very high	55 Å²	55	56.1 Å²	56.1	36%	0.357	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21.5	179.5	31.3	-36.1	0	0	0	113.2	V897 Q990	V897-P987 HydrophobicContact CG1-CG 3.75Å; P987-Q990 PolarHBondContact O-NE2 3.41Å
988	E	87	Confident	91	Very high	117 Å²	117	62 Å²	62	55%	0.547	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-47.1	-178.4	-163.7	71.7	-177.2	0	0	110.5	V897 F957 D986	V897-E988 HydrophobicContact CG2-CB 4.22Å; F957-E988 HydrophobicContact CD2-CB 4.21Å; F957-E988 HydrophobicContact CD2-CG 4.3Å; F957-E988 HydrophobicContact CE2-CB 4.08Å; F957-E988 HydrophobicContact CE2-CG 4.21Å; D986-E988 VanDerWaalsContact C-N 3.28Å; D986-E988 PolarHBondContact O-N 2.93Å; D986-E988 WeakPolarHBondContact OD1-CB 3.29Å; D986-E988 PolarHBondContact OD1-N 3.07Å
989	S	84.4	Confident	89.7	Confident	40 Å²	40	71.8 Å²	71.8	28%	0.28	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.4	177.1	65.7	0	0	0	0	114.4	D986 M991	D986-S989 WeakPolarHBondContact CB-OG 3.31Å; D986-S989 WeakPolarHBondContact OD2-CB 3.18Å; D986-S989 PolarHBondContact OD2-OG 2.94Å; S989-M991 PolarHBondContact O-N 3.16Å; S989-M991 WeakPolarHBondContact OG-CB 3.37Å; S989-M991 PolarHBondContact OG-N 3.13Å
990	Q	87.1	Confident	89.5	Confident	145 Å²	145	74.9 Å²	74.9	68%	0.678	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	23.1	-171.8	-60.6	-70.9	-44.5	0	0	113.5	D986 P987	D986-Q990 VanDerWaalsContact O-CA 3.25Å; D986-Q990 WeakPolarHBondContact O-CA 3.43Å; D986-Q990 PolarHBondContact O-N 2.71Å; P987-Q990 PolarHBondContact O-NE2 3.41Å
991	M	91.3	Very high	89.4	Confident	107 Å²	107	76.3 Å²	76.3	53%	0.527	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	146.5	-179.7	-65.3	-68.4	150.3	0	0	111.7	D986 S989 Y993	D986-M991 PolarHBondContact N-O 3.26Å; D986-M991 PolarHBondContact O-N 3.49Å; S989-M991 PolarHBondContact O-N 3.16Å; S989-M991 WeakPolarHBondContact OG-CB 3.37Å; S989-M991 PolarHBondContact OG-N 3.13Å; M991-Y993 HydrophobicContact CB-CD2 4.26Å; M991-Y993 HydrophobicContact CB-CE2 3.61Å
992	L	94.8	Very high	89.2	Confident	111 Å²	111	80.1 Å²	80.1	58%	0.581	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	113.2	169.2	-177.2	69.1	0	0	0	108.7	A983 K985	A983-L992 HydrophobicContact CB-CD1 4.07Å; K985-L992 HydrophobicContact CB-CD1 4.04Å
993	Y	95.9	Very high	88.8	Confident	44 Å²	44	84.4 Å²	84.4	17%	0.173	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.7	176	-64.2	-93.5	0	0	0	109.1	R960 L961 A983 V984 D986 M991	R960-Y993 HydrophobicContact CG-CE1 4.13Å; L961-Y993 HydrophobicContact CB-CD1 3.83Å; L961-Y993 HydrophobicContact CB-CD2 4.18Å; L961-Y993 HydrophobicContact CB-CE1 3.99Å; L961-Y993 HydrophobicContact CB-CE2 4.32Å; L961-Y993 HydrophobicContact CB-CG 3.93Å; L961-Y993 HydrophobicContact CD1-CD2 3.57Å; L961-Y993 HydrophobicContact CD1-CE2 4.05Å; L961-Y993 HydrophobicContact CD1-CG 3.89Å; L961-Y993 HydrophobicContact CG-CD1 4.37Å; L961-Y993 HydrophobicContact CG-CD2 3.81Å; L961-Y993 HydrophobicContact CG-CE1 4.39Å; L961-Y993 HydrophobicContact CG-CE2 3.83Å; L961-Y993 HydrophobicContact CG-CG 4.09Å; A983-Y993 CarbonylContact C-O 3.55Å; A983-Y993 WeakPolarHBondContact CA-O 3.14Å; V984-Y993 PolarHBondContact N-O 2.81Å; V984-Y993 PolarHBondContact O-N 3.26Å; D986-Y993 HydrophobicContact CB-CE2 4.36Å; M991-Y993 HydrophobicContact CB-CD2 4.26Å; M991-Y993 HydrophobicContact CB-CE2 3.61Å
994	Q	94.9	Very high	88.4	Confident	146 Å²	146	89.6 Å²	89.6	68%	0.682	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.5	176.5	-174.3	173.9	-11	0	0	109.6
995	F	95.1	Very high	87.8	Confident	40 Å²	40	95.5 Å²	95.5	18%	0.175	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	111.5	176.8	-57.5	-86.5	0	0	0	107.6	L961 I964 A981 I982 V984	L961-F995 HydrophobicContact CB-CZ 4.09Å; I964-F995 HydrophobicContact CB-CD2 4.26Å; I964-F995 HydrophobicContact CB-CE2 4.45Å; I964-F995 HydrophobicContact CB-CG 4.37Å; I964-F995 HydrophobicContact CD1-CD2 4.44Å; I964-F995 HydrophobicContact CG2-CB 3.82Å; I964-F995 HydrophobicContact CG2-CD1 4.18Å; I964-F995 HydrophobicContact CG2-CD2 3.98Å; I964-F995 HydrophobicContact CG2-CG 3.73Å; A981-F995 CarbonylContact C-O 3.55Å; A981-F995 VanDerWaalsContact CA-O 3.28Å; A981-F995 WeakPolarHBondContact CA-O 3.44Å; I982-F995 PolarHBondContact N-O 3.01Å; I982-F995 PolarHBondContact O-N 3.46Å; V984-F995 HydrophobicContact CG2-CD2 4.46Å; V984-F995 HydrophobicContact CG2-CE2 4.09Å
996	S	90.6	Very high	87.3	Confident	101 Å²	101	95.3 Å²	95.3	71%	0.706	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	140.6	172.1	48.4	0	0	0	0	110
997	A	83.5	Confident	86.9	Confident	36 Å²	36	102.5 Å²	102.5	30%	0.298	52%	0.518	S	S	.	.			trans	-122.4	129.6	171.3	0	0	0	0	0	108	V979 S980 R999	V979-A997 VanDerWaalsContact O-CB 3.23Å; V979-A997 WeakPolarHBondContact O-CB 3.39Å; S980-A997 PolarHBondContact O-N 3.28Å; A997-R999 VanDerWaalsContact C-N 3.32Å
998	D	72.1	Confident	86.6	Confident	159 Å²	159	106.5 Å²	106.5	85%	0.85	53%	0.531	S	S	*	.			trans	-84.9	-9.6	-177.9	-72.7	-23.1	0	0	0	112.6
999	R	62.6	Low	86.6	Confident	232 Å²	232	105.5 Å²	105.5	88%	0.875	53%	0.53	S	S	*	.			trans	-174.6	0	164.3	-104.8	160.6	-171	-161.3	0.5	111.4	A997	A997-R999 VanDerWaalsContact C-N 3.32Å

Retrieved 999 of 999 residues in 255.3 ms (Link to these results)

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