A0A077Z120_TRITR Loading...

Papilin

AlphaFold DB , UniProt , Accession A0A077Z120, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,789 aa.

						>A0A077Z120_TRITR|A0A077Z120
MLAKVIVFLCSLLAPLFSDRSSVNPCERQIYRSDCPPGSDGISRPSQFVLRYYRRGAQCVSYPYGLCSLSTQPKLFKSRSECQKHCLSVVVTESTMTSRLATGEWQTRTPTTVATQSSTAFHTGIYSTLQHVTKPSTERKTKIYHSSDGKKSKCQLQRAEVLQASRSLNGSKVSIQSAFVPECLGDGRYQPVQCDPFSLSCWCVDQEGLEKPGSRLTNGQRPDCAGQEAVAPVYRLDEKCLETPEPGPCDDQLERWHFDAEDRRCKILIYGGCGGNSNNFPSKEICEKKCNAAVAANRFCPDWSSVLTDETGVTFECLTKTCPLGYKCFISGNEGYCCANADTNDLAAPLLFEDESICKFPKDRGPCGNFDLRFFYDAEEGECRYFFYSGCGGNRNNFKSLLDCQKFCMRGVKSPAPEDALATTPHFVSDPPPKIENKCNFPKDAGPCKENHQRWYYNTVEEKCEPFIYSGCGGNPNNFDSMLGCQETCLELDADICKHPPNVGTCTGRIQRWYFDRWVRKCKPLLYSGCGGNGNNFDSQAICERYCLPELSSDVSASSQPVRVTMVPHKVLPTVLPLNRCFHPKNAGTCTGQFRRWYYDELEEMCKAFTYSGCGGNGNNFESREVCMNTCPNDDSSHLPLNPCFHRRDPGPCRASHRRWFYDSRVNMCHPFTYGGCGGNANNFESFSSCMVKCGPEILSSRCLHPTDRGDCSGHFVRFHYDSDSKTCKEFVYGGCGGTGNNFATKQECLKACAKAEPEDESKKFLKAVHTPVSIQPTLILPTEDSCKQPKMRGNCNKYELRYFFNAHVNRCEFFFYSGCGGNRNNFKTLSQCELFCSKKRPNPLLFGSSDDATPFSSETYGSTETVHSPSANAYAPGSHLPSGHSYHSEDGLTDSPVTQYSGNLQSSATALDGTEKETSYTFLPPGYTEGSLLSQYPGSRPLLPGMKTHHVEKPASVATSSSTSTYGLPVGPDVSQQTQEYVSAYQPGEFPLEPGIAETTLKAKPPVSPAPPPMPPGSAGMAEPSEPITSSMHKCDYPKERGPCSGHLRRWYWNKLRSKCESFLYGGCRGNANNFDTEAKCLAECKGLPADVCQHPKDVGTCKGYFHRWYFDSNIGWCKRFVYGGCGGNGNNFATLQECRTTCLSSRTAVDDTTAEYAPLPPAGADLSNYGGEHAGASSTTSAGLNVYGTTISEYVRTPTDGNGAPEGDHVVHKGKALLLMAVRERNFAFYQFLTLLVAGVLPETVPFPTTTPESDCLLLAKCLPGWILVADDRGCQRCTYPATVAQAVDECPDVAECPDDHSMVFDPVTGCKRCELVYTSTTARTDLTSVGPKEKEVKQCNATEDIVCGDLCMMITGSDGCPSCLCPQGESTVAPLAVTSAEPETEPLSTLEPESAKKTTCKEKMARKDCLPPCHIFAGQAGISTCVCPETTDAPVFETFPANATSPADISGVGLKCTEPMDMGQCQGPMVPRYWYNKETNVCEEFAYSGCGGNRNHFYSKEECEAHCVRDIEPSYFPEPPALPAVPAAVPQFPPTEPPYVPPRAPLNSPGSVPLPPGIESPLEQPQPPTDSSAYGTAEGLSVTFAPGFAPQPPRPAQPMESPYSTLFPGQPGLTPYSPSPPKLPQHVPLSPSPPPYVPKPPSPPPPYSPSTQMTYSTADMRPPTFPEKIEEYSEIPSTPGIFPEAVYGPEAGMPPPYPEPAPAVQSPYESGPTIQRPQDQRQLVYCPDGEIPMQYKNGTLVRCLPGQNFCPVKSRCYFNGLDYFCCSTAEYEMDVAPHPVKSPYKS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	63.5	Low	74.8	Confident	203 Å²	203	114.5 Å²	114.5	100%	1	62%	0.624	S	S	*	*				0	-66.9	0	-72.3	-51	-159.5	0	0	112.7	A3 K4 V5	M1-A3 VanDerWaalsContact C-N 3.34Å; M1-A3 PolarHBondContact O-N 2.04Å; M1-A3 VanDerWaalsContact O-N 3.09Å; M1-K4 PolarHBondContact O-N 3.02Å; M1-V5 PolarHBondContact O-N 3.29Å
2	L	73.8	Confident	74	Confident	142 Å²	142	114.5 Å²	114.5	74%	0.743	62%	0.622	S	S	*	*	H	α-helix	trans	-44	-48.7	-170.9	-128.8	78.9	0	0	0	115.3	K4 V5 I6	L2-K4 VanDerWaalsContact C-N 3.3Å; L2-K4 PolarHBondContact O-N 3.32Å; L2-V5 WeakPolarHBondContact O-CA 3.28Å; L2-V5 WeakPolarHBondContact O-CB 3.48Å; L2-V5 PolarHBondContact O-N 3.49Å; L2-I6 PolarHBondContact O-N 3.3Å
3	A	70.2	Confident	72.6	Confident	71 Å²	71	113.8 Å²	113.8	59%	0.587	62%	0.616	S	S	*	*	H	α-helix	trans	-57.8	-36.7	178.9	0	0	0	0	0	114.1	M1 V5 I6 V7	M1-A3 VanDerWaalsContact C-N 3.34Å; M1-A3 PolarHBondContact O-N 2.04Å; M1-A3 VanDerWaalsContact O-N 3.09Å; A3-V5 VanDerWaalsContact C-N 3.34Å; A3-I6 PolarHBondContact O-N 2.85Å; A3-V7 WeakPolarHBondContact O-CG2 3.49Å; A3-V7 PolarHBondContact O-N 3.19Å; A3-V7 VanDerWaalsContact O-N 3.08Å
4	K	75.5	Confident	71.3	Confident	168 Å²	168	110.2 Å²	110.2	73%	0.73	61%	0.61	S	S	*	*	H	α-helix	trans	-68.4	-33.6	175.2	-68.3	-167.3	174.9	-171.9	0	111.7	M1 L2 F8	M1-K4 PolarHBondContact O-N 3.02Å; L2-K4 VanDerWaalsContact C-N 3.3Å; L2-K4 PolarHBondContact O-N 3.32Å; K4-F8 WeakPolarHBondContact O-CB 3.35Å; K4-F8 PolarHBondContact O-N 3.07Å; K4-F8 VanDerWaalsContact O-N 3.09Å
5	V	83.9	Confident	69.8	Low	80 Å²	80	109.3 Å²	109.3	49%	0.485	61%	0.611	S	S	.	*	H	α-helix	trans	-67.4	-43.9	174.6	-178	0	0	0	0	110.6	M1 L2 A3 F8 L9	M1-V5 PolarHBondContact O-N 3.29Å; L2-V5 WeakPolarHBondContact O-CA 3.28Å; L2-V5 WeakPolarHBondContact O-CB 3.48Å; L2-V5 PolarHBondContact O-N 3.49Å; A3-V5 VanDerWaalsContact C-N 3.34Å; V5-F8 PolarHBondContact O-N 3.09Å; V5-L9 HydrophobicContact CG1-CD1 3.96Å; V5-L9 HydrophobicContact CG1-CG 4.37Å; V5-L9 VanDerWaalsContact O-CG 3.32Å; V5-L9 WeakPolarHBondContact O-CG 3.07Å; V5-L9 PolarHBondContact O-N 2.78Å
6	I	81.3	Confident	67.9	Low	99 Å²	99	110.9 Å²	110.9	51%	0.508	62%	0.617	S	S	.	*	H	α-helix	trans	-60.5	-48	177.7	-65	167.4	0	0	0	110.9	L2 A3 F8 L9 C10	L2-I6 PolarHBondContact O-N 3.3Å; A3-I6 PolarHBondContact O-N 2.85Å; I6-F8 VanDerWaalsContact C-N 3.34Å; I6-F8 PolarHBondContact O-N 2.8Å; I6-L9 PolarHBondContact O-N 2.78Å; I6-C10 PolarHBondContact O-N 2.9Å; I6-C10 PolarHBondContact O-SG 3.01Å; I6-C10 VanDerWaalsContact O-SG 3.36Å
7	V	78.2	Confident	66.1	Low	94 Å²	94	115.2 Å²	115.2	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-59.8	-44.1	176.7	173.4	0	0	0	0	111.3	A3 L9 C10 S11	A3-V7 WeakPolarHBondContact O-CG2 3.49Å; A3-V7 PolarHBondContact O-N 3.19Å; A3-V7 VanDerWaalsContact O-N 3.08Å; V7-L9 PolarHBondContact O-N 2.93Å; V7-C10 PolarHBondContact O-N 3.03Å; V7-S11 PolarHBondContact O-N 3.43Å; V7-S11 PolarHBondContact O-OG 2.89Å; V7-S11 VanDerWaalsContact O-OG 3.13Å
8	F	80.8	Confident	64.4	Low	147 Å²	147	114.4 Å²	114.4	65%	0.645	63%	0.633	S	S	*	*	H	α-helix	trans	-64.5	-38.8	179.1	-138	-89	0	0	0	112.8	K4 V5 I6 S11 L12	K4-F8 WeakPolarHBondContact O-CB 3.35Å; K4-F8 PolarHBondContact O-N 3.07Å; K4-F8 VanDerWaalsContact O-N 3.09Å; V5-F8 PolarHBondContact O-N 3.09Å; I6-F8 VanDerWaalsContact C-N 3.34Å; I6-F8 PolarHBondContact O-N 2.8Å; F8-S11 PolarHBondContact O-N 2.84Å; F8-L12 HydrophobicContact CD1-CD1 3.82Å; F8-L12 HydrophobicContact CD1-CG 4.26Å; F8-L12 HydrophobicContact CE1-CD1 4.2Å; F8-L12 WeakPolarHBondContact O-CG 3.44Å; F8-L12 PolarHBondContact O-N 2.78Å
9	L	76.4	Confident	62.7	Low	98 Å²	98	116.1 Å²	116.1	51%	0.513	64%	0.64	S	S	.	*	H	α-helix	trans	-64.3	-44.3	174.4	-72.5	169.4	0	0	0	111.7	V5 I6 V7 L12 L13	V5-L9 HydrophobicContact CG1-CD1 3.96Å; V5-L9 HydrophobicContact CG1-CG 4.37Å; V5-L9 VanDerWaalsContact O-CG 3.32Å; V5-L9 WeakPolarHBondContact O-CG 3.07Å; V5-L9 PolarHBondContact O-N 2.78Å; I6-L9 PolarHBondContact O-N 2.78Å; V7-L9 PolarHBondContact O-N 2.93Å; L9-L12 PolarHBondContact O-N 3.11Å; L9-L13 WeakPolarHBondContact O-CG 3.06Å; L9-L13 PolarHBondContact O-N 2.87Å
10	C	69.1	Low	61.5	Low	80 Å²	80	122.2 Å²	122.2	54%	0.541	65%	0.653	S	S	.	*	H	α-helix	trans	-62.2	-42.7	175.3	-68.1	0	0	0	0	112.1	I6 V7 L12 L13 A14	I6-C10 PolarHBondContact O-N 2.9Å; I6-C10 PolarHBondContact O-SG 3.01Å; I6-C10 VanDerWaalsContact O-SG 3.36Å; V7-C10 PolarHBondContact O-N 3.03Å; C10-L12 VanDerWaalsContact C-N 3.34Å; C10-L12 PolarHBondContact O-N 2.82Å; C10-L13 PolarHBondContact O-N 2.76Å; C10-A14 PolarHBondContact O-N 3.2Å; C10-A14 VanDerWaalsContact O-N 3.17Å
11	S	70.8	Confident	60.7	Low	78 Å²	78	120.5 Å²	120.5	55%	0.545	65%	0.651	S	S	.	*	H	α-helix	trans	-64.7	-34	177.3	-62	0	0	0	0	113.4	V7 F8	V7-S11 PolarHBondContact O-N 3.43Å; V7-S11 PolarHBondContact O-OG 2.89Å; V7-S11 VanDerWaalsContact O-OG 3.13Å; F8-S11 PolarHBondContact O-N 2.84Å
12	L	64.4	Low	60	Low	114 Å²	114	115.5 Å²	115.5	60%	0.597	64%	0.636	S	S	*	*	H	α-helix	trans	-74.8	-23.8	177.4	-75	170.6	0	0	0	113.6	F8 L9 C10	F8-L12 HydrophobicContact CD1-CD1 3.82Å; F8-L12 HydrophobicContact CD1-CG 4.26Å; F8-L12 HydrophobicContact CE1-CD1 4.2Å; F8-L12 WeakPolarHBondContact O-CG 3.44Å; F8-L12 PolarHBondContact O-N 2.78Å; L9-L12 PolarHBondContact O-N 3.11Å; C10-L12 VanDerWaalsContact C-N 3.34Å; C10-L12 PolarHBondContact O-N 2.82Å
13	L	56.7	Low	59.6	Low	105 Å²	105	112 Å²	112	55%	0.55	62%	0.621	S	S	.	*	H	α-helix	trans	-90.7	-18.7	177.7	-67.2	175.4	0	0	0	113.8	L9 C10 P15 L16	L9-L13 WeakPolarHBondContact O-CG 3.06Å; L9-L13 PolarHBondContact O-N 2.87Å; C10-L13 PolarHBondContact O-N 2.76Å; L13-P15 VanDerWaalsContact C-CD 3.41Å; L13-L16 PolarHBondContact O-N 3.09Å; L13-L16 VanDerWaalsContact O-N 3.15Å
14	A	53.5	Low	60.1	Low	64 Å²	64	110.9 Å²	110.9	53%	0.529	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-48.7	-43	178.3	0	0	0	0	0	115.8	C10 L16	C10-A14 PolarHBondContact O-N 3.2Å; C10-A14 VanDerWaalsContact O-N 3.17Å; A14-L16 VanDerWaalsContact C-N 3.25Å; A14-L16 PolarHBondContact O-N 3.17Å
15	P	48.9	Very low	60.4	Low	96 Å²	96	104.7 Å²	104.7	62%	0.623	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-77	-1.1	-177.2	31.3	-36.1	0	0	0	115.1	L13	L13-P15 VanDerWaalsContact C-CD 3.41Å
16	L	40	Very low	60.6	Low	135 Å²	135	101.4 Å²	101.4	71%	0.707	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-94.2	-10.6	176.6	-66.9	179.3	0	0	0	113.9	L13 A14	L13-L16 PolarHBondContact O-N 3.09Å; L13-L16 VanDerWaalsContact O-N 3.15Å; A14-L16 VanDerWaalsContact C-N 3.25Å; A14-L16 PolarHBondContact O-N 3.17Å
17	F	36.8	Very low	60.8	Low	185 Å²	185	102 Å²	102	81%	0.811	56%	0.563	S	S	*	*	S	Bend	trans	-105.1	67.7	171.8	-71.3	-77.6	0	0	0	111.2
18	S	35.3	Very low	61	Low	101 Å²	101	104.8 Å²	104.8	71%	0.706	56%	0.563	S	S	*	*			trans	-144.9	39.4	170.4	-74.9	0	0	0	0	111.4	R20	S18-R20 PolarHBondContact O-N 2.76Å
19	D	33	Very low	60.5	Low	145 Å²	145	99.1 Å²	99.1	78%	0.775	54%	0.539	S	S	*	.			trans	-69.5	104.3	170	-168.2	-6.1	0	0	0	109.7	S21	D19-S21 PolarHBondContact O-N 3.49Å
20	R	38.5	Very low	60.4	Low	238 Å²	238	101.2 Å²	101.2	90%	0.898	55%	0.549	S	S	*	.			trans	-76.2	66.3	178.2	-169.9	-173.2	-171.4	-177.4	4.6	109	S18 S22	S18-R20 PolarHBondContact O-N 2.76Å; R20-S22 PolarHBondContact O-N 3.15Å
21	S	43.3	Very low	60.4	Low	88 Å²	88	102.4 Å²	102.4	62%	0.615	54%	0.543	S	S	*	.			trans	-46.4	111.8	-165.5	60.3	0	0	0	0	112.3	D19 V23	D19-S21 PolarHBondContact O-N 3.49Å; S21-V23 VanDerWaalsContact C-N 3.29Å; S21-V23 PolarHBondContact O-N 3.29Å
22	S	49.7	Very low	60.1	Low	98 Å²	98	106 Å²	106	69%	0.685	54%	0.544	S	S	*	.			trans	-74.3	85.9	-176.7	-176.6	0	0	0	0	109.3	R20 N24	R20-S22 PolarHBondContact O-N 3.15Å; S22-N24 PolarHBondContact O-N 2.86Å
23	V	66.4	Low	60.1	Low	69 Å²	69	103.8 Å²	103.8	42%	0.418	54%	0.538	S	S	.	.			trans	-49.3	111	-172.8	-164.3	0	0	0	0	110.7	S21 Q29 K74	S21-V23 VanDerWaalsContact C-N 3.29Å; S21-V23 PolarHBondContact O-N 3.29Å; V23-Q29 HydrophobicContact CG1-CG 3.69Å; V23-K74 WeakPolarHBondContact O-CD 3.33Å
24	N	80	Confident	60.9	Low	46 Å²	46	102.6 Å²	102.6	25%	0.246	53%	0.533	C	S	.	.			trans	-67.3	121.3	-168.9	-176.6	-5.7	0	0	0	109.9	S22 C26 E27	S22-N24 PolarHBondContact O-N 2.86Å; N24-C26 PolarHBondContact O-N 3.11Å; N24-C26 VanDerWaalsContact O-N 3.16Å; N24-C26 WeakPolarHBondContact OD1-CB 3.32Å; N24-C26 PolarHBondContact OD1-N 2.78Å; N24-E27 HydrophobicContact CB-CB 4.12Å; N24-E27 HydrophobicContact CB-CG 4.07Å; N24-E27 PolarHBondContact ND2-OE1 2.77Å; N24-E27 PolarHBondContact O-N 2.89Å
25	P	81.9	Confident	61.7	Low	39 Å²	39	100.3 Å²	100.3	25%	0.253	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.7	178.4	31.2	-38.8	0	0	0	112.9	K74 L75 F76	P25-K74 HydrophobicContact CB-CB 4.15Å; P25-K74 WeakPolarHBondContact CB-O 3.45Å; P25-L75 WeakPolarHBondContact O-CG 3.46Å; P25-F76 HydrophobicContact CB-CE1 4.5Å; P25-F76 HydrophobicContact CB-CE2 3.76Å; P25-F76 HydrophobicContact CB-CZ 3.7Å; P25-F76 HydrophobicContact CG-CE2 4.27Å; P25-F76 HydrophobicContact CG-CZ 3.91Å; P25-F76 WeakPolarHBondContact O-CE2 3.33Å
26	C	88.7	Confident	62.7	Low	10 Å²	10	99.2 Å²	99.2	7%	0.068	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.9	173.7	-60.4	0	0	0	0	113.6	N24 R54 C86	N24-C26 PolarHBondContact O-N 3.11Å; N24-C26 VanDerWaalsContact O-N 3.16Å; N24-C26 WeakPolarHBondContact OD1-CB 3.32Å; N24-C26 PolarHBondContact OD1-N 2.78Å; C26-R54 HydrophobicContact CB-CB 4.11Å; C26-R54 WeakPolarHBondContact O-CA 3.22Å; C26-R54 VanDerWaalsContact O-CB 3.31Å; C26-R54 WeakPolarHBondContact O-CB 3.27Å; C26-R54 PolarHBondContact O-N 3.01Å; C26-C86 WeakPolarHBondContact CA-SG 3.38Å; C26-C86 HydrophobicContact CB-CB 3.81Å; C26-C86 WeakPolarHBondContact CB-SG 3.49Å; C26-C86 WeakPolarHBondContact SG-CA 3.39Å; C26-C86 WeakPolarHBondContact SG-CB 3.35Å; C26-C86 CovalentContact SG-SG 2.03Å; C26-C86 PolarHBondContact SG-SG 3.24Å
27	E	85.7	Confident	64.2	Low	113 Å²	113	96.5 Å²	96.5	53%	0.528	50%	0.496	S	S	.	.	S	Bend	trans	-107.3	163.5	179.3	-75.5	161	-148.7	0	0	112.2	N24 Q29 Y53	N24-E27 HydrophobicContact CB-CB 4.12Å; N24-E27 HydrophobicContact CB-CG 4.07Å; N24-E27 PolarHBondContact ND2-OE1 2.77Å; N24-E27 PolarHBondContact O-N 2.89Å; E27-Q29 PolarHBondContact O-N 2.87Å; E27-Y53 WeakPolarHBondContact O-CB 3.44Å
28	R	80.4	Confident	65.4	Low	151 Å²	151	88.6 Å²	88.6	57%	0.57	47%	0.466	S	S	*	.			trans	-80.4	107	-178.1	-172.3	-174.5	175.9	-165	-3.9	110.4	Y53 Y62	R28-Y53 HydrophobicContact CB-CD1 4.19Å; R28-Y53 HydrophobicContact CB-CD2 3.93Å; R28-Y53 HydrophobicContact CB-CE1 3.97Å; R28-Y53 HydrophobicContact CB-CE2 3.73Å; R28-Y53 HydrophobicContact CB-CG 4.18Å; R28-Y53 HydrophobicContact CG-CD1 4.32Å; R28-Y53 HydrophobicContact CG-CE1 3.85Å; R28-Y53 HydrophobicContact CG-CE2 4.43Å; R28-Y62 HydrophobicContact CG-CD2 4.09Å; R28-Y62 HydrophobicContact CG-CE2 3.71Å
29	Q	72	Confident	66.5	Low	28 Å²	28	89.5 Å²	89.5	13%	0.131	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-68.5	150.8	166.5	-73	173	2.6	0	0	111.1	V23 E27 Y62 Y64 L75	V23-Q29 HydrophobicContact CG1-CG 3.69Å; E27-Q29 PolarHBondContact O-N 2.87Å; Q29-Y62 PolarHBondContact N-OH 2.79Å; Q29-Y62 VanDerWaalsContact O-CE2 3.29Å; Q29-Y62 WeakPolarHBondContact O-CE2 3.13Å; Q29-Y62 PolarHBondContact O-OH 2.7Å; Q29-Y64 HydrophobicContact CB-CD2 4.22Å; Q29-Y64 HydrophobicContact CB-CE2 3.73Å; Q29-L75 HydrophobicContact CB-CD1 4.12Å; Q29-L75 HydrophobicContact CG-CD1 3.52Å
30	I	72.5	Confident	67.8	Low	142 Å²	142	86.4 Å²	86.4	73%	0.728	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-66.8	135.1	179.8	-62.2	172.1	0	0	0	109.5
31	Y	69.9	Low	69.1	Low	106 Å²	106	77.5 Å²	77.5	42%	0.416	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-74.3	125.8	169.9	176.5	-95.9	0	0	0	109.4	F48 P63	Y31-F48 HydrophobicContact CE2-CD2 4.47Å; Y31-P63 HydrophobicContact CD2-CB 3.76Å; Y31-P63 WeakPolarHBondContact CD2-O 3.3Å; Y31-P63 HydrophobicContact CE2-CB 3.79Å
32	R	65.5	Low	70	Confident	153 Å²	153	78.3 Å²	78.3	58%	0.577	44%	0.435	S	S	*	.			trans	-111.3	138.4	165.5	-62.8	-174.9	176.8	-166.3	-2.7	108	D34 S46	R32-D34 VanDerWaalsContact C-N 3.35Å; R32-D34 WeakPolarHBondContact CB-O 3.5Å; R32-S46 PolarHBondContact O-OG 3.27Å; R32-S46 VanDerWaalsContact O-OG 3.05Å
33	S	63.7	Low	70.8	Confident	67 Å²	67	76.5 Å²	76.5	47%	0.469	42%	0.422	S	S	.	.	S	Bend	trans	-69.7	-36.6	167.9	38.1	0	0	0	0	111.2	S46	S33-S46 VanDerWaalsContact C-OG 3.27Å; S33-S46 WeakPolarHBondContact O-CA 3.24Å; S33-S46 WeakPolarHBondContact O-CB 3.43Å; S33-S46 PolarHBondContact O-N 3Å; S33-S46 PolarHBondContact O-OG 2.64Å
34	D	72.5	Confident	70.9	Confident	81 Å²	81	78.6 Å²	78.6	43%	0.433	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-122.6	149.1	-168.2	-50.7	-72.7	0	0	0	111	R32	R32-D34 VanDerWaalsContact C-N 3.35Å; R32-D34 WeakPolarHBondContact CB-O 3.5Å
35	C	71.1	Confident	70.4	Confident	15 Å²	15	81.4 Å²	81.4	10%	0.101	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-75.9	148.8	178	-65.1	0	0	0	0	111.4	S43 R44 C67	C35-S43 PolarHBondContact O-OG 3Å; C35-R44 WeakPolarHBondContact CB-O 3.33Å; C35-R44 PolarHBondContact N-O 3.07Å; C35-R44 PolarHBondContact SG-O 2.77Å; C35-C67 WeakPolarHBondContact CA-SG 3.4Å; C35-C67 HydrophobicContact CB-CB 3.8Å; C35-C67 WeakPolarHBondContact CB-SG 3.24Å; C35-C67 WeakPolarHBondContact SG-CA 3.35Å; C35-C67 WeakPolarHBondContact SG-CB 3.35Å; C35-C67 CovalentContact SG-SG 2.03Å; C35-C67 PolarHBondContact SG-SG 3.49Å
36	P	69.3	Low	69.9	Low	73 Å²	73	80.4 Å²	80.4	47%	0.474	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-52.9	138	161.2	27.1	-33.9	0	0	0	108.3
37	P	72.2	Confident	68.9	Low	79 Å²	79	83.6 Å²	83.6	51%	0.513	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-57.1	145.3	-176.9	23	-33.6	0	0	0	111.4	G41	P37-G41 WeakPolarHBondContact CB-O 3.47Å
38	G	60.8	Low	68.4	Low	18 Å²	18	83.8 Å²	83.8	19%	0.186	45%	0.451	C	S	.	.			trans	-70.5	-173.7	176.5	0	0	0	0	0	112.7	D40 G41 I42	G38-D40 PolarHBondContact O-N 3.36Å; G38-D40 VanDerWaalsContact O-N 3.11Å; G38-G41 PolarHBondContact O-N 2.05Å; G38-G41 VanDerWaalsContact O-N 3.12Å; G38-I42 PolarHBondContact N-O 2.93Å
39	S	58.6	Low	68.2	Low	120 Å²	120	77.8 Å²	77.8	84%	0.839	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.7	-35.9	162.1	32.5	0	0	0	0	112.6	G41	S39-G41 PolarHBondContact O-N 3.39Å
40	D	61.1	Low	68.4	Low	81 Å²	81	80.8 Å²	80.8	43%	0.433	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.2	-172.5	-20.2	-28.7	0	0	0	112.9	G38 I42 R44	G38-D40 PolarHBondContact O-N 3.36Å; G38-D40 VanDerWaalsContact O-N 3.11Å; D40-I42 HydrophobicContact CB-CD1 4.49Å; D40-I42 PolarHBondContact O-N 2.96Å; D40-R44 IonicContact OD2-CZ 3.74Å; D40-R44 IonicContact OD2-NE 3.05Å; D40-R44 IonicContact OD2-NH2 3.63Å; D40-R44 PolarHBondContact OD2-NH2 2.74Å
41	G	66.5	Low	69.1	Low	51 Å²	51	75 Å²	75	53%	0.526	42%	0.416	S	S	.	.	S	Bend	trans	71.8	-22.1	-172.2	0	0	0	0	0	114.6	P37 G38 S39 S43	P37-G41 WeakPolarHBondContact CB-O 3.47Å; G38-G41 PolarHBondContact O-N 2.05Å; G38-G41 VanDerWaalsContact O-N 3.12Å; S39-G41 PolarHBondContact O-N 3.39Å; G41-S43 PolarHBondContact O-N 3.09Å
42	I	62.3	Low	70.1	Confident	104 Å²	104	72.2 Å²	72.2	53%	0.533	41%	0.405	S	S	.	.			trans	-68.8	118.2	178.6	-61.1	168.4	0	0	0	110.3	G38 D40 R44	G38-I42 PolarHBondContact N-O 2.93Å; D40-I42 HydrophobicContact CB-CD1 4.49Å; D40-I42 PolarHBondContact O-N 2.96Å; I42-R44 HydrophobicContact CG2-CG 4.24Å
43	S	65.1	Low	71.3	Confident	61 Å²	61	66.4 Å²	66.4	43%	0.427	38%	0.383	S	S	.	.			trans	-70	130.5	160.4	-176.6	0	0	0	0	109.3	C35 G41	C35-S43 PolarHBondContact O-OG 3Å; G41-S43 PolarHBondContact O-N 3.09Å
44	R	68	Low	72.5	Confident	113 Å²	113	68.4 Å²	68.4	43%	0.426	38%	0.38	S	S	.	.			trans	-108.5	142.9	175.4	-56	-172.7	-170.4	-151.5	5.8	108.1	C35 D40 I42	C35-R44 WeakPolarHBondContact CB-O 3.33Å; C35-R44 PolarHBondContact N-O 3.07Å; C35-R44 PolarHBondContact SG-O 2.77Å; D40-R44 IonicContact OD2-CZ 3.74Å; D40-R44 IonicContact OD2-NE 3.05Å; D40-R44 IonicContact OD2-NH2 3.63Å; D40-R44 PolarHBondContact OD2-NH2 2.74Å; I42-R44 HydrophobicContact CG2-CG 4.24Å
45	P	70.9	Confident	72.7	Confident	105 Å²	105	71.2 Å²	71.2	68%	0.682	39%	0.385	S	S	*	.	B	Isolated β-bridge	trans	-60.2	142	179.2	25.2	-34.5	0	0	0	110.5
46	S	70.2	Confident	73.2	Confident	18 Å²	18	73.5 Å²	73.5	13%	0.126	41%	0.411	C	S	.	.			trans	-79.4	143.4	178.9	81.7	0	0	0	0	111.2	R32 S33 F48 G65 L66	R32-S46 PolarHBondContact O-OG 3.27Å; R32-S46 VanDerWaalsContact O-OG 3.05Å; S33-S46 VanDerWaalsContact C-OG 3.27Å; S33-S46 WeakPolarHBondContact O-CA 3.24Å; S33-S46 WeakPolarHBondContact O-CB 3.43Å; S33-S46 PolarHBondContact O-N 3Å; S33-S46 PolarHBondContact O-OG 2.64Å; S46-F48 PolarHBondContact O-N 2.92Å; S46-G65 WeakPolarHBondContact OG-CA 3.18Å; S46-L66 CarbonylContact C-O 3.47Å; S46-L66 WeakPolarHBondContact CA-O 3.37Å
47	Q	69.2	Low	73.8	Confident	76 Å²	76	74.2 Å²	74.2	36%	0.355	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113.3	174.1	-169.9	-176.9	14.2	0	0	109.4	V49 L66	Q47-V49 HydrophobicContact CG-CG1 4.49Å; Q47-V49 PolarHBondContact O-N 3.43Å; Q47-L66 HydrophobicContact CB-CB 4.31Å; Q47-L66 PolarHBondContact N-O 3.2Å; Q47-L66 WeakPolarHBondContact O-CB 3.2Å; Q47-L66 PolarHBondContact O-N 3.01Å
48	F	75.4	Confident	74.3	Confident	118 Å²	118	73.1 Å²	73.1	52%	0.518	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	124.3	170.6	176.3	-79	0	0	0	110.6	Y31 S46 L50 P63	Y31-F48 HydrophobicContact CE2-CD2 4.47Å; S46-F48 PolarHBondContact O-N 2.92Å; F48-L50 HydrophobicContact CE1-CG 4.46Å; F48-P63 HydrophobicContact CD2-CB 4.08Å; F48-P63 HydrophobicContact CE2-CB 3.48Å; F48-P63 VanDerWaalsContact CE2-CB 3.48Å; F48-P63 HydrophobicContact CE2-CG 3.68Å; F48-P63 HydrophobicContact CZ-CB 4.12Å; F48-P63 HydrophobicContact CZ-CG 4.07Å
49	V	75.4	Confident	75.8	Confident	24 Å²	24	72.3 Å²	72.3	15%	0.145	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.5	170.6	-66.5	0	0	0	0	111.3	Q47 R51 Y64 L66	Q47-V49 HydrophobicContact CG-CG1 4.49Å; Q47-V49 PolarHBondContact O-N 3.43Å; V49-R51 HydrophobicContact CG2-CG 4.4Å; V49-Y64 HydrophobicContact CG2-CD1 4.39Å; V49-Y64 WeakPolarHBondContact CG2-O 3.06Å; V49-Y64 PolarHBondContact N-O 3.36Å; V49-Y64 PolarHBondContact O-N 3.36Å; V49-L66 HydrophobicContact CG1-CB 4.2Å; V49-L66 HydrophobicContact CG1-CD1 4.06Å; V49-L66 HydrophobicContact CG2-CB 3.77Å; V49-L66 HydrophobicContact CG2-CD1 4.13Å; V49-L66 HydrophobicContact CG2-CG 4Å
50	L	75.5	Confident	77.1	Confident	91 Å²	91	67.2 Å²	67.2	48%	0.476	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	136.2	170.1	-81.7	154.6	0	0	0	110.6	F48	F48-L50 HydrophobicContact CE1-CG 4.46Å
51	R	87.4	Confident	78.2	Confident	21 Å²	21	65.3 Å²	65.3	8%	0.079	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.5	173	-72.2	-63.7	-179.2	-85.5	-1.8	111.3	V49 S61 Y62 Y64 L75 F76	V49-R51 HydrophobicContact CG2-CG 4.4Å; R51-S61 VanDerWaalsContact O-CA 3.29Å; R51-S61 WeakPolarHBondContact O-CA 3.11Å; R51-Y62 HydrophobicContact CB-CE1 4.09Å; R51-Y62 PolarHBondContact N-O 3.18Å; R51-Y62 WeakPolarHBondContact O-CD1 3.1Å; R51-Y62 PolarHBondContact O-N 3.14Å; R51-Y64 HydrophobicContact CG-CD1 4.43Å; R51-Y64 HydrophobicContact CG-CG 4.21Å; R51-L75 HydrophobicContact CB-CB 4.02Å; R51-L75 HydrophobicContact CB-CD2 4.2Å; R51-L75 WeakPolarHBondContact CD-O 3.39Å; R51-L75 HydrophobicContact CG-CB 4.37Å; R51-F76 WeakPolarHBondContact CD-O 3.41Å
52	Y	90.4	Very high	78.9	Confident	48 Å²	48	63.7 Å²	63.7	19%	0.188	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.1	-175.9	-64.1	-107.1	0	0	0	111.3	V60 F76 K77 S78 R79	Y52-V60 VanDerWaalsContact CA-O 3.25Å; Y52-V60 WeakPolarHBondContact CA-O 3.38Å; Y52-F76 PolarHBondContact N-O 3.01Å; Y52-F76 PolarHBondContact O-N 3.45Å; Y52-K77 WeakPolarHBondContact CD2-O 3.2Å; Y52-K77 VanDerWaalsContact CE2-O 3.25Å; Y52-K77 WeakPolarHBondContact CE2-O 3.44Å; Y52-S78 VanDerWaalsContact CD2-C 3.46Å; Y52-R79 HydrophobicContact CD1-CB 3.9Å; Y52-R79 HydrophobicContact CD1-CG 4.15Å; Y52-R79 HydrophobicContact CE1-CB 3.6Å; Y52-R79 HydrophobicContact CE1-CG 4.05Å
53	Y	91	Very high	79.6	Confident	30 Å²	30	60.3 Å²	60.3	12%	0.118	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	170	174.4	74.3	-84.5	0	0	0	110.4	E27 R28 R55 C59 V60 Y62	E27-Y53 WeakPolarHBondContact O-CB 3.44Å; R28-Y53 HydrophobicContact CB-CD1 4.19Å; R28-Y53 HydrophobicContact CB-CD2 3.93Å; R28-Y53 HydrophobicContact CB-CE1 3.97Å; R28-Y53 HydrophobicContact CB-CE2 3.73Å; R28-Y53 HydrophobicContact CB-CG 4.18Å; R28-Y53 HydrophobicContact CG-CD1 4.32Å; R28-Y53 HydrophobicContact CG-CE1 3.85Å; R28-Y53 HydrophobicContact CG-CE2 4.43Å; Y53-R55 HydrophobicContact CE2-CB 4.06Å; Y53-C59 CarbonylContact O-C 3.52Å; Y53-C59 WeakPolarHBondContact O-CA 3.25Å; Y53-V60 HydrophobicContact CD1-CG2 3.88Å; Y53-V60 HydrophobicContact CD2-CG2 4.19Å; Y53-V60 HydrophobicContact CE1-CG2 3.39Å; Y53-V60 HydrophobicContact CE2-CG2 3.7Å; Y53-V60 HydrophobicContact CG-CG2 4.25Å; Y53-V60 PolarHBondContact N-O 3Å; Y53-V60 VanDerWaalsContact N-O 3.07Å; Y53-V60 PolarHBondContact O-N 2.7Å; Y53-Y62 AromaticContact CD1-CD1 3.42Å; Y53-Y62 HydrophobicContact CD1-CD1 3.42Å; Y53-Y62 VanDerWaalsContact CD1-CD1 3.42Å; Y53-Y62 AromaticContact CD1-CE1 3.56Å; Y53-Y62 HydrophobicContact CD1-CE1 3.56Å; Y53-Y62 HydrophobicContact CD1-CG 4.24Å; Y53-Y62 AromaticContact CE1-CD1 3.51Å; Y53-Y62 HydrophobicContact CE1-CD1 3.51Å; Y53-Y62 HydrophobicContact CE1-CE1 4Å; Y53-Y62 AromaticContact CE1-CG 3.88Å; Y53-Y62 HydrophobicContact CE1-CG 3.88Å
54	R	89.7	Confident	80.4	Confident	109 Å²	109	59.2 Å²	59.2	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120.3	179.6	179.5	175.7	66.4	-171.8	7.6	111.4	C26 G56 Q58 C86 L87	C26-R54 HydrophobicContact CB-CB 4.11Å; C26-R54 WeakPolarHBondContact O-CA 3.22Å; C26-R54 VanDerWaalsContact O-CB 3.31Å; C26-R54 WeakPolarHBondContact O-CB 3.27Å; C26-R54 PolarHBondContact O-N 3.01Å; R54-G56 WeakPolarHBondContact CG-O 3.08Å; R54-Q58 WeakPolarHBondContact CA-O 3.41Å; R54-C86 HydrophobicContact CB-CB 3.92Å; R54-C86 WeakPolarHBondContact CD-O 3.44Å; R54-C86 HydrophobicContact CG-CB 4.44Å; R54-C86 PolarHBondContact NH1-O 3.03Å; R54-L87 HydrophobicContact CG-CD2 3.95Å
55	R	77.3	Confident	80.8	Confident	141 Å²	141	54 Å²	54	53%	0.532	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	109.1	163.3	-169.9	178.9	-179.1	-170.3	-0.5	108	Y53 Q58 V60	Y53-R55 HydrophobicContact CE2-CB 4.06Å; R55-Q58 PolarHBondContact N-O 2.96Å; R55-Q58 PolarHBondContact O-N 2.84Å; R55-V60 HydrophobicContact CB-CG1 3.78Å; R55-V60 HydrophobicContact CB-CG2 3.89Å
56	G	81.8	Confident	80.8	Confident	62 Å²	62	50.8 Å²	50.8	64%	0.639	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	-138	-170	0	0	0	0	0	111.6	R54 Q58	R54-G56 WeakPolarHBondContact CG-O 3.08Å; G56-Q58 PolarHBondContact O-N 3.38Å; G56-Q58 VanDerWaalsContact O-N 3.15Å
57	A	82	Confident	81	Confident	89 Å²	89	50.5 Å²	50.5	74%	0.736	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	16.5	179.3	0	0	0	0	0	114.9	L87	A57-L87 WeakPolarHBondContact O-CD1 3.27Å
58	Q	81.4	Confident	80.7	Confident	56 Å²	56	53.1 Å²	53.1	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150	-175	-68.3	-152	22.4	0	0	115.4	R54 R55 G56 P568	R54-Q58 WeakPolarHBondContact CA-O 3.41Å; R55-Q58 PolarHBondContact N-O 2.96Å; R55-Q58 PolarHBondContact O-N 2.84Å; G56-Q58 PolarHBondContact O-N 3.38Å; G56-Q58 VanDerWaalsContact O-N 3.15Å; Q58-P568 VanDerWaalsContact CD-CD 3.45Å
59	C	91.8	Very high	79.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	104.3	173.8	-77.4	0	0	0	0	112.5	Y53 R79 C82 Q83 K570	Y53-C59 CarbonylContact O-C 3.52Å; Y53-C59 WeakPolarHBondContact O-CA 3.25Å; C59-R79 HydrophobicContact CB-CG 4.32Å; C59-C82 HydrophobicContact CB-CB 3.69Å; C59-C82 WeakPolarHBondContact CB-SG 3.11Å; C59-C82 WeakPolarHBondContact SG-CB 3.29Å; C59-C82 PolarHBondContact SG-O 3.26Å; C59-C82 VanDerWaalsContact SG-O 3.33Å; C59-C82 CovalentContact SG-SG 2.04Å; C59-C82 PolarHBondContact SG-SG 3.42Å; C59-Q83 HydrophobicContact CB-CG 3.91Å; C59-Q83 PolarHBondContact SG-N 3.41Å; C59-K570 PolarHBondContact O-NZ 2.87Å
60	V	86.1	Confident	79.1	Confident	13 Å²	13	55 Å²	55	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	156	-178.1	-49.2	0	0	0	0	109.9	Y52 Y53 R55 H569	Y52-V60 VanDerWaalsContact CA-O 3.25Å; Y52-V60 WeakPolarHBondContact CA-O 3.38Å; Y53-V60 HydrophobicContact CD1-CG2 3.88Å; Y53-V60 HydrophobicContact CD2-CG2 4.19Å; Y53-V60 HydrophobicContact CE1-CG2 3.39Å; Y53-V60 HydrophobicContact CE2-CG2 3.7Å; Y53-V60 HydrophobicContact CG-CG2 4.25Å; Y53-V60 PolarHBondContact N-O 3Å; Y53-V60 VanDerWaalsContact N-O 3.07Å; Y53-V60 PolarHBondContact O-N 2.7Å; R55-V60 HydrophobicContact CB-CG1 3.78Å; R55-V60 HydrophobicContact CB-CG2 3.89Å; V60-H569 VanDerWaalsContact CB-NE2 3.34Å; V60-H569 WeakPolarHBondContact CB-NE2 3.31Å; V60-H569 VanDerWaalsContact CG1-NE2 3.33Å; V60-H569 WeakPolarHBondContact CG1-NE2 3.12Å
61	S	85.7	Confident	78.1	Confident	41 Å²	41	57 Å²	57	29%	0.287	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.6	-177.8	46.8	0	0	0	0	111.1	R51 K570	R51-S61 VanDerWaalsContact O-CA 3.29Å; R51-S61 WeakPolarHBondContact O-CA 3.11Å; S61-K570 WeakPolarHBondContact OG-CE 3.28Å; S61-K570 PolarHBondContact OG-NZ 2.85Å
62	Y	81.2	Confident	76.1	Confident	16 Å²	16	62.1 Å²	62.1	6%	0.063	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	164.7	-178.4	80.6	-59.2	0	0	0	112.2	R28 Q29 R51 Y53 Y64 L75	R28-Y62 HydrophobicContact CG-CD2 4.09Å; R28-Y62 HydrophobicContact CG-CE2 3.71Å; Q29-Y62 PolarHBondContact N-OH 2.79Å; Q29-Y62 VanDerWaalsContact O-CE2 3.29Å; Q29-Y62 WeakPolarHBondContact O-CE2 3.13Å; Q29-Y62 PolarHBondContact O-OH 2.7Å; R51-Y62 HydrophobicContact CB-CE1 4.09Å; R51-Y62 PolarHBondContact N-O 3.18Å; R51-Y62 WeakPolarHBondContact O-CD1 3.1Å; R51-Y62 PolarHBondContact O-N 3.14Å; Y53-Y62 AromaticContact CD1-CD1 3.42Å; Y53-Y62 HydrophobicContact CD1-CD1 3.42Å; Y53-Y62 VanDerWaalsContact CD1-CD1 3.42Å; Y53-Y62 AromaticContact CD1-CE1 3.56Å; Y53-Y62 HydrophobicContact CD1-CE1 3.56Å; Y53-Y62 HydrophobicContact CD1-CG 4.24Å; Y53-Y62 AromaticContact CE1-CD1 3.51Å; Y53-Y62 HydrophobicContact CE1-CD1 3.51Å; Y53-Y62 HydrophobicContact CE1-CE1 4Å; Y53-Y62 AromaticContact CE1-CG 3.88Å; Y53-Y62 HydrophobicContact CE1-CG 3.88Å; Y62-Y64 WeakPolarHBondContact OH-CD2 3.09Å; Y62-L75 HydrophobicContact CE1-CD2 3.4Å; Y62-L75 VanDerWaalsContact CE1-CD2 3.4Å; Y62-L75 VanDerWaalsContact OH-CD2 3.23Å; Y62-L75 WeakPolarHBondContact OH-CD2 3.14Å
63	P	76.9	Confident	74.4	Confident	34 Å²	34	60.4 Å²	60.4	22%	0.221	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	135.5	171.3	-26.5	37.9	0	0	0	113.5	Y31 F48	Y31-P63 HydrophobicContact CD2-CB 3.76Å; Y31-P63 WeakPolarHBondContact CD2-O 3.3Å; Y31-P63 HydrophobicContact CE2-CB 3.79Å; F48-P63 HydrophobicContact CD2-CB 4.08Å; F48-P63 HydrophobicContact CE2-CB 3.48Å; F48-P63 VanDerWaalsContact CE2-CB 3.48Å; F48-P63 HydrophobicContact CE2-CG 3.68Å; F48-P63 HydrophobicContact CZ-CB 4.12Å; F48-P63 HydrophobicContact CZ-CG 4.07Å
64	Y	80.2	Confident	73.3	Confident	37 Å²	37	64.5 Å²	64.5	15%	0.145	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.3	169	-174.3	-92.1	0	0	0	110.1	Q29 V49 R51 Y62 P73	Q29-Y64 HydrophobicContact CB-CD2 4.22Å; Q29-Y64 HydrophobicContact CB-CE2 3.73Å; V49-Y64 HydrophobicContact CG2-CD1 4.39Å; V49-Y64 WeakPolarHBondContact CG2-O 3.06Å; V49-Y64 PolarHBondContact N-O 3.36Å; V49-Y64 PolarHBondContact O-N 3.36Å; R51-Y64 HydrophobicContact CG-CD1 4.43Å; R51-Y64 HydrophobicContact CG-CG 4.21Å; Y62-Y64 WeakPolarHBondContact OH-CD2 3.09Å; Y64-P73 HydrophobicContact CD1-CB 3.94Å; Y64-P73 HydrophobicContact CD1-CG 3.93Å; Y64-P73 HydrophobicContact CE1-CB 3.34Å; Y64-P73 HydrophobicContact CE1-CG 3.64Å
65	G	76.9	Confident	72.8	Confident	5 Å²	5	59.5 Å²	59.5	5%	0.052	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	104.6	175.7	0	0	0	0	0	111.5	S46	S46-G65 WeakPolarHBondContact OG-CA 3.18Å
66	L	72.2	Confident	73.3	Confident	36 Å²	36	53.9 Å²	53.9	19%	0.188	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.6	174.4	-131.6	-175.3	0	0	0	110.3	S46 Q47 V49 P73	S46-L66 CarbonylContact C-O 3.47Å; S46-L66 WeakPolarHBondContact CA-O 3.37Å; Q47-L66 HydrophobicContact CB-CB 4.31Å; Q47-L66 PolarHBondContact N-O 3.2Å; Q47-L66 WeakPolarHBondContact O-CB 3.2Å; Q47-L66 PolarHBondContact O-N 3.01Å; V49-L66 HydrophobicContact CG1-CB 4.2Å; V49-L66 HydrophobicContact CG1-CD1 4.06Å; V49-L66 HydrophobicContact CG2-CB 3.77Å; V49-L66 HydrophobicContact CG2-CD1 4.13Å; V49-L66 HydrophobicContact CG2-CG 4Å; L66-P73 HydrophobicContact CD2-CG 4.15Å; L66-P73 HydrophobicContact CG-CG 4.13Å
67	C	73.7	Confident	73.5	Confident	13 Å²	13	56.1 Å²	56.1	9%	0.088	32%	0.317	C	S	.	.			trans	-127.2	127.6	-179.9	-69.7	0	0	0	0	110.3	C35 L69 S70	C35-C67 WeakPolarHBondContact CA-SG 3.4Å; C35-C67 HydrophobicContact CB-CB 3.8Å; C35-C67 WeakPolarHBondContact CB-SG 3.24Å; C35-C67 WeakPolarHBondContact SG-CA 3.35Å; C35-C67 WeakPolarHBondContact SG-CB 3.35Å; C35-C67 CovalentContact SG-SG 2.03Å; C35-C67 PolarHBondContact SG-SG 3.49Å; C67-L69 PolarHBondContact O-N 2.85Å; C67-L69 VanDerWaalsContact O-N 3.16Å; C67-S70 WeakPolarHBondContact O-CB 3.41Å; C67-S70 PolarHBondContact O-N 2.65Å
68	S	62.2	Low	73.7	Confident	130 Å²	130	53.8 Å²	53.8	91%	0.909	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.1	-173.3	-49.7	0	0	0	0	114.2
69	L	60.2	Low	74	Confident	132 Å²	132	54.5 Å²	54.5	69%	0.691	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-0.3	176.5	-61.8	175.9	0	0	0	113.5	C67	C67-L69 PolarHBondContact O-N 2.85Å; C67-L69 VanDerWaalsContact O-N 3.16Å
70	S	57.6	Low	73.7	Confident	51 Å²	51	58.6 Å²	58.6	36%	0.357	33%	0.325	S	S	.	.	S	Bend	trans	-92.3	129.6	177.5	-163.8	0	0	0	0	110.1	C67 Q72	C67-S70 WeakPolarHBondContact O-CB 3.41Å; C67-S70 PolarHBondContact O-N 2.65Å; S70-Q72 PolarHBondContact O-N 2.05Å
71	T	53.7	Low	73.8	Confident	132 Å²	132	61.5 Å²	61.5	81%	0.81	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-47.5	129	160.5	51.7	0	0	0	0	109.1
72	Q	46.8	Very low	74.1	Confident	129 Å²	129	59.6 Å²	59.6	60%	0.603	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-49.1	134.1	-162.3	-71.7	-171.9	7.6	0	0	112.6	S70 K74	S70-Q72 PolarHBondContact O-N 2.05Å; Q72-K74 PolarHBondContact O-N 3.43Å
73	P	55.2	Low	74.4	Confident	11 Å²	11	62.7 Å²	62.7	7%	0.071	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-58.6	126.5	-173.5	23.7	-34.4	0	0	0	109.7	Y64 L66 L75	Y64-P73 HydrophobicContact CD1-CB 3.94Å; Y64-P73 HydrophobicContact CD1-CG 3.93Å; Y64-P73 HydrophobicContact CE1-CB 3.34Å; Y64-P73 HydrophobicContact CE1-CG 3.64Å; L66-P73 HydrophobicContact CD2-CG 4.15Å; L66-P73 HydrophobicContact CG-CG 4.13Å; P73-L75 PolarHBondContact O-N 3.14Å
74	K	66.3	Low	74.8	Confident	117 Å²	117	68 Å²	68	51%	0.509	36%	0.359	S	S	.	.	S	Bend	trans	-58.6	-20.6	-167.5	-65.9	-175.5	174.6	-178.3	0	114.2	V23 P25 Q72	V23-K74 WeakPolarHBondContact O-CD 3.33Å; P25-K74 HydrophobicContact CB-CB 4.15Å; P25-K74 WeakPolarHBondContact CB-O 3.45Å; Q72-K74 PolarHBondContact O-N 3.43Å
75	L	79.1	Confident	75.1	Confident	4 Å²	4	72.1 Å²	72.1	2%	0.021	38%	0.379	C	S	.	.	S	Bend	trans	-65.8	149.7	177.1	-85.4	72.4	0	0	0	112.8	P25 Q29 R51 Y62 P73	P25-L75 WeakPolarHBondContact O-CG 3.46Å; Q29-L75 HydrophobicContact CB-CD1 4.12Å; Q29-L75 HydrophobicContact CG-CD1 3.52Å; R51-L75 HydrophobicContact CB-CB 4.02Å; R51-L75 HydrophobicContact CB-CD2 4.2Å; R51-L75 WeakPolarHBondContact CD-O 3.39Å; R51-L75 HydrophobicContact CG-CB 4.37Å; Y62-L75 HydrophobicContact CE1-CD2 3.4Å; Y62-L75 VanDerWaalsContact CE1-CD2 3.4Å; Y62-L75 VanDerWaalsContact OH-CD2 3.23Å; Y62-L75 WeakPolarHBondContact OH-CD2 3.14Å; P73-L75 PolarHBondContact O-N 3.14Å
76	F	87.6	Confident	75.7	Confident	22 Å²	22	72.2 Å²	72.2	10%	0.096	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-67.7	144	-174.2	-52.6	-73.9	0	0	0	112.7	P25 R51 Y52 E81 C82 H85 C86	P25-F76 HydrophobicContact CB-CE1 4.5Å; P25-F76 HydrophobicContact CB-CE2 3.76Å; P25-F76 HydrophobicContact CB-CZ 3.7Å; P25-F76 HydrophobicContact CG-CE2 4.27Å; P25-F76 HydrophobicContact CG-CZ 3.91Å; P25-F76 WeakPolarHBondContact O-CE2 3.33Å; R51-F76 WeakPolarHBondContact CD-O 3.41Å; Y52-F76 PolarHBondContact N-O 3.01Å; Y52-F76 PolarHBondContact O-N 3.45Å; F76-E81 HydrophobicContact CB-CB 3.95Å; F76-E81 HydrophobicContact CD1-CB 3.68Å; F76-E81 HydrophobicContact CG-CB 4.11Å; F76-C82 HydrophobicContact CB-CB 3.83Å; F76-C82 HydrophobicContact CD2-CB 3.53Å; F76-C82 HydrophobicContact CE2-CB 4.37Å; F76-C82 HydrophobicContact CG-CB 3.78Å; F76-H85 HydrophobicContact CE1-CB 3.53Å; F76-H85 AromaticContact CE1-CD2 3.65Å; F76-H85 AromaticContact CE1-CG 3.71Å; F76-H85 HydrophobicContact CE2-CB 4.36Å; F76-H85 HydrophobicContact CZ-CB 3.4Å; F76-H85 VanDerWaalsContact CZ-CB 3.4Å; F76-C86 WeakPolarHBondContact CE2-SG 3.3Å
77	K	86	Confident	76.4	Confident	109 Å²	109	73.6 Å²	73.6	47%	0.474	39%	0.386	S	S	.	.	S	Bend	trans	-83.9	-26.5	-179.5	-64.6	166.8	-174.4	166.3	0	111.1	Y52 E81	Y52-K77 WeakPolarHBondContact CD2-O 3.2Å; Y52-K77 VanDerWaalsContact CE2-O 3.25Å; Y52-K77 WeakPolarHBondContact CE2-O 3.44Å; K77-E81 PolarHBondContact N-OE2 3.33Å; K77-E81 VanDerWaalsContact N-OE2 3.07Å
78	S	86.1	Confident	76	Confident	40 Å²	40	76.1 Å²	76.1	28%	0.28	40%	0.404	S	S	.	.	S	Bend	trans	-121.6	161.9	-179.8	70.2	0	0	0	0	112.9	Y52 S80 E81	Y52-S78 VanDerWaalsContact CD2-C 3.46Å; S78-S80 VanDerWaalsContact C-N 3.31Å; S78-E81 WeakPolarHBondContact CB-OE2 3.43Å; S78-E81 PolarHBondContact N-OE2 3.2Å; S78-E81 WeakPolarHBondContact OG-CB 3.07Å; S78-E81 VanDerWaalsContact OG-CD 3.25Å; S78-E81 WeakPolarHBondContact OG-CG 3.45Å; S78-E81 PolarHBondContact OG-N 2.76Å; S78-E81 VanDerWaalsContact OG-N 3.13Å; S78-E81 PolarHBondContact OG-OE2 2.63Å
79	R	88.5	Confident	75.5	Confident	71 Å²	71	76.5 Å²	76.5	27%	0.268	40%	0.401	S	S	.	.	H	α-helix	trans	-61.4	-42.7	170.1	-158.2	-168.8	-176.9	158.1	1.7	110.5	Y52 C59 C82 Q83	Y52-R79 HydrophobicContact CD1-CB 3.9Å; Y52-R79 HydrophobicContact CD1-CG 4.15Å; Y52-R79 HydrophobicContact CE1-CB 3.6Å; Y52-R79 HydrophobicContact CE1-CG 4.05Å; C59-R79 HydrophobicContact CB-CG 4.32Å; R79-C82 PolarHBondContact O-N 3.03Å; R79-Q83 HydrophobicContact CG-CG 4.37Å; R79-Q83 VanDerWaalsContact CG-OE1 3.26Å; R79-Q83 WeakPolarHBondContact O-CG 3.48Å; R79-Q83 PolarHBondContact O-N 3.17Å
80	S	86.3	Confident	74.5	Confident	88 Å²	88	76.5 Å²	76.5	62%	0.615	41%	0.406	S	S	*	.	H	α-helix	trans	-67.1	-42.4	-171.8	-48.5	0	0	0	0	113.5	S78 Q83 K84	S78-S80 VanDerWaalsContact C-N 3.31Å; S80-Q83 PolarHBondContact O-N 3.24Å; S80-K84 WeakPolarHBondContact O-CB 3.46Å; S80-K84 PolarHBondContact O-N 2.92Å
81	E	88.1	Confident	73	Confident	74 Å²	74	80.2 Å²	80.2	35%	0.346	43%	0.426	S	S	.	.	H	α-helix	trans	-58.9	-48.7	172.6	-68.6	158.6	129.3	0	0	110.6	F76 K77 S78 Q83 K84 H85	F76-E81 HydrophobicContact CB-CB 3.95Å; F76-E81 HydrophobicContact CD1-CB 3.68Å; F76-E81 HydrophobicContact CG-CB 4.11Å; K77-E81 PolarHBondContact N-OE2 3.33Å; K77-E81 VanDerWaalsContact N-OE2 3.07Å; S78-E81 WeakPolarHBondContact CB-OE2 3.43Å; S78-E81 PolarHBondContact N-OE2 3.2Å; S78-E81 WeakPolarHBondContact OG-CB 3.07Å; S78-E81 VanDerWaalsContact OG-CD 3.25Å; S78-E81 WeakPolarHBondContact OG-CG 3.45Å; S78-E81 PolarHBondContact OG-N 2.76Å; S78-E81 VanDerWaalsContact OG-N 3.13Å; S78-E81 PolarHBondContact OG-OE2 2.63Å; E81-Q83 PolarHBondContact O-N 3.19Å; E81-K84 PolarHBondContact O-N 3.11Å; E81-H85 WeakPolarHBondContact O-CB 3.44Å; E81-H85 PolarHBondContact O-CD2 2.87Å; E81-H85 VanDerWaalsContact O-CD2 3.24Å; E81-H85 PolarHBondContact O-N 3.21Å
82	C	91.4	Very high	71.9	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-59.5	-44.3	176.8	176.8	0	0	0	0	111.7	C59 F76 R79 K84 H85 C86	C59-C82 HydrophobicContact CB-CB 3.69Å; C59-C82 WeakPolarHBondContact CB-SG 3.11Å; C59-C82 WeakPolarHBondContact SG-CB 3.29Å; C59-C82 PolarHBondContact SG-O 3.26Å; C59-C82 VanDerWaalsContact SG-O 3.33Å; C59-C82 CovalentContact SG-SG 2.04Å; C59-C82 PolarHBondContact SG-SG 3.42Å; F76-C82 HydrophobicContact CB-CB 3.83Å; F76-C82 HydrophobicContact CD2-CB 3.53Å; F76-C82 HydrophobicContact CE2-CB 4.37Å; F76-C82 HydrophobicContact CG-CB 3.78Å; R79-C82 PolarHBondContact O-N 3.03Å; C82-K84 VanDerWaalsContact C-N 3.32Å; C82-K84 PolarHBondContact O-N 3.01Å; C82-H85 PolarHBondContact O-N 2.82Å; C82-C86 WeakPolarHBondContact O-CA 3.29Å; C82-C86 WeakPolarHBondContact O-CB 3.5Å; C82-C86 PolarHBondContact O-N 2.81Å
83	Q	88.6	Confident	70.7	Confident	81 Å²	81	82.8 Å²	82.8	38%	0.379	44%	0.438	S	S	.	.	H	α-helix	trans	-63.5	-39.9	179.1	-70	-175.2	-110.2	0	0	111.1	C59 R79 S80 E81 L87 S88	C59-Q83 HydrophobicContact CB-CG 3.91Å; C59-Q83 PolarHBondContact SG-N 3.41Å; R79-Q83 HydrophobicContact CG-CG 4.37Å; R79-Q83 VanDerWaalsContact CG-OE1 3.26Å; R79-Q83 WeakPolarHBondContact O-CG 3.48Å; R79-Q83 PolarHBondContact O-N 3.17Å; S80-Q83 PolarHBondContact O-N 3.24Å; E81-Q83 PolarHBondContact O-N 3.19Å; Q83-L87 HydrophobicContact CB-CD1 4.29Å; Q83-L87 HydrophobicContact CG-CD1 3.88Å; Q83-L87 CarbonylContact O-C 3.5Å; Q83-L87 WeakPolarHBondContact O-CA 3.46Å; Q83-L87 WeakPolarHBondContact O-CB 3.1Å; Q83-L87 PolarHBondContact O-N 2.89Å; Q83-L87 VanDerWaalsContact O-N 3.11Å; Q83-S88 PolarHBondContact O-N 3.35Å
84	K	84.4	Confident	69.2	Low	145 Å²	145	87.3 Å²	87.3	63%	0.63	47%	0.47	S	S	*	.	H	α-helix	trans	-65.2	-47.1	175.3	-170.7	177.5	-178.9	-178.5	0	112.2	S80 E81 C82 S88	S80-K84 WeakPolarHBondContact O-CB 3.46Å; S80-K84 PolarHBondContact O-N 2.92Å; E81-K84 PolarHBondContact O-N 3.11Å; C82-K84 VanDerWaalsContact C-N 3.32Å; C82-K84 PolarHBondContact O-N 3.01Å; K84-S88 WeakPolarHBondContact O-CB 3.16Å; K84-S88 PolarHBondContact O-OG 3.31Å
85	H	86.1	Confident	67.1	Low	124 Å²	124	87.8 Å²	87.8	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-86.5	-20.1	-173	-73.6	-75.3	0	0	0	115.2	F76 E81 C82	F76-H85 HydrophobicContact CE1-CB 3.53Å; F76-H85 AromaticContact CE1-CD2 3.65Å; F76-H85 AromaticContact CE1-CG 3.71Å; F76-H85 HydrophobicContact CE2-CB 4.36Å; F76-H85 HydrophobicContact CZ-CB 3.4Å; F76-H85 VanDerWaalsContact CZ-CB 3.4Å; E81-H85 WeakPolarHBondContact O-CB 3.44Å; E81-H85 PolarHBondContact O-CD2 2.87Å; E81-H85 VanDerWaalsContact O-CD2 3.24Å; E81-H85 PolarHBondContact O-N 3.21Å; C82-H85 PolarHBondContact O-N 2.82Å
86	C	90.1	Very high	64.3	Low	7 Å²	7	95.3 Å²	95.3	5%	0.047	52%	0.52	C	S	.	.	H	α-helix	trans	-117.2	-18.7	-175.6	-53.8	0	0	0	0	114.8	C26 R54 F76 C82	C26-C86 WeakPolarHBondContact CA-SG 3.38Å; C26-C86 HydrophobicContact CB-CB 3.81Å; C26-C86 WeakPolarHBondContact CB-SG 3.49Å; C26-C86 WeakPolarHBondContact SG-CA 3.39Å; C26-C86 WeakPolarHBondContact SG-CB 3.35Å; C26-C86 CovalentContact SG-SG 2.03Å; C26-C86 PolarHBondContact SG-SG 3.24Å; R54-C86 HydrophobicContact CB-CB 3.92Å; R54-C86 WeakPolarHBondContact CD-O 3.44Å; R54-C86 HydrophobicContact CG-CB 4.44Å; R54-C86 PolarHBondContact NH1-O 3.03Å; F76-C86 WeakPolarHBondContact CE2-SG 3.3Å; C82-C86 WeakPolarHBondContact O-CA 3.29Å; C82-C86 WeakPolarHBondContact O-CB 3.5Å; C82-C86 PolarHBondContact O-N 2.81Å
87	L	85.6	Confident	61.2	Low	65 Å²	65	100 Å²	100	34%	0.34	55%	0.551	S	S	.	*	S	Bend	trans	-123.1	8.8	-176.8	-48.2	177.5	0	0	0	113.2	R54 A57 Q83	R54-L87 HydrophobicContact CG-CD2 3.95Å; A57-L87 WeakPolarHBondContact O-CD1 3.27Å; Q83-L87 HydrophobicContact CB-CD1 4.29Å; Q83-L87 HydrophobicContact CG-CD1 3.88Å; Q83-L87 CarbonylContact O-C 3.5Å; Q83-L87 WeakPolarHBondContact O-CA 3.46Å; Q83-L87 WeakPolarHBondContact O-CB 3.1Å; Q83-L87 PolarHBondContact O-N 2.89Å; Q83-L87 VanDerWaalsContact O-N 3.11Å
88	S	66.7	Low	58.2	Low	67 Å²	67	100.5 Å²	100.5	47%	0.469	57%	0.568	S	S	.	*	S	Bend	trans	-114.6	159.5	166.1	87.7	0	0	0	0	110.5	Q83 K84	Q83-S88 PolarHBondContact O-N 3.35Å; K84-S88 WeakPolarHBondContact O-CB 3.16Å; K84-S88 PolarHBondContact O-OG 3.31Å
89	V	51.5	Low	55.1	Low	138 Å²	138	109.8 Å²	109.8	84%	0.836	60%	0.597	S	S	*	*	S	Bend	trans	76.3	136.5	-167.2	-169.3	0	0	0	0	113.8
90	V	38.6	Very low	52.3	Low	131 Å²	131	115 Å²	115	79%	0.794	63%	0.629	S	S	*	*			trans	-104	164.8	-175.9	175.2	0	0	0	0	109.5	T92	V90-T92 PolarHBondContact O-N 2.88Å
91	V	26.2	Very low	49.2	Very low	130 Å²	130	115.1 Å²	115.1	79%	0.788	64%	0.635	S	S	*	*			trans	-51.6	123.5	-177.3	-179	0	0	0	0	114.1
92	T	31.5	Very low	46.3	Very low	133 Å²	133	118.6 Å²	118.6	82%	0.816	66%	0.662	S	S	*	*			trans	-153	154.6	148.6	45.3	0	0	0	0	109.5	V90	V90-T92 PolarHBondContact O-N 2.88Å
93	E	21	Very low	43	Very low	181 Å²	181	121.8 Å²	121.8	85%	0.846	70%	0.695	S	S	*	*			trans	-100.5	-175.9	-168.4	-57	177.3	120.6	0	0	114.6
94	S	24.8	Very low	39.9	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	72%	0.72	S	S	*	*			trans	86.2	94.4	159	73.1	0	0	0	0	121.8
95	T	20.5	Very low	36.9	Very low	127 Å²	127	131 Å²	131	78%	0.779	73%	0.731	S	S	*	*				48.6	146.1	118.5	59.5	0	0	0	0	125.7
96	M	21.2	Very low	33.9	Very low	162 Å²	162	132.4 Å²	132.4	80%	0.798	74%	0.738	S	S	*	*			trans	98.9	105.9	151.4	-69.8	-59.5	175.2	0	0	122.5
97	T	22.8	Very low	30.6	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	77%	0.767	S	S	*	*			trans	42.4	129.1	134.7	59.5	0	0	0	0	123.3
98	S	23.3	Very low	27.6	Very low	119 Å²	119	145.7 Å²	145.7	83%	0.832	79%	0.794	S	S	*	*				175.1	167.5	95.3	-160.5	0	0	0	0	115
99	R	21.1	Very low	25.5	Very low	234 Å²	234	148.3 Å²	148.3	88%	0.883	81%	0.808	S	S	*	*			trans	-75.4	158.7	-168.4	-52.6	162.2	178.7	173.2	-2.2	115.7
100	L	28.1	Very low	24.2	Very low	181 Å²	181	147.5 Å²	147.5	95%	0.948	81%	0.805	S	S	*	*			trans	-163.1	156.8	137.9	-111.7	166.7	0	0	0	111.3
101	A	22.3	Very low	23.4	Very low	90 Å²	90	146.5 Å²	146.5	74%	0.744	80%	0.8	S	S	*	*			trans	-162.8	135.7	-177.2	0	0	0	0	0	114.9
102	T	26	Very low	23.2	Very low	147 Å²	147	146.2 Å²	146.2	90%	0.902	80%	0.799	S	S	*	*			trans	-166.7	159.5	161.3	41.2	0	0	0	0	107.1
103	G	22.8	Very low	22.7	Very low	68 Å²	68	143.9 Å²	143.9	70%	0.701	78%	0.784	S	S	*	*			cis	125	96.7	-15.9	0	0	0	0	0	115
104	E	23.3	Very low	22.7	Very low	193 Å²	193	138.5 Å²	138.5	90%	0.902	77%	0.77	S	S	*	*			trans	-173.7	-177.7	155.9	-113.9	162.8	-156	0	0	115.1
105	W	21.3	Very low	22.6	Very low	225 Å²	225	136.8 Å²	136.8	85%	0.852	76%	0.755	S	S	*	*			trans	-131.2	-167.1	-167.4	-56.6	75.4	0	0	0	111.2
106	Q	23.2	Very low	22.6	Very low	155 Å²	155	137.6 Å²	137.6	72%	0.724	75%	0.75	S	S	*	*			cis	-159.2	169	7	-148.7	160.3	92.5	0	0	113.5
107	T	20.8	Very low	22.7	Very low	109 Å²	109	135.1 Å²	135.1	67%	0.669	75%	0.749	S	S	*	*			trans	-19.6	147.2	168.1	57.4	0	0	0	0	122.1
108	R	22.7	Very low	22.6	Very low	241 Å²	241	133.5 Å²	133.5	91%	0.909	74%	0.743	S	S	*	*				-176.2	161.1	107.3	-101.1	173.9	-175.6	-173.8	1.5	115.1
109	T	23.1	Very low	22.6	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	74%	0.743	S	S	*	*			trans	-121.2	154	169.6	50.8	0	0	0	0	109.6
110	P	23.4	Very low	22.8	Very low	120 Å²	120	127.1 Å²	127.1	78%	0.779	73%	0.733	S	S	*	*				-137.2	172.2	90.8	17.3	6.3	0	0	0	112.8
111	T	21.5	Very low	22.3	Very low	111 Å²	111	128.3 Å²	128.3	68%	0.681	73%	0.731	S	S	*	*			cis	117.7	128.9	9.4	-59.9	0	0	0	0	113.3
112	T	22.4	Very low	22.4	Very low	124 Å²	124	132.9 Å²	132.9	76%	0.761	74%	0.736	S	S	*	*			trans	78.2	114.8	160	43.7	0	0	0	0	124.4
113	V	21.1	Very low	22.2	Very low	84 Å²	84	133 Å²	133	51%	0.509	74%	0.738	S	S	.	*				93	95.2	121.3	174	0	0	0	0	121.5	P1780 P1782	V113-P1780 WeakPolarHBondContact O-CB 3.49Å; V113-P1782 HydrophobicContact CG1-CB 3.96Å; V113-P1782 HydrophobicContact CG1-CG 3.9Å
114	A	21.8	Very low	22.3	Very low	68 Å²	68	132.7 Å²	132.7	56%	0.562	73%	0.734	S	S	*	*				68.9	163.6	123.8	0	0	0	0	0	120.1	P1780 P1782	A114-P1780 WeakPolarHBondContact O-CB 3.23Å; A114-P1782 HydrophobicContact CB-CB 4.42Å
115	T	22	Very low	22.3	Very low	69 Å²	69	130.6 Å²	130.6	42%	0.423	73%	0.727	S	S	.	*			cis	-168.5	179	20.9	-23.6	0	0	0	0	112.6	H1781 P1782	T115-H1781 WeakPolarHBondContact CB-O 3.21Å; T115-H1781 PolarHBondContact OG1-O 2.94Å; T115-P1782 VanDerWaalsContact OG1-CA 3.31Å; T115-P1782 WeakPolarHBondContact OG1-CA 3.11Å
116	Q	21.2	Very low	22.2	Very low	145 Å²	145	130.3 Å²	130.3	68%	0.678	73%	0.727	S	S	*	*			trans	78.9	141.8	145.9	-79.8	178	39.5	0	0	120.6	H1781	Q116-H1781 PolarHBondContact NE2-O 3.43Å
117	S	22.2	Very low	22.2	Very low	110 Å²	110	128 Å²	128	77%	0.769	73%	0.728	S	S	*	*			trans	63.2	147.5	157.5	-73.9	0	0	0	0	119.7
118	S	22	Very low	22.4	Very low	88 Å²	88	129 Å²	129	62%	0.615	74%	0.735	S	S	*	*			cis	-170.4	175.8	-20.7	52	0	0	0	0	108.7
119	T	23	Very low	22.5	Very low	137 Å²	137	124.2 Å²	124.2	84%	0.84	73%	0.727	S	S	*	*			trans	69.2	146.5	170.3	74	0	0	0	0	116.4
120	A	23.7	Very low	22.4	Very low	81 Å²	81	126.7 Å²	126.7	67%	0.669	73%	0.729	S	S	*	*			cis	-143.7	116.3	-11.7	0	0	0	0	0	110.6
121	F	18.7	Very low	22.5	Very low	207 Å²	207	128.9 Å²	128.9	91%	0.908	73%	0.729	S	S	*	*			trans	-158.6	90.6	157.5	-91.4	-65.2	0	0	0	109.9
122	H	23.5	Very low	22.3	Very low	185 Å²	185	129.7 Å²	129.7	86%	0.856	73%	0.733	S	S	*	*			trans	-178.2	104.9	151.7	-108.4	-66.2	0	0	0	111.6
123	T	22.7	Very low	22.3	Very low	151 Å²	151	129.9 Å²	129.9	93%	0.926	74%	0.735	S	S	*	*			trans	176.6	147.1	144.9	29.9	0	0	0	0	107.5
124	G	24.6	Very low	22.2	Very low	60 Å²	60	134.5 Å²	134.5	62%	0.619	75%	0.748	S	S	*	*			trans	107.3	73.5	-165	0	0	0	0	0	111.1
125	I	22.4	Very low	22.3	Very low	149 Å²	149	136.8 Å²	136.8	76%	0.764	76%	0.757	S	S	*	*				75	99.1	85.2	-63.2	166.8	0	0	0	109.2
126	Y	20.9	Very low	22.1	Very low	219 Å²	219	138.1 Å²	138.1	86%	0.859	77%	0.769	S	S	*	*				57.2	135.3	92.6	-61.7	-66.9	0	0	0	112.9
127	S	23.2	Very low	22.2	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	77%	0.771	S	S	*	*			cis	-133.6	-153.5	2.5	-153.5	0	0	0	0	109.3
128	T	25.5	Very low	22.4	Very low	131 Å²	131	138.8 Å²	138.8	80%	0.804	77%	0.768	S	S	*	*			cis	-162.5	157.6	48.6	-65	0	0	0	0	111.7
129	L	23.7	Very low	22.7	Very low	141 Å²	141	145.7 Å²	145.7	74%	0.738	78%	0.781	S	S	*	*			trans	-45.7	157.5	177.6	-148.5	74.1	0	0	0	115.9	H131	L129-H131 PolarHBondContact O-N 2.94Å
130	Q	21	Very low	23	Very low	174 Å²	174	147 Å²	147	81%	0.813	78%	0.775	S	S	*	*			trans	-55	131.5	151.6	-60.5	155.4	-77.1	0	0	109.6
131	H	25.1	Very low	23.2	Very low	167 Å²	167	148.9 Å²	148.9	77%	0.773	78%	0.778	S	S	*	*			trans	-159.1	121.9	131.7	-121.8	-72.5	0	0	0	112	L129	L129-H131 PolarHBondContact O-N 2.94Å
132	V	18.6	Very low	23.5	Very low	127 Å²	127	145.2 Å²	145.2	77%	0.77	76%	0.762	S	S	*	*			trans	-79.1	128.5	157	173.8	0	0	0	0	107
133	T	21	Very low	23.6	Very low	129 Å²	129	143.4 Å²	143.4	79%	0.791	76%	0.757	S	S	*	*				-171.6	144.7	129.5	24.3	0	0	0	0	114.1
134	K	20	Very low	23.7	Very low	181 Å²	181	144.4 Å²	144.4	79%	0.787	75%	0.745	S	S	*	*			trans	-68.7	162.6	157.3	-86.3	170.8	-176.2	166.5	0	109.1
135	P	23.4	Very low	24.1	Very low	116 Å²	116	149.2 Å²	149.2	75%	0.753	75%	0.751	S	S	*	*				-158.1	-165.7	53.7	45.9	-23.7	0	0	0	117.8
136	S	18.9	Very low	24.6	Very low	97 Å²	97	147.4 Å²	147.4	68%	0.678	75%	0.752	S	S	*	*			trans	16.5	137.6	137.4	-135.8	0	0	0	0	118.1
137	T	22.4	Very low	25.3	Very low	117 Å²	117	142 Å²	142	72%	0.718	75%	0.745	S	S	*	*			cis	-149.8	148.3	49.4	32.3	0	0	0	0	116.5
138	E	26.1	Very low	26	Very low	151 Å²	151	144 Å²	144	71%	0.706	75%	0.748	S	S	*	*			trans	43.7	129.4	137.8	-56.8	-171.3	142.8	0	0	122.5
139	R	29.4	Very low	27.2	Very low	234 Å²	234	141.1 Å²	141.1	88%	0.883	74%	0.744	S	S	*	*				-142	91.1	104.5	-143.3	162.8	-75.7	-156.6	0.7	114.7
140	K	27.9	Very low	28.8	Very low	163 Å²	163	144.4 Å²	144.4	71%	0.709	75%	0.753	S	S	*	*			trans	68.4	112.3	144.4	-66.2	-176.8	177.8	-178.7	0	122
141	T	27.4	Very low	31.4	Very low	122 Å²	122	141.4 Å²	141.4	75%	0.748	74%	0.737	S	S	*	*				48.3	150.6	122.9	17.9	0	0	0	0	121.6
142	K	26.5	Very low	34.2	Very low	130 Å²	130	134.8 Å²	134.8	57%	0.565	71%	0.71	S	S	*	*			cis	-160.8	176.4	26.7	-156.4	172.4	-177.1	175.6	0	112.2
143	I	24.2	Very low	37.5	Very low	147 Å²	147	134.2 Å²	134.2	75%	0.754	70%	0.697	S	S	*	*			trans	89.2	135.5	163.8	-54.7	162.4	0	0	0	115.9
144	Y	25.7	Very low	40.9	Very low	172 Å²	172	128.1 Å²	128.1	68%	0.675	66%	0.659	S	S	*	*			cis	-162.2	-174.9	-28.6	-117.7	-79.5	0	0	0	109.2
145	H	33.1	Very low	44.3	Very low	161 Å²	161	122.4 Å²	122.4	75%	0.745	64%	0.635	S	S	*	*			trans	-123	160	-173.3	-80.2	-121	0	0	0	115.9
146	S	31.9	Very low	47.3	Very low	111 Å²	111	121.4 Å²	121.4	78%	0.776	62%	0.623	S	S	*	*			trans	-156.4	126.2	152.6	-91.4	0	0	0	0	107.1
147	S	35.5	Very low	50.5	Low	104 Å²	104	120.5 Å²	120.5	73%	0.727	61%	0.608	S	S	*	*				90.5	146.8	63	80	0	0	0	0	113.3
148	D	38.5	Very low	53.5	Low	150 Å²	150	119.1 Å²	119.1	80%	0.802	59%	0.59	S	S	*	*			trans	-72.7	143.9	-158.7	-54	-93.5	0	0	0	115.4
149	G	50.5	Low	56.3	Low	70 Å²	70	112.9 Å²	112.9	72%	0.722	56%	0.564	S	S	*	*			trans	172.6	151.3	175.7	0	0	0	0	0	113.8	K151	G149-K151 PolarHBondContact O-N 2.86Å
150	K	58.5	Low	58.7	Low	210 Å²	210	108.1 Å²	108.1	91%	0.913	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-67.8	119.4	173.3	-70.2	-178.4	-179.9	178.7	0	109.3	S152	K150-S152 PolarHBondContact O-N 3.34Å
151	K	74.3	Confident	61	Low	110 Å²	110	102 Å²	102	48%	0.478	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-61.3	131.2	176.7	-67.8	-179.6	-178.4	176	0	111	G149 Q155 L156 A159	G149-K151 PolarHBondContact O-N 2.86Å; K151-Q155 HydrophobicContact CB-CB 3.98Å; K151-Q155 HydrophobicContact CG-CB 4.32Å; K151-L156 HydrophobicContact CB-CD2 3.81Å; K151-L156 HydrophobicContact CB-CG 3.77Å; K151-L156 HydrophobicContact CD-CD2 4.01Å; K151-A159 HydrophobicContact CD-CB 4.41Å
152	S	84.5	Confident	63.5	Low	29 Å²	29	99.2 Å²	99.2	20%	0.203	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-68.3	172	170.9	73.3	0	0	0	0	113	K150 C154 Q155 L156 G187	K150-S152 PolarHBondContact O-N 3.34Å; S152-C154 VanDerWaalsContact C-N 3.33Å; S152-C154 PolarHBondContact O-N 2.96Å; S152-C154 PolarHBondContact OG-N 2.76Å; S152-Q155 PolarHBondContact O-N 3.21Å; S152-Q155 VanDerWaalsContact O-N 3.16Å; S152-Q155 WeakPolarHBondContact OG-CB 2.99Å; S152-Q155 VanDerWaalsContact OG-CG 3.29Å; S152-Q155 WeakPolarHBondContact OG-CG 3.49Å; S152-Q155 PolarHBondContact OG-N 3.31Å; S152-Q155 PolarHBondContact OG-OE1 3.24Å; S152-L156 WeakPolarHBondContact O-CB 3.23Å; S152-L156 VanDerWaalsContact O-CG 3.29Å; S152-L156 WeakPolarHBondContact O-CG 3.17Å; S152-L156 PolarHBondContact O-N 2.97Å; S152-G187 WeakPolarHBondContact CB-O 3.26Å; S152-G187 VanDerWaalsContact OG-C 3.24Å; S152-G187 VanDerWaalsContact OG-CA 3.23Å; S152-G187 WeakPolarHBondContact OG-CA 3.39Å; S152-G187 PolarHBondContact OG-O 3.45Å
153	K	88.7	Confident	65.7	Low	115 Å²	115	99.8 Å²	99.8	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-51.1	-48.3	172.7	-171.2	-169.9	169.3	-169.8	0	112.4	Q157 Y189 E207	K153-Q157 WeakPolarHBondContact O-CG 3.41Å; K153-Q157 PolarHBondContact O-N 3.02Å; K153-Q157 VanDerWaalsContact O-N 3.17Å; K153-Y189 HydrophobicContact CD-CE2 4.12Å; K153-Y189 WeakPolarHBondContact CD-OH 3.43Å; K153-Y189 WeakPolarHBondContact CE-OH 3.32Å; K153-Y189 HydrophobicContact CG-CE2 4.48Å; K153-Y189 WeakPolarHBondContact CG-OH 3.31Å; K153-E207 PolarHBondContact NZ-O 2.82Å
154	C	91.8	Very high	67.7	Low	1 Å²	1	95.8 Å²	95.8	1%	0.007	50%	0.502	C	S	.	.	H	α-helix	trans	-65.6	-45.8	176.9	-176.3	0	0	0	0	111.9	S152 L156 Q157 R158 E182 C183 G187 Y189	S152-C154 VanDerWaalsContact C-N 3.33Å; S152-C154 PolarHBondContact O-N 2.96Å; S152-C154 PolarHBondContact OG-N 2.76Å; C154-L156 VanDerWaalsContact C-N 3.29Å; C154-L156 PolarHBondContact O-N 2.82Å; C154-Q157 PolarHBondContact O-N 3.44Å; C154-R158 VanDerWaalsContact O-CB 3.24Å; C154-R158 WeakPolarHBondContact O-CB 3.44Å; C154-R158 PolarHBondContact O-N 3.13Å; C154-E182 PolarHBondContact SG-O 3.24Å; C154-E182 VanDerWaalsContact SG-O 3.42Å; C154-C183 HydrophobicContact CB-CB 3.87Å; C154-C183 WeakPolarHBondContact CB-SG 3Å; C154-C183 PolarHBondContact O-SG 2.81Å; C154-C183 VanDerWaalsContact O-SG 3.41Å; C154-C183 WeakPolarHBondContact SG-CA 3.25Å; C154-C183 WeakPolarHBondContact SG-CB 3.39Å; C154-C183 CovalentContact SG-SG 2.04Å; C154-C183 PolarHBondContact SG-SG 3.26Å; C154-G187 WeakPolarHBondContact CB-O 3.41Å; C154-Y189 HydrophobicContact CB-CD1 3.73Å; C154-Y189 HydrophobicContact CB-CD2 4.09Å; C154-Y189 HydrophobicContact CB-CE1 3.63Å; C154-Y189 HydrophobicContact CB-CE2 3.99Å; C154-Y189 HydrophobicContact CB-CG 3.97Å; C154-Y189 WeakPolarHBondContact SG-CD1 3.46Å
155	Q	90.2	Very high	69.4	Low	60 Å²	60	89.1 Å²	89.1	28%	0.28	48%	0.48	S	S	.	.	H	α-helix	trans	-67.5	-27.5	-178.7	-69.1	167.1	-13.8	0	0	113	K151 S152 A159 C183 G187	K151-Q155 HydrophobicContact CB-CB 3.98Å; K151-Q155 HydrophobicContact CG-CB 4.32Å; S152-Q155 PolarHBondContact O-N 3.21Å; S152-Q155 VanDerWaalsContact O-N 3.16Å; S152-Q155 WeakPolarHBondContact OG-CB 2.99Å; S152-Q155 VanDerWaalsContact OG-CG 3.29Å; S152-Q155 WeakPolarHBondContact OG-CG 3.49Å; S152-Q155 PolarHBondContact OG-N 3.31Å; S152-Q155 PolarHBondContact OG-OE1 3.24Å; Q155-A159 WeakPolarHBondContact O-CB 3.34Å; Q155-A159 PolarHBondContact O-N 2.72Å; Q155-A159 VanDerWaalsContact O-N 3.1Å; Q155-C183 HydrophobicContact CG-CB 4.32Å; Q155-G187 VanDerWaalsContact NE2-CA 3.3Å
156	L	86.7	Confident	70.5	Confident	96 Å²	96	90.8 Å²	90.8	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-57.1	170.5	-73.9	167.4	0	0	0	110.6	K151 S152 C154 R158 A159 E160	K151-L156 HydrophobicContact CB-CD2 3.81Å; K151-L156 HydrophobicContact CB-CG 3.77Å; K151-L156 HydrophobicContact CD-CD2 4.01Å; S152-L156 WeakPolarHBondContact O-CB 3.23Å; S152-L156 VanDerWaalsContact O-CG 3.29Å; S152-L156 WeakPolarHBondContact O-CG 3.17Å; S152-L156 PolarHBondContact O-N 2.97Å; C154-L156 VanDerWaalsContact C-N 3.29Å; C154-L156 PolarHBondContact O-N 2.82Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 3.19Å; L156-A159 WeakPolarHBondContact O-CB 3.44Å; L156-A159 PolarHBondContact O-N 2.88Å; L156-E160 PolarHBondContact O-N 3.28Å
157	Q	87.1	Confident	71.2	Confident	77 Å²	77	90.3 Å²	90.3	36%	0.36	48%	0.477	S	S	.	.	H	α-helix	trans	-57	-43.9	177.9	-70.9	179.7	-26.9	0	0	112.2	K153 C154 A159 E160 V161 P181 Y189	K153-Q157 WeakPolarHBondContact O-CG 3.41Å; K153-Q157 PolarHBondContact O-N 3.02Å; K153-Q157 VanDerWaalsContact O-N 3.17Å; C154-Q157 PolarHBondContact O-N 3.44Å; Q157-A159 VanDerWaalsContact C-N 3.31Å; Q157-A159 PolarHBondContact O-N 3.34Å; Q157-E160 PolarHBondContact O-N 2.97Å; Q157-V161 WeakPolarHBondContact O-CG2 3.02Å; Q157-V161 PolarHBondContact O-N 3.44Å; Q157-V161 VanDerWaalsContact O-N 3.17Å; Q157-P181 HydrophobicContact CB-CG 3.88Å; Q157-Y189 PolarHBondContact OE1-OH 3.44Å
158	R	85.7	Confident	72	Confident	89 Å²	89	92.4 Å²	92.4	34%	0.336	48%	0.479	S	S	.	.	H	α-helix	trans	-60.4	-39.8	175.5	-169.5	176.5	-176.8	84.9	-2.7	111.5	C154 L156 L162 V180 P181	C154-R158 VanDerWaalsContact O-CB 3.24Å; C154-R158 WeakPolarHBondContact O-CB 3.44Å; C154-R158 PolarHBondContact O-N 3.13Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 3.19Å; R158-L162 HydrophobicContact CG-CD1 4.07Å; R158-L162 VanDerWaalsContact O-CB 3.3Å; R158-L162 WeakPolarHBondContact O-CB 3.42Å; R158-L162 WeakPolarHBondContact O-CD1 3.19Å; R158-L162 WeakPolarHBondContact O-CG 3.26Å; R158-L162 PolarHBondContact O-N 2.79Å; R158-V180 HydrophobicContact CG-CG1 3.73Å; R158-V180 PolarHBondContact NH1-O 2.62Å; R158-P181 HydrophobicContact CB-CG 4.34Å; R158-P181 VanDerWaalsContact CD-O 3.27Å; R158-P181 WeakPolarHBondContact CD-O 3.36Å; R158-P181 WeakPolarHBondContact CG-O 3.32Å; R158-P181 PolarHBondContact NH1-O 3.07Å
159	A	83.5	Confident	71.8	Confident	19 Å²	19	92.2 Å²	92.2	16%	0.157	48%	0.478	C	S	.	.	H	α-helix	trans	-71.8	-37.8	177.7	0	0	0	0	0	112.9	K151 Q155 L156 Q157 L162 Q163	K151-A159 HydrophobicContact CD-CB 4.41Å; Q155-A159 WeakPolarHBondContact O-CB 3.34Å; Q155-A159 PolarHBondContact O-N 2.72Å; Q155-A159 VanDerWaalsContact O-N 3.1Å; L156-A159 WeakPolarHBondContact O-CB 3.44Å; L156-A159 PolarHBondContact O-N 2.88Å; Q157-A159 VanDerWaalsContact C-N 3.31Å; Q157-A159 PolarHBondContact O-N 3.34Å; A159-L162 CarbonylContact O-C 3.57Å; A159-L162 PolarHBondContact O-N 2.92Å; A159-Q163 WeakPolarHBondContact O-CB 3.49Å; A159-Q163 WeakPolarHBondContact O-CG 2.93Å; A159-Q163 PolarHBondContact O-N 3.08Å
160	E	80.6	Confident	71.2	Confident	134 Å²	134	90.9 Å²	90.9	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-61.9	-53.2	179.6	-175.8	177.6	-173.1	0	0	111.5	L156 Q157 L162 Q163 A164	L156-E160 PolarHBondContact O-N 3.28Å; Q157-E160 PolarHBondContact O-N 2.97Å; E160-L162 VanDerWaalsContact C-N 3.28Å; E160-L162 PolarHBondContact O-N 3.21Å; E160-Q163 PolarHBondContact O-N 3.11Å; E160-A164 PolarHBondContact O-N 3.43Å
161	V	76.8	Confident	70.3	Confident	34 Å²	34	85 Å²	85	21%	0.206	45%	0.45	C	S	.	.	H	α-helix	trans	-62.9	-36.3	177.3	-175.1	0	0	0	0	111.3	Q157 I175 A178 V180	Q157-V161 WeakPolarHBondContact O-CG2 3.02Å; Q157-V161 PolarHBondContact O-N 3.44Å; Q157-V161 VanDerWaalsContact O-N 3.17Å; V161-I175 HydrophobicContact CG1-CG2 4.28Å; V161-A178 HydrophobicContact CG1-CB 3.71Å; V161-V180 HydrophobicContact CB-CG2 4.25Å; V161-V180 HydrophobicContact CG1-CG2 3.65Å
162	L	79.4	Confident	68.6	Low	65 Å²	65	89.4 Å²	89.4	34%	0.34	47%	0.469	S	S	.	.	H	α-helix	trans	-72	-24.3	174.7	-71.5	174.5	0	0	0	113.7	R158 A159 E160 S165 V180	R158-L162 HydrophobicContact CG-CD1 4.07Å; R158-L162 VanDerWaalsContact O-CB 3.3Å; R158-L162 WeakPolarHBondContact O-CB 3.42Å; R158-L162 WeakPolarHBondContact O-CD1 3.19Å; R158-L162 WeakPolarHBondContact O-CG 3.26Å; R158-L162 PolarHBondContact O-N 2.79Å; A159-L162 CarbonylContact O-C 3.57Å; A159-L162 PolarHBondContact O-N 2.92Å; E160-L162 VanDerWaalsContact C-N 3.28Å; E160-L162 PolarHBondContact O-N 3.21Å; L162-S165 PolarHBondContact O-OG 2.76Å; L162-V180 HydrophobicContact CD1-CG1 4.38Å; L162-V180 HydrophobicContact CD2-CG1 4.28Å; L162-V180 HydrophobicContact CG-CG1 4.09Å
163	Q	73.1	Confident	66.4	Low	141 Å²	141	93.1 Å²	93.1	66%	0.659	49%	0.49	S	S	*	.	H	α-helix	trans	-79.2	-42.6	174.8	-81.5	178.8	-44.7	0	0	111.8	A159 E160 S165 R166	A159-Q163 WeakPolarHBondContact O-CB 3.49Å; A159-Q163 WeakPolarHBondContact O-CG 2.93Å; A159-Q163 PolarHBondContact O-N 3.08Å; E160-Q163 PolarHBondContact O-N 3.11Å; Q163-S165 PolarHBondContact O-N 3.11Å; Q163-R166 PolarHBondContact O-N 2.03Å
164	A	65.6	Low	64.2	Low	63 Å²	63	89.7 Å²	89.7	52%	0.521	48%	0.481	S	S	.	.	H	α-helix	trans	-54.4	-25.6	174.2	0	0	0	0	0	113.1	E160 R166	E160-A164 PolarHBondContact O-N 3.43Å; A164-R166 PolarHBondContact O-N 3.32Å
165	S	61.2	Low	62	Low	32 Å²	32	92.8 Å²	92.8	22%	0.224	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-19.2	-178.5	78.5	0	0	0	0	117.2	L162 Q163 I175	L162-S165 PolarHBondContact O-OG 2.76Å; Q163-S165 PolarHBondContact O-N 3.11Å; S165-I175 VanDerWaalsContact CB-CG2 3.48Å
166	R	56	Low	60	Low	196 Å²	196	96.3 Å²	96.3	74%	0.74	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-0.7	-159.1	-62.3	-168.1	177.5	-176.5	-2.7	116.4	Q163 A164	Q163-R166 PolarHBondContact O-N 2.03Å; A164-R166 PolarHBondContact O-N 3.32Å
167	S	47.8	Very low	58.2	Low	102 Å²	102	96.5 Å²	96.5	71%	0.713	52%	0.522	S	S	*	.			trans	-72.9	138.5	172.4	-163.1	0	0	0	0	110.8
168	L	51.5	Low	56.9	Low	148 Å²	148	94.2 Å²	94.2	78%	0.775	52%	0.517	S	S	*	.			trans	-111.6	-16.7	-162.5	-113.2	162.3	0	0	0	115.2
169	N	35.3	Very low	56.7	Low	146 Å²	146	93.3 Å²	93.3	78%	0.781	52%	0.515	S	S	*	.	S	Bend	trans	-128.9	150.1	168.8	-82.6	-15.4	0	0	0	108.8
170	G	37.3	Very low	56.8	Low	42 Å²	42	93.7 Å²	93.7	43%	0.433	52%	0.516	S	S	.	.	S	Bend	trans	84.8	155.6	-170.4	0	0	0	0	0	113.2	K172	G170-K172 PolarHBondContact O-N 3.45Å
171	S	39.1	Very low	57.2	Low	86 Å²	86	87.6 Å²	87.6	60%	0.601	49%	0.487	S	S	*	.			trans	-21.2	109.7	-174.9	-50.6	0	0	0	0	116.6	V173 H1509	S171-V173 VanDerWaalsContact C-N 3.34Å; S171-V173 PolarHBondContact O-N 3.18Å; S171-H1509 PolarHBondContact OG-CE1 2.74Å; S171-H1509 VanDerWaalsContact OG-CE1 3.3Å; S171-H1509 PolarHBondContact OG-NE2 3.28Å
172	K	38.3	Very low	57.7	Low	203 Å²	203	88.7 Å²	88.7	88%	0.883	49%	0.49	S	S	*	.			trans	-65.5	87.6	172.3	-74.3	-174.3	177	179.7	0	111.6	G170 S174	G170-K172 PolarHBondContact O-N 3.45Å; K172-S174 VanDerWaalsContact C-N 3.35Å; K172-S174 PolarHBondContact O-N 2.93Å
173	V	38.7	Very low	58.2	Low	107 Å²	107	86.9 Å²	86.9	65%	0.648	48%	0.483	S	S	*	.			trans	-61.1	101.7	153.8	177.8	0	0	0	0	106.2	S171 I175	S171-V173 VanDerWaalsContact C-N 3.34Å; S171-V173 PolarHBondContact O-N 3.18Å; V173-I175 PolarHBondContact O-N 2.56Å
174	S	42.5	Very low	58.9	Low	43 Å²	43	82.4 Å²	82.4	30%	0.301	46%	0.463	S	S	.	.			trans	-76.9	118.9	-173.5	-160.6	0	0	0	0	110.1	K172 Q176 S177	K172-S174 VanDerWaalsContact C-N 3.35Å; K172-S174 PolarHBondContact O-N 2.93Å; S174-Q176 PolarHBondContact O-N 3.42Å; S174-Q176 VanDerWaalsContact O-N 3.1Å; S174-Q176 VanDerWaalsContact OG-CB 3.28Å; S174-Q176 WeakPolarHBondContact OG-CB 3.4Å; S174-Q176 PolarHBondContact OG-N 3.01Å; S174-S177 PolarHBondContact O-N 3.45Å; S174-S177 VanDerWaalsContact O-N 3.08Å; S174-S177 PolarHBondContact O-OG 3.42Å
175	I	46.8	Very low	59.4	Low	66 Å²	66	83.4 Å²	83.4	34%	0.338	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-53.9	-22.9	160	19.8	164.3	0	0	0	111.8	V161 S165 V173 S177 A178 F197	V161-I175 HydrophobicContact CG1-CG2 4.28Å; S165-I175 VanDerWaalsContact CB-CG2 3.48Å; V173-I175 PolarHBondContact O-N 2.56Å; I175-S177 PolarHBondContact O-N 3.37Å; I175-A178 PolarHBondContact O-N 2.81Å; I175-A178 VanDerWaalsContact O-N 3.12Å; I175-F197 WeakPolarHBondContact O-CE2 3.18Å
176	Q	47.4	Very low	60.3	Low	134 Å²	134	86.4 Å²	86.4	63%	0.626	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-72.5	10.2	176.9	-47.5	-178.6	-38.5	0	0	114	S174 F197	S174-Q176 PolarHBondContact O-N 3.42Å; S174-Q176 VanDerWaalsContact O-N 3.1Å; S174-Q176 VanDerWaalsContact OG-CB 3.28Å; S174-Q176 WeakPolarHBondContact OG-CB 3.4Å; S174-Q176 PolarHBondContact OG-N 3.01Å; Q176-F197 HydrophobicContact CB-CD1 4.13Å; Q176-F197 HydrophobicContact CB-CE1 3.77Å; Q176-F197 HydrophobicContact CB-CZ 4.18Å; Q176-F197 HydrophobicContact CG-CE1 4.1Å; Q176-F197 HydrophobicContact CG-CZ 4.35Å; Q176-F197 WeakPolarHBondContact O-CD1 3.41Å; Q176-F197 WeakPolarHBondContact O-CG 3.41Å
177	S	48.2	Very low	61.7	Low	99 Å²	99	77.2 Å²	77.2	69%	0.692	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-142.4	17.5	168.4	58.4	0	0	0	0	112.5	S174 I175	S174-S177 PolarHBondContact O-N 3.45Å; S174-S177 VanDerWaalsContact O-N 3.08Å; S174-S177 PolarHBondContact O-OG 3.42Å; I175-S177 PolarHBondContact O-N 3.37Å
178	A	60.3	Low	63.6	Low	30 Å²	30	78 Å²	78	25%	0.248	45%	0.447	C	S	.	.	S	Bend	trans	-123.5	114.7	179.8	0	0	0	0	0	110.1	V161 I175 V180	V161-A178 HydrophobicContact CG1-CB 3.71Å; I175-A178 PolarHBondContact O-N 2.81Å; I175-A178 VanDerWaalsContact O-N 3.12Å; A178-V180 PolarHBondContact O-N 2.99Å
179	F	81.9	Confident	65.5	Low	70 Å²	70	71.8 Å²	71.8	31%	0.307	41%	0.413	S	S	.	.			trans	-62.2	128.5	-179.6	167.3	-110.7	0	0	0	111.6	P181 Q193 D195 W202	F179-P181 HydrophobicContact CE1-CB 3.84Å; F179-P181 HydrophobicContact CZ-CB 4.01Å; F179-Q193 HydrophobicContact CE2-CB 4.4Å; F179-Q193 HydrophobicContact CZ-CB 3.96Å; F179-Q193 HydrophobicContact CZ-CG 4.23Å; F179-D195 HydrophobicContact CD2-CB 3.86Å; F179-D195 HydrophobicContact CE2-CB 4.49Å; F179-W202 AromaticContact CD2-CH2 3.81Å; F179-W202 HydrophobicContact CD2-CH2 3.81Å; F179-W202 HydrophobicContact CD2-CZ2 4.37Å; F179-W202 HydrophobicContact CE1-CH2 4.44Å; F179-W202 HydrophobicContact CE1-CZ2 4.07Å; F179-W202 AromaticContact CE2-CH2 3.54Å; F179-W202 HydrophobicContact CE2-CH2 3.54Å; F179-W202 AromaticContact CE2-CZ2 3.81Å; F179-W202 HydrophobicContact CE2-CZ2 3.81Å; F179-W202 HydrophobicContact CG-CH2 4.36Å; F179-W202 AromaticContact CZ-CH2 3.88Å; F179-W202 HydrophobicContact CZ-CH2 3.88Å; F179-W202 AromaticContact CZ-CZ2 3.64Å; F179-W202 HydrophobicContact CZ-CZ2 3.64Å
180	V	84.3	Confident	68.2	Low	27 Å²	27	67.6 Å²	67.6	16%	0.164	39%	0.389	C	S	.	.			trans	-110.8	100.3	-179.1	-178.7	0	0	0	0	108.7	R158 V161 L162 A178 E182	R158-V180 HydrophobicContact CG-CG1 3.73Å; R158-V180 PolarHBondContact NH1-O 2.62Å; V161-V180 HydrophobicContact CB-CG2 4.25Å; V161-V180 HydrophobicContact CG1-CG2 3.65Å; L162-V180 HydrophobicContact CD1-CG1 4.38Å; L162-V180 HydrophobicContact CD2-CG1 4.28Å; L162-V180 HydrophobicContact CG-CG1 4.09Å; A178-V180 PolarHBondContact O-N 2.99Å; V180-E182 PolarHBondContact O-N 2.02Å
181	P	89.2	Confident	70.6	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.032	39%	0.388	C	S	.	.			trans	-61.7	135.9	-170.7	22.4	-32.9	0	0	0	112.7	Q157 R158 F179 Y189 Q193	Q157-P181 HydrophobicContact CB-CG 3.88Å; R158-P181 HydrophobicContact CB-CG 4.34Å; R158-P181 VanDerWaalsContact CD-O 3.27Å; R158-P181 WeakPolarHBondContact CD-O 3.36Å; R158-P181 WeakPolarHBondContact CG-O 3.32Å; R158-P181 PolarHBondContact NH1-O 3.07Å; F179-P181 HydrophobicContact CE1-CB 3.84Å; F179-P181 HydrophobicContact CZ-CB 4.01Å; P181-Y189 HydrophobicContact CB-CD1 4.24Å; P181-Y189 HydrophobicContact CB-CE1 4.07Å; P181-Q193 VanDerWaalsContact CA-OE1 3.26Å
182	E	87.8	Confident	73.2	Confident	57 Å²	57	65.4 Å²	65.4	27%	0.266	37%	0.365	S	S	.	.			trans	-79.6	130	174.9	-67.6	-164	164.2	0	0	110	C154 V180 Q190 Q193 R221	C154-E182 PolarHBondContact SG-O 3.24Å; C154-E182 VanDerWaalsContact SG-O 3.42Å; V180-E182 PolarHBondContact O-N 2.02Å; E182-Q190 HydrophobicContact CB-CB 3.68Å; E182-Q190 HydrophobicContact CB-CG 4.25Å; E182-Q190 WeakPolarHBondContact O-CB 3.47Å; E182-Q190 PolarHBondContact O-N 2.92Å; E182-Q193 PolarHBondContact O-NE2 3.08Å; E182-R221 IonicContact OE1-NH2 2.71Å; E182-R221 IonicContact OE2-CZ 2.7Å; E182-R221 IonicContact OE2-NH2 2.66Å; E182-R221 PolarHBondContact OE2-NH2 3.22Å
183	C	90.4	Very high	75.8	Confident	28 Å²	28	55.8 Å²	55.8	19%	0.189	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-119.1	138.4	-178.6	-42.5	0	0	0	0	110	C154 Q155 R188	C154-C183 HydrophobicContact CB-CB 3.87Å; C154-C183 WeakPolarHBondContact CB-SG 3Å; C154-C183 PolarHBondContact O-SG 2.81Å; C154-C183 VanDerWaalsContact O-SG 3.41Å; C154-C183 WeakPolarHBondContact SG-CA 3.25Å; C154-C183 WeakPolarHBondContact SG-CB 3.39Å; C154-C183 CovalentContact SG-SG 2.04Å; C154-C183 PolarHBondContact SG-SG 3.26Å; Q155-C183 HydrophobicContact CG-CB 4.32Å; C183-R188 CarbonylContact C-O 3.5Å; C183-R188 WeakPolarHBondContact CA-O 3.49Å
184	L	86.7	Confident	78.2	Confident	46 Å²	46	51.4 Å²	51.4	24%	0.241	30%	0.297	C	S	.	.			trans	-61.4	162.4	164.7	-65.4	174.9	0	0	0	110.2	D186 G187 R188	L184-D186 VanDerWaalsContact CB-OD1 3.3Å; L184-D186 WeakPolarHBondContact CB-OD1 3.39Å; L184-D186 PolarHBondContact O-N 3.36Å; L184-G187 WeakPolarHBondContact O-CA 3.29Å; L184-G187 PolarHBondContact O-N 3.35Å; L184-R188 HydrophobicContact CD1-CB 4.29Å; L184-R188 PolarHBondContact N-O 2.77Å
185	G	77.1	Confident	80.2	Confident	85 Å²	85	50.5 Å²	50.5	88%	0.876	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.7	-179.7	0	0	0	0	0	114.3	G187	G185-G187 VanDerWaalsContact C-N 3.26Å; G185-G187 PolarHBondContact O-N 2.85Å
186	D	80.3	Confident	81.5	Confident	94 Å²	94	51.1 Å²	51.1	50%	0.503	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.1	172.7	65.9	7.4	0	0	0	113.6	L184 R188	L184-D186 VanDerWaalsContact CB-OD1 3.3Å; L184-D186 WeakPolarHBondContact CB-OD1 3.39Å; L184-D186 PolarHBondContact O-N 3.36Å; D186-R188 WeakPolarHBondContact OD1-CB 3.22Å; D186-R188 PolarHBondContact OD1-N 2.91Å; D186-R188 IonicContact OD1-NE 2.69Å; D186-R188 IonicContact OD2-CZ 2.7Å; D186-R188 IonicContact OD2-NE 3.56Å; D186-R188 PolarHBondContact OD2-NE 2.96Å; D186-R188 IonicContact OD2-NH2 2.67Å; D186-R188 PolarHBondContact OD2-NH2 2.95Å
187	G	84.4	Confident	82.7	Confident	3 Å²	3	47.8 Å²	47.8	3%	0.031	28%	0.281	C	S	.	.	S	Bend	trans	88	-0.5	-179.2	0	0	0	0	0	115.8	S152 C154 Q155 L184 G185	S152-G187 WeakPolarHBondContact CB-O 3.26Å; S152-G187 VanDerWaalsContact OG-C 3.24Å; S152-G187 VanDerWaalsContact OG-CA 3.23Å; S152-G187 WeakPolarHBondContact OG-CA 3.39Å; S152-G187 PolarHBondContact OG-O 3.45Å; C154-G187 WeakPolarHBondContact CB-O 3.41Å; Q155-G187 VanDerWaalsContact NE2-CA 3.3Å; L184-G187 WeakPolarHBondContact O-CA 3.29Å; L184-G187 PolarHBondContact O-N 3.35Å; G185-G187 VanDerWaalsContact C-N 3.26Å; G185-G187 PolarHBondContact O-N 2.85Å
188	R	88	Confident	84	Confident	119 Å²	119	45.3 Å²	45.3	45%	0.449	26%	0.263	S	S	.	.	S	Bend	trans	-66.9	162.5	165.2	-69	-179.1	-64.3	143.2	6.4	109.9	C183 L184 D186	C183-R188 CarbonylContact C-O 3.5Å; C183-R188 WeakPolarHBondContact CA-O 3.49Å; L184-R188 HydrophobicContact CD1-CB 4.29Å; L184-R188 PolarHBondContact N-O 2.77Å; D186-R188 WeakPolarHBondContact OD1-CB 3.22Å; D186-R188 PolarHBondContact OD1-N 2.91Å; D186-R188 IonicContact OD1-NE 2.69Å; D186-R188 IonicContact OD2-CZ 2.7Å; D186-R188 IonicContact OD2-NE 3.56Å; D186-R188 PolarHBondContact OD2-NE 2.96Å; D186-R188 IonicContact OD2-NH2 2.67Å; D186-R188 PolarHBondContact OD2-NH2 2.95Å
189	Y	92.6	Very high	84.8	Confident	17 Å²	17	46.3 Å²	46.3	7%	0.067	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-66	143.1	173.5	-65.1	-93.7	0	0	0	110.2	K153 C154 Q157 P181 Q206 E207 G208	K153-Y189 HydrophobicContact CD-CE2 4.12Å; K153-Y189 WeakPolarHBondContact CD-OH 3.43Å; K153-Y189 WeakPolarHBondContact CE-OH 3.32Å; K153-Y189 HydrophobicContact CG-CE2 4.48Å; K153-Y189 WeakPolarHBondContact CG-OH 3.31Å; C154-Y189 HydrophobicContact CB-CD1 3.73Å; C154-Y189 HydrophobicContact CB-CD2 4.09Å; C154-Y189 HydrophobicContact CB-CE1 3.63Å; C154-Y189 HydrophobicContact CB-CE2 3.99Å; C154-Y189 HydrophobicContact CB-CG 3.97Å; C154-Y189 WeakPolarHBondContact SG-CD1 3.46Å; Q157-Y189 PolarHBondContact OE1-OH 3.44Å; P181-Y189 HydrophobicContact CB-CD1 4.24Å; P181-Y189 HydrophobicContact CB-CE1 4.07Å; Y189-Q206 WeakPolarHBondContact CD2-O 3.23Å; Y189-E207 VanDerWaalsContact CE2-C 3.49Å; Y189-E207 VanDerWaalsContact CE2-O 3.23Å; Y189-E207 WeakPolarHBondContact CE2-O 3.38Å; Y189-G208 VanDerWaalsContact CD2-CA 3.43Å
190	Q	90.2	Very high	84.7	Confident	59 Å²	59	43.5 Å²	43.5	28%	0.276	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-57.1	129.2	164.8	-168.8	81.9	29.6	0	0	108	E182 V192 Q193 V204	E182-Q190 HydrophobicContact CB-CB 3.68Å; E182-Q190 HydrophobicContact CB-CG 4.25Å; E182-Q190 WeakPolarHBondContact O-CB 3.47Å; E182-Q190 PolarHBondContact O-N 2.92Å; Q190-V192 CarbonylContact C-O 3.34Å; Q190-V192 VanDerWaalsContact CB-O 3.31Å; Q190-V192 WeakPolarHBondContact CB-O 3.37Å; Q190-V192 WeakPolarHBondContact CG-O 3.43Å; Q190-V192 CarbonylContact O-C 3.53Å; Q190-V192 PolarHBondContact O-N 2.89Å; Q190-V192 VanDerWaalsContact O-N 3.11Å; Q190-Q193 PolarHBondContact O-NE2 3.38Å; Q190-V204 VanDerWaalsContact O-CG2 3.24Å; Q190-V204 WeakPolarHBondContact O-CG2 2.94Å
191	P	89.6	Confident	85.1	Confident	62 Å²	62	42.5 Å²	42.5	40%	0.403	25%	0.247	S	C	.	.	S	Bend	trans	-58.8	-27	-175	-28.9	36.3	0	0	0	114.3	C203 V204 C224	P191-C203 CarbonylContact O-C 2.89Å; P191-C203 VanDerWaalsContact O-CA 3.24Å; P191-C203 WeakPolarHBondContact O-CA 3.5Å; P191-V204 PolarHBondContact O-N 2.88Å; P191-C224 HydrophobicContact CB-CB 4.29Å; P191-C224 PolarHBondContact O-SG 2.91Å; P191-C224 VanDerWaalsContact O-SG 3.34Å
192	V	92.5	Very high	85.4	Confident	19 Å²	19	43.2 Å²	43.2	12%	0.115	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.4	160	179.8	0	0	0	0	108.4	Q190 C201 W202 R221 P222 C224	Q190-V192 CarbonylContact C-O 3.34Å; Q190-V192 VanDerWaalsContact CB-O 3.31Å; Q190-V192 WeakPolarHBondContact CB-O 3.37Å; Q190-V192 WeakPolarHBondContact CG-O 3.43Å; Q190-V192 CarbonylContact O-C 3.53Å; Q190-V192 PolarHBondContact O-N 2.89Å; Q190-V192 VanDerWaalsContact O-N 3.11Å; V192-C201 HydrophobicContact CG1-CB 3.97Å; V192-W202 CarbonylContact C-O 3.53Å; V192-W202 WeakPolarHBondContact CA-O 3.06Å; V192-R221 HydrophobicContact CG1-CB 4.15Å; V192-R221 HydrophobicContact CG1-CG 4.09Å; V192-R221 HydrophobicContact CG2-CB 4.36Å; V192-P222 HydrophobicContact CG1-CG 4.47Å; V192-P222 HydrophobicContact CG2-CG 4.47Å; V192-P222 WeakPolarHBondContact CG2-O 3.46Å; V192-C224 WeakPolarHBondContact CG2-SG 3.47Å
193	Q	92.3	Very high	85.7	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.009	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.6	161.5	-66.9	-59.6	-63.5	0	0	109.2	F179 P181 E182 Q190 C201 W202 V204	F179-Q193 HydrophobicContact CE2-CB 4.4Å; F179-Q193 HydrophobicContact CZ-CB 3.96Å; F179-Q193 HydrophobicContact CZ-CG 4.23Å; P181-Q193 VanDerWaalsContact CA-OE1 3.26Å; E182-Q193 PolarHBondContact O-NE2 3.08Å; Q190-Q193 PolarHBondContact O-NE2 3.38Å; Q193-C201 CarbonylContact O-C 3.51Å; Q193-C201 VanDerWaalsContact O-CA 3.26Å; Q193-C201 WeakPolarHBondContact O-CA 3.02Å; Q193-W202 HydrophobicContact CB-CD2 4.13Å; Q193-W202 HydrophobicContact CB-CZ2 3.88Å; Q193-W202 PolarHBondContact N-O 3.34Å; Q193-W202 PolarHBondContact O-N 3.29Å; Q193-V204 HydrophobicContact CB-CG1 4.14Å; Q193-V204 HydrophobicContact CG-CB 4.27Å; Q193-V204 HydrophobicContact CG-CG1 3.46Å; Q193-V204 VanDerWaalsContact CG-CG1 3.46Å; Q193-V204 HydrophobicContact CG-CG2 3.76Å
194	C	89.9	Confident	85.7	Confident	15 Å²	15	39.6 Å²	39.6	10%	0.101	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.5	173.6	-68.1	0	0	0	0	110	P196 S200 C201	C194-P196 WeakPolarHBondContact O-CD 3.18Å; C194-S200 WeakPolarHBondContact CA-O 3.02Å; C194-C201 HydrophobicContact CB-CB 4.13Å; C194-C201 WeakPolarHBondContact CB-SG 3.4Å; C194-C201 WeakPolarHBondContact SG-CB 3.3Å; C194-C201 CovalentContact SG-SG 2.04Å; C194-C201 PolarHBondContact SG-SG 3.49Å
195	D	84.5	Confident	85.8	Confident	23 Å²	23	39.2 Å²	39.2	12%	0.123	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113.1	163	171.8	31.7	0	0	0	109.7	F179 F197 S198 L199 S200 W202	F179-D195 HydrophobicContact CD2-CB 3.86Å; F179-D195 HydrophobicContact CE2-CB 4.49Å; D195-F197 PolarHBondContact O-N 2.85Å; D195-F197 PolarHBondContact OD1-N 2.73Å; D195-S198 WeakPolarHBondContact CB-OG 3.05Å; D195-S198 WeakPolarHBondContact OD2-CB 3.3Å; D195-S198 PolarHBondContact OD2-N 2.69Å; D195-S198 PolarHBondContact OD2-OG 2.02Å; D195-L199 WeakPolarHBondContact O-CA 3.29Å; D195-L199 PolarHBondContact O-N 2.95Å; D195-S200 PolarHBondContact N-O 2.83Å; D195-S200 PolarHBondContact O-N 3.38Å; D195-W202 HydrophobicContact CB-CH2 3.97Å; D195-W202 HydrophobicContact CB-CZ3 3.82Å
196	P	73.4	Confident	85.9	Confident	80 Å²	80	41.3 Å²	41.3	52%	0.519	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.3	179.7	29.7	-35.9	0	0	0	114	C194	C194-P196 WeakPolarHBondContact O-CD 3.18Å
197	F	73.2	Confident	86	Confident	64 Å²	64	41.9 Å²	41.9	28%	0.281	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-41.9	-178.5	-60.7	-64.8	0	0	0	113.9	I175 Q176 D195 L199	I175-F197 WeakPolarHBondContact O-CE2 3.18Å; Q176-F197 HydrophobicContact CB-CD1 4.13Å; Q176-F197 HydrophobicContact CB-CE1 3.77Å; Q176-F197 HydrophobicContact CB-CZ 4.18Å; Q176-F197 HydrophobicContact CG-CE1 4.1Å; Q176-F197 HydrophobicContact CG-CZ 4.35Å; Q176-F197 WeakPolarHBondContact O-CD1 3.41Å; Q176-F197 WeakPolarHBondContact O-CG 3.41Å; D195-F197 PolarHBondContact O-N 2.85Å; D195-F197 PolarHBondContact OD1-N 2.73Å; F197-L199 VanDerWaalsContact C-N 3.31Å
198	S	76.5	Confident	86.1	Confident	46 Å²	46	42.9 Å²	42.9	32%	0.322	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-6.7	168.1	61.9	0	0	0	0	113.7	D195 S200	D195-S198 WeakPolarHBondContact CB-OG 3.05Å; D195-S198 WeakPolarHBondContact OD2-CB 3.3Å; D195-S198 PolarHBondContact OD2-N 2.69Å; D195-S198 PolarHBondContact OD2-OG 2.02Å; S198-S200 PolarHBondContact O-N 3.3Å; S198-S200 VanDerWaalsContact O-N 3.14Å; S198-S200 WeakPolarHBondContact OG-CB 3.45Å; S198-S200 PolarHBondContact OG-N 2.03Å; S198-S200 PolarHBondContact OG-OG 2.78Å
199	L	76.4	Confident	86	Confident	52 Å²	52	41.7 Å²	41.7	27%	0.272	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	34.2	-170.1	-64.3	172.3	0	0	0	112.1	D195 F197 T217 N218 G219 M1033 D1037	D195-L199 WeakPolarHBondContact O-CA 3.29Å; D195-L199 PolarHBondContact O-N 2.95Å; F197-L199 VanDerWaalsContact C-N 3.31Å; L199-T217 CarbonylContact O-C 3.35Å; L199-N218 PolarHBondContact O-N 2.92Å; L199-G219 WeakPolarHBondContact O-CA 3.01Å; L199-G219 PolarHBondContact O-N 2.82Å; L199-M1033 HydrophobicContact CB-CE 4.07Å; L199-M1033 HydrophobicContact CB-SD 3.68Å; L199-M1033 HydrophobicContact CD1-CE 4.4Å; L199-M1033 HydrophobicContact CD1-SD 3.59Å; L199-M1033 VanDerWaalsContact CD1-SD 3.59Å; L199-M1033 HydrophobicContact CG-SD 4.27Å; L199-D1037 HydrophobicContact CD1-CB 4.29Å
200	S	80.4	Confident	85.8	Confident	10 Å²	10	44.4 Å²	44.4	7%	0.07	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.3	173.5	-64.2	0	0	0	0	109.9	C194 D195 S198 W202 R215 L216	C194-S200 WeakPolarHBondContact CA-O 3.02Å; D195-S200 PolarHBondContact N-O 2.83Å; D195-S200 PolarHBondContact O-N 3.38Å; S198-S200 PolarHBondContact O-N 3.3Å; S198-S200 VanDerWaalsContact O-N 3.14Å; S198-S200 WeakPolarHBondContact OG-CB 3.45Å; S198-S200 PolarHBondContact OG-N 2.03Å; S198-S200 PolarHBondContact OG-OG 2.78Å; S200-W202 VanDerWaalsContact O-CZ3 3.25Å; S200-W202 WeakPolarHBondContact O-CZ3 3.29Å; S200-R215 VanDerWaalsContact CB-NH1 3.32Å; S200-L216 VanDerWaalsContact CA-O 3.29Å; S200-L216 WeakPolarHBondContact CA-O 3.39Å
201	C	92.6	Very high	85.4	Confident	6 Å²	6	45.8 Å²	45.8	4%	0.041	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.2	167.3	-63.3	0	0	0	0	109.7	V192 Q193 C194 R215 L216 Q220	V192-C201 HydrophobicContact CG1-CB 3.97Å; Q193-C201 CarbonylContact O-C 3.51Å; Q193-C201 VanDerWaalsContact O-CA 3.26Å; Q193-C201 WeakPolarHBondContact O-CA 3.02Å; C194-C201 HydrophobicContact CB-CB 4.13Å; C194-C201 WeakPolarHBondContact CB-SG 3.4Å; C194-C201 WeakPolarHBondContact SG-CB 3.3Å; C194-C201 CovalentContact SG-SG 2.04Å; C194-C201 PolarHBondContact SG-SG 3.49Å; C201-R215 CarbonylContact O-C 3.49Å; C201-R215 WeakPolarHBondContact O-CA 3.11Å; C201-L216 PolarHBondContact N-O 2.73Å; C201-L216 PolarHBondContact O-N 2.9Å; C201-Q220 VanDerWaalsContact CB-O 3.28Å; C201-Q220 WeakPolarHBondContact CB-O 3.23Å
202	W	94.6	Very high	84.7	Confident	20 Å²	20	47.1 Å²	47.1	8%	0.076	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.5	-177.4	62.2	94.7	0	0	0	110.3	F179 V192 Q193 D195 S200 E210 R215	F179-W202 AromaticContact CD2-CH2 3.81Å; F179-W202 HydrophobicContact CD2-CH2 3.81Å; F179-W202 HydrophobicContact CD2-CZ2 4.37Å; F179-W202 HydrophobicContact CE1-CH2 4.44Å; F179-W202 HydrophobicContact CE1-CZ2 4.07Å; F179-W202 AromaticContact CE2-CH2 3.54Å; F179-W202 HydrophobicContact CE2-CH2 3.54Å; F179-W202 AromaticContact CE2-CZ2 3.81Å; F179-W202 HydrophobicContact CE2-CZ2 3.81Å; F179-W202 HydrophobicContact CG-CH2 4.36Å; F179-W202 AromaticContact CZ-CH2 3.88Å; F179-W202 HydrophobicContact CZ-CH2 3.88Å; F179-W202 AromaticContact CZ-CZ2 3.64Å; F179-W202 HydrophobicContact CZ-CZ2 3.64Å; V192-W202 CarbonylContact C-O 3.53Å; V192-W202 WeakPolarHBondContact CA-O 3.06Å; Q193-W202 HydrophobicContact CB-CD2 4.13Å; Q193-W202 HydrophobicContact CB-CZ2 3.88Å; Q193-W202 PolarHBondContact N-O 3.34Å; Q193-W202 PolarHBondContact O-N 3.29Å; D195-W202 HydrophobicContact CB-CH2 3.97Å; D195-W202 HydrophobicContact CB-CZ3 3.82Å; S200-W202 VanDerWaalsContact O-CZ3 3.25Å; S200-W202 WeakPolarHBondContact O-CZ3 3.29Å; W202-E210 HydrophobicContact CB-CG 4.07Å; W202-E210 HydrophobicContact CG-CB 4.48Å; W202-E210 HydrophobicContact CG-CG 3.97Å; W202-R215 HydrophobicContact CB-CB 3.99Å; W202-R215 HydrophobicContact CB-CG 4.42Å; W202-R215 VanDerWaalsContact CE2-NH2 3.34Å; W202-R215 VanDerWaalsContact CE3-NH2 3.25Å
203	C	94.2	Very high	84.1	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.02	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	148.1	170.8	-67.2	0	0	0	0	110.6	P191 E210 K211 S214 C224	P191-C203 CarbonylContact O-C 2.89Å; P191-C203 VanDerWaalsContact O-CA 3.24Å; P191-C203 WeakPolarHBondContact O-CA 3.5Å; C203-E210 CarbonylContact O-C 3.57Å; C203-E210 WeakPolarHBondContact O-CA 3.39Å; C203-K211 HydrophobicContact CB-CB 4.03Å; C203-K211 HydrophobicContact CB-CD 3.56Å; C203-K211 HydrophobicContact CB-CG 3.79Å; C203-K211 PolarHBondContact O-N 2.87Å; C203-S214 PolarHBondContact N-OG 2.66Å; C203-S214 PolarHBondContact O-OG 3.48Å; C203-C224 VanDerWaalsContact CA-SG 3.5Å; C203-C224 HydrophobicContact CB-CB 4.05Å; C203-C224 WeakPolarHBondContact CB-SG 3.13Å; C203-C224 WeakPolarHBondContact SG-CA 3.34Å; C203-C224 WeakPolarHBondContact SG-CB 2.95Å; C203-C224 CovalentContact SG-SG 2.04Å; C203-C224 PolarHBondContact SG-SG 3.06Å
204	V	91.3	Very high	83.8	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.042	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-123	162.5	168.4	-64.6	0	0	0	0	112.7	Q190 P191 Q193 L209	Q190-V204 VanDerWaalsContact O-CG2 3.24Å; Q190-V204 WeakPolarHBondContact O-CG2 2.94Å; P191-V204 PolarHBondContact O-N 2.88Å; Q193-V204 HydrophobicContact CB-CG1 4.14Å; Q193-V204 HydrophobicContact CG-CB 4.27Å; Q193-V204 HydrophobicContact CG-CG1 3.46Å; Q193-V204 VanDerWaalsContact CG-CG1 3.46Å; Q193-V204 HydrophobicContact CG-CG2 3.76Å; V204-L209 CarbonylContact C-O 3.58Å; V204-L209 WeakPolarHBondContact CA-O 3.49Å; V204-L209 WeakPolarHBondContact CB-O 3.44Å
205	D	87.1	Confident	83.7	Confident	38 Å²	38	54.3 Å²	54.3	20%	0.203	31%	0.305	C	S	.	.			trans	-83.1	-178.7	161.8	55.2	29.8	0	0	0	112	E207 G208 L209 K288	D205-E207 PolarHBondContact O-N 2.92Å; D205-G208 PolarHBondContact O-N 2.8Å; D205-G208 VanDerWaalsContact O-N 3.08Å; D205-G208 PolarHBondContact OD1-N 2.83Å; D205-L209 PolarHBondContact N-O 2.94Å; D205-L209 WeakPolarHBondContact OD1-CA 2.99Å; D205-L209 WeakPolarHBondContact OD1-CB 3.38Å; D205-L209 PolarHBondContact OD1-N 2.89Å; D205-K288 IonicContact OD2-NZ 2.61Å; D205-K288 PolarHBondContact OD2-NZ 3.19Å
206	Q	80.5	Confident	83.5	Confident	129 Å²	129	56 Å²	56	60%	0.603	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-20.9	-172.7	-54.8	-166.3	53.8	0	0	112.1	Y189 G208	Y189-Q206 WeakPolarHBondContact CD2-O 3.23Å; Q206-G208 VanDerWaalsContact C-N 3.34Å
207	E	82.8	Confident	83.6	Confident	106 Å²	106	56 Å²	56	50%	0.495	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.6	177.8	-64	58.9	-132.2	0	0	112	K153 Y189 D205 L209	K153-E207 PolarHBondContact NZ-O 2.82Å; Y189-E207 VanDerWaalsContact CE2-C 3.49Å; Y189-E207 VanDerWaalsContact CE2-O 3.23Å; Y189-E207 WeakPolarHBondContact CE2-O 3.38Å; D205-E207 PolarHBondContact O-N 2.92Å; E207-L209 HydrophobicContact CB-CG 4.5Å
208	G	86.7	Confident	83.5	Confident	23 Å²	23	54.9 Å²	54.9	24%	0.237	31%	0.31	C	S	.	.	S	Bend	trans	88.7	17.4	179.9	0	0	0	0	0	114.7	Y189 D205 Q206	Y189-G208 VanDerWaalsContact CD2-CA 3.43Å; D205-G208 PolarHBondContact O-N 2.8Å; D205-G208 VanDerWaalsContact O-N 3.08Å; D205-G208 PolarHBondContact OD1-N 2.83Å; Q206-G208 VanDerWaalsContact C-N 3.34Å
209	L	83.8	Confident	83.3	Confident	95 Å²	95	54.3 Å²	54.3	50%	0.497	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-88.9	139.2	175.5	-55	172.2	0	0	0	110.4	V204 D205 E207	V204-L209 CarbonylContact C-O 3.58Å; V204-L209 WeakPolarHBondContact CA-O 3.49Å; V204-L209 WeakPolarHBondContact CB-O 3.44Å; D205-L209 PolarHBondContact N-O 2.94Å; D205-L209 WeakPolarHBondContact OD1-CA 2.99Å; D205-L209 WeakPolarHBondContact OD1-CB 3.38Å; D205-L209 PolarHBondContact OD1-N 2.89Å; E207-L209 HydrophobicContact CB-CG 4.5Å
210	E	88.6	Confident	83.2	Confident	74 Å²	74	54.7 Å²	54.7	35%	0.346	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-63.8	129.6	179.7	177.2	169.4	171.5	0	0	112.7	W202 C203 P212 R215	W202-E210 HydrophobicContact CB-CG 4.07Å; W202-E210 HydrophobicContact CG-CB 4.48Å; W202-E210 HydrophobicContact CG-CG 3.97Å; C203-E210 CarbonylContact O-C 3.57Å; C203-E210 WeakPolarHBondContact O-CA 3.39Å; E210-P212 WeakPolarHBondContact O-CD 3.2Å; E210-R215 WeakPolarHBondContact OE1-CB 3.39Å; E210-R215 IonicContact OE1-CZ 2.78Å; E210-R215 IonicContact OE1-NE 3.16Å; E210-R215 PolarHBondContact OE1-NE 3.44Å; E210-R215 IonicContact OE1-NH2 3.85Å; E210-R215 IonicContact OE2-CZ 2.74Å; E210-R215 IonicContact OE2-NE 2.64Å; E210-R215 PolarHBondContact OE2-NE 3.43Å; E210-R215 IonicContact OE2-NH2 3.21Å; E210-R215 PolarHBondContact OE2-NH2 3.23Å
211	K	82	Confident	83.3	Confident	88 Å²	88	60.2 Å²	60.2	38%	0.383	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-69	119.6	166.9	-59.9	-170.4	-168	173	0	107.9	C203 G213 S214 C224	C203-K211 HydrophobicContact CB-CB 4.03Å; C203-K211 HydrophobicContact CB-CD 3.56Å; C203-K211 HydrophobicContact CB-CG 3.79Å; C203-K211 PolarHBondContact O-N 2.87Å; K211-G213 PolarHBondContact O-N 2.04Å; K211-S214 WeakPolarHBondContact O-CB 3.17Å; K211-S214 PolarHBondContact O-N 2.84Å; K211-S214 PolarHBondContact O-OG 3.47Å; K211-C224 PolarHBondContact NZ-O 2.89Å
212	P	76.3	Confident	82.8	Confident	90 Å²	90	60.6 Å²	60.6	58%	0.584	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	140.2	-178.4	-27.3	35.6	0	0	0	112.5	E210 S214	E210-P212 WeakPolarHBondContact O-CD 3.2Å; P212-S214 PolarHBondContact O-N 2.94Å
213	G	78.1	Confident	82.2	Confident	81 Å²	81	64.8 Å²	64.8	84%	0.835	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-11.3	-179.9	0	0	0	0	0	115.9	K211 R215	K211-G213 PolarHBondContact O-N 2.04Å; G213-R215 PolarHBondContact O-N 2.79Å
214	S	86.4	Confident	81.7	Confident	19 Å²	19	66 Å²	66	13%	0.133	37%	0.365	C	S	.	.			trans	-77.3	-1.4	-178.3	69.3	0	0	0	0	115.2	C203 K211 P212 L216 P222	C203-S214 PolarHBondContact N-OG 2.66Å; C203-S214 PolarHBondContact O-OG 3.48Å; K211-S214 WeakPolarHBondContact O-CB 3.17Å; K211-S214 PolarHBondContact O-N 2.84Å; K211-S214 PolarHBondContact O-OG 3.47Å; P212-S214 PolarHBondContact O-N 2.94Å; S214-L216 PolarHBondContact O-N 3.38Å; S214-P222 WeakPolarHBondContact O-CB 3.31Å; S214-P222 WeakPolarHBondContact O-CG 3.28Å
215	R	89.1	Confident	80.7	Confident	86 Å²	86	70.1 Å²	70.1	33%	0.325	40%	0.4	S	S	.	.			trans	-82.6	104.4	-173.5	-178.6	176.9	-73.9	-89.4	-3.9	112.4	S200 C201 W202 E210 G213 T217	S200-R215 VanDerWaalsContact CB-NH1 3.32Å; C201-R215 CarbonylContact O-C 3.49Å; C201-R215 WeakPolarHBondContact O-CA 3.11Å; W202-R215 HydrophobicContact CB-CB 3.99Å; W202-R215 HydrophobicContact CB-CG 4.42Å; W202-R215 VanDerWaalsContact CE2-NH2 3.34Å; W202-R215 VanDerWaalsContact CE3-NH2 3.25Å; E210-R215 WeakPolarHBondContact OE1-CB 3.39Å; E210-R215 IonicContact OE1-CZ 2.78Å; E210-R215 IonicContact OE1-NE 3.16Å; E210-R215 PolarHBondContact OE1-NE 3.44Å; E210-R215 IonicContact OE1-NH2 3.85Å; E210-R215 IonicContact OE2-CZ 2.74Å; E210-R215 IonicContact OE2-NE 2.64Å; E210-R215 PolarHBondContact OE2-NE 3.43Å; E210-R215 IonicContact OE2-NH2 3.21Å; E210-R215 PolarHBondContact OE2-NH2 3.23Å; G213-R215 PolarHBondContact O-N 2.79Å; R215-T217 HydrophobicContact CG-CG2 4.42Å
216	L	78.8	Confident	79.1	Confident	59 Å²	59	71 Å²	71	31%	0.309	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-90.8	124.8	172	-55.9	-179.6	0	0	0	109.7	S200 C201 S214 N218 Q220 P222	S200-L216 VanDerWaalsContact CA-O 3.29Å; S200-L216 WeakPolarHBondContact CA-O 3.39Å; C201-L216 PolarHBondContact N-O 2.73Å; C201-L216 PolarHBondContact O-N 2.9Å; S214-L216 PolarHBondContact O-N 3.38Å; L216-N218 PolarHBondContact O-N 3.15Å; L216-Q220 HydrophobicContact CB-CB 4.3Å; L216-Q220 HydrophobicContact CD1-CB 3.65Å; L216-P222 HydrophobicContact CD1-CB 3.99Å; L216-P222 HydrophobicContact CG-CB 4.26Å
217	T	77	Confident	77.1	Confident	80 Å²	80	74 Å²	74	49%	0.491	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	26.8	-170.3	53.1	0	0	0	0	113.9	L199 R215 M1033	L199-T217 CarbonylContact O-C 3.35Å; R215-T217 HydrophobicContact CG-CG2 4.42Å; T217-M1033 VanDerWaalsContact O-CB 3.26Å; T217-M1033 WeakPolarHBondContact O-CB 3.35Å; T217-M1033 WeakPolarHBondContact O-CE 3.26Å
218	N	70.9	Confident	74.7	Confident	41 Å²	41	78.1 Å²	78.1	22%	0.219	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	9.1	-173.8	61.8	5	0	0	0	114	L199 L216 Q220 T1030 S1031 M1033	L199-N218 PolarHBondContact O-N 2.92Å; L216-N218 PolarHBondContact O-N 3.15Å; N218-Q220 VanDerWaalsContact C-N 3.33Å; N218-Q220 PolarHBondContact ND2-NE2 3.04Å; N218-Q220 PolarHBondContact ND2-OE1 2.88Å; N218-Q220 VanDerWaalsContact OD1-CB 3.32Å; N218-Q220 WeakPolarHBondContact OD1-CB 3.47Å; N218-Q220 WeakPolarHBondContact OD1-CG 3.47Å; N218-Q220 PolarHBondContact OD1-N 2.82Å; N218-Q220 VanDerWaalsContact OD1-N 3.13Å; N218-Q220 PolarHBondContact OD1-OE1 3.49Å; N218-T1030 PolarHBondContact ND2-O 2.86Å; N218-S1031 PolarHBondContact ND2-O 3.46Å; N218-M1033 HydrophobicContact CB-CB 3.94Å
219	G	71.3	Confident	72.1	Confident	34 Å²	34	80.9 Å²	80.9	35%	0.351	47%	0.471	S	S	.	.	S	Bend	trans	83.7	-4.1	-179.1	0	0	0	0	0	115.5	L199 R221	L199-G219 WeakPolarHBondContact O-CA 3.01Å; L199-G219 PolarHBondContact O-N 2.82Å; G219-R221 PolarHBondContact O-N 2.03Å
220	Q	75.2	Confident	69.7	Low	59 Å²	59	82.9 Å²	82.9	28%	0.276	49%	0.488	S	S	.	.			trans	-61.9	132.4	169.9	-74.2	160.7	-8.5	0	0	109.7	C201 L216 N218 P222 T1030	C201-Q220 VanDerWaalsContact CB-O 3.28Å; C201-Q220 WeakPolarHBondContact CB-O 3.23Å; L216-Q220 HydrophobicContact CB-CB 4.3Å; L216-Q220 HydrophobicContact CD1-CB 3.65Å; N218-Q220 VanDerWaalsContact C-N 3.33Å; N218-Q220 PolarHBondContact ND2-NE2 3.04Å; N218-Q220 PolarHBondContact ND2-OE1 2.88Å; N218-Q220 VanDerWaalsContact OD1-CB 3.32Å; N218-Q220 WeakPolarHBondContact OD1-CB 3.47Å; N218-Q220 WeakPolarHBondContact OD1-CG 3.47Å; N218-Q220 PolarHBondContact OD1-N 2.82Å; N218-Q220 VanDerWaalsContact OD1-N 3.13Å; N218-Q220 PolarHBondContact OD1-OE1 3.49Å; Q220-P222 WeakPolarHBondContact O-CD 3.4Å; Q220-T1030 PolarHBondContact NE2-O 3.46Å; Q220-T1030 PolarHBondContact NE2-OG1 3.42Å
221	R	82.8	Confident	67	Low	126 Å²	126	83.4 Å²	83.4	48%	0.475	50%	0.504	S	S	.	.			trans	-81	114.5	173.7	-70.3	-174.2	161.4	-150.5	-16.6	107.5	E182 V192 G219	E182-R221 IonicContact OE1-NH2 2.71Å; E182-R221 IonicContact OE2-CZ 2.7Å; E182-R221 IonicContact OE2-NH2 2.66Å; E182-R221 PolarHBondContact OE2-NH2 3.22Å; V192-R221 HydrophobicContact CG1-CB 4.15Å; V192-R221 HydrophobicContact CG1-CG 4.09Å; V192-R221 HydrophobicContact CG2-CB 4.36Å; G219-R221 PolarHBondContact O-N 2.03Å
222	P	82.3	Confident	64.7	Low	14 Å²	14	82 Å²	82	9%	0.091	50%	0.504	C	S	.	.			trans	-62.3	142.2	178.4	28.2	-37.4	0	0	0	110.2	V192 S214 L216 Q220 C224	V192-P222 HydrophobicContact CG1-CG 4.47Å; V192-P222 HydrophobicContact CG2-CG 4.47Å; V192-P222 WeakPolarHBondContact CG2-O 3.46Å; S214-P222 WeakPolarHBondContact O-CB 3.31Å; S214-P222 WeakPolarHBondContact O-CG 3.28Å; L216-P222 HydrophobicContact CD1-CB 3.99Å; L216-P222 HydrophobicContact CG-CB 4.26Å; Q220-P222 WeakPolarHBondContact O-CD 3.4Å; P222-C224 PolarHBondContact O-N 2.84Å; P222-C224 PolarHBondContact O-SG 2.72Å; P222-C224 VanDerWaalsContact O-SG 3.39Å
223	D	81.3	Confident	62.8	Low	108 Å²	108	84.8 Å²	84.8	58%	0.578	52%	0.519	S	S	*	.			trans	-62.8	125.2	168	176.9	34.7	0	0	0	109.8	A225 G226	D223-A225 WeakPolarHBondContact OD1-CA 2.94Å; D223-A225 VanDerWaalsContact OD1-CB 3.31Å; D223-A225 WeakPolarHBondContact OD1-CB 3.27Å; D223-A225 PolarHBondContact OD1-N 3.23Å; D223-G226 PolarHBondContact OD2-N 3.32Å; D223-G226 VanDerWaalsContact OD2-N 3.17Å
224	C	83.2	Confident	60.9	Low	30 Å²	30	85.5 Å²	85.5	20%	0.203	50%	0.497	C	S	.	.			trans	-110	1.5	175.5	-52.3	0	0	0	0	112.5	P191 V192 C203 K211 P222	P191-C224 HydrophobicContact CB-CB 4.29Å; P191-C224 PolarHBondContact O-SG 2.91Å; P191-C224 VanDerWaalsContact O-SG 3.34Å; V192-C224 WeakPolarHBondContact CG2-SG 3.47Å; C203-C224 VanDerWaalsContact CA-SG 3.5Å; C203-C224 HydrophobicContact CB-CB 4.05Å; C203-C224 WeakPolarHBondContact CB-SG 3.13Å; C203-C224 WeakPolarHBondContact SG-CA 3.34Å; C203-C224 WeakPolarHBondContact SG-CB 2.95Å; C203-C224 CovalentContact SG-SG 2.04Å; C203-C224 PolarHBondContact SG-SG 3.06Å; K211-C224 PolarHBondContact NZ-O 2.89Å; P222-C224 PolarHBondContact O-N 2.84Å; P222-C224 PolarHBondContact O-SG 2.72Å; P222-C224 VanDerWaalsContact O-SG 3.39Å
225	A	69.7	Low	59	Low	93 Å²	93	95.5 Å²	95.5	77%	0.769	53%	0.532	S	S	*	.	S	Bend	trans	-113.3	4.2	-162	0	0	0	0	0	115.6	D223	D223-A225 WeakPolarHBondContact OD1-CA 2.94Å; D223-A225 VanDerWaalsContact OD1-CB 3.31Å; D223-A225 WeakPolarHBondContact OD1-CB 3.27Å; D223-A225 PolarHBondContact OD1-N 3.23Å
226	G	54.3	Low	57.5	Low	55 Å²	55	93 Å²	93	57%	0.567	53%	0.525	S	S	*	.			trans	123.3	113.9	133.7	0	0	0	0	0	117.7	D223	D223-G226 PolarHBondContact OD2-N 3.32Å; D223-G226 VanDerWaalsContact OD2-N 3.17Å
227	Q	38.2	Very low	57.1	Low	193 Å²	193	92.8 Å²	92.8	90%	0.902	52%	0.524	S	S	*	.			trans	-126.3	154.2	130.8	-83.3	179.3	1.9	0	0	108.8
228	E	33.6	Very low	57.1	Low	192 Å²	192	96.6 Å²	96.6	90%	0.897	54%	0.536	S	S	*	.			trans	-66.2	145.1	176.8	-66.2	-175.5	123.7	0	0	110.1	V230	E228-V230 PolarHBondContact O-N 2.92Å
229	A	30.8	Very low	57.7	Low	81 Å²	81	99.1 Å²	99.1	67%	0.669	55%	0.546	S	S	*	.			trans	-64.2	122	-165.7	0	0	0	0	0	111.9	A231	A229-A231 PolarHBondContact O-N 3.39Å
230	V	33	Very low	58.5	Low	138 Å²	138	97.6 Å²	97.6	84%	0.836	53%	0.529	S	S	*	.			trans	-52.3	108.8	150.1	175.8	0	0	0	0	105.6	E228 P232	E228-V230 PolarHBondContact O-N 2.92Å; V230-P232 WeakPolarHBondContact O-CD 3.02Å
231	A	32.1	Very low	59	Low	85 Å²	85	99.6 Å²	99.6	70%	0.702	54%	0.541	S	S	*	.			trans	-52.3	109.9	-167.9	0	0	0	0	0	109.6	A229 V233	A229-A231 PolarHBondContact O-N 3.39Å; A231-V233 PolarHBondContact O-N 3.32Å
232	P	35.3	Very low	59.2	Low	58 Å²	58	96.8 Å²	96.8	38%	0.377	53%	0.533	S	S	.	.			trans	-59.8	142.1	-170.7	-27.6	34.8	0	0	0	110.9	V230 Y234	V230-P232 WeakPolarHBondContact O-CD 3.02Å; P232-Y234 HydrophobicContact CB-CD1 4.19Å; P232-Y234 HydrophobicContact CB-CD2 3.83Å; P232-Y234 HydrophobicContact CB-CE1 4.05Å; P232-Y234 HydrophobicContact CB-CE2 3.7Å; P232-Y234 HydrophobicContact CB-CG 4.09Å; P232-Y234 HydrophobicContact CG-CD2 4.37Å; P232-Y234 HydrophobicContact CG-CE1 4.19Å; P232-Y234 HydrophobicContact CG-CE2 3.73Å; P232-Y234 WeakPolarHBondContact O-CD2 3.34Å; P232-Y234 PolarHBondContact O-N 3.5Å
233	V	35.3	Very low	59.4	Low	148 Å²	148	101.4 Å²	101.4	90%	0.897	56%	0.562	S	S	*	*			trans	-70.7	80.6	162.6	-179.1	0	0	0	0	106.5	A231 R235	A231-V233 PolarHBondContact O-N 3.32Å; V233-R235 PolarHBondContact O-N 2.87Å
234	Y	38.3	Very low	59.7	Low	96 Å²	96	98.5 Å²	98.5	38%	0.376	55%	0.549	S	S	.	.			trans	-67.3	84.5	177.1	-69.7	-79.7	0	0	0	109	P232 L236 A292 A293	P232-Y234 HydrophobicContact CB-CD1 4.19Å; P232-Y234 HydrophobicContact CB-CD2 3.83Å; P232-Y234 HydrophobicContact CB-CE1 4.05Å; P232-Y234 HydrophobicContact CB-CE2 3.7Å; P232-Y234 HydrophobicContact CB-CG 4.09Å; P232-Y234 HydrophobicContact CG-CD2 4.37Å; P232-Y234 HydrophobicContact CG-CE1 4.19Å; P232-Y234 HydrophobicContact CG-CE2 3.73Å; P232-Y234 WeakPolarHBondContact O-CD2 3.34Å; P232-Y234 PolarHBondContact O-N 3.5Å; Y234-L236 PolarHBondContact O-N 3.41Å; Y234-A292 HydrophobicContact CD1-CB 3.55Å; Y234-A292 HydrophobicContact CD2-CB 3.44Å; Y234-A292 VanDerWaalsContact CD2-CB 3.44Å; Y234-A292 VanDerWaalsContact CD2-O 3.22Å; Y234-A292 WeakPolarHBondContact CD2-O 3.47Å; Y234-A292 HydrophobicContact CE1-CB 3.8Å; Y234-A292 HydrophobicContact CE2-CB 3.66Å; Y234-A292 HydrophobicContact CG-CB 3.36Å; Y234-A293 VanDerWaalsContact O-CB 3.3Å; Y234-A293 WeakPolarHBondContact O-CB 3.39Å
235	R	45.9	Very low	60	Low	230 Å²	230	101.7 Å²	101.7	87%	0.868	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-51.7	122.5	150	178.1	-178.8	-94.8	144.2	-7.7	105.7	V233 D237	V233-R235 PolarHBondContact O-N 2.87Å; R235-D237 PolarHBondContact O-N 2.65Å
236	L	58.2	Low	60.8	Low	32 Å²	32	100.3 Å²	100.3	17%	0.168	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-53.5	138.4	177.2	-85.1	80.1	0	0	0	108.8	Y234 E238 C240 L241 F258 A293	Y234-L236 PolarHBondContact O-N 3.41Å; L236-E238 PolarHBondContact O-N 3.02Å; L236-C240 HydrophobicContact CB-CB 4.3Å; L236-C240 HydrophobicContact CD2-CB 3.92Å; L236-C240 HydrophobicContact CG-CB 4.44Å; L236-L241 HydrophobicContact CB-CD1 4.44Å; L236-L241 HydrophobicContact CB-CD2 4.13Å; L236-L241 HydrophobicContact CB-CG 4.13Å; L236-L241 HydrophobicContact CD2-CD2 3.76Å; L236-L241 HydrophobicContact CD2-CG 4.47Å; L236-L241 HydrophobicContact CG-CD2 4.48Å; L236-F258 HydrophobicContact CD2-CD1 3.79Å; L236-F258 HydrophobicContact CD2-CE1 3.43Å; L236-F258 VanDerWaalsContact CD2-CE1 3.43Å; L236-F258 HydrophobicContact CD2-CZ 4.08Å; L236-A293 HydrophobicContact CD1-CB 3.47Å; L236-A293 VanDerWaalsContact CD1-CB 3.47Å
237	D	70.3	Confident	62.4	Low	55 Å²	55	99 Å²	99	29%	0.294	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-51	132.1	163.7	-173	-14.5	0	0	0	106.6	R235 K239 C240	R235-D237 PolarHBondContact O-N 2.65Å; D237-K239 PolarHBondContact O-N 2.95Å; D237-K239 WeakPolarHBondContact OD1-CB 3Å; D237-K239 WeakPolarHBondContact OD1-CD 3.31Å; D237-K239 VanDerWaalsContact OD1-CG 3.23Å; D237-K239 WeakPolarHBondContact OD1-CG 3.22Å; D237-K239 PolarHBondContact OD1-N 2.88Å; D237-C240 VanDerWaalsContact O-CB 3.31Å; D237-C240 WeakPolarHBondContact O-CB 3.18Å; D237-C240 PolarHBondContact O-N 3.02Å
238	E	76.2	Confident	64.6	Low	160 Å²	160	95.3 Å²	95.3	75%	0.748	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-54.5	-28.9	-178.3	-68.2	-177.1	131.7	0	0	110.7	L236 C240 L241 E242	L236-E238 PolarHBondContact O-N 3.02Å; E238-C240 PolarHBondContact O-N 3.14Å; E238-L241 WeakPolarHBondContact O-CA 3.29Å; E238-L241 WeakPolarHBondContact O-CB 3.35Å; E238-L241 PolarHBondContact O-N 2.82Å; E238-E242 PolarHBondContact O-N 3.34Å
239	K	84.1	Confident	67	Low	95 Å²	95	89.1 Å²	89.1	41%	0.413	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-61.9	-24.1	174.1	-57.8	177.6	-172.8	146.7	0	114.5	D237 L241 S277 N278	D237-K239 PolarHBondContact O-N 2.95Å; D237-K239 WeakPolarHBondContact OD1-CB 3Å; D237-K239 WeakPolarHBondContact OD1-CD 3.31Å; D237-K239 VanDerWaalsContact OD1-CG 3.23Å; D237-K239 WeakPolarHBondContact OD1-CG 3.22Å; D237-K239 PolarHBondContact OD1-N 2.88Å; K239-L241 VanDerWaalsContact C-N 3.35Å; K239-S277 VanDerWaalsContact CB-CB 3.4Å; K239-S277 CarbonylContact O-C 3.19Å; K239-N278 WeakPolarHBondContact O-CA 3.44Å; K239-N278 WeakPolarHBondContact O-CB 3.49Å; K239-N278 PolarHBondContact O-N 3.28Å; K239-N278 VanDerWaalsContact O-N 3.16Å
240	C	89.2	Confident	69.5	Low	1 Å²	1	91.1 Å²	91.1	1%	0.007	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-82.9	-12.3	172.8	-56.9	0	0	0	0	112.7	L236 D237 E238 F258 N278 C290	L236-C240 HydrophobicContact CB-CB 4.3Å; L236-C240 HydrophobicContact CD2-CB 3.92Å; L236-C240 HydrophobicContact CG-CB 4.44Å; D237-C240 VanDerWaalsContact O-CB 3.31Å; D237-C240 WeakPolarHBondContact O-CB 3.18Å; D237-C240 PolarHBondContact O-N 3.02Å; E238-C240 PolarHBondContact O-N 3.14Å; C240-F258 HydrophobicContact CB-CB 4.21Å; C240-F258 HydrophobicContact CB-CD1 4.37Å; C240-F258 HydrophobicContact CB-CG 4.49Å; C240-N278 PolarHBondContact O-ND2 3.35Å; C240-C290 HydrophobicContact CB-CB 3.7Å; C240-C290 WeakPolarHBondContact CB-SG 3.22Å; C240-C290 VanDerWaalsContact SG-CA 3.56Å; C240-C290 WeakPolarHBondContact SG-CB 3.49Å; C240-C290 CovalentContact SG-SG 2.03Å; C240-C290 PolarHBondContact SG-SG 2.83Å
241	L	84.5	Confident	71.6	Confident	101 Å²	101	88.6 Å²	88.6	53%	0.529	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-17.9	-178.4	-60.7	175.9	0	0	0	112.9	L236 E238 K239	L236-L241 HydrophobicContact CB-CD1 4.44Å; L236-L241 HydrophobicContact CB-CD2 4.13Å; L236-L241 HydrophobicContact CB-CG 4.13Å; L236-L241 HydrophobicContact CD2-CD2 3.76Å; L236-L241 HydrophobicContact CD2-CG 4.47Å; L236-L241 HydrophobicContact CG-CD2 4.48Å; E238-L241 WeakPolarHBondContact O-CA 3.29Å; E238-L241 WeakPolarHBondContact O-CB 3.35Å; E238-L241 PolarHBondContact O-N 2.82Å; K239-L241 VanDerWaalsContact C-N 3.35Å
242	E	86.7	Confident	74.1	Confident	67 Å²	67	90.4 Å²	90.4	31%	0.313	48%	0.475	S	S	.	.	S	Bend	trans	-61	135.7	170.8	-66.9	173.1	-165.5	0	0	110.7	E238 N276 S277 N278	E238-E242 PolarHBondContact O-N 3.34Å; E242-N276 WeakPolarHBondContact OE2-CB 2.99Å; E242-S277 PolarHBondContact OE1-OG 2.88Å; E242-S277 WeakPolarHBondContact OE2-CA 3.4Å; E242-S277 WeakPolarHBondContact OE2-CB 3.07Å; E242-S277 PolarHBondContact OE2-N 3.42Å; E242-S277 PolarHBondContact OE2-OG 2.78Å; E242-N278 HydrophobicContact CB-CB 4.3Å; E242-N278 VanDerWaalsContact O-CB 3.25Å; E242-N278 WeakPolarHBondContact O-CB 3.26Å; E242-N278 PolarHBondContact O-ND2 3.36Å
243	T	87.1	Confident	76.5	Confident	112 Å²	112	90 Å²	90	69%	0.687	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-68.3	122.7	176.8	47.7	0	0	0	0	110	E245 N276	T243-E245 PolarHBondContact O-N 3.4Å; T243-N276 PolarHBondContact O-ND2 3.44Å
244	P	87.8	Confident	79.1	Confident	47 Å²	47	89.2 Å²	89.2	31%	0.305	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-61.3	123.2	-166.6	27.7	-39.4	0	0	0	113.3	H257 L268	P244-H257 HydrophobicContact CB-CB 3.64Å; P244-H257 HydrophobicContact CG-CB 4.33Å; P244-L268 HydrophobicContact CB-CD1 4.39Å
245	E	88.5	Confident	81.8	Confident	96 Å²	96	87.6 Å²	87.6	45%	0.449	45%	0.45	S	S	.	.			trans	-106.7	122.2	177.9	-78.2	174.2	-145.3	0	0	112.5	T243 G247 G275 N276	T243-E245 PolarHBondContact O-N 3.4Å; E245-G247 PolarHBondContact O-N 2.03Å; E245-G275 WeakPolarHBondContact O-CA 3.19Å; E245-N276 HydrophobicContact CB-CB 4.48Å; E245-N276 WeakPolarHBondContact CG-ND2 3.46Å; E245-N276 PolarHBondContact N-OD1 3.38Å; E245-N276 PolarHBondContact OE1-ND2 3.33Å
246	P	88.6	Confident	84	Confident	65 Å²	65	79.1 Å²	79.1	42%	0.422	42%	0.418	S	S	.	.			trans	-60.5	-23.8	168.1	-27.8	36.9	0	0	0	114.7	L268 I269 Y270 G271	P246-L268 HydrophobicContact CG-CD1 3.95Å; P246-I269 WeakPolarHBondContact CB-O 3.38Å; P246-Y270 WeakPolarHBondContact O-CD2 3.41Å; P246-G271 WeakPolarHBondContact O-CA 3.22Å; P246-G271 PolarHBondContact O-N 3.44Å
247	G	86.9	Confident	85.7	Confident	26 Å²	26	78.5 Å²	78.5	27%	0.268	41%	0.414	S	S	.	.			trans	77.5	174.5	-171.3	0	0	0	0	0	114	E245 C273	E245-G247 PolarHBondContact O-N 2.03Å; G247-C273 WeakPolarHBondContact CA-O 3.46Å
248	P	84.2	Confident	86.8	Confident	117 Å²	117	76.2 Å²	76.2	76%	0.76	40%	0.401	S	S	*	.	S	Bend	trans	-93.9	0.5	-169.4	36.4	-37.2	0	0	0	115.7	C273	P248-C273 WeakPolarHBondContact CD-O 3.36Å
249	C	83.6	Confident	87.3	Confident	61 Å²	61	69.8 Å²	69.8	41%	0.412	37%	0.372	S	S	.	.	S	Bend	trans	-90.4	167.2	172.9	-71.7	0	0	0	0	111.2	G271 C273	C249-G271 CarbonylContact C-O 3.48Å; C249-G271 WeakPolarHBondContact CB-O 3.14Å; C249-G271 WeakPolarHBondContact O-CA 3.48Å; C249-C273 HydrophobicContact CB-CB 3.8Å; C249-C273 WeakPolarHBondContact CB-SG 3Å; C249-C273 WeakPolarHBondContact SG-CB 3.36Å; C249-C273 CovalentContact SG-SG 2.03Å; C249-C273 PolarHBondContact SG-SG 3.09Å
250	D	83.1	Confident	86.8	Confident	123 Å²	123	67.9 Å²	67.9	66%	0.658	37%	0.374	S	S	*	.			trans	-116.6	29.7	-172	-161	17.7	0	0	0	113.6	Q252 G271	D250-Q252 PolarHBondContact OD1-NE2 3.47Å; D250-G271 PolarHBondContact N-O 3.19Å
251	D	77.1	Confident	85.9	Confident	86 Å²	86	76.5 Å²	76.5	46%	0.46	41%	0.414	S	S	.	.			trans	-74.7	146.6	165.8	-160.4	-9.2	0	0	0	109.8	L253 Y270 G271	D251-L253 HydrophobicContact CB-CG 4.08Å; D251-L253 VanDerWaalsContact CG-CG 3.45Å; D251-L253 PolarHBondContact O-N 2.95Å; D251-L253 WeakPolarHBondContact OD1-CD2 3.44Å; D251-L253 WeakPolarHBondContact OD2-CD1 3.47Å; D251-L253 WeakPolarHBondContact OD2-CD2 3.37Å; D251-L253 WeakPolarHBondContact OD2-CG 3.36Å; D251-Y270 CarbonylContact O-C 3.51Å; D251-G271 VanDerWaalsContact CB-O 3.23Å; D251-G271 WeakPolarHBondContact CB-O 3.37Å; D251-G271 PolarHBondContact N-O 2.95Å; D251-G271 CarbonylContact O-C 2.99Å; D251-G271 WeakPolarHBondContact O-CA 3.03Å
252	Q	85.7	Confident	85.4	Confident	123 Å²	123	75.3 Å²	75.3	58%	0.575	41%	0.408	S	S	*	.			trans	-103.2	49.7	-174	-64.1	-67.3	-54.7	0	0	110.4	D250 E254	D250-Q252 PolarHBondContact OD1-NE2 3.47Å; Q252-E254 PolarHBondContact O-N 2.92Å
253	L	85.9	Confident	84.9	Confident	50 Å²	50	79.3 Å²	79.3	26%	0.262	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	114.3	-173.4	-57.2	-176.6	0	0	0	110.8	D251 R255 Y270	D251-L253 HydrophobicContact CB-CG 4.08Å; D251-L253 VanDerWaalsContact CG-CG 3.45Å; D251-L253 PolarHBondContact O-N 2.95Å; D251-L253 WeakPolarHBondContact OD1-CD2 3.44Å; D251-L253 WeakPolarHBondContact OD2-CD1 3.47Å; D251-L253 WeakPolarHBondContact OD2-CD2 3.37Å; D251-L253 WeakPolarHBondContact OD2-CG 3.36Å; L253-R255 VanDerWaalsContact CD1-NH2 3.35Å; L253-R255 PolarHBondContact O-N 3.24Å; L253-Y270 HydrophobicContact CB-CD1 4.42Å; L253-Y270 WeakPolarHBondContact CB-O 3.04Å; L253-Y270 HydrophobicContact CD1-CD1 4.31Å; L253-Y270 PolarHBondContact N-O 3.17Å; L253-Y270 VanDerWaalsContact N-O 3.15Å; L253-Y270 PolarHBondContact O-N 3.27Å
254	E	90.4	Very high	84.6	Confident	130 Å²	130	80.2 Å²	80.2	61%	0.607	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	125.5	168.1	-69.5	-170.6	-179.2	0	0	110.3	Q252	Q252-E254 PolarHBondContact O-N 2.92Å
255	R	93.4	Very high	84.8	Confident	63 Å²	63	78.3 Å²	78.3	24%	0.238	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	177.7	175.8	-66.7	-67.5	-175.5	-85.7	-4.8	107.6	L253 I267 L268 Y270 N279 F280	L253-R255 VanDerWaalsContact CD1-NH2 3.35Å; L253-R255 PolarHBondContact O-N 3.24Å; R255-I267 CarbonylContact O-C 3.2Å; R255-I267 WeakPolarHBondContact O-CA 3.26Å; R255-L268 CarbonylContact C-O 3.5Å; R255-L268 WeakPolarHBondContact CA-O 3.45Å; R255-L268 HydrophobicContact CB-CB 4.02Å; R255-L268 HydrophobicContact CB-CD2 4.38Å; R255-L268 HydrophobicContact CB-CG 4.29Å; R255-L268 WeakPolarHBondContact CB-O 2.94Å; R255-L268 PolarHBondContact N-O 2.02Å; R255-L268 PolarHBondContact O-N 2.9Å; R255-Y270 VanDerWaalsContact CG-CB 3.46Å; R255-Y270 HydrophobicContact CG-CD1 4.12Å; R255-Y270 HydrophobicContact CG-CG 4.08Å; R255-N279 WeakPolarHBondContact CB-OD1 3.31Å; R255-N279 WeakPolarHBondContact CD-OD1 3.1Å; R255-N279 WeakPolarHBondContact CG-OD1 3.36Å; R255-F280 CarbonylContact C-O 3.48Å; R255-F280 WeakPolarHBondContact CA-O 3.19Å; R255-F280 WeakPolarHBondContact CD-O 3.39Å
256	W	93.6	Very high	85	Confident	52 Å²	52	76.9 Å²	76.9	20%	0.197	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	139.8	179.8	-68.1	75.7	0	0	0	109.4	C265 K266 I267 F280 S282 K283 C286	W256-C265 HydrophobicContact CE3-CB 4.35Å; W256-K266 CarbonylContact C-O 3.55Å; W256-K266 WeakPolarHBondContact CA-O 3.18Å; W256-K266 VanDerWaalsContact CE3-C 3.42Å; W256-I267 HydrophobicContact CD2-CG1 4.02Å; W256-I267 HydrophobicContact CE3-CG1 4.06Å; W256-I267 HydrophobicContact CH2-CD1 3.94Å; W256-I267 HydrophobicContact CH2-CG1 3.43Å; W256-I267 VanDerWaalsContact CH2-CG1 3.43Å; W256-I267 HydrophobicContact CZ2-CD1 3.83Å; W256-I267 HydrophobicContact CZ2-CG1 3.38Å; W256-I267 HydrophobicContact CZ3-CG1 3.78Å; W256-F280 PolarHBondContact N-O 3.01Å; W256-F280 WeakPolarHBondContact O-CB 3.32Å; W256-F280 VanDerWaalsContact O-CD2 3.26Å; W256-F280 WeakPolarHBondContact O-CD2 3.45Å; W256-F280 PolarHBondContact O-N 3.31Å; W256-S282 VanDerWaalsContact CG-C 3.48Å; W256-K283 VanDerWaalsContact CD2-CA 3.44Å; W256-K283 HydrophobicContact CD2-CB 3.52Å; W256-K283 HydrophobicContact CD2-CG 4.09Å; W256-K283 HydrophobicContact CE3-CB 3.62Å; W256-K283 HydrophobicContact CE3-CD 4.17Å; W256-K283 HydrophobicContact CE3-CG 3.63Å; W256-K283 VanDerWaalsContact CG-CA 3.49Å; W256-K283 HydrophobicContact CG-CB 4.13Å; W256-K283 HydrophobicContact CH2-CB 3.94Å; W256-K283 HydrophobicContact CH2-CD 3.68Å; W256-K283 HydrophobicContact CH2-CG 4.01Å; W256-K283 HydrophobicContact CZ2-CB 3.83Å; W256-K283 HydrophobicContact CZ2-CD 4.34Å; W256-K283 HydrophobicContact CZ2-CG 4.41Å; W256-K283 HydrophobicContact CZ3-CB 3.84Å; W256-K283 HydrophobicContact CZ3-CD 3.58Å; W256-K283 HydrophobicContact CZ3-CG 3.59Å; W256-C286 HydrophobicContact CB-CB 3.97Å
257	H	93.3	Very high	85.1	Confident	19 Å²	19	77.7 Å²	77.7	9%	0.088	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	153.1	175.2	78.7	86.5	0	0	0	109.5	P244 D259 C265 K266 L268 N278	P244-H257 HydrophobicContact CB-CB 3.64Å; P244-H257 HydrophobicContact CG-CB 4.33Å; H257-D259 IonicContact CE1-OD2 2.61Å; H257-C265 CarbonylContact O-C 3.55Å; H257-C265 WeakPolarHBondContact O-CA 3.24Å; H257-K266 PolarHBondContact N-O 2.79Å; H257-K266 WeakPolarHBondContact NE2-CB 3.47Å; H257-K266 PolarHBondContact O-N 3.45Å; H257-L268 HydrophobicContact CB-CB 4.26Å; H257-N278 WeakPolarHBondContact CA-OD1 3.17Å; H257-N278 WeakPolarHBondContact CB-O 3.02Å
258	F	92.7	Very high	85.3	Confident	7 Å²	7	77 Å²	77	3%	0.031	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	136.2	167.7	-175.5	-103.3	0	0	0	109.8	L236 C240 A260 R263 N278 C286 C290 N291 V294	L236-F258 HydrophobicContact CD2-CD1 3.79Å; L236-F258 HydrophobicContact CD2-CE1 3.43Å; L236-F258 VanDerWaalsContact CD2-CE1 3.43Å; L236-F258 HydrophobicContact CD2-CZ 4.08Å; C240-F258 HydrophobicContact CB-CB 4.21Å; C240-F258 HydrophobicContact CB-CD1 4.37Å; C240-F258 HydrophobicContact CB-CG 4.49Å; F258-A260 HydrophobicContact CE1-CB 4.35Å; F258-R263 HydrophobicContact CZ-CB 4.33Å; F258-N278 PolarHBondContact N-OD1 2.87Å; F258-N278 PolarHBondContact O-ND2 3.26Å; F258-C286 PolarHBondContact N-SG 3.03Å; F258-C286 VanDerWaalsContact N-SG 3.35Å; F258-C290 HydrophobicContact CB-CB 3.47Å; F258-C290 VanDerWaalsContact CB-CB 3.47Å; F258-C290 HydrophobicContact CD1-CB 4.21Å; F258-C290 HydrophobicContact CD2-CB 3.33Å; F258-C290 HydrophobicContact CE2-CB 4.07Å; F258-C290 HydrophobicContact CG-CB 3.4Å; F258-C290 VanDerWaalsContact CG-CB 3.4Å; F258-N291 WeakPolarHBondContact CE2-OD1 3.33Å; F258-V294 HydrophobicContact CE2-CG2 4.27Å; F258-V294 HydrophobicContact CZ-CG2 4.17Å
259	D	87.4	Confident	85.6	Confident	25 Å²	25	75.7 Å²	75.7	13%	0.134	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.5	173.4	-170.4	-70.4	0	0	0	109	H257 E261 D262 R263 R264 K266	H257-D259 IonicContact CE1-OD2 2.61Å; D259-E261 PolarHBondContact OD1-N 2.81Å; D259-D262 HydrophobicContact CB-CB 4.33Å; D259-D262 PolarHBondContact OD1-N 2.88Å; D259-R263 WeakPolarHBondContact O-CA 3.07Å; D259-R263 PolarHBondContact O-N 3.49Å; D259-R264 WeakPolarHBondContact CB-O 3.44Å; D259-R264 PolarHBondContact N-O 3.08Å; D259-R264 PolarHBondContact O-N 2.85Å; D259-K266 HydrophobicContact CB-CD 3.85Å; D259-K266 HydrophobicContact CB-CG 4.18Å; D259-K266 VanDerWaalsContact CG-NZ 3.25Å; D259-K266 IonicContact OD1-NZ 3.97Å; D259-K266 WeakPolarHBondContact OD2-CD 3.48Å; D259-K266 WeakPolarHBondContact OD2-CE 3.19Å; D259-K266 IonicContact OD2-NZ 2.75Å; D259-K266 PolarHBondContact OD2-NZ 3.34Å
260	A	73.1	Confident	85.9	Confident	55 Å²	55	74.2 Å²	74.2	46%	0.455	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.9	-175.1	0	0	0	0	0	113.7	F258 R263	F258-A260 HydrophobicContact CE1-CB 4.35Å; A260-R263 WeakPolarHBondContact O-CG 3.24Å
261	E	71.3	Confident	86	Confident	182 Å²	182	68.6 Å²	68.6	85%	0.85	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-51.9	178.4	-60.3	-172.1	158.9	0	0	110.5	D259 R263	D259-E261 PolarHBondContact OD1-N 2.81Å; E261-R263 VanDerWaalsContact C-N 3.26Å; E261-R263 PolarHBondContact O-N 3.19Å
262	D	73.7	Confident	86.2	Confident	76 Å²	76	66 Å²	66	41%	0.406	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-12	176	-89.6	-30.1	0	0	0	113.3	D259 R264 K266	D259-D262 HydrophobicContact CB-CB 4.33Å; D259-D262 PolarHBondContact OD1-N 2.88Å; D262-R264 VanDerWaalsContact C-N 3.32Å; D262-R264 HydrophobicContact CB-CG 3.83Å; D262-R264 VanDerWaalsContact CG-NH2 3.34Å; D262-R264 PolarHBondContact O-N 2.83Å; D262-R264 IonicContact OD1-NH2 2.74Å; D262-R264 IonicContact OD2-CZ 2.74Å; D262-R264 VanDerWaalsContact OD2-CZ 3.3Å; D262-R264 IonicContact OD2-NE 2.63Å; D262-R264 PolarHBondContact OD2-NE 3.37Å; D262-R264 IonicContact OD2-NH2 3.17Å; D262-R264 PolarHBondContact OD2-NH2 3.25Å; D262-K266 WeakPolarHBondContact OD2-CE 3.42Å; D262-K266 IonicContact OD2-NZ 3.62Å; D262-K266 PolarHBondContact OD2-NZ 3.27Å
263	R	74.6	Confident	86.1	Confident	151 Å²	151	62.4 Å²	62.4	57%	0.57	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	44.9	-176.2	-62	-173.8	-64.6	-115.7	-1.5	113.8	F258 D259 A260 E261 V294	F258-R263 HydrophobicContact CZ-CB 4.33Å; D259-R263 WeakPolarHBondContact O-CA 3.07Å; D259-R263 PolarHBondContact O-N 3.49Å; A260-R263 WeakPolarHBondContact O-CG 3.24Å; E261-R263 VanDerWaalsContact C-N 3.26Å; E261-R263 PolarHBondContact O-N 3.19Å; R263-V294 HydrophobicContact CB-CG1 3.89Å; R263-V294 HydrophobicContact CB-CG2 3.94Å
264	R	82.5	Confident	86	Confident	130 Å²	130	62.4 Å²	62.4	49%	0.491	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	161.9	-178.6	71.2	-167.6	166.7	162.9	-13.8	111.7	D259 D262	D259-R264 WeakPolarHBondContact CB-O 3.44Å; D259-R264 PolarHBondContact N-O 3.08Å; D259-R264 PolarHBondContact O-N 2.85Å; D262-R264 VanDerWaalsContact C-N 3.32Å; D262-R264 HydrophobicContact CB-CG 3.83Å; D262-R264 VanDerWaalsContact CG-NH2 3.34Å; D262-R264 PolarHBondContact O-N 2.83Å; D262-R264 IonicContact OD1-NH2 2.74Å; D262-R264 IonicContact OD2-CZ 2.74Å; D262-R264 VanDerWaalsContact OD2-CZ 3.3Å; D262-R264 IonicContact OD2-NE 2.63Å; D262-R264 PolarHBondContact OD2-NE 3.37Å; D262-R264 IonicContact OD2-NH2 3.17Å; D262-R264 PolarHBondContact OD2-NH2 3.25Å
265	C	91.8	Very high	85.7	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.054	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	127.8	172	-66.7	0	0	0	0	112.7	W256 H257 C286 E287	W256-C265 HydrophobicContact CE3-CB 4.35Å; H257-C265 CarbonylContact O-C 3.55Å; H257-C265 WeakPolarHBondContact O-CA 3.24Å; C265-C286 HydrophobicContact CB-CB 3.67Å; C265-C286 WeakPolarHBondContact CB-SG 2.97Å; C265-C286 WeakPolarHBondContact SG-CB 3.23Å; C265-C286 CovalentContact SG-SG 2.02Å; C265-C286 PolarHBondContact SG-SG 3.36Å; C265-E287 HydrophobicContact CB-CG 3.63Å; C265-E287 VanDerWaalsContact SG-CG 3.58Å; C265-E287 PolarHBondContact SG-N 3.06Å
266	K	91.4	Very high	85.4	Confident	65 Å²	65	56.1 Å²	56.1	28%	0.283	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	164.1	175.2	-68	179.7	-177.9	172.8	0	110.1	W256 H257 D259 D262	W256-K266 CarbonylContact C-O 3.55Å; W256-K266 WeakPolarHBondContact CA-O 3.18Å; W256-K266 VanDerWaalsContact CE3-C 3.42Å; H257-K266 PolarHBondContact N-O 2.79Å; H257-K266 WeakPolarHBondContact NE2-CB 3.47Å; H257-K266 PolarHBondContact O-N 3.45Å; D259-K266 HydrophobicContact CB-CD 3.85Å; D259-K266 HydrophobicContact CB-CG 4.18Å; D259-K266 VanDerWaalsContact CG-NZ 3.25Å; D259-K266 IonicContact OD1-NZ 3.97Å; D259-K266 WeakPolarHBondContact OD2-CD 3.48Å; D259-K266 WeakPolarHBondContact OD2-CE 3.19Å; D259-K266 IonicContact OD2-NZ 2.75Å; D259-K266 PolarHBondContact OD2-NZ 3.34Å; D262-K266 WeakPolarHBondContact OD2-CE 3.42Å; D262-K266 IonicContact OD2-NZ 3.62Å; D262-K266 PolarHBondContact OD2-NZ 3.27Å
267	I	90.5	Very high	85.2	Confident	83 Å²	83	55.9 Å²	55.9	43%	0.426	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	127.9	172.9	-62.9	173.2	0	0	0	109.1	R255 W256	R255-I267 CarbonylContact O-C 3.2Å; R255-I267 WeakPolarHBondContact O-CA 3.26Å; W256-I267 HydrophobicContact CD2-CG1 4.02Å; W256-I267 HydrophobicContact CE3-CG1 4.06Å; W256-I267 HydrophobicContact CH2-CD1 3.94Å; W256-I267 HydrophobicContact CH2-CG1 3.43Å; W256-I267 VanDerWaalsContact CH2-CG1 3.43Å; W256-I267 HydrophobicContact CZ2-CD1 3.83Å; W256-I267 HydrophobicContact CZ2-CG1 3.38Å; W256-I267 HydrophobicContact CZ3-CG1 3.78Å
268	L	92.5	Very high	85.2	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.4	162.1	172.3	61	0	0	0	107.1	P244 P246 R255 H257 N279	P244-L268 HydrophobicContact CB-CD1 4.39Å; P246-L268 HydrophobicContact CG-CD1 3.95Å; R255-L268 CarbonylContact C-O 3.5Å; R255-L268 WeakPolarHBondContact CA-O 3.45Å; R255-L268 HydrophobicContact CB-CB 4.02Å; R255-L268 HydrophobicContact CB-CD2 4.38Å; R255-L268 HydrophobicContact CB-CG 4.29Å; R255-L268 WeakPolarHBondContact CB-O 2.94Å; R255-L268 PolarHBondContact N-O 2.02Å; R255-L268 PolarHBondContact O-N 2.9Å; H257-L268 HydrophobicContact CB-CB 4.26Å; L268-N279 HydrophobicContact CD2-CB 3.94Å
269	I	90.4	Very high	85.2	Confident	90 Å²	90	56.3 Å²	56.3	46%	0.462	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	118.4	161.4	-60.5	179.8	0	0	0	106.1	P246	P246-I269 WeakPolarHBondContact CB-O 3.38Å
270	Y	90	Very high	85.5	Confident	30 Å²	30	55.3 Å²	55.3	12%	0.118	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.2	-174.4	168.8	-110.7	0	0	0	110.5	P246 D251 L253 R255 G272 C273 G274 N279	P246-Y270 WeakPolarHBondContact O-CD2 3.41Å; D251-Y270 CarbonylContact O-C 3.51Å; L253-Y270 HydrophobicContact CB-CD1 4.42Å; L253-Y270 WeakPolarHBondContact CB-O 3.04Å; L253-Y270 HydrophobicContact CD1-CD1 4.31Å; L253-Y270 PolarHBondContact N-O 3.17Å; L253-Y270 VanDerWaalsContact N-O 3.15Å; L253-Y270 PolarHBondContact O-N 3.27Å; R255-Y270 VanDerWaalsContact CG-CB 3.46Å; R255-Y270 HydrophobicContact CG-CD1 4.12Å; R255-Y270 HydrophobicContact CG-CG 4.08Å; Y270-G272 WeakPolarHBondContact CE1-O 3.34Å; Y270-G272 VanDerWaalsContact CZ-C 3.42Å; Y270-G272 PolarHBondContact O-N 3.43Å; Y270-G272 VanDerWaalsContact OH-C 3.25Å; Y270-G272 PolarHBondContact OH-O 3.22Å; Y270-C273 WeakPolarHBondContact OH-CA 3.24Å; Y270-C273 PolarHBondContact OH-N 3.05Å; Y270-G274 WeakPolarHBondContact CE2-O 3Å; Y270-G274 PolarHBondContact OH-N 2.78Å; Y270-G274 PolarHBondContact OH-O 2.67Å; Y270-N279 WeakPolarHBondContact CD2-ND2 3.45Å; Y270-N279 WeakPolarHBondContact CE2-ND2 3.3Å
271	G	84.6	Confident	86.3	Confident	5 Å²	5	56.7 Å²	56.7	5%	0.052	31%	0.308	C	S	.	.			trans	-60.8	-3.3	-175.3	0	0	0	0	0	116.7	P246 C249 D250 D251 C273	P246-G271 WeakPolarHBondContact O-CA 3.22Å; P246-G271 PolarHBondContact O-N 3.44Å; C249-G271 CarbonylContact C-O 3.48Å; C249-G271 WeakPolarHBondContact CB-O 3.14Å; C249-G271 WeakPolarHBondContact O-CA 3.48Å; D250-G271 PolarHBondContact N-O 3.19Å; D251-G271 VanDerWaalsContact CB-O 3.23Å; D251-G271 WeakPolarHBondContact CB-O 3.37Å; D251-G271 PolarHBondContact N-O 2.95Å; D251-G271 CarbonylContact O-C 2.99Å; D251-G271 WeakPolarHBondContact O-CA 3.03Å; G271-C273 VanDerWaalsContact C-N 3.29Å; G271-C273 PolarHBondContact O-N 3.41Å
272	G	82.2	Confident	87.2	Confident	32 Å²	32	49.8 Å²	49.8	33%	0.33	28%	0.28	S	S	.	.	S	Bend	trans	89.5	-30.5	-176.8	0	0	0	0	0	114.2	Y270	Y270-G272 WeakPolarHBondContact CE1-O 3.34Å; Y270-G272 VanDerWaalsContact CZ-C 3.42Å; Y270-G272 PolarHBondContact O-N 3.43Å; Y270-G272 VanDerWaalsContact OH-C 3.25Å; Y270-G272 PolarHBondContact OH-O 3.22Å
273	C	82.7	Confident	87.8	Confident	46 Å²	46	50.3 Å²	50.3	31%	0.311	28%	0.279	S	S	.	.	S	Bend	trans	-129.7	156.2	175.2	87.7	0	0	0	0	113.1	G247 P248 C249 Y270 G271	G247-C273 WeakPolarHBondContact CA-O 3.46Å; P248-C273 WeakPolarHBondContact CD-O 3.36Å; C249-C273 HydrophobicContact CB-CB 3.8Å; C249-C273 WeakPolarHBondContact CB-SG 3Å; C249-C273 WeakPolarHBondContact SG-CB 3.36Å; C249-C273 CovalentContact SG-SG 2.03Å; C249-C273 PolarHBondContact SG-SG 3.09Å; Y270-C273 WeakPolarHBondContact OH-CA 3.24Å; Y270-C273 PolarHBondContact OH-N 3.05Å; G271-C273 VanDerWaalsContact C-N 3.29Å; G271-C273 PolarHBondContact O-N 3.41Å
274	G	84.6	Confident	88.3	Confident	51 Å²	51	50.1 Å²	50.1	53%	0.526	28%	0.284	S	S	.	.			trans	72	-136.6	179.1	0	0	0	0	0	112.6	Y270	Y270-G274 WeakPolarHBondContact CE2-O 3Å; Y270-G274 PolarHBondContact OH-N 2.78Å; Y270-G274 PolarHBondContact OH-O 2.67Å
275	G	83.3	Confident	88.5	Confident	28 Å²	28	46.9 Å²	46.9	29%	0.289	28%	0.276	S	S	.	.			trans	66.9	-171.3	-174.6	0	0	0	0	0	112.9	E245	E245-G275 WeakPolarHBondContact O-CA 3.19Å
276	N	87.6	Confident	88.5	Confident	32 Å²	32	46.5 Å²	46.5	17%	0.171	27%	0.274	C	S	.	.			trans	-127.9	-169.2	-178.3	66.7	22.4	0	0	0	111.5	E242 T243 E245 N278 N279	E242-N276 WeakPolarHBondContact OE2-CB 2.99Å; T243-N276 PolarHBondContact O-ND2 3.44Å; E245-N276 HydrophobicContact CB-CB 4.48Å; E245-N276 WeakPolarHBondContact CG-ND2 3.46Å; E245-N276 PolarHBondContact N-OD1 3.38Å; E245-N276 PolarHBondContact OE1-ND2 3.33Å; N276-N278 PolarHBondContact O-N 3.34Å; N276-N278 PolarHBondContact OD1-N 2.88Å; N276-N279 WeakPolarHBondContact O-CB 3.35Å
277	S	88	Confident	88.3	Confident	47 Å²	47	46 Å²	46	33%	0.329	27%	0.272	S	S	.	.	S	Bend	trans	-79.9	-13.7	-165.5	-42.4	0	0	0	0	114.3	K239 E242 N279	K239-S277 VanDerWaalsContact CB-CB 3.4Å; K239-S277 CarbonylContact O-C 3.19Å; E242-S277 PolarHBondContact OE1-OG 2.88Å; E242-S277 WeakPolarHBondContact OE2-CA 3.4Å; E242-S277 WeakPolarHBondContact OE2-CB 3.07Å; E242-S277 PolarHBondContact OE2-N 3.42Å; E242-S277 PolarHBondContact OE2-OG 2.78Å; S277-N279 PolarHBondContact O-N 3.35Å
278	N	93.6	Very high	87.8	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	28%	0.276	C	S	.	.	S	Bend	trans	-79.7	53.1	175.1	-159	-2	0	0	0	110.9	K239 C240 E242 H257 F258 N276	K239-N278 WeakPolarHBondContact O-CA 3.44Å; K239-N278 WeakPolarHBondContact O-CB 3.49Å; K239-N278 PolarHBondContact O-N 3.28Å; K239-N278 VanDerWaalsContact O-N 3.16Å; C240-N278 PolarHBondContact O-ND2 3.35Å; E242-N278 HydrophobicContact CB-CB 4.3Å; E242-N278 VanDerWaalsContact O-CB 3.25Å; E242-N278 WeakPolarHBondContact O-CB 3.26Å; E242-N278 PolarHBondContact O-ND2 3.36Å; H257-N278 WeakPolarHBondContact CA-OD1 3.17Å; H257-N278 WeakPolarHBondContact CB-O 3.02Å; F258-N278 PolarHBondContact N-OD1 2.87Å; F258-N278 PolarHBondContact O-ND2 3.26Å; N276-N278 PolarHBondContact O-N 3.34Å; N276-N278 PolarHBondContact OD1-N 2.88Å
279	N	94	Very high	87.4	Confident	32 Å²	32	51.4 Å²	51.4	17%	0.171	29%	0.292	C	S	.	.			trans	-148	88.4	-164.5	-177.1	-6.1	0	0	0	109.4	R255 L268 Y270 N276 S277	R255-N279 WeakPolarHBondContact CB-OD1 3.31Å; R255-N279 WeakPolarHBondContact CD-OD1 3.1Å; R255-N279 WeakPolarHBondContact CG-OD1 3.36Å; L268-N279 HydrophobicContact CD2-CB 3.94Å; Y270-N279 WeakPolarHBondContact CD2-ND2 3.45Å; Y270-N279 WeakPolarHBondContact CE2-ND2 3.3Å; N276-N279 WeakPolarHBondContact O-CB 3.35Å; S277-N279 PolarHBondContact O-N 3.35Å
280	F	93.9	Very high	87.1	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.022	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-105.2	142.5	-174.1	-53.5	-69.5	0	0	0	111.1	R255 W256 S282 I285 C286 K289 C290	R255-F280 CarbonylContact C-O 3.48Å; R255-F280 WeakPolarHBondContact CA-O 3.19Å; R255-F280 WeakPolarHBondContact CD-O 3.39Å; W256-F280 PolarHBondContact N-O 3.01Å; W256-F280 WeakPolarHBondContact O-CB 3.32Å; W256-F280 VanDerWaalsContact O-CD2 3.26Å; W256-F280 WeakPolarHBondContact O-CD2 3.45Å; W256-F280 PolarHBondContact O-N 3.31Å; F280-S282 VanDerWaalsContact C-N 3.25Å; F280-S282 PolarHBondContact O-N 3.15Å; F280-I285 HydrophobicContact CB-CG2 4.19Å; F280-I285 HydrophobicContact CD1-CG2 4.27Å; F280-C286 HydrophobicContact CB-CB 3.9Å; F280-C286 HydrophobicContact CD2-CB 3.45Å; F280-C286 VanDerWaalsContact CD2-CB 3.45Å; F280-C286 VanDerWaalsContact CD2-SG 3.57Å; F280-C286 HydrophobicContact CE2-CB 4.27Å; F280-C286 HydrophobicContact CG-CB 3.88Å; F280-K289 HydrophobicContact CD1-CD 3.85Å; F280-K289 HydrophobicContact CE1-CD 3.48Å; F280-K289 VanDerWaalsContact CE1-CD 3.48Å; F280-K289 HydrophobicContact CZ-CD 4.28Å; F280-C290 VanDerWaalsContact CE2-SG 3.52Å
281	P	90	Very high	86.1	Confident	83 Å²	83	47.7 Å²	47.7	54%	0.539	28%	0.275	S	S	.	.	S	Bend	trans	-74.1	-6.8	-176.9	27.8	-33.6	0	0	0	115.1	I285	P281-I285 HydrophobicContact CG-CD1 3.88Å
282	S	89	Confident	84.7	Confident	38 Å²	38	48.8 Å²	48.8	27%	0.266	28%	0.284	S	S	.	.	S	Bend	trans	-154.6	159.9	172.7	78.4	0	0	0	0	112.2	W256 F280 E284 I285 C286	W256-S282 VanDerWaalsContact CG-C 3.48Å; F280-S282 VanDerWaalsContact C-N 3.25Å; F280-S282 PolarHBondContact O-N 3.15Å; S282-E284 VanDerWaalsContact C-N 3.31Å; S282-E284 PolarHBondContact O-N 3.31Å; S282-I285 PolarHBondContact O-N 2.03Å; S282-I285 WeakPolarHBondContact OG-CG1 3.47Å; S282-I285 PolarHBondContact OG-N 3.23Å; S282-C286 PolarHBondContact O-N 2.99Å; S282-C286 VanDerWaalsContact O-N 3.1Å
283	K	87.2	Confident	83	Confident	87 Å²	87	47.9 Å²	47.9	38%	0.378	27%	0.273	S	S	.	.	H	α-helix	trans	-52.8	-51.2	174.2	-173.1	174.7	-170	-89.1	0	110.9	W256 I285 C286 E287	W256-K283 VanDerWaalsContact CD2-CA 3.44Å; W256-K283 HydrophobicContact CD2-CB 3.52Å; W256-K283 HydrophobicContact CD2-CG 4.09Å; W256-K283 HydrophobicContact CE3-CB 3.62Å; W256-K283 HydrophobicContact CE3-CD 4.17Å; W256-K283 HydrophobicContact CE3-CG 3.63Å; W256-K283 VanDerWaalsContact CG-CA 3.49Å; W256-K283 HydrophobicContact CG-CB 4.13Å; W256-K283 HydrophobicContact CH2-CB 3.94Å; W256-K283 HydrophobicContact CH2-CD 3.68Å; W256-K283 HydrophobicContact CH2-CG 4.01Å; W256-K283 HydrophobicContact CZ2-CB 3.83Å; W256-K283 HydrophobicContact CZ2-CD 4.34Å; W256-K283 HydrophobicContact CZ2-CG 4.41Å; W256-K283 HydrophobicContact CZ3-CB 3.84Å; W256-K283 HydrophobicContact CZ3-CD 3.58Å; W256-K283 HydrophobicContact CZ3-CG 3.59Å; K283-I285 VanDerWaalsContact C-N 3.32Å; K283-I285 PolarHBondContact O-N 3.4Å; K283-C286 CarbonylContact O-C 3.55Å; K283-C286 WeakPolarHBondContact O-CA 3.06Å; K283-C286 WeakPolarHBondContact O-CB 3.4Å; K283-C286 PolarHBondContact O-N 3.47Å; K283-C286 VanDerWaalsContact O-N 3.09Å; K283-E287 WeakPolarHBondContact CE-OE1 3.31Å; K283-E287 HydrophobicContact CG-CG 4.16Å; K283-E287 IonicContact NZ-OE1 3.69Å; K283-E287 PolarHBondContact NZ-OE1 2.86Å; K283-E287 IonicContact NZ-OE2 3.79Å; K283-E287 PolarHBondContact NZ-OE2 2.78Å; K283-E287 WeakPolarHBondContact O-CG 2.95Å; K283-E287 PolarHBondContact O-N 3.45Å
284	E	84.2	Confident	81.2	Confident	146 Å²	146	48.4 Å²	48.4	68%	0.682	28%	0.275	S	S	*	.	H	α-helix	trans	-61.4	-38.4	-176.7	-172.1	177.4	-169.6	0	0	112.4	S282 E287 K288	S282-E284 VanDerWaalsContact C-N 3.31Å; S282-E284 PolarHBondContact O-N 3.31Å; E284-E287 PolarHBondContact O-N 2.8Å; E284-K288 WeakPolarHBondContact O-CB 3.45Å; E284-K288 PolarHBondContact O-N 3.3Å
285	I	87.7	Confident	79	Confident	62 Å²	62	50.7 Å²	50.7	32%	0.318	29%	0.289	S	S	.	.	H	α-helix	trans	-69	-36	176.1	-69.2	166.5	0	0	0	111.3	F280 P281 S282 K283 K289	F280-I285 HydrophobicContact CB-CG2 4.19Å; F280-I285 HydrophobicContact CD1-CG2 4.27Å; P281-I285 HydrophobicContact CG-CD1 3.88Å; S282-I285 PolarHBondContact O-N 2.03Å; S282-I285 WeakPolarHBondContact OG-CG1 3.47Å; S282-I285 PolarHBondContact OG-N 3.23Å; K283-I285 VanDerWaalsContact C-N 3.32Å; K283-I285 PolarHBondContact O-N 3.4Å; I285-K289 HydrophobicContact CG2-CD 4.4Å; I285-K289 WeakPolarHBondContact O-CB 3.47Å; I285-K289 VanDerWaalsContact O-CG 3.3Å; I285-K289 WeakPolarHBondContact O-CG 3.12Å; I285-K289 PolarHBondContact O-N 3.47Å
286	C	92.1	Very high	76.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-50.6	171.5	178.8	0	0	0	0	111.2	W256 F258 C265 F280 S282 K283 K288 K289 C290	W256-C286 HydrophobicContact CB-CB 3.97Å; F258-C286 PolarHBondContact N-SG 3.03Å; F258-C286 VanDerWaalsContact N-SG 3.35Å; C265-C286 HydrophobicContact CB-CB 3.67Å; C265-C286 WeakPolarHBondContact CB-SG 2.97Å; C265-C286 WeakPolarHBondContact SG-CB 3.23Å; C265-C286 CovalentContact SG-SG 2.02Å; C265-C286 PolarHBondContact SG-SG 3.36Å; F280-C286 HydrophobicContact CB-CB 3.9Å; F280-C286 HydrophobicContact CD2-CB 3.45Å; F280-C286 VanDerWaalsContact CD2-CB 3.45Å; F280-C286 VanDerWaalsContact CD2-SG 3.57Å; F280-C286 HydrophobicContact CE2-CB 4.27Å; F280-C286 HydrophobicContact CG-CB 3.88Å; S282-C286 PolarHBondContact O-N 2.99Å; S282-C286 VanDerWaalsContact O-N 3.1Å; K283-C286 CarbonylContact O-C 3.55Å; K283-C286 WeakPolarHBondContact O-CA 3.06Å; K283-C286 WeakPolarHBondContact O-CB 3.4Å; K283-C286 PolarHBondContact O-N 3.47Å; K283-C286 VanDerWaalsContact O-N 3.09Å; C286-K288 PolarHBondContact O-N 3.05Å; C286-K289 PolarHBondContact O-N 3.14Å; C286-K289 VanDerWaalsContact O-N 3.1Å; C286-C290 WeakPolarHBondContact O-CB 3.18Å; C286-C290 PolarHBondContact O-N 2.78Å
287	E	86.5	Confident	74.5	Confident	55 Å²	55	57.7 Å²	57.7	26%	0.257	33%	0.328	S	S	.	.	H	α-helix	trans	-66.9	-40.5	-175.5	-64.8	-171	133.1	0	0	111.5	C265 K283 E284 K289 C290 N291	C265-E287 HydrophobicContact CB-CG 3.63Å; C265-E287 VanDerWaalsContact SG-CG 3.58Å; C265-E287 PolarHBondContact SG-N 3.06Å; K283-E287 WeakPolarHBondContact CE-OE1 3.31Å; K283-E287 HydrophobicContact CG-CG 4.16Å; K283-E287 IonicContact NZ-OE1 3.69Å; K283-E287 PolarHBondContact NZ-OE1 2.86Å; K283-E287 IonicContact NZ-OE2 3.79Å; K283-E287 PolarHBondContact NZ-OE2 2.78Å; K283-E287 WeakPolarHBondContact O-CG 2.95Å; K283-E287 PolarHBondContact O-N 3.45Å; E284-E287 PolarHBondContact O-N 2.8Å; E287-K289 PolarHBondContact O-N 2.82Å; E287-C290 PolarHBondContact O-N 3.36Å; E287-N291 HydrophobicContact CB-CB 4.23Å; E287-N291 VanDerWaalsContact CG-ND2 3.26Å; E287-N291 WeakPolarHBondContact CG-ND2 3.39Å; E287-N291 WeakPolarHBondContact O-CB 3.37Å; E287-N291 PolarHBondContact O-N 3.49Å; E287-N291 PolarHBondContact OE1-ND2 3.19Å; E287-N291 VanDerWaalsContact OE1-ND2 3.1Å
288	K	79.7	Confident	72.9	Confident	115 Å²	115	61.4 Å²	61.4	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-21.9	173.6	-174.9	175.7	177.7	-178.7	0	113.2	D205 E284 C286	D205-K288 IonicContact OD2-NZ 2.61Å; D205-K288 PolarHBondContact OD2-NZ 3.19Å; E284-K288 WeakPolarHBondContact O-CB 3.45Å; E284-K288 PolarHBondContact O-N 3.3Å; C286-K288 PolarHBondContact O-N 3.05Å
289	K	83.4	Confident	71.5	Confident	92 Å²	92	67 Å²	67	40%	0.4	36%	0.359	S	S	.	.	H	α-helix	trans	-98.6	-37.6	177.2	-75.1	-178.2	172.7	-165.9	0	114.1	F280 I285 C286 E287	F280-K289 HydrophobicContact CD1-CD 3.85Å; F280-K289 HydrophobicContact CE1-CD 3.48Å; F280-K289 VanDerWaalsContact CE1-CD 3.48Å; F280-K289 HydrophobicContact CZ-CD 4.28Å; I285-K289 HydrophobicContact CG2-CD 4.4Å; I285-K289 WeakPolarHBondContact O-CB 3.47Å; I285-K289 VanDerWaalsContact O-CG 3.3Å; I285-K289 WeakPolarHBondContact O-CG 3.12Å; I285-K289 PolarHBondContact O-N 3.47Å; C286-K289 PolarHBondContact O-N 3.14Å; C286-K289 VanDerWaalsContact O-N 3.1Å; E287-K289 PolarHBondContact O-N 2.82Å
290	C	84.2	Confident	70.5	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.007	35%	0.353	C	S	.	.	H	α-helix	trans	-117.9	-35.6	-164	-50.6	0	0	0	0	114.3	C240 F258 F280 C286 E287 A292	C240-C290 HydrophobicContact CB-CB 3.7Å; C240-C290 WeakPolarHBondContact CB-SG 3.22Å; C240-C290 VanDerWaalsContact SG-CA 3.56Å; C240-C290 WeakPolarHBondContact SG-CB 3.49Å; C240-C290 CovalentContact SG-SG 2.03Å; C240-C290 PolarHBondContact SG-SG 2.83Å; F258-C290 HydrophobicContact CB-CB 3.47Å; F258-C290 VanDerWaalsContact CB-CB 3.47Å; F258-C290 HydrophobicContact CD1-CB 4.21Å; F258-C290 HydrophobicContact CD2-CB 3.33Å; F258-C290 HydrophobicContact CE2-CB 4.07Å; F258-C290 HydrophobicContact CG-CB 3.4Å; F258-C290 VanDerWaalsContact CG-CB 3.4Å; F280-C290 VanDerWaalsContact CE2-SG 3.52Å; C286-C290 WeakPolarHBondContact O-CB 3.18Å; C286-C290 PolarHBondContact O-N 2.78Å; E287-C290 PolarHBondContact O-N 3.36Å; C290-A292 PolarHBondContact O-N 3.31Å; C290-A292 VanDerWaalsContact O-N 3.14Å
291	N	69.9	Low	69.1	Low	41 Å²	41	68.8 Å²	68.8	22%	0.219	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-68.9	-11.4	177	-72.3	13.9	0	0	0	112.5	F258 E287 A293 V294	F258-N291 WeakPolarHBondContact CE2-OD1 3.33Å; E287-N291 HydrophobicContact CB-CB 4.23Å; E287-N291 VanDerWaalsContact CG-ND2 3.26Å; E287-N291 WeakPolarHBondContact CG-ND2 3.39Å; E287-N291 WeakPolarHBondContact O-CB 3.37Å; E287-N291 PolarHBondContact O-N 3.49Å; E287-N291 PolarHBondContact OE1-ND2 3.19Å; E287-N291 VanDerWaalsContact OE1-ND2 3.1Å; N291-A293 PolarHBondContact O-N 3.46Å; N291-A293 VanDerWaalsContact O-N 3.09Å; N291-V294 WeakPolarHBondContact O-CB 3.14Å; N291-V294 WeakPolarHBondContact O-CG2 3.5Å; N291-V294 PolarHBondContact O-N 3.29Å
292	A	54.8	Low	67.9	Low	29 Å²	29	70.9 Å²	70.9	24%	0.24	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-58.6	-25.4	-172.2	0	0	0	0	0	114	Y234 C290	Y234-A292 HydrophobicContact CD1-CB 3.55Å; Y234-A292 HydrophobicContact CD2-CB 3.44Å; Y234-A292 VanDerWaalsContact CD2-CB 3.44Å; Y234-A292 VanDerWaalsContact CD2-O 3.22Å; Y234-A292 WeakPolarHBondContact CD2-O 3.47Å; Y234-A292 HydrophobicContact CE1-CB 3.8Å; Y234-A292 HydrophobicContact CE2-CB 3.66Å; Y234-A292 HydrophobicContact CG-CB 3.36Å; C290-A292 PolarHBondContact O-N 3.31Å; C290-A292 VanDerWaalsContact O-N 3.14Å
293	A	47.2	Very low	66.3	Low	12 Å²	12	78.9 Å²	78.9	10%	0.099	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-81.8	-19.2	174.5	0	0	0	0	0	114.7	Y234 L236 N291 A295	Y234-A293 VanDerWaalsContact O-CB 3.3Å; Y234-A293 WeakPolarHBondContact O-CB 3.39Å; L236-A293 HydrophobicContact CD1-CB 3.47Å; L236-A293 VanDerWaalsContact CD1-CB 3.47Å; N291-A293 PolarHBondContact O-N 3.46Å; N291-A293 VanDerWaalsContact O-N 3.09Å; A293-A295 VanDerWaalsContact C-N 3.29Å; A293-A295 PolarHBondContact O-N 2.97Å
294	V	45	Very low	65.3	Low	57 Å²	57	76 Å²	76	35%	0.345	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.2	-164.2	-173.3	0	0	0	0	112.5	F258 R263 N291 A296	F258-V294 HydrophobicContact CE2-CG2 4.27Å; F258-V294 HydrophobicContact CZ-CG2 4.17Å; R263-V294 HydrophobicContact CB-CG1 3.89Å; R263-V294 HydrophobicContact CB-CG2 3.94Å; N291-V294 WeakPolarHBondContact O-CB 3.14Å; N291-V294 WeakPolarHBondContact O-CG2 3.5Å; N291-V294 PolarHBondContact O-N 3.29Å; V294-A296 VanDerWaalsContact C-N 3.34Å; V294-A296 PolarHBondContact O-N 2.63Å
295	A	38.6	Very low	64.5	Low	100 Å²	100	73.3 Å²	73.3	83%	0.826	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.4	-179.5	0	0	0	0	0	114.6	A293	A293-A295 VanDerWaalsContact C-N 3.29Å; A293-A295 PolarHBondContact O-N 2.97Å
296	A	36	Very low	64.1	Low	59 Å²	59	71.5 Å²	71.5	49%	0.488	38%	0.384	S	S	.	.			trans	-102.6	96.2	-177.1	0	0	0	0	0	111.2	V294 R298 F299	V294-A296 VanDerWaalsContact C-N 3.34Å; V294-A296 PolarHBondContact O-N 2.63Å; A296-R298 PolarHBondContact O-N 2.8Å; A296-F299 WeakPolarHBondContact O-CE2 3.23Å
297	N	39.1	Very low	63.4	Low	147 Å²	147	73 Å²	73	79%	0.786	39%	0.392	S	S	*	.			trans	-77.8	45.8	-173.4	-161.1	36.8	0	0	0	114.2
298	R	55.8	Low	62.9	Low	125 Å²	125	73.5 Å²	73.5	47%	0.472	40%	0.399	S	S	.	.			trans	-140.9	84.2	-175.6	-68.7	-176.5	176.3	160.2	-1.8	111.5	A296	A296-R298 PolarHBondContact O-N 2.8Å
299	F	63.1	Low	62.4	Low	120 Å²	120	71.1 Å²	71.1	53%	0.526	39%	0.392	S	S	.	.			trans	-128	147.6	176.4	-66.3	-75.5	0	0	0	111.3	A296	A296-F299 WeakPolarHBondContact O-CE2 3.23Å
300	C	73.2	Confident	61.2	Low	6 Å²	6	76.7 Å²	76.7	4%	0.041	42%	0.419	C	S	.	.			trans	-80.7	152.1	170.6	-61.2	0	0	0	0	111	D302 W303 S304 C338	C300-D302 VanDerWaalsContact C-N 3.27Å; C300-D302 PolarHBondContact O-N 2.91Å; C300-W303 PolarHBondContact O-N 2.73Å; C300-W303 VanDerWaalsContact O-N 3.16Å; C300-S304 VanDerWaalsContact CB-O 3.24Å; C300-S304 WeakPolarHBondContact CB-O 3.45Å; C300-S304 VanDerWaalsContact CB-OG 3.29Å; C300-S304 WeakPolarHBondContact CB-OG 3.21Å; C300-S304 PolarHBondContact SG-O 2.87Å; C300-C338 HydrophobicContact CB-CB 3.69Å; C300-C338 WeakPolarHBondContact CB-SG 3.32Å; C300-C338 WeakPolarHBondContact SG-CA 3.3Å; C300-C338 WeakPolarHBondContact SG-CB 3.28Å; C300-C338 CovalentContact SG-SG 2.03Å; C300-C338 PolarHBondContact SG-SG 2.91Å
301	P	65.5	Low	59.9	Low	70 Å²	70	82 Å²	82	46%	0.455	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.7	-178.3	-26.4	35.3	0	0	0	113.9	W303 F329	P301-W303 PolarHBondContact O-N 3.19Å; P301-F329 HydrophobicContact CG-CD1 4.26Å; P301-F329 HydrophobicContact CG-CD2 3.63Å; P301-F329 HydrophobicContact CG-CE1 4.07Å; P301-F329 HydrophobicContact CG-CE2 3.42Å; P301-F329 VanDerWaalsContact CG-CE2 3.42Å; P301-F329 HydrophobicContact CG-CG 4.05Å; P301-F329 HydrophobicContact CG-CZ 3.67Å
302	D	62.8	Low	59.6	Low	126 Å²	126	82.3 Å²	82.3	67%	0.674	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	20.2	-175.7	-47	-44.9	0	0	0	112.6	C300 S304	C300-D302 VanDerWaalsContact C-N 3.27Å; C300-D302 PolarHBondContact O-N 2.91Å; D302-S304 PolarHBondContact O-N 3.23Å
303	W	57.1	Low	60.4	Low	207 Å²	207	85 Å²	85	78%	0.784	48%	0.478	S	S	*	.	S	Bend	trans	57.9	10.5	-173.9	-57.7	83.2	0	0	0	115.6	C300 P301	C300-W303 PolarHBondContact O-N 2.73Å; C300-W303 VanDerWaalsContact O-N 3.16Å; P301-W303 PolarHBondContact O-N 3.19Å
304	S	66.4	Low	61.5	Low	27 Å²	27	85.6 Å²	85.6	19%	0.189	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-67.6	153.5	172	56.8	0	0	0	0	111.8	C300 D302	C300-S304 VanDerWaalsContact CB-O 3.24Å; C300-S304 WeakPolarHBondContact CB-O 3.45Å; C300-S304 VanDerWaalsContact CB-OG 3.29Å; C300-S304 WeakPolarHBondContact CB-OG 3.21Å; C300-S304 PolarHBondContact SG-O 2.87Å; D302-S304 PolarHBondContact O-N 3.23Å
305	S	67.5	Low	63.1	Low	89 Å²	89	86.1 Å²	86.1	62%	0.622	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-69.7	134.1	174.3	52.1	0	0	0	0	110.8
306	V	78.6	Confident	65.1	Low	23 Å²	23	85.1 Å²	85.1	14%	0.139	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-61.3	134.4	165.1	179.9	0	0	0	0	108.8	T308 T314 Y336	V306-T308 PolarHBondContact O-N 3.23Å; V306-T314 HydrophobicContact CG1-CG2 3.79Å; V306-Y336 HydrophobicContact CG1-CG 4.19Å
307	L	77.1	Confident	67.5	Low	31 Å²	31	83 Å²	83	16%	0.162	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-68.7	123.8	176.9	-178.3	65.7	0	0	0	110.8	F315 P323 Y326 C337	L307-F315 HydrophobicContact CB-CB 4.41Å; L307-F315 HydrophobicContact CD2-CB 4.15Å; L307-F315 HydrophobicContact CD2-CD1 4.36Å; L307-F315 HydrophobicContact CD2-CD2 3.87Å; L307-F315 HydrophobicContact CD2-CE2 4.33Å; L307-F315 HydrophobicContact CD2-CG 3.87Å; L307-F315 HydrophobicContact CG-CB 4.29Å; L307-F315 HydrophobicContact CG-CD2 3.75Å; L307-F315 HydrophobicContact CG-CE2 4.34Å; L307-F315 HydrophobicContact CG-CG 4.14Å; L307-F315 PolarHBondContact O-N 2.7Å; L307-P323 HydrophobicContact CD2-CG 3.78Å; L307-Y326 HydrophobicContact CB-CD1 3.95Å; L307-Y326 HydrophobicContact CB-CE1 3.88Å; L307-Y326 HydrophobicContact CD1-CE1 4.08Å; L307-Y326 HydrophobicContact CD1-CE2 4.45Å; L307-Y326 HydrophobicContact CD2-CD1 4.26Å; L307-Y326 HydrophobicContact CD2-CD2 4.39Å; L307-Y326 HydrophobicContact CD2-CE1 4.43Å; L307-Y326 HydrophobicContact CD2-CG 4.27Å; L307-Y326 HydrophobicContact CG-CE1 4.35Å; L307-C337 HydrophobicContact CB-CB 4.02Å; L307-C337 WeakPolarHBondContact CB-O 3.4Å; L307-C337 HydrophobicContact CD2-CB 4.21Å; L307-C337 PolarHBondContact N-O 3.36Å
308	T	75	Confident	69.5	Low	67 Å²	67	80.1 Å²	80.1	41%	0.411	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-112.6	158.7	169.9	59	0	0	0	0	111.1	V306 G312 V313 T314	V306-T308 PolarHBondContact O-N 3.23Å; T308-G312 WeakPolarHBondContact CG2-O 3Å; T308-V313 CarbonylContact C-O 3.58Å; T308-V313 WeakPolarHBondContact CA-O 3.04Å; T308-V313 WeakPolarHBondContact CB-O 3.47Å; T308-T314 HydrophobicContact CG2-CG2 4.03Å
309	D	70.2	Confident	70.6	Confident	65 Å²	65	78.7 Å²	78.7	35%	0.348	43%	0.427	S	S	.	.			trans	-80.1	-178.4	164.2	65.7	30.8	0	0	0	112.3	T311 G312 V313 F315	D309-T311 PolarHBondContact O-N 3.11Å; D309-T311 VanDerWaalsContact O-N 3.16Å; D309-T311 WeakPolarHBondContact OD1-CA 3.27Å; D309-T311 WeakPolarHBondContact OD1-CB 3.23Å; D309-T311 PolarHBondContact OD1-N 3.23Å; D309-T311 PolarHBondContact OD1-OG1 2.87Å; D309-G312 PolarHBondContact O-N 2.82Å; D309-G312 PolarHBondContact OD1-N 3.16Å; D309-V313 PolarHBondContact N-O 2.8Å; D309-V313 PolarHBondContact OD1-N 3.1Å; D309-V313 VanDerWaalsContact OD1-N 3.11Å; D309-F315 HydrophobicContact CB-CE2 3.91Å
310	E	58	Low	71.2	Confident	208 Å²	208	79.9 Å²	79.9	97%	0.972	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.3	179.8	-60.8	179.5	163.7	0	0	113.5
311	T	57.5	Low	71.6	Confident	114 Å²	114	86.2 Å²	86.2	70%	0.699	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-1	176	73.1	0	0	0	0	113	D309 V313	D309-T311 PolarHBondContact O-N 3.11Å; D309-T311 VanDerWaalsContact O-N 3.16Å; D309-T311 WeakPolarHBondContact OD1-CA 3.27Å; D309-T311 WeakPolarHBondContact OD1-CB 3.23Å; D309-T311 PolarHBondContact OD1-N 3.23Å; D309-T311 PolarHBondContact OD1-OG1 2.87Å; T311-V313 VanDerWaalsContact C-N 3.32Å; T311-V313 WeakPolarHBondContact OG1-CG2 3.1Å
312	G	62.9	Low	72.6	Confident	47 Å²	47	84 Å²	84	49%	0.485	46%	0.457	S	S	.	.	S	Bend	trans	81.2	7.2	-176	0	0	0	0	0	114.2	T308 D309	T308-G312 WeakPolarHBondContact CG2-O 3Å; D309-G312 PolarHBondContact O-N 2.82Å; D309-G312 PolarHBondContact OD1-N 3.16Å
313	V	72.4	Confident	73.6	Confident	85 Å²	85	80.5 Å²	80.5	52%	0.515	44%	0.441	S	S	.	.			trans	-80	133.2	176.7	176.5	0	0	0	0	109.5	T308 D309 T311	T308-V313 CarbonylContact C-O 3.58Å; T308-V313 WeakPolarHBondContact CA-O 3.04Å; T308-V313 WeakPolarHBondContact CB-O 3.47Å; D309-V313 PolarHBondContact N-O 2.8Å; D309-V313 PolarHBondContact OD1-N 3.1Å; D309-V313 VanDerWaalsContact OD1-N 3.11Å; T311-V313 VanDerWaalsContact C-N 3.32Å; T311-V313 WeakPolarHBondContact OG1-CG2 3.1Å
314	T	69.7	Low	74.3	Confident	24 Å²	24	79.1 Å²	79.1	15%	0.147	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-70.7	134.3	-177.8	47.5	0	0	0	0	112.1	V306 T308 E316 Y336	V306-T314 HydrophobicContact CG1-CG2 3.79Å; T308-T314 HydrophobicContact CG2-CG2 4.03Å; T314-E316 PolarHBondContact O-N 3.16Å; T314-Y336 HydrophobicContact CG2-CD1 4.44Å
315	F	78.7	Confident	74.8	Confident	69 Å²	69	78.3 Å²	78.3	30%	0.303	44%	0.444	S	S	.	.			trans	-64.6	102.5	171.9	-93.4	-101.6	0	0	0	110.7	L307 D309 C317 Y336 C337	L307-F315 HydrophobicContact CB-CB 4.41Å; L307-F315 HydrophobicContact CD2-CB 4.15Å; L307-F315 HydrophobicContact CD2-CD1 4.36Å; L307-F315 HydrophobicContact CD2-CD2 3.87Å; L307-F315 HydrophobicContact CD2-CE2 4.33Å; L307-F315 HydrophobicContact CD2-CG 3.87Å; L307-F315 HydrophobicContact CG-CB 4.29Å; L307-F315 HydrophobicContact CG-CD2 3.75Å; L307-F315 HydrophobicContact CG-CE2 4.34Å; L307-F315 HydrophobicContact CG-CG 4.14Å; L307-F315 PolarHBondContact O-N 2.7Å; D309-F315 HydrophobicContact CB-CE2 3.91Å; F315-C317 PolarHBondContact O-N 2.88Å; F315-Y336 WeakPolarHBondContact O-CA 3.41Å; F315-C337 HydrophobicContact CB-CB 4.15Å; F315-C337 PolarHBondContact O-N 3.25Å; F315-C337 VanDerWaalsContact O-N 3.14Å
316	E	81.4	Confident	75.7	Confident	78 Å²	78	77.4 Å²	77.4	36%	0.364	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-73.6	114	178.6	-173	-173.6	-145.9	0	0	111.3	T314 L318 T319 K320 G335	T314-E316 PolarHBondContact O-N 3.16Å; E316-L318 HydrophobicContact CG-CB 4.33Å; E316-T319 PolarHBondContact O-OG1 3.26Å; E316-T319 WeakPolarHBondContact OE2-CB 3.15Å; E316-T319 WeakPolarHBondContact OE2-CG2 3.37Å; E316-T319 PolarHBondContact OE2-OG1 3.41Å; E316-K320 PolarHBondContact O-N 2.86Å; E316-K320 VanDerWaalsContact O-N 3.16Å; E316-G335 CarbonylContact C-O 3.5Å; E316-G335 VanDerWaalsContact CA-O 3.25Å; E316-G335 WeakPolarHBondContact CA-O 3.3Å
317	C	86.2	Confident	76	Confident	15 Å²	15	82.2 Å²	82.2	10%	0.101	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-6	-173.9	75.6	0	0	0	0	114.8	F315 K320 C322 C328 G335 Y336	F315-C317 PolarHBondContact O-N 2.88Å; C317-K320 CarbonylContact C-O 3.58Å; C317-K320 VanDerWaalsContact CA-O 3.29Å; C317-K320 WeakPolarHBondContact CA-O 3.31Å; C317-C322 WeakPolarHBondContact CB-SG 3.43Å; C317-C328 HydrophobicContact CB-CB 3.48Å; C317-C328 VanDerWaalsContact CB-CB 3.48Å; C317-C328 WeakPolarHBondContact CB-SG 3.47Å; C317-C328 WeakPolarHBondContact SG-CA 3.46Å; C317-C328 WeakPolarHBondContact SG-CB 3.47Å; C317-C328 CovalentContact SG-SG 2.03Å; C317-C328 PolarHBondContact SG-SG 3.21Å; C317-G335 PolarHBondContact N-O 3.25Å; C317-Y336 PolarHBondContact SG-N 2.97Å; C317-Y336 PolarHBondContact SG-O 2.86Å; C317-Y336 VanDerWaalsContact SG-O 3.42Å
318	L	81.5	Confident	76.4	Confident	86 Å²	86	83.4 Å²	83.4	45%	0.45	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.3	170.8	-70.6	171.4	0	0	0	112.3	E316 I330 N333	E316-L318 HydrophobicContact CG-CB 4.33Å; L318-I330 HydrophobicContact CD2-CD1 3.72Å; L318-I330 HydrophobicContact CD2-CG1 3.98Å; L318-N333 WeakPolarHBondContact CD1-O 3.45Å
319	T	77.3	Confident	76.9	Confident	96 Å²	96	83.8 Å²	83.8	59%	0.589	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-21.5	-177.6	56.7	0	0	0	0	113.6	E316	E316-T319 PolarHBondContact O-OG1 3.26Å; E316-T319 WeakPolarHBondContact OE2-CB 3.15Å; E316-T319 WeakPolarHBondContact OE2-CG2 3.37Å; E316-T319 PolarHBondContact OE2-OG1 3.41Å
320	K	77	Confident	77.2	Confident	145 Å²	145	85 Å²	85	63%	0.63	46%	0.458	S	S	*	.	S	Bend	trans	-136.6	142.4	176.5	-61.9	177.3	-174.4	171.2	0	111.4	E316 C317	E316-K320 PolarHBondContact O-N 2.86Å; E316-K320 VanDerWaalsContact O-N 3.16Å; C317-K320 CarbonylContact C-O 3.58Å; C317-K320 VanDerWaalsContact CA-O 3.29Å; C317-K320 WeakPolarHBondContact CA-O 3.31Å
321	T	81.2	Confident	77.4	Confident	139 Å²	139	78.2 Å²	78.2	85%	0.853	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-65.5	137.7	173.7	-46.9	0	0	0	0	110.9
322	C	87.3	Confident	78.2	Confident	22 Å²	22	76 Å²	76	15%	0.149	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-64.3	148	176.7	-65.2	0	0	0	0	112.9	C317 C337	C317-C322 WeakPolarHBondContact CB-SG 3.43Å; C322-C337 WeakPolarHBondContact CA-SG 3.49Å; C322-C337 HydrophobicContact CB-CB 3.88Å; C322-C337 WeakPolarHBondContact CB-SG 3.44Å; C322-C337 WeakPolarHBondContact SG-CA 3.23Å; C322-C337 WeakPolarHBondContact SG-CB 3.42Å; C322-C337 CovalentContact SG-SG 2.04Å; C322-C337 PolarHBondContact SG-SG 2.66Å
323	P	82.8	Confident	78.6	Confident	54 Å²	54	81.4 Å²	81.4	35%	0.351	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-61.2	161.2	171.4	-24.7	36.4	0	0	0	113.4	L307 G325 Y326	L307-P323 HydrophobicContact CD2-CG 3.78Å; P323-G325 PolarHBondContact O-N 2.79Å; P323-Y326 HydrophobicContact CB-CD2 4.48Å; P323-Y326 WeakPolarHBondContact O-CB 3.46Å; P323-Y326 PolarHBondContact O-N 2.7Å
324	L	71.1	Confident	78.6	Confident	177 Å²	177	81.8 Å²	81.8	93%	0.927	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	137.4	171.3	-74.4	164.2	0	0	0	110.8	Y326	L324-Y326 VanDerWaalsContact C-N 3.34Å
325	G	77	Confident	79.2	Confident	10 Å²	10	80.7 Å²	80.7	10%	0.103	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-2.3	-172.7	0	0	0	0	0	115	P323 N340	P323-G325 PolarHBondContact O-N 2.79Å; G325-N340 PolarHBondContact O-N 3.24Å
326	Y	87.9	Confident	79.6	Confident	70 Å²	70	78.4 Å²	78.4	28%	0.275	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151	179.2	-66.4	-99.8	0	0	0	112.5	L307 P323 L324 C338 A339	L307-Y326 HydrophobicContact CB-CD1 3.95Å; L307-Y326 HydrophobicContact CB-CE1 3.88Å; L307-Y326 HydrophobicContact CD1-CE1 4.08Å; L307-Y326 HydrophobicContact CD1-CE2 4.45Å; L307-Y326 HydrophobicContact CD2-CD1 4.26Å; L307-Y326 HydrophobicContact CD2-CD2 4.39Å; L307-Y326 HydrophobicContact CD2-CE1 4.43Å; L307-Y326 HydrophobicContact CD2-CG 4.27Å; L307-Y326 HydrophobicContact CG-CE1 4.35Å; P323-Y326 HydrophobicContact CB-CD2 4.48Å; P323-Y326 WeakPolarHBondContact O-CB 3.46Å; P323-Y326 PolarHBondContact O-N 2.7Å; L324-Y326 VanDerWaalsContact C-N 3.34Å; Y326-C338 CarbonylContact C-O 3.44Å; Y326-C338 WeakPolarHBondContact CA-O 3.19Å; Y326-C338 WeakPolarHBondContact CB-O 3.22Å; Y326-C338 VanDerWaalsContact CD1-C 3.48Å; Y326-A339 HydrophobicContact CD1-CB 4.31Å; Y326-A339 HydrophobicContact CE1-CB 4.02Å
327	K	84.3	Confident	79.9	Confident	124 Å²	124	74.7 Å²	74.7	54%	0.539	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.9	-177.8	176.9	174.4	176.6	-176.5	0	109.9	C338 N340	K327-C338 PolarHBondContact N-O 2.97Å; K327-C338 PolarHBondContact O-N 2.86Å; K327-N340 HydrophobicContact CB-CB 3.75Å; K327-N340 WeakPolarHBondContact CD-OD1 3.2Å
328	C	84.2	Confident	79.9	Confident	56 Å²	56	74.4 Å²	74.4	38%	0.378	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	127.7	178.2	-178.5	0	0	0	0	110.8	C317	C317-C328 HydrophobicContact CB-CB 3.48Å; C317-C328 VanDerWaalsContact CB-CB 3.48Å; C317-C328 WeakPolarHBondContact CB-SG 3.47Å; C317-C328 WeakPolarHBondContact SG-CA 3.46Å; C317-C328 WeakPolarHBondContact SG-CB 3.47Å; C317-C328 CovalentContact SG-SG 2.03Å; C317-C328 PolarHBondContact SG-SG 3.21Å
329	F	85.6	Confident	79.8	Confident	76 Å²	76	71.1 Å²	71.1	33%	0.333	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.8	169.2	-179.6	-104.9	0	0	0	109.8	P301 G335 Y336	P301-F329 HydrophobicContact CG-CD1 4.26Å; P301-F329 HydrophobicContact CG-CD2 3.63Å; P301-F329 HydrophobicContact CG-CE1 4.07Å; P301-F329 HydrophobicContact CG-CE2 3.42Å; P301-F329 VanDerWaalsContact CG-CE2 3.42Å; P301-F329 HydrophobicContact CG-CG 4.05Å; P301-F329 HydrophobicContact CG-CZ 3.67Å; F329-G335 CarbonylContact O-C 3.56Å; F329-G335 VanDerWaalsContact O-CA 3.24Å; F329-G335 WeakPolarHBondContact O-CA 3.36Å; F329-Y336 PolarHBondContact N-O 2.89Å; F329-Y336 PolarHBondContact O-N 3.29Å
330	I	77.9	Confident	79.2	Confident	90 Å²	90	67.6 Å²	67.6	46%	0.462	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.5	-175.9	-58.6	166.5	0	0	0	108.9	L318 G332	L318-I330 HydrophobicContact CD2-CD1 3.72Å; L318-I330 HydrophobicContact CD2-CG1 3.98Å; I330-G332 WeakPolarHBondContact CG2-O 3.14Å
331	S	62.1	Low	78.2	Confident	66 Å²	66	63.7 Å²	63.7	46%	0.462	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	97.9	177.9	-168.1	0	0	0	0	109.2	N333 E334	S331-N333 PolarHBondContact O-N 2.82Å; S331-E334 CarbonylContact C-O 3.55Å; S331-E334 PolarHBondContact N-O 3.29Å; S331-E334 PolarHBondContact O-N 2.87Å
332	G	72.9	Confident	76.8	Confident	67 Å²	67	63.6 Å²	63.6	69%	0.691	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	-119.9	-171.2	0	0	0	0	0	111.5	I330	I330-G332 WeakPolarHBondContact CG2-O 3.14Å
333	N	71.5	Confident	75.2	Confident	160 Å²	160	66.6 Å²	66.6	86%	0.856	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-5.7	179.5	-83.9	17	0	0	0	114.1	L318 S331	L318-N333 WeakPolarHBondContact CD1-O 3.45Å; S331-N333 PolarHBondContact O-N 2.82Å
334	E	73.3	Confident	73.5	Confident	94 Å²	94	65.7 Å²	65.7	44%	0.439	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	146.4	177.2	-72.2	175	-130.4	0	0	109.4	S331 Y336	S331-E334 CarbonylContact C-O 3.55Å; S331-E334 PolarHBondContact N-O 3.29Å; S331-E334 PolarHBondContact O-N 2.87Å; E334-Y336 HydrophobicContact CB-CE1 4.03Å; E334-Y336 HydrophobicContact CB-CE2 4.36Å; E334-Y336 WeakPolarHBondContact CB-OH 3.05Å; E334-Y336 PolarHBondContact OE2-OH 3.17Å; E334-Y336 VanDerWaalsContact OE2-OH 3.11Å
335	G	82.3	Confident	72.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.6	177.8	0	0	0	0	0	111.5	E316 C317 F329	E316-G335 CarbonylContact C-O 3.5Å; E316-G335 VanDerWaalsContact CA-O 3.25Å; E316-G335 WeakPolarHBondContact CA-O 3.3Å; C317-G335 PolarHBondContact N-O 3.25Å; F329-G335 CarbonylContact O-C 3.56Å; F329-G335 VanDerWaalsContact O-CA 3.24Å; F329-G335 WeakPolarHBondContact O-CA 3.36Å
336	Y	86.1	Confident	70.7	Confident	21 Å²	21	72.2 Å²	72.2	8%	0.082	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	154.3	-171.9	-30.6	-89.5	0	0	0	111.8	V306 T314 F315 C317 F329 E334	V306-Y336 HydrophobicContact CG1-CG 4.19Å; T314-Y336 HydrophobicContact CG2-CD1 4.44Å; F315-Y336 WeakPolarHBondContact O-CA 3.41Å; C317-Y336 PolarHBondContact SG-N 2.97Å; C317-Y336 PolarHBondContact SG-O 2.86Å; C317-Y336 VanDerWaalsContact SG-O 3.42Å; F329-Y336 PolarHBondContact N-O 2.89Å; F329-Y336 PolarHBondContact O-N 3.29Å; E334-Y336 HydrophobicContact CB-CE1 4.03Å; E334-Y336 HydrophobicContact CB-CE2 4.36Å; E334-Y336 WeakPolarHBondContact CB-OH 3.05Å; E334-Y336 PolarHBondContact OE2-OH 3.17Å; E334-Y336 VanDerWaalsContact OE2-OH 3.11Å
337	C	88.9	Confident	68.4	Low	1 Å²	1	71.6 Å²	71.6	1%	0.007	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	121.7	176.6	-64.4	0	0	0	0	112.3	L307 F315 C322	L307-C337 HydrophobicContact CB-CB 4.02Å; L307-C337 WeakPolarHBondContact CB-O 3.4Å; L307-C337 HydrophobicContact CD2-CB 4.21Å; L307-C337 PolarHBondContact N-O 3.36Å; F315-C337 HydrophobicContact CB-CB 4.15Å; F315-C337 PolarHBondContact O-N 3.25Å; F315-C337 VanDerWaalsContact O-N 3.14Å; C322-C337 WeakPolarHBondContact CA-SG 3.49Å; C322-C337 HydrophobicContact CB-CB 3.88Å; C322-C337 WeakPolarHBondContact CB-SG 3.44Å; C322-C337 WeakPolarHBondContact SG-CA 3.23Å; C322-C337 WeakPolarHBondContact SG-CB 3.42Å; C322-C337 CovalentContact SG-SG 2.04Å; C322-C337 PolarHBondContact SG-SG 2.66Å
338	C	85.7	Confident	66.5	Low	8 Å²	8	68.8 Å²	68.8	5%	0.054	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	147.6	178.6	-72.2	0	0	0	0	111	C300 Y326 K327 N340	C300-C338 HydrophobicContact CB-CB 3.69Å; C300-C338 WeakPolarHBondContact CB-SG 3.32Å; C300-C338 WeakPolarHBondContact SG-CA 3.3Å; C300-C338 WeakPolarHBondContact SG-CB 3.28Å; C300-C338 CovalentContact SG-SG 2.03Å; C300-C338 PolarHBondContact SG-SG 2.91Å; Y326-C338 CarbonylContact C-O 3.44Å; Y326-C338 WeakPolarHBondContact CA-O 3.19Å; Y326-C338 WeakPolarHBondContact CB-O 3.22Å; Y326-C338 VanDerWaalsContact CD1-C 3.48Å; K327-C338 PolarHBondContact N-O 2.97Å; K327-C338 PolarHBondContact O-N 2.86Å; C338-N340 PolarHBondContact O-N 3.11Å
339	A	78.8	Confident	64.1	Low	18 Å²	18	71.4 Å²	71.4	15%	0.149	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	132.2	-179.5	0	0	0	0	0	110.9	Y326	Y326-A339 HydrophobicContact CD1-CB 4.31Å; Y326-A339 HydrophobicContact CE1-CB 4.02Å
340	N	65.9	Low	61.5	Low	22 Å²	22	75.7 Å²	75.7	12%	0.118	46%	0.456	C	S	.	.			trans	-106.6	108.4	-171.8	-174.3	57.7	0	0	0	111.8	G325 K327 C338 D342 T343 N344	G325-N340 PolarHBondContact O-N 3.24Å; K327-N340 HydrophobicContact CB-CB 3.75Å; K327-N340 WeakPolarHBondContact CD-OD1 3.2Å; C338-N340 PolarHBondContact O-N 3.11Å; N340-D342 PolarHBondContact O-N 3.3Å; N340-T343 WeakPolarHBondContact CB-OG1 3.47Å; N340-T343 PolarHBondContact ND2-OG1 3.49Å; N340-T343 PolarHBondContact O-N 3.27Å; N340-T343 PolarHBondContact O-OG1 3.04Å; N340-T343 VanDerWaalsContact O-OG1 3.06Å; N340-N344 PolarHBondContact O-N 2.64Å
341	A	56.1	Low	59.2	Low	62 Å²	62	78.9 Å²	78.9	51%	0.512	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-57.8	-32.6	-172.9	0	0	0	0	0	113.6	T343	A341-T343 PolarHBondContact O-N 3.16Å; A341-T343 VanDerWaalsContact O-N 3.1Å
342	D	52.2	Low	57.9	Low	137 Å²	137	86 Å²	86	73%	0.733	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-64.8	-11.2	177.7	-55.2	-41.4	0	0	0	114.1	N340	N340-D342 PolarHBondContact O-N 3.3Å
343	T	53.6	Low	56.3	Low	85 Å²	85	91.5 Å²	91.5	52%	0.521	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-142.6	5.5	-166.2	53.6	0	0	0	0	115.3	N340 A341	N340-T343 WeakPolarHBondContact CB-OG1 3.47Å; N340-T343 PolarHBondContact ND2-OG1 3.49Å; N340-T343 PolarHBondContact O-N 3.27Å; N340-T343 PolarHBondContact O-OG1 3.04Å; N340-T343 VanDerWaalsContact O-OG1 3.06Å; A341-T343 PolarHBondContact O-N 3.16Å; A341-T343 VanDerWaalsContact O-N 3.1Å
344	N	46.8	Very low	55.4	Low	36 Å²	36	89 Å²	89	19%	0.193	49%	0.491	C	S	.	.			trans	-134.2	99.1	-175.8	-170.9	-11.9	0	0	0	110.6	N340 L346 A347	N340-N344 PolarHBondContact O-N 2.64Å; N344-L346 PolarHBondContact O-N 3.47Å; N344-L346 PolarHBondContact OD1-N 3.06Å; N344-A347 PolarHBondContact O-N 2.88Å
345	D	48.6	Very low	54.6	Low	156 Å²	156	91.4 Å²	91.4	83%	0.834	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-57.7	-21.8	-174.5	-72.3	-40.3	0	0	0	113.9	A347	D345-A347 PolarHBondContact O-N 3.2Å
346	L	39.6	Very low	53.9	Low	167 Å²	167	94.3 Å²	94.3	87%	0.874	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-70.3	-10.6	175.8	-67.8	171.8	0	0	0	113.9	N344	N344-L346 PolarHBondContact O-N 3.47Å; N344-L346 PolarHBondContact OD1-N 3.06Å
347	A	41.2	Very low	53.6	Low	57 Å²	57	94.4 Å²	94.4	47%	0.471	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-109.6	-2.5	-179	0	0	0	0	0	114.6	N344 D345	N344-A347 PolarHBondContact O-N 2.88Å; D345-A347 PolarHBondContact O-N 3.2Å
348	A	43.8	Very low	53.6	Low	66 Å²	66	95 Å²	95	55%	0.545	53%	0.528	S	S	.	.			trans	-94.2	13.9	-160.5	0	0	0	0	0	121
349	P	33.7	Very low	53.5	Low	110 Å²	110	100.4 Å²	100.4	71%	0.714	55%	0.551	S	S	*	*			trans	-111.6	59.9	-174.8	42.5	-36.7	0	0	0	116.8
350	L	30.2	Very low	53.9	Low	166 Å²	166	103.8 Å²	103.8	87%	0.869	56%	0.562	S	S	*	*	S	Bend	trans	-140.9	-1.6	174.2	-92.9	-171.4	0	0	0	120
351	L	29.7	Very low	54.7	Low	157 Å²	157	107.2 Å²	107.2	82%	0.822	59%	0.586	S	S	*	*			trans	-137	123.4	179.5	-66.8	172.8	0	0	0	112.7
352	F	35.6	Very low	56.3	Low	216 Å²	216	108.8 Å²	108.8	95%	0.947	58%	0.581	S	S	*	*			trans	163.8	158.5	146.4	-83	-53.2	0	0	0	110.7
353	E	39	Very low	57.9	Low	182 Å²	182	105.3 Å²	105.3	85%	0.85	56%	0.563	S	S	*	*			trans	-96.9	161	-142.4	-63	-171.4	134.4	0	0	120.3	E355	E353-E355 VanDerWaalsContact C-N 3.34Å; E353-E355 PolarHBondContact O-N 3.1Å
354	D	53.7	Low	59.5	Low	107 Å²	107	108.6 Å²	108.6	57%	0.572	57%	0.566	S	S	*	*	S	Bend	trans	-35.7	-25.1	-172.7	-146	15.9	0	0	0	120.4	S356 F407	D354-S356 PolarHBondContact O-N 2.85Å; D354-F407 WeakPolarHBondContact OD1-CZ 3.23Å
355	E	55.1	Low	61.2	Low	145 Å²	145	108 Å²	108	68%	0.678	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	10.1	-166.3	-144.6	-161.8	-126.1	0	0	114.9	E353 K359	E353-E355 VanDerWaalsContact C-N 3.34Å; E353-E355 PolarHBondContact O-N 3.1Å; E355-K359 WeakPolarHBondContact O-CD 3.03Å; E355-K359 VanDerWaalsContact O-CE 3.31Å; E355-K359 WeakPolarHBondContact O-CE 3.32Å; E355-K359 PolarHBondContact O-NZ 2.8Å; E355-K359 IonicContact OE2-NZ 3.68Å; E355-K359 PolarHBondContact OE2-NZ 3.31Å
356	S	66.9	Low	62.4	Low	62 Å²	62	104.1 Å²	104.1	43%	0.434	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.5	-36.8	-175.3	59.5	0	0	0	0	113.9	D354 C358 K359	D354-S356 PolarHBondContact O-N 2.85Å; S356-C358 VanDerWaalsContact C-N 3.31Å; S356-C358 PolarHBondContact O-N 2.88Å; S356-K359 PolarHBondContact O-N 3.01Å
357	I	81.5	Confident	64.4	Low	22 Å²	22	99 Å²	99	11%	0.113	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-58.1	-42	-170	-74.1	168.5	0	0	0	112.2	K359 F360 R395 N396 F407	I357-K359 PolarHBondContact O-N 2.87Å; I357-F360 HydrophobicContact CG1-CE2 4.28Å; I357-F360 VanDerWaalsContact O-CD2 3.28Å; I357-F360 WeakPolarHBondContact O-CD2 3.37Å; I357-F360 PolarHBondContact O-N 3.17Å; I357-R395 HydrophobicContact CB-CB 4.38Å; I357-R395 HydrophobicContact CD1-CB 4.24Å; I357-R395 HydrophobicContact CG1-CB 3.99Å; I357-R395 HydrophobicContact CG2-CB 3.62Å; I357-N396 WeakPolarHBondContact O-CB 3.17Å; I357-F407 HydrophobicContact CB-CE1 3.91Å; I357-F407 HydrophobicContact CB-CZ 4.47Å; I357-F407 HydrophobicContact CD1-CE1 4.34Å; I357-F407 HydrophobicContact CD1-CZ 4.04Å; I357-F407 HydrophobicContact CG2-CD1 4.48Å; I357-F407 HydrophobicContact CG2-CE1 3.91Å
358	C	88	Confident	66	Low	13 Å²	13	98.9 Å²	98.9	9%	0.088	53%	0.533	C	S	.	.	G	3₁₀ helix	trans	-66.1	-15.8	-179.5	-60.8	0	0	0	0	114.8	S356 Y376 N396 F407 C408	S356-C358 VanDerWaalsContact C-N 3.31Å; S356-C358 PolarHBondContact O-N 2.88Å; C358-Y376 HydrophobicContact CB-CD1 3.84Å; C358-Y376 HydrophobicContact CB-CG 4.46Å; C358-Y376 WeakPolarHBondContact O-CD1 3.48Å; C358-N396 PolarHBondContact O-ND2 3.01Å; C358-F407 VanDerWaalsContact SG-CD1 3.54Å; C358-C408 VanDerWaalsContact CA-SG 3.55Å; C358-C408 HydrophobicContact CB-CB 3.65Å; C358-C408 WeakPolarHBondContact CB-SG 3.3Å; C358-C408 WeakPolarHBondContact SG-CA 3.38Å; C358-C408 WeakPolarHBondContact SG-CB 3.33Å; C358-C408 CovalentContact SG-SG 2.03Å; C358-C408 PolarHBondContact SG-SG 2.91Å
359	K	84.6	Confident	67.3	Low	122 Å²	122	101.9 Å²	101.9	53%	0.53	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-95.3	-5.3	-177.2	-64	162.6	-174.2	146.7	0	112.5	E355 S356 I357	E355-K359 WeakPolarHBondContact O-CD 3.03Å; E355-K359 VanDerWaalsContact O-CE 3.31Å; E355-K359 WeakPolarHBondContact O-CE 3.32Å; E355-K359 PolarHBondContact O-NZ 2.8Å; E355-K359 IonicContact OE2-NZ 3.68Å; E355-K359 PolarHBondContact OE2-NZ 3.31Å; S356-K359 PolarHBondContact O-N 3.01Å; I357-K359 PolarHBondContact O-N 2.87Å
360	F	86.7	Confident	69.3	Low	89 Å²	89	102.8 Å²	102.8	39%	0.39	53%	0.532	S	S	.	.	S	Bend	trans	-71.3	145.8	170.1	-60	-50.5	0	0	0	111	I357 N394 N396	I357-F360 HydrophobicContact CG1-CE2 4.28Å; I357-F360 VanDerWaalsContact O-CD2 3.28Å; I357-F360 WeakPolarHBondContact O-CD2 3.37Å; I357-F360 PolarHBondContact O-N 3.17Å; F360-N394 WeakPolarHBondContact CB-OD1 3.27Å; F360-N396 HydrophobicContact CB-CB 4.11Å; F360-N396 PolarHBondContact O-ND2 2.88Å
361	P	83.3	Confident	71.7	Confident	94 Å²	94	98 Å²	98	61%	0.61	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-72	159.2	173.2	31.9	-35.9	0	0	0	111.1	D363 N394	P361-D363 PolarHBondContact O-N 3.22Å; P361-N394 PolarHBondContact O-ND2 3.2Å; P361-N394 PolarHBondContact O-OD1 2.02Å
362	K	88.2	Confident	74.5	Confident	95 Å²	95	95 Å²	95	41%	0.413	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-54.2	121.9	163.8	41	166.2	177.1	-65.1	0	111.3	F375 F386	K362-F375 HydrophobicContact CB-CB 3.99Å; K362-F375 HydrophobicContact CB-CD1 3.65Å; K362-F375 HydrophobicContact CB-CD2 3.92Å; K362-F375 HydrophobicContact CB-CE1 4.15Å; K362-F375 HydrophobicContact CB-CE2 4.4Å; K362-F375 HydrophobicContact CB-CG 3.55Å; K362-F375 HydrophobicContact CD-CD1 3.88Å; K362-F375 HydrophobicContact CD-CE1 3.55Å; K362-F375 HydrophobicContact CD-CZ 3.96Å; K362-F375 HydrophobicContact CG-CD1 3.85Å; K362-F375 HydrophobicContact CG-CD2 4Å; K362-F375 HydrophobicContact CG-CE1 3.81Å; K362-F375 HydrophobicContact CG-CE2 3.97Å; K362-F375 HydrophobicContact CG-CG 3.98Å; K362-F375 HydrophobicContact CG-CZ 3.92Å; K362-F375 VanDerWaalsContact NZ-CE1 3.33Å; K362-F386 HydrophobicContact CB-CB 4.32Å; K362-F386 HydrophobicContact CB-CD1 3.95Å; K362-F386 HydrophobicContact CB-CD2 4.12Å; K362-F386 HydrophobicContact CB-CE1 4.2Å; K362-F386 HydrophobicContact CB-CE2 4.39Å; K362-F386 HydrophobicContact CB-CG 3.88Å; K362-F386 HydrophobicContact CB-CZ 4.41Å; K362-F386 HydrophobicContact CD-CB 3.7Å; K362-F386 HydrophobicContact CD-CG 4.21Å
363	D	87.3	Confident	77.2	Confident	65 Å²	65	87.1 Å²	87.1	35%	0.348	46%	0.456	S	S	.	.			trans	-107.9	126.7	166.1	173.6	27.6	0	0	0	110	P361 G365 F386 G393 N394	P361-D363 PolarHBondContact O-N 3.22Å; D363-G365 PolarHBondContact OD1-N 3.42Å; D363-F386 WeakPolarHBondContact O-CE2 3.33Å; D363-G393 WeakPolarHBondContact OD2-CA 3.26Å; D363-G393 PolarHBondContact OD2-N 2.88Å; D363-N394 WeakPolarHBondContact CB-ND2 3.5Å
364	R	86.2	Confident	79.9	Confident	154 Å²	154	80.2 Å²	80.2	58%	0.581	42%	0.423	S	S	*	.			trans	-75.6	-26.9	177.4	-62.4	-169.9	171.9	167.8	-4.5	112.5	F386 F387 S389	R364-F386 HydrophobicContact CG-CD2 4.41Å; R364-F387 WeakPolarHBondContact CG-O 3.22Å; R364-S389 WeakPolarHBondContact O-CB 3.43Å; R364-S389 PolarHBondContact O-N 3.46Å; R364-S389 PolarHBondContact O-OG 3.24Å
365	G	82.5	Confident	81.8	Confident	22 Å²	22	75.5 Å²	75.5	23%	0.227	40%	0.398	C	S	.	.			trans	65.5	178.1	-166.8	0	0	0	0	0	114.4	D363 S389 C391	D363-G365 PolarHBondContact OD1-N 3.42Å; G365-S389 PolarHBondContact O-OG 3.27Å; G365-C391 WeakPolarHBondContact CA-O 3.44Å
366	P	73.6	Confident	83.7	Confident	76 Å²	76	70 Å²	70	49%	0.494	37%	0.371	S	S	.	.	S	Bend	trans	-102.5	4.5	-164.3	39.1	-36.9	0	0	0	116.3	C391 S713	P366-C391 WeakPolarHBondContact CD-O 3.35Å; P366-S713 WeakPolarHBondContact CG-OG 3.47Å
367	C	82.1	Confident	84.8	Confident	60 Å²	60	67.9 Å²	67.9	41%	0.405	36%	0.355	S	S	.	.			trans	-81	-173	-177.8	-85.9	0	0	0	0	113.2	S389 C391	C367-S389 CarbonylContact C-O 3.51Å; C367-S389 WeakPolarHBondContact CB-O 3.25Å; C367-S389 PolarHBondContact N-OG 2.92Å; C367-S389 VanDerWaalsContact O-CB 3.31Å; C367-S389 WeakPolarHBondContact O-CB 3.29Å; C367-C391 HydrophobicContact CB-CB 3.96Å; C367-C391 WeakPolarHBondContact CB-SG 3.26Å; C367-C391 WeakPolarHBondContact SG-CB 3.49Å; C367-C391 CovalentContact SG-SG 2.03Å; C367-C391 PolarHBondContact SG-SG 3.29Å
368	G	73.8	Confident	84.7	Confident	54 Å²	54	69.7 Å²	69.7	56%	0.557	37%	0.373	S	S	*	.	S	Bend	trans	-115	-3.3	-179.8	0	0	0	0	0	116.3	F370 S389	G368-F370 WeakPolarHBondContact O-CD2 3.46Å; G368-S389 PolarHBondContact N-O 3.4Å
369	N	72	Confident	83.9	Confident	128 Å²	128	75.4 Å²	75.4	68%	0.684	40%	0.398	S	S	*	.			trans	-101.8	87.8	-170.8	-68.1	-0.9	0	0	0	109.9	D371 S389 G390	N369-D371 PolarHBondContact O-N 3.37Å; N369-D371 VanDerWaalsContact O-N 3.15Å; N369-S389 CarbonylContact C-O 3.51Å; N369-S389 PolarHBondContact N-O 3.16Å; N369-S389 CarbonylContact O-C 3.55Å; N369-G390 PolarHBondContact O-N 3.26Å
370	F	76.4	Confident	83.6	Confident	129 Å²	129	74.8 Å²	74.8	57%	0.566	40%	0.397	S	S	*	.			trans	-76.2	101.2	-167.9	-64.4	-73.8	0	0	0	114.7	G368 F387 Y388	G368-F370 WeakPolarHBondContact O-CD2 3.46Å; F370-F387 HydrophobicContact CB-CB 4.4Å; F370-F387 HydrophobicContact CD1-CB 4.06Å; F370-Y388 CarbonylContact C-O 3.47Å; F370-Y388 VanDerWaalsContact CA-O 3.3Å; F370-Y388 WeakPolarHBondContact CA-O 3.07Å
371	D	80	Confident	83.5	Confident	65 Å²	65	71.8 Å²	71.8	35%	0.348	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	147.2	164.2	-65.9	-27.3	0	0	0	111.4	N369 R373 F387 Y388	N369-D371 PolarHBondContact O-N 3.37Å; N369-D371 VanDerWaalsContact O-N 3.15Å; D371-R373 HydrophobicContact CB-CG 4.01Å; D371-R373 IonicContact OD2-CZ 3.25Å; D371-R373 VanDerWaalsContact OD2-CZ 3.3Å; D371-R373 IonicContact OD2-NE 2.91Å; D371-R373 PolarHBondContact OD2-NE 3.49Å; D371-R373 VanDerWaalsContact OD2-NE 3.11Å; D371-R373 IonicContact OD2-NH2 2.73Å; D371-R373 PolarHBondContact OD2-NH2 3.47Å; D371-F387 CarbonylContact O-C 3.55Å; D371-F387 WeakPolarHBondContact O-CA 3.19Å; D371-Y388 HydrophobicContact CB-CD1 4.26Å; D371-Y388 PolarHBondContact N-O 2.78Å; D371-Y388 PolarHBondContact O-N 2.96Å
372	L	88.3	Confident	83.5	Confident	94 Å²	94	73 Å²	73	49%	0.492	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.2	161.7	-174	72.1	0	0	0	109.5	F374 Y385 F387	L372-F374 HydrophobicContact CD2-CZ 4.48Å; L372-Y385 HydrophobicContact CD1-CD2 3.6Å; L372-Y385 HydrophobicContact CD1-CE2 4.49Å; L372-Y385 HydrophobicContact CD1-CG 4.09Å; L372-F387 HydrophobicContact CD1-CE1 4.15Å
373	R	92.5	Very high	83.7	Confident	52 Å²	52	69 Å²	69	20%	0.196	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	169.9	177.9	-63.3	-165.8	-175.6	-156.1	6	111.5	D371 Y385 F386 Y388 N397 F398	D371-R373 HydrophobicContact CB-CG 4.01Å; D371-R373 IonicContact OD2-CZ 3.25Å; D371-R373 VanDerWaalsContact OD2-CZ 3.3Å; D371-R373 IonicContact OD2-NE 2.91Å; D371-R373 PolarHBondContact OD2-NE 3.49Å; D371-R373 VanDerWaalsContact OD2-NE 3.11Å; D371-R373 IonicContact OD2-NH2 2.73Å; D371-R373 PolarHBondContact OD2-NH2 3.47Å; R373-Y385 CarbonylContact O-C 3.49Å; R373-Y385 VanDerWaalsContact O-CA 3.3Å; R373-Y385 WeakPolarHBondContact O-CA 3.29Å; R373-F386 HydrophobicContact CB-CE1 4.03Å; R373-F386 HydrophobicContact CB-CZ 4.18Å; R373-F386 PolarHBondContact N-O 2.92Å; R373-F386 WeakPolarHBondContact O-CD1 3.26Å; R373-F386 PolarHBondContact O-N 2.79Å; R373-F386 VanDerWaalsContact O-O 3.09Å; R373-Y388 HydrophobicContact CG-CG 4.49Å; R373-N397 WeakPolarHBondContact CB-OD1 3.12Å; R373-N397 WeakPolarHBondContact CD-OD1 3Å; R373-F398 WeakPolarHBondContact CB-O 3.29Å
374	F	94.8	Very high	83.8	Confident	37 Å²	37	70.2 Å²	70.2	16%	0.162	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.1	-171.7	-61.6	-95	0	0	0	111.8	L372 R384 F398 L401 C404	L372-F374 HydrophobicContact CD2-CZ 4.48Å; F374-R384 CarbonylContact C-O 3.5Å; F374-R384 WeakPolarHBondContact CA-O 3.32Å; F374-F398 HydrophobicContact CB-CB 4.4Å; F374-F398 PolarHBondContact N-O 3.27Å; F374-F398 PolarHBondContact O-N 3.4Å; F374-L401 HydrophobicContact CD1-CB 3.84Å; F374-L401 HydrophobicContact CD1-CD1 3.6Å; F374-L401 HydrophobicContact CD1-CG 4.35Å; F374-L401 VanDerWaalsContact CD2-N 3.31Å; F374-L401 HydrophobicContact CE1-CB 3.78Å; F374-L401 HydrophobicContact CE1-CD1 3.92Å; F374-L401 HydrophobicContact CE1-CG 4.4Å; F374-L401 HydrophobicContact CG-CB 4.27Å; F374-L401 HydrophobicContact CG-CD1 4.49Å; F374-L401 HydrophobicContact CZ-CB 4.15Å; F374-C404 HydrophobicContact CB-CB 4.25Å
375	F	94.8	Very high	84	Confident	8 Å²	8	68.7 Å²	68.7	4%	0.035	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.9	174.6	81.2	-74.4	0	0	0	109.5	K362 D377 C383 R384 F386 N396	K362-F375 HydrophobicContact CB-CB 3.99Å; K362-F375 HydrophobicContact CB-CD1 3.65Å; K362-F375 HydrophobicContact CB-CD2 3.92Å; K362-F375 HydrophobicContact CB-CE1 4.15Å; K362-F375 HydrophobicContact CB-CE2 4.4Å; K362-F375 HydrophobicContact CB-CG 3.55Å; K362-F375 HydrophobicContact CD-CD1 3.88Å; K362-F375 HydrophobicContact CD-CE1 3.55Å; K362-F375 HydrophobicContact CD-CZ 3.96Å; K362-F375 HydrophobicContact CG-CD1 3.85Å; K362-F375 HydrophobicContact CG-CD2 4Å; K362-F375 HydrophobicContact CG-CE1 3.81Å; K362-F375 HydrophobicContact CG-CE2 3.97Å; K362-F375 HydrophobicContact CG-CG 3.98Å; K362-F375 HydrophobicContact CG-CZ 3.92Å; K362-F375 VanDerWaalsContact NZ-CE1 3.33Å; F375-D377 HydrophobicContact CE2-CB 3.67Å; F375-D377 HydrophobicContact CZ-CB 3.84Å; F375-D377 WeakPolarHBondContact CZ-OD2 3.26Å; F375-D377 PolarHBondContact O-N 2.99Å; F375-C383 CarbonylContact O-C 3.48Å; F375-C383 WeakPolarHBondContact O-CA 3.22Å; F375-R384 HydrophobicContact CD1-CB 4.25Å; F375-R384 WeakPolarHBondContact CD1-O 3.21Å; F375-R384 HydrophobicContact CE1-CB 3.56Å; F375-R384 HydrophobicContact CZ-CB 3.97Å; F375-R384 PolarHBondContact N-O 2.88Å; F375-R384 PolarHBondContact O-N 2.81Å; F375-F386 HydrophobicContact CB-CD1 4.11Å; F375-F386 HydrophobicContact CB-CE1 3.95Å; F375-F386 HydrophobicContact CD1-CB 4.5Å; F375-F386 AromaticContact CD1-CD1 3.82Å; F375-F386 HydrophobicContact CD1-CD1 3.82Å; F375-F386 HydrophobicContact CD1-CG 4.49Å; F375-F386 HydrophobicContact CG-CD1 4.37Å; F375-N396 VanDerWaalsContact CA-OD1 3.27Å; F375-N396 WeakPolarHBondContact CA-OD1 3.44Å; F375-N396 HydrophobicContact CB-CB 4.49Å; F375-N396 WeakPolarHBondContact CB-O 3.27Å
376	Y	93.4	Very high	84.5	Confident	29 Å²	29	68 Å²	68	11%	0.114	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	120.6	171.7	-174.5	-116.1	0	0	0	109.6	C358 A378 G381 N396 C404 C408 M409	C358-Y376 HydrophobicContact CB-CD1 3.84Å; C358-Y376 HydrophobicContact CB-CG 4.46Å; C358-Y376 WeakPolarHBondContact O-CD1 3.48Å; Y376-A378 HydrophobicContact CD1-CB 4.12Å; Y376-A378 HydrophobicContact CE1-CB 4.06Å; Y376-A378 PolarHBondContact O-N 2.86Å; Y376-G381 VanDerWaalsContact CE2-C 3.48Å; Y376-G381 WeakPolarHBondContact CE2-O 3.23Å; Y376-N396 PolarHBondContact N-ND2 2.88Å; Y376-N396 PolarHBondContact N-OD1 2.82Å; Y376-N396 PolarHBondContact O-ND2 3.42Å; Y376-C404 PolarHBondContact N-SG 3.34Å; Y376-C408 VanDerWaalsContact CB-SG 3.6Å; Y376-C408 HydrophobicContact CD1-CB 3.76Å; Y376-C408 HydrophobicContact CD2-CB 3.65Å; Y376-C408 HydrophobicContact CE1-CB 4.29Å; Y376-C408 HydrophobicContact CE2-CB 4.23Å; Y376-C408 HydrophobicContact CG-CB 3.37Å; Y376-M409 HydrophobicContact CD2-CG 4.17Å; Y376-M409 HydrophobicContact CE2-CG 3.58Å; Y376-M409 HydrophobicContact CE2-SD 4.49Å
377	D	89.9	Confident	85.3	Confident	18 Å²	18	69.1 Å²	69.1	10%	0.096	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	91.3	175.4	-163	-38.8	0	0	0	108.5	F375 E379 E380 G381 E382 R384	F375-D377 HydrophobicContact CE2-CB 3.67Å; F375-D377 HydrophobicContact CZ-CB 3.84Å; F375-D377 WeakPolarHBondContact CZ-OD2 3.26Å; F375-D377 PolarHBondContact O-N 2.99Å; D377-E379 PolarHBondContact O-N 2.71Å; D377-E379 PolarHBondContact OD1-N 3.27Å; D377-E380 PolarHBondContact O-N 3.13Å; D377-G381 PolarHBondContact O-N 2.88Å; D377-E382 WeakPolarHBondContact CB-O 3.39Å; D377-E382 PolarHBondContact N-O 3.49Å; D377-R384 HydrophobicContact CB-CG 3.87Å; D377-R384 WeakPolarHBondContact OD2-CD 3.08Å; D377-R384 IonicContact OD2-CZ 3.31Å; D377-R384 IonicContact OD2-NE 3.3Å; D377-R384 IonicContact OD2-NH1 2.68Å; D377-R384 PolarHBondContact OD2-NH1 2.03Å
378	A	80.6	Confident	85.6	Confident	60 Å²	60	67.2 Å²	67.2	50%	0.496	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.2	-176.8	0	0	0	0	0	114.2	Y376	Y376-A378 HydrophobicContact CD1-CB 4.12Å; Y376-A378 HydrophobicContact CE1-CB 4.06Å; Y376-A378 PolarHBondContact O-N 2.86Å
379	E	71.3	Confident	85.8	Confident	133 Å²	133	64.7 Å²	64.7	62%	0.621	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-37.7	170.7	-66	-178.6	-145.1	0	0	112.4	D377 Y799	D377-E379 PolarHBondContact O-N 2.71Å; D377-E379 PolarHBondContact OD1-N 3.27Å; E379-Y799 VanDerWaalsContact CD-CE2 3.44Å; E379-Y799 HydrophobicContact CG-CD2 4.13Å; E379-Y799 HydrophobicContact CG-CE2 4.21Å; E379-Y799 WeakPolarHBondContact OE1-CD2 3.08Å; E379-Y799 VanDerWaalsContact OE2-CD2 3.28Å; E379-Y799 WeakPolarHBondContact OE2-CD2 3.5Å; E379-Y799 WeakPolarHBondContact OE2-CE2 3.41Å
380	E	77.1	Confident	86.2	Confident	109 Å²	109	60.2 Å²	60.2	51%	0.509	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-8.3	178.4	-59.9	-151.6	-132.3	0	0	113.3	D377 E382 R384	D377-E380 PolarHBondContact O-N 3.13Å; E380-E382 VanDerWaalsContact C-N 3.28Å; E380-E382 PolarHBondContact O-N 3.44Å; E380-R384 VanDerWaalsContact CD-NH2 3.31Å; E380-R384 IonicContact OE1-CZ 3.07Å; E380-R384 IonicContact OE1-NH1 2.78Å; E380-R384 PolarHBondContact OE1-NH1 3.43Å; E380-R384 IonicContact OE1-NH2 2.69Å; E380-R384 PolarHBondContact OE1-NH2 3.22Å; E380-R384 IonicContact OE2-NH2 2.7Å
381	G	85.5	Confident	86.4	Confident	26 Å²	26	56.1 Å²	56.1	27%	0.268	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	14.5	177.9	0	0	0	0	0	114.3	Y376 D377 M409	Y376-G381 VanDerWaalsContact CE2-C 3.48Å; Y376-G381 WeakPolarHBondContact CE2-O 3.23Å; D377-G381 PolarHBondContact O-N 2.88Å; G381-M409 WeakPolarHBondContact O-CE 3.26Å
382	E	83.9	Confident	86.4	Confident	120 Å²	120	55.4 Å²	55.4	56%	0.561	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.8	-172.7	-72.5	-167.7	161.6	0	0	112.6	D377 E380	D377-E382 WeakPolarHBondContact CB-O 3.39Å; D377-E382 PolarHBondContact N-O 3.49Å; E380-E382 VanDerWaalsContact C-N 3.28Å; E380-E382 PolarHBondContact O-N 3.44Å
383	C	92.4	Very high	86	Confident	11 Å²	11	52.2 Å²	52.2	7%	0.074	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	131.7	171.1	-71.5	0	0	0	0	112.2	F375 L401 C404 Q405	F375-C383 CarbonylContact O-C 3.48Å; F375-C383 WeakPolarHBondContact O-CA 3.22Å; C383-L401 HydrophobicContact CB-CD1 3.54Å; C383-L401 VanDerWaalsContact O-CD1 3.31Å; C383-L401 WeakPolarHBondContact O-CD1 3.43Å; C383-C404 HydrophobicContact CB-CB 3.73Å; C383-C404 WeakPolarHBondContact CB-SG 3.45Å; C383-C404 WeakPolarHBondContact SG-CB 3.31Å; C383-C404 PolarHBondContact SG-O 2.81Å; C383-C404 CovalentContact SG-SG 2.03Å; C383-C404 PolarHBondContact SG-SG 2.85Å; C383-Q405 HydrophobicContact CB-CG 3.94Å; C383-Q405 PolarHBondContact SG-N 2.8Å
384	R	89.6	Confident	85.7	Confident	89 Å²	89	52 Å²	52	34%	0.336	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152.2	-174.5	-54.3	177.1	91.8	160.3	27.6	110.6	F374 F375 D377 E380	F374-R384 CarbonylContact C-O 3.5Å; F374-R384 WeakPolarHBondContact CA-O 3.32Å; F375-R384 HydrophobicContact CD1-CB 4.25Å; F375-R384 WeakPolarHBondContact CD1-O 3.21Å; F375-R384 HydrophobicContact CE1-CB 3.56Å; F375-R384 HydrophobicContact CZ-CB 3.97Å; F375-R384 PolarHBondContact N-O 2.88Å; F375-R384 PolarHBondContact O-N 2.81Å; D377-R384 HydrophobicContact CB-CG 3.87Å; D377-R384 WeakPolarHBondContact OD2-CD 3.08Å; D377-R384 IonicContact OD2-CZ 3.31Å; D377-R384 IonicContact OD2-NE 3.3Å; D377-R384 IonicContact OD2-NH1 2.68Å; D377-R384 PolarHBondContact OD2-NH1 2.03Å; E380-R384 VanDerWaalsContact CD-NH2 3.31Å; E380-R384 IonicContact OE1-CZ 3.07Å; E380-R384 IonicContact OE1-NH1 2.78Å; E380-R384 PolarHBondContact OE1-NH1 3.43Å; E380-R384 IonicContact OE1-NH2 2.69Å; E380-R384 PolarHBondContact OE1-NH2 3.22Å; E380-R384 IonicContact OE2-NH2 2.7Å
385	Y	90	Very high	85.4	Confident	122 Å²	122	59.4 Å²	59.4	48%	0.478	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	155.8	179.9	76.6	-88.3	0	0	0	112.8	L372 R373	L372-Y385 HydrophobicContact CD1-CD2 3.6Å; L372-Y385 HydrophobicContact CD1-CE2 4.49Å; L372-Y385 HydrophobicContact CD1-CG 4.09Å; R373-Y385 CarbonylContact O-C 3.49Å; R373-Y385 VanDerWaalsContact O-CA 3.3Å; R373-Y385 WeakPolarHBondContact O-CA 3.29Å
386	F	93.2	Very high	85.3	Confident	9 Å²	9	59 Å²	59	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	166.2	167.2	74.4	-78.3	0	0	0	110.7	K362 D363 R364 R373 F375 Y388 N397	K362-F386 HydrophobicContact CB-CB 4.32Å; K362-F386 HydrophobicContact CB-CD1 3.95Å; K362-F386 HydrophobicContact CB-CD2 4.12Å; K362-F386 HydrophobicContact CB-CE1 4.2Å; K362-F386 HydrophobicContact CB-CE2 4.39Å; K362-F386 HydrophobicContact CB-CG 3.88Å; K362-F386 HydrophobicContact CB-CZ 4.41Å; K362-F386 HydrophobicContact CD-CB 3.7Å; K362-F386 HydrophobicContact CD-CG 4.21Å; D363-F386 WeakPolarHBondContact O-CE2 3.33Å; R364-F386 HydrophobicContact CG-CD2 4.41Å; R373-F386 HydrophobicContact CB-CE1 4.03Å; R373-F386 HydrophobicContact CB-CZ 4.18Å; R373-F386 PolarHBondContact N-O 2.92Å; R373-F386 WeakPolarHBondContact O-CD1 3.26Å; R373-F386 PolarHBondContact O-N 2.79Å; R373-F386 VanDerWaalsContact O-O 3.09Å; F375-F386 HydrophobicContact CB-CD1 4.11Å; F375-F386 HydrophobicContact CB-CE1 3.95Å; F375-F386 HydrophobicContact CD1-CB 4.5Å; F375-F386 AromaticContact CD1-CD1 3.82Å; F375-F386 HydrophobicContact CD1-CD1 3.82Å; F375-F386 HydrophobicContact CD1-CG 4.49Å; F375-F386 HydrophobicContact CG-CD1 4.37Å; F386-Y388 HydrophobicContact CE2-CD2 4.44Å; F386-N397 HydrophobicContact CZ-CB 4.19Å; F386-N397 WeakPolarHBondContact CZ-OD1 3.15Å
387	F	90.2	Very high	85.4	Confident	98 Å²	98	59 Å²	59	43%	0.43	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	110.8	172	-65.3	-72.1	0	0	0	109.3	R364 F370 D371 L372	R364-F387 WeakPolarHBondContact CG-O 3.22Å; F370-F387 HydrophobicContact CB-CB 4.4Å; F370-F387 HydrophobicContact CD1-CB 4.06Å; D371-F387 CarbonylContact O-C 3.55Å; D371-F387 WeakPolarHBondContact O-CA 3.19Å; L372-F387 HydrophobicContact CD1-CE1 4.15Å
388	Y	88.3	Confident	85.6	Confident	21 Å²	21	59.4 Å²	59.4	8%	0.082	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.7	172	168.8	-103.3	0	0	0	108.8	F370 D371 R373 F386 G390 C391 G392 N397	F370-Y388 CarbonylContact C-O 3.47Å; F370-Y388 VanDerWaalsContact CA-O 3.3Å; F370-Y388 WeakPolarHBondContact CA-O 3.07Å; D371-Y388 HydrophobicContact CB-CD1 4.26Å; D371-Y388 PolarHBondContact N-O 2.78Å; D371-Y388 PolarHBondContact O-N 2.96Å; R373-Y388 HydrophobicContact CG-CG 4.49Å; F386-Y388 HydrophobicContact CE2-CD2 4.44Å; Y388-G390 VanDerWaalsContact C-N 3.26Å; Y388-G390 VanDerWaalsContact CD1-N 3.33Å; Y388-G390 WeakPolarHBondContact CE1-O 3.01Å; Y388-G390 PolarHBondContact O-N 2.04Å; Y388-G390 PolarHBondContact OH-O 3.24Å; Y388-C391 VanDerWaalsContact OH-C 3.22Å; Y388-C391 WeakPolarHBondContact OH-CA 3.36Å; Y388-C391 PolarHBondContact OH-N 2.93Å; Y388-G392 WeakPolarHBondContact CE2-O 3.49Å; Y388-G392 PolarHBondContact OH-O 2.94Å; Y388-N397 WeakPolarHBondContact CD2-ND2 3.42Å; Y388-N397 WeakPolarHBondContact CE2-ND2 3.4Å
389	S	78.7	Confident	86	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.007	32%	0.324	C	S	.	.			trans	-78.7	0.5	-167.8	67.4	0	0	0	0	116	R364 G365 C367 G368 N369 C391	R364-S389 WeakPolarHBondContact O-CB 3.43Å; R364-S389 PolarHBondContact O-N 3.46Å; R364-S389 PolarHBondContact O-OG 3.24Å; G365-S389 PolarHBondContact O-OG 3.27Å; C367-S389 CarbonylContact C-O 3.51Å; C367-S389 WeakPolarHBondContact CB-O 3.25Å; C367-S389 PolarHBondContact N-OG 2.92Å; C367-S389 VanDerWaalsContact O-CB 3.31Å; C367-S389 WeakPolarHBondContact O-CB 3.29Å; G368-S389 PolarHBondContact N-O 3.4Å; N369-S389 CarbonylContact C-O 3.51Å; N369-S389 PolarHBondContact N-O 3.16Å; N369-S389 CarbonylContact O-C 3.55Å; S389-C391 PolarHBondContact OG-O 2.73Å; S389-C391 VanDerWaalsContact OG-O 3.08Å
390	G	78.8	Confident	86.8	Confident	33 Å²	33	60 Å²	60	34%	0.34	31%	0.308	S	S	.	.	S	Bend	trans	100.6	-26.9	-177.2	0	0	0	0	0	113.8	N369 Y388	N369-G390 PolarHBondContact O-N 3.26Å; Y388-G390 VanDerWaalsContact C-N 3.26Å; Y388-G390 VanDerWaalsContact CD1-N 3.33Å; Y388-G390 WeakPolarHBondContact CE1-O 3.01Å; Y388-G390 PolarHBondContact O-N 2.04Å; Y388-G390 PolarHBondContact OH-O 3.24Å
391	C	81.1	Confident	87.3	Confident	44 Å²	44	58.1 Å²	58.1	30%	0.297	30%	0.3	S	S	.	.	S	Bend	trans	-137.9	164.3	174.5	77	0	0	0	0	112.4	G365 P366 C367 Y388 S389	G365-C391 WeakPolarHBondContact CA-O 3.44Å; P366-C391 WeakPolarHBondContact CD-O 3.35Å; C367-C391 HydrophobicContact CB-CB 3.96Å; C367-C391 WeakPolarHBondContact CB-SG 3.26Å; C367-C391 WeakPolarHBondContact SG-CB 3.49Å; C367-C391 CovalentContact SG-SG 2.03Å; C367-C391 PolarHBondContact SG-SG 3.29Å; Y388-C391 VanDerWaalsContact OH-C 3.22Å; Y388-C391 WeakPolarHBondContact OH-CA 3.36Å; Y388-C391 PolarHBondContact OH-N 2.93Å; S389-C391 PolarHBondContact OG-O 2.73Å; S389-C391 VanDerWaalsContact OG-O 3.08Å
392	G	79.7	Confident	87.3	Confident	49 Å²	49	61.5 Å²	61.5	51%	0.505	31%	0.312	S	S	.	.			trans	81.5	-142.9	-175.8	0	0	0	0	0	112.1	Y388	Y388-G392 WeakPolarHBondContact CE2-O 3.49Å; Y388-G392 PolarHBondContact OH-O 2.94Å
393	G	80.7	Confident	87.5	Confident	28 Å²	28	59.5 Å²	59.5	29%	0.289	31%	0.305	S	S	.	.			trans	84.7	153.4	-179.5	0	0	0	0	0	113.4	D363	D363-G393 WeakPolarHBondContact OD2-CA 3.26Å; D363-G393 PolarHBondContact OD2-N 2.88Å
394	N	86.6	Confident	87.5	Confident	46 Å²	46	59 Å²	59	25%	0.246	30%	0.301	C	S	.	.			trans	-97.3	-176.6	162.1	67.1	63.2	0	0	0	110.5	F360 P361 D363 N396 N397	F360-N394 WeakPolarHBondContact CB-OD1 3.27Å; P361-N394 PolarHBondContact O-ND2 3.2Å; P361-N394 PolarHBondContact O-OD1 2.02Å; D363-N394 WeakPolarHBondContact CB-ND2 3.5Å; N394-N396 VanDerWaalsContact C-N 3.31Å; N394-N396 PolarHBondContact O-N 3.34Å; N394-N396 WeakPolarHBondContact OD1-CB 3.02Å; N394-N396 PolarHBondContact OD1-N 3.34Å; N394-N397 WeakPolarHBondContact O-CB 3.4Å
395	R	87.6	Confident	87.4	Confident	193 Å²	193	58.2 Å²	58.2	73%	0.728	30%	0.302	S	S	*	.	S	Bend	trans	-72.3	-12.7	-174.4	-68.5	-173.3	179.4	178.9	0.1	115.2	I357 N397	I357-R395 HydrophobicContact CB-CB 4.38Å; I357-R395 HydrophobicContact CD1-CB 4.24Å; I357-R395 HydrophobicContact CG1-CB 3.99Å; I357-R395 HydrophobicContact CG2-CB 3.62Å; R395-N397 PolarHBondContact O-N 2.95Å
396	N	93.8	Very high	87.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.311	C	S	.	.			trans	-81	60.2	172.3	-160.9	0.8	0	0	0	110.8	I357 C358 F360 F375 Y376 N394 F398	I357-N396 WeakPolarHBondContact O-CB 3.17Å; C358-N396 PolarHBondContact O-ND2 3.01Å; F360-N396 HydrophobicContact CB-CB 4.11Å; F360-N396 PolarHBondContact O-ND2 2.88Å; F375-N396 VanDerWaalsContact CA-OD1 3.27Å; F375-N396 WeakPolarHBondContact CA-OD1 3.44Å; F375-N396 HydrophobicContact CB-CB 4.49Å; F375-N396 WeakPolarHBondContact CB-O 3.27Å; Y376-N396 PolarHBondContact N-ND2 2.88Å; Y376-N396 PolarHBondContact N-OD1 2.82Å; Y376-N396 PolarHBondContact O-ND2 3.42Å; N394-N396 VanDerWaalsContact C-N 3.31Å; N394-N396 PolarHBondContact O-N 3.34Å; N394-N396 WeakPolarHBondContact OD1-CB 3.02Å; N394-N396 PolarHBondContact OD1-N 3.34Å; N396-F398 WeakPolarHBondContact OD1-CE2 3.32Å
397	N	94.8	Very high	86.8	Confident	28 Å²	28	63 Å²	63	15%	0.15	33%	0.325	C	S	.	.			trans	-148.6	68.2	-165.2	-175.1	7.4	0	0	0	110.6	R373 F386 Y388 N394 R395	R373-N397 WeakPolarHBondContact CB-OD1 3.12Å; R373-N397 WeakPolarHBondContact CD-OD1 3Å; F386-N397 HydrophobicContact CZ-CB 4.19Å; F386-N397 WeakPolarHBondContact CZ-OD1 3.15Å; Y388-N397 WeakPolarHBondContact CD2-ND2 3.42Å; Y388-N397 WeakPolarHBondContact CE2-ND2 3.4Å; N394-N397 WeakPolarHBondContact O-CB 3.4Å; R395-N397 PolarHBondContact O-N 2.95Å
398	F	93.8	Very high	86.7	Confident	27 Å²	27	59.1 Å²	59.1	12%	0.118	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-84.5	144.1	-174.2	-60.6	-83.1	0	0	0	111.9	R373 F374 N396 D403 C404 F407	R373-F398 WeakPolarHBondContact CB-O 3.29Å; F374-F398 HydrophobicContact CB-CB 4.4Å; F374-F398 PolarHBondContact N-O 3.27Å; F374-F398 PolarHBondContact O-N 3.4Å; N396-F398 WeakPolarHBondContact OD1-CE2 3.32Å; F398-D403 HydrophobicContact CB-CB 4.18Å; F398-D403 HydrophobicContact CD1-CB 3.93Å; F398-D403 HydrophobicContact CG-CB 4.43Å; F398-C404 HydrophobicContact CB-CB 3.79Å; F398-C404 HydrophobicContact CD1-CB 4.42Å; F398-C404 HydrophobicContact CD2-CB 3.39Å; F398-C404 HydrophobicContact CE2-CB 4.04Å; F398-C404 HydrophobicContact CG-CB 3.61Å; F398-F407 HydrophobicContact CE1-CB 3.65Å; F398-F407 HydrophobicContact CE1-CD1 4.18Å; F398-F407 HydrophobicContact CE1-CD2 4.48Å; F398-F407 AromaticContact CE1-CG 3.84Å; F398-F407 HydrophobicContact CE1-CG 3.84Å; F398-F407 HydrophobicContact CZ-CB 3.8Å; F398-F407 AromaticContact CZ-CD1 3.76Å; F398-F407 HydrophobicContact CZ-CD1 3.76Å; F398-F407 AromaticContact CZ-CG 3.88Å; F398-F407 HydrophobicContact CZ-CG 3.88Å
399	K	88.6	Confident	86.4	Confident	168 Å²	168	61.7 Å²	61.7	73%	0.73	32%	0.324	S	S	*	.	S	Bend	trans	-69.8	-37.5	178.3	-65.9	-177.6	-178	176.1	0	112
400	S	89	Confident	85.9	Confident	39 Å²	39	71.7 Å²	71.7	27%	0.273	36%	0.361	S	S	.	.	S	Bend	trans	-120.9	162.3	175.8	80.6	0	0	0	0	113	L402 D403 C404	S400-L402 PolarHBondContact O-N 3.16Å; S400-L402 PolarHBondContact OG-N 3.48Å; S400-D403 VanDerWaalsContact CB-OD2 3.3Å; S400-D403 WeakPolarHBondContact CB-OD2 3.4Å; S400-D403 PolarHBondContact N-OD2 3.4Å; S400-D403 VanDerWaalsContact N-OD2 3.1Å; S400-D403 PolarHBondContact OG-N 2.56Å; S400-D403 VanDerWaalsContact OG-N 3.1Å; S400-D403 PolarHBondContact OG-OD2 3.46Å; S400-C404 PolarHBondContact O-N 2.64Å
401	L	86.3	Confident	84.8	Confident	68 Å²	68	73.2 Å²	73.2	36%	0.356	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-39.4	170.2	-174.5	70	0	0	0	111.2	F374 C383 C404 Q405	F374-L401 HydrophobicContact CD1-CB 3.84Å; F374-L401 HydrophobicContact CD1-CD1 3.6Å; F374-L401 HydrophobicContact CD1-CG 4.35Å; F374-L401 VanDerWaalsContact CD2-N 3.31Å; F374-L401 HydrophobicContact CE1-CB 3.78Å; F374-L401 HydrophobicContact CE1-CD1 3.92Å; F374-L401 HydrophobicContact CE1-CG 4.4Å; F374-L401 HydrophobicContact CG-CB 4.27Å; F374-L401 HydrophobicContact CG-CD1 4.49Å; F374-L401 HydrophobicContact CZ-CB 4.15Å; C383-L401 HydrophobicContact CB-CD1 3.54Å; C383-L401 VanDerWaalsContact O-CD1 3.31Å; C383-L401 WeakPolarHBondContact O-CD1 3.43Å; L401-C404 WeakPolarHBondContact O-CB 3.42Å; L401-C404 PolarHBondContact O-N 3.12Å; L401-Q405 HydrophobicContact CG-CG 4.43Å; L401-Q405 VanDerWaalsContact O-CG 3.29Å; L401-Q405 WeakPolarHBondContact O-CG 3.31Å; L401-Q405 PolarHBondContact O-N 3Å
402	L	85.8	Confident	83.1	Confident	98 Å²	98	76.8 Å²	76.8	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-68.8	-40.2	-175.1	-177.2	61.7	0	0	0	112.2	S400 C404 Q405 K406	S400-L402 PolarHBondContact O-N 3.16Å; S400-L402 PolarHBondContact OG-N 3.48Å; L402-C404 VanDerWaalsContact C-N 3.31Å; L402-C404 PolarHBondContact O-N 2.81Å; L402-Q405 PolarHBondContact O-N 2.89Å; L402-K406 VanDerWaalsContact O-CB 3.22Å; L402-K406 WeakPolarHBondContact O-CB 3.23Å; L402-K406 PolarHBondContact O-N 2.86Å
403	D	87.7	Confident	81	Confident	77 Å²	77	83.8 Å²	83.8	41%	0.412	41%	0.414	S	S	.	.	H	α-helix	trans	-60.3	-45.6	175.9	-54.8	-50	0	0	0	110.4	F398 S400 K406 F407	F398-D403 HydrophobicContact CB-CB 4.18Å; F398-D403 HydrophobicContact CD1-CB 3.93Å; F398-D403 HydrophobicContact CG-CB 4.43Å; S400-D403 VanDerWaalsContact CB-OD2 3.3Å; S400-D403 WeakPolarHBondContact CB-OD2 3.4Å; S400-D403 PolarHBondContact N-OD2 3.4Å; S400-D403 VanDerWaalsContact N-OD2 3.1Å; S400-D403 PolarHBondContact OG-N 2.56Å; S400-D403 VanDerWaalsContact OG-N 3.1Å; S400-D403 PolarHBondContact OG-OD2 3.46Å; D403-K406 PolarHBondContact O-N 3.28Å; D403-F407 VanDerWaalsContact O-CB 3.27Å; D403-F407 WeakPolarHBondContact O-CB 3.1Å; D403-F407 PolarHBondContact O-N 2.63Å
404	C	93.5	Very high	78.7	Confident	0 Å²	0	88 Å²	88	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-59.5	-48.1	175.9	178.2	0	0	0	0	111.7	F374 Y376 C383 F398 S400 L401 L402 F407 C408	F374-C404 HydrophobicContact CB-CB 4.25Å; Y376-C404 PolarHBondContact N-SG 3.34Å; C383-C404 HydrophobicContact CB-CB 3.73Å; C383-C404 WeakPolarHBondContact CB-SG 3.45Å; C383-C404 WeakPolarHBondContact SG-CB 3.31Å; C383-C404 PolarHBondContact SG-O 2.81Å; C383-C404 CovalentContact SG-SG 2.03Å; C383-C404 PolarHBondContact SG-SG 2.85Å; F398-C404 HydrophobicContact CB-CB 3.79Å; F398-C404 HydrophobicContact CD1-CB 4.42Å; F398-C404 HydrophobicContact CD2-CB 3.39Å; F398-C404 HydrophobicContact CE2-CB 4.04Å; F398-C404 HydrophobicContact CG-CB 3.61Å; S400-C404 PolarHBondContact O-N 2.64Å; L401-C404 WeakPolarHBondContact O-CB 3.42Å; L401-C404 PolarHBondContact O-N 3.12Å; L402-C404 VanDerWaalsContact C-N 3.31Å; L402-C404 PolarHBondContact O-N 2.81Å; C404-F407 PolarHBondContact O-N 2.87Å; C404-C408 VanDerWaalsContact O-CB 3.29Å; C404-C408 WeakPolarHBondContact O-CB 3.1Å; C404-C408 PolarHBondContact O-N 3.28Å
405	Q	88.3	Confident	76	Confident	74 Å²	74	90.7 Å²	90.7	35%	0.346	46%	0.459	S	S	.	.	H	α-helix	trans	-64.8	-44.7	-179.5	-70	177.6	-48.9	0	0	111.3	C383 L401 L402 F407 C408 M409	C383-Q405 HydrophobicContact CB-CG 3.94Å; C383-Q405 PolarHBondContact SG-N 2.8Å; L401-Q405 HydrophobicContact CG-CG 4.43Å; L401-Q405 VanDerWaalsContact O-CG 3.29Å; L401-Q405 WeakPolarHBondContact O-CG 3.31Å; L401-Q405 PolarHBondContact O-N 3Å; L402-Q405 PolarHBondContact O-N 2.89Å; Q405-F407 VanDerWaalsContact C-N 3.34Å; Q405-F407 PolarHBondContact O-N 3.16Å; Q405-C408 PolarHBondContact O-N 3.11Å; Q405-M409 HydrophobicContact CB-SD 4.05Å; Q405-M409 HydrophobicContact CG-SD 3.7Å; Q405-M409 WeakPolarHBondContact O-CB 3.47Å; Q405-M409 PolarHBondContact O-N 2.03Å
406	K	83.2	Confident	73.1	Confident	154 Å²	154	86.2 Å²	86.2	67%	0.67	46%	0.463	S	S	*	.	H	α-helix	trans	-62.5	-38.5	178.4	-177.4	178.7	178.7	-179	0	112.5	L402 D403	L402-K406 VanDerWaalsContact O-CB 3.22Å; L402-K406 WeakPolarHBondContact O-CB 3.23Å; L402-K406 PolarHBondContact O-N 2.86Å; D403-K406 PolarHBondContact O-N 3.28Å
407	F	86.8	Confident	70.8	Confident	77 Å²	77	91.9 Å²	91.9	34%	0.338	50%	0.5	S	S	.	.	H	α-helix	trans	-78.8	-39.9	179.5	-164.2	-83.5	0	0	0	111.9	D354 I357 C358 F398 D403 C404 Q405	D354-F407 WeakPolarHBondContact OD1-CZ 3.23Å; I357-F407 HydrophobicContact CB-CE1 3.91Å; I357-F407 HydrophobicContact CB-CZ 4.47Å; I357-F407 HydrophobicContact CD1-CE1 4.34Å; I357-F407 HydrophobicContact CD1-CZ 4.04Å; I357-F407 HydrophobicContact CG2-CD1 4.48Å; I357-F407 HydrophobicContact CG2-CE1 3.91Å; C358-F407 VanDerWaalsContact SG-CD1 3.54Å; F398-F407 HydrophobicContact CE1-CB 3.65Å; F398-F407 HydrophobicContact CE1-CD1 4.18Å; F398-F407 HydrophobicContact CE1-CD2 4.48Å; F398-F407 AromaticContact CE1-CG 3.84Å; F398-F407 HydrophobicContact CE1-CG 3.84Å; F398-F407 HydrophobicContact CZ-CB 3.8Å; F398-F407 AromaticContact CZ-CD1 3.76Å; F398-F407 HydrophobicContact CZ-CD1 3.76Å; F398-F407 AromaticContact CZ-CG 3.88Å; F398-F407 HydrophobicContact CZ-CG 3.88Å; D403-F407 VanDerWaalsContact O-CB 3.27Å; D403-F407 WeakPolarHBondContact O-CB 3.1Å; D403-F407 PolarHBondContact O-N 2.63Å; C404-F407 PolarHBondContact O-N 2.87Å; Q405-F407 VanDerWaalsContact C-N 3.34Å; Q405-F407 PolarHBondContact O-N 3.16Å
408	C	88.7	Confident	67.6	Low	16 Å²	16	100 Å²	100	11%	0.108	54%	0.537	C	S	.	.	H	α-helix	trans	-108.9	-21.8	-166.7	-65.4	0	0	0	0	117.9	C358 Y376 C404 Q405 R410	C358-C408 VanDerWaalsContact CA-SG 3.55Å; C358-C408 HydrophobicContact CB-CB 3.65Å; C358-C408 WeakPolarHBondContact CB-SG 3.3Å; C358-C408 WeakPolarHBondContact SG-CA 3.38Å; C358-C408 WeakPolarHBondContact SG-CB 3.33Å; C358-C408 CovalentContact SG-SG 2.03Å; C358-C408 PolarHBondContact SG-SG 2.91Å; Y376-C408 VanDerWaalsContact CB-SG 3.6Å; Y376-C408 HydrophobicContact CD1-CB 3.76Å; Y376-C408 HydrophobicContact CD2-CB 3.65Å; Y376-C408 HydrophobicContact CE1-CB 4.29Å; Y376-C408 HydrophobicContact CE2-CB 4.23Å; Y376-C408 HydrophobicContact CG-CB 3.37Å; C404-C408 VanDerWaalsContact O-CB 3.29Å; C404-C408 WeakPolarHBondContact O-CB 3.1Å; C404-C408 PolarHBondContact O-N 3.28Å; Q405-C408 PolarHBondContact O-N 3.11Å; C408-R410 PolarHBondContact O-N 2.04Å
409	M	80.2	Confident	64.5	Low	75 Å²	75	106.7 Å²	106.7	37%	0.369	57%	0.574	S	S	.	*			trans	-88.6	16.9	-176.9	-64.4	-176.4	68.6	0	0	113.3	Y376 G381 Q405 G411	Y376-M409 HydrophobicContact CD2-CG 4.17Å; Y376-M409 HydrophobicContact CE2-CG 3.58Å; Y376-M409 HydrophobicContact CE2-SD 4.49Å; G381-M409 WeakPolarHBondContact O-CE 3.26Å; Q405-M409 HydrophobicContact CB-SD 4.05Å; Q405-M409 HydrophobicContact CG-SD 3.7Å; Q405-M409 WeakPolarHBondContact O-CB 3.47Å; Q405-M409 PolarHBondContact O-N 2.03Å; M409-G411 VanDerWaalsContact C-N 3.25Å; M409-G411 PolarHBondContact O-N 3.14Å
410	R	68.2	Low	61.6	Low	211 Å²	211	103.7 Å²	103.7	80%	0.796	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	37.3	-164.7	-145.2	177.2	-162.6	-179.3	3.7	114.6	C408	C408-R410 PolarHBondContact O-N 2.04Å
411	G	56.4	Low	58.6	Low	65 Å²	65	110.1 Å²	110.1	67%	0.67	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.5	-6.3	-174.1	0	0	0	0	0	120	M409 K413	M409-G411 VanDerWaalsContact C-N 3.25Å; M409-G411 PolarHBondContact O-N 3.14Å; G411-K413 PolarHBondContact O-N 3.42Å
412	V	46	Very low	55.8	Low	120 Å²	120	110.9 Å²	110.9	73%	0.727	63%	0.627	S	S	*	*			trans	-80.5	111.1	-174.5	-175.3	0	0	0	0	111.8
413	K	34.3	Very low	53.1	Low	196 Å²	196	113 Å²	113	85%	0.852	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-103.1	135.3	169	-71.1	-179.3	178.3	178.6	0	110.8	G411	G411-K413 PolarHBondContact O-N 3.42Å
414	S	32.1	Very low	50.1	Low	115 Å²	115	115 Å²	115	80%	0.804	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-79.9	134.1	178.2	-49.4	0	0	0	0	112.3
415	P	30.6	Very low	46.9	Very low	104 Å²	104	120.7 Å²	120.7	68%	0.675	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-79.5	144.7	169.6	32	-33	0	0	0	111.9
416	A	27.5	Very low	43.9	Very low	99 Å²	99	124.8 Å²	124.8	82%	0.818	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-100	164.3	-179.7	0	0	0	0	0	112.5
417	P	44.8	Very low	41.4	Very low	119 Å²	119	126.4 Å²	126.4	77%	0.773	72%	0.723	S	S	*	*			trans	-122	155.7	-155	40.7	-28.8	0	0	0	116.4
418	E	27	Very low	38.5	Very low	197 Å²	197	128.8 Å²	128.8	92%	0.921	74%	0.743	S	S	*	*			trans	-139.4	166	156.2	-68.3	-165.5	135.9	0	0	110.4
419	D	30	Very low	35.6	Very low	168 Å²	168	132.9 Å²	132.9	90%	0.898	77%	0.772	S	S	*	*			trans	56.9	80.7	175.2	-78.8	-10.6	0	0	0	120.4
420	A	27.9	Very low	33.4	Very low	105 Å²	105	136.8 Å²	136.8	87%	0.868	79%	0.794	S	S	*	*				-156.6	116.5	129.5	0	0	0	0	0	111.3
421	L	25.3	Very low	31.7	Very low	174 Å²	174	131.8 Å²	131.8	91%	0.911	79%	0.789	S	S	*	*			trans	-91.6	113.1	-173.4	176.7	68.8	0	0	0	113.2
422	A	28.2	Very low	30.5	Very low	84 Å²	84	134.1 Å²	134.1	69%	0.694	79%	0.793	S	S	*	*			trans	-161.7	121.4	155.4	0	0	0	0	0	112.9
423	T	29.2	Very low	29.9	Very low	143 Å²	143	134.4 Å²	134.4	88%	0.877	80%	0.797	S	S	*	*			trans	71	103.8	166.7	-37	0	0	0	0	117.9
424	T	24.4	Very low	29.8	Very low	119 Å²	119	134.2 Å²	134.2	73%	0.73	80%	0.796	S	S	*	*			trans	-91.1	160.4	167.9	38.2	0	0	0	0	110.7
425	P	26.4	Very low	30	Very low	119 Å²	119	136.8 Å²	136.8	77%	0.773	80%	0.799	S	S	*	*			cis	-142.4	178.8	48.1	40.8	-20.1	0	0	0	118.8
426	H	24.7	Very low	30.9	Very low	160 Å²	160	138.3 Å²	138.3	74%	0.741	80%	0.797	S	S	*	*			trans	-49.3	156.9	176.5	-52.4	-90	0	0	0	114.3
427	F	30	Very low	32.7	Very low	189 Å²	189	135.3 Å²	135.3	83%	0.829	77%	0.767	S	S	*	*				-158.3	133.4	72.4	-108.9	-103.8	0	0	0	114.9
428	V	26.9	Very low	34.2	Very low	126 Å²	126	134.9 Å²	134.9	76%	0.764	75%	0.753	S	S	*	*			trans	56.4	143.9	142.4	-179.9	0	0	0	0	121
429	S	28	Very low	37.1	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	71%	0.709	S	S	*	*			trans	-75.1	156.3	-169.4	53.1	0	0	0	0	117.9
430	D	32.7	Very low	39.8	Very low	157 Å²	157	121.6 Å²	121.6	84%	0.84	69%	0.688	S	S	*	*			trans	-148.4	168.5	142.9	-110.5	-26.9	0	0	0	110.8
431	P	34.3	Very low	42.7	Very low	106 Å²	106	119.1 Å²	119.1	69%	0.688	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-64.4	164.4	-172.8	-24.7	34.8	0	0	0	116.3
432	P	31.3	Very low	45.7	Very low	115 Å²	115	115.3 Å²	115.3	75%	0.747	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-63.9	157.8	-179	27.7	-36.5	0	0	0	113.1	K434	P432-K434 PolarHBondContact O-N 3.25Å
433	P	32	Very low	48.7	Very low	125 Å²	125	116.4 Å²	116.4	81%	0.812	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-58.9	125.1	-176.7	24.1	-34.5	0	0	0	111.3	I435	P433-I435 PolarHBondContact O-N 3.41Å
434	K	31.7	Very low	51.7	Low	192 Å²	192	112.4 Å²	112.4	84%	0.835	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-55.8	136.1	162.8	-64.3	177.6	-179.6	178.5	0	107.6	P432 E436	P432-K434 PolarHBondContact O-N 3.25Å; K434-E436 PolarHBondContact O-N 2.8Å
435	I	37.6	Very low	54.7	Low	170 Å²	170	108.8 Å²	108.8	87%	0.872	59%	0.589	S	S	*	*			trans	-60.1	113.1	165.2	-62.7	174.6	0	0	0	105.7	P433 N437	P433-I435 PolarHBondContact O-N 3.41Å; I435-N437 PolarHBondContact O-N 2.87Å
436	E	48.6	Very low	57.6	Low	136 Å²	136	104.2 Å²	104.2	64%	0.636	56%	0.563	S	S	*	*			trans	-70.8	102	-167.7	-158.4	160.5	-127.6	0	0	108.8	K434 K438 F441	K434-E436 PolarHBondContact O-N 2.8Å; E436-K438 PolarHBondContact O-N 3.27Å; E436-F441 HydrophobicContact CB-CE2 4.34Å; E436-F441 HydrophobicContact CB-CZ 4.12Å; E436-F441 HydrophobicContact CG-CE1 4.37Å; E436-F441 HydrophobicContact CG-CE2 3.98Å; E436-F441 HydrophobicContact CG-CZ 3.73Å; E436-F441 WeakPolarHBondContact OE2-CZ 3.03Å
437	N	66.2	Low	60.4	Low	36 Å²	36	101.9 Å²	101.9	19%	0.193	56%	0.562	C	S	.	*			trans	-55.8	133.9	-177.4	-175.9	0	0	0	0	108.5	I435 C439 N440	I435-N437 PolarHBondContact O-N 2.87Å; N437-C439 PolarHBondContact O-N 3.01Å; N437-C439 PolarHBondContact OD1-N 3.18Å; N437-C439 PolarHBondContact OD1-SG 2.86Å; N437-C439 VanDerWaalsContact OD1-SG 3.36Å; N437-N440 HydrophobicContact CB-CB 4.47Å; N437-N440 WeakPolarHBondContact O-CB 3.28Å; N437-N440 PolarHBondContact O-N 3.27Å
438	K	76	Confident	63.1	Low	109 Å²	109	95.5 Å²	95.5	47%	0.474	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-55.7	-26.3	178.6	-69	-175.6	174.7	-179.8	0	112.3	E436 N440 P476 N477	E436-K438 PolarHBondContact O-N 3.27Å; K438-N440 VanDerWaalsContact C-N 3.33Å; K438-P476 HydrophobicContact CB-CB 3.77Å; K438-P476 HydrophobicContact CD-CB 3.97Å; K438-P476 HydrophobicContact CG-CB 3.66Å; K438-N477 WeakPolarHBondContact O-CA 3.14Å; K438-N477 WeakPolarHBondContact O-CB 3.06Å; K438-N477 PolarHBondContact O-N 2.97Å
439	C	88.1	Confident	65.6	Low	0 Å²	0	99.3 Å²	99.3	0%	0	55%	0.546	C	S	.	.	G	3₁₀ helix	trans	-76.2	-13.1	176.5	-50.4	0	0	0	0	114.4	N437 Y457 T459 N477 C489	N437-C439 PolarHBondContact O-N 3.01Å; N437-C439 PolarHBondContact OD1-N 3.18Å; N437-C439 PolarHBondContact OD1-SG 2.86Å; N437-C439 VanDerWaalsContact OD1-SG 3.36Å; C439-Y457 HydrophobicContact CB-CD1 3.79Å; C439-Y457 HydrophobicContact CB-CG 4.07Å; C439-T459 WeakPolarHBondContact O-CG2 3.34Å; C439-N477 PolarHBondContact O-ND2 3.03Å; C439-C489 HydrophobicContact CB-CB 3.59Å; C439-C489 WeakPolarHBondContact CB-SG 3.07Å; C439-C489 WeakPolarHBondContact SG-CA 3.49Å; C439-C489 WeakPolarHBondContact SG-CB 3.01Å; C439-C489 CovalentContact SG-SG 2.02Å; C439-C489 PolarHBondContact SG-SG 2.93Å
440	N	87.5	Confident	67.6	Low	86 Å²	86	100 Å²	100	46%	0.46	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-91.2	-12.1	-177.6	-67.6	5.8	0	0	0	113.7	N437 K438	N437-N440 HydrophobicContact CB-CB 4.47Å; N437-N440 WeakPolarHBondContact O-CB 3.28Å; N437-N440 PolarHBondContact O-N 3.27Å; K438-N440 VanDerWaalsContact C-N 3.33Å
441	F	88.8	Confident	70	Confident	54 Å²	54	99 Å²	99	24%	0.237	53%	0.533	C	S	.	.	S	Bend	trans	-70.6	146.9	173.1	-63.4	-91.8	0	0	0	109.9	E436 N475 P476 N477	E436-F441 HydrophobicContact CB-CE2 4.34Å; E436-F441 HydrophobicContact CB-CZ 4.12Å; E436-F441 HydrophobicContact CG-CE1 4.37Å; E436-F441 HydrophobicContact CG-CE2 3.98Å; E436-F441 HydrophobicContact CG-CZ 3.73Å; E436-F441 WeakPolarHBondContact OE2-CZ 3.03Å; F441-N475 HydrophobicContact CB-CB 4.39Å; F441-N475 WeakPolarHBondContact CB-OD1 3.11Å; F441-P476 HydrophobicContact CD2-CB 4.49Å; F441-P476 HydrophobicContact CD2-CG 4.39Å; F441-P476 HydrophobicContact CE2-CG 4.36Å; F441-N477 HydrophobicContact CB-CB 4.16Å; F441-N477 WeakPolarHBondContact O-CB 3.47Å; F441-N477 PolarHBondContact O-ND2 3.15Å
442	P	88.3	Confident	72.4	Confident	94 Å²	94	97.2 Å²	97.2	61%	0.61	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-66	162.3	176.5	29.5	-36.2	0	0	0	111.2	D444 N475	P442-D444 PolarHBondContact O-N 3.41Å; P442-N475 PolarHBondContact O-ND2 3.42Å; P442-N475 PolarHBondContact O-OD1 2.54Å
443	K	90.7	Very high	75.2	Confident	107 Å²	107	98.1 Å²	98.1	47%	0.465	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-57	128.5	163.9	47.1	171.8	169.2	-120.4	0	110.1	Y456 F467	K443-Y456 HydrophobicContact CB-CD1 3.81Å; K443-Y456 HydrophobicContact CB-CD2 3.62Å; K443-Y456 HydrophobicContact CB-CE1 4.07Å; K443-Y456 HydrophobicContact CB-CE2 3.87Å; K443-Y456 HydrophobicContact CB-CG 3.61Å; K443-Y456 HydrophobicContact CD-CD1 4.17Å; K443-Y456 HydrophobicContact CD-CE1 3.65Å; K443-Y456 HydrophobicContact CD-CE2 4.22Å; K443-Y456 HydrophobicContact CG-CD1 4.32Å; K443-Y456 HydrophobicContact CG-CD2 4.09Å; K443-Y456 HydrophobicContact CG-CE1 4.06Å; K443-Y456 HydrophobicContact CG-CE2 3.77Å; K443-Y456 HydrophobicContact CG-CG 4.37Å; K443-Y456 PolarHBondContact NZ-OH 2.85Å; K443-F467 HydrophobicContact CB-CB 4.28Å; K443-F467 HydrophobicContact CB-CD1 4.33Å; K443-F467 HydrophobicContact CB-CD2 4.05Å; K443-F467 HydrophobicContact CB-CE2 4.46Å; K443-F467 HydrophobicContact CB-CG 3.98Å; K443-F467 HydrophobicContact CD-CB 3.86Å; K443-F467 HydrophobicContact CD-CG 4.46Å
444	D	91.2	Very high	78.1	Confident	58 Å²	58	95.5 Å²	95.5	31%	0.31	48%	0.484	S	S	.	.			trans	-128.4	106.9	178.6	178.8	13.2	0	0	0	109.7	P442 G446 F467 N475	P442-D444 PolarHBondContact O-N 3.41Å; D444-G446 PolarHBondContact O-N 3.06Å; D444-G446 WeakPolarHBondContact OD1-CA 3.01Å; D444-G446 PolarHBondContact OD1-N 3.12Å; D444-F467 WeakPolarHBondContact O-CE2 3.3Å; D444-N475 HydrophobicContact CB-CB 4.32Å; D444-N475 WeakPolarHBondContact CB-ND2 3.18Å; D444-N475 PolarHBondContact OD2-N 3.13Å
445	A	88.8	Confident	81	Confident	44 Å²	44	88.6 Å²	88.6	36%	0.364	45%	0.453	S	S	.	.			trans	-64.1	-28.3	175.6	0	0	0	0	0	111.6	I468 Y469 S470	A445-I468 WeakPolarHBondContact CB-O 3.43Å; A445-Y469 WeakPolarHBondContact O-CD2 3.25Å; A445-S470 WeakPolarHBondContact O-CA 3.42Å; A445-S470 WeakPolarHBondContact O-CB 3.35Å; A445-S470 PolarHBondContact O-N 3.07Å; A445-S470 PolarHBondContact O-OG 3.22Å
446	G	87.3	Confident	83.7	Confident	23 Å²	23	81.1 Å²	81.1	24%	0.237	41%	0.413	C	S	.	.			trans	67.6	-179.1	-171.2	0	0	0	0	0	114.2	D444 S470 C472	D444-G446 PolarHBondContact O-N 3.06Å; D444-G446 WeakPolarHBondContact OD1-CA 3.01Å; D444-G446 PolarHBondContact OD1-N 3.12Å; G446-S470 WeakPolarHBondContact O-CB 3.03Å; G446-S470 PolarHBondContact O-OG 3.19Å; G446-S470 VanDerWaalsContact O-OG 3.14Å; G446-C472 WeakPolarHBondContact CA-O 3.05Å
447	P	83.4	Confident	85.8	Confident	110 Å²	110	76 Å²	76	71%	0.714	39%	0.388	S	S	*	.	S	Bend	trans	-101.1	13.8	-164.2	39	-37.3	0	0	0	116.3	C472	P447-C472 WeakPolarHBondContact CD-O 3.47Å
448	C	86.4	Confident	87	Confident	56 Å²	56	75.3 Å²	75.3	38%	0.378	39%	0.385	S	S	.	.			trans	-86.4	-162.4	177.7	-85.1	0	0	0	0	112.4	S470 C472	C448-S470 CarbonylContact C-O 3.6Å; C448-S470 WeakPolarHBondContact CB-O 3.03Å; C448-S470 PolarHBondContact N-OG 3.34Å; C448-C472 HydrophobicContact CB-CB 3.85Å; C448-C472 WeakPolarHBondContact CB-SG 3.46Å; C448-C472 WeakPolarHBondContact SG-CB 3.32Å; C448-C472 CovalentContact SG-SG 2.03Å; C448-C472 PolarHBondContact SG-SG 3.34Å
449	K	78	Confident	87.4	Confident	205 Å²	205	73.2 Å²	73.2	89%	0.891	38%	0.381	S	S	*	.			trans	-135.3	8.9	-171.4	-68.5	-170.9	175.2	-174.8	0	115.1	S470	K449-S470 PolarHBondContact N-O 2.85Å
450	E	70.7	Confident	87.2	Confident	116 Å²	116	79.4 Å²	79.4	54%	0.542	42%	0.419	S	S	.	.			trans	-97.9	135.3	178.9	-63.4	174.4	-172.4	0	0	109.7	H452 S470	E450-H452 WeakPolarHBondContact CB-NE2 3.46Å; E450-H452 PolarHBondContact O-N 2.03Å; E450-H452 IonicContact OE2-CD2 3.71Å; E450-H452 IonicContact OE2-CE1 2.68Å; E450-H452 IonicContact OE2-NE2 2.63Å; E450-H452 PolarHBondContact OE2-NE2 2.9Å; E450-S470 PolarHBondContact N-O 2.79Å; E450-S470 CarbonylContact O-C 3.58Å; E450-S470 WeakPolarHBondContact O-CA 3.41Å; E450-S470 VanDerWaalsContact O-O 3.06Å
451	N	83.7	Confident	87	Confident	138 Å²	138	79.4 Å²	79.4	74%	0.738	42%	0.416	S	S	*	.			trans	-93.8	89.4	-178.3	-70.1	-21.7	0	0	0	111.2	I468	N451-I468 HydrophobicContact CB-CG2 3.77Å
452	H	85.3	Confident	86.8	Confident	67 Å²	67	83.7 Å²	83.7	31%	0.31	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121	173.3	-64.9	-101.8	0	0	0	110	E450 R454 Y469 G471	E450-H452 WeakPolarHBondContact CB-NE2 3.46Å; E450-H452 PolarHBondContact O-N 2.03Å; E450-H452 IonicContact OE2-CD2 3.71Å; E450-H452 IonicContact OE2-CE1 2.68Å; E450-H452 IonicContact OE2-NE2 2.63Å; E450-H452 PolarHBondContact OE2-NE2 2.9Å; H452-R454 HydrophobicContact CB-CG 4.43Å; H452-R454 PolarHBondContact O-N 3.4Å; H452-Y469 HydrophobicContact CB-CD1 4.4Å; H452-Y469 WeakPolarHBondContact CB-O 3.1Å; H452-Y469 PolarHBondContact N-O 3.33Å; H452-Y469 PolarHBondContact O-N 3.06Å; H452-G471 VanDerWaalsContact CD2-CA 3.48Å; H452-G471 WeakPolarHBondContact CD2-CA 3.42Å
453	Q	88.9	Confident	86.6	Confident	134 Å²	134	83.2 Å²	83.2	63%	0.626	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	128	168.8	-176.2	173.1	-28.1	0	0	109.5
454	R	92.2	Very high	86.7	Confident	70 Å²	70	79 Å²	79	26%	0.264	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	171.1	-179.5	-66.8	-65.3	178.1	138.4	-6.5	109.8	H452 P466 F467 Y469 N478 F479	H452-R454 HydrophobicContact CB-CG 4.43Å; H452-R454 PolarHBondContact O-N 3.4Å; R454-P466 CarbonylContact O-C 3.39Å; R454-P466 VanDerWaalsContact O-CA 3.23Å; R454-P466 WeakPolarHBondContact O-CA 2.94Å; R454-F467 HydrophobicContact CB-CD1 4.05Å; R454-F467 HydrophobicContact CB-CE1 3.58Å; R454-F467 HydrophobicContact CB-CZ 3.9Å; R454-F467 PolarHBondContact N-O 3.28Å; R454-F467 PolarHBondContact O-N 2.75Å; R454-F467 VanDerWaalsContact O-O 3.13Å; R454-Y469 VanDerWaalsContact CG-CB 3.45Å; R454-Y469 HydrophobicContact CG-CD1 4.11Å; R454-Y469 HydrophobicContact CG-CG 4.15Å; R454-N478 WeakPolarHBondContact CB-OD1 3.02Å; R454-N478 WeakPolarHBondContact CD-OD1 3.43Å; R454-N478 WeakPolarHBondContact CG-OD1 3Å; R454-F479 CarbonylContact C-O 3.48Å; R454-F479 WeakPolarHBondContact CA-O 3.28Å; R454-F479 WeakPolarHBondContact CB-O 3.3Å; R454-F479 VanDerWaalsContact CD-O 3.24Å; R454-F479 WeakPolarHBondContact CD-O 3.42Å
455	W	93.7	Very high	86.6	Confident	48 Å²	48	78 Å²	78	18%	0.182	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	144.7	179.5	-64.1	80.2	0	0	0	110.8	E465 P466 F479 M482 C485	W455-E465 CarbonylContact C-O 3.57Å; W455-E465 VanDerWaalsContact CA-O 3.27Å; W455-E465 WeakPolarHBondContact CA-O 3.33Å; W455-P466 HydrophobicContact CD2-CB 4.23Å; W455-P466 HydrophobicContact CE3-CB 4.24Å; W455-P466 HydrophobicContact CH2-CB 4.21Å; W455-P466 HydrophobicContact CH2-CG 4.24Å; W455-P466 HydrophobicContact CZ2-CB 4.18Å; W455-P466 HydrophobicContact CZ3-CB 4.25Å; W455-P466 HydrophobicContact CZ3-CG 4.23Å; W455-F479 HydrophobicContact CB-CB 4.24Å; W455-F479 PolarHBondContact N-O 2.91Å; W455-F479 WeakPolarHBondContact O-CD2 3.28Å; W455-F479 PolarHBondContact O-N 2.87Å; W455-M482 HydrophobicContact CD2-CB 3.72Å; W455-M482 HydrophobicContact CD2-CG 4.18Å; W455-M482 HydrophobicContact CE3-CB 3.77Å; W455-M482 HydrophobicContact CE3-CG 3.69Å; W455-M482 HydrophobicContact CE3-SD 4.47Å; W455-M482 HydrophobicContact CG-CB 4.37Å; W455-M482 HydrophobicContact CH2-CB 3.9Å; W455-M482 HydrophobicContact CH2-CG 3.89Å; W455-M482 HydrophobicContact CH2-SD 3.7Å; W455-M482 HydrophobicContact CZ2-CB 3.85Å; W455-M482 HydrophobicContact CZ2-CG 4.36Å; W455-M482 HydrophobicContact CZ2-SD 4.47Å; W455-M482 HydrophobicContact CZ3-CB 3.86Å; W455-M482 HydrophobicContact CZ3-CG 3.52Å; W455-M482 HydrophobicContact CZ3-SD 3.69Å; W455-C485 HydrophobicContact CB-CB 4.06Å
456	Y	94.3	Very high	86.7	Confident	13 Å²	13	79.2 Å²	79.2	5%	0.051	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.2	175	82.6	-70	0	0	0	109.7	K443 N458 C464 E465 F467 N477 C485	K443-Y456 HydrophobicContact CB-CD1 3.81Å; K443-Y456 HydrophobicContact CB-CD2 3.62Å; K443-Y456 HydrophobicContact CB-CE1 4.07Å; K443-Y456 HydrophobicContact CB-CE2 3.87Å; K443-Y456 HydrophobicContact CB-CG 3.61Å; K443-Y456 HydrophobicContact CD-CD1 4.17Å; K443-Y456 HydrophobicContact CD-CE1 3.65Å; K443-Y456 HydrophobicContact CD-CE2 4.22Å; K443-Y456 HydrophobicContact CG-CD1 4.32Å; K443-Y456 HydrophobicContact CG-CD2 4.09Å; K443-Y456 HydrophobicContact CG-CE1 4.06Å; K443-Y456 HydrophobicContact CG-CE2 3.77Å; K443-Y456 HydrophobicContact CG-CG 4.37Å; K443-Y456 PolarHBondContact NZ-OH 2.85Å; Y456-N458 HydrophobicContact CE2-CB 3.81Å; Y456-N458 PolarHBondContact O-N 2.86Å; Y456-N458 PolarHBondContact OH-ND2 2.79Å; Y456-C464 WeakPolarHBondContact O-CA 3.35Å; Y456-E465 HydrophobicContact CD1-CB 3.96Å; Y456-E465 VanDerWaalsContact CD1-O 3.27Å; Y456-E465 WeakPolarHBondContact CD1-O 3.09Å; Y456-E465 HydrophobicContact CE1-CB 3.39Å; Y456-E465 HydrophobicContact CE1-CG 4.4Å; Y456-E465 PolarHBondContact N-O 2.03Å; Y456-E465 PolarHBondContact O-N 2.82Å; Y456-E465 PolarHBondContact OH-OE2 3.32Å; Y456-F467 HydrophobicContact CD1-CB 4.15Å; Y456-F467 AromaticContact CD1-CD1 3.79Å; Y456-F467 HydrophobicContact CD1-CD1 3.79Å; Y456-F467 HydrophobicContact CD1-CG 4.26Å; Y456-F467 HydrophobicContact CE1-CB 4.46Å; Y456-F467 HydrophobicContact CG-CD1 4.2Å; Y456-N477 WeakPolarHBondContact CA-OD1 3.22Å; Y456-N477 WeakPolarHBondContact CB-O 3.49Å; Y456-C485 VanDerWaalsContact C-SG 3.55Å
457	Y	93.4	Very high	87	Confident	27 Å²	27	79 Å²	79	11%	0.106	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	113.5	171.3	-173.2	-110	0	0	0	109.7	C439 T459 E462 N477 C485 C489 L490	C439-Y457 HydrophobicContact CB-CD1 3.79Å; C439-Y457 HydrophobicContact CB-CG 4.07Å; Y457-T459 HydrophobicContact CD1-CG2 3.74Å; Y457-T459 HydrophobicContact CE1-CG2 3.89Å; Y457-T459 PolarHBondContact O-N 2.83Å; Y457-E462 VanDerWaalsContact CE2-C 3.49Å; Y457-E462 WeakPolarHBondContact OH-CA 3.49Å; Y457-N477 PolarHBondContact N-ND2 3.5Å; Y457-N477 PolarHBondContact N-OD1 2.88Å; Y457-N477 PolarHBondContact O-ND2 3.08Å; Y457-C485 PolarHBondContact N-SG 3.32Å; Y457-C489 HydrophobicContact CD1-CB 4.18Å; Y457-C489 HydrophobicContact CD2-CB 3.61Å; Y457-C489 HydrophobicContact CE2-CB 4.23Å; Y457-C489 HydrophobicContact CG-CB 3.58Å; Y457-L490 HydrophobicContact CE2-CD1 4.44Å; Y457-L490 HydrophobicContact CE2-CD2 3.79Å; Y457-L490 HydrophobicContact CE2-CG 3.82Å
458	N	90.9	Very high	87.4	Confident	22 Å²	22	78.4 Å²	78.4	12%	0.118	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	100	173.5	-178.2	-11.7	0	0	0	108.6	Y456 V460 E461 E462 K463 E465	Y456-N458 HydrophobicContact CE2-CB 3.81Å; Y456-N458 PolarHBondContact O-N 2.86Å; Y456-N458 PolarHBondContact OH-ND2 2.79Å; N458-V460 PolarHBondContact O-N 2.84Å; N458-V460 VanDerWaalsContact O-N 3.14Å; N458-V460 WeakPolarHBondContact OD1-CB 3.41Å; N458-V460 PolarHBondContact OD1-N 2.87Å; N458-E461 CarbonylContact O-C 3.57Å; N458-E461 PolarHBondContact O-N 2.79Å; N458-E461 PolarHBondContact OD1-N 2.99Å; N458-E462 WeakPolarHBondContact O-CA 3.37Å; N458-E462 PolarHBondContact O-N 3.5Å; N458-K463 PolarHBondContact N-O 3.48Å; N458-K463 PolarHBondContact O-N 3.12Å; N458-E465 HydrophobicContact CB-CG 4.19Å; N458-E465 PolarHBondContact ND2-OE2 2.91Å
459	T	84.6	Confident	87.6	Confident	66 Å²	66	77.2 Å²	77.2	41%	0.405	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9.5	178.4	46.7	0	0	0	0	115	C439 Y457	C439-T459 WeakPolarHBondContact O-CG2 3.34Å; Y457-T459 HydrophobicContact CD1-CG2 3.74Å; Y457-T459 HydrophobicContact CE1-CG2 3.89Å; Y457-T459 PolarHBondContact O-N 2.83Å
460	V	83.2	Confident	87.9	Confident	129 Å²	129	68 Å²	68	78%	0.782	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-27.7	176.2	-174.4	0	0	0	0	111.6	N458	N458-V460 PolarHBondContact O-N 2.84Å; N458-V460 VanDerWaalsContact O-N 3.14Å; N458-V460 WeakPolarHBondContact OD1-CB 3.41Å; N458-V460 PolarHBondContact OD1-N 2.87Å
461	E	84	Confident	88.4	Confident	86 Å²	86	63.8 Å²	63.8	40%	0.402	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	11.3	176.7	-60.8	-162.7	170.5	0	0	113.2	N458 K463	N458-E461 CarbonylContact O-C 3.57Å; N458-E461 PolarHBondContact O-N 2.79Å; N458-E461 PolarHBondContact OD1-N 2.99Å; E461-K463 HydrophobicContact CB-CD 4.07Å; E461-K463 HydrophobicContact CB-CG 4.19Å; E461-K463 WeakPolarHBondContact O-CB 3.35Å; E461-K463 PolarHBondContact O-N 2.76Å; E461-K463 WeakPolarHBondContact OE2-CE 3.47Å; E461-K463 IonicContact OE2-NZ 2.84Å; E461-K463 PolarHBondContact OE2-NZ 3.48Å
462	E	83.4	Confident	88.4	Confident	145 Å²	145	59.2 Å²	59.2	68%	0.678	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.9	36.1	178.1	-60.3	-172.4	151.5	0	0	114.6	Y457 N458	Y457-E462 VanDerWaalsContact CE2-C 3.49Å; Y457-E462 WeakPolarHBondContact OH-CA 3.49Å; N458-E462 WeakPolarHBondContact O-CA 3.37Å; N458-E462 PolarHBondContact O-N 3.5Å
463	K	84.2	Confident	88.3	Confident	83 Å²	83	58.6 Å²	58.6	36%	0.361	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	157.3	-173	80.9	-171.2	-161.8	-158.2	0	112.5	N458 E461 E465	N458-K463 PolarHBondContact N-O 3.48Å; N458-K463 PolarHBondContact O-N 3.12Å; E461-K463 HydrophobicContact CB-CD 4.07Å; E461-K463 HydrophobicContact CB-CG 4.19Å; E461-K463 WeakPolarHBondContact O-CB 3.35Å; E461-K463 PolarHBondContact O-N 2.76Å; E461-K463 WeakPolarHBondContact OE2-CE 3.47Å; E461-K463 IonicContact OE2-NZ 2.84Å; E461-K463 PolarHBondContact OE2-NZ 3.48Å; K463-E465 HydrophobicContact CD-CG 4.32Å; K463-E465 VanDerWaalsContact CE-CD 3.41Å; K463-E465 WeakPolarHBondContact CE-OE1 3.3Å; K463-E465 HydrophobicContact CG-CG 4.04Å; K463-E465 IonicContact NZ-OE1 3.22Å; K463-E465 PolarHBondContact NZ-OE1 2.98Å
464	C	93.2	Very high	88	Confident	18 Å²	18	53.4 Å²	53.4	12%	0.122	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.2	170.4	-73.1	0	0	0	0	111.8	Y456 C485 Q486	Y456-C464 WeakPolarHBondContact O-CA 3.35Å; C464-C485 HydrophobicContact CB-CB 3.79Å; C464-C485 WeakPolarHBondContact CB-SG 3.34Å; C464-C485 WeakPolarHBondContact SG-CB 3.44Å; C464-C485 CovalentContact SG-SG 2.04Å; C464-C485 PolarHBondContact SG-SG 3.37Å; C464-Q486 PolarHBondContact SG-N 2.88Å
465	E	88.9	Confident	87.8	Confident	39 Å²	39	51.6 Å²	51.6	18%	0.182	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.6	-179	-74.5	-162.6	130.5	0	0	111.7	W455 Y456 N458 K463	W455-E465 CarbonylContact C-O 3.57Å; W455-E465 VanDerWaalsContact CA-O 3.27Å; W455-E465 WeakPolarHBondContact CA-O 3.33Å; Y456-E465 HydrophobicContact CD1-CB 3.96Å; Y456-E465 VanDerWaalsContact CD1-O 3.27Å; Y456-E465 WeakPolarHBondContact CD1-O 3.09Å; Y456-E465 HydrophobicContact CE1-CB 3.39Å; Y456-E465 HydrophobicContact CE1-CG 4.4Å; Y456-E465 PolarHBondContact N-O 2.03Å; Y456-E465 PolarHBondContact O-N 2.82Å; Y456-E465 PolarHBondContact OH-OE2 3.32Å; N458-E465 HydrophobicContact CB-CG 4.19Å; N458-E465 PolarHBondContact ND2-OE2 2.91Å; K463-E465 HydrophobicContact CD-CG 4.32Å; K463-E465 VanDerWaalsContact CE-CD 3.41Å; K463-E465 WeakPolarHBondContact CE-OE1 3.3Å; K463-E465 HydrophobicContact CG-CG 4.04Å; K463-E465 IonicContact NZ-OE1 3.22Å; K463-E465 PolarHBondContact NZ-OE1 2.98Å
466	P	90.6	Very high	87.6	Confident	68 Å²	68	52.2 Å²	52.2	44%	0.442	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	147.4	172.4	32.6	-32.8	0	0	0	111.4	R454 W455	R454-P466 CarbonylContact O-C 3.39Å; R454-P466 VanDerWaalsContact O-CA 3.23Å; R454-P466 WeakPolarHBondContact O-CA 2.94Å; W455-P466 HydrophobicContact CD2-CB 4.23Å; W455-P466 HydrophobicContact CE3-CB 4.24Å; W455-P466 HydrophobicContact CH2-CB 4.21Å; W455-P466 HydrophobicContact CH2-CG 4.24Å; W455-P466 HydrophobicContact CZ2-CB 4.18Å; W455-P466 HydrophobicContact CZ3-CB 4.25Å; W455-P466 HydrophobicContact CZ3-CG 4.23Å
467	F	94.7	Very high	87.5	Confident	18 Å²	18	51.6 Å²	51.6	8%	0.079	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	163.4	168.8	78.9	-76.3	0	0	0	110.8	K443 D444 R454 Y456 N478	K443-F467 HydrophobicContact CB-CB 4.28Å; K443-F467 HydrophobicContact CB-CD1 4.33Å; K443-F467 HydrophobicContact CB-CD2 4.05Å; K443-F467 HydrophobicContact CB-CE2 4.46Å; K443-F467 HydrophobicContact CB-CG 3.98Å; K443-F467 HydrophobicContact CD-CB 3.86Å; K443-F467 HydrophobicContact CD-CG 4.46Å; D444-F467 WeakPolarHBondContact O-CE2 3.3Å; R454-F467 HydrophobicContact CB-CD1 4.05Å; R454-F467 HydrophobicContact CB-CE1 3.58Å; R454-F467 HydrophobicContact CB-CZ 3.9Å; R454-F467 PolarHBondContact N-O 3.28Å; R454-F467 PolarHBondContact O-N 2.75Å; R454-F467 VanDerWaalsContact O-O 3.13Å; Y456-F467 HydrophobicContact CD1-CB 4.15Å; Y456-F467 AromaticContact CD1-CD1 3.79Å; Y456-F467 HydrophobicContact CD1-CD1 3.79Å; Y456-F467 HydrophobicContact CD1-CG 4.26Å; Y456-F467 HydrophobicContact CE1-CB 4.46Å; Y456-F467 HydrophobicContact CG-CD1 4.2Å; F467-N478 HydrophobicContact CZ-CB 4.1Å
468	I	90.5	Very high	87.6	Confident	99 Å²	99	51.7 Å²	51.7	51%	0.508	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.3	172.6	-57.9	179.6	0	0	0	108.5	A445 N451	A445-I468 WeakPolarHBondContact CB-O 3.43Å; N451-I468 HydrophobicContact CB-CG2 3.77Å
469	Y	92.2	Very high	87.7	Confident	31 Å²	31	52 Å²	52	12%	0.122	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.8	168.4	177	-129.9	0	0	0	109.8	A445 H452 R454 G471 C472 G473 G474 N478	A445-Y469 WeakPolarHBondContact O-CD2 3.25Å; H452-Y469 HydrophobicContact CB-CD1 4.4Å; H452-Y469 WeakPolarHBondContact CB-O 3.1Å; H452-Y469 PolarHBondContact N-O 3.33Å; H452-Y469 PolarHBondContact O-N 3.06Å; R454-Y469 VanDerWaalsContact CG-CB 3.45Å; R454-Y469 HydrophobicContact CG-CD1 4.11Å; R454-Y469 HydrophobicContact CG-CG 4.15Å; Y469-G471 PolarHBondContact O-N 3.48Å; Y469-G471 VanDerWaalsContact O-N 3.1Å; Y469-C472 WeakPolarHBondContact CE2-O 3.49Å; Y469-C472 WeakPolarHBondContact OH-CA 3.18Å; Y469-C472 PolarHBondContact OH-N 3.36Å; Y469-G473 PolarHBondContact OH-N 2.99Å; Y469-G474 PolarHBondContact OH-N 2.91Å; Y469-N478 VanDerWaalsContact CD2-ND2 3.27Å; Y469-N478 WeakPolarHBondContact CD2-ND2 3.46Å; Y469-N478 WeakPolarHBondContact CE2-ND2 3.33Å
470	S	83.7	Confident	87.9	Confident	10 Å²	10	54.3 Å²	54.3	7%	0.07	31%	0.314	C	S	.	.			trans	-71.6	-1.2	-174.3	73.6	0	0	0	0	115.2	A445 G446 C448 K449 E450 C472	A445-S470 WeakPolarHBondContact O-CA 3.42Å; A445-S470 WeakPolarHBondContact O-CB 3.35Å; A445-S470 PolarHBondContact O-N 3.07Å; A445-S470 PolarHBondContact O-OG 3.22Å; G446-S470 WeakPolarHBondContact O-CB 3.03Å; G446-S470 PolarHBondContact O-OG 3.19Å; G446-S470 VanDerWaalsContact O-OG 3.14Å; C448-S470 CarbonylContact C-O 3.6Å; C448-S470 WeakPolarHBondContact CB-O 3.03Å; C448-S470 PolarHBondContact N-OG 3.34Å; K449-S470 PolarHBondContact N-O 2.85Å; E450-S470 PolarHBondContact N-O 2.79Å; E450-S470 CarbonylContact O-C 3.58Å; E450-S470 WeakPolarHBondContact O-CA 3.41Å; E450-S470 VanDerWaalsContact O-O 3.06Å; S470-C472 PolarHBondContact OG-O 2.8Å
471	G	81.5	Confident	88.1	Confident	29 Å²	29	50.2 Å²	50.2	30%	0.299	29%	0.292	S	S	.	.	S	Bend	trans	96.4	-22.7	-174.9	0	0	0	0	0	114.6	H452 Y469	H452-G471 VanDerWaalsContact CD2-CA 3.48Å; H452-G471 WeakPolarHBondContact CD2-CA 3.42Å; Y469-G471 PolarHBondContact O-N 3.48Å; Y469-G471 VanDerWaalsContact O-N 3.1Å
472	C	83.7	Confident	88.1	Confident	42 Å²	42	50.7 Å²	50.7	28%	0.284	30%	0.295	S	S	.	.	S	Bend	trans	-144.9	158.6	177.6	81.9	0	0	0	0	114.1	G446 P447 C448 Y469 S470 G474	G446-C472 WeakPolarHBondContact CA-O 3.05Å; P447-C472 WeakPolarHBondContact CD-O 3.47Å; C448-C472 HydrophobicContact CB-CB 3.85Å; C448-C472 WeakPolarHBondContact CB-SG 3.46Å; C448-C472 WeakPolarHBondContact SG-CB 3.32Å; C448-C472 CovalentContact SG-SG 2.03Å; C448-C472 PolarHBondContact SG-SG 3.34Å; Y469-C472 WeakPolarHBondContact CE2-O 3.49Å; Y469-C472 WeakPolarHBondContact OH-CA 3.18Å; Y469-C472 PolarHBondContact OH-N 3.36Å; S470-C472 PolarHBondContact OG-O 2.8Å; C472-G474 PolarHBondContact O-N 2.85Å
473	G	83.4	Confident	87.8	Confident	53 Å²	53	48.8 Å²	48.8	55%	0.546	29%	0.289	S	S	.	.	S	Bend	trans	75.4	14.6	163.1	0	0	0	0	0	117.1	Y469	Y469-G473 PolarHBondContact OH-N 2.99Å
474	G	81.9	Confident	87.7	Confident	26 Å²	26	45.6 Å²	45.6	27%	0.268	28%	0.279	S	S	.	.			trans	-84.6	158.8	177.9	0	0	0	0	0	113.1	Y469 C472	Y469-G474 PolarHBondContact OH-N 2.91Å; C472-G474 PolarHBondContact O-N 2.85Å
475	N	87	Confident	87.6	Confident	32 Å²	32	44.7 Å²	44.7	17%	0.171	27%	0.273	C	S	.	.			trans	-79.8	178.4	178.6	79.3	48.1	0	0	0	113.2	F441 P442 D444 N477 N478	F441-N475 HydrophobicContact CB-CB 4.39Å; F441-N475 WeakPolarHBondContact CB-OD1 3.11Å; P442-N475 PolarHBondContact O-ND2 3.42Å; P442-N475 PolarHBondContact O-OD1 2.54Å; D444-N475 HydrophobicContact CB-CB 4.32Å; D444-N475 WeakPolarHBondContact CB-ND2 3.18Å; D444-N475 PolarHBondContact OD2-N 3.13Å; N475-N477 VanDerWaalsContact C-N 3.28Å; N475-N477 PolarHBondContact O-N 3.17Å; N475-N477 PolarHBondContact OD1-N 2.63Å; N475-N478 VanDerWaalsContact O-CB 3.28Å; N475-N478 WeakPolarHBondContact O-CB 3.39Å
476	P	89.7	Confident	87.3	Confident	61 Å²	61	47.2 Å²	47.2	40%	0.396	29%	0.285	S	S	.	.	S	Bend	trans	-65.5	-13.1	-174.6	-24.5	36.1	0	0	0	117.6	K438 F441 N478	K438-P476 HydrophobicContact CB-CB 3.77Å; K438-P476 HydrophobicContact CD-CB 3.97Å; K438-P476 HydrophobicContact CG-CB 3.66Å; F441-P476 HydrophobicContact CD2-CB 4.49Å; F441-P476 HydrophobicContact CD2-CG 4.39Å; F441-P476 HydrophobicContact CE2-CG 4.36Å; P476-N478 PolarHBondContact O-N 2.74Å
477	N	93.1	Very high	86.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.288	C	S	.	.			trans	-83.6	58.9	177.2	-156.7	3.8	0	0	0	110.5	K438 C439 F441 Y456 Y457 N475 F479	K438-N477 WeakPolarHBondContact O-CA 3.14Å; K438-N477 WeakPolarHBondContact O-CB 3.06Å; K438-N477 PolarHBondContact O-N 2.97Å; C439-N477 PolarHBondContact O-ND2 3.03Å; F441-N477 HydrophobicContact CB-CB 4.16Å; F441-N477 WeakPolarHBondContact O-CB 3.47Å; F441-N477 PolarHBondContact O-ND2 3.15Å; Y456-N477 WeakPolarHBondContact CA-OD1 3.22Å; Y456-N477 WeakPolarHBondContact CB-O 3.49Å; Y457-N477 PolarHBondContact N-ND2 3.5Å; Y457-N477 PolarHBondContact N-OD1 2.88Å; Y457-N477 PolarHBondContact O-ND2 3.08Å; N475-N477 VanDerWaalsContact C-N 3.28Å; N475-N477 PolarHBondContact O-N 3.17Å; N475-N477 PolarHBondContact OD1-N 2.63Å; N477-F479 WeakPolarHBondContact OD1-CE2 3.17Å
478	N	94.6	Very high	86.1	Confident	29 Å²	29	51.1 Å²	51.1	16%	0.155	30%	0.302	C	S	.	.			trans	-146.7	78.2	-165.8	-173.6	-11	0	0	0	110.6	R454 F467 Y469 N475 P476	R454-N478 WeakPolarHBondContact CB-OD1 3.02Å; R454-N478 WeakPolarHBondContact CD-OD1 3.43Å; R454-N478 WeakPolarHBondContact CG-OD1 3Å; F467-N478 HydrophobicContact CZ-CB 4.1Å; Y469-N478 VanDerWaalsContact CD2-ND2 3.27Å; Y469-N478 WeakPolarHBondContact CD2-ND2 3.46Å; Y469-N478 WeakPolarHBondContact CE2-ND2 3.33Å; N475-N478 VanDerWaalsContact O-CB 3.28Å; N475-N478 WeakPolarHBondContact O-CB 3.39Å; P476-N478 PolarHBondContact O-N 2.74Å
479	F	93.8	Very high	85.8	Confident	27 Å²	27	46.8 Å²	46.8	12%	0.118	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-89.8	148.5	-179.1	-57.6	-84.6	0	0	0	110.9	R454 W455 N477 S481 C485 T488 C489	R454-F479 CarbonylContact C-O 3.48Å; R454-F479 WeakPolarHBondContact CA-O 3.28Å; R454-F479 WeakPolarHBondContact CB-O 3.3Å; R454-F479 VanDerWaalsContact CD-O 3.24Å; R454-F479 WeakPolarHBondContact CD-O 3.42Å; W455-F479 HydrophobicContact CB-CB 4.24Å; W455-F479 PolarHBondContact N-O 2.91Å; W455-F479 WeakPolarHBondContact O-CD2 3.28Å; W455-F479 PolarHBondContact O-N 2.87Å; N477-F479 WeakPolarHBondContact OD1-CE2 3.17Å; F479-S481 VanDerWaalsContact C-N 3.3Å; F479-C485 HydrophobicContact CB-CB 3.85Å; F479-C485 HydrophobicContact CD1-CB 4.4Å; F479-C485 HydrophobicContact CD2-CB 3.44Å; F479-C485 VanDerWaalsContact CD2-CB 3.44Å; F479-C485 HydrophobicContact CE2-CB 4.08Å; F479-C485 HydrophobicContact CG-CB 3.63Å; F479-T488 HydrophobicContact CE1-CG2 3.71Å; F479-T488 WeakPolarHBondContact CE1-OG1 3.27Å; F479-T488 HydrophobicContact CZ-CG2 3.71Å; F479-C489 VanDerWaalsContact CZ-SG 3.57Å
480	D	89.6	Confident	85.1	Confident	116 Å²	116	49.3 Å²	49.3	62%	0.62	30%	0.295	S	S	*	.	S	Bend	trans	-73.3	-23.5	172.7	48.5	27	0	0	0	113.1
481	S	87	Confident	83.9	Confident	43 Å²	43	56.2 Å²	56.2	30%	0.301	33%	0.326	S	S	.	.	S	Bend	trans	-140.4	150.6	-168	55.1	0	0	0	0	112.1	F479 L483 G484 C485	F479-S481 VanDerWaalsContact C-N 3.3Å; S481-L483 VanDerWaalsContact C-N 3.31Å; S481-L483 PolarHBondContact O-N 3.47Å; S481-G484 PolarHBondContact OG-N 3.11Å; S481-C485 PolarHBondContact O-N 2.84Å; S481-C485 VanDerWaalsContact O-N 3.17Å
482	M	84.1	Confident	82.1	Confident	96 Å²	96	60.3 Å²	60.3	47%	0.473	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-42.4	175.2	-171.5	179.1	77.6	0	0	111.2	W455 C485 Q486	W455-M482 HydrophobicContact CD2-CB 3.72Å; W455-M482 HydrophobicContact CD2-CG 4.18Å; W455-M482 HydrophobicContact CE3-CB 3.77Å; W455-M482 HydrophobicContact CE3-CG 3.69Å; W455-M482 HydrophobicContact CE3-SD 4.47Å; W455-M482 HydrophobicContact CG-CB 4.37Å; W455-M482 HydrophobicContact CH2-CB 3.9Å; W455-M482 HydrophobicContact CH2-CG 3.89Å; W455-M482 HydrophobicContact CH2-SD 3.7Å; W455-M482 HydrophobicContact CZ2-CB 3.85Å; W455-M482 HydrophobicContact CZ2-CG 4.36Å; W455-M482 HydrophobicContact CZ2-SD 4.47Å; W455-M482 HydrophobicContact CZ3-CB 3.86Å; W455-M482 HydrophobicContact CZ3-CG 3.52Å; W455-M482 HydrophobicContact CZ3-SD 3.69Å; M482-C485 WeakPolarHBondContact O-CB 3.34Å; M482-C485 PolarHBondContact O-N 3.34Å; M482-Q486 WeakPolarHBondContact O-CB 3.35Å; M482-Q486 PolarHBondContact O-N 2.04Å
483	L	75.8	Confident	80.1	Confident	105 Å²	105	63.5 Å²	63.5	55%	0.55	36%	0.355	S	S	.	.	H	α-helix	trans	-64.4	-48.3	-180	-176.2	62.5	0	0	0	111.5	S481 C485 Q486 E487	S481-L483 VanDerWaalsContact C-N 3.31Å; S481-L483 PolarHBondContact O-N 3.47Å; L483-C485 VanDerWaalsContact C-N 3.26Å; L483-C485 PolarHBondContact O-N 3.42Å; L483-Q486 PolarHBondContact O-N 3.33Å; L483-E487 HydrophobicContact CD1-CG 4.01Å; L483-E487 HydrophobicContact CG-CG 4.23Å; L483-E487 WeakPolarHBondContact CG-OE1 3.43Å; L483-E487 WeakPolarHBondContact O-CG 3.34Å; L483-E487 PolarHBondContact O-N 3.3Å
484	G	82.3	Confident	78.7	Confident	15 Å²	15	65.6 Å²	65.6	16%	0.155	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-32.1	177.6	0	0	0	0	0	113.5	S481 T488	S481-G484 PolarHBondContact OG-N 3.11Å; G484-T488 VanDerWaalsContact O-CB 3.26Å; G484-T488 WeakPolarHBondContact O-CB 3.24Å; G484-T488 PolarHBondContact O-N 2.67Å; G484-T488 PolarHBondContact O-OG1 2.88Å
485	C	91.9	Very high	78.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-49.7	168.3	177.6	0	0	0	0	111.5	W455 Y456 Y457 C464 F479 S481 M482 L483 T488 C489	W455-C485 HydrophobicContact CB-CB 4.06Å; Y456-C485 VanDerWaalsContact C-SG 3.55Å; Y457-C485 PolarHBondContact N-SG 3.32Å; C464-C485 HydrophobicContact CB-CB 3.79Å; C464-C485 WeakPolarHBondContact CB-SG 3.34Å; C464-C485 WeakPolarHBondContact SG-CB 3.44Å; C464-C485 CovalentContact SG-SG 2.04Å; C464-C485 PolarHBondContact SG-SG 3.37Å; F479-C485 HydrophobicContact CB-CB 3.85Å; F479-C485 HydrophobicContact CD1-CB 4.4Å; F479-C485 HydrophobicContact CD2-CB 3.44Å; F479-C485 VanDerWaalsContact CD2-CB 3.44Å; F479-C485 HydrophobicContact CE2-CB 4.08Å; F479-C485 HydrophobicContact CG-CB 3.63Å; S481-C485 PolarHBondContact O-N 2.84Å; S481-C485 VanDerWaalsContact O-N 3.17Å; M482-C485 WeakPolarHBondContact O-CB 3.34Å; M482-C485 PolarHBondContact O-N 3.34Å; L483-C485 VanDerWaalsContact C-N 3.26Å; L483-C485 PolarHBondContact O-N 3.42Å; C485-T488 PolarHBondContact O-N 3.13Å; C485-C489 WeakPolarHBondContact O-CB 3.42Å; C485-C489 PolarHBondContact O-N 3.22Å; C485-C489 PolarHBondContact O-SG 3.24Å
486	Q	83.3	Confident	77.7	Confident	92 Å²	92	69.9 Å²	69.9	43%	0.43	38%	0.383	S	S	.	.	H	α-helix	trans	-62.7	-50.1	-176.1	171.4	149.5	0.4	0	0	112	C464 M482 L483 T488 C489 L490	C464-Q486 PolarHBondContact SG-N 2.88Å; M482-Q486 WeakPolarHBondContact O-CB 3.35Å; M482-Q486 PolarHBondContact O-N 2.04Å; L483-Q486 PolarHBondContact O-N 3.33Å; Q486-T488 VanDerWaalsContact C-N 3.34Å; Q486-T488 PolarHBondContact O-N 2.82Å; Q486-C489 PolarHBondContact O-N 3.38Å; Q486-L490 HydrophobicContact CB-CD1 4.35Å; Q486-L490 HydrophobicContact CG-CD1 3.8Å; Q486-L490 WeakPolarHBondContact O-CB 3.42Å; Q486-L490 PolarHBondContact O-N 3.43Å
487	E	76.6	Confident	77.6	Confident	109 Å²	109	67.9 Å²	67.9	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-58.7	-42.1	175.1	-67.9	173.6	169	0	0	112	L483	L483-E487 HydrophobicContact CD1-CG 4.01Å; L483-E487 HydrophobicContact CG-CG 4.23Å; L483-E487 WeakPolarHBondContact CG-OE1 3.43Å; L483-E487 WeakPolarHBondContact O-CG 3.34Å; L483-E487 PolarHBondContact O-N 3.3Å
488	T	81.7	Confident	77.3	Confident	59 Å²	59	72.4 Å²	72.4	36%	0.362	39%	0.39	S	S	.	.	H	α-helix	trans	-72.1	-31.3	-179.1	-56.3	0	0	0	0	112.8	F479 G484 C485 Q486 L492	F479-T488 HydrophobicContact CE1-CG2 3.71Å; F479-T488 WeakPolarHBondContact CE1-OG1 3.27Å; F479-T488 HydrophobicContact CZ-CG2 3.71Å; G484-T488 VanDerWaalsContact O-CB 3.26Å; G484-T488 WeakPolarHBondContact O-CB 3.24Å; G484-T488 PolarHBondContact O-N 2.67Å; G484-T488 PolarHBondContact O-OG1 2.88Å; C485-T488 PolarHBondContact O-N 3.13Å; Q486-T488 VanDerWaalsContact C-N 3.34Å; Q486-T488 PolarHBondContact O-N 2.82Å; T488-L492 WeakPolarHBondContact O-CD1 3.06Å
489	C	85	Confident	76.8	Confident	8 Å²	8	72.6 Å²	72.6	5%	0.054	39%	0.39	C	S	.	.	H	α-helix	trans	-111.3	-29	-163.1	-62.4	0	0	0	0	115.9	C439 Y457 F479 C485 Q486	C439-C489 HydrophobicContact CB-CB 3.59Å; C439-C489 WeakPolarHBondContact CB-SG 3.07Å; C439-C489 WeakPolarHBondContact SG-CA 3.49Å; C439-C489 WeakPolarHBondContact SG-CB 3.01Å; C439-C489 CovalentContact SG-SG 2.02Å; C439-C489 PolarHBondContact SG-SG 2.93Å; Y457-C489 HydrophobicContact CD1-CB 4.18Å; Y457-C489 HydrophobicContact CD2-CB 3.61Å; Y457-C489 HydrophobicContact CE2-CB 4.23Å; Y457-C489 HydrophobicContact CG-CB 3.58Å; F479-C489 VanDerWaalsContact CZ-SG 3.57Å; C485-C489 WeakPolarHBondContact O-CB 3.42Å; C485-C489 PolarHBondContact O-N 3.22Å; C485-C489 PolarHBondContact O-SG 3.24Å; Q486-C489 PolarHBondContact O-N 3.38Å
490	L	76.6	Confident	76.3	Confident	84 Å²	84	75.5 Å²	75.5	44%	0.44	41%	0.412	S	S	.	.	S	Bend	trans	-91.5	-3.7	-177.8	-76.7	159.3	0	0	0	113.7	Y457 Q486	Y457-L490 HydrophobicContact CE2-CD1 4.44Å; Y457-L490 HydrophobicContact CE2-CD2 3.79Å; Y457-L490 HydrophobicContact CE2-CG 3.82Å; Q486-L490 HydrophobicContact CB-CD1 4.35Å; Q486-L490 HydrophobicContact CG-CD1 3.8Å; Q486-L490 WeakPolarHBondContact O-CB 3.42Å; Q486-L490 PolarHBondContact O-N 3.43Å
491	E	60.1	Low	76.2	Confident	154 Å²	154	72.9 Å²	72.9	72%	0.72	40%	0.401	S	S	*	.	S	Bend	trans	-102.8	1.3	-178.7	-58.5	-157.8	149.4	0	0	115.3	D493	E491-D493 PolarHBondContact O-N 3.44Å
492	L	43.5	Very low	76.2	Confident	116 Å²	116	73.5 Å²	73.5	61%	0.607	40%	0.401	S	S	*	.			trans	-101.9	72.8	-171.2	-71.9	174.1	0	0	0	114.7	T488	T488-L492 WeakPolarHBondContact O-CD1 3.06Å
493	D	41.2	Very low	76.4	Confident	108 Å²	108	72.6 Å²	72.6	58%	0.578	40%	0.4	S	S	*	.			trans	-108.5	136.9	161.9	-171.2	20.8	0	0	0	112.4	E491 D495 H499	E491-D493 PolarHBondContact O-N 3.44Å; D493-D495 PolarHBondContact O-N 3.37Å; D493-H499 PolarHBondContact O-NE2 3.42Å
494	A	54.6	Low	76.9	Confident	98 Å²	98	68.2 Å²	68.2	81%	0.81	38%	0.381	S	S	*	.	S	Bend	trans	-100.8	21.5	-138	0	0	0	0	0	116.3
495	D	70.3	Confident	76.8	Confident	58 Å²	58	73.4 Å²	73.4	31%	0.31	41%	0.41	S	S	.	.			trans	-156.6	109.8	165.5	175	-5.9	0	0	0	109.5	D493 C497 K498 H499	D493-D495 PolarHBondContact O-N 3.37Å; D495-C497 PolarHBondContact O-N 3.11Å; D495-C497 VanDerWaalsContact O-N 3.16Å; D495-C497 WeakPolarHBondContact OD1-CB 3.33Å; D495-C497 PolarHBondContact OD1-N 2.82Å; D495-K498 HydrophobicContact CB-CB 4.44Å; D495-K498 HydrophobicContact CB-CD 3.83Å; D495-K498 HydrophobicContact CB-CG 3.76Å; D495-K498 VanDerWaalsContact CG-NZ 3.34Å; D495-K498 WeakPolarHBondContact O-CB 3.24Å; D495-K498 PolarHBondContact O-N 2.99Å; D495-K498 VanDerWaalsContact OD2-CE 3.31Å; D495-K498 WeakPolarHBondContact OD2-CE 3.33Å; D495-K498 WeakPolarHBondContact OD2-CG 3.03Å; D495-K498 IonicContact OD2-NZ 3.98Å; D495-K498 PolarHBondContact OD2-NZ 2.86Å; D495-H499 PolarHBondContact O-CD2 2.03Å
496	I	77.6	Confident	76.4	Confident	89 Å²	89	76.2 Å²	76.2	46%	0.456	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-54.5	-36.4	-175.3	-67.5	175.3	0	0	0	112	K498 H499 G534 N535 F537	I496-K498 PolarHBondContact O-N 2.85Å; I496-H499 PolarHBondContact O-N 3.4Å; I496-G534 WeakPolarHBondContact CG2-O 3.16Å; I496-N535 WeakPolarHBondContact O-CB 2.98Å; I496-F537 HydrophobicContact CG2-CZ 4.45Å
497	C	87.7	Confident	76.1	Confident	19 Å²	19	77.9 Å²	77.9	13%	0.128	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-73.2	-6.6	179.6	-58.4	0	0	0	0	113.5	D495 F515 C547	D495-C497 PolarHBondContact O-N 3.11Å; D495-C497 VanDerWaalsContact O-N 3.16Å; D495-C497 WeakPolarHBondContact OD1-CB 3.33Å; D495-C497 PolarHBondContact OD1-N 2.82Å; C497-F515 HydrophobicContact CB-CD1 4.04Å; C497-F515 WeakPolarHBondContact O-CD1 3.01Å; C497-C547 HydrophobicContact CB-CB 3.76Å; C497-C547 WeakPolarHBondContact CB-SG 3.3Å; C497-C547 WeakPolarHBondContact SG-CA 3.47Å; C497-C547 WeakPolarHBondContact SG-CB 3.3Å; C497-C547 CovalentContact SG-SG 2.04Å; C497-C547 PolarHBondContact SG-SG 2.81Å
498	K	85.7	Confident	76.1	Confident	95 Å²	95	74.2 Å²	74.2	41%	0.413	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-94.1	-20.2	173.5	-57.2	-173.7	-179.4	90.7	0	113.6	D495 I496 R517	D495-K498 HydrophobicContact CB-CB 4.44Å; D495-K498 HydrophobicContact CB-CD 3.83Å; D495-K498 HydrophobicContact CB-CG 3.76Å; D495-K498 VanDerWaalsContact CG-NZ 3.34Å; D495-K498 WeakPolarHBondContact O-CB 3.24Å; D495-K498 PolarHBondContact O-N 2.99Å; D495-K498 VanDerWaalsContact OD2-CE 3.31Å; D495-K498 WeakPolarHBondContact OD2-CE 3.33Å; D495-K498 WeakPolarHBondContact OD2-CG 3.03Å; D495-K498 IonicContact OD2-NZ 3.98Å; D495-K498 PolarHBondContact OD2-NZ 2.86Å; I496-K498 PolarHBondContact O-N 2.85Å; K498-R517 VanDerWaalsContact CE-NH2 3.31Å
499	H	83.9	Confident	76.3	Confident	34 Å²	34	81.2 Å²	81.2	16%	0.157	46%	0.456	C	S	.	.	S	Bend	trans	-60.9	143.3	-177.5	-82.7	-110.7	0	0	0	110.7	D493 D495 I496 N533 N535	D493-H499 PolarHBondContact O-NE2 3.42Å; D495-H499 PolarHBondContact O-CD2 2.03Å; I496-H499 PolarHBondContact O-N 3.4Å; H499-N533 HydrophobicContact CB-CB 4.42Å; H499-N535 HydrophobicContact CB-CB 4.06Å; H499-N535 PolarHBondContact O-ND2 3.18Å
500	P	83.7	Confident	76.4	Confident	88 Å²	88	84.2 Å²	84.2	57%	0.571	47%	0.471	S	S	*	.			trans	-65.7	152.9	175.8	29.3	-35.4	0	0	0	110.8	N502 N533	P500-N502 PolarHBondContact O-N 3.19Å; P500-N533 PolarHBondContact O-ND2 2.73Å; P500-N533 PolarHBondContact O-OD1 3.44Å
501	P	87.5	Confident	77	Confident	60 Å²	60	86.1 Å²	86.1	39%	0.39	48%	0.478	S	S	.	.			trans	-58.2	103	171.2	23.3	-33.2	0	0	0	110.7	Y514 L525	P501-Y514 HydrophobicContact CB-CD1 3.91Å; P501-Y514 HydrophobicContact CB-CD2 3.63Å; P501-Y514 HydrophobicContact CB-CE1 3.97Å; P501-Y514 HydrophobicContact CB-CE2 3.73Å; P501-Y514 HydrophobicContact CB-CG 3.7Å; P501-Y514 HydrophobicContact CG-CD2 3.96Å; P501-Y514 HydrophobicContact CG-CE1 4.45Å; P501-Y514 HydrophobicContact CG-CE2 3.63Å; P501-Y514 HydrophobicContact CG-CG 4.5Å; P501-L525 HydrophobicContact CB-CD1 3.96Å
502	N	86.5	Confident	78.6	Confident	57 Å²	57	82 Å²	82	31%	0.305	46%	0.456	S	S	.	.			trans	-99.5	107.9	178.2	-178.2	9	0	0	0	110	P500 G504 G531 N533	P500-N502 PolarHBondContact O-N 3.19Å; N502-G504 PolarHBondContact O-N 3.13Å; N502-G504 WeakPolarHBondContact OD1-CA 3.34Å; N502-G504 PolarHBondContact OD1-N 2.89Å; N502-G531 PolarHBondContact ND2-O 3.06Å; N502-N533 HydrophobicContact CB-CB 4.34Å; N502-N533 WeakPolarHBondContact CB-ND2 3.49Å; N502-N533 PolarHBondContact ND2-N 2.93Å
503	V	88.7	Confident	81	Confident	76 Å²	76	78.8 Å²	78.8	46%	0.461	44%	0.436	S	S	.	.			trans	-57.8	-31.2	173.4	166.9	0	0	0	0	111.9	L525 L526 Y527 S528	V503-L525 HydrophobicContact CG2-CD1 4.05Å; V503-L526 WeakPolarHBondContact CG1-O 3.18Å; V503-Y527 WeakPolarHBondContact O-CD2 3.49Å; V503-S528 WeakPolarHBondContact O-CB 3.47Å; V503-S528 PolarHBondContact O-N 2.76Å; V503-S528 PolarHBondContact O-OG 3.3Å
504	G	85.4	Confident	83.5	Confident	14 Å²	14	75.4 Å²	75.4	14%	0.144	42%	0.415	C	S	.	.			trans	85	169.5	-176.8	0	0	0	0	0	113.8	N502 S528 C530 G531	N502-G504 PolarHBondContact O-N 3.13Å; N502-G504 WeakPolarHBondContact OD1-CA 3.34Å; N502-G504 PolarHBondContact OD1-N 2.89Å; G504-S528 PolarHBondContact O-OG 3.18Å; G504-C530 CarbonylContact C-O 3.45Å; G504-C530 WeakPolarHBondContact CA-O 3.44Å; G504-G531 WeakPolarHBondContact CA-O 3.14Å
505	T	81.5	Confident	85.4	Confident	124 Å²	124	71.5 Å²	71.5	76%	0.761	38%	0.38	S	S	*	.	S	Bend	trans	-94.6	-7.3	-166.2	47.8	0	0	0	0	115.5	C530	T505-C530 PolarHBondContact N-O 3.46Å
506	C	83	Confident	86.5	Confident	59 Å²	59	69.7 Å²	69.7	40%	0.399	37%	0.37	S	S	.	.	S	Bend	trans	-77.6	-177.6	175.8	-86.2	0	0	0	0	112.9	S528 C530	C506-S528 WeakPolarHBondContact CB-O 3.46Å; C506-S528 PolarHBondContact N-OG 3.27Å; C506-S528 VanDerWaalsContact N-OG 3.09Å; C506-S528 WeakPolarHBondContact O-CB 3.35Å; C506-S528 PolarHBondContact O-OG 2.93Å; C506-S528 VanDerWaalsContact O-OG 3.13Å; C506-C530 HydrophobicContact CB-CB 3.97Å; C506-C530 WeakPolarHBondContact CB-SG 3.24Å; C506-C530 PolarHBondContact N-SG 2.85Å; C506-C530 WeakPolarHBondContact SG-CB 3.47Å; C506-C530 CovalentContact SG-SG 2.03Å; C506-C530 PolarHBondContact SG-SG 3.38Å
507	T	77.4	Confident	86.8	Confident	126 Å²	126	71.4 Å²	71.4	77%	0.773	37%	0.371	S	S	*	.	S	Bend	trans	-99.1	-8.2	-175.2	48.9	0	0	0	0	114.9
508	G	76.1	Confident	86.4	Confident	32 Å²	32	81.5 Å²	81.5	33%	0.33	41%	0.406	S	S	.	.			trans	-68.1	175.7	-174.5	0	0	0	0	0	114.7	S528	G508-S528 VanDerWaalsContact CA-O 3.22Å; G508-S528 WeakPolarHBondContact CA-O 3.49Å; G508-S528 PolarHBondContact N-O 3.28Å; G508-S528 VanDerWaalsContact O-CA 3.3Å; G508-S528 WeakPolarHBondContact O-CA 3.2Å
509	R	86.4	Confident	86.5	Confident	206 Å²	206	80.4 Å²	80.4	78%	0.777	41%	0.408	S	S	*	.			trans	-143.1	57.2	179.6	-71.2	-170.3	172	-171.2	-1.5	111.8	L526	R509-L526 HydrophobicContact CB-CD1 4.02Å; R509-L526 HydrophobicContact CB-CD2 4.2Å; R509-L526 HydrophobicContact CB-CG 4.16Å; R509-L526 HydrophobicContact CG-CD2 4.02Å; R509-L526 HydrophobicContact CG-CG 4.37Å
510	I	86.5	Confident	86.8	Confident	71 Å²	71	86.4 Å²	86.4	36%	0.364	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.5	-178.6	-47.9	178.3	0	0	0	109	R512 Y527	I510-R512 HydrophobicContact CG2-CG 4.24Å; I510-R512 PolarHBondContact O-N 3.37Å; I510-Y527 WeakPolarHBondContact CB-O 3.34Å; I510-Y527 HydrophobicContact CD1-CD1 4.5Å; I510-Y527 PolarHBondContact N-O 2.93Å; I510-Y527 PolarHBondContact O-N 2.96Å
511	Q	89.7	Confident	87.1	Confident	125 Å²	125	88.3 Å²	88.3	58%	0.584	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	125.5	171.1	-175.1	171.9	-27.2	0	0	110.1	P524	Q511-P524 HydrophobicContact CG-CB 4.43Å
512	R	93.2	Very high	87.4	Confident	68 Å²	68	86 Å²	86	26%	0.257	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	-174	178	-67.4	-68	174.4	77.7	-2.9	108.4	I510 P524 L525 Y527 N536 F537	I510-R512 HydrophobicContact CG2-CG 4.24Å; I510-R512 PolarHBondContact O-N 3.37Å; R512-P524 CarbonylContact O-C 3.57Å; R512-P524 VanDerWaalsContact O-CA 3.26Å; R512-P524 WeakPolarHBondContact O-CA 3.33Å; R512-L525 CarbonylContact C-O 3.58Å; R512-L525 WeakPolarHBondContact CA-O 2.97Å; R512-L525 HydrophobicContact CB-CB 4.2Å; R512-L525 PolarHBondContact N-O 3.24Å; R512-L525 PolarHBondContact O-N 3.2Å; R512-Y527 HydrophobicContact CG-CD1 4.26Å; R512-Y527 HydrophobicContact CG-CG 4.29Å; R512-N536 VanDerWaalsContact CB-OD1 3.23Å; R512-N536 WeakPolarHBondContact CB-OD1 3.34Å; R512-N536 WeakPolarHBondContact CG-OD1 3.35Å; R512-F537 CarbonylContact C-O 3.5Å; R512-F537 WeakPolarHBondContact CA-O 3.48Å; R512-F537 WeakPolarHBondContact CB-O 3.45Å; R512-F537 WeakPolarHBondContact CD-O 3.36Å
513	W	94.4	Very high	87.7	Confident	48 Å²	48	86.7 Å²	86.7	18%	0.182	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141.3	-179.3	-64.2	82.1	0	0	0	111.1	C522 K523 N536 F537 S539 Q540 C543	W513-C522 HydrophobicContact CE3-CB 4.38Å; W513-K523 CarbonylContact C-O 3.55Å; W513-K523 VanDerWaalsContact CA-O 3.29Å; W513-K523 WeakPolarHBondContact CA-O 3.32Å; W513-K523 VanDerWaalsContact CE3-C 3.46Å; W513-N536 CarbonylContact O-C 3.47Å; W513-N536 WeakPolarHBondContact O-CA 3.25Å; W513-F537 HydrophobicContact CB-CB 4.42Å; W513-F537 PolarHBondContact N-O 2.82Å; W513-F537 WeakPolarHBondContact O-CD2 3.31Å; W513-F537 PolarHBondContact O-N 2.93Å; W513-S539 VanDerWaalsContact CD1-CA 3.44Å; W513-Q540 HydrophobicContact CD2-CB 3.69Å; W513-Q540 HydrophobicContact CD2-CG 4.31Å; W513-Q540 HydrophobicContact CE3-CB 3.7Å; W513-Q540 HydrophobicContact CE3-CG 3.8Å; W513-Q540 HydrophobicContact CG-CB 4.33Å; W513-Q540 HydrophobicContact CH2-CB 3.95Å; W513-Q540 HydrophobicContact CH2-CG 4.2Å; W513-Q540 HydrophobicContact CZ2-CB 3.96Å; W513-Q540 HydrophobicContact CZ3-CB 3.83Å; W513-Q540 HydrophobicContact CZ3-CG 3.73Å; W513-C543 HydrophobicContact CB-CB 4.15Å
514	Y	94.4	Very high	87.9	Confident	37 Å²	37	86.7 Å²	86.7	15%	0.145	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.6	173.6	76.9	-84	0	0	0	110.2	P501 D516 C522 K523 P524 L525 N535	P501-Y514 HydrophobicContact CB-CD1 3.91Å; P501-Y514 HydrophobicContact CB-CD2 3.63Å; P501-Y514 HydrophobicContact CB-CE1 3.97Å; P501-Y514 HydrophobicContact CB-CE2 3.73Å; P501-Y514 HydrophobicContact CB-CG 3.7Å; P501-Y514 HydrophobicContact CG-CD2 3.96Å; P501-Y514 HydrophobicContact CG-CE1 4.45Å; P501-Y514 HydrophobicContact CG-CE2 3.63Å; P501-Y514 HydrophobicContact CG-CG 4.5Å; Y514-D516 HydrophobicContact CD2-CB 4.45Å; Y514-D516 HydrophobicContact CE2-CB 3.83Å; Y514-D516 PolarHBondContact O-N 2.77Å; Y514-C522 CarbonylContact O-C 3.47Å; Y514-C522 VanDerWaalsContact O-CA 3.3Å; Y514-C522 WeakPolarHBondContact O-CA 3Å; Y514-K523 HydrophobicContact CD1-CB 3.99Å; Y514-K523 VanDerWaalsContact CD1-O 3.29Å; Y514-K523 WeakPolarHBondContact CD1-O 3.4Å; Y514-K523 HydrophobicContact CE1-CB 3.5Å; Y514-K523 HydrophobicContact CE1-CD 4.4Å; Y514-K523 HydrophobicContact CE2-CB 4.45Å; Y514-K523 PolarHBondContact N-O 3.41Å; Y514-K523 PolarHBondContact O-N 3.45Å; Y514-K523 WeakPolarHBondContact OH-CD 3.21Å; Y514-P524 WeakPolarHBondContact CE1-O 3.01Å; Y514-L525 HydrophobicContact CD1-CB 3.89Å; Y514-N535 WeakPolarHBondContact CA-OD1 2.95Å; Y514-N535 WeakPolarHBondContact CB-O 3.34Å
515	F	94.4	Very high	88.2	Confident	16 Å²	16	86.3 Å²	86.3	7%	0.07	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	111.1	171.3	-174.3	-112.1	0	0	0	110.1	C497 R517 R520 N535 C547 L548	C497-F515 HydrophobicContact CB-CD1 4.04Å; C497-F515 WeakPolarHBondContact O-CD1 3.01Å; F515-R517 HydrophobicContact CE1-CB 4.46Å; F515-R517 PolarHBondContact O-N 3.22Å; F515-R520 HydrophobicContact CZ-CB 4.15Å; F515-N535 PolarHBondContact N-OD1 2.87Å; F515-N535 PolarHBondContact O-ND2 2.9Å; F515-C547 HydrophobicContact CB-CB 3.72Å; F515-C547 VanDerWaalsContact CB-SG 3.57Å; F515-C547 HydrophobicContact CD1-CB 3.81Å; F515-C547 HydrophobicContact CD2-CB 3.52Å; F515-C547 HydrophobicContact CE1-CB 4.27Å; F515-C547 HydrophobicContact CE2-CB 4.03Å; F515-C547 HydrophobicContact CG-CB 3.39Å; F515-C547 HydrophobicContact CZ-CB 4.36Å; F515-L548 HydrophobicContact CE2-CD1 4.16Å; F515-L548 HydrophobicContact CE2-CD2 3.56Å; F515-L548 HydrophobicContact CE2-CG 3.65Å; F515-L548 HydrophobicContact CZ-CD2 3.69Å; F515-L548 HydrophobicContact CZ-CG 4.25Å
516	D	92.5	Very high	88.6	Confident	19 Å²	19	84.6 Å²	84.6	10%	0.102	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	101.5	167.8	-175.1	-37.2	0	0	0	108.7	Y514 W518 V519 R520 K521 K523	Y514-D516 HydrophobicContact CD2-CB 4.45Å; Y514-D516 HydrophobicContact CE2-CB 3.83Å; Y514-D516 PolarHBondContact O-N 2.77Å; D516-W518 PolarHBondContact O-N 2.86Å; D516-W518 WeakPolarHBondContact OD1-CA 3.48Å; D516-W518 WeakPolarHBondContact OD1-CB 3.38Å; D516-W518 PolarHBondContact OD1-N 3.42Å; D516-V519 HydrophobicContact CB-CB 4.21Å; D516-V519 HydrophobicContact CB-CG2 4.48Å; D516-V519 PolarHBondContact O-N 2.8Å; D516-V519 PolarHBondContact OD1-N 3.43Å; D516-R520 VanDerWaalsContact O-CA 3.24Å; D516-R520 WeakPolarHBondContact O-CA 3.3Å; D516-R520 PolarHBondContact O-N 2.95Å; D516-K521 PolarHBondContact N-O 3.4Å; D516-K521 PolarHBondContact O-N 2.95Å; D516-K523 HydrophobicContact CB-CD 3.88Å; D516-K523 HydrophobicContact CB-CG 4.23Å; D516-K523 WeakPolarHBondContact OD2-CE 3.49Å; D516-K523 IonicContact OD2-NZ 3.82Å; D516-K523 PolarHBondContact OD2-NZ 2.79Å
517	R	83.8	Confident	88.9	Confident	125 Å²	125	83 Å²	83	47%	0.472	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-30.6	177	150.4	174.6	-90.8	-142.9	-20	114.4	K498 F515 R520	K498-R517 VanDerWaalsContact CE-NH2 3.31Å; F515-R517 HydrophobicContact CE1-CB 4.46Å; F515-R517 PolarHBondContact O-N 3.22Å; R517-R520 WeakPolarHBondContact O-CG 3Å
518	W	80.7	Confident	89.2	Confident	232 Å²	232	77.2 Å²	77.2	88%	0.879	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-38.3	-177.7	-59.1	107.7	0	0	0	111.9	D516 R520	D516-W518 PolarHBondContact O-N 2.86Å; D516-W518 WeakPolarHBondContact OD1-CA 3.48Å; D516-W518 WeakPolarHBondContact OD1-CB 3.38Å; D516-W518 PolarHBondContact OD1-N 3.42Å; W518-R520 VanDerWaalsContact C-N 3.34Å
519	V	87.8	Confident	89.4	Confident	72 Å²	72	77.5 Å²	77.5	44%	0.436	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-16.2	174.3	-175.4	0	0	0	0	111.7	D516 K521	D516-V519 HydrophobicContact CB-CB 4.21Å; D516-V519 HydrophobicContact CB-CG2 4.48Å; D516-V519 PolarHBondContact O-N 2.8Å; D516-V519 PolarHBondContact OD1-N 3.43Å; V519-K521 HydrophobicContact CG1-CB 4.04Å; V519-K521 HydrophobicContact CG1-CD 4.13Å; V519-K521 HydrophobicContact CG1-CG 4.1Å; V519-K521 PolarHBondContact O-N 3Å
520	R	88.4	Confident	89.1	Confident	159 Å²	159	69.9 Å²	69.9	60%	0.6	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	42.5	-169.8	-58.8	-172.6	74.1	113.2	-4.7	112.5	F515 D516 R517 W518	F515-R520 HydrophobicContact CZ-CB 4.15Å; D516-R520 VanDerWaalsContact O-CA 3.24Å; D516-R520 WeakPolarHBondContact O-CA 3.3Å; D516-R520 PolarHBondContact O-N 2.95Å; R517-R520 WeakPolarHBondContact O-CG 3Å; W518-R520 VanDerWaalsContact C-N 3.34Å
521	K	89.8	Confident	88.8	Confident	129 Å²	129	68.5 Å²	68.5	56%	0.561	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.4	178.9	-68.7	-172.1	179.6	-171.4	0	110.8	D516 V519	D516-K521 PolarHBondContact N-O 3.4Å; D516-K521 PolarHBondContact O-N 2.95Å; V519-K521 HydrophobicContact CG1-CB 4.04Å; V519-K521 HydrophobicContact CG1-CD 4.13Å; V519-K521 HydrophobicContact CG1-CG 4.1Å; V519-K521 PolarHBondContact O-N 3Å
522	C	95.3	Very high	88.3	Confident	10 Å²	10	63.9 Å²	63.9	7%	0.068	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.5	170.1	-66.6	0	0	0	0	110.6	W513 Y514 Q540 C543 E544	W513-C522 HydrophobicContact CE3-CB 4.38Å; Y514-C522 CarbonylContact O-C 3.47Å; Y514-C522 VanDerWaalsContact O-CA 3.3Å; Y514-C522 WeakPolarHBondContact O-CA 3Å; C522-Q540 HydrophobicContact CB-CG 4.04Å; C522-C543 HydrophobicContact CB-CB 3.73Å; C522-C543 WeakPolarHBondContact CB-SG 3.31Å; C522-C543 WeakPolarHBondContact SG-CB 3.38Å; C522-C543 CovalentContact SG-SG 2.03Å; C522-C543 PolarHBondContact SG-SG 3.3Å; C522-E544 HydrophobicContact CB-CG 3.98Å; C522-E544 PolarHBondContact SG-N 3.31Å
523	K	92.8	Very high	87.8	Confident	72 Å²	72	62.1 Å²	62.1	31%	0.313	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.2	178.2	-75.4	-176.1	178	173.9	0	109.6	W513 Y514 D516 L525	W513-K523 CarbonylContact C-O 3.55Å; W513-K523 VanDerWaalsContact CA-O 3.29Å; W513-K523 WeakPolarHBondContact CA-O 3.32Å; W513-K523 VanDerWaalsContact CE3-C 3.46Å; Y514-K523 HydrophobicContact CD1-CB 3.99Å; Y514-K523 VanDerWaalsContact CD1-O 3.29Å; Y514-K523 WeakPolarHBondContact CD1-O 3.4Å; Y514-K523 HydrophobicContact CE1-CB 3.5Å; Y514-K523 HydrophobicContact CE1-CD 4.4Å; Y514-K523 HydrophobicContact CE2-CB 4.45Å; Y514-K523 PolarHBondContact N-O 3.41Å; Y514-K523 PolarHBondContact O-N 3.45Å; Y514-K523 WeakPolarHBondContact OH-CD 3.21Å; D516-K523 HydrophobicContact CB-CD 3.88Å; D516-K523 HydrophobicContact CB-CG 4.23Å; D516-K523 WeakPolarHBondContact OD2-CE 3.49Å; D516-K523 IonicContact OD2-NZ 3.82Å; D516-K523 PolarHBondContact OD2-NZ 2.79Å; K523-L525 PolarHBondContact O-N 2.61Å
524	P	91.8	Very high	87.3	Confident	76 Å²	76	61.7 Å²	61.7	49%	0.494	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	132.6	173.8	27	-33.8	0	0	0	111.3	Q511 R512 Y514	Q511-P524 HydrophobicContact CG-CB 4.43Å; R512-P524 CarbonylContact O-C 3.57Å; R512-P524 VanDerWaalsContact O-CA 3.26Å; R512-P524 WeakPolarHBondContact O-CA 3.33Å; Y514-P524 WeakPolarHBondContact CE1-O 3.01Å
525	L	92.5	Very high	87.3	Confident	7 Å²	7	60 Å²	60	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.3	167	176.9	62.1	0	0	0	107.6	P501 V503 R512 Y514 K523 Y527 N536	P501-L525 HydrophobicContact CB-CD1 3.96Å; V503-L525 HydrophobicContact CG2-CD1 4.05Å; R512-L525 CarbonylContact C-O 3.58Å; R512-L525 WeakPolarHBondContact CA-O 2.97Å; R512-L525 HydrophobicContact CB-CB 4.2Å; R512-L525 PolarHBondContact N-O 3.24Å; R512-L525 PolarHBondContact O-N 3.2Å; Y514-L525 HydrophobicContact CD1-CB 3.89Å; K523-L525 PolarHBondContact O-N 2.61Å; L525-Y527 PolarHBondContact O-N 3.01Å; L525-N536 HydrophobicContact CD2-CB 3.96Å
526	L	89.2	Confident	87.2	Confident	88 Å²	88	60.5 Å²	60.5	46%	0.461	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	88	168.2	-166.7	67.8	0	0	0	108.1	V503 R509	V503-L526 WeakPolarHBondContact CG1-O 3.18Å; R509-L526 HydrophobicContact CB-CD1 4.02Å; R509-L526 HydrophobicContact CB-CD2 4.2Å; R509-L526 HydrophobicContact CB-CG 4.16Å; R509-L526 HydrophobicContact CG-CD2 4.02Å; R509-L526 HydrophobicContact CG-CG 4.37Å
527	Y	90.8	Very high	87.3	Confident	24 Å²	24	60.8 Å²	60.8	9%	0.094	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	137.2	-175.6	179.1	-123.8	0	0	0	111.4	V503 I510 R512 L525 G529 C530 N536	V503-Y527 WeakPolarHBondContact O-CD2 3.49Å; I510-Y527 WeakPolarHBondContact CB-O 3.34Å; I510-Y527 HydrophobicContact CD1-CD1 4.5Å; I510-Y527 PolarHBondContact N-O 2.93Å; I510-Y527 PolarHBondContact O-N 2.96Å; R512-Y527 HydrophobicContact CG-CD1 4.26Å; R512-Y527 HydrophobicContact CG-CG 4.29Å; L525-Y527 PolarHBondContact O-N 3.01Å; Y527-G529 VanDerWaalsContact CE1-CA 3.43Å; Y527-G529 VanDerWaalsContact CE1-O 3.26Å; Y527-G529 WeakPolarHBondContact CE1-O 3.47Å; Y527-G529 VanDerWaalsContact OH-C 3.24Å; Y527-G529 PolarHBondContact OH-O 3.15Å; Y527-C530 VanDerWaalsContact OH-C 3.26Å; Y527-C530 WeakPolarHBondContact OH-CA 3.03Å; Y527-C530 PolarHBondContact OH-N 3.04Å; Y527-N536 WeakPolarHBondContact CD2-ND2 3.29Å; Y527-N536 VanDerWaalsContact CE2-ND2 3.26Å; Y527-N536 WeakPolarHBondContact CE2-ND2 3.24Å
528	S	83.4	Confident	87.6	Confident	5 Å²	5	59.6 Å²	59.6	4%	0.035	32%	0.323	C	S	.	.			trans	-89.5	-0.7	-172.9	75.7	0	0	0	0	115.3	V503 G504 C506 G508	V503-S528 WeakPolarHBondContact O-CB 3.47Å; V503-S528 PolarHBondContact O-N 2.76Å; V503-S528 PolarHBondContact O-OG 3.3Å; G504-S528 PolarHBondContact O-OG 3.18Å; C506-S528 WeakPolarHBondContact CB-O 3.46Å; C506-S528 PolarHBondContact N-OG 3.27Å; C506-S528 VanDerWaalsContact N-OG 3.09Å; C506-S528 WeakPolarHBondContact O-CB 3.35Å; C506-S528 PolarHBondContact O-OG 2.93Å; C506-S528 VanDerWaalsContact O-OG 3.13Å; G508-S528 VanDerWaalsContact CA-O 3.22Å; G508-S528 WeakPolarHBondContact CA-O 3.49Å; G508-S528 PolarHBondContact N-O 3.28Å; G508-S528 VanDerWaalsContact O-CA 3.3Å; G508-S528 WeakPolarHBondContact O-CA 3.2Å
529	G	80.3	Confident	88	Confident	38 Å²	38	50.4 Å²	50.4	39%	0.392	29%	0.294	S	S	.	.	S	Bend	trans	108.7	-35.5	172.7	0	0	0	0	0	114.2	Y527	Y527-G529 VanDerWaalsContact CE1-CA 3.43Å; Y527-G529 VanDerWaalsContact CE1-O 3.26Å; Y527-G529 WeakPolarHBondContact CE1-O 3.47Å; Y527-G529 VanDerWaalsContact OH-C 3.24Å; Y527-G529 PolarHBondContact OH-O 3.15Å
530	C	79.4	Confident	88.1	Confident	46 Å²	46	50.9 Å²	50.9	31%	0.311	29%	0.291	S	S	.	.	S	Bend	trans	-137.3	161.1	175.6	77.7	0	0	0	0	112.5	G504 T505 C506 Y527 G532	G504-C530 CarbonylContact C-O 3.45Å; G504-C530 WeakPolarHBondContact CA-O 3.44Å; T505-C530 PolarHBondContact N-O 3.46Å; C506-C530 HydrophobicContact CB-CB 3.97Å; C506-C530 WeakPolarHBondContact CB-SG 3.24Å; C506-C530 PolarHBondContact N-SG 2.85Å; C506-C530 WeakPolarHBondContact SG-CB 3.47Å; C506-C530 CovalentContact SG-SG 2.03Å; C506-C530 PolarHBondContact SG-SG 3.38Å; Y527-C530 VanDerWaalsContact OH-C 3.26Å; Y527-C530 WeakPolarHBondContact OH-CA 3.03Å; Y527-C530 PolarHBondContact OH-N 3.04Å; C530-G532 VanDerWaalsContact C-N 3.33Å; C530-G532 PolarHBondContact O-N 2.76Å
531	G	80.9	Confident	87.9	Confident	43 Å²	43	46.6 Å²	46.6	44%	0.443	29%	0.29	S	S	.	.	S	Bend	trans	75	13.3	172.5	0	0	0	0	0	115.8	N502 G504	N502-G531 PolarHBondContact ND2-O 3.06Å; G504-G531 WeakPolarHBondContact CA-O 3.14Å
532	G	79.4	Confident	87.9	Confident	27 Å²	27	43.5 Å²	43.5	28%	0.278	28%	0.279	S	S	.	.			trans	-82.3	152.7	173.6	0	0	0	0	0	112.3	C530	C530-G532 VanDerWaalsContact C-N 3.33Å; C530-G532 PolarHBondContact O-N 2.76Å
533	N	82.6	Confident	87.9	Confident	31 Å²	31	43 Å²	43	17%	0.166	28%	0.275	C	S	.	.			trans	-83.1	178.1	167.8	63.6	30.4	0	0	0	110.7	H499 P500 N502 N535 N536	H499-N533 HydrophobicContact CB-CB 4.42Å; P500-N533 PolarHBondContact O-ND2 2.73Å; P500-N533 PolarHBondContact O-OD1 3.44Å; N502-N533 HydrophobicContact CB-CB 4.34Å; N502-N533 WeakPolarHBondContact CB-ND2 3.49Å; N502-N533 PolarHBondContact ND2-N 2.93Å; N533-N535 PolarHBondContact O-N 3.38Å; N533-N535 PolarHBondContact OD1-N 2.74Å; N533-N536 VanDerWaalsContact O-CB 3.22Å; N533-N536 WeakPolarHBondContact O-CB 3.49Å
534	G	84	Confident	87.7	Confident	40 Å²	40	42.9 Å²	42.9	41%	0.412	28%	0.276	S	S	.	.	S	Bend	trans	-68.8	-10.4	-173.5	0	0	0	0	0	116.2	I496 N536	I496-G534 WeakPolarHBondContact CG2-O 3.16Å; G534-N536 PolarHBondContact O-N 3.45Å
535	N	92.8	Very high	87.4	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	29%	0.291	C	S	.	.			trans	-80.1	56.8	179.8	-159.9	5.1	0	0	0	110.4	I496 H499 Y514 F515 N533	I496-N535 WeakPolarHBondContact O-CB 2.98Å; H499-N535 HydrophobicContact CB-CB 4.06Å; H499-N535 PolarHBondContact O-ND2 3.18Å; Y514-N535 WeakPolarHBondContact CA-OD1 2.95Å; Y514-N535 WeakPolarHBondContact CB-O 3.34Å; F515-N535 PolarHBondContact N-OD1 2.87Å; F515-N535 PolarHBondContact O-ND2 2.9Å; N533-N535 PolarHBondContact O-N 3.38Å; N533-N535 PolarHBondContact OD1-N 2.74Å
536	N	93.3	Very high	87.2	Confident	27 Å²	27	56.9 Å²	56.9	14%	0.144	32%	0.32	C	S	.	.			trans	-154.1	66.1	-158.5	-177.3	6.2	0	0	0	109.6	R512 W513 L525 Y527 N533 G534	R512-N536 VanDerWaalsContact CB-OD1 3.23Å; R512-N536 WeakPolarHBondContact CB-OD1 3.34Å; R512-N536 WeakPolarHBondContact CG-OD1 3.35Å; W513-N536 CarbonylContact O-C 3.47Å; W513-N536 WeakPolarHBondContact O-CA 3.25Å; L525-N536 HydrophobicContact CD2-CB 3.96Å; Y527-N536 WeakPolarHBondContact CD2-ND2 3.29Å; Y527-N536 VanDerWaalsContact CE2-ND2 3.26Å; Y527-N536 WeakPolarHBondContact CE2-ND2 3.24Å; N533-N536 VanDerWaalsContact O-CB 3.22Å; N533-N536 WeakPolarHBondContact O-CB 3.49Å; G534-N536 PolarHBondContact O-N 3.45Å
537	F	94.1	Very high	87.3	Confident	24 Å²	24	53.3 Å²	53.3	11%	0.105	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-82	153.2	-179.1	-53.5	-84.2	0	0	0	111	I496 R512 W513 I542 C543 Y546	I496-F537 HydrophobicContact CG2-CZ 4.45Å; R512-F537 CarbonylContact C-O 3.5Å; R512-F537 WeakPolarHBondContact CA-O 3.48Å; R512-F537 WeakPolarHBondContact CB-O 3.45Å; R512-F537 WeakPolarHBondContact CD-O 3.36Å; W513-F537 HydrophobicContact CB-CB 4.42Å; W513-F537 PolarHBondContact N-O 2.82Å; W513-F537 WeakPolarHBondContact O-CD2 3.31Å; W513-F537 PolarHBondContact O-N 2.93Å; F537-I542 HydrophobicContact CB-CG2 4.42Å; F537-I542 HydrophobicContact CD1-CG2 3.96Å; F537-C543 HydrophobicContact CB-CB 3.84Å; F537-C543 HydrophobicContact CD2-CB 3.38Å; F537-C543 VanDerWaalsContact CD2-SG 3.6Å; F537-C543 HydrophobicContact CE2-CB 4.06Å; F537-C543 HydrophobicContact CG-CB 3.67Å; F537-Y546 HydrophobicContact CD1-CD2 4.39Å; F537-Y546 HydrophobicContact CE1-CD2 4.02Å; F537-Y546 HydrophobicContact CE1-CG 4.02Å
538	D	89.9	Confident	87	Confident	101 Å²	101	53.9 Å²	53.9	54%	0.54	31%	0.306	S	S	.	.	S	Bend	trans	-68.9	-35.8	175.9	52.1	9	0	0	0	113.2	I542	D538-I542 WeakPolarHBondContact OD1-CD1 3.36Å
539	S	88.8	Confident	86.2	Confident	39 Å²	39	57.6 Å²	57.6	27%	0.273	33%	0.33	S	S	.	.	S	Bend	trans	-136.9	154.9	-174.2	66.4	0	0	0	0	112.9	W513 A541 I542 C543	W513-S539 VanDerWaalsContact CD1-CA 3.44Å; S539-A541 VanDerWaalsContact C-N 3.34Å; S539-A541 PolarHBondContact O-N 2.75Å; S539-I542 PolarHBondContact O-N 3.48Å; S539-I542 WeakPolarHBondContact OG-CB 3.26Å; S539-I542 WeakPolarHBondContact OG-CD1 3.2Å; S539-I542 VanDerWaalsContact OG-CG1 3.31Å; S539-I542 WeakPolarHBondContact OG-CG1 3.38Å; S539-I542 PolarHBondContact OG-N 2.84Å; S539-C543 PolarHBondContact O-N 2.7Å; S539-C543 VanDerWaalsContact O-N 3.1Å
540	Q	90.8	Very high	84.7	Confident	82 Å²	82	64.4 Å²	64.4	38%	0.383	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-45.2	176.4	-171.3	-176.4	-27.3	0	0	111.2	W513 C522 I542 C543 E544	W513-Q540 HydrophobicContact CD2-CB 3.69Å; W513-Q540 HydrophobicContact CD2-CG 4.31Å; W513-Q540 HydrophobicContact CE3-CB 3.7Å; W513-Q540 HydrophobicContact CE3-CG 3.8Å; W513-Q540 HydrophobicContact CG-CB 4.33Å; W513-Q540 HydrophobicContact CH2-CB 3.95Å; W513-Q540 HydrophobicContact CH2-CG 4.2Å; W513-Q540 HydrophobicContact CZ2-CB 3.96Å; W513-Q540 HydrophobicContact CZ3-CB 3.83Å; W513-Q540 HydrophobicContact CZ3-CG 3.73Å; C522-Q540 HydrophobicContact CB-CG 4.04Å; Q540-I542 VanDerWaalsContact C-N 3.34Å; Q540-I542 PolarHBondContact O-N 2.67Å; Q540-C543 WeakPolarHBondContact O-CB 3.47Å; Q540-C543 PolarHBondContact O-N 3.06Å; Q540-E544 HydrophobicContact CG-CG 4.35Å; Q540-E544 PolarHBondContact NE2-OE1 2.77Å; Q540-E544 WeakPolarHBondContact O-CG 3.48Å; Q540-E544 PolarHBondContact O-N 3.41Å
541	A	84.9	Confident	83.2	Confident	69 Å²	69	69.3 Å²	69.3	57%	0.57	37%	0.374	S	S	*	.	H	α-helix	trans	-64.6	-35.2	-177.4	0	0	0	0	0	113	S539 R545	S539-A541 VanDerWaalsContact C-N 3.34Å; S539-A541 PolarHBondContact O-N 2.75Å; A541-R545 VanDerWaalsContact O-CB 3.27Å; A541-R545 WeakPolarHBondContact O-CB 3.39Å; A541-R545 PolarHBondContact O-N 2.98Å
542	I	89.9	Confident	81.5	Confident	64 Å²	64	72 Å²	72	33%	0.328	39%	0.386	S	S	.	.	H	α-helix	trans	-70.3	-45.2	174.6	-73.2	173.4	0	0	0	110.1	F537 D538 S539 Q540 E544 R545 Y546	F537-I542 HydrophobicContact CB-CG2 4.42Å; F537-I542 HydrophobicContact CD1-CG2 3.96Å; D538-I542 WeakPolarHBondContact OD1-CD1 3.36Å; S539-I542 PolarHBondContact O-N 3.48Å; S539-I542 WeakPolarHBondContact OG-CB 3.26Å; S539-I542 WeakPolarHBondContact OG-CD1 3.2Å; S539-I542 VanDerWaalsContact OG-CG1 3.31Å; S539-I542 WeakPolarHBondContact OG-CG1 3.38Å; S539-I542 PolarHBondContact OG-N 2.84Å; Q540-I542 VanDerWaalsContact C-N 3.34Å; Q540-I542 PolarHBondContact O-N 2.67Å; I542-E544 VanDerWaalsContact C-N 3.33Å; I542-E544 PolarHBondContact O-N 3.11Å; I542-R545 PolarHBondContact O-N 3.23Å; I542-Y546 HydrophobicContact CG2-CD2 3.77Å; I542-Y546 HydrophobicContact CG2-CE2 3.94Å; I542-Y546 WeakPolarHBondContact O-CD2 3.17Å; I542-Y546 PolarHBondContact O-N 2.95Å
543	C	94	Very high	79.5	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-55.6	-45.8	172.8	174.9	0	0	0	0	112.5	W513 C522 F537 S539 Q540 Y546 C547	W513-C543 HydrophobicContact CB-CB 4.15Å; C522-C543 HydrophobicContact CB-CB 3.73Å; C522-C543 WeakPolarHBondContact CB-SG 3.31Å; C522-C543 WeakPolarHBondContact SG-CB 3.38Å; C522-C543 CovalentContact SG-SG 2.03Å; C522-C543 PolarHBondContact SG-SG 3.3Å; F537-C543 HydrophobicContact CB-CB 3.84Å; F537-C543 HydrophobicContact CD2-CB 3.38Å; F537-C543 VanDerWaalsContact CD2-SG 3.6Å; F537-C543 HydrophobicContact CE2-CB 4.06Å; F537-C543 HydrophobicContact CG-CB 3.67Å; S539-C543 PolarHBondContact O-N 2.7Å; S539-C543 VanDerWaalsContact O-N 3.1Å; Q540-C543 WeakPolarHBondContact O-CB 3.47Å; Q540-C543 PolarHBondContact O-N 3.06Å; C543-Y546 PolarHBondContact O-N 2.8Å; C543-C547 WeakPolarHBondContact O-CB 3.11Å; C543-C547 PolarHBondContact O-N 2.89Å
544	E	89.2	Confident	77	Confident	68 Å²	68	82 Å²	82	32%	0.318	44%	0.442	S	S	.	.	H	α-helix	trans	-66.9	-42.8	179.6	-71.6	175.3	170.9	0	0	111.2	C522 Q540 I542 Y546 C547 L548	C522-E544 HydrophobicContact CB-CG 3.98Å; C522-E544 PolarHBondContact SG-N 3.31Å; Q540-E544 HydrophobicContact CG-CG 4.35Å; Q540-E544 PolarHBondContact NE2-OE1 2.77Å; Q540-E544 WeakPolarHBondContact O-CG 3.48Å; Q540-E544 PolarHBondContact O-N 3.41Å; I542-E544 VanDerWaalsContact C-N 3.33Å; I542-E544 PolarHBondContact O-N 3.11Å; E544-Y546 VanDerWaalsContact C-N 3.33Å; E544-Y546 PolarHBondContact O-N 2.93Å; E544-C547 PolarHBondContact O-N 3.03Å; E544-L548 HydrophobicContact CG-CD1 4.36Å; E544-L548 WeakPolarHBondContact O-CA 3.48Å; E544-L548 WeakPolarHBondContact O-CB 3.48Å; E544-L548 PolarHBondContact O-N 3.07Å
545	R	85	Confident	74.6	Confident	214 Å²	214	85.9 Å²	85.9	81%	0.808	46%	0.457	S	S	*	.	H	α-helix	trans	-63.1	-35	176.4	-173.9	174.7	-178.5	172.9	0.1	113.2	A541 I542	A541-R545 VanDerWaalsContact O-CB 3.27Å; A541-R545 WeakPolarHBondContact O-CB 3.39Å; A541-R545 PolarHBondContact O-N 2.98Å; I542-R545 PolarHBondContact O-N 3.23Å
546	Y	87.9	Confident	71.4	Confident	164 Å²	164	90.7 Å²	90.7	64%	0.643	49%	0.491	S	S	*	.	H	α-helix	trans	-80.5	-38.4	177.7	-88.1	-77.1	0	0	0	113.4	F537 I542 C543 E544	F537-Y546 HydrophobicContact CD1-CD2 4.39Å; F537-Y546 HydrophobicContact CE1-CD2 4.02Å; F537-Y546 HydrophobicContact CE1-CG 4.02Å; I542-Y546 HydrophobicContact CG2-CD2 3.77Å; I542-Y546 HydrophobicContact CG2-CE2 3.94Å; I542-Y546 WeakPolarHBondContact O-CD2 3.17Å; I542-Y546 PolarHBondContact O-N 2.95Å; C543-Y546 PolarHBondContact O-N 2.8Å; E544-Y546 VanDerWaalsContact C-N 3.33Å; E544-Y546 PolarHBondContact O-N 2.93Å
547	C	91.6	Very high	68.2	Low	13 Å²	13	94 Å²	94	9%	0.088	52%	0.522	C	S	.	.	H	α-helix	trans	-106.7	-8	-170.1	-59.4	0	0	0	0	115.5	C497 F515 C543 E544	C497-C547 HydrophobicContact CB-CB 3.76Å; C497-C547 WeakPolarHBondContact CB-SG 3.3Å; C497-C547 WeakPolarHBondContact SG-CA 3.47Å; C497-C547 WeakPolarHBondContact SG-CB 3.3Å; C497-C547 CovalentContact SG-SG 2.04Å; C497-C547 PolarHBondContact SG-SG 2.81Å; F515-C547 HydrophobicContact CB-CB 3.72Å; F515-C547 VanDerWaalsContact CB-SG 3.57Å; F515-C547 HydrophobicContact CD1-CB 3.81Å; F515-C547 HydrophobicContact CD2-CB 3.52Å; F515-C547 HydrophobicContact CE1-CB 4.27Å; F515-C547 HydrophobicContact CE2-CB 4.03Å; F515-C547 HydrophobicContact CG-CB 3.39Å; F515-C547 HydrophobicContact CZ-CB 4.36Å; C543-C547 WeakPolarHBondContact O-CB 3.11Å; C543-C547 PolarHBondContact O-N 2.89Å; E544-C547 PolarHBondContact O-N 3.03Å
548	L	86	Confident	64.9	Low	35 Å²	35	97.8 Å²	97.8	18%	0.183	55%	0.551	C	S	.	*			trans	-125.8	54	175	-64.6	174.1	0	0	0	113.2	F515 E544 E550 L551	F515-L548 HydrophobicContact CE2-CD1 4.16Å; F515-L548 HydrophobicContact CE2-CD2 3.56Å; F515-L548 HydrophobicContact CE2-CG 3.65Å; F515-L548 HydrophobicContact CZ-CD2 3.69Å; F515-L548 HydrophobicContact CZ-CG 4.25Å; E544-L548 HydrophobicContact CG-CD1 4.36Å; E544-L548 WeakPolarHBondContact O-CA 3.48Å; E544-L548 WeakPolarHBondContact O-CB 3.48Å; E544-L548 PolarHBondContact O-N 3.07Å; L548-E550 PolarHBondContact O-N 2.93Å; L548-E550 VanDerWaalsContact O-N 3.12Å; L548-L551 HydrophobicContact CB-CD1 4.14Å; L548-L551 HydrophobicContact CD1-CD1 4.45Å; L548-L551 PolarHBondContact O-N 2.84Å
549	P	64.7	Low	62	Low	84 Å²	84	97.9 Å²	97.9	55%	0.545	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-64.9	-17.1	-174.4	27.6	-36.7	0	0	0	115.2	L551	P549-L551 PolarHBondContact O-N 3.17Å
550	E	49.9	Very low	59.2	Low	180 Å²	180	102.8 Å²	102.8	84%	0.841	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-76.6	5.3	-178.8	-63.9	-173.5	170.8	0	0	114.4	L548	L548-E550 PolarHBondContact O-N 2.93Å; L548-E550 VanDerWaalsContact O-N 3.12Å
551	L	48.4	Very low	56.4	Low	150 Å²	150	103.9 Å²	103.9	79%	0.785	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-93.9	5.9	174.3	-87.2	140.5	0	0	0	114.2	L548 P549	L548-L551 HydrophobicContact CB-CD1 4.14Å; L548-L551 HydrophobicContact CD1-CD1 4.45Å; L548-L551 PolarHBondContact O-N 2.84Å; P549-L551 PolarHBondContact O-N 3.17Å
552	S	45.5	Very low	53.6	Low	98 Å²	98	107.2 Å²	107.2	69%	0.685	61%	0.605	S	S	*	*			trans	-149.8	112.8	174.5	59.4	0	0	0	0	112.6
553	S	37	Very low	50.5	Low	107 Å²	107	115.3 Å²	115.3	75%	0.748	63%	0.632	S	S	*	*			trans	-145.8	118.2	-177.2	60.3	0	0	0	0	114
554	D	30.6	Very low	47.1	Very low	162 Å²	162	119 Å²	119	87%	0.866	65%	0.654	S	S	*	*			trans	176.5	157.1	158.5	-95.9	-11.7	0	0	0	107.1
555	V	31.6	Very low	44	Very low	122 Å²	122	121.7 Å²	121.7	74%	0.739	68%	0.676	S	S	*	*			cis	-145.7	166.8	-10.5	119.5	0	0	0	0	108.7
556	S	27.4	Very low	40.9	Very low	102 Å²	102	118.3 Å²	118.3	71%	0.713	67%	0.671	S	S	*	*			trans	-50.8	152.5	175.9	-45	0	0	0	0	115.2
557	A	25.1	Very low	38	Very low	96 Å²	96	115.3 Å²	115.3	79%	0.793	67%	0.669	S	S	*	*			cis	76.6	152.5	25.8	0	0	0	0	0	116.8
558	S	25.2	Very low	34.8	Very low	104 Å²	104	117.5 Å²	117.5	73%	0.727	68%	0.683	S	S	*	*			cis	-173.5	140.2	-36.9	-172.3	0	0	0	0	112.6
559	S	29.6	Very low	31.9	Very low	102 Å²	102	119.9 Å²	119.9	71%	0.713	69%	0.693	S	S	*	*			trans	64.6	146.9	151.3	76.5	0	0	0	0	122.8
560	Q	29	Very low	29.9	Very low	143 Å²	143	119 Å²	119	67%	0.668	68%	0.681	S	S	*	*				172.7	-175.7	118.2	-82.9	-145.5	18.3	0	0	109.7
561	P	33.1	Very low	28.6	Very low	105 Å²	105	116.6 Å²	116.6	68%	0.682	68%	0.678	S	S	*	*				-128.4	-170.1	-90.9	40.1	-20.5	0	0	0	113.6
562	V	25.6	Very low	27.4	Very low	138 Å²	138	117 Å²	117	84%	0.836	68%	0.68	S	S	*	*			trans	-177.4	150.4	137.7	140.5	0	0	0	0	112.1
563	R	23.4	Very low	26.7	Very low	235 Å²	235	117.7 Å²	117.7	89%	0.887	68%	0.682	S	S	*	*			trans	-76.6	160.6	-170.8	-62.9	170.7	172.9	143.9	-3.2	114.9
564	V	23	Very low	26.3	Very low	78 Å²	78	119.3 Å²	119.3	47%	0.473	69%	0.688	S	S	.	*			trans	-140.3	143.5	164.6	178.4	0	0	0	0	110.8
565	T	24.4	Very low	26.4	Very low	124 Å²	124	118.4 Å²	118.4	76%	0.761	69%	0.688	S	S	*	*			trans	-156.6	151.5	172.4	46.7	0	0	0	0	108.8
566	M	20.7	Very low	26.4	Very low	143 Å²	143	120.2 Å²	120.2	70%	0.704	69%	0.693	S	S	*	*			cis	-169.9	177.5	-21.6	-171.5	-171	-84.7	0	0	107.3
567	V	25.8	Very low	27.2	Very low	101 Å²	101	118.3 Å²	118.3	61%	0.612	68%	0.678	S	S	*	*			trans	77.4	161.5	157.4	-99.3	0	0	0	0	119.5
568	P	24.3	Very low	28.1	Very low	58 Å²	58	119.3 Å²	119.3	38%	0.377	67%	0.669	S	S	.	*				-150.2	-164.5	-118.8	46.3	-23.3	0	0	0	120.2	Q58	Q58-P568 VanDerWaalsContact CD-CD 3.45Å
569	H	25.9	Very low	29.6	Very low	86 Å²	86	120.3 Å²	120.3	40%	0.398	67%	0.666	S	S	.	*			trans	88.6	112.4	137	-81.9	-19.6	0	0	0	126.1	V60	V60-H569 VanDerWaalsContact CB-NE2 3.34Å; V60-H569 WeakPolarHBondContact CB-NE2 3.31Å; V60-H569 VanDerWaalsContact CG1-NE2 3.33Å; V60-H569 WeakPolarHBondContact CG1-NE2 3.12Å
570	K	22.1	Very low	32.1	Very low	66 Å²	66	119.8 Å²	119.8	29%	0.287	65%	0.649	S	S	.	*				109.4	107.2	119.9	-75.1	167.7	179.2	179.9	0	122.4	C59 S61	C59-K570 PolarHBondContact O-NZ 2.87Å; S61-K570 WeakPolarHBondContact OG-CE 3.28Å; S61-K570 PolarHBondContact OG-NZ 2.85Å
571	V	22	Very low	34.9	Very low	129 Å²	129	113 Å²	113	78%	0.782	62%	0.617	S	S	*	*				65.1	122.4	123	179	0	0	0	0	122
572	L	24.9	Very low	37.5	Very low	157 Å²	157	112.5 Å²	112.5	82%	0.822	60%	0.604	S	S	*	*				-170.4	-155.8	114.2	-148.5	70.4	0	0	0	111.7
573	P	31	Very low	40.1	Very low	113 Å²	113	109.4 Å²	109.4	73%	0.734	58%	0.581	S	S	*	*				-119.8	-167.1	-123.4	45.1	-28.1	0	0	0	118.5
574	T	28.4	Very low	42.9	Very low	142 Å²	142	103.1 Å²	103.1	87%	0.871	57%	0.57	S	S	*	*			trans	-102.2	-173.7	-159	-17.4	0	0	0	0	116.9
575	V	30.9	Very low	45.9	Very low	142 Å²	142	105.3 Å²	105.3	86%	0.861	57%	0.574	S	S	*	*			trans	-95.3	166.7	-160.5	-176	0	0	0	0	114.9
576	L	32.4	Very low	48.9	Very low	161 Å²	161	102.1 Å²	102.1	84%	0.843	55%	0.552	S	S	*	*			trans	-86.7	168.4	-160.2	-69.1	167.4	0	0	0	117.7
577	P	43.3	Very low	52	Low	62 Å²	62	97.7 Å²	97.7	40%	0.403	54%	0.538	S	S	.	.			trans	-129.8	76	-159.1	41.2	-22.4	0	0	0	115.6	R580	P577-R580 WeakPolarHBondContact O-CG 3.34Å
578	L	44.6	Very low	54.8	Low	117 Å²	117	94 Å²	94	61%	0.613	52%	0.52	S	S	*	.			trans	-76.9	-42.4	175.6	-91.2	160.2	0	0	0	113.9	R580 C581	L578-R580 PolarHBondContact O-N 2.81Å; L578-C581 PolarHBondContact O-N 2.03Å
579	N	57.6	Low	57.5	Low	125 Å²	125	97.2 Å²	97.2	67%	0.668	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13	-170.9	-160.6	12.7	0	0	0	114.6	C581	N579-C581 VanDerWaalsContact C-N 3.33Å; N579-C581 PolarHBondContact O-N 2.93Å
580	R	82.2	Confident	60.2	Low	90 Å²	90	96 Å²	96	34%	0.34	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.1	-178.8	70.5	-179.4	171.1	161.5	9.6	114.2	P577 L578 G618 N619 F621 T630	P577-R580 WeakPolarHBondContact O-CG 3.34Å; L578-R580 PolarHBondContact O-N 2.81Å; R580-G618 CarbonylContact O-C 3.47Å; R580-N619 VanDerWaalsContact O-CA 3.24Å; R580-N619 WeakPolarHBondContact O-CA 3.5Å; R580-N619 WeakPolarHBondContact O-CB 3.48Å; R580-N619 PolarHBondContact O-N 3.16Å; R580-N619 VanDerWaalsContact O-N 3.07Å; R580-F621 HydrophobicContact CG-CE1 4.34Å; R580-F621 HydrophobicContact CG-CZ 4.1Å; R580-T630 HydrophobicContact CG-CG2 4.29Å; R580-T630 VanDerWaalsContact NE-CG2 3.34Å; R580-T630 PolarHBondContact NH2-OG1 3.3Å
581	C	87.6	Confident	62.7	Low	1 Å²	1	97 Å²	97	1%	0.007	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-31.1	-179.3	-64.2	0	0	0	0	113.6	L578 N579 H583 N619 C631	L578-C581 PolarHBondContact O-N 2.03Å; N579-C581 VanDerWaalsContact C-N 3.33Å; N579-C581 PolarHBondContact O-N 2.93Å; C581-H583 VanDerWaalsContact C-N 3.31Å; C581-H583 PolarHBondContact O-N 2.76Å; C581-N619 VanDerWaalsContact O-CG 3.26Å; C581-N619 PolarHBondContact O-ND2 3.42Å; C581-C631 HydrophobicContact CB-CB 3.76Å; C581-C631 WeakPolarHBondContact CB-SG 3.46Å; C581-C631 WeakPolarHBondContact SG-CA 3.31Å; C581-C631 WeakPolarHBondContact SG-CB 2.99Å; C581-C631 CovalentContact SG-SG 2.04Å; C581-C631 PolarHBondContact SG-SG 3.07Å
582	F	86.3	Confident	65.3	Low	95 Å²	95	91.8 Å²	91.8	42%	0.417	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	28.6	-173.5	-53.7	-75	0	0	0	113.3	Y599 P632	F582-Y599 HydrophobicContact CE1-CE1 4.28Å; F582-P632 HydrophobicContact CZ-CG 4.13Å
583	H	82.1	Confident	68.2	Low	73 Å²	73	92.3 Å²	92.3	34%	0.338	52%	0.522	S	S	.	.	S	Bend	trans	-97	143.4	167.8	-62.6	-50.2	0	0	0	109.9	C581 N617 N619	C581-H583 VanDerWaalsContact C-N 3.31Å; C581-H583 PolarHBondContact O-N 2.76Å; H583-N617 HydrophobicContact CB-CB 4.17Å; H583-N619 HydrophobicContact CB-CB 4.02Å; H583-N619 WeakPolarHBondContact O-CB 3.13Å; H583-N619 PolarHBondContact O-ND2 2.03Å
584	P	80.3	Confident	70.8	Confident	103 Å²	103	90.6 Å²	90.6	67%	0.669	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-63.6	149	177.8	27.4	-35.8	0	0	0	111	N586 N617	P584-N586 PolarHBondContact O-N 2.99Å; P584-N586 VanDerWaalsContact O-N 3.11Å; P584-N617 PolarHBondContact O-ND2 2.83Å; P584-N617 PolarHBondContact O-OD1 2.95Å
585	K	87	Confident	73.9	Confident	124 Å²	124	92.1 Å²	92.1	54%	0.539	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-54.7	120.3	177.7	74.7	-161	-179.5	-168.7	0	110.9	Y598	K585-Y598 HydrophobicContact CB-CD1 3.88Å; K585-Y598 HydrophobicContact CB-CD2 3.61Å; K585-Y598 HydrophobicContact CB-CE1 4.04Å; K585-Y598 HydrophobicContact CB-CE2 3.78Å; K585-Y598 HydrophobicContact CB-CG 3.66Å; K585-Y598 HydrophobicContact CD-CD1 4.3Å; K585-Y598 HydrophobicContact CD-CD2 4.35Å; K585-Y598 HydrophobicContact CD-CE1 3.59Å; K585-Y598 HydrophobicContact CD-CE2 3.66Å; K585-Y598 VanDerWaalsContact CD-OH 3.25Å; K585-Y598 WeakPolarHBondContact CD-OH 3.27Å; K585-Y598 HydrophobicContact CG-CE1 4.47Å; K585-Y598 HydrophobicContact CG-CE2 4.31Å; K585-Y598 PolarHBondContact NZ-OH 3.4Å
586	N	87.2	Confident	76.9	Confident	56 Å²	56	88.1 Å²	88.1	30%	0.299	46%	0.462	S	S	.	.			trans	-123.4	100	-176.1	-178.9	7.3	0	0	0	110.1	P584 G588 F609 G615 N617	P584-N586 PolarHBondContact O-N 2.99Å; P584-N586 VanDerWaalsContact O-N 3.11Å; N586-G588 PolarHBondContact O-N 3.16Å; N586-G588 WeakPolarHBondContact OD1-CA 3.02Å; N586-G588 PolarHBondContact OD1-N 3.25Å; N586-F609 WeakPolarHBondContact O-CE2 3.46Å; N586-G615 PolarHBondContact ND2-O 3.25Å; N586-N617 HydrophobicContact CB-CB 4.47Å; N586-N617 WeakPolarHBondContact CB-ND2 3.41Å
587	A	86.4	Confident	79.8	Confident	50 Å²	50	82.4 Å²	82.4	41%	0.413	43%	0.43	S	S	.	.			trans	-58.2	-27.7	173.4	0	0	0	0	0	112.2	T610 Y611 S612	A587-T610 WeakPolarHBondContact CB-O 3.38Å; A587-Y611 WeakPolarHBondContact O-CD2 3.26Å; A587-S612 WeakPolarHBondContact O-CB 3.18Å; A587-S612 PolarHBondContact O-N 3.02Å; A587-S612 PolarHBondContact O-OG 3.05Å
588	G	84.9	Confident	82.2	Confident	23 Å²	23	80 Å²	80	24%	0.237	41%	0.413	C	S	.	.			trans	75	-172.6	-178.5	0	0	0	0	0	113.5	N586 S612 C614	N586-G588 PolarHBondContact O-N 3.16Å; N586-G588 WeakPolarHBondContact OD1-CA 3.02Å; N586-G588 PolarHBondContact OD1-N 3.25Å; G588-S612 WeakPolarHBondContact CA-OG 3.47Å; G588-C614 CarbonylContact C-O 3.57Å; G588-C614 VanDerWaalsContact CA-O 3.26Å; G588-C614 WeakPolarHBondContact CA-O 2.98Å
589	T	81.3	Confident	84.5	Confident	126 Å²	126	75.3 Å²	75.3	77%	0.773	39%	0.387	S	S	*	.	S	Bend	trans	-112.4	10.9	-162.2	59.2	0	0	0	0	115.1	S612 C614	T589-S612 PolarHBondContact N-OG 3.37Å; T589-C614 PolarHBondContact N-O 3.29Å; T589-C614 VanDerWaalsContact N-O 3.17Å
590	C	81.3	Confident	86	Confident	61 Å²	61	70.6 Å²	70.6	41%	0.412	36%	0.362	S	S	.	.	S	Bend	trans	-93	-175.4	179.4	-91.7	0	0	0	0	113	S612 C614	C590-S612 WeakPolarHBondContact CB-O 3.33Å; C590-S612 PolarHBondContact N-OG 3.44Å; C590-S612 VanDerWaalsContact O-CB 3.27Å; C590-S612 WeakPolarHBondContact O-CB 3.32Å; C590-C614 HydrophobicContact CB-CB 4Å; C590-C614 WeakPolarHBondContact CB-SG 3.14Å; C590-C614 WeakPolarHBondContact SG-CB 3.16Å; C590-C614 CovalentContact SG-SG 2.03Å; C590-C614 PolarHBondContact SG-SG 3.34Å
591	T	75.6	Confident	85.8	Confident	86 Å²	86	72.6 Å²	72.6	53%	0.528	38%	0.375	S	S	.	.	S	Bend	trans	-106.3	1.5	-178.3	55.7	0	0	0	0	114.9	N1740 T1742	T591-N1740 PolarHBondContact O-ND2 2.84Å; T591-N1740 VanDerWaalsContact O-ND2 3.16Å; T591-T1742 PolarHBondContact OG1-OG1 3.25Å
592	G	75.6	Confident	85.2	Confident	21 Å²	21	80.1 Å²	80.1	22%	0.216	41%	0.414	C	S	.	.			trans	-74.4	169.8	178	0	0	0	0	0	113	S612	G592-S612 WeakPolarHBondContact CA-O 3.42Å; G592-S612 PolarHBondContact N-O 2.03Å; G592-S612 WeakPolarHBondContact O-CA 3.3Å
593	Q	85.4	Confident	84.8	Confident	168 Å²	168	81.3 Å²	81.3	79%	0.785	42%	0.421	S	S	*	.			trans	-137	73.8	173.9	-67.4	-168.8	-7.3	0	0	110.3	T610	Q593-T610 HydrophobicContact CB-CG2 3.71Å; Q593-T610 HydrophobicContact CG-CG2 3.83Å
594	F	86.5	Confident	84.7	Confident	77 Å²	77	83.3 Å²	83.3	34%	0.338	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.7	176.6	-57.8	-82	0	0	0	109	R596 Y611	F594-R596 HydrophobicContact CB-CG 4.26Å; F594-R596 PolarHBondContact O-N 2.87Å; F594-R596 VanDerWaalsContact O-N 3.17Å; F594-Y611 WeakPolarHBondContact CD2-O 3.33Å; F594-Y611 PolarHBondContact N-O 3.5Å; F594-Y611 PolarHBondContact O-N 3.48Å
595	R	92.5	Very high	84.9	Confident	174 Å²	174	81.3 Å²	81.3	66%	0.657	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	118.8	168	-175.6	177.8	179.6	176.1	1.5	108.2	A608	R595-A608 HydrophobicContact CG-CB 4.47Å
596	R	94.1	Very high	85.2	Confident	57 Å²	57	75.5 Å²	75.5	22%	0.215	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	172.7	178.8	-67.2	-65.5	176.9	77.5	-2.7	109.2	F594 A608 F609 Y611 N620 F621	F594-R596 HydrophobicContact CB-CG 4.26Å; F594-R596 PolarHBondContact O-N 2.87Å; F594-R596 VanDerWaalsContact O-N 3.17Å; R596-A608 CarbonylContact O-C 3.54Å; R596-A608 VanDerWaalsContact O-CA 3.26Å; R596-A608 WeakPolarHBondContact O-CA 3.42Å; R596-F609 HydrophobicContact CB-CD1 3.97Å; R596-F609 HydrophobicContact CB-CE1 3.52Å; R596-F609 HydrophobicContact CB-CZ 3.95Å; R596-F609 PolarHBondContact N-O 2.9Å; R596-F609 PolarHBondContact O-N 3.3Å; R596-F609 VanDerWaalsContact O-O 3.13Å; R596-Y611 HydrophobicContact CG-CD1 4.32Å; R596-Y611 HydrophobicContact CG-CG 4.33Å; R596-N620 VanDerWaalsContact CG-OD1 3.27Å; R596-N620 WeakPolarHBondContact CG-OD1 3.34Å; R596-N620 PolarHBondContact NH1-OD1 3.08Å; R596-F621 CarbonylContact C-O 2.79Å; R596-F621 WeakPolarHBondContact CA-O 3.33Å; R596-F621 WeakPolarHBondContact CB-O 3.47Å; R596-F621 VanDerWaalsContact CD-O 3.23Å; R596-F621 WeakPolarHBondContact CD-O 3.47Å
597	W	94.1	Very high	85.4	Confident	41 Å²	41	74.7 Å²	74.7	16%	0.155	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.1	180	-60.3	80.1	0	0	0	109.9	C606 K607 A608 F621 S623 R624 C627	W597-C606 WeakPolarHBondContact CZ3-O 3.31Å; W597-K607 CarbonylContact C-O 3.48Å; W597-K607 WeakPolarHBondContact CA-O 3.47Å; W597-A608 HydrophobicContact CD2-CB 4.14Å; W597-A608 HydrophobicContact CE3-CB 4.01Å; W597-A608 VanDerWaalsContact CE3-N 3.35Å; W597-A608 HydrophobicContact CH2-CB 4.03Å; W597-A608 HydrophobicContact CZ2-CB 4.14Å; W597-A608 HydrophobicContact CZ3-CB 3.96Å; W597-F621 HydrophobicContact CB-CB 4.27Å; W597-F621 PolarHBondContact N-O 2.75Å; W597-F621 WeakPolarHBondContact O-CB 3.33Å; W597-F621 WeakPolarHBondContact O-CD2 3.22Å; W597-F621 PolarHBondContact O-N 3.16Å; W597-S623 VanDerWaalsContact CD1-CA 3.46Å; W597-R624 VanDerWaalsContact CD1-N 3.32Å; W597-R624 HydrophobicContact CD2-CB 3.65Å; W597-R624 HydrophobicContact CD2-CG 4.13Å; W597-R624 HydrophobicContact CE3-CB 3.69Å; W597-R624 HydrophobicContact CE3-CG 3.64Å; W597-R624 HydrophobicContact CG-CB 4.26Å; W597-R624 HydrophobicContact CH2-CB 3.96Å; W597-R624 HydrophobicContact CH2-CG 4.13Å; W597-R624 HydrophobicContact CZ2-CB 3.91Å; W597-R624 HydrophobicContact CZ3-CB 3.86Å; W597-R624 HydrophobicContact CZ3-CG 3.64Å; W597-C627 HydrophobicContact CB-CB 4.07Å
598	Y	93.8	Very high	85.6	Confident	12 Å²	12	74.4 Å²	74.4	5%	0.047	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.8	173.3	77.7	-81.8	0	0	0	108.1	K585 D600 C606 K607 F609 N619	K585-Y598 HydrophobicContact CB-CD1 3.88Å; K585-Y598 HydrophobicContact CB-CD2 3.61Å; K585-Y598 HydrophobicContact CB-CE1 4.04Å; K585-Y598 HydrophobicContact CB-CE2 3.78Å; K585-Y598 HydrophobicContact CB-CG 3.66Å; K585-Y598 HydrophobicContact CD-CD1 4.3Å; K585-Y598 HydrophobicContact CD-CD2 4.35Å; K585-Y598 HydrophobicContact CD-CE1 3.59Å; K585-Y598 HydrophobicContact CD-CE2 3.66Å; K585-Y598 VanDerWaalsContact CD-OH 3.25Å; K585-Y598 WeakPolarHBondContact CD-OH 3.27Å; K585-Y598 HydrophobicContact CG-CE1 4.47Å; K585-Y598 HydrophobicContact CG-CE2 4.31Å; K585-Y598 PolarHBondContact NZ-OH 3.4Å; Y598-D600 HydrophobicContact CD2-CB 4.13Å; Y598-D600 HydrophobicContact CE2-CB 3.39Å; Y598-D600 VanDerWaalsContact CE2-CG 3.44Å; Y598-D600 VanDerWaalsContact CE2-OD2 3.3Å; Y598-D600 WeakPolarHBondContact CE2-OD2 3.3Å; Y598-D600 VanDerWaalsContact CZ-OD2 3.25Å; Y598-D600 PolarHBondContact O-N 3.32Å; Y598-D600 PolarHBondContact OH-OD2 2.01Å; Y598-C606 CarbonylContact O-C 3.57Å; Y598-C606 VanDerWaalsContact O-CA 3.31Å; Y598-C606 WeakPolarHBondContact O-CA 3.17Å; Y598-K607 HydrophobicContact CD1-CB 4.25Å; Y598-K607 WeakPolarHBondContact CD1-O 3.29Å; Y598-K607 HydrophobicContact CE1-CB 3.7Å; Y598-K607 PolarHBondContact N-O 3.14Å; Y598-K607 PolarHBondContact O-N 3.31Å; Y598-F609 HydrophobicContact CD1-CB 3.8Å; Y598-F609 AromaticContact CD1-CD1 3.63Å; Y598-F609 HydrophobicContact CD1-CD1 3.63Å; Y598-F609 HydrophobicContact CD1-CE1 4.45Å; Y598-F609 AromaticContact CD1-CG 3.94Å; Y598-F609 HydrophobicContact CD1-CG 3.94Å; Y598-F609 HydrophobicContact CE1-CB 4.01Å; Y598-F609 HydrophobicContact CG-CD1 4.22Å; Y598-N619 VanDerWaalsContact CA-OD1 3.25Å; Y598-N619 WeakPolarHBondContact CA-OD1 3.31Å; Y598-N619 VanDerWaalsContact CB-O 3.3Å; Y598-N619 WeakPolarHBondContact CB-O 3.33Å
599	Y	92.8	Very high	86.1	Confident	19 Å²	19	74.3 Å²	74.3	8%	0.075	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	114.2	168.4	-176.4	-99.6	0	0	0	108.1	F582 N619 C631 P632	F582-Y599 HydrophobicContact CE1-CE1 4.28Å; Y599-N619 PolarHBondContact N-OD1 2.77Å; Y599-N619 PolarHBondContact O-ND2 3.26Å; Y599-C631 HydrophobicContact CD2-CB 3.54Å; Y599-C631 HydrophobicContact CE2-CB 4.19Å; Y599-C631 HydrophobicContact CG-CB 3.76Å; Y599-P632 WeakPolarHBondContact CE2-O 3.13Å
600	D	88.4	Confident	86.6	Confident	26 Å²	26	72 Å²	72	14%	0.139	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	107.5	175.4	-159.2	-34	0	0	0	108.9	Y598 L602 E603 E604 M605 K607	Y598-D600 HydrophobicContact CD2-CB 4.13Å; Y598-D600 HydrophobicContact CE2-CB 3.39Å; Y598-D600 VanDerWaalsContact CE2-CG 3.44Å; Y598-D600 VanDerWaalsContact CE2-OD2 3.3Å; Y598-D600 WeakPolarHBondContact CE2-OD2 3.3Å; Y598-D600 VanDerWaalsContact CZ-OD2 3.25Å; Y598-D600 PolarHBondContact O-N 3.32Å; Y598-D600 PolarHBondContact OH-OD2 2.01Å; D600-L602 PolarHBondContact O-N 2.63Å; D600-L602 PolarHBondContact OD1-N 3.11Å; D600-E603 CarbonylContact O-C 3.59Å; D600-E603 PolarHBondContact O-N 3.44Å; D600-E604 WeakPolarHBondContact O-CA 3.44Å; D600-E604 PolarHBondContact O-N 3.24Å; D600-M605 PolarHBondContact N-O 3.38Å; D600-M605 PolarHBondContact O-N 2.89Å; D600-K607 HydrophobicContact CB-CD 3.71Å; D600-K607 HydrophobicContact CB-CG 4.01Å; D600-K607 IonicContact OD1-NZ 2.69Å; D600-K607 WeakPolarHBondContact OD2-CD 3.25Å; D600-K607 WeakPolarHBondContact OD2-CE 3.49Å; D600-K607 IonicContact OD2-NZ 3.51Å; D600-K607 PolarHBondContact OD2-NZ 3.18Å
601	E	79.6	Confident	87	Confident	132 Å²	132	70.2 Å²	70.2	62%	0.617	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.2	-179.2	-170.9	174	-171.3	0	0	112.9
602	L	74.6	Confident	87.5	Confident	159 Å²	159	66.6 Å²	66.6	83%	0.832	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-10	-177.9	-151.6	97.3	0	0	0	114.4	D600	D600-L602 PolarHBondContact O-N 2.63Å; D600-L602 PolarHBondContact OD1-N 3.11Å
603	E	78.1	Confident	87.7	Confident	120 Å²	120	67.3 Å²	67.3	56%	0.561	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	13.7	173	-83.5	172.8	-120.8	0	0	111.2	D600 M605 K607	D600-E603 CarbonylContact O-C 3.59Å; D600-E603 PolarHBondContact O-N 3.44Å; E603-M605 HydrophobicContact CB-CG 4.05Å; E603-M605 HydrophobicContact CB-SD 4.34Å; E603-M605 WeakPolarHBondContact O-CB 3.25Å; E603-M605 WeakPolarHBondContact O-CG 3.49Å; E603-M605 PolarHBondContact O-N 3.25Å; E603-K607 WeakPolarHBondContact OE1-CE 3.25Å; E603-K607 IonicContact OE1-NZ 3.55Å; E603-K607 PolarHBondContact OE1-NZ 2.92Å; E603-K607 WeakPolarHBondContact OE2-CE 3.23Å; E603-K607 IonicContact OE2-NZ 3.55Å; E603-K607 PolarHBondContact OE2-NZ 3.23Å; E603-K607 VanDerWaalsContact OE2-NZ 3.17Å
604	E	80.3	Confident	87.5	Confident	115 Å²	115	61.5 Å²	61.5	54%	0.537	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.9	34.5	177.4	-62.9	177.4	157.1	0	0	114.7	D600	D600-E604 WeakPolarHBondContact O-CA 3.44Å; D600-E604 PolarHBondContact O-N 3.24Å
605	M	83.8	Confident	87.1	Confident	61 Å²	61	60 Å²	60	30%	0.3	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	147.2	-170.9	75	178.7	-54.4	0	0	113.4	D600 E603 K607 M628	D600-M605 PolarHBondContact N-O 3.38Å; D600-M605 PolarHBondContact O-N 2.89Å; E603-M605 HydrophobicContact CB-CG 4.05Å; E603-M605 HydrophobicContact CB-SD 4.34Å; E603-M605 WeakPolarHBondContact O-CB 3.25Å; E603-M605 WeakPolarHBondContact O-CG 3.49Å; E603-M605 PolarHBondContact O-N 3.25Å; M605-K607 HydrophobicContact CG-CG 3.92Å; M605-K607 PolarHBondContact O-N 2.94Å; M605-K607 VanDerWaalsContact O-N 3.13Å; M605-K607 HydrophobicContact SD-CG 4.44Å; M605-M628 HydrophobicContact CB-CE 4.18Å
606	C	93	Very high	86.5	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	106.9	170.8	-69.2	0	0	0	0	112	W597 Y598 R624 C627 M628	W597-C606 WeakPolarHBondContact CZ3-O 3.31Å; Y598-C606 CarbonylContact O-C 3.57Å; Y598-C606 VanDerWaalsContact O-CA 3.31Å; Y598-C606 WeakPolarHBondContact O-CA 3.17Å; C606-R624 HydrophobicContact CB-CG 4.18Å; C606-C627 HydrophobicContact CB-CB 3.57Å; C606-C627 WeakPolarHBondContact CB-SG 3.04Å; C606-C627 WeakPolarHBondContact SG-CB 3.46Å; C606-C627 CovalentContact SG-SG 2.02Å; C606-C627 PolarHBondContact SG-SG 3.23Å; C606-M628 HydrophobicContact CB-CE 3.99Å; C606-M628 HydrophobicContact CB-CG 3.94Å; C606-M628 HydrophobicContact CB-SD 3.59Å; C606-M628 VanDerWaalsContact CB-SD 3.59Å; C606-M628 PolarHBondContact SG-N 2.87Å
607	K	91	Very high	86	Confident	39 Å²	39	52.5 Å²	52.5	17%	0.17	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	152.7	176.1	-64.3	-174.8	-165.7	167.2	0	111.7	W597 Y598 D600 E603 M605	W597-K607 CarbonylContact C-O 3.48Å; W597-K607 WeakPolarHBondContact CA-O 3.47Å; Y598-K607 HydrophobicContact CD1-CB 4.25Å; Y598-K607 WeakPolarHBondContact CD1-O 3.29Å; Y598-K607 HydrophobicContact CE1-CB 3.7Å; Y598-K607 PolarHBondContact N-O 3.14Å; Y598-K607 PolarHBondContact O-N 3.31Å; D600-K607 HydrophobicContact CB-CD 3.71Å; D600-K607 HydrophobicContact CB-CG 4.01Å; D600-K607 IonicContact OD1-NZ 2.69Å; D600-K607 WeakPolarHBondContact OD2-CD 3.25Å; D600-K607 WeakPolarHBondContact OD2-CE 3.49Å; D600-K607 IonicContact OD2-NZ 3.51Å; D600-K607 PolarHBondContact OD2-NZ 3.18Å; E603-K607 WeakPolarHBondContact OE1-CE 3.25Å; E603-K607 IonicContact OE1-NZ 3.55Å; E603-K607 PolarHBondContact OE1-NZ 2.92Å; E603-K607 WeakPolarHBondContact OE2-CE 3.23Å; E603-K607 IonicContact OE2-NZ 3.55Å; E603-K607 PolarHBondContact OE2-NZ 3.23Å; E603-K607 VanDerWaalsContact OE2-NZ 3.17Å; M605-K607 HydrophobicContact CG-CG 3.92Å; M605-K607 PolarHBondContact O-N 2.94Å; M605-K607 VanDerWaalsContact O-N 3.13Å; M605-K607 HydrophobicContact SD-CG 4.44Å
608	A	92	Very high	85.6	Confident	45 Å²	45	52 Å²	52	37%	0.372	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	142.8	174.2	0	0	0	0	0	111.3	R595 R596 W597	R595-A608 HydrophobicContact CG-CB 4.47Å; R596-A608 CarbonylContact O-C 3.54Å; R596-A608 VanDerWaalsContact O-CA 3.26Å; R596-A608 WeakPolarHBondContact O-CA 3.42Å; W597-A608 HydrophobicContact CD2-CB 4.14Å; W597-A608 HydrophobicContact CE3-CB 4.01Å; W597-A608 VanDerWaalsContact CE3-N 3.35Å; W597-A608 HydrophobicContact CH2-CB 4.03Å; W597-A608 HydrophobicContact CZ2-CB 4.14Å; W597-A608 HydrophobicContact CZ3-CB 3.96Å
609	F	94.7	Very high	85.5	Confident	21 Å²	21	51.6 Å²	51.6	9%	0.092	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	162.7	168.4	79.3	-70.8	0	0	0	111.2	N586 R596 Y598 Y611 N620	N586-F609 WeakPolarHBondContact O-CE2 3.46Å; R596-F609 HydrophobicContact CB-CD1 3.97Å; R596-F609 HydrophobicContact CB-CE1 3.52Å; R596-F609 HydrophobicContact CB-CZ 3.95Å; R596-F609 PolarHBondContact N-O 2.9Å; R596-F609 PolarHBondContact O-N 3.3Å; R596-F609 VanDerWaalsContact O-O 3.13Å; Y598-F609 HydrophobicContact CD1-CB 3.8Å; Y598-F609 AromaticContact CD1-CD1 3.63Å; Y598-F609 HydrophobicContact CD1-CD1 3.63Å; Y598-F609 HydrophobicContact CD1-CE1 4.45Å; Y598-F609 AromaticContact CD1-CG 3.94Å; Y598-F609 HydrophobicContact CD1-CG 3.94Å; Y598-F609 HydrophobicContact CE1-CB 4.01Å; Y598-F609 HydrophobicContact CG-CD1 4.22Å; F609-Y611 HydrophobicContact CE2-CD2 4.35Å; F609-N620 HydrophobicContact CZ-CB 4.07Å
610	T	91.4	Very high	85.5	Confident	76 Å²	76	52.1 Å²	52.1	47%	0.466	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.3	173.5	-55.6	0	0	0	0	109.3	A587 Q593	A587-T610 WeakPolarHBondContact CB-O 3.38Å; Q593-T610 HydrophobicContact CB-CG2 3.71Å; Q593-T610 HydrophobicContact CG-CG2 3.83Å
611	Y	90.5	Very high	85.7	Confident	25 Å²	25	51.1 Å²	51.1	10%	0.098	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135.9	170.3	179.1	-127.3	0	0	0	110.6	A587 F594 R596 F609 G613 C614 G616 N620	A587-Y611 WeakPolarHBondContact O-CD2 3.26Å; F594-Y611 WeakPolarHBondContact CD2-O 3.33Å; F594-Y611 PolarHBondContact N-O 3.5Å; F594-Y611 PolarHBondContact O-N 3.48Å; R596-Y611 HydrophobicContact CG-CD1 4.32Å; R596-Y611 HydrophobicContact CG-CG 4.33Å; F609-Y611 HydrophobicContact CE2-CD2 4.35Å; Y611-G613 VanDerWaalsContact C-N 3.31Å; Y611-G613 WeakPolarHBondContact CE1-O 3.32Å; Y611-G613 PolarHBondContact O-N 2.97Å; Y611-G613 VanDerWaalsContact OH-C 3.3Å; Y611-G613 PolarHBondContact OH-O 3.49Å; Y611-C614 WeakPolarHBondContact OH-CA 3.46Å; Y611-C614 PolarHBondContact OH-N 3.24Å; Y611-G616 VanDerWaalsContact CE2-CA 3.46Å; Y611-G616 PolarHBondContact OH-N 2.92Å; Y611-N620 WeakPolarHBondContact CD1-ND2 3.05Å; Y611-N620 WeakPolarHBondContact CD2-ND2 3.07Å; Y611-N620 WeakPolarHBondContact CE1-ND2 3.01Å; Y611-N620 VanDerWaalsContact CE2-ND2 3.3Å; Y611-N620 WeakPolarHBondContact CE2-ND2 3.42Å; Y611-N620 VanDerWaalsContact CG-ND2 3.25Å
612	S	84.6	Confident	86.1	Confident	10 Å²	10	52.1 Å²	52.1	7%	0.07	31%	0.306	C	S	.	.			trans	-75	-16.3	-177.6	67.1	0	0	0	0	114.9	A587 G588 T589 C590 G592 C614	A587-S612 WeakPolarHBondContact O-CB 3.18Å; A587-S612 PolarHBondContact O-N 3.02Å; A587-S612 PolarHBondContact O-OG 3.05Å; G588-S612 WeakPolarHBondContact CA-OG 3.47Å; T589-S612 PolarHBondContact N-OG 3.37Å; C590-S612 WeakPolarHBondContact CB-O 3.33Å; C590-S612 PolarHBondContact N-OG 3.44Å; C590-S612 VanDerWaalsContact O-CB 3.27Å; C590-S612 WeakPolarHBondContact O-CB 3.32Å; G592-S612 WeakPolarHBondContact CA-O 3.42Å; G592-S612 PolarHBondContact N-O 2.03Å; G592-S612 WeakPolarHBondContact O-CA 3.3Å; S612-C614 PolarHBondContact OG-O 2.03Å
613	G	81.2	Confident	86.8	Confident	35 Å²	35	46 Å²	46	36%	0.361	28%	0.277	S	S	.	.	S	Bend	trans	106.9	-26.6	-178.3	0	0	0	0	0	114.6	Y611	Y611-G613 VanDerWaalsContact C-N 3.31Å; Y611-G613 WeakPolarHBondContact CE1-O 3.32Å; Y611-G613 PolarHBondContact O-N 2.97Å; Y611-G613 VanDerWaalsContact OH-C 3.3Å; Y611-G613 PolarHBondContact OH-O 3.49Å
614	C	79.9	Confident	87.3	Confident	46 Å²	46	45.1 Å²	45.1	31%	0.311	27%	0.268	S	S	.	.	S	Bend	trans	-138.6	162.5	175	75.3	0	0	0	0	112.4	G588 T589 C590 Y611 S612 G616	G588-C614 CarbonylContact C-O 3.57Å; G588-C614 VanDerWaalsContact CA-O 3.26Å; G588-C614 WeakPolarHBondContact CA-O 2.98Å; T589-C614 PolarHBondContact N-O 3.29Å; T589-C614 VanDerWaalsContact N-O 3.17Å; C590-C614 HydrophobicContact CB-CB 4Å; C590-C614 WeakPolarHBondContact CB-SG 3.14Å; C590-C614 WeakPolarHBondContact SG-CB 3.16Å; C590-C614 CovalentContact SG-SG 2.03Å; C590-C614 PolarHBondContact SG-SG 3.34Å; Y611-C614 WeakPolarHBondContact OH-CA 3.46Å; Y611-C614 PolarHBondContact OH-N 3.24Å; S612-C614 PolarHBondContact OG-O 2.03Å; C614-G616 VanDerWaalsContact C-N 3.27Å; C614-G616 PolarHBondContact O-N 3.07Å
615	G	79.9	Confident	87.4	Confident	47 Å²	47	45.1 Å²	45.1	49%	0.485	27%	0.268	S	S	.	.	S	Bend	trans	73.5	10.7	175	0	0	0	0	0	115.6	N586	N586-G615 PolarHBondContact ND2-O 3.25Å
616	G	79.5	Confident	87.4	Confident	29 Å²	29	45.4 Å²	45.4	30%	0.299	27%	0.273	S	S	.	.			trans	-77.5	162.4	174.4	0	0	0	0	0	113	Y611 C614	Y611-G616 VanDerWaalsContact CE2-CA 3.46Å; Y611-G616 PolarHBondContact OH-N 2.92Å; C614-G616 VanDerWaalsContact C-N 3.27Å; C614-G616 PolarHBondContact O-N 3.07Å
617	N	82.7	Confident	87.4	Confident	44 Å²	44	45.4 Å²	45.4	24%	0.235	27%	0.273	C	S	.	.			trans	-100.7	-171.3	170.9	61.5	27	0	0	0	110.9	H583 P584 N586 N619 N620	H583-N617 HydrophobicContact CB-CB 4.17Å; P584-N617 PolarHBondContact O-ND2 2.83Å; P584-N617 PolarHBondContact O-OD1 2.95Å; N586-N617 HydrophobicContact CB-CB 4.47Å; N586-N617 WeakPolarHBondContact CB-ND2 3.41Å; N617-N619 VanDerWaalsContact C-N 3.29Å; N617-N619 PolarHBondContact O-N 3.21Å; N617-N619 PolarHBondContact OD1-N 3.49Å; N617-N620 WeakPolarHBondContact O-CB 3.3Å
618	G	85.1	Confident	87.1	Confident	30 Å²	30	45.6 Å²	45.6	31%	0.309	28%	0.275	S	S	.	.	S	Bend	trans	-68.3	-17.1	-173.6	0	0	0	0	0	116.3	R580 N620	R580-G618 CarbonylContact O-C 3.47Å; G618-N620 PolarHBondContact O-N 3.3Å
619	N	91.5	Very high	86.5	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.016	29%	0.293	C	S	.	.			trans	-85.6	59.9	-179.1	-163.2	8	0	0	0	110.1	R580 C581 H583 Y598 Y599 N617 F621	R580-N619 VanDerWaalsContact O-CA 3.24Å; R580-N619 WeakPolarHBondContact O-CA 3.5Å; R580-N619 WeakPolarHBondContact O-CB 3.48Å; R580-N619 PolarHBondContact O-N 3.16Å; R580-N619 VanDerWaalsContact O-N 3.07Å; C581-N619 VanDerWaalsContact O-CG 3.26Å; C581-N619 PolarHBondContact O-ND2 3.42Å; H583-N619 HydrophobicContact CB-CB 4.02Å; H583-N619 WeakPolarHBondContact O-CB 3.13Å; H583-N619 PolarHBondContact O-ND2 2.03Å; Y598-N619 VanDerWaalsContact CA-OD1 3.25Å; Y598-N619 WeakPolarHBondContact CA-OD1 3.31Å; Y598-N619 VanDerWaalsContact CB-O 3.3Å; Y598-N619 WeakPolarHBondContact CB-O 3.33Å; Y599-N619 PolarHBondContact N-OD1 2.77Å; Y599-N619 PolarHBondContact O-ND2 3.26Å; N617-N619 VanDerWaalsContact C-N 3.29Å; N617-N619 PolarHBondContact O-N 3.21Å; N617-N619 PolarHBondContact OD1-N 3.49Å; N619-F621 WeakPolarHBondContact OD1-CE2 3.38Å
620	N	93.6	Very high	85.9	Confident	30 Å²	30	50.4 Å²	50.4	16%	0.16	30%	0.296	C	S	.	.			trans	-148.1	79.1	-166.1	-174.4	-18.6	0	0	0	109.8	R596 F609 Y611 N617 G618	R596-N620 VanDerWaalsContact CG-OD1 3.27Å; R596-N620 WeakPolarHBondContact CG-OD1 3.34Å; R596-N620 PolarHBondContact NH1-OD1 3.08Å; F609-N620 HydrophobicContact CZ-CB 4.07Å; Y611-N620 WeakPolarHBondContact CD1-ND2 3.05Å; Y611-N620 WeakPolarHBondContact CD2-ND2 3.07Å; Y611-N620 WeakPolarHBondContact CE1-ND2 3.01Å; Y611-N620 VanDerWaalsContact CE2-ND2 3.3Å; Y611-N620 WeakPolarHBondContact CE2-ND2 3.42Å; Y611-N620 VanDerWaalsContact CG-ND2 3.25Å; N617-N620 WeakPolarHBondContact O-CB 3.3Å; G618-N620 PolarHBondContact O-N 3.3Å
621	F	93.3	Very high	85.6	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.022	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-94.8	147.3	-176	-57.6	-76.9	0	0	0	111.6	R580 R596 W597 N619 V626 C627 T630 C631	R580-F621 HydrophobicContact CG-CE1 4.34Å; R580-F621 HydrophobicContact CG-CZ 4.1Å; R596-F621 CarbonylContact C-O 2.79Å; R596-F621 WeakPolarHBondContact CA-O 3.33Å; R596-F621 WeakPolarHBondContact CB-O 3.47Å; R596-F621 VanDerWaalsContact CD-O 3.23Å; R596-F621 WeakPolarHBondContact CD-O 3.47Å; W597-F621 HydrophobicContact CB-CB 4.27Å; W597-F621 PolarHBondContact N-O 2.75Å; W597-F621 WeakPolarHBondContact O-CB 3.33Å; W597-F621 WeakPolarHBondContact O-CD2 3.22Å; W597-F621 PolarHBondContact O-N 3.16Å; N619-F621 WeakPolarHBondContact OD1-CE2 3.38Å; F621-V626 HydrophobicContact CD1-CG1 4.15Å; F621-C627 HydrophobicContact CB-CB 3.69Å; F621-C627 HydrophobicContact CD1-CB 4.43Å; F621-C627 HydrophobicContact CD2-CB 3.48Å; F621-C627 VanDerWaalsContact CD2-CB 3.48Å; F621-C627 WeakPolarHBondContact CD2-SG 3.15Å; F621-C627 HydrophobicContact CE2-CB 4.21Å; F621-C627 HydrophobicContact CG-CB 3.6Å; F621-T630 HydrophobicContact CE1-CG2 3.74Å; F621-T630 HydrophobicContact CZ-CG2 3.94Å; F621-C631 VanDerWaalsContact CE2-SG 3.54Å; F621-C631 WeakPolarHBondContact CZ-SG 3.27Å
622	E	88.6	Confident	85	Confident	154 Å²	154	48.7 Å²	48.7	72%	0.72	29%	0.29	S	S	*	.	S	Bend	trans	-72.9	-35.6	-178.4	-172.4	161	-145.9	0	0	112.7
623	S	88	Confident	83.8	Confident	31 Å²	31	51.7 Å²	51.7	22%	0.217	31%	0.305	C	S	.	.	S	Bend	trans	-133.6	164.9	178.2	96.6	0	0	0	0	111.9	W597 E625 V626 C627	W597-S623 VanDerWaalsContact CD1-CA 3.46Å; S623-E625 VanDerWaalsContact C-N 3.26Å; S623-E625 WeakPolarHBondContact CB-OE2 3.32Å; S623-E625 PolarHBondContact O-N 2.98Å; S623-E625 PolarHBondContact OG-N 2.8Å; S623-E625 PolarHBondContact OG-OE2 2.03Å; S623-V626 PolarHBondContact O-N 2.89Å; S623-V626 PolarHBondContact OG-N 2.83Å; S623-V626 VanDerWaalsContact OG-N 3.12Å; S623-C627 PolarHBondContact O-N 2.78Å; S623-C627 VanDerWaalsContact O-N 3.16Å
624	R	88	Confident	82	Confident	100 Å²	100	55.3 Å²	55.3	38%	0.377	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-38	177.7	-168.8	-178.3	-173	-154.8	-3.3	110.4	W597 C606 C627 M628	W597-R624 VanDerWaalsContact CD1-N 3.32Å; W597-R624 HydrophobicContact CD2-CB 3.65Å; W597-R624 HydrophobicContact CD2-CG 4.13Å; W597-R624 HydrophobicContact CE3-CB 3.69Å; W597-R624 HydrophobicContact CE3-CG 3.64Å; W597-R624 HydrophobicContact CG-CB 4.26Å; W597-R624 HydrophobicContact CH2-CB 3.96Å; W597-R624 HydrophobicContact CH2-CG 4.13Å; W597-R624 HydrophobicContact CZ2-CB 3.91Å; W597-R624 HydrophobicContact CZ3-CB 3.86Å; W597-R624 HydrophobicContact CZ3-CG 3.64Å; C606-R624 HydrophobicContact CB-CG 4.18Å; R624-C627 WeakPolarHBondContact O-CB 3.24Å; R624-C627 PolarHBondContact O-N 3.45Å; R624-M628 HydrophobicContact CG-CG 4.29Å; R624-M628 WeakPolarHBondContact O-CB 2.98Å; R624-M628 VanDerWaalsContact O-CG 3.3Å; R624-M628 WeakPolarHBondContact O-CG 3.05Å; R624-M628 PolarHBondContact O-N 2.81Å
625	E	82.3	Confident	79.9	Confident	115 Å²	115	57.5 Å²	57.5	54%	0.537	33%	0.325	S	S	.	.	H	α-helix	trans	-69.4	-41.9	-178.2	-51.5	67.7	-141.8	0	0	110.5	S623 C627 M628 N629	S623-E625 VanDerWaalsContact C-N 3.26Å; S623-E625 WeakPolarHBondContact CB-OE2 3.32Å; S623-E625 PolarHBondContact O-N 2.98Å; S623-E625 PolarHBondContact OG-N 2.8Å; S623-E625 PolarHBondContact OG-OE2 2.03Å; E625-C627 VanDerWaalsContact C-N 3.26Å; E625-C627 PolarHBondContact O-N 3.08Å; E625-M628 PolarHBondContact O-N 3.03Å; E625-N629 WeakPolarHBondContact O-CB 2.96Å; E625-N629 PolarHBondContact O-N 3.19Å; E625-N629 PolarHBondContact O-ND2 3.25Å
626	V	85.2	Confident	77.7	Confident	68 Å²	68	60 Å²	60	41%	0.412	34%	0.335	S	S	.	.	H	α-helix	trans	-64.4	-33.5	173.6	176.7	0	0	0	0	111.6	F621 S623 T630	F621-V626 HydrophobicContact CD1-CG1 4.15Å; S623-V626 PolarHBondContact O-N 2.89Å; S623-V626 PolarHBondContact OG-N 2.83Å; S623-V626 VanDerWaalsContact OG-N 3.12Å; V626-T630 WeakPolarHBondContact O-CB 3.29Å; V626-T630 PolarHBondContact O-N 3.25Å; V626-T630 PolarHBondContact O-OG1 2.82Å
627	C	92.4	Very high	75.6	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68.6	-56.3	172.5	-177	0	0	0	0	111.4	W597 C606 F621 S623 R624 E625 N629 T630 C631	W597-C627 HydrophobicContact CB-CB 4.07Å; C606-C627 HydrophobicContact CB-CB 3.57Å; C606-C627 WeakPolarHBondContact CB-SG 3.04Å; C606-C627 WeakPolarHBondContact SG-CB 3.46Å; C606-C627 CovalentContact SG-SG 2.02Å; C606-C627 PolarHBondContact SG-SG 3.23Å; F621-C627 HydrophobicContact CB-CB 3.69Å; F621-C627 HydrophobicContact CD1-CB 4.43Å; F621-C627 HydrophobicContact CD2-CB 3.48Å; F621-C627 VanDerWaalsContact CD2-CB 3.48Å; F621-C627 WeakPolarHBondContact CD2-SG 3.15Å; F621-C627 HydrophobicContact CE2-CB 4.21Å; F621-C627 HydrophobicContact CG-CB 3.6Å; S623-C627 PolarHBondContact O-N 2.78Å; S623-C627 VanDerWaalsContact O-N 3.16Å; R624-C627 WeakPolarHBondContact O-CB 3.24Å; R624-C627 PolarHBondContact O-N 3.45Å; E625-C627 VanDerWaalsContact C-N 3.26Å; E625-C627 PolarHBondContact O-N 3.08Å; C627-N629 PolarHBondContact O-N 3.07Å; C627-T630 PolarHBondContact O-N 3.02Å; C627-C631 PolarHBondContact O-N 2.71Å
628	M	83.8	Confident	73.3	Confident	43 Å²	43	64.1 Å²	64.1	21%	0.212	35%	0.348	C	S	.	.	H	α-helix	trans	-62.9	-25.2	-178.5	-67.1	-58.4	-152.7	0	0	113.5	M605 C606 R624 E625 N633	M605-M628 HydrophobicContact CB-CE 4.18Å; C606-M628 HydrophobicContact CB-CE 3.99Å; C606-M628 HydrophobicContact CB-CG 3.94Å; C606-M628 HydrophobicContact CB-SD 3.59Å; C606-M628 VanDerWaalsContact CB-SD 3.59Å; C606-M628 PolarHBondContact SG-N 2.87Å; R624-M628 HydrophobicContact CG-CG 4.29Å; R624-M628 WeakPolarHBondContact O-CB 2.98Å; R624-M628 VanDerWaalsContact O-CG 3.3Å; R624-M628 WeakPolarHBondContact O-CG 3.05Å; R624-M628 PolarHBondContact O-N 2.81Å; E625-M628 PolarHBondContact O-N 3.03Å; M628-N633 PolarHBondContact O-ND2 3.25Å; M628-N633 PolarHBondContact SD-OD1 3.03Å
629	N	79.8	Confident	71.2	Confident	140 Å²	140	70.2 Å²	70.2	75%	0.749	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-9.1	174.4	-65.8	-18	0	0	0	113.5	E625 C627	E625-N629 WeakPolarHBondContact O-CB 2.96Å; E625-N629 PolarHBondContact O-N 3.19Å; E625-N629 PolarHBondContact O-ND2 3.25Å; C627-N629 PolarHBondContact O-N 3.07Å
630	T	82.3	Confident	68.6	Low	27 Å²	27	75.9 Å²	75.9	17%	0.166	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-41.2	172.2	-58.7	0	0	0	0	111.3	R580 F621 V626 C627	R580-T630 HydrophobicContact CG-CG2 4.29Å; R580-T630 VanDerWaalsContact NE-CG2 3.34Å; R580-T630 PolarHBondContact NH2-OG1 3.3Å; F621-T630 HydrophobicContact CE1-CG2 3.74Å; F621-T630 HydrophobicContact CZ-CG2 3.94Å; V626-T630 WeakPolarHBondContact O-CB 3.29Å; V626-T630 PolarHBondContact O-N 3.25Å; V626-T630 PolarHBondContact O-OG1 2.82Å; C627-T630 PolarHBondContact O-N 3.02Å
631	C	85.6	Confident	66.3	Low	8 Å²	8	80.7 Å²	80.7	5%	0.054	44%	0.435	C	S	.	.	S	Bend	trans	-99.3	154.8	-170.4	-53.2	0	0	0	0	111.2	C581 Y599 F621 C627	C581-C631 HydrophobicContact CB-CB 3.76Å; C581-C631 WeakPolarHBondContact CB-SG 3.46Å; C581-C631 WeakPolarHBondContact SG-CA 3.31Å; C581-C631 WeakPolarHBondContact SG-CB 2.99Å; C581-C631 CovalentContact SG-SG 2.04Å; C581-C631 PolarHBondContact SG-SG 3.07Å; Y599-C631 HydrophobicContact CD2-CB 3.54Å; Y599-C631 HydrophobicContact CE2-CB 4.19Å; Y599-C631 HydrophobicContact CG-CB 3.76Å; F621-C631 VanDerWaalsContact CE2-SG 3.54Å; F621-C631 WeakPolarHBondContact CZ-SG 3.27Å; C627-C631 PolarHBondContact O-N 2.71Å
632	P	78.7	Confident	65	Low	58 Å²	58	83.8 Å²	83.8	38%	0.377	45%	0.452	S	S	.	.			trans	-61.5	152.8	179.8	-20.9	34	0	0	0	112.3	F582 Y599	F582-P632 HydrophobicContact CZ-CG 4.13Å; Y599-P632 WeakPolarHBondContact CE2-O 3.13Å
633	N	59.3	Low	64.3	Low	73 Å²	73	79 Å²	79	39%	0.39	43%	0.433	S	S	.	.			trans	-135.4	135.7	160.2	-66.2	-71.9	0	0	0	106.1	M628 D635	M628-N633 PolarHBondContact O-ND2 3.25Å; M628-N633 PolarHBondContact SD-OD1 3.03Å; N633-D635 VanDerWaalsContact C-N 3.33Å; N633-D635 PolarHBondContact O-N 2.94Å
634	D	42.5	Very low	64.2	Low	111 Å²	111	77.7 Å²	77.7	59%	0.594	42%	0.424	S	S	*	.	S	Bend	trans	-87.8	52.3	-156	-163.3	31.1	0	0	0	116.5	Q980	D634-Q980 PolarHBondContact O-NE2 2.69Å; D634-Q980 PolarHBondContact OD1-NE2 2.78Å
635	D	35.1	Very low	64.2	Low	91 Å²	91	78.2 Å²	78.2	49%	0.487	43%	0.43	S	S	.	.	S	Bend	trans	-147.3	59.1	162.3	-174.3	15	0	0	0	111	N633 Q978 T979	N633-D635 VanDerWaalsContact C-N 3.33Å; N633-D635 PolarHBondContact O-N 2.94Å; D635-Q978 PolarHBondContact OD1-NE2 2.7Å; D635-Q978 PolarHBondContact OD2-NE2 3.07Å; D635-T979 VanDerWaalsContact C-CG2 3.46Å; D635-T979 WeakPolarHBondContact OD1-CG2 3.15Å; D635-T979 PolarHBondContact OD1-OG1 3.1Å
636	S	34.2	Very low	64.3	Low	100 Å²	100	75.9 Å²	75.9	70%	0.699	42%	0.419	S	S	*	.			trans	-157.9	85.4	170.6	-82	0	0	0	0	114.7	T979	S636-T979 VanDerWaalsContact N-CG2 3.32Å
637	S	35.5	Very low	64.4	Low	30 Å²	30	78.5 Å²	78.5	21%	0.21	42%	0.421	C	S	.	.			trans	-82.3	138.2	133.6	125.4	0	0	0	0	106.7	T979	S637-T979 VanDerWaalsContact CB-C 3.45Å; S637-T979 WeakPolarHBondContact CB-O 3.07Å; S637-T979 PolarHBondContact O-N 2.98Å; S637-T979 PolarHBondContact OG-N 3.29Å; S637-T979 PolarHBondContact OG-O 3.05Å
638	H	34.2	Very low	64.2	Low	129 Å²	129	83.4 Å²	83.4	60%	0.597	44%	0.44	S	S	*	.				-113.9	134.2	57	-56.8	-74	0	0	0	114.6	Q978	H638-Q978 WeakPolarHBondContact NE2-CA 3.4Å; H638-Q978 PolarHBondContact NE2-N 3.14Å
639	L	40.6	Very low	64.5	Low	158 Å²	158	82.4 Å²	82.4	83%	0.827	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-62.3	131.4	172.9	-73.9	169.9	0	0	0	110.6	L641	L639-L641 PolarHBondContact O-N 3.47Å
640	P	38.5	Very low	65.1	Low	123 Å²	123	78.1 Å²	78.1	80%	0.799	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-58.2	124.1	-176.5	-27.4	35.3	0	0	0	112.8
641	L	45.4	Very low	65.5	Low	130 Å²	130	77.8 Å²	77.8	68%	0.681	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-58.3	140.3	-178.5	-149.2	76.1	0	0	0	111	L639 P643	L639-L641 PolarHBondContact O-N 3.47Å; L641-P643 WeakPolarHBondContact O-CD 3.37Å
642	N	65	Low	65.5	Low	71 Å²	71	82.6 Å²	82.6	38%	0.38	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-55.2	122.9	-172.7	175.9	-4.4	0	0	0	111.5	C644 F645	N642-C644 PolarHBondContact O-N 3.43Å; N642-C644 WeakPolarHBondContact OD1-CB 2.99Å; N642-C644 PolarHBondContact OD1-N 2.94Å; N642-C644 PolarHBondContact OD1-SG 2.82Å; N642-F645 HydrophobicContact CB-CD2 3.81Å; N642-F645 HydrophobicContact CB-CE2 4.01Å; N642-F645 PolarHBondContact O-N 2.84Å
643	P	74.2	Confident	65.9	Low	52 Å²	52	82.5 Å²	82.5	34%	0.338	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-46.4	-31.6	179.3	-34.6	37.9	0	0	0	115.9	L641 F645 H646 A681 N682 F684	L641-P643 WeakPolarHBondContact O-CD 3.37Å; P643-F645 PolarHBondContact O-N 3.36Å; P643-H646 PolarHBondContact O-CD2 3.18Å; P643-A681 HydrophobicContact CB-CB 3.76Å; P643-A681 HydrophobicContact CG-CB 4.04Å; P643-N682 WeakPolarHBondContact O-CA 3.41Å; P643-N682 WeakPolarHBondContact O-CB 2.95Å; P643-N682 PolarHBondContact O-N 2.77Å; P643-F684 HydrophobicContact CB-CZ 4.3Å
644	C	86.8	Confident	67	Low	4 Å²	4	91 Å²	91	3%	0.027	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-64.7	-18.7	-179	-57.5	0	0	0	0	114.8	N642 Y662 N682 K693 C694	N642-C644 PolarHBondContact O-N 3.43Å; N642-C644 WeakPolarHBondContact OD1-CB 2.99Å; N642-C644 PolarHBondContact OD1-N 2.94Å; N642-C644 PolarHBondContact OD1-SG 2.82Å; C644-Y662 HydrophobicContact CB-CD1 4.28Å; C644-N682 PolarHBondContact O-ND2 3.11Å; C644-K693 PolarHBondContact SG-O 3.26Å; C644-K693 VanDerWaalsContact SG-O 3.34Å; C644-C694 VanDerWaalsContact CA-SG 3.58Å; C644-C694 HydrophobicContact CB-CB 3.62Å; C644-C694 WeakPolarHBondContact CB-SG 2.94Å; C644-C694 WeakPolarHBondContact SG-CA 3.48Å; C644-C694 WeakPolarHBondContact SG-CB 3.19Å; C644-C694 CovalentContact SG-SG 2.03Å; C644-C694 PolarHBondContact SG-SG 2.83Å
645	F	86.5	Confident	68.5	Low	112 Å²	112	87.9 Å²	87.9	49%	0.491	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-101.4	-5.8	-174.3	-60.1	-50.8	0	0	0	114.9	N642 P643 L699	N642-F645 HydrophobicContact CB-CD2 3.81Å; N642-F645 HydrophobicContact CB-CE2 4.01Å; N642-F645 PolarHBondContact O-N 2.84Å; P643-F645 PolarHBondContact O-N 3.36Å; F645-L699 HydrophobicContact CZ-CD1 4.47Å
646	H	85.8	Confident	70.8	Confident	65 Å²	65	88.3 Å²	88.3	30%	0.301	47%	0.474	S	S	.	.	S	Bend	trans	-69	156.5	167.4	-49.3	-67.7	0	0	0	110.5	P643 N680 N682	P643-H646 PolarHBondContact O-CD2 3.18Å; H646-N680 HydrophobicContact CB-CB 4.29Å; H646-N680 VanDerWaalsContact CB-CG 3.46Å; H646-N680 WeakPolarHBondContact CB-OD1 3.41Å; H646-N682 HydrophobicContact CB-CB 4.07Å; H646-N682 WeakPolarHBondContact O-CB 2.98Å; H646-N682 PolarHBondContact O-ND2 3.36Å
647	R	86.1	Confident	73.2	Confident	123 Å²	123	87.7 Å²	87.7	46%	0.464	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-71.8	157.7	173.6	-52.4	-167.6	-166.7	-91.1	23	110.4	D649 N680 S962 S963 T964	R647-D649 PolarHBondContact O-N 2.92Å; R647-N680 PolarHBondContact O-ND2 3.45Å; R647-N680 PolarHBondContact O-OD1 3.13Å; R647-S962 PolarHBondContact NH2-O 2.92Å; R647-S963 VanDerWaalsContact NH1-C 3.35Å; R647-S963 PolarHBondContact NH1-O 3.02Å; R647-S963 PolarHBondContact NH2-O 2.84Å; R647-T964 WeakPolarHBondContact CD-O 3.34Å; R647-T964 VanDerWaalsContact CZ-O 3.25Å; R647-T964 PolarHBondContact NE-O 2.56Å
648	R	89.1	Confident	75.6	Confident	103 Å²	103	92.2 Å²	92.2	39%	0.389	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-52.8	138.8	168.3	74.2	-179.3	170	-95.9	0.8	110.1	F661 F672 T966	R648-F661 HydrophobicContact CB-CB 3.92Å; R648-F661 HydrophobicContact CB-CD1 3.57Å; R648-F661 HydrophobicContact CB-CD2 3.56Å; R648-F661 HydrophobicContact CB-CE1 3.9Å; R648-F661 HydrophobicContact CB-CE2 3.87Å; R648-F661 HydrophobicContact CB-CG 3.39Å; R648-F661 HydrophobicContact CB-CZ 4.05Å; R648-F661 HydrophobicContact CG-CD1 4.48Å; R648-F661 HydrophobicContact CG-CE1 4.36Å; R648-F661 HydrophobicContact CG-CE2 4.41Å; R648-F661 HydrophobicContact CG-CZ 4.33Å; R648-F672 HydrophobicContact CB-CD2 4.37Å; R648-F672 HydrophobicContact CB-CG 4.23Å; R648-T966 PolarHBondContact O-OG1 2.91Å; R648-T966 VanDerWaalsContact O-OG1 3.13Å
649	D	90.4	Very high	78.3	Confident	22 Å²	22	88.8 Å²	88.8	12%	0.118	45%	0.454	C	S	.	.			trans	-141.4	102.9	-175.3	-172.5	14.2	0	0	0	114.6	R647 G651 F672 Y674 G679 N680 T966	R647-D649 PolarHBondContact O-N 2.92Å; D649-G651 PolarHBondContact O-N 3.34Å; D649-G651 PolarHBondContact OD1-N 3.21Å; D649-F672 WeakPolarHBondContact O-CE2 3.47Å; D649-Y674 WeakPolarHBondContact O-CD2 3.48Å; D649-G679 VanDerWaalsContact OD2-CA 3.32Å; D649-G679 WeakPolarHBondContact OD2-CA 3.19Å; D649-N680 HydrophobicContact CB-CB 4.39Å; D649-N680 VanDerWaalsContact CB-ND2 3.26Å; D649-N680 WeakPolarHBondContact CB-ND2 3.38Å; D649-N680 PolarHBondContact OD2-N 2.67Å; D649-T966 VanDerWaalsContact CA-OG1 3.29Å; D649-T966 WeakPolarHBondContact CA-OG1 3.27Å; D649-T966 WeakPolarHBondContact CB-OG1 3.19Å; D649-T966 VanDerWaalsContact OD1-CG2 3.31Å; D649-T966 WeakPolarHBondContact OD1-CG2 3.32Å; D649-T966 PolarHBondContact OD1-OG1 3.24Å
650	P	91.9	Very high	80.8	Confident	51 Å²	51	83.1 Å²	83.1	33%	0.331	42%	0.422	S	S	.	.			trans	-59.2	-28.7	172.1	-25.6	36.3	0	0	0	114.1	T673 Y674 G675	P650-T673 WeakPolarHBondContact CB-O 3.23Å; P650-Y674 WeakPolarHBondContact O-CD2 3.15Å; P650-G675 VanDerWaalsContact O-CA 3.24Å; P650-G675 WeakPolarHBondContact O-CA 3.1Å; P650-G675 PolarHBondContact O-N 2.96Å
651	G	89.6	Confident	83.3	Confident	19 Å²	19	77.7 Å²	77.7	20%	0.196	39%	0.386	C	S	.	.			trans	65.4	177.1	-170.1	0	0	0	0	0	114.3	D649 G678	D649-G651 PolarHBondContact O-N 3.34Å; D649-G651 PolarHBondContact OD1-N 3.21Å; G651-G678 WeakPolarHBondContact CA-O 3.36Å
652	P	86.4	Confident	85.5	Confident	109 Å²	109	71.9 Å²	71.9	71%	0.708	36%	0.355	S	S	*	.	S	Bend	trans	-80.9	-15.2	-169.9	29.9	-36.5	0	0	0	115.8	C677 G678	P652-C677 WeakPolarHBondContact CD-O 3.26Å; P652-G678 WeakPolarHBondContact CD-O 3.31Å
653	C	87.8	Confident	86.5	Confident	56 Å²	56	69 Å²	69	38%	0.378	34%	0.339	S	S	.	.			trans	-75.6	161.2	178.3	-77.6	0	0	0	0	112.6	G675 C677	C653-G675 CarbonylContact C-O 3.36Å; C653-G675 VanDerWaalsContact C-O 3.24Å; C653-G675 WeakPolarHBondContact CB-O 3.32Å; C653-G675 WeakPolarHBondContact O-CA 3.09Å; C653-C677 HydrophobicContact CB-CB 3.87Å; C653-C677 WeakPolarHBondContact CB-SG 3.3Å; C653-C677 WeakPolarHBondContact SG-CB 3.4Å; C653-C677 CovalentContact SG-SG 2.03Å; C653-C677 PolarHBondContact SG-SG 3.46Å
654	R	82.1	Confident	86.8	Confident	253 Å²	253	69.4 Å²	69.4	96%	0.955	34%	0.343	S	S	*	.			trans	-111.1	20.6	-174	-64.3	-174.9	177.5	-179.2	-1.1	115.2	G675	R654-G675 PolarHBondContact N-O 3.3Å
655	A	72.6	Confident	86.4	Confident	45 Å²	45	77.2 Å²	77.2	37%	0.372	37%	0.372	S	S	.	.			trans	-76.2	165	167.6	0	0	0	0	0	110.7	H657 G675	A655-H657 WeakPolarHBondContact CB-NE2 3.39Å; A655-G675 WeakPolarHBondContact CA-O 3.37Å; A655-G675 VanDerWaalsContact CB-O 3.26Å; A655-G675 WeakPolarHBondContact CB-O 3.26Å; A655-G675 PolarHBondContact N-O 3.38Å; A655-G675 VanDerWaalsContact O-CA 3.24Å; A655-G675 WeakPolarHBondContact O-CA 3.46Å
656	S	85	Confident	86	Confident	99 Å²	99	75.6 Å²	75.6	69%	0.692	37%	0.371	S	S	*	.			trans	-119.9	64.7	-175.8	179.3	0	0	0	0	111.6	R658 T673	S656-R658 PolarHBondContact O-N 3.2Å; S656-T673 WeakPolarHBondContact OG-CG2 3.49Å
657	H	84.4	Confident	85.4	Confident	88 Å²	88	76.3 Å²	76.3	41%	0.407	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	115.3	176.5	-60	-88.5	0	0	0	110	A655 R659 Y674 G676	A655-H657 WeakPolarHBondContact CB-NE2 3.39Å; H657-R659 HydrophobicContact CB-CG 4.44Å; H657-R659 PolarHBondContact O-N 3.43Å; H657-Y674 HydrophobicContact CB-CD1 4.33Å; H657-Y674 WeakPolarHBondContact CB-O 3.46Å; H657-Y674 PolarHBondContact N-O 2.93Å; H657-Y674 PolarHBondContact O-N 2.88Å; H657-G676 VanDerWaalsContact CD2-CA 3.47Å; H657-G676 WeakPolarHBondContact CD2-CA 3.15Å
658	R	85.6	Confident	84.9	Confident	124 Å²	124	74.2 Å²	74.2	47%	0.468	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	118.5	168.9	-178.3	176.3	172.9	-174.1	-1.6	109.1	S656 P671 C820	S656-R658 PolarHBondContact O-N 3.2Å; R658-P671 HydrophobicContact CG-CB 4.5Å; R658-C820 PolarHBondContact NH1-SG 2.04Å; R658-C820 VanDerWaalsContact NH1-SG 3.4Å
659	R	91.6	Very high	84.9	Confident	57 Å²	57	69.4 Å²	69.4	22%	0.215	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	177.7	176.6	-68.7	-69.6	-179.1	79.5	-4.6	109.1	H657 P671 F672 Y674 N683 F684	H657-R659 HydrophobicContact CB-CG 4.44Å; H657-R659 PolarHBondContact O-N 3.43Å; R659-P671 CarbonylContact O-C 3.59Å; R659-P671 VanDerWaalsContact O-CA 3.22Å; R659-P671 WeakPolarHBondContact O-CA 3.2Å; R659-F672 HydrophobicContact CB-CD1 4Å; R659-F672 HydrophobicContact CB-CE1 3.52Å; R659-F672 HydrophobicContact CB-CE2 4.44Å; R659-F672 HydrophobicContact CB-CZ 3.79Å; R659-F672 PolarHBondContact N-O 3.48Å; R659-F672 PolarHBondContact O-N 2.95Å; R659-Y674 HydrophobicContact CG-CD1 4.22Å; R659-Y674 HydrophobicContact CG-CG 4.2Å; R659-Y674 VanDerWaalsContact NH1-CD1 3.27Å; R659-N683 WeakPolarHBondContact CB-OD1 3.39Å; R659-N683 WeakPolarHBondContact CD-OD1 2.95Å; R659-N683 WeakPolarHBondContact CG-OD1 3.22Å; R659-N683 PolarHBondContact NH1-OD1 3.22Å; R659-F684 CarbonylContact C-O 3.52Å; R659-F684 WeakPolarHBondContact CA-O 3.5Å; R659-F684 WeakPolarHBondContact CB-O 3.32Å; R659-F684 VanDerWaalsContact CD-O 3.31Å; R659-F684 WeakPolarHBondContact CD-O 3.3Å
660	W	91.8	Very high	84.7	Confident	39 Å²	39	71.7 Å²	71.7	15%	0.148	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.7	179.5	-59.6	79.2	0	0	0	109.3	H670 P671 F684 S686 F687 C690	W660-H670 CarbonylContact C-O 3.08Å; W660-H670 VanDerWaalsContact CA-O 3.31Å; W660-H670 WeakPolarHBondContact CA-O 3.38Å; W660-P671 HydrophobicContact CD2-CB 4.09Å; W660-P671 HydrophobicContact CE3-CB 3.91Å; W660-P671 HydrophobicContact CE3-CG 4.38Å; W660-P671 HydrophobicContact CH2-CB 4.17Å; W660-P671 HydrophobicContact CH2-CG 4.36Å; W660-P671 HydrophobicContact CZ2-CB 4.31Å; W660-P671 HydrophobicContact CZ3-CB 3.96Å; W660-P671 HydrophobicContact CZ3-CG 4.05Å; W660-F684 PolarHBondContact N-O 3.12Å; W660-F684 WeakPolarHBondContact O-CD2 3.18Å; W660-F684 PolarHBondContact O-N 3.37Å; W660-S686 VanDerWaalsContact CD1-CA 3.41Å; W660-F687 HydrophobicContact CD2-CB 3.83Å; W660-F687 HydrophobicContact CE3-CB 3.79Å; W660-F687 AromaticContact CE3-CD2 3.68Å; W660-F687 HydrophobicContact CE3-CD2 3.68Å; W660-F687 HydrophobicContact CE3-CG 4.21Å; W660-F687 HydrophobicContact CH2-CB 3.83Å; W660-F687 HydrophobicContact CH2-CD2 4.26Å; W660-F687 HydrophobicContact CH2-CG 4.34Å; W660-F687 HydrophobicContact CZ2-CB 3.88Å; W660-F687 HydrophobicContact CZ3-CB 3.79Å; W660-F687 AromaticContact CZ3-CD2 3.52Å; W660-F687 HydrophobicContact CZ3-CD2 3.52Å; W660-F687 HydrophobicContact CZ3-CE2 4.46Å; W660-F687 HydrophobicContact CZ3-CG 4.02Å; W660-C690 HydrophobicContact CB-CB 4.01Å
661	F	92.2	Very high	84.6	Confident	10 Å²	10	72.1 Å²	72.1	4%	0.044	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	148.4	174	79	-77.6	0	0	0	108.5	R648 D663 C669 H670 F672 N682 C690	R648-F661 HydrophobicContact CB-CB 3.92Å; R648-F661 HydrophobicContact CB-CD1 3.57Å; R648-F661 HydrophobicContact CB-CD2 3.56Å; R648-F661 HydrophobicContact CB-CE1 3.9Å; R648-F661 HydrophobicContact CB-CE2 3.87Å; R648-F661 HydrophobicContact CB-CG 3.39Å; R648-F661 HydrophobicContact CB-CZ 4.05Å; R648-F661 HydrophobicContact CG-CD1 4.48Å; R648-F661 HydrophobicContact CG-CE1 4.36Å; R648-F661 HydrophobicContact CG-CE2 4.41Å; R648-F661 HydrophobicContact CG-CZ 4.33Å; F661-D663 HydrophobicContact CD2-CB 4.23Å; F661-D663 HydrophobicContact CE2-CB 3.43Å; F661-D663 VanDerWaalsContact CE2-CB 3.43Å; F661-D663 WeakPolarHBondContact CE2-OD2 3.19Å; F661-D663 HydrophobicContact CZ-CB 3.77Å; F661-D663 VanDerWaalsContact CZ-OD2 3.29Å; F661-D663 WeakPolarHBondContact CZ-OD2 3.39Å; F661-D663 PolarHBondContact O-N 3.25Å; F661-C669 CarbonylContact O-C 3.48Å; F661-C669 VanDerWaalsContact O-CA 3.27Å; F661-C669 WeakPolarHBondContact O-CA 3.3Å; F661-H670 HydrophobicContact CD1-CB 4.16Å; F661-H670 VanDerWaalsContact CD1-O 3.25Å; F661-H670 WeakPolarHBondContact CD1-O 3.31Å; F661-H670 HydrophobicContact CE1-CB 3.5Å; F661-H670 HydrophobicContact CZ-CB 3.92Å; F661-H670 PolarHBondContact N-O 2.81Å; F661-H670 PolarHBondContact O-N 3.32Å; F661-F672 HydrophobicContact CB-CD1 3.82Å; F661-F672 HydrophobicContact CB-CE1 3.81Å; F661-F672 HydrophobicContact CD1-CB 3.95Å; F661-F672 AromaticContact CD1-CD1 3.69Å; F661-F672 HydrophobicContact CD1-CD1 3.69Å; F661-F672 HydrophobicContact CD1-CG 4.09Å; F661-F672 HydrophobicContact CE1-CB 4.26Å; F661-F672 HydrophobicContact CG-CD1 4.19Å; F661-N682 VanDerWaalsContact CA-OD1 3.29Å; F661-N682 WeakPolarHBondContact CA-OD1 3.05Å; F661-N682 HydrophobicContact CB-CB 4.46Å; F661-N682 WeakPolarHBondContact CB-O 3.41Å; F661-C690 VanDerWaalsContact C-SG 3.51Å
662	Y	90.6	Very high	84.7	Confident	8 Å²	8	72 Å²	72	3%	0.031	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	117.2	169.7	-174.7	-116.6	0	0	0	109.6	C644 N667 N682 C690 C694	C644-Y662 HydrophobicContact CB-CD1 4.28Å; Y662-N667 WeakPolarHBondContact CE2-O 3.39Å; Y662-N667 WeakPolarHBondContact OH-CA 3.29Å; Y662-N667 VanDerWaalsContact OH-CB 3.26Å; Y662-N667 WeakPolarHBondContact OH-CB 3.13Å; Y662-N667 PolarHBondContact OH-OD1 3.3Å; Y662-N682 PolarHBondContact N-ND2 3.04Å; Y662-N682 PolarHBondContact N-OD1 2.71Å; Y662-N682 PolarHBondContact O-ND2 3.31Å; Y662-C690 PolarHBondContact N-SG 2.79Å; Y662-C690 VanDerWaalsContact N-SG 3.38Å; Y662-C694 VanDerWaalsContact CB-CB 3.48Å; Y662-C694 HydrophobicContact CD1-CB 3.93Å; Y662-C694 HydrophobicContact CD2-CB 3.57Å; Y662-C694 WeakPolarHBondContact CD2-O 3.38Å; Y662-C694 WeakPolarHBondContact CE1-O 3.04Å; Y662-C694 HydrophobicContact CE2-CB 4.24Å; Y662-C694 WeakPolarHBondContact CE2-O 3.38Å; Y662-C694 HydrophobicContact CG-CB 3.38Å; Y662-C694 PolarHBondContact OH-O 3.01Å
663	D	86.6	Confident	84.8	Confident	9 Å²	9	70.5 Å²	70.5	5%	0.048	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	96.2	170.1	-156.6	-36.5	0	0	0	108.3	F661 R665 V666 N667 M668	F661-D663 HydrophobicContact CD2-CB 4.23Å; F661-D663 HydrophobicContact CE2-CB 3.43Å; F661-D663 VanDerWaalsContact CE2-CB 3.43Å; F661-D663 WeakPolarHBondContact CE2-OD2 3.19Å; F661-D663 HydrophobicContact CZ-CB 3.77Å; F661-D663 VanDerWaalsContact CZ-OD2 3.29Å; F661-D663 WeakPolarHBondContact CZ-OD2 3.39Å; F661-D663 PolarHBondContact O-N 3.25Å; D663-R665 PolarHBondContact O-N 3.1Å; D663-R665 WeakPolarHBondContact OD1-CB 3.33Å; D663-R665 WeakPolarHBondContact OD1-CG 3.32Å; D663-R665 IonicContact OD1-CZ 3.6Å; D663-R665 PolarHBondContact OD1-N 2.98Å; D663-R665 IonicContact OD1-NE 3.67Å; D663-R665 PolarHBondContact OD1-NE 2.94Å; D663-R665 IonicContact OD1-NH2 3.74Å; D663-R665 PolarHBondContact OD1-NH2 3.27Å; D663-R665 IonicContact OD2-CZ 2.7Å; D663-R665 IonicContact OD2-NE 3.48Å; D663-R665 IonicContact OD2-NH2 3.56Å; D663-R665 PolarHBondContact OD2-NH2 2.94Å; D663-V666 HydrophobicContact CB-CG2 3.94Å; D663-V666 WeakPolarHBondContact O-CG2 3.31Å; D663-V666 PolarHBondContact O-N 2.95Å; D663-V666 VanDerWaalsContact O-N 3.14Å; D663-N667 WeakPolarHBondContact O-CA 3.4Å; D663-N667 PolarHBondContact O-N 3.38Å; D663-M668 PolarHBondContact N-O 2.91Å; D663-M668 PolarHBondContact O-N 2.02Å
664	S	79.5	Confident	85	Confident	61 Å²	61	69 Å²	69	43%	0.427	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-10.9	-179.3	53.3	0	0	0	0	114.1	N667	S664-N667 PolarHBondContact O-OD1 3.22Å
665	R	78.1	Confident	85.3	Confident	169 Å²	169	57.1 Å²	57.1	64%	0.638	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-29.2	177.3	-56.1	174.1	-62.2	141.8	8.8	112.9	D663	D663-R665 PolarHBondContact O-N 3.1Å; D663-R665 WeakPolarHBondContact OD1-CB 3.33Å; D663-R665 WeakPolarHBondContact OD1-CG 3.32Å; D663-R665 IonicContact OD1-CZ 3.6Å; D663-R665 PolarHBondContact OD1-N 2.98Å; D663-R665 IonicContact OD1-NE 3.67Å; D663-R665 PolarHBondContact OD1-NE 2.94Å; D663-R665 IonicContact OD1-NH2 3.74Å; D663-R665 PolarHBondContact OD1-NH2 3.27Å; D663-R665 IonicContact OD2-CZ 2.7Å; D663-R665 IonicContact OD2-NE 3.48Å; D663-R665 IonicContact OD2-NH2 3.56Å; D663-R665 PolarHBondContact OD2-NH2 2.94Å
666	V	78.9	Confident	85.7	Confident	77 Å²	77	56.6 Å²	56.6	47%	0.467	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	7	170.6	-63.7	0	0	0	0	111.7	D663 M668 H670	D663-V666 HydrophobicContact CB-CG2 3.94Å; D663-V666 WeakPolarHBondContact O-CG2 3.31Å; D663-V666 PolarHBondContact O-N 2.95Å; D663-V666 VanDerWaalsContact O-N 3.14Å; V666-M668 HydrophobicContact CG2-CB 4.06Å; V666-M668 PolarHBondContact O-N 2.78Å; V666-M668 VanDerWaalsContact O-N 3.11Å; V666-H670 WeakPolarHBondContact CG2-NE2 3.36Å
667	N	72.4	Confident	85.7	Confident	80 Å²	80	54.1 Å²	54.1	43%	0.428	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.5	40	-169.4	-68.8	-61	0	0	0	114	Y662 D663 S664 P696	Y662-N667 WeakPolarHBondContact CE2-O 3.39Å; Y662-N667 WeakPolarHBondContact OH-CA 3.29Å; Y662-N667 VanDerWaalsContact OH-CB 3.26Å; Y662-N667 WeakPolarHBondContact OH-CB 3.13Å; Y662-N667 PolarHBondContact OH-OD1 3.3Å; D663-N667 WeakPolarHBondContact O-CA 3.4Å; D663-N667 PolarHBondContact O-N 3.38Å; S664-N667 PolarHBondContact O-OD1 3.22Å; N667-P696 HydrophobicContact CB-CB 3.86Å; N667-P696 WeakPolarHBondContact O-CB 3.39Å; N667-P696 WeakPolarHBondContact O-CD 3.41Å; N667-P696 WeakPolarHBondContact O-CG 3.38Å
668	M	75.7	Confident	85.6	Confident	80 Å²	80	52.5 Å²	52.5	39%	0.394	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	151	-174.8	-174.4	163.3	52	0	0	112.6	D663 V666 H670 F687 M691	D663-M668 PolarHBondContact N-O 2.91Å; D663-M668 PolarHBondContact O-N 2.02Å; V666-M668 HydrophobicContact CG2-CB 4.06Å; V666-M668 PolarHBondContact O-N 2.78Å; V666-M668 VanDerWaalsContact O-N 3.11Å; M668-H670 PolarHBondContact O-N 2.82Å; M668-F687 HydrophobicContact CG-CE2 4.18Å; M668-M691 HydrophobicContact CG-CE 4.37Å; M668-M691 HydrophobicContact CG-SD 4.15Å
669	C	90.4	Very high	85.3	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.014	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	108.9	178.8	-71	0	0	0	0	112.5	F661 F687 C690 M691	F661-C669 CarbonylContact O-C 3.48Å; F661-C669 VanDerWaalsContact O-CA 3.27Å; F661-C669 WeakPolarHBondContact O-CA 3.3Å; C669-F687 HydrophobicContact CB-CD2 3.73Å; C669-F687 HydrophobicContact CB-CE2 3.89Å; C669-F687 WeakPolarHBondContact O-CD2 3.25Å; C669-F687 WeakPolarHBondContact O-CE2 3.23Å; C669-C690 HydrophobicContact CB-CB 3.57Å; C669-C690 WeakPolarHBondContact CB-SG 3.33Å; C669-C690 WeakPolarHBondContact SG-CB 3.2Å; C669-C690 CovalentContact SG-SG 2.02Å; C669-C690 PolarHBondContact SG-SG 3.15Å; C669-M691 HydrophobicContact CB-CG 3.82Å; C669-M691 HydrophobicContact CB-SD 3.66Å; C669-M691 PolarHBondContact SG-N 2.82Å
670	H	85.9	Confident	85.2	Confident	69 Å²	69	47.3 Å²	47.3	32%	0.319	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	146.4	175.3	-81.7	-41.1	0	0	0	111.9	W660 F661 V666 M668	W660-H670 CarbonylContact C-O 3.08Å; W660-H670 VanDerWaalsContact CA-O 3.31Å; W660-H670 WeakPolarHBondContact CA-O 3.38Å; F661-H670 HydrophobicContact CD1-CB 4.16Å; F661-H670 VanDerWaalsContact CD1-O 3.25Å; F661-H670 WeakPolarHBondContact CD1-O 3.31Å; F661-H670 HydrophobicContact CE1-CB 3.5Å; F661-H670 HydrophobicContact CZ-CB 3.92Å; F661-H670 PolarHBondContact N-O 2.81Å; F661-H670 PolarHBondContact O-N 3.32Å; V666-H670 WeakPolarHBondContact CG2-NE2 3.36Å; M668-H670 PolarHBondContact O-N 2.82Å
671	P	89	Confident	85	Confident	60 Å²	60	47.8 Å²	47.8	39%	0.39	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	146.2	172.1	32.1	-32.7	0	0	0	110.4	R658 R659 W660	R658-P671 HydrophobicContact CG-CB 4.5Å; R659-P671 CarbonylContact O-C 3.59Å; R659-P671 VanDerWaalsContact O-CA 3.22Å; R659-P671 WeakPolarHBondContact O-CA 3.2Å; W660-P671 HydrophobicContact CD2-CB 4.09Å; W660-P671 HydrophobicContact CE3-CB 3.91Å; W660-P671 HydrophobicContact CE3-CG 4.38Å; W660-P671 HydrophobicContact CH2-CB 4.17Å; W660-P671 HydrophobicContact CH2-CG 4.36Å; W660-P671 HydrophobicContact CZ2-CB 4.31Å; W660-P671 HydrophobicContact CZ3-CB 3.96Å; W660-P671 HydrophobicContact CZ3-CG 4.05Å
672	F	91.7	Very high	85	Confident	16 Å²	16	47.3 Å²	47.3	7%	0.07	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	164.5	170.4	78.7	-77.3	0	0	0	111	R648 D649 R659 F661 N683	R648-F672 HydrophobicContact CB-CD2 4.37Å; R648-F672 HydrophobicContact CB-CG 4.23Å; D649-F672 WeakPolarHBondContact O-CE2 3.47Å; R659-F672 HydrophobicContact CB-CD1 4Å; R659-F672 HydrophobicContact CB-CE1 3.52Å; R659-F672 HydrophobicContact CB-CE2 4.44Å; R659-F672 HydrophobicContact CB-CZ 3.79Å; R659-F672 PolarHBondContact N-O 3.48Å; R659-F672 PolarHBondContact O-N 2.95Å; F661-F672 HydrophobicContact CB-CD1 3.82Å; F661-F672 HydrophobicContact CB-CE1 3.81Å; F661-F672 HydrophobicContact CD1-CB 3.95Å; F661-F672 AromaticContact CD1-CD1 3.69Å; F661-F672 HydrophobicContact CD1-CD1 3.69Å; F661-F672 HydrophobicContact CD1-CG 4.09Å; F661-F672 HydrophobicContact CE1-CB 4.26Å; F661-F672 HydrophobicContact CG-CD1 4.19Å; F672-N683 HydrophobicContact CZ-CB 4.06Å
673	T	89.6	Confident	85.2	Confident	79 Å²	79	48.1 Å²	48.1	49%	0.485	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.2	175.7	-56.2	0	0	0	0	109.9	P650 S656	P650-T673 WeakPolarHBondContact CB-O 3.23Å; S656-T673 WeakPolarHBondContact OG-CG2 3.49Å
674	Y	91.5	Very high	85.4	Confident	23 Å²	23	48.2 Å²	48.2	9%	0.09	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129.3	172.6	176	-124.7	0	0	0	111.1	D649 P650 H657 R659 G676 C677 G678 N683	D649-Y674 WeakPolarHBondContact O-CD2 3.48Å; P650-Y674 WeakPolarHBondContact O-CD2 3.15Å; H657-Y674 HydrophobicContact CB-CD1 4.33Å; H657-Y674 WeakPolarHBondContact CB-O 3.46Å; H657-Y674 PolarHBondContact N-O 2.93Å; H657-Y674 PolarHBondContact O-N 2.88Å; R659-Y674 HydrophobicContact CG-CD1 4.22Å; R659-Y674 HydrophobicContact CG-CG 4.2Å; R659-Y674 VanDerWaalsContact NH1-CD1 3.27Å; Y674-G676 VanDerWaalsContact CE1-CA 3.41Å; Y674-G676 VanDerWaalsContact CZ-C 3.45Å; Y674-G676 PolarHBondContact O-N 3.45Å; Y674-G676 VanDerWaalsContact O-N 3.15Å; Y674-G676 PolarHBondContact OH-O 3.43Å; Y674-C677 WeakPolarHBondContact OH-CA 3.04Å; Y674-C677 PolarHBondContact OH-N 3.46Å; Y674-G678 PolarHBondContact OH-N 2.85Å; Y674-N683 VanDerWaalsContact CD2-ND2 3.31Å; Y674-N683 WeakPolarHBondContact CD2-ND2 3Å; Y674-N683 WeakPolarHBondContact CE2-ND2 3.16Å
675	G	87.5	Confident	85.7	Confident	4 Å²	4	52.9 Å²	52.9	4%	0.041	31%	0.305	C	S	.	.			trans	-61.6	-15.4	179.5	0	0	0	0	0	115.2	P650 C653 R654 A655	P650-G675 VanDerWaalsContact O-CA 3.24Å; P650-G675 WeakPolarHBondContact O-CA 3.1Å; P650-G675 PolarHBondContact O-N 2.96Å; C653-G675 CarbonylContact C-O 3.36Å; C653-G675 VanDerWaalsContact C-O 3.24Å; C653-G675 WeakPolarHBondContact CB-O 3.32Å; C653-G675 WeakPolarHBondContact O-CA 3.09Å; R654-G675 PolarHBondContact N-O 3.3Å; A655-G675 WeakPolarHBondContact CA-O 3.37Å; A655-G675 VanDerWaalsContact CB-O 3.26Å; A655-G675 WeakPolarHBondContact CB-O 3.26Å; A655-G675 PolarHBondContact N-O 3.38Å; A655-G675 VanDerWaalsContact O-CA 3.24Å; A655-G675 WeakPolarHBondContact O-CA 3.46Å
676	G	81.6	Confident	85.9	Confident	34 Å²	34	47.1 Å²	47.1	35%	0.351	29%	0.291	S	S	.	.	S	Bend	trans	100	-20.2	177.4	0	0	0	0	0	114.7	H657 Y674	H657-G676 VanDerWaalsContact CD2-CA 3.47Å; H657-G676 WeakPolarHBondContact CD2-CA 3.15Å; Y674-G676 VanDerWaalsContact CE1-CA 3.41Å; Y674-G676 VanDerWaalsContact CZ-C 3.45Å; Y674-G676 PolarHBondContact O-N 3.45Å; Y674-G676 VanDerWaalsContact O-N 3.15Å; Y674-G676 PolarHBondContact OH-O 3.43Å
677	C	84.7	Confident	86.2	Confident	47 Å²	47	47.2 Å²	47.2	32%	0.318	29%	0.285	S	S	.	.	S	Bend	trans	-139.5	155.6	172.6	80.5	0	0	0	0	111.5	P652 C653 Y674 G679	P652-C677 WeakPolarHBondContact CD-O 3.26Å; C653-C677 HydrophobicContact CB-CB 3.87Å; C653-C677 WeakPolarHBondContact CB-SG 3.3Å; C653-C677 WeakPolarHBondContact SG-CB 3.4Å; C653-C677 CovalentContact SG-SG 2.03Å; C653-C677 PolarHBondContact SG-SG 3.46Å; Y674-C677 WeakPolarHBondContact OH-CA 3.04Å; Y674-C677 PolarHBondContact OH-N 3.46Å; C677-G679 PolarHBondContact O-N 3.47Å
678	G	82.4	Confident	86.2	Confident	54 Å²	54	47.1 Å²	47.1	56%	0.557	29%	0.291	S	S	*	.	S	Bend	trans	63.5	38.4	166.3	0	0	0	0	0	116	G651 P652 Y674	G651-G678 WeakPolarHBondContact CA-O 3.36Å; P652-G678 WeakPolarHBondContact CD-O 3.31Å; Y674-G678 PolarHBondContact OH-N 2.85Å
679	G	80.5	Confident	86.4	Confident	25 Å²	25	45.5 Å²	45.5	26%	0.258	29%	0.287	S	S	.	.			trans	-107.5	147.3	171.4	0	0	0	0	0	112	D649 C677	D649-G679 VanDerWaalsContact OD2-CA 3.32Å; D649-G679 WeakPolarHBondContact OD2-CA 3.19Å; C677-G679 PolarHBondContact O-N 3.47Å
680	N	88	Confident	86.4	Confident	47 Å²	47	45.4 Å²	45.4	25%	0.251	29%	0.286	S	S	.	.			trans	-65.9	-179.6	177.8	76.9	49.2	0	0	0	114.4	H646 R647 D649 N682 N683	H646-N680 HydrophobicContact CB-CB 4.29Å; H646-N680 VanDerWaalsContact CB-CG 3.46Å; H646-N680 WeakPolarHBondContact CB-OD1 3.41Å; R647-N680 PolarHBondContact O-ND2 3.45Å; R647-N680 PolarHBondContact O-OD1 3.13Å; D649-N680 HydrophobicContact CB-CB 4.39Å; D649-N680 VanDerWaalsContact CB-ND2 3.26Å; D649-N680 WeakPolarHBondContact CB-ND2 3.38Å; D649-N680 PolarHBondContact OD2-N 2.67Å; N680-N682 PolarHBondContact O-N 2.86Å; N680-N682 PolarHBondContact OD1-N 2.79Å; N680-N683 WeakPolarHBondContact O-CB 3.42Å
681	A	87.4	Confident	86.2	Confident	49 Å²	49	44 Å²	44	41%	0.405	28%	0.281	S	S	.	.	S	Bend	trans	-76.8	-8.5	-170.5	0	0	0	0	0	116.3	P643 N683	P643-A681 HydrophobicContact CB-CB 3.76Å; P643-A681 HydrophobicContact CG-CB 4.04Å; A681-N683 PolarHBondContact O-N 3.22Å
682	N	92.8	Very high	85.3	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	29%	0.29	C	S	.	.			trans	-79.9	56.1	171.8	-160.3	-2	0	0	0	110.9	P643 C644 H646 F661 Y662 N680 F684	P643-N682 WeakPolarHBondContact O-CA 3.41Å; P643-N682 WeakPolarHBondContact O-CB 2.95Å; P643-N682 PolarHBondContact O-N 2.77Å; C644-N682 PolarHBondContact O-ND2 3.11Å; H646-N682 HydrophobicContact CB-CB 4.07Å; H646-N682 WeakPolarHBondContact O-CB 2.98Å; H646-N682 PolarHBondContact O-ND2 3.36Å; F661-N682 VanDerWaalsContact CA-OD1 3.29Å; F661-N682 WeakPolarHBondContact CA-OD1 3.05Å; F661-N682 HydrophobicContact CB-CB 4.46Å; F661-N682 WeakPolarHBondContact CB-O 3.41Å; Y662-N682 PolarHBondContact N-ND2 3.04Å; Y662-N682 PolarHBondContact N-OD1 2.71Å; Y662-N682 PolarHBondContact O-ND2 3.31Å; N680-N682 PolarHBondContact O-N 2.86Å; N680-N682 PolarHBondContact OD1-N 2.79Å; N682-F684 VanDerWaalsContact OD1-CE2 3.26Å; N682-F684 WeakPolarHBondContact OD1-CE2 3.38Å
683	N	94	Very high	84.6	Confident	24 Å²	24	50.6 Å²	50.6	13%	0.128	31%	0.311	C	S	.	.			trans	-145.7	70	-161.3	-171.8	-11.8	0	0	0	110.8	R659 F672 Y674 N680 A681	R659-N683 WeakPolarHBondContact CB-OD1 3.39Å; R659-N683 WeakPolarHBondContact CD-OD1 2.95Å; R659-N683 WeakPolarHBondContact CG-OD1 3.22Å; R659-N683 PolarHBondContact NH1-OD1 3.22Å; F672-N683 HydrophobicContact CZ-CB 4.06Å; Y674-N683 VanDerWaalsContact CD2-ND2 3.31Å; Y674-N683 WeakPolarHBondContact CD2-ND2 3Å; Y674-N683 WeakPolarHBondContact CE2-ND2 3.16Å; N680-N683 WeakPolarHBondContact O-CB 3.42Å; A681-N683 PolarHBondContact O-N 3.22Å
684	F	91.8	Very high	84.3	Confident	11 Å²	11	47.1 Å²	47.1	5%	0.048	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-91.2	150.4	-174.9	-50.1	-69	0	0	0	111.8	P643 R659 W660 N682 C690 K693 C694	P643-F684 HydrophobicContact CB-CZ 4.3Å; R659-F684 CarbonylContact C-O 3.52Å; R659-F684 WeakPolarHBondContact CA-O 3.5Å; R659-F684 WeakPolarHBondContact CB-O 3.32Å; R659-F684 VanDerWaalsContact CD-O 3.31Å; R659-F684 WeakPolarHBondContact CD-O 3.3Å; W660-F684 PolarHBondContact N-O 3.12Å; W660-F684 WeakPolarHBondContact O-CD2 3.18Å; W660-F684 PolarHBondContact O-N 3.37Å; N682-F684 VanDerWaalsContact OD1-CE2 3.26Å; N682-F684 WeakPolarHBondContact OD1-CE2 3.38Å; F684-C690 HydrophobicContact CB-CB 3.84Å; F684-C690 HydrophobicContact CD2-CB 3.4Å; F684-C690 WeakPolarHBondContact CD2-SG 3.29Å; F684-C690 HydrophobicContact CE2-CB 4.21Å; F684-C690 HydrophobicContact CG-CB 3.83Å; F684-K693 HydrophobicContact CD1-CD 3.88Å; F684-K693 HydrophobicContact CE1-CB 4.4Å; F684-K693 HydrophobicContact CE1-CD 3.4Å; F684-K693 HydrophobicContact CZ-CB 4.38Å; F684-K693 HydrophobicContact CZ-CD 4.16Å; F684-C694 VanDerWaalsContact CE2-SG 3.55Å; F684-C694 VanDerWaalsContact CZ-SG 3.58Å
685	E	85.3	Confident	83.4	Confident	159 Å²	159	46.1 Å²	46.1	74%	0.743	29%	0.287	S	S	*	.	S	Bend	trans	-76.1	-28.9	-178	-170.2	167.4	-148.1	0	0	113.3
686	S	83.2	Confident	81.9	Confident	49 Å²	49	48.6 Å²	48.6	34%	0.343	30%	0.302	S	S	.	.	S	Bend	trans	-136.2	154.5	-177.2	69.1	0	0	0	0	112.7	W660 S688 S689 C690	W660-S686 VanDerWaalsContact CD1-CA 3.41Å; S686-S688 VanDerWaalsContact C-N 3.26Å; S686-S688 PolarHBondContact O-N 3.21Å; S686-S689 PolarHBondContact O-N 2.95Å; S686-S689 VanDerWaalsContact O-N 3.14Å; S686-S689 VanDerWaalsContact OG-CB 3.26Å; S686-S689 WeakPolarHBondContact OG-CB 3.12Å; S686-S689 PolarHBondContact OG-N 2.93Å; S686-C690 PolarHBondContact O-N 2.91Å
687	F	84	Confident	79.9	Confident	78 Å²	78	52.1 Å²	52.1	34%	0.342	31%	0.309	S	S	.	.	H	α-helix	trans	-52.4	-47.3	172.3	178	-109.7	0	0	0	110.8	W660 M668 C669 S689 C690 M691	W660-F687 HydrophobicContact CD2-CB 3.83Å; W660-F687 HydrophobicContact CE3-CB 3.79Å; W660-F687 AromaticContact CE3-CD2 3.68Å; W660-F687 HydrophobicContact CE3-CD2 3.68Å; W660-F687 HydrophobicContact CE3-CG 4.21Å; W660-F687 HydrophobicContact CH2-CB 3.83Å; W660-F687 HydrophobicContact CH2-CD2 4.26Å; W660-F687 HydrophobicContact CH2-CG 4.34Å; W660-F687 HydrophobicContact CZ2-CB 3.88Å; W660-F687 HydrophobicContact CZ3-CB 3.79Å; W660-F687 AromaticContact CZ3-CD2 3.52Å; W660-F687 HydrophobicContact CZ3-CD2 3.52Å; W660-F687 HydrophobicContact CZ3-CE2 4.46Å; W660-F687 HydrophobicContact CZ3-CG 4.02Å; M668-F687 HydrophobicContact CG-CE2 4.18Å; C669-F687 HydrophobicContact CB-CD2 3.73Å; C669-F687 HydrophobicContact CB-CE2 3.89Å; C669-F687 WeakPolarHBondContact O-CD2 3.25Å; C669-F687 WeakPolarHBondContact O-CE2 3.23Å; F687-S689 PolarHBondContact O-N 2.89Å; F687-C690 WeakPolarHBondContact O-CB 3.27Å; F687-C690 PolarHBondContact O-N 3.48Å; F687-M691 HydrophobicContact CD1-CG 4.09Å; F687-M691 HydrophobicContact CD2-CG 3.92Å; F687-M691 HydrophobicContact CE1-CG 3.8Å; F687-M691 HydrophobicContact CE2-CE 4.37Å; F687-M691 HydrophobicContact CE2-CG 3.62Å; F687-M691 HydrophobicContact CE2-SD 3.82Å; F687-M691 HydrophobicContact CG-CG 4.16Å; F687-M691 HydrophobicContact CZ-CE 3.84Å; F687-M691 HydrophobicContact CZ-CG 3.57Å; F687-M691 HydrophobicContact CZ-SD 3.86Å; F687-M691 WeakPolarHBondContact O-CB 3.43Å; F687-M691 VanDerWaalsContact O-CG 3.26Å; F687-M691 WeakPolarHBondContact O-CG 3.44Å; F687-M691 PolarHBondContact O-N 3.17Å
688	S	73.7	Confident	78	Confident	79 Å²	79	51 Å²	51	55%	0.552	30%	0.299	S	S	*	.	H	α-helix	trans	-60.5	-44.2	177.1	-48.9	0	0	0	0	112.5	S686 C690 M691 V692	S686-S688 VanDerWaalsContact C-N 3.26Å; S686-S688 PolarHBondContact O-N 3.21Å; S688-C690 VanDerWaalsContact C-N 3.28Å; S688-C690 PolarHBondContact O-N 2.84Å; S688-M691 PolarHBondContact O-N 2.88Å; S688-V692 VanDerWaalsContact O-CB 3.27Å; S688-V692 WeakPolarHBondContact O-CB 3.39Å; S688-V692 WeakPolarHBondContact O-CG2 3.4Å; S688-V692 PolarHBondContact O-N 2.81Å
689	S	79.4	Confident	76.2	Confident	45 Å²	45	54.4 Å²	54.4	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-32.4	177.9	-178.3	0	0	0	0	112.8	S686 F687 K693	S686-S689 PolarHBondContact O-N 2.95Å; S686-S689 VanDerWaalsContact O-N 3.14Å; S686-S689 VanDerWaalsContact OG-CB 3.26Å; S686-S689 WeakPolarHBondContact OG-CB 3.12Å; S686-S689 PolarHBondContact OG-N 2.93Å; F687-S689 PolarHBondContact O-N 2.89Å; S689-K693 WeakPolarHBondContact O-CG 3.03Å
690	C	91.1	Very high	74.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-70.9	-51.8	171.8	-179.7	0	0	0	0	111.4	W660 F661 Y662 C669 F684 S686 F687 S688 V692 K693 C694	W660-C690 HydrophobicContact CB-CB 4.01Å; F661-C690 VanDerWaalsContact C-SG 3.51Å; Y662-C690 PolarHBondContact N-SG 2.79Å; Y662-C690 VanDerWaalsContact N-SG 3.38Å; C669-C690 HydrophobicContact CB-CB 3.57Å; C669-C690 WeakPolarHBondContact CB-SG 3.33Å; C669-C690 WeakPolarHBondContact SG-CB 3.2Å; C669-C690 CovalentContact SG-SG 2.02Å; C669-C690 PolarHBondContact SG-SG 3.15Å; F684-C690 HydrophobicContact CB-CB 3.84Å; F684-C690 HydrophobicContact CD2-CB 3.4Å; F684-C690 WeakPolarHBondContact CD2-SG 3.29Å; F684-C690 HydrophobicContact CE2-CB 4.21Å; F684-C690 HydrophobicContact CG-CB 3.83Å; S686-C690 PolarHBondContact O-N 2.91Å; F687-C690 WeakPolarHBondContact O-CB 3.27Å; F687-C690 PolarHBondContact O-N 3.48Å; S688-C690 VanDerWaalsContact C-N 3.28Å; S688-C690 PolarHBondContact O-N 2.84Å; C690-V692 PolarHBondContact O-N 2.86Å; C690-K693 PolarHBondContact O-N 3.03Å; C690-C694 WeakPolarHBondContact O-CB 3.13Å; C690-C694 PolarHBondContact O-N 3.21Å
691	M	80.3	Confident	72.8	Confident	41 Å²	41	57 Å²	57	20%	0.202	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-38.6	-175.5	-67.8	-70.8	-79.1	0	0	112	M668 C669 F687 S688 K693 C694 G695 P696 I698	M668-M691 HydrophobicContact CG-CE 4.37Å; M668-M691 HydrophobicContact CG-SD 4.15Å; C669-M691 HydrophobicContact CB-CG 3.82Å; C669-M691 HydrophobicContact CB-SD 3.66Å; C669-M691 PolarHBondContact SG-N 2.82Å; F687-M691 HydrophobicContact CD1-CG 4.09Å; F687-M691 HydrophobicContact CD2-CG 3.92Å; F687-M691 HydrophobicContact CE1-CG 3.8Å; F687-M691 HydrophobicContact CE2-CE 4.37Å; F687-M691 HydrophobicContact CE2-CG 3.62Å; F687-M691 HydrophobicContact CE2-SD 3.82Å; F687-M691 HydrophobicContact CG-CG 4.16Å; F687-M691 HydrophobicContact CZ-CE 3.84Å; F687-M691 HydrophobicContact CZ-CG 3.57Å; F687-M691 HydrophobicContact CZ-SD 3.86Å; F687-M691 WeakPolarHBondContact O-CB 3.43Å; F687-M691 VanDerWaalsContact O-CG 3.26Å; F687-M691 WeakPolarHBondContact O-CG 3.44Å; F687-M691 PolarHBondContact O-N 3.17Å; S688-M691 PolarHBondContact O-N 2.88Å; M691-K693 PolarHBondContact O-N 3.32Å; M691-C694 PolarHBondContact O-N 3.28Å; M691-G695 WeakPolarHBondContact O-CA 3.3Å; M691-G695 PolarHBondContact O-N 3.33Å; M691-P696 VanDerWaalsContact CE-CD 3.43Å; M691-P696 HydrophobicContact CE-CG 4.17Å; M691-I698 VanDerWaalsContact O-CD1 3.23Å; M691-I698 WeakPolarHBondContact O-CD1 3.26Å
692	V	71.8	Confident	72	Confident	97 Å²	97	58.6 Å²	58.6	59%	0.588	32%	0.318	S	S	*	.	H	α-helix	trans	-64	-27.6	174.4	168.5	0	0	0	0	112.3	S688 C690	S688-V692 VanDerWaalsContact O-CB 3.27Å; S688-V692 WeakPolarHBondContact O-CB 3.39Å; S688-V692 WeakPolarHBondContact O-CG2 3.4Å; S688-V692 PolarHBondContact O-N 2.81Å; C690-V692 PolarHBondContact O-N 2.86Å
693	K	75.4	Confident	71.5	Confident	117 Å²	117	59.1 Å²	59.1	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-88.6	-33.3	175.7	-73.7	-179.3	172.3	-174.7	0	113.2	C644 F684 S689 C690 M691	C644-K693 PolarHBondContact SG-O 3.26Å; C644-K693 VanDerWaalsContact SG-O 3.34Å; F684-K693 HydrophobicContact CD1-CD 3.88Å; F684-K693 HydrophobicContact CE1-CB 4.4Å; F684-K693 HydrophobicContact CE1-CD 3.4Å; F684-K693 HydrophobicContact CZ-CB 4.38Å; F684-K693 HydrophobicContact CZ-CD 4.16Å; S689-K693 WeakPolarHBondContact O-CG 3.03Å; C690-K693 PolarHBondContact O-N 3.03Å; M691-K693 PolarHBondContact O-N 3.32Å
694	C	85.1	Confident	70.9	Confident	6 Å²	6	63.3 Å²	63.3	4%	0.041	34%	0.343	C	S	.	.	H	α-helix	trans	-136.5	-15.3	-159.4	-50.4	0	0	0	0	117	C644 Y662 F684 C690 M691	C644-C694 VanDerWaalsContact CA-SG 3.58Å; C644-C694 HydrophobicContact CB-CB 3.62Å; C644-C694 WeakPolarHBondContact CB-SG 2.94Å; C644-C694 WeakPolarHBondContact SG-CA 3.48Å; C644-C694 WeakPolarHBondContact SG-CB 3.19Å; C644-C694 CovalentContact SG-SG 2.03Å; C644-C694 PolarHBondContact SG-SG 2.83Å; Y662-C694 VanDerWaalsContact CB-CB 3.48Å; Y662-C694 HydrophobicContact CD1-CB 3.93Å; Y662-C694 HydrophobicContact CD2-CB 3.57Å; Y662-C694 WeakPolarHBondContact CD2-O 3.38Å; Y662-C694 WeakPolarHBondContact CE1-O 3.04Å; Y662-C694 HydrophobicContact CE2-CB 4.24Å; Y662-C694 WeakPolarHBondContact CE2-O 3.38Å; Y662-C694 HydrophobicContact CG-CB 3.38Å; Y662-C694 PolarHBondContact OH-O 3.01Å; F684-C694 VanDerWaalsContact CE2-SG 3.55Å; F684-C694 VanDerWaalsContact CZ-SG 3.58Å; C690-C694 WeakPolarHBondContact O-CB 3.13Å; C690-C694 PolarHBondContact O-N 3.21Å; M691-C694 PolarHBondContact O-N 3.28Å
695	G	72.5	Confident	70.3	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.021	35%	0.352	C	S	.	.			trans	-58.4	171.4	-163.9	0	0	0	0	0	117.3	M691 E697 I698	M691-G695 WeakPolarHBondContact O-CA 3.3Å; M691-G695 PolarHBondContact O-N 3.33Å; G695-E697 PolarHBondContact O-N 3.17Å; G695-I698 VanDerWaalsContact N-CG2 3.33Å; G695-I698 VanDerWaalsContact O-CA 3.31Å; G695-I698 WeakPolarHBondContact O-CA 3.03Å; G695-I698 VanDerWaalsContact O-CB 3.23Å; G695-I698 WeakPolarHBondContact O-CB 3.3Å; G695-I698 WeakPolarHBondContact O-CG2 3.42Å; G695-I698 PolarHBondContact O-N 2.67Å
696	P	55.1	Low	69.9	Low	56 Å²	56	62.4 Å²	62.4	36%	0.364	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-64	-47.2	-171.3	22	-24.3	0	0	0	111.2	N667 M691 I698	N667-P696 HydrophobicContact CB-CB 3.86Å; N667-P696 WeakPolarHBondContact O-CB 3.39Å; N667-P696 WeakPolarHBondContact O-CD 3.41Å; N667-P696 WeakPolarHBondContact O-CG 3.38Å; M691-P696 VanDerWaalsContact CE-CD 3.43Å; M691-P696 HydrophobicContact CE-CG 4.17Å; P696-I698 PolarHBondContact O-N 3.04Å
697	E	38.8	Very low	69.7	Low	108 Å²	108	62.9 Å²	62.9	51%	0.505	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-65.4	7.2	173.5	-70.7	-65.3	119.7	0	0	113.9	G695 S701 R702 H705	G695-E697 PolarHBondContact O-N 3.17Å; E697-S701 WeakPolarHBondContact CA-OG 3.49Å; E697-S701 WeakPolarHBondContact CB-OG 3.09Å; E697-S701 PolarHBondContact O-OG 2.91Å; E697-S701 WeakPolarHBondContact OE2-CB 3.48Å; E697-S701 PolarHBondContact OE2-OG 2.84Å; E697-R702 PolarHBondContact O-N 3.21Å; E697-H705 PolarHBondContact O-NE2 2.61Å; E697-H705 IonicContact OE2-CE1 3.4Å; E697-H705 IonicContact OE2-NE2 2.7Å; E697-H705 PolarHBondContact OE2-NE2 3.28Å
698	I	46.2	Very low	69.4	Low	22 Å²	22	62.2 Å²	62.2	11%	0.113	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-126.4	22.2	-168.1	-101.6	166.5	0	0	0	112.3	M691 G695 P696 R702	M691-I698 VanDerWaalsContact O-CD1 3.23Å; M691-I698 WeakPolarHBondContact O-CD1 3.26Å; G695-I698 VanDerWaalsContact N-CG2 3.33Å; G695-I698 VanDerWaalsContact O-CA 3.31Å; G695-I698 WeakPolarHBondContact O-CA 3.03Å; G695-I698 VanDerWaalsContact O-CB 3.23Å; G695-I698 WeakPolarHBondContact O-CB 3.3Å; G695-I698 WeakPolarHBondContact O-CG2 3.42Å; G695-I698 PolarHBondContact O-N 2.67Å; P696-I698 PolarHBondContact O-N 3.04Å; I698-R702 HydrophobicContact CB-CG 4.4Å; I698-R702 HydrophobicContact CG1-CG 4.01Å; I698-R702 VanDerWaalsContact O-CZ 3.28Å; I698-R702 PolarHBondContact O-NE 3.05Å; I698-R702 PolarHBondContact O-NH2 2.78Å
699	L	44.1	Very low	69.8	Low	126 Å²	126	64.7 Å²	64.7	66%	0.66	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	-32.3	160.7	-101.2	162.8	0	0	0	115.3	F645	F645-L699 HydrophobicContact CZ-CD1 4.47Å
700	S	46.4	Very low	69.8	Low	111 Å²	111	63.2 Å²	63.2	78%	0.776	34%	0.338	S	S	*	.	S	Bend	trans	-115.5	-26.7	179.9	-162.2	0	0	0	0	114.6
701	S	50.8	Low	68.8	Low	16 Å²	16	70.6 Å²	70.6	11%	0.112	38%	0.378	C	S	.	.	S	Bend	trans	-105.3	4.7	178.5	68.2	0	0	0	0	115	E697 C703 L704 H705	E697-S701 WeakPolarHBondContact CA-OG 3.49Å; E697-S701 WeakPolarHBondContact CB-OG 3.09Å; E697-S701 PolarHBondContact O-OG 2.91Å; E697-S701 WeakPolarHBondContact OE2-CB 3.48Å; E697-S701 PolarHBondContact OE2-OG 2.84Å; S701-C703 PolarHBondContact O-N 2.83Å; S701-L704 PolarHBondContact O-N 2.88Å; S701-H705 PolarHBondContact O-CD2 3.42Å; S701-H705 PolarHBondContact O-N 3.2Å; S701-H705 PolarHBondContact OG-NE2 3.19Å
702	R	70	Confident	68.6	Low	82 Å²	82	70.9 Å²	70.9	31%	0.309	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-44.8	-41.9	174.4	-77.3	-156.9	-160.8	-158.9	4.9	111.9	E697 I698 L704 G740 N741 F743	E697-R702 PolarHBondContact O-N 3.21Å; I698-R702 HydrophobicContact CB-CG 4.4Å; I698-R702 HydrophobicContact CG1-CG 4.01Å; I698-R702 VanDerWaalsContact O-CZ 3.28Å; I698-R702 PolarHBondContact O-NE 3.05Å; I698-R702 PolarHBondContact O-NH2 2.78Å; R702-L704 VanDerWaalsContact C-N 3.27Å; R702-L704 PolarHBondContact O-N 3.27Å; R702-G740 WeakPolarHBondContact CD-O 3.36Å; R702-N741 VanDerWaalsContact O-CA 3.23Å; R702-N741 WeakPolarHBondContact O-CA 3.27Å; R702-N741 WeakPolarHBondContact O-CB 3.5Å; R702-N741 PolarHBondContact O-N 3.04Å; R702-F743 HydrophobicContact CB-CZ 4.39Å
703	C	83.4	Confident	68.5	Low	13 Å²	13	70.2 Å²	70.2	9%	0.088	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-67.1	-18.2	-178.8	-48	0	0	0	0	114.9	S701 Y721 N741 C753	S701-C703 PolarHBondContact O-N 2.83Å; C703-Y721 HydrophobicContact CB-CD1 3.74Å; C703-Y721 HydrophobicContact CB-CG 4.02Å; C703-Y721 WeakPolarHBondContact O-CD1 3.02Å; C703-N741 PolarHBondContact O-ND2 3.32Å; C703-N741 VanDerWaalsContact O-ND2 3.08Å; C703-C753 HydrophobicContact CB-CB 3.59Å; C703-C753 WeakPolarHBondContact CB-SG 3.45Å; C703-C753 WeakPolarHBondContact SG-CA 3.42Å; C703-C753 WeakPolarHBondContact SG-CB 3.22Å; C703-C753 CovalentContact SG-SG 2.02Å; C703-C753 PolarHBondContact SG-SG 2.83Å
704	L	80	Confident	68.1	Low	111 Å²	111	65.8 Å²	65.8	58%	0.581	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-107.3	-5.5	-175.6	-57.2	180	0	0	0	113	S701 R702	S701-L704 PolarHBondContact O-N 2.88Å; R702-L704 VanDerWaalsContact C-N 3.27Å; R702-L704 PolarHBondContact O-N 3.27Å
705	H	80.1	Confident	67.8	Low	49 Å²	49	71.4 Å²	71.4	23%	0.227	40%	0.396	C	S	.	.	S	Bend	trans	-71.6	144.1	172.8	-68.9	-83.9	0	0	0	110.7	E697 S701 T739 N741	E697-H705 PolarHBondContact O-NE2 2.61Å; E697-H705 IonicContact OE2-CE1 3.4Å; E697-H705 IonicContact OE2-NE2 2.7Å; E697-H705 PolarHBondContact OE2-NE2 3.28Å; S701-H705 PolarHBondContact O-CD2 3.42Å; S701-H705 PolarHBondContact O-N 3.2Å; S701-H705 PolarHBondContact OG-NE2 3.19Å; H705-T739 HydrophobicContact CB-CG2 4.01Å; H705-N741 HydrophobicContact CB-CB 4.34Å; H705-N741 WeakPolarHBondContact O-CB 3.42Å; H705-N741 PolarHBondContact O-ND2 2.82Å
706	P	76.6	Confident	68.1	Low	102 Å²	102	76.5 Å²	76.5	66%	0.662	42%	0.418	S	S	*	.			trans	-55.6	147	172.6	-25.8	34.7	0	0	0	112.7	D708 T739	P706-D708 PolarHBondContact O-N 3.01Å; P706-D708 VanDerWaalsContact O-N 3.16Å; P706-T739 WeakPolarHBondContact O-CG2 3.31Å; P706-T739 PolarHBondContact O-OG1 3.41Å
707	T	80	Confident	69.4	Low	60 Å²	60	77 Å²	77	37%	0.368	42%	0.42	S	S	.	.			trans	-65.8	108	175.8	-45.9	0	0	0	0	110.5	H720 F731	T707-H720 HydrophobicContact CG2-CB 4.2Å; T707-H720 VanDerWaalsContact CG2-CD2 3.43Å; T707-H720 WeakPolarHBondContact CG2-CD2 3.3Å; T707-H720 PolarHBondContact OG1-CD2 3.36Å; T707-H720 VanDerWaalsContact OG1-CD2 3.23Å; T707-H720 PolarHBondContact OG1-CE1 3.33Å; T707-H720 PolarHBondContact OG1-ND1 3.17Å; T707-H720 VanDerWaalsContact OG1-ND1 3.11Å; T707-H720 PolarHBondContact OG1-NE2 2.9Å; T707-H720 VanDerWaalsContact OG1-NE2 3.16Å; T707-F731 HydrophobicContact CG2-CB 3.54Å; T707-F731 HydrophobicContact CG2-CD1 3.73Å; T707-F731 HydrophobicContact CG2-CD2 3.47Å; T707-F731 VanDerWaalsContact CG2-CD2 3.47Å; T707-F731 HydrophobicContact CG2-CE1 4.22Å; T707-F731 HydrophobicContact CG2-CE2 4Å; T707-F731 HydrophobicContact CG2-CG 3.3Å; T707-F731 HydrophobicContact CG2-CZ 4.34Å
708	D	76.2	Confident	71.7	Confident	64 Å²	64	74.8 Å²	74.8	34%	0.342	41%	0.407	S	S	.	.			trans	-111.1	122.1	179.3	176.1	33	0	0	0	111.8	P706 G710 F731 G738 T739	P706-D708 PolarHBondContact O-N 3.01Å; P706-D708 VanDerWaalsContact O-N 3.16Å; D708-G710 VanDerWaalsContact C-N 3.28Å; D708-G710 VanDerWaalsContact CG-N 3.29Å; D708-G710 PolarHBondContact OD1-N 3.09Å; D708-F731 WeakPolarHBondContact O-CE2 3.28Å; D708-G738 WeakPolarHBondContact OD2-CA 3.46Å; D708-G738 PolarHBondContact OD2-N 3.39Å; D708-T739 HydrophobicContact CB-CG2 3.85Å
709	R	81.9	Confident	73.8	Confident	130 Å²	130	75.2 Å²	75.2	49%	0.491	41%	0.408	S	S	.	.			trans	-67.1	-29.2	172.1	178.4	162.3	-173.8	178.9	3.6	112	V732 Y733 G734	R709-V732 VanDerWaalsContact CG-O 3.27Å; R709-V732 WeakPolarHBondContact CG-O 3.29Å; R709-Y733 VanDerWaalsContact O-CD2 3.3Å; R709-Y733 WeakPolarHBondContact O-CD2 3.41Å; R709-G734 WeakPolarHBondContact O-CA 3.4Å; R709-G734 PolarHBondContact O-N 3.4Å
710	G	79.3	Confident	76	Confident	14 Å²	14	70.3 Å²	70.3	14%	0.144	38%	0.381	C	S	.	.			trans	74	167.9	-175.8	0	0	0	0	0	113.8	D708 C712 C736	D708-G710 VanDerWaalsContact C-N 3.28Å; D708-G710 VanDerWaalsContact CG-N 3.29Å; D708-G710 PolarHBondContact OD1-N 3.09Å; G710-C712 PolarHBondContact O-N 2.76Å; G710-C712 VanDerWaalsContact O-N 3.12Å; G710-C736 CarbonylContact C-O 3.33Å; G710-C736 WeakPolarHBondContact CA-O 3.19Å
711	D	70.6	Confident	78.1	Confident	155 Å²	155	66.1 Å²	66.1	83%	0.829	35%	0.349	S	S	*	.	S	Bend	trans	-67.3	-13.7	-168.3	-54.6	-60.7	0	0	0	115.1	C736	D711-C736 PolarHBondContact N-O 3.21Å
712	C	77.2	Confident	79.8	Confident	48 Å²	48	66.8 Å²	66.8	32%	0.324	35%	0.351	S	S	.	.	S	Bend	trans	-88.7	151.2	-177	-78.7	0	0	0	0	113.5	G710 G714 G734 C736	G710-C712 PolarHBondContact O-N 2.76Å; G710-C712 VanDerWaalsContact O-N 3.12Å; C712-G714 PolarHBondContact O-N 3.21Å; C712-G734 WeakPolarHBondContact CB-O 3.37Å; C712-G734 WeakPolarHBondContact O-CA 3.35Å; C712-C736 HydrophobicContact CB-CB 3.96Å; C712-C736 WeakPolarHBondContact CB-SG 3.21Å; C712-C736 WeakPolarHBondContact SG-CB 3.33Å; C712-C736 CovalentContact SG-SG 2.03Å; C712-C736 PolarHBondContact SG-SG 3.47Å
713	S	69.6	Low	80.1	Confident	83 Å²	83	64.9 Å²	64.9	58%	0.58	35%	0.351	S	S	*	.			trans	-91.7	12.1	-176.9	-45.8	0	0	0	0	115.3	P366	P366-S713 WeakPolarHBondContact CG-OG 3.47Å
714	G	65.6	Low	79.6	Confident	24 Å²	24	71.4 Å²	71.4	25%	0.247	38%	0.384	C	S	.	.			trans	-64.3	169.3	176.2	0	0	0	0	0	113.3	C712 G734	C712-G714 PolarHBondContact O-N 3.21Å; G714-G734 WeakPolarHBondContact CA-O 3.36Å; G714-G734 PolarHBondContact N-O 3.4Å
715	H	80.3	Confident	79.7	Confident	123 Å²	123	68.4 Å²	68.4	57%	0.569	37%	0.373	S	S	*	.			trans	-128.5	61.6	-179.8	-166.2	-66.6	0	0	0	110.9	V732	H715-V732 HydrophobicContact CB-CG1 4.19Å
716	F	79	Confident	79.7	Confident	109 Å²	109	71.8 Å²	71.8	48%	0.478	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.2	172.9	-58.6	-84.8	0	0	0	108.2	R718 Y733	F716-R718 HydrophobicContact CB-CG 4.5Å; F716-R718 PolarHBondContact O-N 3.19Å; F716-Y733 HydrophobicContact CB-CD1 4.36Å; F716-Y733 PolarHBondContact N-O 3.33Å; F716-Y733 PolarHBondContact O-N 2.85Å
717	V	82.1	Confident	79.9	Confident	68 Å²	68	69.9 Å²	69.9	41%	0.412	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	131.3	167.8	-177.4	0	0	0	0	107.9	E730	V717-E730 HydrophobicContact CG1-CB 4.02Å
718	R	87.3	Confident	80.3	Confident	60 Å²	60	67.2 Å²	67.2	23%	0.226	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	165.8	179.8	-66	-62.9	176.2	84.9	-2.6	108.7	F716 E730 F731 Y733 N742 F743	F716-R718 HydrophobicContact CB-CG 4.5Å; F716-R718 PolarHBondContact O-N 3.19Å; R718-E730 CarbonylContact O-C 3.51Å; R718-E730 VanDerWaalsContact O-CA 3.23Å; R718-E730 WeakPolarHBondContact O-CA 3.41Å; R718-F731 HydrophobicContact CB-CD1 4Å; R718-F731 HydrophobicContact CB-CE1 3.54Å; R718-F731 HydrophobicContact CB-CE2 4.4Å; R718-F731 HydrophobicContact CB-CZ 3.78Å; R718-F731 PolarHBondContact N-O 2.95Å; R718-F731 WeakPolarHBondContact O-CD1 3.36Å; R718-F731 PolarHBondContact O-N 3.3Å; R718-Y733 VanDerWaalsContact CG-CB 3.46Å; R718-Y733 HydrophobicContact CG-CD1 4.19Å; R718-Y733 HydrophobicContact CG-CG 4.18Å; R718-Y733 VanDerWaalsContact NH1-CD1 3.33Å; R718-N742 WeakPolarHBondContact CD-OD1 3.15Å; R718-N742 VanDerWaalsContact CG-OD1 3.26Å; R718-N742 WeakPolarHBondContact CG-OD1 3.25Å; R718-N742 PolarHBondContact NH1-OD1 2.81Å; R718-F743 CarbonylContact C-O 3.49Å; R718-F743 VanDerWaalsContact CA-O 3.29Å; R718-F743 WeakPolarHBondContact CA-O 3.22Å; R718-F743 WeakPolarHBondContact CB-O 3.19Å; R718-F743 VanDerWaalsContact CD-O 3.23Å; R718-F743 WeakPolarHBondContact CD-O 3.23Å
719	F	90	Very high	80.7	Confident	32 Å²	32	68.7 Å²	68.7	14%	0.14	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.1	177	-65.3	-94.2	0	0	0	110	K729 E730 F743 K746 C749	F719-K729 CarbonylContact C-O 3.56Å; F719-K729 VanDerWaalsContact CA-O 3.25Å; F719-K729 WeakPolarHBondContact CA-O 3.4Å; F719-E730 HydrophobicContact CD1-CB 3.96Å; F719-E730 HydrophobicContact CE1-CB 3.64Å; F719-E730 HydrophobicContact CZ-CB 4.08Å; F719-F743 HydrophobicContact CB-CB 4.45Å; F719-F743 PolarHBondContact N-O 3.28Å; F719-F743 WeakPolarHBondContact O-CD2 3.28Å; F719-F743 PolarHBondContact O-N 2.95Å; F719-K746 HydrophobicContact CD1-CB 3.6Å; F719-K746 HydrophobicContact CD1-CD 4.37Å; F719-K746 HydrophobicContact CD1-CG 3.81Å; F719-K746 HydrophobicContact CD2-CB 4.27Å; F719-K746 HydrophobicContact CE1-CB 3.6Å; F719-K746 HydrophobicContact CE1-CD 4.14Å; F719-K746 HydrophobicContact CE1-CG 3.98Å; F719-K746 HydrophobicContact CE2-CB 4.27Å; F719-K746 HydrophobicContact CG-CB 3.95Å; F719-K746 HydrophobicContact CG-CG 4.48Å; F719-K746 HydrophobicContact CZ-CB 3.96Å; F719-C749 HydrophobicContact CB-CB 3.94Å
720	H	89.9	Confident	80.8	Confident	22 Å²	22	68.9 Å²	68.9	10%	0.102	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.7	169.5	80.8	88.8	0	0	0	108	T707 C728 K729 F731 N741 C749	T707-H720 HydrophobicContact CG2-CB 4.2Å; T707-H720 VanDerWaalsContact CG2-CD2 3.43Å; T707-H720 WeakPolarHBondContact CG2-CD2 3.3Å; T707-H720 PolarHBondContact OG1-CD2 3.36Å; T707-H720 VanDerWaalsContact OG1-CD2 3.23Å; T707-H720 PolarHBondContact OG1-CE1 3.33Å; T707-H720 PolarHBondContact OG1-ND1 3.17Å; T707-H720 VanDerWaalsContact OG1-ND1 3.11Å; T707-H720 PolarHBondContact OG1-NE2 2.9Å; T707-H720 VanDerWaalsContact OG1-NE2 3.16Å; H720-C728 CarbonylContact O-C 3.47Å; H720-C728 VanDerWaalsContact O-CA 3.22Å; H720-C728 WeakPolarHBondContact O-CA 3.42Å; H720-K729 PolarHBondContact N-O 3.27Å; H720-K729 PolarHBondContact O-N 3.35Å; H720-F731 HydrophobicContact CB-CD1 3.86Å; H720-F731 HydrophobicContact CB-CE1 3.82Å; H720-F731 AromaticContact CD2-CD1 3.86Å; H720-N741 WeakPolarHBondContact CA-O 3.42Å; H720-N741 WeakPolarHBondContact CA-OD1 3.18Å; H720-N741 HydrophobicContact CB-CB 4.14Å; H720-N741 WeakPolarHBondContact CB-O 3.36Å; H720-C749 VanDerWaalsContact C-SG 3.54Å
721	Y	90.4	Very high	81.2	Confident	24 Å²	24	69.3 Å²	69.3	9%	0.094	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	134.4	167.6	-173.9	-102.8	0	0	0	108.5	C703 K726 N741 C749 C753 A754	C703-Y721 HydrophobicContact CB-CD1 3.74Å; C703-Y721 HydrophobicContact CB-CG 4.02Å; C703-Y721 WeakPolarHBondContact O-CD1 3.02Å; Y721-K726 VanDerWaalsContact CE2-C 3.48Å; Y721-K726 VanDerWaalsContact CE2-O 3.3Å; Y721-K726 WeakPolarHBondContact CE2-O 3.35Å; Y721-K726 VanDerWaalsContact OH-CD 3.3Å; Y721-K726 WeakPolarHBondContact OH-CD 3.22Å; Y721-N741 PolarHBondContact N-OD1 3.25Å; Y721-N741 PolarHBondContact O-ND2 3.33Å; Y721-C749 PolarHBondContact N-SG 3.48Å; Y721-C753 HydrophobicContact CD1-CB 4.1Å; Y721-C753 HydrophobicContact CD2-CB 3.29Å; Y721-C753 HydrophobicContact CE2-CB 3.83Å; Y721-C753 HydrophobicContact CG-CB 3.43Å; Y721-C753 VanDerWaalsContact CG-CB 3.43Å; Y721-A754 HydrophobicContact CE2-CB 4.23Å
722	D	85.7	Confident	81.7	Confident	30 Å²	30	64 Å²	64	16%	0.16	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.7	165.9	-172.5	-14.9	0	0	0	108.5	D724 K726 T727 K729	D722-D724 VanDerWaalsContact C-N 3.29Å; D722-D724 PolarHBondContact OD1-N 3.33Å; D722-K726 CarbonylContact O-C 3.56Å; D722-K726 VanDerWaalsContact O-CA 3.24Å; D722-K726 WeakPolarHBondContact O-CA 3.43Å; D722-K726 PolarHBondContact O-N 3.46Å; D722-T727 PolarHBondContact N-O 3.39Å; D722-T727 PolarHBondContact O-N 3.39Å; D722-K729 HydrophobicContact CB-CD 4.01Å; D722-K729 HydrophobicContact CB-CG 4.4Å; D722-K729 VanDerWaalsContact OD2-CE 3.3Å; D722-K729 WeakPolarHBondContact OD2-CE 3.3Å; D722-K729 IonicContact OD2-NZ 3.78Å; D722-K729 PolarHBondContact OD2-NZ 3.35Å
723	S	77.9	Confident	81.8	Confident	42 Å²	42	62.9 Å²	62.9	29%	0.294	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-30	177.8	178.5	0	0	0	0	112.3	K726	S723-K726 VanDerWaalsContact O-CD 3.29Å; S723-K726 WeakPolarHBondContact O-CD 3.48Å; S723-K726 WeakPolarHBondContact O-CE 3.3Å; S723-K726 PolarHBondContact O-NZ 3.46Å
724	D	73	Confident	82.4	Confident	149 Å²	149	59.1 Å²	59.1	80%	0.797	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-43.4	-172.3	-61.9	-19.3	0	0	0	110.5	D722	D722-D724 VanDerWaalsContact C-N 3.29Å; D722-D724 PolarHBondContact OD1-N 3.33Å
725	S	80.9	Confident	82.9	Confident	48 Å²	48	59.7 Å²	59.7	34%	0.336	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	7.3	174.5	71.9	0	0	0	0	114.3	T727 K729	S725-T727 WeakPolarHBondContact CB-OG1 3.32Å; S725-T727 WeakPolarHBondContact O-CB 3.16Å; S725-T727 WeakPolarHBondContact O-CG2 3.43Å; S725-T727 PolarHBondContact O-N 2.85Å; S725-T727 PolarHBondContact O-OG1 3Å; S725-T727 PolarHBondContact OG-OG1 3.45Å; S725-K729 VanDerWaalsContact OG-CE 3.23Å; S725-K729 WeakPolarHBondContact OG-CE 3.38Å
726	K	80.1	Confident	82.9	Confident	120 Å²	120	56.1 Å²	56.1	52%	0.522	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	25.2	-178.1	-58.8	-63.2	176.5	-150	0	115.3	Y721 D722 S723	Y721-K726 VanDerWaalsContact CE2-C 3.48Å; Y721-K726 VanDerWaalsContact CE2-O 3.3Å; Y721-K726 WeakPolarHBondContact CE2-O 3.35Å; Y721-K726 VanDerWaalsContact OH-CD 3.3Å; Y721-K726 WeakPolarHBondContact OH-CD 3.22Å; D722-K726 CarbonylContact O-C 3.56Å; D722-K726 VanDerWaalsContact O-CA 3.24Å; D722-K726 WeakPolarHBondContact O-CA 3.43Å; D722-K726 PolarHBondContact O-N 3.46Å; S723-K726 VanDerWaalsContact O-CD 3.29Å; S723-K726 WeakPolarHBondContact O-CD 3.48Å; S723-K726 WeakPolarHBondContact O-CE 3.3Å; S723-K726 PolarHBondContact O-NZ 3.46Å
727	T	80.7	Confident	82.8	Confident	63 Å²	63	53 Å²	53	39%	0.387	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.8	-165.4	37.6	0	0	0	0	112.5	D722 S725 K729	D722-T727 PolarHBondContact N-O 3.39Å; D722-T727 PolarHBondContact O-N 3.39Å; S725-T727 WeakPolarHBondContact CB-OG1 3.32Å; S725-T727 WeakPolarHBondContact O-CB 3.16Å; S725-T727 WeakPolarHBondContact O-CG2 3.43Å; S725-T727 PolarHBondContact O-N 2.85Å; S725-T727 PolarHBondContact O-OG1 3Å; S725-T727 PolarHBondContact OG-OG1 3.45Å; T727-K729 PolarHBondContact O-N 2.79Å
728	C	89.4	Confident	82.3	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.027	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	102	176.9	-69.3	0	0	0	0	111.5	H720 K746 C749 L750	H720-C728 CarbonylContact O-C 3.47Å; H720-C728 VanDerWaalsContact O-CA 3.22Å; H720-C728 WeakPolarHBondContact O-CA 3.42Å; C728-K746 HydrophobicContact CB-CG 3.87Å; C728-K746 VanDerWaalsContact O-CE 3.28Å; C728-K746 WeakPolarHBondContact O-CE 3.43Å; C728-C749 HydrophobicContact CB-CB 3.62Å; C728-C749 WeakPolarHBondContact CB-SG 3.37Å; C728-C749 WeakPolarHBondContact SG-CB 3.34Å; C728-C749 CovalentContact SG-SG 2.02Å; C728-C749 PolarHBondContact SG-SG 2.86Å; C728-L750 HydrophobicContact CB-CD2 4.02Å; C728-L750 HydrophobicContact CB-CG 4.02Å; C728-L750 PolarHBondContact SG-N 2.79Å
729	K	84.1	Confident	82	Confident	94 Å²	94	49.9 Å²	49.9	41%	0.409	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	150	173.9	-70.3	180	176.1	170.2	0	110	F719 H720 D722 S725 T727	F719-K729 CarbonylContact C-O 3.56Å; F719-K729 VanDerWaalsContact CA-O 3.25Å; F719-K729 WeakPolarHBondContact CA-O 3.4Å; H720-K729 PolarHBondContact N-O 3.27Å; H720-K729 PolarHBondContact O-N 3.35Å; D722-K729 HydrophobicContact CB-CD 4.01Å; D722-K729 HydrophobicContact CB-CG 4.4Å; D722-K729 VanDerWaalsContact OD2-CE 3.3Å; D722-K729 WeakPolarHBondContact OD2-CE 3.3Å; D722-K729 IonicContact OD2-NZ 3.78Å; D722-K729 PolarHBondContact OD2-NZ 3.35Å; S725-K729 VanDerWaalsContact OG-CE 3.23Å; S725-K729 WeakPolarHBondContact OG-CE 3.38Å; T727-K729 PolarHBondContact O-N 2.79Å
730	E	83.4	Confident	81.6	Confident	134 Å²	134	48.9 Å²	48.9	63%	0.626	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	149.9	172.3	62.7	177	-134.4	0	0	112.1	V717 R718 F719	V717-E730 HydrophobicContact CG1-CB 4.02Å; R718-E730 CarbonylContact O-C 3.51Å; R718-E730 VanDerWaalsContact O-CA 3.23Å; R718-E730 WeakPolarHBondContact O-CA 3.41Å; F719-E730 HydrophobicContact CD1-CB 3.96Å; F719-E730 HydrophobicContact CE1-CB 3.64Å; F719-E730 HydrophobicContact CZ-CB 4.08Å
731	F	87.2	Confident	81.6	Confident	24 Å²	24	48 Å²	48	11%	0.105	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	164.9	173.3	77.1	-79.4	0	0	0	111.2	T707 D708 R718 H720 N741 N742	T707-F731 HydrophobicContact CG2-CB 3.54Å; T707-F731 HydrophobicContact CG2-CD1 3.73Å; T707-F731 HydrophobicContact CG2-CD2 3.47Å; T707-F731 VanDerWaalsContact CG2-CD2 3.47Å; T707-F731 HydrophobicContact CG2-CE1 4.22Å; T707-F731 HydrophobicContact CG2-CE2 4Å; T707-F731 HydrophobicContact CG2-CG 3.3Å; T707-F731 HydrophobicContact CG2-CZ 4.34Å; D708-F731 WeakPolarHBondContact O-CE2 3.28Å; R718-F731 HydrophobicContact CB-CD1 4Å; R718-F731 HydrophobicContact CB-CE1 3.54Å; R718-F731 HydrophobicContact CB-CE2 4.4Å; R718-F731 HydrophobicContact CB-CZ 3.78Å; R718-F731 PolarHBondContact N-O 2.95Å; R718-F731 WeakPolarHBondContact O-CD1 3.36Å; R718-F731 PolarHBondContact O-N 3.3Å; H720-F731 HydrophobicContact CB-CD1 3.86Å; H720-F731 HydrophobicContact CB-CE1 3.82Å; H720-F731 AromaticContact CD2-CD1 3.86Å; F731-N741 WeakPolarHBondContact CE1-O 3.37Å; F731-N742 HydrophobicContact CZ-CB 3.98Å
732	V	81.7	Confident	81.6	Confident	42 Å²	42	48.4 Å²	48.4	26%	0.255	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	112.5	176.3	-175.4	0	0	0	0	109.7	R709 H715	R709-V732 VanDerWaalsContact CG-O 3.27Å; R709-V732 WeakPolarHBondContact CG-O 3.29Å; H715-V732 HydrophobicContact CB-CG1 4.19Å
733	Y	80.5	Confident	81.8	Confident	26 Å²	26	48 Å²	48	10%	0.102	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.8	169.2	174.5	-122.3	0	0	0	111.2	R709 F716 R718 G735 C736 G737 N742	R709-Y733 VanDerWaalsContact O-CD2 3.3Å; R709-Y733 WeakPolarHBondContact O-CD2 3.41Å; F716-Y733 HydrophobicContact CB-CD1 4.36Å; F716-Y733 PolarHBondContact N-O 3.33Å; F716-Y733 PolarHBondContact O-N 2.85Å; R718-Y733 VanDerWaalsContact CG-CB 3.46Å; R718-Y733 HydrophobicContact CG-CD1 4.19Å; R718-Y733 HydrophobicContact CG-CG 4.18Å; R718-Y733 VanDerWaalsContact NH1-CD1 3.33Å; Y733-G735 VanDerWaalsContact C-N 3.29Å; Y733-G735 VanDerWaalsContact CE1-C 3.42Å; Y733-G735 VanDerWaalsContact CZ-C 3.4Å; Y733-G735 PolarHBondContact O-N 3.39Å; Y733-G735 VanDerWaalsContact OH-C 3.28Å; Y733-G735 PolarHBondContact OH-O 2.85Å; Y733-C736 VanDerWaalsContact OH-C 3.29Å; Y733-C736 WeakPolarHBondContact OH-CA 3.27Å; Y733-C736 PolarHBondContact OH-N 3.34Å; Y733-G737 PolarHBondContact OH-O 2.93Å; Y733-N742 WeakPolarHBondContact CD2-ND2 3.47Å; Y733-N742 VanDerWaalsContact CE2-ND2 3.33Å; Y733-N742 WeakPolarHBondContact CE2-ND2 3.18Å
734	G	81.3	Confident	82	Confident	3 Å²	3	48.6 Å²	48.6	3%	0.031	29%	0.289	C	S	.	.			trans	-69.9	-17.7	-178.5	0	0	0	0	0	115.5	R709 C712 G714	R709-G734 WeakPolarHBondContact O-CA 3.4Å; R709-G734 PolarHBondContact O-N 3.4Å; C712-G734 WeakPolarHBondContact CB-O 3.37Å; C712-G734 WeakPolarHBondContact O-CA 3.35Å; G714-G734 WeakPolarHBondContact CA-O 3.36Å; G714-G734 PolarHBondContact N-O 3.4Å
735	G	76.4	Confident	82.4	Confident	36 Å²	36	44.6 Å²	44.6	37%	0.371	27%	0.27	S	S	.	.	S	Bend	trans	98.9	-19.6	-176.2	0	0	0	0	0	114.5	Y733	Y733-G735 VanDerWaalsContact C-N 3.29Å; Y733-G735 VanDerWaalsContact CE1-C 3.42Å; Y733-G735 VanDerWaalsContact CZ-C 3.4Å; Y733-G735 PolarHBondContact O-N 3.39Å; Y733-G735 VanDerWaalsContact OH-C 3.28Å; Y733-G735 PolarHBondContact OH-O 2.85Å
736	C	79	Confident	82.5	Confident	49 Å²	49	47.3 Å²	47.3	33%	0.331	28%	0.276	S	S	.	.	S	Bend	trans	-139	158.4	167.7	79	0	0	0	0	110.6	G710 D711 C712 Y733	G710-C736 CarbonylContact C-O 3.33Å; G710-C736 WeakPolarHBondContact CA-O 3.19Å; D711-C736 PolarHBondContact N-O 3.21Å; C712-C736 HydrophobicContact CB-CB 3.96Å; C712-C736 WeakPolarHBondContact CB-SG 3.21Å; C712-C736 WeakPolarHBondContact SG-CB 3.33Å; C712-C736 CovalentContact SG-SG 2.03Å; C712-C736 PolarHBondContact SG-SG 3.47Å; Y733-C736 VanDerWaalsContact OH-C 3.29Å; Y733-C736 WeakPolarHBondContact OH-CA 3.27Å; Y733-C736 PolarHBondContact OH-N 3.34Å
737	G	77.3	Confident	82.4	Confident	42 Å²	42	49.1 Å²	49.1	43%	0.433	29%	0.286	S	S	.	.			trans	86	-144.1	-171.7	0	0	0	0	0	111.4	Y733	Y733-G737 PolarHBondContact OH-O 2.93Å
738	G	72.4	Confident	82.3	Confident	20 Å²	20	50.6 Å²	50.6	21%	0.206	29%	0.288	C	S	.	.			trans	89.2	149.1	174.9	0	0	0	0	0	114.2	D708	D708-G738 WeakPolarHBondContact OD2-CA 3.46Å; D708-G738 PolarHBondContact OD2-N 3.39Å
739	T	79.8	Confident	82.3	Confident	43 Å²	43	50.4 Å²	50.4	26%	0.264	29%	0.287	S	S	.	.			trans	-83	179	166.2	59.4	0	0	0	0	111.1	H705 P706 D708 N741 N742	H705-T739 HydrophobicContact CB-CG2 4.01Å; P706-T739 WeakPolarHBondContact O-CG2 3.31Å; P706-T739 PolarHBondContact O-OG1 3.41Å; D708-T739 HydrophobicContact CB-CG2 3.85Å; T739-N741 PolarHBondContact O-N 3.28Å; T739-N742 WeakPolarHBondContact O-CB 3.26Å
740	G	82.4	Confident	82.3	Confident	12 Å²	12	48.8 Å²	48.8	12%	0.124	28%	0.283	C	S	.	.	S	Bend	trans	-64.2	-14.4	173.7	0	0	0	0	0	114.7	R702 N742	R702-G740 WeakPolarHBondContact CD-O 3.36Å; G740-N742 PolarHBondContact O-N 2.98Å
741	N	89.3	Confident	82.2	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	29%	0.289	C	S	.	.			trans	-83.6	52.2	-175.6	-145.9	-4.9	0	0	0	111.7	R702 C703 H705 H720 Y721 F731 T739	R702-N741 VanDerWaalsContact O-CA 3.23Å; R702-N741 WeakPolarHBondContact O-CA 3.27Å; R702-N741 WeakPolarHBondContact O-CB 3.5Å; R702-N741 PolarHBondContact O-N 3.04Å; C703-N741 PolarHBondContact O-ND2 3.32Å; C703-N741 VanDerWaalsContact O-ND2 3.08Å; H705-N741 HydrophobicContact CB-CB 4.34Å; H705-N741 WeakPolarHBondContact O-CB 3.42Å; H705-N741 PolarHBondContact O-ND2 2.82Å; H720-N741 WeakPolarHBondContact CA-O 3.42Å; H720-N741 WeakPolarHBondContact CA-OD1 3.18Å; H720-N741 HydrophobicContact CB-CB 4.14Å; H720-N741 WeakPolarHBondContact CB-O 3.36Å; Y721-N741 PolarHBondContact N-OD1 3.25Å; Y721-N741 PolarHBondContact O-ND2 3.33Å; F731-N741 WeakPolarHBondContact CE1-O 3.37Å; T739-N741 PolarHBondContact O-N 3.28Å
742	N	90	Very high	81.7	Confident	32 Å²	32	52.2 Å²	52.2	17%	0.171	31%	0.305	C	S	.	.			trans	-143.4	82.3	-163.5	-171.6	-26.4	0	0	0	110.7	R718 F731 Y733 T739 G740	R718-N742 WeakPolarHBondContact CD-OD1 3.15Å; R718-N742 VanDerWaalsContact CG-OD1 3.26Å; R718-N742 WeakPolarHBondContact CG-OD1 3.25Å; R718-N742 PolarHBondContact NH1-OD1 2.81Å; F731-N742 HydrophobicContact CZ-CB 3.98Å; Y733-N742 WeakPolarHBondContact CD2-ND2 3.47Å; Y733-N742 VanDerWaalsContact CE2-ND2 3.33Å; Y733-N742 WeakPolarHBondContact CE2-ND2 3.18Å; T739-N742 WeakPolarHBondContact O-CB 3.26Å; G740-N742 PolarHBondContact O-N 2.98Å
743	F	89.9	Confident	81.9	Confident	21 Å²	21	51 Å²	51	9%	0.092	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-99	147.2	-179.3	-56.5	-84	0	0	0	110.5	R702 R718 F719 T745 E748 C749 A752	R702-F743 HydrophobicContact CB-CZ 4.39Å; R718-F743 CarbonylContact C-O 3.49Å; R718-F743 VanDerWaalsContact CA-O 3.29Å; R718-F743 WeakPolarHBondContact CA-O 3.22Å; R718-F743 WeakPolarHBondContact CB-O 3.19Å; R718-F743 VanDerWaalsContact CD-O 3.23Å; R718-F743 WeakPolarHBondContact CD-O 3.23Å; F719-F743 HydrophobicContact CB-CB 4.45Å; F719-F743 PolarHBondContact N-O 3.28Å; F719-F743 WeakPolarHBondContact O-CD2 3.28Å; F719-F743 PolarHBondContact O-N 2.95Å; F743-T745 VanDerWaalsContact C-N 3.35Å; F743-E748 HydrophobicContact CB-CB 4.11Å; F743-E748 HydrophobicContact CD1-CB 4.16Å; F743-C749 HydrophobicContact CB-CB 3.74Å; F743-C749 HydrophobicContact CD1-CB 4.39Å; F743-C749 HydrophobicContact CD2-CB 3.37Å; F743-C749 VanDerWaalsContact CD2-SG 3.59Å; F743-C749 HydrophobicContact CE2-CB 4.06Å; F743-C749 VanDerWaalsContact CG-CA 3.5Å; F743-C749 HydrophobicContact CG-CB 3.57Å; F743-A752 HydrophobicContact CD1-CB 4.36Å; F743-A752 HydrophobicContact CE1-CB 3.42Å; F743-A752 VanDerWaalsContact CE1-CB 3.42Å; F743-A752 HydrophobicContact CZ-CB 3.66Å
744	A	83.8	Confident	81.7	Confident	56 Å²	56	52 Å²	52	46%	0.463	31%	0.312	S	S	.	.	S	Bend	trans	-75.1	-28.5	179.5	0	0	0	0	0	111.9	E748	A744-E748 VanDerWaalsContact CA-OE2 3.32Å; A744-E748 WeakPolarHBondContact CA-OE2 3.15Å; A744-E748 VanDerWaalsContact CB-OE2 3.31Å; A744-E748 WeakPolarHBondContact CB-OE2 3.45Å; A744-E748 PolarHBondContact N-OE2 3.11Å
745	T	81	Confident	80.5	Confident	64 Å²	64	60.7 Å²	60.7	39%	0.393	35%	0.349	S	S	.	.	S	Bend	trans	-129.8	156.2	178.2	69.4	0	0	0	0	112.6	F743 Q747 E748 C749	F743-T745 VanDerWaalsContact C-N 3.35Å; T745-Q747 PolarHBondContact O-N 3.01Å; T745-E748 PolarHBondContact N-OE2 2.78Å; T745-E748 PolarHBondContact O-N 2.69Å; T745-E748 WeakPolarHBondContact OG1-CB 3.26Å; T745-E748 VanDerWaalsContact OG1-CG 3.26Å; T745-E748 WeakPolarHBondContact OG1-CG 3.25Å; T745-E748 PolarHBondContact OG1-N 2.89Å; T745-E748 PolarHBondContact OG1-OE2 3.21Å; T745-C749 PolarHBondContact O-N 3.29Å
746	K	81.9	Confident	78.8	Confident	106 Å²	106	63.3 Å²	63.3	46%	0.461	37%	0.367	S	S	.	.	H	α-helix	trans	-59.5	-33.7	173.1	-164.7	174.3	179.4	172.9	0	111.8	F719 C728 C749 L750	F719-K746 HydrophobicContact CD1-CB 3.6Å; F719-K746 HydrophobicContact CD1-CD 4.37Å; F719-K746 HydrophobicContact CD1-CG 3.81Å; F719-K746 HydrophobicContact CD2-CB 4.27Å; F719-K746 HydrophobicContact CE1-CB 3.6Å; F719-K746 HydrophobicContact CE1-CD 4.14Å; F719-K746 HydrophobicContact CE1-CG 3.98Å; F719-K746 HydrophobicContact CE2-CB 4.27Å; F719-K746 HydrophobicContact CG-CB 3.95Å; F719-K746 HydrophobicContact CG-CG 4.48Å; F719-K746 HydrophobicContact CZ-CB 3.96Å; C728-K746 HydrophobicContact CB-CG 3.87Å; C728-K746 VanDerWaalsContact O-CE 3.28Å; C728-K746 WeakPolarHBondContact O-CE 3.43Å; K746-C749 PolarHBondContact O-N 2.82Å; K746-L750 HydrophobicContact CG-CD1 4.12Å; K746-L750 HydrophobicContact CG-CG 4.45Å; K746-L750 VanDerWaalsContact O-CG 3.31Å; K746-L750 WeakPolarHBondContact O-CG 3.12Å; K746-L750 PolarHBondContact O-N 2.79Å
747	Q	78.2	Confident	76.5	Confident	157 Å²	157	69.5 Å²	69.5	73%	0.734	39%	0.391	S	S	*	.	H	α-helix	trans	-76	-36.7	-176.7	-167.6	170.9	-0.7	0	0	112.6	T745 C749 K751	T745-Q747 PolarHBondContact O-N 3.01Å; Q747-C749 VanDerWaalsContact C-N 3.34Å; Q747-K751 WeakPolarHBondContact O-CB 3.18Å; Q747-K751 PolarHBondContact O-N 2.88Å
748	E	79.9	Confident	74.5	Confident	94 Å²	94	73.1 Å²	73.1	44%	0.439	41%	0.408	S	S	.	.	H	α-helix	trans	-59.2	-46.5	167.5	-75.5	168.4	144.6	0	0	111.2	F743 A744 T745 K751 A752	F743-E748 HydrophobicContact CB-CB 4.11Å; F743-E748 HydrophobicContact CD1-CB 4.16Å; A744-E748 VanDerWaalsContact CA-OE2 3.32Å; A744-E748 WeakPolarHBondContact CA-OE2 3.15Å; A744-E748 VanDerWaalsContact CB-OE2 3.31Å; A744-E748 WeakPolarHBondContact CB-OE2 3.45Å; A744-E748 PolarHBondContact N-OE2 3.11Å; T745-E748 PolarHBondContact N-OE2 2.78Å; T745-E748 PolarHBondContact O-N 2.69Å; T745-E748 WeakPolarHBondContact OG1-CB 3.26Å; T745-E748 VanDerWaalsContact OG1-CG 3.26Å; T745-E748 WeakPolarHBondContact OG1-CG 3.25Å; T745-E748 PolarHBondContact OG1-N 2.89Å; T745-E748 PolarHBondContact OG1-OE2 3.21Å; E748-K751 PolarHBondContact O-N 2.91Å; E748-A752 VanDerWaalsContact O-CB 3.28Å; E748-A752 WeakPolarHBondContact O-CB 3.07Å; E748-A752 PolarHBondContact O-N 3.23Å
749	C	89.3	Confident	72.6	Confident	0 Å²	0	77 Å²	77	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-60.2	-50.7	178.1	177.7	0	0	0	0	111.8	F719 H720 Y721 C728 F743 T745 K746 Q747 K751 A752 C753	F719-C749 HydrophobicContact CB-CB 3.94Å; H720-C749 VanDerWaalsContact C-SG 3.54Å; Y721-C749 PolarHBondContact N-SG 3.48Å; C728-C749 HydrophobicContact CB-CB 3.62Å; C728-C749 WeakPolarHBondContact CB-SG 3.37Å; C728-C749 WeakPolarHBondContact SG-CB 3.34Å; C728-C749 CovalentContact SG-SG 2.02Å; C728-C749 PolarHBondContact SG-SG 2.86Å; F743-C749 HydrophobicContact CB-CB 3.74Å; F743-C749 HydrophobicContact CD1-CB 4.39Å; F743-C749 HydrophobicContact CD2-CB 3.37Å; F743-C749 VanDerWaalsContact CD2-SG 3.59Å; F743-C749 HydrophobicContact CE2-CB 4.06Å; F743-C749 VanDerWaalsContact CG-CA 3.5Å; F743-C749 HydrophobicContact CG-CB 3.57Å; T745-C749 PolarHBondContact O-N 3.29Å; K746-C749 PolarHBondContact O-N 2.82Å; Q747-C749 VanDerWaalsContact C-N 3.34Å; C749-K751 VanDerWaalsContact C-N 3.34Å; C749-K751 PolarHBondContact O-N 3.49Å; C749-A752 PolarHBondContact O-N 3.44Å; C749-A752 VanDerWaalsContact O-N 3.17Å; C749-C753 VanDerWaalsContact O-CB 3.23Å; C749-C753 WeakPolarHBondContact O-CB 3.48Å; C749-C753 PolarHBondContact O-N 2.91Å; C749-C753 PolarHBondContact O-SG 3.46Å
750	L	84.4	Confident	70.3	Confident	61 Å²	61	78.4 Å²	78.4	32%	0.319	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-40.2	178.7	-69.5	171	0	0	0	111.2	C728 K746 A752 C753 A754	C728-L750 HydrophobicContact CB-CD2 4.02Å; C728-L750 HydrophobicContact CB-CG 4.02Å; C728-L750 PolarHBondContact SG-N 2.79Å; K746-L750 HydrophobicContact CG-CD1 4.12Å; K746-L750 HydrophobicContact CG-CG 4.45Å; K746-L750 VanDerWaalsContact O-CG 3.31Å; K746-L750 WeakPolarHBondContact O-CG 3.12Å; K746-L750 PolarHBondContact O-N 2.79Å; L750-A752 VanDerWaalsContact C-N 3.27Å; L750-A752 PolarHBondContact O-N 3.44Å; L750-C753 PolarHBondContact O-N 2.84Å; L750-A754 HydrophobicContact CB-CB 4.2Å; L750-A754 HydrophobicContact CD2-CB 3.66Å; L750-A754 WeakPolarHBondContact O-CA 3.48Å; L750-A754 WeakPolarHBondContact O-CB 3.05Å; L750-A754 PolarHBondContact O-N 3.45Å
751	K	80	Confident	67.7	Low	174 Å²	174	79.3 Å²	79.3	76%	0.757	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-30.7	175.6	-177.4	174.3	179	176.8	0	113	Q747 E748 C749	Q747-K751 WeakPolarHBondContact O-CB 3.18Å; Q747-K751 PolarHBondContact O-N 2.88Å; E748-K751 PolarHBondContact O-N 2.91Å; C749-K751 VanDerWaalsContact C-N 3.34Å; C749-K751 PolarHBondContact O-N 3.49Å
752	A	78	Confident	65.3	Low	55 Å²	55	80.2 Å²	80.2	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-86.4	-25.6	178.3	0	0	0	0	0	114	F743 E748 C749 L750	F743-A752 HydrophobicContact CD1-CB 4.36Å; F743-A752 HydrophobicContact CE1-CB 3.42Å; F743-A752 VanDerWaalsContact CE1-CB 3.42Å; F743-A752 HydrophobicContact CZ-CB 3.66Å; E748-A752 VanDerWaalsContact O-CB 3.28Å; E748-A752 WeakPolarHBondContact O-CB 3.07Å; E748-A752 PolarHBondContact O-N 3.23Å; C749-A752 PolarHBondContact O-N 3.44Å; C749-A752 VanDerWaalsContact O-N 3.17Å; L750-A752 VanDerWaalsContact C-N 3.27Å; L750-A752 PolarHBondContact O-N 3.44Å
753	C	85.4	Confident	62.6	Low	17 Å²	17	83.5 Å²	83.5	12%	0.115	45%	0.446	C	S	.	.	H	α-helix	trans	-129.1	-28.1	-164.3	-58.4	0	0	0	0	116	C703 Y721 C749 L750 K755	C703-C753 HydrophobicContact CB-CB 3.59Å; C703-C753 WeakPolarHBondContact CB-SG 3.45Å; C703-C753 WeakPolarHBondContact SG-CA 3.42Å; C703-C753 WeakPolarHBondContact SG-CB 3.22Å; C703-C753 CovalentContact SG-SG 2.02Å; C703-C753 PolarHBondContact SG-SG 2.83Å; Y721-C753 HydrophobicContact CD1-CB 4.1Å; Y721-C753 HydrophobicContact CD2-CB 3.29Å; Y721-C753 HydrophobicContact CE2-CB 3.83Å; Y721-C753 HydrophobicContact CG-CB 3.43Å; Y721-C753 VanDerWaalsContact CG-CB 3.43Å; C749-C753 VanDerWaalsContact O-CB 3.23Å; C749-C753 WeakPolarHBondContact O-CB 3.48Å; C749-C753 PolarHBondContact O-N 2.91Å; C749-C753 PolarHBondContact O-SG 3.46Å; L750-C753 PolarHBondContact O-N 2.84Å; C753-K755 VanDerWaalsContact C-N 3.34Å; C753-K755 PolarHBondContact O-N 2.6Å
754	A	75.2	Confident	59.8	Low	46 Å²	46	88.7 Å²	88.7	38%	0.38	47%	0.469	S	S	.	.			trans	-95.4	53.5	-173.6	0	0	0	0	0	112.2	Y721 L750	Y721-A754 HydrophobicContact CE2-CB 4.23Å; L750-A754 HydrophobicContact CB-CB 4.2Å; L750-A754 HydrophobicContact CD2-CB 3.66Å; L750-A754 WeakPolarHBondContact O-CA 3.48Å; L750-A754 WeakPolarHBondContact O-CB 3.05Å; L750-A754 PolarHBondContact O-N 3.45Å
755	K	56.9	Low	57.3	Low	186 Å²	186	90.9 Å²	90.9	81%	0.809	47%	0.468	S	S	*	.			trans	-125.8	80.8	174.3	-80.1	-158	171.8	-158.9	0	111.6	C753	C753-K755 VanDerWaalsContact C-N 3.34Å; C753-K755 PolarHBondContact O-N 2.6Å
756	A	39.8	Very low	54.8	Low	91 Å²	91	93.5 Å²	93.5	75%	0.752	48%	0.479	S	S	*	.			trans	-170.4	82.2	158.7	0	0	0	0	0	110.1
757	E	31.6	Very low	52.3	Low	179 Å²	179	96.6 Å²	96.6	84%	0.836	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-97.5	128.4	152.7	-65.7	-59.4	156.3	0	0	106.7
758	P	34.6	Very low	49.9	Very low	119 Å²	119	91.5 Å²	91.5	77%	0.773	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-95.5	132	175	34.3	-29.5	0	0	0	111.3
759	E	32.8	Very low	47.3	Very low	102 Å²	102	90.7 Å²	90.7	48%	0.477	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-91.7	165.4	-175.7	-58.3	173.6	153.8	0	0	110.9	E1255 S1256 D1257	E759-E1255 VanDerWaalsContact OE1-CA 3.29Å; E759-E1255 WeakPolarHBondContact OE1-CA 3.04Å; E759-S1256 PolarHBondContact OE1-N 2.92Å; E759-S1256 PolarHBondContact OE2-N 3.1Å; E759-D1257 WeakPolarHBondContact CB-OD2 3.47Å
760	D	32	Very low	44.5	Very low	71 Å²	71	93.9 Å²	93.9	38%	0.38	49%	0.494	S	S	.	.	S	Bend	trans	-110.6	62.5	-160.5	-165.3	20.2	0	0	0	115.8	S863 T864 D1257	D760-S863 PolarHBondContact OD1-OG 2.95Å; D760-T864 HydrophobicContact CB-CG2 3.93Å; D760-T864 WeakPolarHBondContact OD1-CB 3.3Å; D760-T864 WeakPolarHBondContact OD1-CG2 3.06Å; D760-T864 PolarHBondContact OD1-OG1 2.85Å; D760-T864 WeakPolarHBondContact OD2-CB 3.33Å; D760-T864 WeakPolarHBondContact OD2-CG2 3.39Å; D760-T864 PolarHBondContact OD2-OG1 2.99Å; D760-D1257 PolarHBondContact N-OD2 3.1Å
761	E	28.1	Very low	41.8	Very low	31 Å²	31	96.2 Å²	96.2	15%	0.145	51%	0.51	C	S	.	.			trans	-118.7	78.9	161.1	-99.6	-64.7	174.2	0	0	111.5	T1191 T1192 D1257	E761-T1191 WeakPolarHBondContact OE1-CA 3.17Å; E761-T1191 WeakPolarHBondContact OE1-CB 3.49Å; E761-T1191 WeakPolarHBondContact OE1-CG2 3.48Å; E761-T1192 WeakPolarHBondContact OE1-CG2 3.5Å; E761-T1192 PolarHBondContact OE1-N 3.27Å; E761-D1257 HydrophobicContact CB-CB 4.47Å; E761-D1257 HydrophobicContact CG-CB 4.23Å
762	S	38.7	Very low	39.4	Very low	22 Å²	22	93.7 Å²	93.7	15%	0.154	51%	0.512	C	S	.	.			trans	-158.7	-20.3	173.3	-94.2	0	0	0	0	116.8	K764 F765 Y861 G862 S863	S762-K764 PolarHBondContact O-N 2.68Å; S762-F765 PolarHBondContact O-N 3.31Å; S762-Y861 WeakPolarHBondContact OG-CD1 3.1Å; S762-G862 VanDerWaalsContact C-C 3.49Å; S762-G862 CarbonylContact C-O 3.48Å; S762-G862 VanDerWaalsContact CB-C 3.49Å; S762-G862 CarbonylContact O-C 3.39Å; S762-S863 VanDerWaalsContact C-OG 3.27Å; S762-S863 VanDerWaalsContact CA-OG 3.31Å; S762-S863 WeakPolarHBondContact CA-OG 3.45Å; S762-S863 WeakPolarHBondContact CB-OG 3.17Å; S762-S863 PolarHBondContact N-OG 3.31Å
763	K	32.2	Very low	36.8	Very low	102 Å²	102	98 Å²	98	44%	0.443	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	9.8	178.3	-158.4	163.7	-177.6	169.7	0	115.3	G862 S863 T864 E865	K763-G862 VanDerWaalsContact CA-O 3.25Å; K763-G862 WeakPolarHBondContact CA-O 3.2Å; K763-G862 PolarHBondContact N-O 3.31Å; K763-S863 PolarHBondContact N-OG 2.04Å; K763-T864 WeakPolarHBondContact CD-O 2.99Å; K763-T864 WeakPolarHBondContact CD-OG1 3.49Å; K763-T864 VanDerWaalsContact CE-O 3.24Å; K763-T864 WeakPolarHBondContact CE-O 3.31Å; K763-T864 PolarHBondContact NZ-O 3.23Å; K763-E865 PolarHBondContact NZ-O 3.34Å
764	K	32.7	Very low	34	Very low	129 Å²	129	101.9 Å²	101.9	56%	0.561	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-11.3	171.8	-112.2	169.5	179.9	167.2	0	114.3	S762 T1191 T1192	S762-K764 PolarHBondContact O-N 2.68Å; K764-T1191 HydrophobicContact CD-CG2 4.32Å; K764-T1191 PolarHBondContact NZ-OG1 3.22Å; K764-T1192 PolarHBondContact NZ-OG1 3.29Å
765	F	30.6	Very low	31.7	Very low	102 Å²	102	107.6 Å²	107.6	45%	0.447	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101	-24.2	-179.1	-139.4	-85.2	0	0	0	114.1	S762 K767 T860	S762-F765 PolarHBondContact O-N 3.31Å; F765-K767 PolarHBondContact O-N 3.05Å; F765-T860 HydrophobicContact CE1-CG2 4.14Å; F765-T860 WeakPolarHBondContact CE1-OG1 3.06Å
766	L	29	Very low	30.3	Very low	119 Å²	119	106.4 Å²	106.4	62%	0.623	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	43.2	167.6	-83.5	175.8	0	0	0	113.9	G862	L766-G862 VanDerWaalsContact CD1-CA 3.49Å
767	K	28.1	Very low	29.8	Very low	171 Å²	171	108.2 Å²	108.2	74%	0.743	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	8.3	165.4	-75.4	-167.8	174.4	177.1	0	114.7	F765	F765-K767 PolarHBondContact O-N 3.05Å
768	A	28.6	Very low	29.6	Very low	50 Å²	50	105.2 Å²	105.2	41%	0.413	58%	0.577	S	S	.	*	S	Bend	trans	-170.5	98.8	157.8	0	0	0	0	0	105.4
769	V	24.3	Very low	29.4	Very low	78 Å²	78	106.2 Å²	106.2	47%	0.473	58%	0.575	S	S	.	*	S	Bend	cis	-111	170.9	35.8	-169.4	0	0	0	0	112.8	S879	V769-S879 VanDerWaalsContact CG2-O 3.24Å; V769-S879 WeakPolarHBondContact CG2-O 3.09Å
770	H	30.9	Very low	29.4	Very low	67 Å²	67	109.5 Å²	109.5	31%	0.31	60%	0.595	S	S	.	*			trans	-118.6	159.7	-169.1	-79.5	-129.5	0	0	0	115.2	Y875 A876 P877	H770-Y875 PolarHBondContact ND1-O 3.43Å; H770-A876 HydrophobicContact CB-CB 4.09Å; H770-A876 WeakPolarHBondContact ND1-CA 3.41Å; H770-P877 PolarHBondContact CD2-O 2.87Å; H770-P877 WeakPolarHBondContact NE2-CD 3.06Å
771	T	28	Very low	29.7	Very low	110 Å²	110	111.2 Å²	111.2	68%	0.675	60%	0.603	S	S	*	*			trans	74.1	150.5	161.1	44.1	0	0	0	0	118.8
772	P	29	Very low	30.6	Very low	120 Å²	120	111.9 Å²	111.9	78%	0.779	61%	0.61	S	S	*	*			trans	-120.6	163.2	-145.6	41.6	-30.4	0	0	0	116.6
773	V	24.7	Very low	31.4	Very low	146 Å²	146	114.2 Å²	114.2	89%	0.885	62%	0.623	S	S	*	*			trans	-139.1	148.1	164.6	-179.6	0	0	0	0	110.2
774	S	26.6	Very low	32.7	Very low	98 Å²	98	114.2 Å²	114.2	69%	0.685	63%	0.625	S	S	*	*			trans	-88	147	-178.9	178.4	0	0	0	0	113.4
775	I	27.1	Very low	34.7	Very low	167 Å²	167	112.3 Å²	112.3	86%	0.856	62%	0.621	S	S	*	*			trans	-134.9	124.4	158.9	-56.7	-179.8	0	0	0	108.5
776	Q	27	Very low	37.1	Very low	160 Å²	160	107.5 Å²	107.5	75%	0.748	60%	0.6	S	S	*	*			trans	-102.8	150.3	168.4	-83.7	-158.5	-12.9	0	0	111.7	T778	Q776-T778 PolarHBondContact O-N 2.69Å
777	P	29	Very low	40	Very low	129 Å²	129	102.4 Å²	102.4	84%	0.838	57%	0.574	S	S	*	*			trans	-68.6	125.3	-179.4	28.8	-34.9	0	0	0	111.2
778	T	26.7	Very low	42.8	Very low	116 Å²	116	99.8 Å²	99.8	71%	0.712	56%	0.563	S	S	*	*			trans	-122.1	124.6	176.1	-59.7	0	0	0	0	109.8	Q776	Q776-T778 PolarHBondContact O-N 2.69Å
779	L	31.4	Very low	45.6	Very low	140 Å²	140	100.6 Å²	100.6	73%	0.733	56%	0.558	S	S	*	*			trans	-57.5	137.1	169.7	-112.5	72.1	0	0	0	110	L781	L779-L781 PolarHBondContact O-N 2.88Å
780	I	33	Very low	48.6	Very low	172 Å²	172	101.3 Å²	101.3	88%	0.882	56%	0.564	S	S	*	*			trans	-69.4	96.5	173.3	-58.2	179.3	0	0	0	108.8
781	L	38.6	Very low	51.3	Low	107 Å²	107	103.7 Å²	103.7	56%	0.56	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-66.4	146.2	175	-46.9	178.3	0	0	0	109.8	L779 T783 F836	L779-L781 PolarHBondContact O-N 2.88Å; L781-T783 PolarHBondContact O-N 2.03Å; L781-F836 HydrophobicContact CB-CD1 4.47Å; L781-F836 HydrophobicContact CB-CE1 4.44Å; L781-F836 HydrophobicContact CD2-CD1 4.19Å; L781-F836 HydrophobicContact CD2-CE1 3.7Å
782	P	46.2	Very low	54	Low	44 Å²	44	102.3 Å²	102.3	29%	0.286	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-57.4	134.2	166.9	-22.9	35.2	0	0	0	110.8	F827 F836	P782-F827 HydrophobicContact CG-CE1 4.18Å; P782-F836 HydrophobicContact CG-CD1 4.35Å; P782-F836 HydrophobicContact CG-CD2 3.98Å; P782-F836 HydrophobicContact CG-CE2 4.2Å; P782-F836 HydrophobicContact CG-CG 4.07Å; P782-F836 HydrophobicContact CG-CZ 4.49Å
783	T	56.5	Low	56.5	Low	71 Å²	71	101.3 Å²	101.3	44%	0.436	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-58.4	149.1	179	57.6	0	0	0	0	111.3	L781 D785 S786 R824	L781-T783 PolarHBondContact O-N 2.03Å; T783-D785 PolarHBondContact O-N 2.92Å; T783-S786 PolarHBondContact N-OG 2.03Å; T783-S786 WeakPolarHBondContact O-CA 2.97Å; T783-S786 WeakPolarHBondContact O-CB 3.32Å; T783-S786 PolarHBondContact O-N 2.82Å; T783-S786 PolarHBondContact O-OG 3.22Å; T783-S786 PolarHBondContact OG1-OG 2.93Å; T783-R824 PolarHBondContact OG1-NH1 2.65Å
784	E	58.8	Low	59.3	Low	103 Å²	103	95.1 Å²	95.1	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-51.5	-35.1	-176.2	-75.7	-150.9	172.1	0	0	114	S786 C787 K788 K839	E784-S786 PolarHBondContact O-N 3.04Å; E784-C787 WeakPolarHBondContact O-CB 3.48Å; E784-C787 PolarHBondContact O-N 3.16Å; E784-K788 IonicContact OE2-NZ 3.46Å; E784-K839 WeakPolarHBondContact OE1-CE 3.45Å; E784-K839 IonicContact OE1-NZ 2.7Å; E784-K839 PolarHBondContact OE1-NZ 3.06Å; E784-K839 IonicContact OE2-NZ 2.79Å; E784-K839 PolarHBondContact OE2-NZ 2.99Å
785	D	75.4	Confident	61.7	Low	89 Å²	89	97.7 Å²	97.7	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-66.8	-21.3	179.9	-52.1	-52.7	0	0	0	112.7	T783 C787 K788 Q789	T783-D785 PolarHBondContact O-N 2.92Å; D785-C787 PolarHBondContact O-N 3.15Å; D785-K788 PolarHBondContact O-N 3.34Å; D785-K788 VanDerWaalsContact O-N 3.08Å; D785-K788 WeakPolarHBondContact OD1-CD 3.34Å; D785-K788 WeakPolarHBondContact OD1-CE 3.28Å; D785-K788 IonicContact OD1-NZ 2.65Å; D785-K788 PolarHBondContact OD1-NZ 3.34Å; D785-Q789 WeakPolarHBondContact O-CG 3.23Å; D785-Q789 PolarHBondContact O-N 3.16Å
786	S	80.9	Confident	64.2	Low	0 Å²	0	91 Å²	91	0%	0	48%	0.48	C	S	.	.	H	α-helix	trans	-56.5	-37.2	169.1	-51.4	0	0	0	0	111.7	T783 E784 R824 N825	T783-S786 PolarHBondContact N-OG 2.03Å; T783-S786 WeakPolarHBondContact O-CA 2.97Å; T783-S786 WeakPolarHBondContact O-CB 3.32Å; T783-S786 PolarHBondContact O-N 2.82Å; T783-S786 PolarHBondContact O-OG 3.22Å; T783-S786 PolarHBondContact OG1-OG 2.93Å; E784-S786 PolarHBondContact O-N 3.04Å; S786-R824 VanDerWaalsContact CB-CB 3.46Å; S786-R824 WeakPolarHBondContact OG-CB 3.28Å; S786-R824 VanDerWaalsContact OG-CD 3.23Å; S786-R824 WeakPolarHBondContact OG-CD 3.03Å; S786-N825 VanDerWaalsContact O-CA 3.29Å; S786-N825 WeakPolarHBondContact O-CA 3.24Å; S786-N825 WeakPolarHBondContact O-CB 3.44Å; S786-N825 VanDerWaalsContact O-CG 3.3Å; S786-N825 PolarHBondContact O-N 3.35Å
787	C	89	Confident	65.6	Low	12 Å²	12	90.4 Å²	90.4	8%	0.081	48%	0.483	C	S	.	.	H	α-helix	trans	-80.5	-18.4	177.9	-60	0	0	0	0	113.3	E784 D785 F805 N825 C837	E784-C787 WeakPolarHBondContact O-CB 3.48Å; E784-C787 PolarHBondContact O-N 3.16Å; D785-C787 PolarHBondContact O-N 3.15Å; C787-F805 HydrophobicContact CB-CB 4.32Å; C787-F805 HydrophobicContact CB-CD1 4.31Å; C787-N825 PolarHBondContact O-ND2 2.03Å; C787-N825 VanDerWaalsContact O-ND2 3.11Å; C787-C837 HydrophobicContact CB-CB 3.64Å; C787-C837 WeakPolarHBondContact CB-SG 3.08Å; C787-C837 WeakPolarHBondContact SG-CA 3.45Å; C787-C837 WeakPolarHBondContact SG-CB 3.24Å; C787-C837 CovalentContact SG-SG 2.03Å; C787-C837 PolarHBondContact SG-SG 2.04Å
788	K	87.2	Confident	67.2	Low	116 Å²	116	90.2 Å²	90.2	50%	0.504	47%	0.469	S	S	.	.	H	α-helix	trans	-89	-20	-178.5	-57.8	172.3	-158.5	159.9	0	112.7	E784 D785	E784-K788 IonicContact OE2-NZ 3.46Å; D785-K788 PolarHBondContact O-N 3.34Å; D785-K788 VanDerWaalsContact O-N 3.08Å; D785-K788 WeakPolarHBondContact OD1-CD 3.34Å; D785-K788 WeakPolarHBondContact OD1-CE 3.28Å; D785-K788 IonicContact OD1-NZ 2.65Å; D785-K788 PolarHBondContact OD1-NZ 3.34Å
789	Q	87.3	Confident	69.2	Low	68 Å²	68	88.8 Å²	88.8	32%	0.318	45%	0.451	S	S	.	.	S	Bend	trans	-65.6	143.7	179	-76.1	167.8	2.6	0	0	111.8	D785 N823 N825	D785-Q789 WeakPolarHBondContact O-CG 3.23Å; D785-Q789 PolarHBondContact O-N 3.16Å; Q789-N823 HydrophobicContact CB-CB 4.41Å; Q789-N825 HydrophobicContact CB-CB 4.22Å; Q789-N825 WeakPolarHBondContact O-CB 3.42Å; Q789-N825 PolarHBondContact O-ND2 3.49Å
790	P	87.1	Confident	71.3	Confident	93 Å²	93	84.2 Å²	84.2	60%	0.604	43%	0.425	S	S	*	.			trans	-71.3	159.5	-177.9	30.1	-36.7	0	0	0	112.2	M792 N823	P790-M792 PolarHBondContact O-N 2.92Å; P790-N823 PolarHBondContact O-ND2 2.78Å; P790-N823 PolarHBondContact O-OD1 3.29Å
791	K	88.1	Confident	73.7	Confident	117 Å²	117	79.8 Å²	79.8	51%	0.509	40%	0.403	S	S	.	.			trans	-56.4	110.4	170.1	50.3	173.8	162.9	-149.8	0	111.2	F804 F815	K791-F804 HydrophobicContact CB-CB 4.4Å; K791-F804 HydrophobicContact CB-CD1 3.7Å; K791-F804 HydrophobicContact CB-CD2 3.69Å; K791-F804 HydrophobicContact CB-CE1 3.83Å; K791-F804 HydrophobicContact CB-CE2 3.8Å; K791-F804 HydrophobicContact CB-CG 3.65Å; K791-F804 HydrophobicContact CB-CZ 3.89Å; K791-F804 HydrophobicContact CD-CD1 4.22Å; K791-F804 HydrophobicContact CD-CE1 3.55Å; K791-F804 HydrophobicContact CD-CE2 4.28Å; K791-F804 HydrophobicContact CD-CZ 3.6Å; K791-F804 HydrophobicContact CG-CD1 4.38Å; K791-F804 HydrophobicContact CG-CD2 4.32Å; K791-F804 HydrophobicContact CG-CE1 3.99Å; K791-F804 HydrophobicContact CG-CE2 3.9Å; K791-F804 HydrophobicContact CG-CZ 3.74Å; K791-F815 HydrophobicContact CB-CB 4.29Å; K791-F815 HydrophobicContact CB-CD1 4.43Å; K791-F815 HydrophobicContact CB-CD2 4.27Å; K791-F815 HydrophobicContact CB-CG 4.09Å; K791-F815 HydrophobicContact CD-CB 4.13Å
792	M	85.3	Confident	76.2	Confident	80 Å²	80	76.9 Å²	76.9	39%	0.394	39%	0.385	S	S	.	.			trans	-109.1	100.5	179	-172.3	-173	-68.5	0	0	110	P790 G794 F815 G822 N823	P790-M792 PolarHBondContact O-N 2.92Å; M792-G794 PolarHBondContact O-N 3.46Å; M792-G794 VanDerWaalsContact O-N 3.09Å; M792-F815 WeakPolarHBondContact O-CE2 3.4Å; M792-G822 WeakPolarHBondContact O-CA 3.38Å; M792-G822 VanDerWaalsContact SD-CA 3.51Å; M792-N823 HydrophobicContact CB-CB 4.45Å; M792-N823 WeakPolarHBondContact CB-ND2 3.4Å; M792-N823 HydrophobicContact CE-CB 4.26Å; M792-N823 HydrophobicContact SD-CB 4.44Å
793	R	81	Confident	78.5	Confident	99 Å²	99	77.3 Å²	77.3	37%	0.374	38%	0.381	S	S	.	.			trans	-47.6	-37.5	173.7	179.3	172.3	-173.7	-176	2.8	112.2	Y799 S818	R793-Y799 VanDerWaalsContact NH2-CZ 3.35Å; R793-Y799 PolarHBondContact NH2-OH 3.4Å; R793-S818 WeakPolarHBondContact O-CB 3.07Å; R793-S818 PolarHBondContact O-N 2.83Å; R793-S818 PolarHBondContact O-OG 2.8Å
794	G	82.5	Confident	80.3	Confident	16 Å²	16	74.2 Å²	74.2	17%	0.165	36%	0.362	C	S	.	.			trans	78.8	179.4	-172.1	0	0	0	0	0	112.3	M792 S818	M792-G794 PolarHBondContact O-N 3.46Å; M792-G794 VanDerWaalsContact O-N 3.09Å; G794-S818 WeakPolarHBondContact CA-OG 3.4Å; G794-S818 PolarHBondContact O-OG 2.86Å
795	N	78	Confident	82	Confident	153 Å²	153	70.2 Å²	70.2	82%	0.818	34%	0.343	S	S	*	.	S	Bend	trans	-112.2	27.2	-160.1	-61.4	51	0	0	0	112.5	S818 C820	N795-S818 PolarHBondContact N-OG 3.05Å; N795-C820 PolarHBondContact N-O 2.82Å
796	C	78.7	Confident	82.7	Confident	25 Å²	25	67.1 Å²	67.1	17%	0.169	33%	0.326	C	S	.	.	S	Bend	trans	-116.3	-178.2	-176	-72.4	0	0	0	0	111.9	S818 C820	C796-S818 CarbonylContact C-O 3.52Å; C796-S818 WeakPolarHBondContact CB-O 3Å; C796-S818 PolarHBondContact N-OG 2.99Å; C796-S818 VanDerWaalsContact N-OG 3.15Å; C796-S818 WeakPolarHBondContact O-CB 3.13Å; C796-C820 HydrophobicContact CB-CB 4.1Å; C796-C820 WeakPolarHBondContact CB-SG 3.33Å; C796-C820 WeakPolarHBondContact SG-CB 3.25Å; C796-C820 CovalentContact SG-SG 2.03Å; C796-C820 PolarHBondContact SG-SG 2.87Å
797	N	57.6	Low	82.8	Confident	149 Å²	149	69.2 Å²	69.2	80%	0.797	34%	0.344	S	S	*	.	S	Bend	trans	-128.7	41.7	-173.6	-70.6	-27.7	0	0	0	112.7
798	K	62.3	Low	82.4	Confident	125 Å²	125	77.2 Å²	77.2	54%	0.543	38%	0.38	S	S	.	.			trans	-125.4	121.5	172.3	179.7	-169	178.9	-167.8	0	109	E800 S818 G819	K798-E800 HydrophobicContact CD-CG 4.11Å; K798-E800 WeakPolarHBondContact CD-OE1 3.46Å; K798-E800 WeakPolarHBondContact CE-OE1 3.08Å; K798-E800 HydrophobicContact CG-CG 4.35Å; K798-E800 IonicContact NZ-OE1 2.88Å; K798-E800 PolarHBondContact NZ-OE1 3.33Å; K798-E800 PolarHBondContact O-N 2.04Å; K798-S818 PolarHBondContact N-O 3.27Å; K798-S818 VanDerWaalsContact N-O 3.11Å; K798-S818 CarbonylContact O-C 3.59Å; K798-S818 WeakPolarHBondContact O-CA 3.46Å; K798-G819 PolarHBondContact O-N 2.7Å
799	Y	67.8	Low	82.3	Confident	86 Å²	86	75.3 Å²	75.3	34%	0.337	38%	0.377	S	S	.	.			trans	-82.4	105.9	179.5	-64.3	-96.4	0	0	0	110.5	E379 R793 F816	E379-Y799 VanDerWaalsContact CD-CE2 3.44Å; E379-Y799 HydrophobicContact CG-CD2 4.13Å; E379-Y799 HydrophobicContact CG-CE2 4.21Å; E379-Y799 WeakPolarHBondContact OE1-CD2 3.08Å; E379-Y799 VanDerWaalsContact OE2-CD2 3.28Å; E379-Y799 WeakPolarHBondContact OE2-CD2 3.5Å; E379-Y799 WeakPolarHBondContact OE2-CE2 3.41Å; R793-Y799 VanDerWaalsContact NH2-CZ 3.35Å; R793-Y799 PolarHBondContact NH2-OH 3.4Å; Y799-F816 HydrophobicContact CD1-CB 3.97Å; Y799-F816 HydrophobicContact CD1-CD1 4.33Å; Y799-F816 HydrophobicContact CD1-CG 4.16Å
800	E	77	Confident	82.3	Confident	43 Å²	43	77.6 Å²	77.6	20%	0.201	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.9	167.7	-67.7	-175.4	-170.2	0	0	108.8	K798 R802 Y817	K798-E800 HydrophobicContact CD-CG 4.11Å; K798-E800 WeakPolarHBondContact CD-OE1 3.46Å; K798-E800 WeakPolarHBondContact CE-OE1 3.08Å; K798-E800 HydrophobicContact CG-CG 4.35Å; K798-E800 IonicContact NZ-OE1 2.88Å; K798-E800 PolarHBondContact NZ-OE1 3.33Å; K798-E800 PolarHBondContact O-N 2.04Å; E800-R802 PolarHBondContact O-N 2.89Å; E800-R802 IonicContact OE2-CZ 3.43Å; E800-R802 IonicContact OE2-NH1 3.45Å; E800-R802 PolarHBondContact OE2-NH1 3.14Å; E800-R802 IonicContact OE2-NH2 3.34Å; E800-R802 PolarHBondContact OE2-NH2 3.23Å; E800-Y817 HydrophobicContact CB-CD1 4.28Å; E800-Y817 PolarHBondContact N-O 2.79Å; E800-Y817 PolarHBondContact O-N 2.78Å
801	L	83.2	Confident	82.2	Confident	79 Å²	79	79.7 Å²	79.7	41%	0.414	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	129	169.8	-171.2	147.9	0	0	0	109	Y803 F814	L801-Y803 HydrophobicContact CD2-CD2 4.19Å; L801-Y803 HydrophobicContact CD2-CE2 3.41Å; L801-Y803 VanDerWaalsContact CD2-CE2 3.41Å; L801-F814 HydrophobicContact CD1-CB 4.48Å; L801-F814 HydrophobicContact CD1-CD2 3.95Å; L801-F814 HydrophobicContact CD1-CG 4.35Å; L801-F814 HydrophobicContact CD2-CB 4.22Å; L801-F814 HydrophobicContact CG-CB 4.29Å; L801-F814 HydrophobicContact CG-CD2 4.29Å
802	R	90.6	Very high	82.4	Confident	46 Å²	46	74.7 Å²	74.7	17%	0.174	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	167.8	179	-76.2	-80.5	-154.2	-68	-14.5	108.9	E800 F814 F815 Y817 N826 F827	E800-R802 PolarHBondContact O-N 2.89Å; E800-R802 IonicContact OE2-CZ 3.43Å; E800-R802 IonicContact OE2-NH1 3.45Å; E800-R802 PolarHBondContact OE2-NH1 3.14Å; E800-R802 IonicContact OE2-NH2 3.34Å; E800-R802 PolarHBondContact OE2-NH2 3.23Å; R802-F814 CarbonylContact O-C 3.46Å; R802-F814 WeakPolarHBondContact O-CA 3.46Å; R802-F815 HydrophobicContact CB-CD1 4.07Å; R802-F815 HydrophobicContact CB-CE1 3.62Å; R802-F815 HydrophobicContact CB-CZ 3.96Å; R802-F815 PolarHBondContact N-O 2.93Å; R802-F815 PolarHBondContact O-N 3.34Å; R802-F815 VanDerWaalsContact O-O 3.1Å; R802-Y817 VanDerWaalsContact CG-CB 3.49Å; R802-Y817 HydrophobicContact CG-CD1 4.15Å; R802-Y817 HydrophobicContact CG-CG 4.11Å; R802-Y817 VanDerWaalsContact NH2-CE1 3.33Å; R802-N826 WeakPolarHBondContact CB-OD1 3.44Å; R802-N826 WeakPolarHBondContact CD-O 3.06Å; R802-N826 WeakPolarHBondContact CD-OD1 3.49Å; R802-N826 WeakPolarHBondContact CG-OD1 3.25Å; R802-N826 PolarHBondContact NE-O 3.14Å; R802-N826 PolarHBondContact NE-OD1 3.05Å; R802-F827 CarbonylContact C-O 3.48Å; R802-F827 VanDerWaalsContact CA-O 3.23Å; R802-F827 WeakPolarHBondContact CA-O 3.08Å; R802-F827 WeakPolarHBondContact CB-O 3.47Å; R802-F827 WeakPolarHBondContact CD-O 3.23Å
803	Y	93.9	Very high	82.6	Confident	53 Å²	53	72.7 Å²	72.7	21%	0.208	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	146	175.6	-62.6	-97.4	0	0	0	110.2	L801 E813 F814 F827 L830	L801-Y803 HydrophobicContact CD2-CD2 4.19Å; L801-Y803 HydrophobicContact CD2-CE2 3.41Å; L801-Y803 VanDerWaalsContact CD2-CE2 3.41Å; Y803-E813 CarbonylContact C-O 3.4Å; Y803-E813 WeakPolarHBondContact CA-O 3.31Å; Y803-F814 HydrophobicContact CD1-CB 3.91Å; Y803-F814 HydrophobicContact CE1-CB 3.76Å; Y803-F827 PolarHBondContact N-O 3.4Å; Y803-F827 WeakPolarHBondContact O-CD2 3.47Å; Y803-F827 PolarHBondContact O-N 3.18Å; Y803-L830 HydrophobicContact CD1-CB 3.93Å; Y803-L830 HydrophobicContact CD1-CD1 3.72Å; Y803-L830 HydrophobicContact CD1-CG 4.43Å; Y803-L830 VanDerWaalsContact CD2-N 3.34Å; Y803-L830 HydrophobicContact CE1-CB 3.64Å; Y803-L830 HydrophobicContact CE1-CD1 3.93Å; Y803-L830 HydrophobicContact CE1-CG 4.28Å; Y803-L830 HydrophobicContact CE2-CB 4.38Å; Y803-L830 VanDerWaalsContact CE2-N 3.35Å; Y803-L830 HydrophobicContact CG-CB 4.41Å
804	F	94.2	Very high	83.1	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.026	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	146.3	172.6	83	-71.9	0	0	0	109.1	K791 N806 C812 E813 F815 N825	K791-F804 HydrophobicContact CB-CB 4.4Å; K791-F804 HydrophobicContact CB-CD1 3.7Å; K791-F804 HydrophobicContact CB-CD2 3.69Å; K791-F804 HydrophobicContact CB-CE1 3.83Å; K791-F804 HydrophobicContact CB-CE2 3.8Å; K791-F804 HydrophobicContact CB-CG 3.65Å; K791-F804 HydrophobicContact CB-CZ 3.89Å; K791-F804 HydrophobicContact CD-CD1 4.22Å; K791-F804 HydrophobicContact CD-CE1 3.55Å; K791-F804 HydrophobicContact CD-CE2 4.28Å; K791-F804 HydrophobicContact CD-CZ 3.6Å; K791-F804 HydrophobicContact CG-CD1 4.38Å; K791-F804 HydrophobicContact CG-CD2 4.32Å; K791-F804 HydrophobicContact CG-CE1 3.99Å; K791-F804 HydrophobicContact CG-CE2 3.9Å; K791-F804 HydrophobicContact CG-CZ 3.74Å; F804-N806 HydrophobicContact CD2-CB 4.45Å; F804-N806 HydrophobicContact CE2-CB 3.6Å; F804-N806 HydrophobicContact CZ-CB 3.7Å; F804-N806 PolarHBondContact O-N 2.88Å; F804-C812 WeakPolarHBondContact O-CA 3.43Å; F804-E813 HydrophobicContact CD1-CB 4.18Å; F804-E813 WeakPolarHBondContact CD1-O 3.4Å; F804-E813 HydrophobicContact CE1-CB 3.56Å; F804-E813 HydrophobicContact CZ-CB 4.15Å; F804-E813 PolarHBondContact N-O 3.47Å; F804-E813 PolarHBondContact O-N 2.82Å; F804-F815 HydrophobicContact CB-CD1 3.89Å; F804-F815 HydrophobicContact CB-CE1 3.81Å; F804-F815 HydrophobicContact CD1-CB 4.24Å; F804-F815 AromaticContact CD1-CD1 3.77Å; F804-F815 HydrophobicContact CD1-CD1 3.77Å; F804-F815 HydrophobicContact CD1-CG 4.3Å; F804-F815 HydrophobicContact CG-CD1 4.2Å; F804-N825 WeakPolarHBondContact CA-OD1 3.31Å; F804-N825 HydrophobicContact CB-CB 4.14Å; F804-N825 WeakPolarHBondContact CB-O 3.09Å
805	F	94	Very high	83.5	Confident	19 Å²	19	73.3 Å²	73.3	8%	0.083	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	111.6	171.5	-174	-100.7	0	0	0	109.4	C787 A807 N810 N825 C833 C837	C787-F805 HydrophobicContact CB-CB 4.32Å; C787-F805 HydrophobicContact CB-CD1 4.31Å; F805-A807 HydrophobicContact CD1-CB 4.28Å; F805-A807 HydrophobicContact CE1-CB 4.27Å; F805-A807 PolarHBondContact O-N 3.3Å; F805-A807 VanDerWaalsContact O-N 3.14Å; F805-N810 HydrophobicContact CZ-CB 4.14Å; F805-N825 PolarHBondContact N-ND2 3.06Å; F805-N825 PolarHBondContact N-OD1 3.39Å; F805-N825 PolarHBondContact O-ND2 3.44Å; F805-C833 PolarHBondContact N-SG 3.26Å; F805-C833 VanDerWaalsContact N-SG 3.4Å; F805-C837 HydrophobicContact CB-CB 3.47Å; F805-C837 VanDerWaalsContact CB-CB 3.47Å; F805-C837 HydrophobicContact CD1-CB 4.19Å; F805-C837 HydrophobicContact CD2-CB 3.44Å; F805-C837 VanDerWaalsContact CD2-CB 3.44Å; F805-C837 HydrophobicContact CE2-CB 4.17Å; F805-C837 HydrophobicContact CG-CB 3.43Å; F805-C837 VanDerWaalsContact CG-CB 3.43Å
806	N	91.2	Very high	84	Confident	24 Å²	24	71 Å²	71	13%	0.128	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	92.4	174.8	-171	-11.6	0	0	0	109.3	F804 H808 V809 N810 R811 E813	F804-N806 HydrophobicContact CD2-CB 4.45Å; F804-N806 HydrophobicContact CE2-CB 3.6Å; F804-N806 HydrophobicContact CZ-CB 3.7Å; F804-N806 PolarHBondContact O-N 2.88Å; N806-H808 PolarHBondContact O-N 2.82Å; N806-H808 PolarHBondContact OD1-N 2.67Å; N806-H808 PolarHBondContact OD1-ND1 3.05Å; N806-V809 HydrophobicContact CB-CB 4.47Å; N806-V809 CarbonylContact O-C 3.38Å; N806-V809 PolarHBondContact O-N 2.84Å; N806-N810 PolarHBondContact O-N 3.46Å; N806-R811 PolarHBondContact N-O 2.04Å; N806-E813 HydrophobicContact CB-CG 4.13Å; N806-E813 PolarHBondContact ND2-OE2 2.86Å
807	A	83.3	Confident	84.3	Confident	45 Å²	45	71 Å²	71	37%	0.372	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.2	-178.7	0	0	0	0	0	114.9	F805	F805-A807 HydrophobicContact CD1-CB 4.28Å; F805-A807 HydrophobicContact CE1-CB 4.27Å; F805-A807 PolarHBondContact O-N 3.3Å; F805-A807 VanDerWaalsContact O-N 3.14Å
808	H	79.7	Confident	85.3	Confident	180 Å²	180	64 Å²	64	83%	0.833	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-23.8	173.4	-55.4	89.6	0	0	0	113	N806	N806-H808 PolarHBondContact O-N 2.82Å; N806-H808 PolarHBondContact OD1-N 2.67Å; N806-H808 PolarHBondContact OD1-ND1 3.05Å
809	V	85.4	Confident	85.9	Confident	75 Å²	75	59.2 Å²	59.2	46%	0.455	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-5.7	-177.1	-165.8	0	0	0	0	111.1	N806 R811	N806-V809 HydrophobicContact CB-CB 4.47Å; N806-V809 CarbonylContact O-C 3.38Å; N806-V809 PolarHBondContact O-N 2.84Å; V809-R811 HydrophobicContact CB-CG 4.12Å; V809-R811 HydrophobicContact CG1-CG 3.86Å; V809-R811 PolarHBondContact O-N 2.91Å
810	N	86.6	Confident	86.4	Confident	117 Å²	117	56.6 Å²	56.6	63%	0.626	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	37.4	-176.3	-71.9	-59.1	0	0	0	114.4	F805 N806	F805-N810 HydrophobicContact CZ-CB 4.14Å; N806-N810 PolarHBondContact O-N 3.46Å
811	R	86.8	Confident	86.6	Confident	137 Å²	137	56.9 Å²	56.9	52%	0.517	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	160.2	176.9	74	-179.6	-177.5	179.2	-0.3	111.3	N806 V809 E813	N806-R811 PolarHBondContact N-O 2.04Å; V809-R811 HydrophobicContact CB-CG 4.12Å; V809-R811 HydrophobicContact CG1-CG 3.86Å; V809-R811 PolarHBondContact O-N 2.91Å; R811-E813 HydrophobicContact CG-CG 3.99Å; R811-E813 IonicContact CZ-OE1 3.6Å; R811-E813 VanDerWaalsContact CZ-OE1 3.25Å; R811-E813 IonicContact NE-OE1 2.82Å; R811-E813 PolarHBondContact NE-OE1 3.34Å; R811-E813 IonicContact NH2-OE1 3.89Å; R811-E813 PolarHBondContact NH2-OE1 2.03Å
812	C	92.2	Very high	86.4	Confident	12 Å²	12	54.2 Å²	54.2	8%	0.081	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134.3	168.5	-72.1	0	0	0	0	111.3	F804 L830 C833 E834	F804-C812 WeakPolarHBondContact O-CA 3.43Å; C812-L830 HydrophobicContact CB-CD1 3.62Å; C812-C833 HydrophobicContact CB-CB 3.72Å; C812-C833 WeakPolarHBondContact CB-SG 2.97Å; C812-C833 WeakPolarHBondContact SG-CB 3.01Å; C812-C833 PolarHBondContact SG-O 2.57Å; C812-C833 CovalentContact SG-SG 2.03Å; C812-C833 PolarHBondContact SG-SG 2.83Å; C812-E834 HydrophobicContact CB-CG 3.8Å; C812-E834 PolarHBondContact SG-N 3.06Å; C812-E834 VanDerWaalsContact SG-N 3.39Å
813	E	88	Confident	86.4	Confident	37 Å²	37	53.5 Å²	53.5	17%	0.173	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.2	177.6	-63.5	-173.5	152.5	0	0	109.1	Y803 F804 N806 R811	Y803-E813 CarbonylContact C-O 3.4Å; Y803-E813 WeakPolarHBondContact CA-O 3.31Å; F804-E813 HydrophobicContact CD1-CB 4.18Å; F804-E813 WeakPolarHBondContact CD1-O 3.4Å; F804-E813 HydrophobicContact CE1-CB 3.56Å; F804-E813 HydrophobicContact CZ-CB 4.15Å; F804-E813 PolarHBondContact N-O 3.47Å; F804-E813 PolarHBondContact O-N 2.82Å; N806-E813 HydrophobicContact CB-CG 4.13Å; N806-E813 PolarHBondContact ND2-OE2 2.86Å; R811-E813 HydrophobicContact CG-CG 3.99Å; R811-E813 IonicContact CZ-OE1 3.6Å; R811-E813 VanDerWaalsContact CZ-OE1 3.25Å; R811-E813 IonicContact NE-OE1 2.82Å; R811-E813 PolarHBondContact NE-OE1 3.34Å; R811-E813 IonicContact NH2-OE1 3.89Å; R811-E813 PolarHBondContact NH2-OE1 2.03Å
814	F	92.2	Very high	86.1	Confident	114 Å²	114	58.3 Å²	58.3	50%	0.5	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	151.1	174.7	78.6	-90.3	0	0	0	111.7	L801 R802 Y803 F816	L801-F814 HydrophobicContact CD1-CB 4.48Å; L801-F814 HydrophobicContact CD1-CD2 3.95Å; L801-F814 HydrophobicContact CD1-CG 4.35Å; L801-F814 HydrophobicContact CD2-CB 4.22Å; L801-F814 HydrophobicContact CG-CB 4.29Å; L801-F814 HydrophobicContact CG-CD2 4.29Å; R802-F814 CarbonylContact O-C 3.46Å; R802-F814 WeakPolarHBondContact O-CA 3.46Å; Y803-F814 HydrophobicContact CD1-CB 3.91Å; Y803-F814 HydrophobicContact CE1-CB 3.76Å; F814-F816 HydrophobicContact CE2-CE2 4.24Å; F814-F816 HydrophobicContact CE2-CZ 4.36Å
815	F	90.7	Very high	86.1	Confident	14 Å²	14	58 Å²	58	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	153.7	168.2	77.2	-74.5	0	0	0	110.2	K791 M792 R802 F804 Y817 N825 N826	K791-F815 HydrophobicContact CB-CB 4.29Å; K791-F815 HydrophobicContact CB-CD1 4.43Å; K791-F815 HydrophobicContact CB-CD2 4.27Å; K791-F815 HydrophobicContact CB-CG 4.09Å; K791-F815 HydrophobicContact CD-CB 4.13Å; M792-F815 WeakPolarHBondContact O-CE2 3.4Å; R802-F815 HydrophobicContact CB-CD1 4.07Å; R802-F815 HydrophobicContact CB-CE1 3.62Å; R802-F815 HydrophobicContact CB-CZ 3.96Å; R802-F815 PolarHBondContact N-O 2.93Å; R802-F815 PolarHBondContact O-N 3.34Å; R802-F815 VanDerWaalsContact O-O 3.1Å; F804-F815 HydrophobicContact CB-CD1 3.89Å; F804-F815 HydrophobicContact CB-CE1 3.81Å; F804-F815 HydrophobicContact CD1-CB 4.24Å; F804-F815 AromaticContact CD1-CD1 3.77Å; F804-F815 HydrophobicContact CD1-CD1 3.77Å; F804-F815 HydrophobicContact CD1-CG 4.3Å; F804-F815 HydrophobicContact CG-CD1 4.2Å; F815-Y817 HydrophobicContact CE2-CD2 4.4Å; F815-Y817 PolarHBondContact O-N 3.46Å; F815-N825 WeakPolarHBondContact CE1-O 3.07Å; F815-N826 HydrophobicContact CZ-CB 4.21Å; F815-N826 WeakPolarHBondContact CZ-OD1 3.1Å
816	F	88.5	Confident	86.1	Confident	106 Å²	106	58.5 Å²	58.5	47%	0.465	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	104.5	170.5	-65.3	-70.9	0	0	0	109.5	Y799 F814	Y799-F816 HydrophobicContact CD1-CB 3.97Å; Y799-F816 HydrophobicContact CD1-CD1 4.33Å; Y799-F816 HydrophobicContact CD1-CG 4.16Å; F814-F816 HydrophobicContact CE2-CE2 4.24Å; F814-F816 HydrophobicContact CE2-CZ 4.36Å
817	Y	85.7	Confident	86.2	Confident	23 Å²	23	57.8 Å²	57.8	9%	0.09	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	138	164.8	174.6	-119.2	0	0	0	109.1	E800 R802 F815 G819 C820 G821 N826	E800-Y817 HydrophobicContact CB-CD1 4.28Å; E800-Y817 PolarHBondContact N-O 2.79Å; E800-Y817 PolarHBondContact O-N 2.78Å; R802-Y817 VanDerWaalsContact CG-CB 3.49Å; R802-Y817 HydrophobicContact CG-CD1 4.15Å; R802-Y817 HydrophobicContact CG-CG 4.11Å; R802-Y817 VanDerWaalsContact NH2-CE1 3.33Å; F815-Y817 HydrophobicContact CE2-CD2 4.4Å; F815-Y817 PolarHBondContact O-N 3.46Å; Y817-G819 VanDerWaalsContact CE1-CA 3.44Å; Y817-G819 WeakPolarHBondContact CE1-O 3.4Å; Y817-G819 PolarHBondContact O-N 3.4Å; Y817-C820 VanDerWaalsContact OH-CA 3.23Å; Y817-C820 WeakPolarHBondContact OH-CA 3.1Å; Y817-G821 WeakPolarHBondContact CE2-O 3.06Å; Y817-G821 PolarHBondContact OH-O 2.88Å; Y817-G821 VanDerWaalsContact OH-O 3.08Å; Y817-N826 WeakPolarHBondContact CD2-ND2 3.09Å; Y817-N826 WeakPolarHBondContact CE2-ND2 3.26Å
818	S	78.1	Confident	86.4	Confident	4 Å²	4	63.1 Å²	63.1	3%	0.028	32%	0.316	C	S	.	.			trans	-78.7	8.4	-175.1	63.8	0	0	0	0	115	R793 G794 N795 C796 K798 C820	R793-S818 WeakPolarHBondContact O-CB 3.07Å; R793-S818 PolarHBondContact O-N 2.83Å; R793-S818 PolarHBondContact O-OG 2.8Å; G794-S818 WeakPolarHBondContact CA-OG 3.4Å; G794-S818 PolarHBondContact O-OG 2.86Å; N795-S818 PolarHBondContact N-OG 3.05Å; C796-S818 CarbonylContact C-O 3.52Å; C796-S818 WeakPolarHBondContact CB-O 3Å; C796-S818 PolarHBondContact N-OG 2.99Å; C796-S818 VanDerWaalsContact N-OG 3.15Å; C796-S818 WeakPolarHBondContact O-CB 3.13Å; K798-S818 PolarHBondContact N-O 3.27Å; K798-S818 VanDerWaalsContact N-O 3.11Å; K798-S818 CarbonylContact O-C 3.59Å; K798-S818 WeakPolarHBondContact O-CA 3.46Å; S818-C820 PolarHBondContact O-N 2.82Å; S818-C820 PolarHBondContact OG-O 2.84Å
819	G	74.9	Confident	86.6	Confident	24 Å²	24	57.8 Å²	57.8	25%	0.247	30%	0.296	C	S	.	.	S	Bend	trans	83	-19.8	-177.3	0	0	0	0	0	114.4	K798 Y817	K798-G819 PolarHBondContact O-N 2.7Å; Y817-G819 VanDerWaalsContact CE1-CA 3.44Å; Y817-G819 WeakPolarHBondContact CE1-O 3.4Å; Y817-G819 PolarHBondContact O-N 3.4Å
820	C	77.5	Confident	86.4	Confident	31 Å²	31	57.3 Å²	57.3	21%	0.209	29%	0.291	C	S	.	.	S	Bend	trans	-152.9	152.1	169.8	33.8	0	0	0	0	114.7	R658 N795 C796 Y817 S818	R658-C820 PolarHBondContact NH1-SG 2.04Å; R658-C820 VanDerWaalsContact NH1-SG 3.4Å; N795-C820 PolarHBondContact N-O 2.82Å; C796-C820 HydrophobicContact CB-CB 4.1Å; C796-C820 WeakPolarHBondContact CB-SG 3.33Å; C796-C820 WeakPolarHBondContact SG-CB 3.25Å; C796-C820 CovalentContact SG-SG 2.03Å; C796-C820 PolarHBondContact SG-SG 2.87Å; Y817-C820 VanDerWaalsContact OH-CA 3.23Å; Y817-C820 WeakPolarHBondContact OH-CA 3.1Å; S818-C820 PolarHBondContact O-N 2.82Å; S818-C820 PolarHBondContact OG-O 2.84Å
821	G	81.1	Confident	85.9	Confident	49 Å²	49	55.8 Å²	55.8	51%	0.505	29%	0.289	S	S	.	.			trans	95.2	-137.6	-168.6	0	0	0	0	0	109.4	Y817	Y817-G821 WeakPolarHBondContact CE2-O 3.06Å; Y817-G821 PolarHBondContact OH-O 2.88Å; Y817-G821 VanDerWaalsContact OH-O 3.08Å
822	G	80.3	Confident	85.8	Confident	22 Å²	22	52.7 Å²	52.7	23%	0.227	28%	0.281	C	S	.	.			trans	74.2	-173.3	179.3	0	0	0	0	0	113.1	M792	M792-G822 WeakPolarHBondContact O-CA 3.38Å; M792-G822 VanDerWaalsContact SD-CA 3.51Å
823	N	89.6	Confident	85.8	Confident	31 Å²	31	52.1 Å²	52.1	17%	0.166	28%	0.277	C	S	.	.			trans	-131.6	-167.1	176.4	61.5	25.3	0	0	0	109.1	Q789 P790 M792 N825 N826	Q789-N823 HydrophobicContact CB-CB 4.41Å; P790-N823 PolarHBondContact O-ND2 2.78Å; P790-N823 PolarHBondContact O-OD1 3.29Å; M792-N823 HydrophobicContact CB-CB 4.45Å; M792-N823 WeakPolarHBondContact CB-ND2 3.4Å; M792-N823 HydrophobicContact CE-CB 4.26Å; M792-N823 HydrophobicContact SD-CB 4.44Å; N823-N825 VanDerWaalsContact C-N 3.31Å; N823-N825 PolarHBondContact O-N 2.86Å; N823-N825 PolarHBondContact OD1-N 3.45Å; N823-N826 WeakPolarHBondContact O-CB 3.37Å
824	R	88.5	Confident	85.7	Confident	155 Å²	155	54.1 Å²	54.1	59%	0.585	29%	0.286	S	S	*	.	S	Bend	trans	-78.3	-10.7	-174.9	-63.9	-176	179.9	169.8	-0.3	113.8	T783 S786 N826	T783-R824 PolarHBondContact OG1-NH1 2.65Å; S786-R824 VanDerWaalsContact CB-CB 3.46Å; S786-R824 WeakPolarHBondContact OG-CB 3.28Å; S786-R824 VanDerWaalsContact OG-CD 3.23Å; S786-R824 WeakPolarHBondContact OG-CD 3.03Å; R824-N826 PolarHBondContact O-N 3.16Å
825	N	93.6	Very high	85.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.298	C	S	.	.			trans	-81.5	63.7	175.7	-148.4	-6.5	0	0	0	110.9	S786 C787 Q789 F804 F805 F815 N823 F827	S786-N825 VanDerWaalsContact O-CA 3.29Å; S786-N825 WeakPolarHBondContact O-CA 3.24Å; S786-N825 WeakPolarHBondContact O-CB 3.44Å; S786-N825 VanDerWaalsContact O-CG 3.3Å; S786-N825 PolarHBondContact O-N 3.35Å; C787-N825 PolarHBondContact O-ND2 2.03Å; C787-N825 VanDerWaalsContact O-ND2 3.11Å; Q789-N825 HydrophobicContact CB-CB 4.22Å; Q789-N825 WeakPolarHBondContact O-CB 3.42Å; Q789-N825 PolarHBondContact O-ND2 3.49Å; F804-N825 WeakPolarHBondContact CA-OD1 3.31Å; F804-N825 HydrophobicContact CB-CB 4.14Å; F804-N825 WeakPolarHBondContact CB-O 3.09Å; F805-N825 PolarHBondContact N-ND2 3.06Å; F805-N825 PolarHBondContact N-OD1 3.39Å; F805-N825 PolarHBondContact O-ND2 3.44Å; F815-N825 WeakPolarHBondContact CE1-O 3.07Å; N823-N825 VanDerWaalsContact C-N 3.31Å; N823-N825 PolarHBondContact O-N 2.86Å; N823-N825 PolarHBondContact OD1-N 3.45Å; N825-F827 WeakPolarHBondContact OD1-CE2 3.25Å
826	N	94.2	Very high	84.9	Confident	29 Å²	29	57.5 Å²	57.5	16%	0.155	31%	0.307	C	S	.	.			trans	-152.8	57.5	-156.6	-166.5	2.1	0	0	0	112.6	R802 F815 Y817 N823 R824	R802-N826 WeakPolarHBondContact CB-OD1 3.44Å; R802-N826 WeakPolarHBondContact CD-O 3.06Å; R802-N826 WeakPolarHBondContact CD-OD1 3.49Å; R802-N826 WeakPolarHBondContact CG-OD1 3.25Å; R802-N826 PolarHBondContact NE-O 3.14Å; R802-N826 PolarHBondContact NE-OD1 3.05Å; F815-N826 HydrophobicContact CZ-CB 4.21Å; F815-N826 WeakPolarHBondContact CZ-OD1 3.1Å; Y817-N826 WeakPolarHBondContact CD2-ND2 3.09Å; Y817-N826 WeakPolarHBondContact CE2-ND2 3.26Å; N823-N826 WeakPolarHBondContact O-CB 3.37Å; R824-N826 PolarHBondContact O-N 3.16Å
827	F	92.8	Very high	84.8	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.035	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-82.6	149.2	-173.1	-55.1	-77.7	0	0	0	112.9	P782 R802 Y803 N825 Q832 C833 F836 C837	P782-F827 HydrophobicContact CG-CE1 4.18Å; R802-F827 CarbonylContact C-O 3.48Å; R802-F827 VanDerWaalsContact CA-O 3.23Å; R802-F827 WeakPolarHBondContact CA-O 3.08Å; R802-F827 WeakPolarHBondContact CB-O 3.47Å; R802-F827 WeakPolarHBondContact CD-O 3.23Å; Y803-F827 PolarHBondContact N-O 3.4Å; Y803-F827 WeakPolarHBondContact O-CD2 3.47Å; Y803-F827 PolarHBondContact O-N 3.18Å; N825-F827 WeakPolarHBondContact OD1-CE2 3.25Å; F827-Q832 HydrophobicContact CB-CB 4.32Å; F827-Q832 HydrophobicContact CB-CG 4.36Å; F827-Q832 HydrophobicContact CD1-CG 3.99Å; F827-C833 HydrophobicContact CB-CB 3.84Å; F827-C833 HydrophobicContact CD2-CB 3.41Å; F827-C833 VanDerWaalsContact CD2-CB 3.41Å; F827-C833 VanDerWaalsContact CD2-SG 3.59Å; F827-C833 HydrophobicContact CE2-CB 4.14Å; F827-C833 HydrophobicContact CG-CB 3.73Å; F827-F836 AromaticContact CD1-CD2 3.92Å; F827-F836 HydrophobicContact CD1-CD2 3.92Å; F827-F836 HydrophobicContact CE1-CB 3.96Å; F827-F836 AromaticContact CE1-CD2 3.57Å; F827-F836 HydrophobicContact CE1-CD2 3.57Å; F827-F836 HydrophobicContact CE1-CG 4.2Å; F827-F836 HydrophobicContact CZ-CB 4.18Å; F827-C837 VanDerWaalsContact CE2-SG 3.51Å; F827-C837 WeakPolarHBondContact CZ-SG 3.06Å
828	K	87.5	Confident	84.4	Confident	158 Å²	158	53.6 Å²	53.6	69%	0.687	30%	0.296	S	S	*	.	S	Bend	trans	-77.7	-30.6	-177.4	-167.8	-175.7	175.6	-169.2	0	113.1
829	T	84.1	Confident	83.5	Confident	67 Å²	67	60.7 Å²	60.7	41%	0.411	33%	0.327	S	S	.	.	S	Bend	trans	-132.8	161.6	179.8	66.8	0	0	0	0	111.4	Q832 C833	T829-Q832 PolarHBondContact O-N 2.03Å; T829-Q832 VanDerWaalsContact OG1-CB 3.3Å; T829-Q832 WeakPolarHBondContact OG1-CB 3.44Å; T829-Q832 PolarHBondContact OG1-N 3.24Å; T829-C833 PolarHBondContact O-N 3.1Å
830	L	81.9	Confident	82.1	Confident	65 Å²	65	68.9 Å²	68.9	34%	0.34	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-52.7	177.1	179.4	59.7	0	0	0	110.5	Y803 C812 Q832 C833 E834	Y803-L830 HydrophobicContact CD1-CB 3.93Å; Y803-L830 HydrophobicContact CD1-CD1 3.72Å; Y803-L830 HydrophobicContact CD1-CG 4.43Å; Y803-L830 VanDerWaalsContact CD2-N 3.34Å; Y803-L830 HydrophobicContact CE1-CB 3.64Å; Y803-L830 HydrophobicContact CE1-CD1 3.93Å; Y803-L830 HydrophobicContact CE1-CG 4.28Å; Y803-L830 HydrophobicContact CE2-CB 4.38Å; Y803-L830 VanDerWaalsContact CE2-N 3.35Å; Y803-L830 HydrophobicContact CG-CB 4.41Å; C812-L830 HydrophobicContact CB-CD1 3.62Å; L830-Q832 PolarHBondContact O-N 3.34Å; L830-C833 WeakPolarHBondContact O-CA 3.49Å; L830-C833 WeakPolarHBondContact O-CB 3.42Å; L830-C833 PolarHBondContact O-N 3.19Å; L830-E834 HydrophobicContact CD1-CG 4.13Å; L830-E834 HydrophobicContact CG-CG 4.38Å; L830-E834 PolarHBondContact O-N 2.04Å
831	S	76.6	Confident	79.9	Confident	85 Å²	85	77.6 Å²	77.6	59%	0.594	38%	0.384	S	S	*	.	H	α-helix	trans	-56.6	-34.6	178.8	-34.9	0	0	0	0	112.8	E834 L835	S831-E834 PolarHBondContact O-N 2.99Å; S831-L835 WeakPolarHBondContact O-CB 3.3Å; S831-L835 PolarHBondContact O-N 2.69Å
832	Q	84.2	Confident	77.6	Confident	73 Å²	73	81.1 Å²	81.1	34%	0.341	40%	0.398	S	S	.	.	H	α-helix	trans	-67.2	-41.9	175.3	-170.1	-173.3	29.1	0	0	111.6	F827 T829 L830 F836	F827-Q832 HydrophobicContact CB-CB 4.32Å; F827-Q832 HydrophobicContact CB-CG 4.36Å; F827-Q832 HydrophobicContact CD1-CG 3.99Å; T829-Q832 PolarHBondContact O-N 2.03Å; T829-Q832 VanDerWaalsContact OG1-CB 3.3Å; T829-Q832 WeakPolarHBondContact OG1-CB 3.44Å; T829-Q832 PolarHBondContact OG1-N 3.24Å; L830-Q832 PolarHBondContact O-N 3.34Å; Q832-F836 HydrophobicContact CG-CD2 3.82Å; Q832-F836 HydrophobicContact CG-CE2 3.56Å; Q832-F836 WeakPolarHBondContact O-CD2 3.18Å; Q832-F836 PolarHBondContact O-N 3.37Å
833	C	91.5	Very high	74.9	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-64.3	-45.2	174.7	178.6	0	0	0	0	111.5	F805 C812 F827 T829 L830 F836 C837	F805-C833 PolarHBondContact N-SG 3.26Å; F805-C833 VanDerWaalsContact N-SG 3.4Å; C812-C833 HydrophobicContact CB-CB 3.72Å; C812-C833 WeakPolarHBondContact CB-SG 2.97Å; C812-C833 WeakPolarHBondContact SG-CB 3.01Å; C812-C833 PolarHBondContact SG-O 2.57Å; C812-C833 CovalentContact SG-SG 2.03Å; C812-C833 PolarHBondContact SG-SG 2.83Å; F827-C833 HydrophobicContact CB-CB 3.84Å; F827-C833 HydrophobicContact CD2-CB 3.41Å; F827-C833 VanDerWaalsContact CD2-CB 3.41Å; F827-C833 VanDerWaalsContact CD2-SG 3.59Å; F827-C833 HydrophobicContact CE2-CB 4.14Å; F827-C833 HydrophobicContact CG-CB 3.73Å; T829-C833 PolarHBondContact O-N 3.1Å; L830-C833 WeakPolarHBondContact O-CA 3.49Å; L830-C833 WeakPolarHBondContact O-CB 3.42Å; L830-C833 PolarHBondContact O-N 3.19Å; C833-F836 PolarHBondContact O-N 2.03Å; C833-C837 VanDerWaalsContact O-CB 3.3Å; C833-C837 WeakPolarHBondContact O-CB 3.5Å; C833-C837 PolarHBondContact O-N 2.75Å
834	E	86.2	Confident	72.2	Confident	78 Å²	78	90.2 Å²	90.2	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-68.1	-43.7	-176.6	-67.8	177.6	146.4	0	0	111.5	C812 L830 S831 F836 C837 S838	C812-E834 HydrophobicContact CB-CG 3.8Å; C812-E834 PolarHBondContact SG-N 3.06Å; C812-E834 VanDerWaalsContact SG-N 3.39Å; L830-E834 HydrophobicContact CD1-CG 4.13Å; L830-E834 HydrophobicContact CG-CG 4.38Å; L830-E834 PolarHBondContact O-N 2.04Å; S831-E834 PolarHBondContact O-N 2.99Å; E834-F836 VanDerWaalsContact C-N 3.29Å; E834-F836 PolarHBondContact O-N 3.16Å; E834-C837 PolarHBondContact O-N 3.38Å; E834-S838 WeakPolarHBondContact O-CA 3.38Å; E834-S838 WeakPolarHBondContact O-CB 3.05Å; E834-S838 PolarHBondContact O-N 3.47Å
835	L	81.3	Confident	69.2	Low	144 Å²	144	90 Å²	90	75%	0.754	46%	0.458	S	S	*	.	H	α-helix	trans	-59.7	-35.7	176.7	-176.8	64.8	0	0	0	113.1	S831	S831-L835 WeakPolarHBondContact O-CB 3.3Å; S831-L835 PolarHBondContact O-N 2.69Å
836	F	84.3	Confident	66.2	Low	56 Å²	56	96.9 Å²	96.9	25%	0.246	49%	0.494	C	S	.	.	H	α-helix	trans	-90.4	-25.6	-179.4	-68.1	-49.4	0	0	0	114.6	L781 P782 F827 Q832 C833 E834	L781-F836 HydrophobicContact CB-CD1 4.47Å; L781-F836 HydrophobicContact CB-CE1 4.44Å; L781-F836 HydrophobicContact CD2-CD1 4.19Å; L781-F836 HydrophobicContact CD2-CE1 3.7Å; P782-F836 HydrophobicContact CG-CD1 4.35Å; P782-F836 HydrophobicContact CG-CD2 3.98Å; P782-F836 HydrophobicContact CG-CE2 4.2Å; P782-F836 HydrophobicContact CG-CG 4.07Å; P782-F836 HydrophobicContact CG-CZ 4.49Å; F827-F836 AromaticContact CD1-CD2 3.92Å; F827-F836 HydrophobicContact CD1-CD2 3.92Å; F827-F836 HydrophobicContact CE1-CB 3.96Å; F827-F836 AromaticContact CE1-CD2 3.57Å; F827-F836 HydrophobicContact CE1-CD2 3.57Å; F827-F836 HydrophobicContact CE1-CG 4.2Å; F827-F836 HydrophobicContact CZ-CB 4.18Å; Q832-F836 HydrophobicContact CG-CD2 3.82Å; Q832-F836 HydrophobicContact CG-CE2 3.56Å; Q832-F836 WeakPolarHBondContact O-CD2 3.18Å; Q832-F836 PolarHBondContact O-N 3.37Å; C833-F836 PolarHBondContact O-N 2.03Å; E834-F836 VanDerWaalsContact C-N 3.29Å; E834-F836 PolarHBondContact O-N 3.16Å
837	C	87	Confident	62.9	Low	6 Å²	6	104.9 Å²	104.9	4%	0.041	53%	0.527	C	S	.	.	H	α-helix	trans	-121.3	-28.5	-170.7	-59.4	0	0	0	0	115.5	C787 F805 F827 C833 E834 K839	C787-C837 HydrophobicContact CB-CB 3.64Å; C787-C837 WeakPolarHBondContact CB-SG 3.08Å; C787-C837 WeakPolarHBondContact SG-CA 3.45Å; C787-C837 WeakPolarHBondContact SG-CB 3.24Å; C787-C837 CovalentContact SG-SG 2.03Å; C787-C837 PolarHBondContact SG-SG 2.04Å; F805-C837 HydrophobicContact CB-CB 3.47Å; F805-C837 VanDerWaalsContact CB-CB 3.47Å; F805-C837 HydrophobicContact CD1-CB 4.19Å; F805-C837 HydrophobicContact CD2-CB 3.44Å; F805-C837 VanDerWaalsContact CD2-CB 3.44Å; F805-C837 HydrophobicContact CE2-CB 4.17Å; F805-C837 HydrophobicContact CG-CB 3.43Å; F805-C837 VanDerWaalsContact CG-CB 3.43Å; F827-C837 VanDerWaalsContact CE2-SG 3.51Å; F827-C837 WeakPolarHBondContact CZ-SG 3.06Å; C833-C837 VanDerWaalsContact O-CB 3.3Å; C833-C837 WeakPolarHBondContact O-CB 3.5Å; C833-C837 PolarHBondContact O-N 2.75Å; E834-C837 PolarHBondContact O-N 3.38Å; C837-K839 PolarHBondContact O-N 2.89Å; C837-K839 VanDerWaalsContact O-N 3.11Å
838	S	76.4	Confident	59.6	Low	40 Å²	40	108 Å²	108	28%	0.28	56%	0.561	S	S	.	*			trans	-78.6	97.2	177.5	-62.7	0	0	0	0	109.3	E834 K840	E834-S838 WeakPolarHBondContact O-CA 3.38Å; E834-S838 WeakPolarHBondContact O-CB 3.05Å; E834-S838 PolarHBondContact O-N 3.47Å; S838-K840 PolarHBondContact O-N 2.87Å
839	K	60.2	Low	56.5	Low	154 Å²	154	105.4 Å²	105.4	67%	0.67	56%	0.563	S	S	*	*			trans	-63.9	22.4	-172.2	-61.4	-162.7	-177.1	-165.9	0	117	E784 C837 R841	E784-K839 WeakPolarHBondContact OE1-CE 3.45Å; E784-K839 IonicContact OE1-NZ 2.7Å; E784-K839 PolarHBondContact OE1-NZ 3.06Å; E784-K839 IonicContact OE2-NZ 2.79Å; E784-K839 PolarHBondContact OE2-NZ 2.99Å; C837-K839 PolarHBondContact O-N 2.89Å; C837-K839 VanDerWaalsContact O-N 3.11Å; K839-R841 PolarHBondContact O-N 2.89Å
840	K	46.2	Very low	53.5	Low	196 Å²	196	106.7 Å²	106.7	85%	0.852	58%	0.575	S	S	*	*			trans	-80.8	87.3	169.1	-71.9	-173	176.4	-177.4	0	110.1	S838	S838-K840 PolarHBondContact O-N 2.87Å
841	R	31.3	Very low	50.8	Low	213 Å²	213	111 Å²	111	80%	0.804	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-66.8	131.9	171.7	-70	-176.8	175.8	-175.8	-1.6	111.4	K839	K839-R841 PolarHBondContact O-N 2.89Å
842	P	31.3	Very low	48.2	Very low	124 Å²	124	114.7 Å²	114.7	81%	0.805	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-72.6	124.1	149.6	-8.2	26.2	0	0	0	108.3
843	N	24.4	Very low	45.3	Very low	121 Å²	121	115 Å²	115	65%	0.647	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-94.9	127.3	175.2	-81.4	-5.4	0	0	0	110.2
844	P	31.5	Very low	42.1	Very low	122 Å²	122	121.8 Å²	121.8	79%	0.792	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-66.8	137.6	162.7	-15.9	30.7	0	0	0	110.5
845	L	25.8	Very low	40.6	Very low	152 Å²	152	123.5 Å²	123.5	80%	0.796	69%	0.686	S	S	*	*			trans	-139.7	161.3	168.5	-75.2	178.3	0	0	0	109.3
846	L	30.5	Very low	37.8	Very low	144 Å²	144	127 Å²	127	75%	0.754	70%	0.696	S	S	*	*	S	Bend	trans	76.4	106.2	-163.8	-64.2	83.4	0	0	0	113.8
847	F	25.2	Very low	35.4	Very low	197 Å²	197	128.9 Å²	128.9	86%	0.864	72%	0.716	S	S	*	*	S	Bend	cis	-155.7	145.7	-10.7	-98	-59.7	0	0	0	109.6
848	G	23.2	Very low	33	Very low	72 Å²	72	133.7 Å²	133.7	74%	0.742	75%	0.75	S	S	*	*			trans	135.7	120.4	165.8	0	0	0	0	0	115.1
849	S	23.5	Very low	30.8	Very low	105 Å²	105	139.7 Å²	139.7	73%	0.734	77%	0.773	S	S	*	*			trans	-33.9	142.3	170.7	-119.2	0	0	0	0	115
850	S	21.1	Very low	29.4	Very low	94 Å²	94	137 Å²	137	66%	0.657	77%	0.77	S	S	*	*			cis	57.5	100.1	48.1	-50.6	0	0	0	0	113.7
851	D	24.3	Very low	28.6	Very low	155 Å²	155	133.9 Å²	133.9	83%	0.829	75%	0.753	S	S	*	*				175.8	173	119	-78.2	-10.5	0	0	0	111.5
852	D	22.6	Very low	28.4	Very low	163 Å²	163	124.3 Å²	124.3	87%	0.872	72%	0.722	S	S	*	*			trans	-72.5	164.9	-156.7	-68.4	-70.8	0	0	0	119.9
853	A	23.4	Very low	28.2	Very low	80 Å²	80	120.9 Å²	120.9	66%	0.661	70%	0.7	S	S	*	*				131.8	83.8	123.6	0	0	0	0	0	121.4
854	T	23.6	Very low	28.3	Very low	142 Å²	142	118.1 Å²	118.1	87%	0.871	69%	0.688	S	S	*	*			trans	69.6	164.6	133.1	60.3	0	0	0	0	121.2
855	P	56.5	Low	27.9	Very low	114 Å²	114	119.1 Å²	119.1	74%	0.74	68%	0.682	S	S	*	*			trans	-125.9	166.3	-140.1	44.4	-34.9	0	0	0	119.9
856	F	20.7	Very low	27.9	Very low	217 Å²	217	117.7 Å²	117.7	95%	0.952	68%	0.68	S	S	*	*			trans	-162.2	-168.4	163.3	-112.2	-74.2	0	0	0	113.7
857	S	34.4	Very low	27.5	Very low	95 Å²	95	117.9 Å²	117.9	66%	0.664	69%	0.687	S	S	*	*			trans	-146.1	154.9	-158.9	60.1	0	0	0	0	119.9
858	S	37.4	Very low	27.4	Very low	108 Å²	108	117 Å²	117	76%	0.755	69%	0.685	S	S	*	*			trans	76.4	138	150.5	61.5	0	0	0	0	125.9
859	E	29.4	Very low	27.4	Very low	165 Å²	165	118.6 Å²	118.6	77%	0.771	68%	0.684	S	S	*	*			trans	101.7	141.4	152.6	-54.9	-150.9	163	0	0	125.4
860	T	30.7	Very low	27.6	Very low	98 Å²	98	118.9 Å²	118.9	60%	0.601	68%	0.684	S	S	*	*			trans	67.7	179.5	152.4	33.3	0	0	0	0	126.7	F765	F765-T860 HydrophobicContact CE1-CG2 4.14Å; F765-T860 WeakPolarHBondContact CE1-OG1 3.06Å
861	Y	30.3	Very low	27.6	Very low	130 Å²	130	119.9 Å²	119.9	51%	0.51	69%	0.691	S	S	.	*			trans	-74.8	170.9	-157.5	-88.5	-138	0	0	0	117.4	S762 L1259	S762-Y861 WeakPolarHBondContact OG-CD1 3.1Å; Y861-L1259 HydrophobicContact CE1-CD1 3.71Å
862	G	26	Very low	27.4	Very low	13 Å²	13	116.7 Å²	116.7	13%	0.134	69%	0.686	C	S	.	*			trans	-157.7	-71	-171.8	0	0	0	0	0	126.9	S762 K763 L766	S762-G862 VanDerWaalsContact C-C 3.49Å; S762-G862 CarbonylContact C-O 3.48Å; S762-G862 VanDerWaalsContact CB-C 3.49Å; S762-G862 CarbonylContact O-C 3.39Å; K763-G862 VanDerWaalsContact CA-O 3.25Å; K763-G862 WeakPolarHBondContact CA-O 3.2Å; K763-G862 PolarHBondContact N-O 3.31Å; L766-G862 VanDerWaalsContact CD1-CA 3.49Å
863	S	27.3	Very low	27.4	Very low	51 Å²	51	116.1 Å²	116.1	36%	0.357	68%	0.683	S	S	.	*			trans	44.3	156.3	177.8	86.2	0	0	0	0	127.3	D760 S762 K763	D760-S863 PolarHBondContact OD1-OG 2.95Å; S762-S863 VanDerWaalsContact C-OG 3.27Å; S762-S863 VanDerWaalsContact CA-OG 3.31Å; S762-S863 WeakPolarHBondContact CA-OG 3.45Å; S762-S863 WeakPolarHBondContact CB-OG 3.17Å; S762-S863 PolarHBondContact N-OG 3.31Å; K763-S863 PolarHBondContact N-OG 2.04Å
864	T	26.6	Very low	27.3	Very low	64 Å²	64	116.3 Å²	116.3	39%	0.393	68%	0.684	S	S	.	*			trans	56.4	156.5	150.4	55.4	0	0	0	0	126.8	D760 K763	D760-T864 HydrophobicContact CB-CG2 3.93Å; D760-T864 WeakPolarHBondContact OD1-CB 3.3Å; D760-T864 WeakPolarHBondContact OD1-CG2 3.06Å; D760-T864 PolarHBondContact OD1-OG1 2.85Å; D760-T864 WeakPolarHBondContact OD2-CB 3.33Å; D760-T864 WeakPolarHBondContact OD2-CG2 3.39Å; D760-T864 PolarHBondContact OD2-OG1 2.99Å; K763-T864 WeakPolarHBondContact CD-O 2.99Å; K763-T864 WeakPolarHBondContact CD-OG1 3.49Å; K763-T864 VanDerWaalsContact CE-O 3.24Å; K763-T864 WeakPolarHBondContact CE-O 3.31Å; K763-T864 PolarHBondContact NZ-O 3.23Å
865	E	24.4	Very low	27.3	Very low	143 Å²	143	119.5 Å²	119.5	67%	0.668	68%	0.682	S	S	*	*			trans	56.3	98.2	159.7	-80.5	-163.9	153.6	0	0	120.5	K763	K763-E865 PolarHBondContact NZ-O 3.34Å
866	T	25.9	Very low	25.6	Very low	122 Å²	122	116.6 Å²	116.6	75%	0.748	67%	0.668	S	S	*	*				46.5	114.1	120.7	46.3	0	0	0	0	121.4
867	V	20.8	Very low	25.9	Very low	148 Å²	148	110.2 Å²	110.2	90%	0.897	65%	0.648	S	S	*	*				-149.1	160.8	117.7	-163.9	0	0	0	0	108.2
868	H	24.2	Very low	25.6	Very low	178 Å²	178	107.4 Å²	107.4	82%	0.824	63%	0.634	S	S	*	*			trans	-68.3	165.2	161.9	-86.4	-81.9	0	0	0	113
869	S	23.1	Very low	25.1	Very low	105 Å²	105	106 Å²	106	73%	0.734	62%	0.624	S	S	*	*			trans	-24.3	157.9	165.8	-47	0	0	0	0	119
870	P	27.9	Very low	25.1	Very low	112 Å²	112	105.6 Å²	105.6	73%	0.727	62%	0.622	S	S	*	*			cis	-138.6	-175.6	-27.2	38.5	-20.5	0	0	0	114.3
871	S	19.4	Very low	25	Very low	115 Å²	115	107.5 Å²	107.5	80%	0.804	63%	0.627	S	S	*	*			trans	82.5	136.1	158	-62	0	0	0	0	121.5
872	A	21.1	Very low	24.6	Very low	87 Å²	87	106.3 Å²	106.3	72%	0.719	64%	0.636	S	S	*	*			trans	81.9	133.1	151.4	0	0	0	0	0	121.6
873	N	21.5	Very low	24.7	Very low	152 Å²	152	111.4 Å²	111.4	81%	0.813	67%	0.669	S	S	*	*			trans	51.1	104.6	149.2	-54.9	-17.2	0	0	0	118.6
874	A	21.2	Very low	24.6	Very low	83 Å²	83	111.6 Å²	111.6	69%	0.686	68%	0.679	S	S	*	*				70.6	115.1	71.5	0	0	0	0	0	115.2
875	Y	23.6	Very low	24.4	Very low	210 Å²	210	117 Å²	117	82%	0.824	70%	0.7	S	S	*	*				-172.1	162.6	121.8	-112.6	-81.1	0	0	0	110.7	H770	H770-Y875 PolarHBondContact ND1-O 3.43Å
876	A	22.4	Very low	24.3	Very low	53 Å²	53	113.5 Å²	113.5	44%	0.438	69%	0.691	S	S	.	*			trans	-92.7	163.1	171.1	0	0	0	0	0	110.8	H770	H770-A876 HydrophobicContact CB-CB 4.09Å; H770-A876 WeakPolarHBondContact ND1-CA 3.41Å
877	P	26.3	Very low	24	Very low	83 Å²	83	113.7 Å²	113.7	54%	0.539	68%	0.679	S	S	.	*				-152.9	166.3	68.6	41.3	-21.2	0	0	0	118.8	H770	H770-P877 PolarHBondContact CD2-O 2.87Å; H770-P877 WeakPolarHBondContact NE2-CD 3.06Å
878	G	27.5	Very low	24.1	Very low	36 Å²	36	112.9 Å²	112.9	37%	0.371	67%	0.665	S	S	.	*				93.3	107.7	113.7	0	0	0	0	0	121.9
879	S	27.2	Very low	24	Very low	78 Å²	78	108 Å²	108	55%	0.545	65%	0.651	S	S	.	*			trans	75.3	156	132.5	84.8	0	0	0	0	118.8	V769	V769-S879 VanDerWaalsContact CG2-O 3.24Å; V769-S879 WeakPolarHBondContact CG2-O 3.09Å
880	H	29.1	Very low	24.2	Very low	157 Å²	157	108.4 Å²	108.4	73%	0.727	64%	0.641	S	S	*	*			cis	-165	145.3	19.3	-133.7	-47.4	0	0	0	111.7
881	L	28.6	Very low	24.3	Very low	137 Å²	137	111 Å²	111	72%	0.717	65%	0.649	S	S	*	*			trans	68.2	158.8	159.1	-62.9	150.8	0	0	0	117.7
882	P	22.9	Very low	24.6	Very low	106 Å²	106	107.4 Å²	107.4	69%	0.688	63%	0.63	S	S	*	*				-140.4	-170.2	-51.3	40.7	-23.7	0	0	0	113.5
883	S	27.2	Very low	24.6	Very low	119 Å²	119	107.7 Å²	107.7	83%	0.832	62%	0.619	S	S	*	*			trans	-26.9	143.6	153.3	-41.6	0	0	0	0	115.6
884	G	25.6	Very low	24.8	Very low	55 Å²	55	105.4 Å²	105.4	57%	0.567	61%	0.611	S	S	*	*			cis	158.9	169.9	3.5	0	0	0	0	0	111.1
885	H	23.4	Very low	25.2	Very low	178 Å²	178	108.1 Å²	108.1	82%	0.824	61%	0.614	S	S	*	*			trans	65.4	144.5	-160.3	-42.2	-76	0	0	0	111.3
886	S	21.5	Very low	26	Very low	69 Å²	69	101.9 Å²	101.9	48%	0.483	60%	0.601	S	S	.	*			cis	-137.6	114.9	26.6	169	0	0	0	0	111.7	Y937	S886-Y937 WeakPolarHBondContact CB-OH 3.31Å; S886-Y937 PolarHBondContact O-OH 2.73Å; S886-Y937 PolarHBondContact OG-OH 3.06Å
887	Y	20.7	Very low	27	Very low	127 Å²	127	103.8 Å²	103.8	50%	0.498	61%	0.609	S	S	.	*			trans	50.4	124.4	146.7	-64.3	-88.1	0	0	0	117.8
888	H	21	Very low	27.1	Very low	131 Å²	131	104.2 Å²	104.2	61%	0.606	61%	0.609	S	S	*	*				37.4	92.2	84.4	-65.6	-99.1	0	0	0	109.8	Q900	H888-Q900 PolarHBondContact CE1-O 3.2Å; H888-Q900 PolarHBondContact ND1-O 2.87Å
889	S	23.2	Very low	27.8	Very low	75 Å²	75	106.7 Å²	106.7	52%	0.524	62%	0.618	S	S	.	*				-150.2	166.8	69.2	-88.8	0	0	0	0	111.7
890	E	26.7	Very low	27.9	Very low	114 Å²	114	109.2 Å²	109.2	53%	0.533	62%	0.621	S	S	.	*				46.6	137.2	85.9	-27.7	158	127.3	0	0	112.3
891	D	29.7	Very low	27.8	Very low	166 Å²	166	110.4 Å²	110.4	89%	0.888	62%	0.62	S	S	*	*	S	Bend	cis	-78.4	129.9	11	-55	-45.5	0	0	0	112.2
892	G	26.4	Very low	27.7	Very low	40 Å²	40	108 Å²	108	41%	0.412	61%	0.614	S	S	.	*			cis	98	135.6	24.2	0	0	0	0	0	109.1	T894	G892-T894 CarbonylContact C-O 3.4Å
893	L	21	Very low	27.6	Very low	93 Å²	93	105 Å²	105	49%	0.487	60%	0.604	S	S	.	*			cis	46.1	63.8	15.5	-75.8	73.9	0	0	0	112.3	D895 S896 V898	L893-D895 VanDerWaalsContact N-N 3.18Å; L893-S896 CarbonylContact C-O 3.2Å; L893-S896 WeakPolarHBondContact CA-O 3.05Å; L893-V898 PolarHBondContact O-N 3.45Å
894	T	25.6	Very low	27.4	Very low	104 Å²	104	106.4 Å²	106.4	64%	0.638	60%	0.602	S	S	*	*	S	Bend	cis	-76.4	119.4	23.8	49.3	0	0	0	0	114.6	G892 S896	G892-T894 CarbonylContact C-O 3.4Å; T894-S896 WeakPolarHBondContact CA-O 3.43Å
895	D	30	Very low	27.2	Very low	139 Å²	139	110.3 Å²	110.3	74%	0.743	61%	0.609	S	S	*	*	S	Bend	cis	-123.8	139.3	6	-85.9	-55.5	0	0	0	113.5	L893	L893-D895 VanDerWaalsContact N-N 3.18Å
896	S	39.6	Very low	26.9	Very low	80 Å²	80	109.5 Å²	109.5	56%	0.559	61%	0.606	S	S	*	*	S	Bend	cis	-93.4	-111.7	13.8	-52.2	0	0	0	0	116.7	L893 T894	L893-S896 CarbonylContact C-O 3.2Å; L893-S896 WeakPolarHBondContact CA-O 3.05Å; T894-S896 WeakPolarHBondContact CA-O 3.43Å
897	P	43.5	Very low	26.9	Very low	92 Å²	92	111 Å²	111	60%	0.597	62%	0.616	S	S	*	*			trans	-91.3	116.9	-160.1	36.3	-37.2	0	0	0	118.6
898	V	29.1	Very low	27.1	Very low	92 Å²	92	110.6 Å²	110.6	56%	0.558	63%	0.632	S	S	*	*				67.8	135.7	109.2	175.1	0	0	0	0	121.2	L893	L893-V898 PolarHBondContact O-N 3.45Å
899	T	41.7	Very low	27.1	Very low	88 Å²	88	108 Å²	108	54%	0.54	63%	0.633	S	S	.	*			trans	81.9	128.4	150.9	48.1	0	0	0	0	124.3
900	Q	28.9	Very low	27	Very low	132 Å²	132	111.4 Å²	111.4	62%	0.617	65%	0.651	S	S	*	*				69.5	133.9	129.6	-68	169	-14.3	0	0	118.8	H888	H888-Q900 PolarHBondContact CE1-O 3.2Å; H888-Q900 PolarHBondContact ND1-O 2.87Å
901	Y	28.5	Very low	26.9	Very low	182 Å²	182	109.5 Å²	109.5	71%	0.714	66%	0.655	S	S	*	*				80.5	140.2	51.3	-102.7	-93.2	0	0	0	115.1
902	S	26.3	Very low	26.6	Very low	85 Å²	85	109.7 Å²	109.7	59%	0.594	66%	0.655	S	S	*	*			trans	65.9	128.4	162.2	-65	0	0	0	0	117.4
903	G	20.9	Very low	26.4	Very low	45 Å²	45	114.7 Å²	114.7	46%	0.464	67%	0.672	S	S	.	*			cis	73.4	100.9	5.8	0	0	0	0	0	112.2
904	N	22.1	Very low	26.9	Very low	148 Å²	148	112.7 Å²	112.7	79%	0.791	67%	0.674	S	S	*	*			trans	75.8	127.2	-161.7	-66.1	-28.4	0	0	0	113.2
905	L	20.9	Very low	26.8	Very low	137 Å²	137	113.2 Å²	113.2	72%	0.717	68%	0.677	S	S	*	*				67.5	99.4	84.6	-134.3	100.2	0	0	0	109.9
906	Q	18.5	Very low	26.5	Very low	161 Å²	161	114 Å²	114	75%	0.752	68%	0.676	S	S	*	*				58.4	132.4	108.7	-66.2	-173.3	-25.2	0	0	116.3
907	S	21.5	Very low	26.1	Very low	99 Å²	99	118.3 Å²	118.3	69%	0.692	69%	0.685	S	S	*	*			trans	77.5	131.1	156.8	-48.1	0	0	0	0	117.7
908	S	23.2	Very low	25	Very low	120 Å²	120	121.9 Å²	121.9	84%	0.839	69%	0.693	S	S	*	*			trans	64.1	161.5	144.3	57.5	0	0	0	0	119.2
909	A	21.8	Very low	24.6	Very low	77 Å²	77	123.5 Å²	123.5	64%	0.636	70%	0.704	S	S	*	*			cis	-175.7	158.5	-33.5	0	0	0	0	0	106.2
910	T	21.7	Very low	23.7	Very low	146 Å²	146	123.8 Å²	123.8	90%	0.896	71%	0.709	S	S	*	*			trans	59.4	168.1	169.9	47.4	0	0	0	0	115.2
911	A	24.6	Very low	23.3	Very low	74 Å²	74	128.1 Å²	128.1	61%	0.612	72%	0.722	S	S	*	*			cis	-168.9	158.1	-37.9	0	0	0	0	0	107.9
912	L	23	Very low	23	Very low	169 Å²	169	124.8 Å²	124.8	89%	0.885	72%	0.721	S	S	*	*			trans	61.1	166.6	159.6	-63.3	167.8	0	0	0	115.7
913	D	22.2	Very low	22.9	Very low	146 Å²	146	129.2 Å²	129.2	78%	0.781	73%	0.729	S	S	*	*			cis	-174.1	171.4	-25.2	176	32	0	0	0	106.3
914	G	32.3	Very low	22.9	Very low	51 Å²	51	134.6 Å²	134.6	53%	0.526	75%	0.746	S	S	.	*			trans	72	96.2	165.9	0	0	0	0	0	116.5
915	T	22.5	Very low	24.4	Very low	114 Å²	114	132.7 Å²	132.7	70%	0.699	74%	0.743	S	S	*	*				67.1	145.9	57.6	81.2	0	0	0	0	116.4
916	E	24.2	Very low	24.6	Very low	156 Å²	156	132.2 Å²	132.2	73%	0.729	75%	0.747	S	S	*	*			trans	73.3	154.7	172.4	-54.9	175.3	168.9	0	0	114.4
917	K	31	Very low	25	Very low	170 Å²	170	127.8 Å²	127.8	74%	0.739	75%	0.745	S	S	*	*			cis	-144.6	165.7	44.7	-110.1	89.7	-161	156.3	0	116.8
918	E	19.5	Very low	25.1	Very low	167 Å²	167	133.4 Å²	133.4	78%	0.78	75%	0.753	S	S	*	*			trans	-63	138.2	165.8	-71.3	-173	111.8	0	0	114.6
919	T	21.6	Very low	25.1	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	74%	0.743	S	S	*	*			trans	71.6	153.2	135.3	65.5	0	0	0	0	123.6
920	S	22.6	Very low	25.1	Very low	94 Å²	94	137 Å²	137	66%	0.657	75%	0.75	S	S	*	*			trans	97.8	97.6	136.3	-145.5	0	0	0	0	121.1
921	Y	19.7	Very low	25.3	Very low	223 Å²	223	132.6 Å²	132.6	88%	0.875	73%	0.734	S	S	*	*				49.2	162.1	126.6	-78.9	-87.7	0	0	0	123.9
922	T	23.8	Very low	25.3	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.693	73%	0.73	S	S	*	*			trans	103	102.5	141.4	-4.5	0	0	0	0	120.9
923	F	22.9	Very low	25.5	Very low	178 Å²	178	128.8 Å²	128.8	78%	0.781	71%	0.71	S	S	*	*			trans	55.3	114.6	133.4	-79.3	-124.1	0	0	0	123.6
924	L	21.3	Very low	25.6	Very low	157 Å²	157	129.4 Å²	129.4	82%	0.822	71%	0.712	S	S	*	*				67.7	159	126.8	-66.5	-177.8	0	0	0	121.3
925	P	52.7	Low	25.1	Very low	109 Å²	109	130.1 Å²	130.1	71%	0.708	71%	0.709	S	S	*	*			trans	-113.4	173.9	-152.5	46.1	-37.8	0	0	0	114.1
926	P	26.9	Very low	25.2	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	70%	0.699	S	S	*	*				-152.7	157.3	89	39.8	-22.3	0	0	0	117.7
927	G	26.3	Very low	25.2	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	70%	0.696	S	S	*	*				89.7	153.6	130	0	0	0	0	0	122
928	Y	22.4	Very low	25	Very low	216 Å²	216	127.6 Å²	127.6	85%	0.847	70%	0.696	S	S	*	*			trans	67.5	123.8	151.5	-91.2	-112.8	0	0	0	122
929	T	23.7	Very low	25.3	Very low	104 Å²	104	121.6 Å²	121.6	64%	0.638	68%	0.679	S	S	*	*			trans	61.9	151.8	144.4	54.7	0	0	0	0	120
930	E	21.2	Very low	25.7	Very low	169 Å²	169	119.2 Å²	119.2	79%	0.79	67%	0.668	S	S	*	*			cis	-163.9	129.9	-25.9	-111.9	164.4	160.4	0	0	105.5
931	G	26.6	Very low	25.8	Very low	53 Å²	53	123.1 Å²	123.1	55%	0.546	67%	0.668	S	S	.	*			trans	173.1	130.2	-178.3	0	0	0	0	0	118.7	T960	G931-T960 CarbonylContact C-O 3.49Å
932	S	24.5	Very low	26.5	Very low	77 Å²	77	117.2 Å²	117.2	54%	0.538	66%	0.657	S	S	.	*			trans	-80.4	154.4	174.7	-129.2	0	0	0	0	111.8	T960	S932-T960 VanDerWaalsContact CA-O 3.27Å; S932-T960 WeakPolarHBondContact CA-O 3.27Å; S932-T960 PolarHBondContact N-O 3.21Å; S932-T960 WeakPolarHBondContact OG-CB 3.43Å; S932-T960 PolarHBondContact OG-O 2.83Å; S932-T960 PolarHBondContact OG-OG1 2.68Å
933	L	28.4	Very low	26.6	Very low	87 Å²	87	117.8 Å²	117.8	46%	0.455	66%	0.655	S	S	.	*			cis	75	115.3	12.6	-154.7	93.6	0	0	0	119.2	T960 S961	L933-T960 HydrophobicContact CD2-CG2 4.45Å; L933-S961 VanDerWaalsContact CB-C 3.47Å; L933-S961 WeakPolarHBondContact CD2-O 2.95Å
934	L	22.9	Very low	27.4	Very low	159 Å²	159	115.1 Å²	115.1	83%	0.832	65%	0.648	S	S	*	*	S	Bend	trans	60.1	148.6	166.9	-154.3	127.1	0	0	0	115.7
935	S	23.1	Very low	27.4	Very low	66 Å²	66	112.5 Å²	112.5	46%	0.462	64%	0.641	S	S	.	*	S	Bend	trans	63.5	117.5	-165	-122	0	0	0	0	112.5
936	Q	23.4	Very low	26.1	Very low	103 Å²	103	110.6 Å²	110.6	48%	0.481	64%	0.64	S	S	.	*			trans	72.5	168.3	141.5	-71.7	151.4	-24.2	0	0	115.1	G939 S940	Q936-G939 VanDerWaalsContact CD-C 3.45Å; Q936-G939 VanDerWaalsContact NE2-N 3.13Å; Q936-S940 PolarHBondContact NE2-O 3.33Å; Q936-S940 PolarHBondContact OE1-O 2.86Å
937	Y	23.8	Very low	25.8	Very low	170 Å²	170	110.2 Å²	110.2	67%	0.667	63%	0.629	S	S	*	*	S	Bend	cis	4.4	124.7	8.5	-120.8	-3.1	0	0	0	120.2	S886	S886-Y937 WeakPolarHBondContact CB-OH 3.31Å; S886-Y937 PolarHBondContact O-OH 2.73Å; S886-Y937 PolarHBondContact OG-OH 3.06Å
938	P	27.1	Very low	26.1	Very low	113 Å²	113	116.2 Å²	116.2	73%	0.734	64%	0.636	S	S	*	*	S	Bend		-68.9	160.9	-118	8.9	11.6	0	0	0	113.1
939	G	26.2	Very low	26	Very low	42 Å²	42	110 Å²	110	43%	0.433	62%	0.621	S	S	.	*			cis	-175.8	148.5	-7.5	0	0	0	0	0	107.9	Q936	Q936-G939 VanDerWaalsContact CD-C 3.45Å; Q936-G939 VanDerWaalsContact NE2-N 3.13Å
940	S	30.6	Very low	26.5	Very low	76 Å²	76	112.7 Å²	112.7	53%	0.531	63%	0.625	S	S	.	*			trans	67.8	148.1	-174.1	87.8	0	0	0	0	112.7	Q936 P942	Q936-S940 PolarHBondContact NE2-O 3.33Å; Q936-S940 PolarHBondContact OE1-O 2.86Å; S940-P942 VanDerWaalsContact C-CD 3.45Å; S940-P942 VanDerWaalsContact CB-N 3.33Å; S940-P942 WeakPolarHBondContact OG-CD 3.06Å
941	R	23.3	Very low	26.9	Very low	176 Å²	176	109.5 Å²	109.5	66%	0.664	61%	0.61	S	S	*	*			cis	35	62.9	17.9	-155.7	176.4	-171.2	-129.9	-14.2	116.1	L943 L944	R941-L943 PolarHBondContact NE-O 3.03Å; R941-L943 VanDerWaalsContact NE-O 3.17Å; R941-L943 PolarHBondContact NH2-O 3.25Å; R941-L943 VanDerWaalsContact NH2-O 3.09Å; R941-L944 PolarHBondContact NH1-O 3.14Å; R941-L944 PolarHBondContact NH2-O 3.39Å
942	P	35.2	Very low	27.3	Very low	99 Å²	99	113 Å²	113	64%	0.643	62%	0.621	S	S	*	*			trans	-71.2	114.9	135	25.3	-9.2	0	0	0	105.3	S940	S940-P942 VanDerWaalsContact C-CD 3.45Å; S940-P942 VanDerWaalsContact CB-N 3.33Å; S940-P942 WeakPolarHBondContact OG-CD 3.06Å
943	L	25.3	Very low	27.6	Very low	124 Å²	124	115.9 Å²	115.9	65%	0.649	63%	0.626	S	S	*	*	S	Bend	cis	-147	-171.6	17.4	-59.6	164.7	0	0	0	110.9	R941	R941-L943 PolarHBondContact NE-O 3.03Å; R941-L943 VanDerWaalsContact NE-O 3.17Å; R941-L943 PolarHBondContact NH2-O 3.25Å; R941-L943 VanDerWaalsContact NH2-O 3.09Å
944	L	39.6	Very low	28.6	Very low	123 Å²	123	119.2 Å²	119.2	64%	0.644	64%	0.637	S	S	*	*			trans	78.6	93.9	150.3	-68.8	157.2	0	0	0	119.4	R941	R941-L944 PolarHBondContact NH1-O 3.14Å; R941-L944 PolarHBondContact NH2-O 3.39Å
945	P	22.4	Very low	29.3	Very low	102 Å²	102	117.4 Å²	117.4	66%	0.662	63%	0.634	S	S	*	*				-42.3	161.8	125.3	24.4	-36.5	0	0	0	112.7
946	G	24.8	Very low	30.2	Very low	68 Å²	68	117 Å²	117	70%	0.701	64%	0.635	S	S	*	*			cis	-65.4	156.7	18.4	0	0	0	0	0	115.9
947	M	20.4	Very low	30.3	Very low	118 Å²	118	114.8 Å²	114.8	58%	0.581	63%	0.631	S	S	*	*			cis	-48.8	125.6	20.1	-74.9	168.1	141.3	0	0	118	S957	M947-S957 VanDerWaalsContact SD-O 3.35Å
948	K	32.7	Very low	30.9	Very low	196 Å²	196	112.8 Å²	112.8	85%	0.852	64%	0.636	S	S	*	*			trans	-110.9	117.9	137.6	-80	-176.1	179.5	176.7	0	107.1
949	T	21.1	Very low	30.6	Very low	86 Å²	86	110.9 Å²	110.9	53%	0.528	63%	0.63	S	S	.	*			trans	-118.2	156.6	135.2	41.8	0	0	0	0	105.7	H951 S957	T949-H951 PolarHBondContact O-N 3.15Å; T949-S957 PolarHBondContact OG1-OG 3.17Å
950	H	34	Very low	30.8	Very low	159 Å²	159	113 Å²	113	74%	0.736	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-50.9	122.5	-170.2	-70.6	-109.3	0	0	0	111
951	H	28.6	Very low	30.7	Very low	102 Å²	102	113.1 Å²	113.1	47%	0.472	64%	0.635	S	S	.	*	P	Polyproline II helix	cis	-47.7	139.8	45.9	-77.9	-122.5	0	0	0	118.6	T949 E953 K954 P955	T949-H951 PolarHBondContact O-N 3.15Å; H951-E953 WeakPolarHBondContact ND1-CA 3.17Å; H951-E953 PolarHBondContact ND1-N 3.24Å; H951-K954 VanDerWaalsContact CD2-C 3.46Å; H951-K954 PolarHBondContact CD2-O 2.01Å; H951-K954 PolarHBondContact NE2-O 2.81Å; H951-P955 WeakPolarHBondContact NE2-CA 3.02Å
952	V	36.8	Very low	31.4	Very low	126 Å²	126	107.3 Å²	107.3	76%	0.764	62%	0.622	S	S	*	*	S	Bend	cis	-46.1	131.2	20.9	-177.9	0	0	0	0	115.1	K954	V952-K954 PolarHBondContact O-N 3.25Å
953	E	29.4	Very low	31	Very low	138 Å²	138	105.5 Å²	105.5	65%	0.645	61%	0.611	S	S	*	*	S	Bend	trans	-21	112.4	-177.9	-59.7	-175.1	138.4	0	0	114.1	H951	H951-E953 WeakPolarHBondContact ND1-CA 3.17Å; H951-E953 PolarHBondContact ND1-N 3.24Å
954	K	49.2	Very low	30.9	Very low	158 Å²	158	104 Å²	104	69%	0.687	61%	0.607	S	S	*	*	S	Bend	cis	-135.6	-151.2	41.8	-53.9	95.4	-157.8	151.8	0	112.6	H951 V952	H951-K954 VanDerWaalsContact CD2-C 3.46Å; H951-K954 PolarHBondContact CD2-O 2.01Å; H951-K954 PolarHBondContact NE2-O 2.81Å; V952-K954 PolarHBondContact O-N 3.25Å
955	P	37.7	Very low	29.9	Very low	121 Å²	121	100 Å²	100	79%	0.786	59%	0.59	S	S	*	*				-95.1	126.1	-123.8	7	16.7	0	0	0	115.1	H951	H951-P955 WeakPolarHBondContact NE2-CA 3.02Å
956	A	43.7	Very low	29.8	Very low	57 Å²	57	97.2 Å²	97.2	47%	0.471	57%	0.571	S	S	.	*			trans	-173.5	164.8	173.9	0	0	0	0	0	109.9
957	S	24.1	Very low	29.6	Very low	56 Å²	56	103 Å²	103	39%	0.392	57%	0.573	S	S	.	*			cis	-169	143.5	-26.5	53.1	0	0	0	0	108.1	M947 T949	M947-S957 VanDerWaalsContact SD-O 3.35Å; T949-S957 PolarHBondContact OG1-OG 3.17Å
958	V	37.1	Very low	29.8	Very low	128 Å²	128	100.2 Å²	100.2	78%	0.776	58%	0.575	S	S	*	*			trans	-152.9	143.1	-164.7	-172.1	0	0	0	0	112.6
959	A	21.4	Very low	29.3	Very low	73 Å²	73	98.1 Å²	98.1	60%	0.603	57%	0.572	S	S	*	*			trans	-159	155.7	174.9	0	0	0	0	0	118.1
960	T	28.9	Very low	30.9	Very low	87 Å²	87	99.4 Å²	99.4	53%	0.534	58%	0.582	S	S	.	*			trans	-153.4	165	149.6	-9.9	0	0	0	0	107.7	G931 S932 L933	G931-T960 CarbonylContact C-O 3.49Å; S932-T960 VanDerWaalsContact CA-O 3.27Å; S932-T960 WeakPolarHBondContact CA-O 3.27Å; S932-T960 PolarHBondContact N-O 3.21Å; S932-T960 WeakPolarHBondContact OG-CB 3.43Å; S932-T960 PolarHBondContact OG-O 2.83Å; S932-T960 PolarHBondContact OG-OG1 2.68Å; L933-T960 HydrophobicContact CD2-CG2 4.45Å
961	S	30	Very low	30.9	Very low	78 Å²	78	99 Å²	99	55%	0.545	59%	0.59	S	S	.	*			trans	-149.6	124.4	-156	53.5	0	0	0	0	120.8	L933	L933-S961 VanDerWaalsContact CB-C 3.47Å; L933-S961 WeakPolarHBondContact CD2-O 2.95Å
962	S	37.1	Very low	31.6	Very low	55 Å²	55	97.5 Å²	97.5	39%	0.385	60%	0.602	S	S	.	*			trans	28.1	142.8	143.5	64.4	0	0	0	0	124.9	R647	R647-S962 PolarHBondContact NH2-O 2.92Å
963	S	27	Very low	32.2	Very low	61 Å²	61	96.9 Å²	96.9	43%	0.427	60%	0.601	S	S	.	*			trans	-18.4	-172.1	132.9	56.3	0	0	0	0	120.2	R647	R647-S963 VanDerWaalsContact NH1-C 3.35Å; R647-S963 PolarHBondContact NH1-O 3.02Å; R647-S963 PolarHBondContact NH2-O 2.84Å
964	T	23	Very low	32.3	Very low	91 Å²	91	97.1 Å²	97.1	56%	0.558	61%	0.606	S	S	*	*			trans	87.3	118.4	159.6	-26.1	0	0	0	0	118.3	R647	R647-T964 WeakPolarHBondContact CD-O 3.34Å; R647-T964 VanDerWaalsContact CZ-O 3.25Å; R647-T964 PolarHBondContact NE-O 2.56Å
965	S	19.3	Very low	32.2	Very low	40 Å²	40	95.5 Å²	95.5	28%	0.28	61%	0.609	S	S	.	*			trans	51	143.9	143.5	64.7	0	0	0	0	124.1	Y967	S965-Y967 VanDerWaalsContact CB-CD2 3.45Å; S965-Y967 PolarHBondContact O-N 2.52Å; S965-Y967 WeakPolarHBondContact OG-CD2 3.27Å
966	T	18.9	Very low	32.3	Very low	44 Å²	44	93.6 Å²	93.6	27%	0.27	60%	0.599	S	S	.	*			trans	-59.1	109.2	131.6	-70.8	0	0	0	0	110	R648 D649	R648-T966 PolarHBondContact O-OG1 2.91Å; R648-T966 VanDerWaalsContact O-OG1 3.13Å; D649-T966 VanDerWaalsContact CA-OG1 3.29Å; D649-T966 WeakPolarHBondContact CA-OG1 3.27Å; D649-T966 WeakPolarHBondContact CB-OG1 3.19Å; D649-T966 VanDerWaalsContact OD1-CG2 3.31Å; D649-T966 WeakPolarHBondContact OD1-CG2 3.32Å; D649-T966 PolarHBondContact OD1-OG1 3.24Å
967	Y	21.3	Very low	31.8	Very low	189 Å²	189	97.8 Å²	97.8	74%	0.741	61%	0.609	S	S	*	*			trans	-155	126.1	147.2	-70.4	-60.8	0	0	0	107.7	S965	S965-Y967 VanDerWaalsContact CB-CD2 3.45Å; S965-Y967 PolarHBondContact O-N 2.52Å; S965-Y967 WeakPolarHBondContact OG-CD2 3.27Å
968	G	24.8	Very low	32	Very low	60 Å²	60	99 Å²	99	62%	0.619	61%	0.608	S	S	*	*			cis	64.7	55.3	-9.4	0	0	0	0	0	113.6
969	L	22.3	Very low	31.5	Very low	152 Å²	152	94.6 Å²	94.6	80%	0.796	58%	0.582	S	S	*	*			cis	-116.1	165.2	27.4	-53.9	94.6	0	0	0	111.2
970	P	53.4	Low	32	Very low	113 Å²	113	95.5 Å²	95.5	73%	0.734	57%	0.573	S	S	*	*			cis	-139	162.2	15.4	39.8	-20.6	0	0	0	119
971	V	34	Very low	32.1	Very low	151 Å²	151	97.6 Å²	97.6	92%	0.915	58%	0.577	S	S	*	*			trans	57.9	131.2	145.4	175.7	0	0	0	0	122.3
972	G	43.7	Very low	32	Very low	70 Å²	70	103 Å²	103	72%	0.722	59%	0.587	S	S	*	*			trans	118.4	120.7	152.6	0	0	0	0	0	117.2
973	P	50.6	Low	31.3	Very low	112 Å²	112	105.5 Å²	105.5	73%	0.727	60%	0.6	S	S	*	*			trans	-115.3	177.4	-171.7	42	-35.5	0	0	0	119
974	D	31.2	Very low	31	Very low	144 Å²	144	107.9 Å²	107.9	77%	0.77	62%	0.616	S	S	*	*			trans	97	147.1	157.1	-57.5	-32.6	0	0	0	119.6
975	V	47.3	Very low	30.9	Very low	123 Å²	123	107.6 Å²	107.6	75%	0.745	62%	0.623	S	S	*	*			cis	-167.2	158.9	-10.1	123.2	0	0	0	0	114.5
976	S	39.3	Very low	31	Very low	82 Å²	82	116 Å²	116	57%	0.573	65%	0.65	S	S	*	*			trans	52.3	120.9	157.2	66.9	0	0	0	0	128.2
977	Q	33	Very low	31.2	Very low	145 Å²	145	119.4 Å²	119.4	68%	0.678	66%	0.663	S	S	*	*				61.4	163.9	122	-67.7	148.2	-101.5	0	0	124.4
978	Q	28.7	Very low	31.9	Very low	81 Å²	81	116.1 Å²	116.1	38%	0.379	67%	0.665	S	S	.	*			cis	-161.4	169	-4.4	-131.8	163.7	-86.1	0	0	117.2	D635 H638	D635-Q978 PolarHBondContact OD1-NE2 2.7Å; D635-Q978 PolarHBondContact OD2-NE2 3.07Å; H638-Q978 WeakPolarHBondContact NE2-CA 3.4Å; H638-Q978 PolarHBondContact NE2-N 3.14Å
979	T	26.8	Very low	31.7	Very low	36 Å²	36	116.8 Å²	116.8	22%	0.221	67%	0.672	C	S	.	*			trans	67.9	-178.9	149.3	13.2	0	0	0	0	128.9	D635 S636 S637	D635-T979 VanDerWaalsContact C-CG2 3.46Å; D635-T979 WeakPolarHBondContact OD1-CG2 3.15Å; D635-T979 PolarHBondContact OD1-OG1 3.1Å; S636-T979 VanDerWaalsContact N-CG2 3.32Å; S637-T979 VanDerWaalsContact CB-C 3.45Å; S637-T979 WeakPolarHBondContact CB-O 3.07Å; S637-T979 PolarHBondContact O-N 2.98Å; S637-T979 PolarHBondContact OG-N 3.29Å; S637-T979 PolarHBondContact OG-O 3.05Å
980	Q	30.7	Very low	31.6	Very low	91 Å²	91	116.6 Å²	116.6	43%	0.425	67%	0.667	S	S	.	*			trans	-94.4	-151.1	-146.6	-37	93.6	-39.3	0	0	119.1	D634	D634-Q980 PolarHBondContact O-NE2 2.69Å; D634-Q980 PolarHBondContact OD1-NE2 2.78Å
981	E	32.7	Very low	30.1	Very low	131 Å²	131	118.3 Å²	118.3	61%	0.612	66%	0.663	S	S	*	*			cis	-154.3	-120.6	5.8	-131.9	-47.8	58.6	0	0	118.8
982	Y	26.3	Very low	29.5	Very low	193 Å²	193	114.8 Å²	114.8	76%	0.757	64%	0.643	S	S	*	*			trans	-123.5	-172.1	-148.2	-114.6	-155.4	0	0	0	116
983	V	22.3	Very low	28.4	Very low	107 Å²	107	118 Å²	118	65%	0.648	64%	0.643	S	S	*	*			cis	-176.3	166.8	-37.3	133.1	0	0	0	0	112.9
984	S	21.4	Very low	27.1	Very low	110 Å²	110	120.8 Å²	120.8	77%	0.769	65%	0.647	S	S	*	*			trans	91.9	122.9	153.4	-99.3	0	0	0	0	126.3
985	A	20.7	Very low	27.1	Very low	86 Å²	86	118.6 Å²	118.6	71%	0.711	64%	0.64	S	S	*	*				77.7	155	119.2	0	0	0	0	0	127.7
986	Y	22.5	Very low	25.9	Very low	215 Å²	215	116 Å²	116	84%	0.843	64%	0.638	S	S	*	*			trans	101.3	164.4	161.9	-81.8	-84.1	0	0	0	123.5
987	Q	23	Very low	25.1	Very low	116 Å²	116	116.7 Å²	116.7	54%	0.542	63%	0.634	S	S	.	*			trans	-153	-159.3	-157.8	-41.7	172.6	-91.1	0	0	110.6	R1121	Q987-R1121 VanDerWaalsContact OE1-CZ 3.23Å
988	P	34.7	Very low	24.7	Very low	120 Å²	120	112.6 Å²	112.6	78%	0.779	63%	0.626	S	S	*	*			cis	-141.9	-177.4	-18.9	41.7	-22.6	0	0	0	117.5
989	G	21.6	Very low	24.6	Very low	74 Å²	74	114.2 Å²	114.2	76%	0.763	63%	0.633	S	S	*	*			trans	101.1	159.7	153	0	0	0	0	0	119.2
990	E	20.2	Very low	24.6	Very low	149 Å²	149	116.2 Å²	116.2	70%	0.696	65%	0.645	S	S	*	*			cis	-168.8	157.6	-15.4	-142.3	170.6	-174.3	0	0	113.4
991	F	20.7	Very low	24.4	Very low	149 Å²	149	115.7 Å²	115.7	65%	0.654	65%	0.649	S	S	*	*			trans	75.9	160	162.2	-67.6	-58.7	0	0	0	124.4
992	P	21.4	Very low	24.4	Very low	76 Å²	76	114.1 Å²	114.1	49%	0.494	64%	0.644	S	S	.	*			trans	-150.8	179.3	-143.8	46.5	-24.5	0	0	0	122.3	W1118	P992-W1118 HydrophobicContact CB-CH2 4.41Å; P992-W1118 HydrophobicContact CB-CZ2 4.05Å; P992-W1118 HydrophobicContact CG-CZ2 3.95Å
993	L	21.2	Very low	24.4	Very low	137 Å²	137	113.5 Å²	113.5	72%	0.717	65%	0.645	S	S	*	*			trans	83.7	131.5	144.9	-81.7	164.5	0	0	0	126.4	W1118	L993-W1118 HydrophobicContact CD1-CZ2 4.14Å
994	E	23.9	Very low	24.5	Very low	172 Å²	172	112.8 Å²	112.8	80%	0.804	65%	0.65	S	S	*	*			trans	67.1	164.8	147.8	-94.7	-155.2	128	0	0	123
995	P	29.9	Very low	24.7	Very low	97 Å²	97	117.2 Å²	117.2	63%	0.63	66%	0.656	S	S	*	*			cis	-135.2	177.5	-6.8	39.4	-22	0	0	0	117.4	A1164	P995-A1164 HydrophobicContact CG-CB 4.28Å
996	G	23.1	Very low	25	Very low	68 Å²	68	118.3 Å²	118.3	70%	0.701	66%	0.656	S	S	*	*			trans	132.5	160.8	152.2	0	0	0	0	0	118.7
997	I	22.8	Very low	25.3	Very low	97 Å²	97	113.6 Å²	113.6	50%	0.497	65%	0.652	S	S	.	*			cis	-171.8	120	-5.1	-93.2	173.1	0	0	0	106.6	L1161 P1162	I997-L1161 HydrophobicContact CG2-CB 3.68Å; I997-L1161 HydrophobicContact CG2-CD2 3.31Å; I997-L1161 HydrophobicContact CG2-CG 4.01Å; I997-P1162 WeakPolarHBondContact CD1-O 3.48Å; I997-P1162 WeakPolarHBondContact CG1-O 3.27Å
998	A	24.3	Very low	25.3	Very low	60 Å²	60	115.1 Å²	115.1	50%	0.496	67%	0.668	S	S	.	*			trans	-179	150	146.7	0	0	0	0	0	122.1
999	E	25.9	Very low	24.8	Very low	114 Å²	114	114.6 Å²	114.6	53%	0.533	67%	0.668	S	S	.	*			trans	100.9	153.4	157.4	-46.3	-77	92.5	0	0	119.9	A1159 P1160 L1161	E999-A1159 CarbonylContact C-O 3.6Å; E999-A1159 WeakPolarHBondContact CA-O 3.39Å; E999-A1159 VanDerWaalsContact CD-CA 3.5Å; E999-A1159 WeakPolarHBondContact OE1-CA 3.39Å; E999-A1159 WeakPolarHBondContact OE2-CA 3.18Å; E999-P1160 WeakPolarHBondContact OE1-CA 3.2Å; E999-P1160 WeakPolarHBondContact OE1-CB 3.44Å; E999-P1160 WeakPolarHBondContact OE1-CG 3.36Å; E999-L1161 VanDerWaalsContact N-N 3.11Å
1000	T	28.2	Very low	25.2	Very low	78 Å²	78	117.1 Å²	117.1	48%	0.479	67%	0.67	S	S	.	*			trans	-148.5	172.9	-157.3	-37.5	0	0	0	0	116.6	Y1158 A1159	T1000-Y1158 PolarHBondContact N-O 3.16Å; T1000-Y1158 CarbonylContact O-C 3.59Å; T1000-Y1158 WeakPolarHBondContact O-CA 3.4Å; T1000-Y1158 WeakPolarHBondContact O-CB 3.44Å; T1000-Y1158 PolarHBondContact O-N 3.2Å; T1000-A1159 WeakPolarHBondContact CB-O 3.46Å; T1000-A1159 PolarHBondContact N-O 2.94Å; T1000-A1159 PolarHBondContact OG1-O 3.36Å
1001	T	26.7	Very low	25.4	Very low	81 Å²	81	114.4 Å²	114.4	50%	0.497	67%	0.674	S	S	.	*			trans	61.4	107	157.3	-16.1	0	0	0	0	124.2	E1157 Y1158	T1001-E1157 CarbonylContact O-C 3.42Å; T1001-E1157 VanDerWaalsContact O-O 3.1Å; T1001-Y1158 HydrophobicContact CG2-CD2 4.43Å; T1001-Y1158 WeakPolarHBondContact OG1-CB 2.94Å
1002	L	31.9	Very low	25.8	Very low	98 Å²	98	113.1 Å²	113.1	51%	0.513	68%	0.68	S	S	.	*			trans	-151.4	-173.9	147.8	-116.5	171.9	0	0	0	113.7	A1156 E1157	L1002-A1156 HydrophobicContact CD1-CB 4.45Å; L1002-A1156 WeakPolarHBondContact CD1-O 3.42Å; L1002-E1157 HydrophobicContact CD1-CB 4.09Å; L1002-E1157 HydrophobicContact CG-CB 4.08Å
1003	K	26.5	Very low	26.1	Very low	179 Å²	179	115.1 Å²	115.1	78%	0.778	69%	0.693	S	S	*	*			trans	-81.4	126	-152.7	-72.4	150.9	-173.9	149.2	0	118.7
1004	A	23.7	Very low	26.5	Very low	92 Å²	92	114.1 Å²	114.1	76%	0.76	70%	0.695	S	S	*	*				47.9	120.5	126	0	0	0	0	0	124.8
1005	K	24.8	Very low	26.4	Very low	203 Å²	203	114.1 Å²	114.1	88%	0.883	70%	0.697	S	S	*	*			trans	80.4	158.8	140.2	-98	-162.7	172.5	-179	0	119.5
1006	P	27.5	Very low	26.6	Very low	110 Å²	110	115.2 Å²	115.2	71%	0.714	70%	0.704	S	S	*	*				-135.3	-148.9	-116	44.7	-22.4	0	0	0	114.4
1007	P	29.1	Very low	27.1	Very low	116 Å²	116	118.1 Å²	118.1	75%	0.753	71%	0.71	S	S	*	*				-102	168.2	-117.3	41.1	-27.1	0	0	0	115.7
1008	V	23.5	Very low	27.1	Very low	148 Å²	148	117 Å²	117	90%	0.897	72%	0.722	S	S	*	*			trans	-131.4	143.3	157	179.4	0	0	0	0	109
1009	S	24.2	Very low	27.1	Very low	109 Å²	109	119.9 Å²	119.9	76%	0.762	74%	0.74	S	S	*	*			trans	-144.7	179.3	179.1	78	0	0	0	0	109.8
1010	P	30	Very low	27	Very low	126 Å²	126	119.7 Å²	119.7	82%	0.818	76%	0.757	S	S	*	*				-109.9	159.5	-112.4	40.3	-32.5	0	0	0	116.3
1011	A	23.6	Very low	26.8	Very low	93 Å²	93	119.9 Å²	119.9	77%	0.769	77%	0.774	S	S	*	*			trans	-166.8	158.3	165.5	0	0	0	0	0	112.1
1012	P	29.4	Very low	26.6	Very low	122 Å²	122	125.4 Å²	125.4	79%	0.792	80%	0.797	S	S	*	*			cis	-132.8	-137.7	-45.8	46.3	-29.6	0	0	0	110.3
1013	P	28.1	Very low	26.3	Very low	118 Å²	118	125.4 Å²	125.4	77%	0.766	81%	0.812	S	S	*	*			trans	-107.8	178.8	-148.2	8.7	20.2	0	0	0	115.7
1014	P	28.7	Very low	26.3	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	81%	0.814	S	S	*	*			trans	-102.5	-177.6	-159.1	40.3	-38.6	0	0	0	117.5
1015	M	22	Very low	26.5	Very low	173 Å²	173	126.6 Å²	126.6	85%	0.852	81%	0.814	S	S	*	*			trans	101.8	150.6	166.1	-61.9	-163.6	-59.3	0	0	117.7
1016	P	35.7	Very low	26.8	Very low	119 Å²	119	122.8 Å²	122.8	77%	0.773	81%	0.813	S	S	*	*			cis	-131.9	-140.6	-35.6	42	-23.4	0	0	0	111.7
1017	P	32	Very low	26.8	Very low	129 Å²	129	125.3 Å²	125.3	84%	0.838	82%	0.816	S	S	*	*			trans	-100.8	151.7	-135.4	38.7	-23.6	0	0	0	116.5
1018	G	23.5	Very low	27	Very low	73 Å²	73	125.2 Å²	125.2	75%	0.753	82%	0.815	S	S	*	*			trans	-166.5	98.5	173.3	0	0	0	0	0	114.6
1019	S	24.9	Very low	27.1	Very low	122 Å²	122	126.2 Å²	126.2	85%	0.853	81%	0.813	S	S	*	*			trans	-4.5	130.9	165.8	57	0	0	0	0	121.6
1020	A	23.6	Very low	27.5	Very low	109 Å²	109	125.6 Å²	125.6	90%	0.901	81%	0.805	S	S	*	*				135.4	145	129.3	0	0	0	0	0	114.7
1021	G	24.7	Very low	27.8	Very low	82 Å²	82	124.1 Å²	124.1	85%	0.845	80%	0.798	S	S	*	*			trans	112.1	108.1	169.1	0	0	0	0	0	115.1
1022	M	21.5	Very low	28.9	Very low	197 Å²	197	124.5 Å²	124.5	97%	0.97	80%	0.795	S	S	*	*			trans	-103.4	135.9	158	-72.7	169.9	160.9	0	0	108.5
1023	A	26.3	Very low	30	Very low	99 Å²	99	120.2 Å²	120.2	82%	0.818	77%	0.765	S	S	*	*			trans	-156.7	135.8	156.9	0	0	0	0	0	106.6
1024	E	24.8	Very low	32.3	Very low	176 Å²	176	118.4 Å²	118.4	82%	0.822	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-96.2	146.9	-158.5	-72.5	165.8	132.4	0	0	114.2
1025	P	28.9	Very low	34.9	Very low	119 Å²	119	116.6 Å²	116.6	77%	0.773	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-73.6	156.7	157.1	-8.9	26.6	0	0	0	111.4
1026	S	30.7	Very low	38.1	Very low	123 Å²	123	108.5 Å²	108.5	86%	0.86	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-67.9	136.8	179	51.1	0	0	0	0	114.3
1027	E	28.3	Very low	40.4	Very low	164 Å²	164	104 Å²	104	77%	0.766	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-87.5	151.1	-177.5	-63.3	-164.8	129	0	0	115.6
1028	P	33.3	Very low	43.1	Very low	113 Å²	113	102.1 Å²	102.1	73%	0.734	63%	0.633	S	S	*	*			trans	-103.7	113.6	167.7	35.6	-28.8	0	0	0	114.6
1029	I	26.1	Very low	45.9	Very low	169 Å²	169	101.2 Å²	101.2	87%	0.867	61%	0.614	S	S	*	*			trans	14.8	110.2	147.8	-44.7	174.1	0	0	0	117.4
1030	T	31.1	Very low	49	Very low	96 Å²	96	99.8 Å²	99.8	59%	0.589	59%	0.592	S	S	*	*			trans	-140.8	119.1	159.9	34.8	0	0	0	0	115.3	N218 Q220	N218-T1030 PolarHBondContact ND2-O 2.86Å; Q220-T1030 PolarHBondContact NE2-O 3.46Å; Q220-T1030 PolarHBondContact NE2-OG1 3.42Å
1031	S	36.8	Very low	52.2	Low	96 Å²	96	98.4 Å²	98.4	67%	0.671	57%	0.567	S	S	*	*			trans	29.3	146.9	147.9	-159.6	0	0	0	0	123.1	N218	N218-S1031 PolarHBondContact ND2-O 3.46Å
1032	S	47.3	Very low	55.3	Low	101 Å²	101	99.4 Å²	99.4	71%	0.706	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-60.3	146.9	162.4	55.1	0	0	0	0	112.9
1033	M	52.6	Low	58.4	Low	32 Å²	32	91.1 Å²	91.1	16%	0.158	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-71.1	145.8	-179	-166.2	168.9	67.4	0	0	113.3	L199 T217 N218 D1037 Y1038	L199-M1033 HydrophobicContact CB-CE 4.07Å; L199-M1033 HydrophobicContact CB-SD 3.68Å; L199-M1033 HydrophobicContact CD1-CE 4.4Å; L199-M1033 HydrophobicContact CD1-SD 3.59Å; L199-M1033 VanDerWaalsContact CD1-SD 3.59Å; L199-M1033 HydrophobicContact CG-SD 4.27Å; T217-M1033 VanDerWaalsContact O-CB 3.26Å; T217-M1033 WeakPolarHBondContact O-CB 3.35Å; T217-M1033 WeakPolarHBondContact O-CE 3.26Å; N218-M1033 HydrophobicContact CB-CB 3.94Å; M1033-D1037 HydrophobicContact CE-CB 4.39Å; M1033-D1037 HydrophobicContact CG-CB 3.49Å; M1033-D1037 VanDerWaalsContact CG-CB 3.49Å; M1033-D1037 VanDerWaalsContact CG-OD2 3.26Å; M1033-D1037 WeakPolarHBondContact CG-OD2 3.22Å; M1033-D1037 HydrophobicContact SD-CB 3.65Å; M1033-Y1038 HydrophobicContact CE-CD1 3.98Å; M1033-Y1038 HydrophobicContact CE-CE1 3.78Å
1034	H	76.3	Confident	61	Low	79 Å²	79	90.9 Å²	90.9	37%	0.366	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-88.9	152.3	-174.8	-165.9	-115.9	0	0	0	112.2	C1036 D1037 E1085	H1034-C1036 VanDerWaalsContact CE1-SG 3.54Å; H1034-C1036 PolarHBondContact ND1-SG 3.31Å; H1034-C1036 VanDerWaalsContact ND1-SG 3.38Å; H1034-C1036 PolarHBondContact O-N 2.76Å; H1034-D1037 WeakPolarHBondContact CA-OD2 3.43Å; H1034-D1037 WeakPolarHBondContact CB-OD2 3.4Å; H1034-D1037 PolarHBondContact N-OD2 3.41Å; H1034-D1037 WeakPolarHBondContact O-CB 3.31Å; H1034-D1037 PolarHBondContact O-N 2.66Å; H1034-E1085 PolarHBondContact CE1-O 2.86Å
1035	K	83	Confident	63.9	Low	78 Å²	78	85 Å²	85	34%	0.339	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-16.5	178.6	55.2	178.9	165.8	-178.6	0	115.2	Y1038 A1073 N1074 E1085	K1035-Y1038 HydrophobicContact CB-CE2 4.47Å; K1035-Y1038 WeakPolarHBondContact O-CD2 3.09Å; K1035-A1073 HydrophobicContact CB-CB 3.72Å; K1035-N1074 WeakPolarHBondContact O-CB 3.17Å; K1035-N1074 PolarHBondContact O-N 2.89Å; K1035-E1085 WeakPolarHBondContact CE-OE2 3.44Å; K1035-E1085 IonicContact NZ-OE2 2.76Å; K1035-E1085 PolarHBondContact NZ-OE2 3.18Å
1036	C	89.3	Confident	66.1	Low	2 Å²	2	84.8 Å²	84.8	1%	0.014	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-11.1	178.7	-60.5	0	0	0	0	114.2	H1034 W1054 N1074 E1085 C1086	H1034-C1036 VanDerWaalsContact CE1-SG 3.54Å; H1034-C1036 PolarHBondContact ND1-SG 3.31Å; H1034-C1036 VanDerWaalsContact ND1-SG 3.38Å; H1034-C1036 PolarHBondContact O-N 2.76Å; C1036-W1054 HydrophobicContact CB-CB 4.11Å; C1036-W1054 HydrophobicContact CB-CG 4.21Å; C1036-N1074 PolarHBondContact O-ND2 3.1Å; C1036-E1085 PolarHBondContact SG-O 3.49Å; C1036-E1085 VanDerWaalsContact SG-O 3.32Å; C1036-C1086 HydrophobicContact CB-CB 3.41Å; C1036-C1086 VanDerWaalsContact CB-CB 3.41Å; C1036-C1086 WeakPolarHBondContact CB-SG 2.99Å; C1036-C1086 WeakPolarHBondContact SG-CA 3.39Å; C1036-C1086 WeakPolarHBondContact SG-CB 3.22Å; C1036-C1086 CovalentContact SG-SG 2.01Å; C1036-C1086 PolarHBondContact SG-SG 2.82Å
1037	D	83.8	Confident	68.2	Low	25 Å²	25	80.1 Å²	80.1	13%	0.134	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-22.3	177.5	-62.5	-58.9	0	0	0	112.3	L199 M1033 H1034 K1056	L199-D1037 HydrophobicContact CD1-CB 4.29Å; M1033-D1037 HydrophobicContact CE-CB 4.39Å; M1033-D1037 HydrophobicContact CG-CB 3.49Å; M1033-D1037 VanDerWaalsContact CG-CB 3.49Å; M1033-D1037 VanDerWaalsContact CG-OD2 3.26Å; M1033-D1037 WeakPolarHBondContact CG-OD2 3.22Å; M1033-D1037 HydrophobicContact SD-CB 3.65Å; H1034-D1037 WeakPolarHBondContact CA-OD2 3.43Å; H1034-D1037 WeakPolarHBondContact CB-OD2 3.4Å; H1034-D1037 PolarHBondContact N-OD2 3.41Å; H1034-D1037 WeakPolarHBondContact O-CB 3.31Å; H1034-D1037 PolarHBondContact O-N 2.66Å; D1037-K1056 VanDerWaalsContact OD1-CD 3.31Å; D1037-K1056 WeakPolarHBondContact OD1-CD 2.95Å; D1037-K1056 VanDerWaalsContact OD1-CE 3.3Å; D1037-K1056 WeakPolarHBondContact OD1-CE 3.48Å; D1037-K1056 IonicContact OD1-NZ 2.63Å; D1037-K1056 PolarHBondContact OD1-NZ 2.91Å
1038	Y	87.5	Confident	71	Confident	89 Å²	89	79 Å²	79	35%	0.349	45%	0.445	S	S	.	.	S	Bend	trans	-61	149.7	175.4	-59.7	-56.9	0	0	0	112.1	M1033 K1035 N1072 A1073 N1074	M1033-Y1038 HydrophobicContact CE-CD1 3.98Å; M1033-Y1038 HydrophobicContact CE-CE1 3.78Å; K1035-Y1038 HydrophobicContact CB-CE2 4.47Å; K1035-Y1038 WeakPolarHBondContact O-CD2 3.09Å; Y1038-N1072 WeakPolarHBondContact CB-OD1 3.44Å; Y1038-N1072 HydrophobicContact CD2-CB 4.47Å; Y1038-N1072 HydrophobicContact CG-CB 4.36Å; Y1038-A1073 HydrophobicContact CD2-CB 4.06Å; Y1038-A1073 HydrophobicContact CE2-CB 4.14Å; Y1038-N1074 VanDerWaalsContact O-CB 3.26Å; Y1038-N1074 WeakPolarHBondContact O-CB 3.43Å; Y1038-N1074 PolarHBondContact O-ND2 3.27Å
1039	P	84.1	Confident	73.5	Confident	54 Å²	54	77.4 Å²	77.4	35%	0.351	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-75.5	160.8	176.5	31.4	-36	0	0	0	112.6	E1041 N1072	P1039-E1041 PolarHBondContact O-N 2.02Å; P1039-N1072 PolarHBondContact O-ND2 2.83Å; P1039-N1072 PolarHBondContact O-OD1 3.08Å
1040	K	89.9	Confident	76.7	Confident	93 Å²	93	76.8 Å²	76.8	40%	0.404	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-58.1	125.3	165.9	43.6	165.1	175.5	-115	0	111.4	Y1053 F1064	K1040-Y1053 HydrophobicContact CB-CD1 3.6Å; K1040-Y1053 HydrophobicContact CB-CD2 3.89Å; K1040-Y1053 HydrophobicContact CB-CE1 3.98Å; K1040-Y1053 HydrophobicContact CB-CE2 4.24Å; K1040-Y1053 HydrophobicContact CB-CG 3.55Å; K1040-Y1053 HydrophobicContact CD-CD1 3.9Å; K1040-Y1053 HydrophobicContact CD-CE1 3.45Å; K1040-Y1053 VanDerWaalsContact CD-CE1 3.45Å; K1040-Y1053 HydrophobicContact CD-CE2 4.49Å; K1040-Y1053 HydrophobicContact CG-CD1 3.86Å; K1040-Y1053 HydrophobicContact CG-CD2 4.05Å; K1040-Y1053 HydrophobicContact CG-CE1 3.66Å; K1040-Y1053 HydrophobicContact CG-CE2 3.87Å; K1040-Y1053 HydrophobicContact CG-CG 4.05Å; K1040-Y1053 VanDerWaalsContact NZ-CE1 3.33Å; K1040-Y1053 PolarHBondContact NZ-OH 2.96Å; K1040-F1064 HydrophobicContact CB-CB 4.07Å; K1040-F1064 HydrophobicContact CB-CD1 3.84Å; K1040-F1064 HydrophobicContact CB-CD2 3.93Å; K1040-F1064 HydrophobicContact CB-CE1 4.18Å; K1040-F1064 HydrophobicContact CB-CE2 4.29Å; K1040-F1064 HydrophobicContact CB-CG 3.69Å; K1040-F1064 HydrophobicContact CB-CZ 4.39Å; K1040-F1064 HydrophobicContact CD-CB 3.63Å; K1040-F1064 HydrophobicContact CD-CG 4.22Å
1041	E	90.6	Very high	79.7	Confident	79 Å²	79	75.2 Å²	75.2	37%	0.369	40%	0.4	S	S	.	.			trans	-124.2	119	179.6	-177.9	179	-178	0	0	111.4	P1039 F1064 Y1066 N1072	P1039-E1041 PolarHBondContact O-N 2.02Å; E1041-F1064 WeakPolarHBondContact O-CE2 3.45Å; E1041-Y1066 WeakPolarHBondContact O-CD2 3.24Å; E1041-N1072 WeakPolarHBondContact CB-ND2 3.34Å; E1041-N1072 WeakPolarHBondContact OE2-CB 3.29Å; E1041-N1072 PolarHBondContact OE2-N 2.81Å; E1041-N1072 PolarHBondContact OE2-ND2 3.16Å
1042	R	88.2	Confident	82.5	Confident	104 Å²	104	72.1 Å²	72.1	39%	0.392	37%	0.374	S	S	.	.			trans	-70.3	-35.2	177	-177.5	168	-171.6	-168.2	3.1	112.2	G1047 H1048 L1065 Y1066 G1067	R1042-G1047 PolarHBondContact NH2-O 2.96Å; R1042-H1048 PolarHBondContact NH2-CD2 3.1Å; R1042-H1048 PolarHBondContact NH2-NE2 3.38Å; R1042-L1065 WeakPolarHBondContact CB-O 3.35Å; R1042-L1065 VanDerWaalsContact CG-O 3.27Å; R1042-L1065 WeakPolarHBondContact CG-O 3.11Å; R1042-Y1066 WeakPolarHBondContact O-CD2 3.2Å; R1042-G1067 VanDerWaalsContact O-CA 3.31Å; R1042-G1067 WeakPolarHBondContact O-CA 3.26Å; R1042-G1067 PolarHBondContact O-N 3.35Å
1043	G	86.9	Confident	84.7	Confident	23 Å²	23	68.3 Å²	68.3	24%	0.237	34%	0.344	C	S	.	.			trans	71	173	-168.6	0	0	0	0	0	113.7	C1069 R1070	G1043-C1069 WeakPolarHBondContact CA-O 3.37Å; G1043-R1070 WeakPolarHBondContact CA-O 3.42Å
1044	P	80.9	Confident	86.7	Confident	93 Å²	93	67.7 Å²	67.7	60%	0.604	34%	0.34	S	S	*	.	S	Bend	trans	-86.6	-7.9	-168.2	34.2	-35.7	0	0	0	114.7	R1070	P1044-R1070 HydrophobicContact CG-CB 4.43Å
1045	C	85.5	Confident	87.3	Confident	53 Å²	53	65.2 Å²	65.2	36%	0.358	33%	0.329	S	S	.	.	S	Bend	trans	-78.8	146.6	178.6	-73.2	0	0	0	0	112.1	G1047 G1067 C1069	C1045-G1047 PolarHBondContact O-N 3.1Å; C1045-G1067 CarbonylContact C-O 3.53Å; C1045-G1067 WeakPolarHBondContact CB-O 3.44Å; C1045-G1067 CarbonylContact O-C 3.57Å; C1045-G1067 WeakPolarHBondContact O-CA 3.1Å; C1045-C1069 HydrophobicContact CB-CB 3.95Å; C1045-C1069 WeakPolarHBondContact CB-SG 3.18Å; C1045-C1069 WeakPolarHBondContact SG-CB 3.07Å; C1045-C1069 CovalentContact SG-SG 2.03Å; C1045-C1069 PolarHBondContact SG-SG 2.78Å
1046	S	75.6	Confident	87.3	Confident	115 Å²	115	67.1 Å²	67.1	80%	0.804	34%	0.338	S	S	*	.			trans	-78.9	17.3	-174	-48	0	0	0	0	115.2	H1048	S1046-H1048 PolarHBondContact O-CD2 3.09Å
1047	G	75.9	Confident	86.7	Confident	24 Å²	24	75.1 Å²	75.1	25%	0.247	38%	0.379	C	S	.	.			trans	-66.7	156.1	178.7	0	0	0	0	0	113.7	R1042 C1045 Y1066 G1067	R1042-G1047 PolarHBondContact NH2-O 2.96Å; C1045-G1047 PolarHBondContact O-N 3.1Å; G1047-Y1066 CarbonylContact C-O 3.53Å; G1047-G1067 WeakPolarHBondContact CA-O 3.26Å; G1047-G1067 PolarHBondContact N-O 3.21Å
1048	H	86.5	Confident	86.7	Confident	140 Å²	140	81.8 Å²	81.8	65%	0.648	40%	0.403	S	S	*	.			trans	-119.9	47.3	177.7	-82.1	-121.2	0	0	0	110.6	R1042 S1046 L1065	R1042-H1048 PolarHBondContact NH2-CD2 3.1Å; R1042-H1048 PolarHBondContact NH2-NE2 3.38Å; S1046-H1048 PolarHBondContact O-CD2 3.09Å; H1048-L1065 VanDerWaalsContact C-CD1 3.46Å; H1048-L1065 HydrophobicContact CB-CD1 4.02Å; H1048-L1065 HydrophobicContact CB-CD2 4.49Å
1049	L	85.8	Confident	86.3	Confident	81 Å²	81	81.7 Å²	81.7	42%	0.424	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.3	-178.6	-55.9	179.8	0	0	0	110	R1051 Y1066	L1049-R1051 PolarHBondContact O-N 2.82Å; L1049-Y1066 WeakPolarHBondContact CB-O 3.48Å; L1049-Y1066 HydrophobicContact CD1-CD1 4.25Å; L1049-Y1066 PolarHBondContact N-O 2.95Å; L1049-Y1066 PolarHBondContact O-N 3.11Å
1050	R	92.8	Very high	86.3	Confident	156 Å²	156	83.8 Å²	83.8	59%	0.589	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	130.3	172.6	-170	176.7	-177.3	-133.4	-2.1	109.8	W1052 S1063	R1050-W1052 VanDerWaalsContact NH2-CH2 3.32Å; R1050-S1063 PolarHBondContact NE-OG 3.18Å; R1050-S1063 VanDerWaalsContact NH2-CB 3.29Å; R1050-S1063 PolarHBondContact NH2-OG 2.98Å
1051	R	94.3	Very high	86.5	Confident	63 Å²	63	79.3 Å²	79.3	24%	0.238	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	176.7	179.7	-66.5	-64.2	177.4	82.8	-4.5	110.2	L1049 S1063 F1064 Y1066 N1075 F1076	L1049-R1051 PolarHBondContact O-N 2.82Å; R1051-S1063 CarbonylContact O-C 3.5Å; R1051-S1063 WeakPolarHBondContact O-CA 3.39Å; R1051-S1063 WeakPolarHBondContact O-CB 3.08Å; R1051-F1064 HydrophobicContact CB-CD1 4.05Å; R1051-F1064 HydrophobicContact CB-CE1 3.62Å; R1051-F1064 HydrophobicContact CB-CE2 4.34Å; R1051-F1064 HydrophobicContact CB-CZ 3.79Å; R1051-F1064 PolarHBondContact N-O 2.75Å; R1051-F1064 PolarHBondContact O-N 3.12Å; R1051-Y1066 VanDerWaalsContact CG-CB 3.5Å; R1051-Y1066 HydrophobicContact CG-CD1 4.32Å; R1051-Y1066 HydrophobicContact CG-CG 4.24Å; R1051-Y1066 VanDerWaalsContact NH1-CD1 3.32Å; R1051-N1075 VanDerWaalsContact CG-OD1 3.25Å; R1051-N1075 WeakPolarHBondContact CG-OD1 3.43Å; R1051-N1075 PolarHBondContact NH1-OD1 3.01Å; R1051-F1076 CarbonylContact C-O 3.56Å; R1051-F1076 VanDerWaalsContact CA-O 3.25Å; R1051-F1076 WeakPolarHBondContact CA-O 3.5Å; R1051-F1076 WeakPolarHBondContact CB-O 3.22Å; R1051-F1076 VanDerWaalsContact CD-O 3.23Å; R1051-F1076 WeakPolarHBondContact CD-O 3.23Å
1052	W	95.1	Very high	86.5	Confident	31 Å²	31	77.5 Å²	77.5	12%	0.117	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	146.1	-177.7	-63	85.1	0	0	0	110.9	R1050 C1061 E1062 S1063 F1076 T1078 E1079 C1082	R1050-W1052 VanDerWaalsContact NH2-CH2 3.32Å; W1052-C1061 HydrophobicContact CE3-CB 4.49Å; W1052-E1062 WeakPolarHBondContact CA-O 2.82Å; W1052-E1062 VanDerWaalsContact CE3-C 3.44Å; W1052-S1063 VanDerWaalsContact CE3-N 3.31Å; W1052-F1076 HydrophobicContact CB-CB 4.28Å; W1052-F1076 PolarHBondContact N-O 3.49Å; W1052-F1076 WeakPolarHBondContact O-CD2 3.37Å; W1052-F1076 PolarHBondContact O-N 3.4Å; W1052-T1078 VanDerWaalsContact CD1-CA 3.48Å; W1052-E1079 HydrophobicContact CD2-CB 3.66Å; W1052-E1079 HydrophobicContact CD2-CG 4.2Å; W1052-E1079 HydrophobicContact CE3-CB 3.64Å; W1052-E1079 HydrophobicContact CE3-CG 3.63Å; W1052-E1079 HydrophobicContact CG-CB 4.31Å; W1052-E1079 HydrophobicContact CH2-CB 3.78Å; W1052-E1079 HydrophobicContact CH2-CG 3.95Å; W1052-E1079 WeakPolarHBondContact CH2-OE2 3.42Å; W1052-E1079 HydrophobicContact CZ2-CB 3.82Å; W1052-E1079 HydrophobicContact CZ2-CG 4.49Å; W1052-E1079 HydrophobicContact CZ3-CB 3.71Å; W1052-E1079 HydrophobicContact CZ3-CG 3.5Å; W1052-E1079 WeakPolarHBondContact CZ3-OE2 3.21Å; W1052-C1082 HydrophobicContact CB-CB 4.1Å
1053	Y	94.5	Very high	86.6	Confident	20 Å²	20	75 Å²	75	8%	0.078	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	148.2	176	85.1	-73.9	0	0	0	110.4	K1040 N1055 C1061 E1062 F1064 N1074	K1040-Y1053 HydrophobicContact CB-CD1 3.6Å; K1040-Y1053 HydrophobicContact CB-CD2 3.89Å; K1040-Y1053 HydrophobicContact CB-CE1 3.98Å; K1040-Y1053 HydrophobicContact CB-CE2 4.24Å; K1040-Y1053 HydrophobicContact CB-CG 3.55Å; K1040-Y1053 HydrophobicContact CD-CD1 3.9Å; K1040-Y1053 HydrophobicContact CD-CE1 3.45Å; K1040-Y1053 VanDerWaalsContact CD-CE1 3.45Å; K1040-Y1053 HydrophobicContact CD-CE2 4.49Å; K1040-Y1053 HydrophobicContact CG-CD1 3.86Å; K1040-Y1053 HydrophobicContact CG-CD2 4.05Å; K1040-Y1053 HydrophobicContact CG-CE1 3.66Å; K1040-Y1053 HydrophobicContact CG-CE2 3.87Å; K1040-Y1053 HydrophobicContact CG-CG 4.05Å; K1040-Y1053 VanDerWaalsContact NZ-CE1 3.33Å; K1040-Y1053 PolarHBondContact NZ-OH 2.96Å; Y1053-N1055 HydrophobicContact CE2-CB 3.83Å; Y1053-N1055 PolarHBondContact O-N 2.8Å; Y1053-N1055 PolarHBondContact OH-ND2 2.75Å; Y1053-C1061 CarbonylContact O-C 3.55Å; Y1053-C1061 VanDerWaalsContact O-CA 3.32Å; Y1053-C1061 WeakPolarHBondContact O-CA 3.35Å; Y1053-E1062 HydrophobicContact CD1-CB 4.2Å; Y1053-E1062 WeakPolarHBondContact CD1-O 3.41Å; Y1053-E1062 HydrophobicContact CE1-CB 3.64Å; Y1053-E1062 PolarHBondContact N-O 2.84Å; Y1053-E1062 PolarHBondContact O-N 3.36Å; Y1053-E1062 PolarHBondContact OH-OE2 2.78Å; Y1053-F1064 HydrophobicContact CD1-CB 4.38Å; Y1053-F1064 AromaticContact CD1-CD1 3.91Å; Y1053-F1064 HydrophobicContact CD1-CD1 3.91Å; Y1053-F1064 HydrophobicContact CD1-CG 4.48Å; Y1053-F1064 HydrophobicContact CG-CD1 4.33Å; Y1053-N1074 VanDerWaalsContact CA-OD1 3.22Å; Y1053-N1074 WeakPolarHBondContact CA-OD1 3.34Å; Y1053-N1074 WeakPolarHBondContact CB-O 3.38Å
1054	W	93.5	Very high	86.9	Confident	20 Å²	20	74.8 Å²	74.8	8%	0.076	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	109.5	173.2	178	-102.6	0	0	0	109.7	C1036 K1056 S1059 N1074 C1082 L1083 C1086 K1087	C1036-W1054 HydrophobicContact CB-CB 4.11Å; C1036-W1054 HydrophobicContact CB-CG 4.21Å; W1054-K1056 PolarHBondContact O-N 2.8Å; W1054-S1059 WeakPolarHBondContact CH2-O 3.39Å; W1054-N1074 PolarHBondContact N-ND2 3.21Å; W1054-N1074 PolarHBondContact N-OD1 3.19Å; W1054-N1074 PolarHBondContact O-ND2 2.89Å; W1054-C1082 PolarHBondContact N-SG 2.99Å; W1054-L1083 HydrophobicContact CZ3-CD2 4.04Å; W1054-C1086 HydrophobicContact CB-CB 3.6Å; W1054-C1086 VanDerWaalsContact CB-SG 3.59Å; W1054-C1086 HydrophobicContact CD2-CB 3.41Å; W1054-C1086 VanDerWaalsContact CD2-CB 3.41Å; W1054-C1086 HydrophobicContact CE3-CB 3.6Å; W1054-C1086 HydrophobicContact CG-CB 3.42Å; W1054-C1086 VanDerWaalsContact CG-CB 3.42Å; W1054-C1086 HydrophobicContact CZ3-CB 4.43Å; W1054-K1087 HydrophobicContact CH2-CB 3.71Å; W1054-K1087 HydrophobicContact CH2-CG 3.88Å; W1054-K1087 HydrophobicContact CZ3-CB 3.88Å; W1054-K1087 HydrophobicContact CZ3-CG 4.39Å
1055	N	89.5	Confident	87.4	Confident	27 Å²	27	73.4 Å²	73.4	14%	0.144	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	93.8	170.4	-173.4	-26.7	0	0	0	108.6	Y1053 L1057 R1058 S1059 K1060 E1062	Y1053-N1055 HydrophobicContact CE2-CB 3.83Å; Y1053-N1055 PolarHBondContact O-N 2.8Å; Y1053-N1055 PolarHBondContact OH-ND2 2.75Å; N1055-L1057 VanDerWaalsContact C-N 3.25Å; N1055-L1057 PolarHBondContact O-N 2.8Å; N1055-L1057 PolarHBondContact OD1-N 2.83Å; N1055-R1058 HydrophobicContact CB-CB 4.3Å; N1055-R1058 CarbonylContact O-C 3.58Å; N1055-R1058 PolarHBondContact O-N 3.4Å; N1055-R1058 PolarHBondContact OD1-N 2.89Å; N1055-S1059 PolarHBondContact O-N 3.5Å; N1055-K1060 WeakPolarHBondContact CA-O 3.21Å; N1055-K1060 VanDerWaalsContact CB-O 3.3Å; N1055-K1060 WeakPolarHBondContact CB-O 2.99Å; N1055-K1060 PolarHBondContact N-O 2.83Å; N1055-K1060 PolarHBondContact O-N 3.28Å; N1055-E1062 HydrophobicContact CB-CG 4.26Å; N1055-E1062 PolarHBondContact ND2-OE2 2.8Å
1056	K	82.6	Confident	87.7	Confident	118 Å²	118	72 Å²	72	51%	0.513	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-52.1	-39.5	179.5	-172.2	175.5	-171.7	163.3	0	113.2	D1037 W1054 R1058 S1059	D1037-K1056 VanDerWaalsContact OD1-CD 3.31Å; D1037-K1056 WeakPolarHBondContact OD1-CD 2.95Å; D1037-K1056 VanDerWaalsContact OD1-CE 3.3Å; D1037-K1056 WeakPolarHBondContact OD1-CE 3.48Å; D1037-K1056 IonicContact OD1-NZ 2.63Å; D1037-K1056 PolarHBondContact OD1-NZ 2.91Å; W1054-K1056 PolarHBondContact O-N 2.8Å; K1056-R1058 VanDerWaalsContact C-N 3.27Å; K1056-R1058 PolarHBondContact O-N 3.46Å; K1056-S1059 PolarHBondContact O-N 2.72Å
1057	L	77.9	Confident	88.3	Confident	170 Å²	170	66.7 Å²	66.7	89%	0.89	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-66.2	-27.4	178.7	-175.6	69.9	0	0	0	112.9	N1055	N1055-L1057 VanDerWaalsContact C-N 3.25Å; N1055-L1057 PolarHBondContact O-N 2.8Å; N1055-L1057 PolarHBondContact OD1-N 2.83Å
1058	R	82.4	Confident	88.7	Confident	165 Å²	165	67.5 Å²	67.5	62%	0.623	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-101.9	-0.3	176	-57.7	-171	79.1	169	10.3	113.4	N1055 K1056 K1060 E1062	N1055-R1058 HydrophobicContact CB-CB 4.3Å; N1055-R1058 CarbonylContact O-C 3.58Å; N1055-R1058 PolarHBondContact O-N 3.4Å; N1055-R1058 PolarHBondContact OD1-N 2.89Å; K1056-R1058 VanDerWaalsContact C-N 3.27Å; K1056-R1058 PolarHBondContact O-N 3.46Å; R1058-K1060 HydrophobicContact CB-CB 4.2Å; R1058-K1060 WeakPolarHBondContact O-CB 2.99Å; R1058-K1060 PolarHBondContact O-N 3.44Å; R1058-K1060 VanDerWaalsContact O-N 3.1Å; R1058-E1062 WeakPolarHBondContact CD-OE1 3.3Å; R1058-E1062 IonicContact CZ-OE1 2.66Å; R1058-E1062 IonicContact NE-OE1 3.76Å; R1058-E1062 IonicContact NH1-OE1 3.92Å; R1058-E1062 PolarHBondContact NH1-OE1 2.79Å
1059	S	80.4	Confident	88.7	Confident	86 Å²	86	62.4 Å²	62.4	60%	0.601	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.2	42.8	-166.6	-64.5	0	0	0	0	113.3	W1054 N1055 K1056	W1054-S1059 WeakPolarHBondContact CH2-O 3.39Å; N1055-S1059 PolarHBondContact O-N 3.5Å; K1056-S1059 PolarHBondContact O-N 2.72Å
1060	K	84.4	Confident	88.5	Confident	98 Å²	98	68.2 Å²	68.2	43%	0.426	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	144.3	-171.1	175.9	172.5	-179.6	-177.7	0	112	N1055 R1058	N1055-K1060 WeakPolarHBondContact CA-O 3.21Å; N1055-K1060 VanDerWaalsContact CB-O 3.3Å; N1055-K1060 WeakPolarHBondContact CB-O 2.99Å; N1055-K1060 PolarHBondContact N-O 2.83Å; N1055-K1060 PolarHBondContact O-N 3.28Å; R1058-K1060 HydrophobicContact CB-CB 4.2Å; R1058-K1060 WeakPolarHBondContact O-CB 2.99Å; R1058-K1060 PolarHBondContact O-N 3.44Å; R1058-K1060 VanDerWaalsContact O-N 3.1Å
1061	C	93.6	Very high	88	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.4	167.4	-68.7	0	0	0	0	113.1	W1052 Y1053 E1079 C1082 L1083	W1052-C1061 HydrophobicContact CE3-CB 4.49Å; Y1053-C1061 CarbonylContact O-C 3.55Å; Y1053-C1061 VanDerWaalsContact O-CA 3.32Å; Y1053-C1061 WeakPolarHBondContact O-CA 3.35Å; C1061-E1079 HydrophobicContact CB-CG 3.85Å; C1061-C1082 HydrophobicContact CB-CB 3.82Å; C1061-C1082 WeakPolarHBondContact CB-SG 3.42Å; C1061-C1082 WeakPolarHBondContact SG-CB 3.49Å; C1061-C1082 CovalentContact SG-SG 2.02Å; C1061-C1082 PolarHBondContact SG-SG 3.39Å; C1061-L1083 HydrophobicContact CB-CD2 3.94Å; C1061-L1083 HydrophobicContact CB-CG 4.08Å; C1061-L1083 PolarHBondContact SG-N 2.93Å
1062	E	90.8	Very high	87.7	Confident	40 Å²	40	60.7 Å²	60.7	19%	0.187	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.4	176.1	-67.6	-174	141.8	0	0	110	W1052 Y1053 N1055 R1058	W1052-E1062 WeakPolarHBondContact CA-O 2.82Å; W1052-E1062 VanDerWaalsContact CE3-C 3.44Å; Y1053-E1062 HydrophobicContact CD1-CB 4.2Å; Y1053-E1062 WeakPolarHBondContact CD1-O 3.41Å; Y1053-E1062 HydrophobicContact CE1-CB 3.64Å; Y1053-E1062 PolarHBondContact N-O 2.84Å; Y1053-E1062 PolarHBondContact O-N 3.36Å; Y1053-E1062 PolarHBondContact OH-OE2 2.78Å; N1055-E1062 HydrophobicContact CB-CG 4.26Å; N1055-E1062 PolarHBondContact ND2-OE2 2.8Å; R1058-E1062 WeakPolarHBondContact CD-OE1 3.3Å; R1058-E1062 IonicContact CZ-OE1 2.66Å; R1058-E1062 IonicContact NE-OE1 3.76Å; R1058-E1062 IonicContact NH1-OE1 3.92Å; R1058-E1062 PolarHBondContact NH1-OE1 2.79Å
1063	S	90.5	Very high	87.4	Confident	51 Å²	51	61.6 Å²	61.6	36%	0.357	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	140.4	177.8	67.6	0	0	0	0	112.3	R1050 R1051 W1052	R1050-S1063 PolarHBondContact NE-OG 3.18Å; R1050-S1063 VanDerWaalsContact NH2-CB 3.29Å; R1050-S1063 PolarHBondContact NH2-OG 2.98Å; R1051-S1063 CarbonylContact O-C 3.5Å; R1051-S1063 WeakPolarHBondContact O-CA 3.39Å; R1051-S1063 WeakPolarHBondContact O-CB 3.08Å; W1052-S1063 VanDerWaalsContact CE3-N 3.31Å
1064	F	93.5	Very high	87.4	Confident	20 Å²	20	60.6 Å²	60.6	9%	0.088	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	174.3	175.3	79.1	-83.7	0	0	0	111.7	K1040 E1041 R1051 Y1053 N1075	K1040-F1064 HydrophobicContact CB-CB 4.07Å; K1040-F1064 HydrophobicContact CB-CD1 3.84Å; K1040-F1064 HydrophobicContact CB-CD2 3.93Å; K1040-F1064 HydrophobicContact CB-CE1 4.18Å; K1040-F1064 HydrophobicContact CB-CE2 4.29Å; K1040-F1064 HydrophobicContact CB-CG 3.69Å; K1040-F1064 HydrophobicContact CB-CZ 4.39Å; K1040-F1064 HydrophobicContact CD-CB 3.63Å; K1040-F1064 HydrophobicContact CD-CG 4.22Å; E1041-F1064 WeakPolarHBondContact O-CE2 3.45Å; R1051-F1064 HydrophobicContact CB-CD1 4.05Å; R1051-F1064 HydrophobicContact CB-CE1 3.62Å; R1051-F1064 HydrophobicContact CB-CE2 4.34Å; R1051-F1064 HydrophobicContact CB-CZ 3.79Å; R1051-F1064 PolarHBondContact N-O 2.75Å; R1051-F1064 PolarHBondContact O-N 3.12Å; Y1053-F1064 HydrophobicContact CD1-CB 4.38Å; Y1053-F1064 AromaticContact CD1-CD1 3.91Å; Y1053-F1064 HydrophobicContact CD1-CD1 3.91Å; Y1053-F1064 HydrophobicContact CD1-CG 4.48Å; Y1053-F1064 HydrophobicContact CG-CD1 4.33Å; F1064-N1075 HydrophobicContact CZ-CB 4.07Å
1065	L	90.5	Very high	87.5	Confident	64 Å²	64	61 Å²	61	34%	0.335	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.7	179	-165	72.7	0	0	0	110.1	R1042 H1048	R1042-L1065 WeakPolarHBondContact CB-O 3.35Å; R1042-L1065 VanDerWaalsContact CG-O 3.27Å; R1042-L1065 WeakPolarHBondContact CG-O 3.11Å; H1048-L1065 VanDerWaalsContact C-CD1 3.46Å; H1048-L1065 HydrophobicContact CB-CD1 4.02Å; H1048-L1065 HydrophobicContact CB-CD2 4.49Å
1066	Y	92.7	Very high	87.7	Confident	24 Å²	24	60 Å²	60	9%	0.094	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.6	176.7	179.7	-124.4	0	0	0	111.4	E1041 R1042 G1047 L1049 R1051 G1068 C1069 R1070 N1075	E1041-Y1066 WeakPolarHBondContact O-CD2 3.24Å; R1042-Y1066 WeakPolarHBondContact O-CD2 3.2Å; G1047-Y1066 CarbonylContact C-O 3.53Å; L1049-Y1066 WeakPolarHBondContact CB-O 3.48Å; L1049-Y1066 HydrophobicContact CD1-CD1 4.25Å; L1049-Y1066 PolarHBondContact N-O 2.95Å; L1049-Y1066 PolarHBondContact O-N 3.11Å; R1051-Y1066 VanDerWaalsContact CG-CB 3.5Å; R1051-Y1066 HydrophobicContact CG-CD1 4.32Å; R1051-Y1066 HydrophobicContact CG-CG 4.24Å; R1051-Y1066 VanDerWaalsContact NH1-CD1 3.32Å; Y1066-G1068 VanDerWaalsContact C-N 3.31Å; Y1066-G1068 VanDerWaalsContact CE1-C 3.43Å; Y1066-G1068 VanDerWaalsContact CZ-C 3.49Å; Y1066-G1068 PolarHBondContact O-N 3.06Å; Y1066-G1068 PolarHBondContact OH-O 3.33Å; Y1066-C1069 VanDerWaalsContact OH-CA 3.23Å; Y1066-C1069 WeakPolarHBondContact OH-CA 3.39Å; Y1066-C1069 PolarHBondContact OH-N 2.84Å; Y1066-R1070 PolarHBondContact OH-N 3.23Å; Y1066-N1075 VanDerWaalsContact CD2-ND2 3.26Å; Y1066-N1075 WeakPolarHBondContact CD2-ND2 3.44Å; Y1066-N1075 VanDerWaalsContact CE2-ND2 3.28Å; Y1066-N1075 WeakPolarHBondContact CE2-ND2 3.31Å
1067	G	87.2	Confident	88	Confident	3 Å²	3	58.3 Å²	58.3	3%	0.031	31%	0.31	C	S	.	.			trans	-75	-15	-178.5	0	0	0	0	0	114.7	R1042 C1045 G1047	R1042-G1067 VanDerWaalsContact O-CA 3.31Å; R1042-G1067 WeakPolarHBondContact O-CA 3.26Å; R1042-G1067 PolarHBondContact O-N 3.35Å; C1045-G1067 CarbonylContact C-O 3.53Å; C1045-G1067 WeakPolarHBondContact CB-O 3.44Å; C1045-G1067 CarbonylContact O-C 3.57Å; C1045-G1067 WeakPolarHBondContact O-CA 3.1Å; G1047-G1067 WeakPolarHBondContact CA-O 3.26Å; G1047-G1067 PolarHBondContact N-O 3.21Å
1068	G	84.2	Confident	88.5	Confident	40 Å²	40	53.4 Å²	53.4	41%	0.412	29%	0.287	S	S	.	.	S	Bend	trans	100.5	-17.1	178.1	0	0	0	0	0	115.1	Y1066	Y1066-G1068 VanDerWaalsContact C-N 3.31Å; Y1066-G1068 VanDerWaalsContact CE1-C 3.43Å; Y1066-G1068 VanDerWaalsContact CZ-C 3.49Å; Y1066-G1068 PolarHBondContact O-N 3.06Å; Y1066-G1068 PolarHBondContact OH-O 3.33Å
1069	C	87.2	Confident	88.6	Confident	34 Å²	34	48.8 Å²	48.8	23%	0.23	27%	0.273	C	S	.	.	S	Bend	trans	-139.2	155.9	174.2	77.1	0	0	0	0	111.8	G1043 C1045 Y1066	G1043-C1069 WeakPolarHBondContact CA-O 3.37Å; C1045-C1069 HydrophobicContact CB-CB 3.95Å; C1045-C1069 WeakPolarHBondContact CB-SG 3.18Å; C1045-C1069 WeakPolarHBondContact SG-CB 3.07Å; C1045-C1069 CovalentContact SG-SG 2.03Å; C1045-C1069 PolarHBondContact SG-SG 2.78Å; Y1066-C1069 VanDerWaalsContact OH-CA 3.23Å; Y1066-C1069 WeakPolarHBondContact OH-CA 3.39Å; Y1066-C1069 PolarHBondContact OH-N 2.84Å
1070	R	81.5	Confident	88.6	Confident	202 Å²	202	48 Å²	48	76%	0.762	27%	0.272	S	S	*	.	S	Bend	trans	42.2	76.8	179.5	-52.9	-176	-174.7	177.9	-0.4	113.5	G1043 P1044 Y1066	G1043-R1070 WeakPolarHBondContact CA-O 3.42Å; P1044-R1070 HydrophobicContact CG-CB 4.43Å; Y1066-R1070 PolarHBondContact OH-N 3.23Å
1071	G	82	Confident	88.6	Confident	25 Å²	25	46.9 Å²	46.9	26%	0.258	27%	0.267	S	S	.	.			trans	-133.7	146.7	162.7	0	0	0	0	0	109.8
1072	N	87.8	Confident	88.6	Confident	36 Å²	36	46.9 Å²	46.9	19%	0.193	27%	0.267	C	S	.	.			trans	-64.4	-178.4	178.4	70.6	67.1	0	0	0	114	Y1038 P1039 E1041 N1074 N1075	Y1038-N1072 WeakPolarHBondContact CB-OD1 3.44Å; Y1038-N1072 HydrophobicContact CD2-CB 4.47Å; Y1038-N1072 HydrophobicContact CG-CB 4.36Å; P1039-N1072 PolarHBondContact O-ND2 2.83Å; P1039-N1072 PolarHBondContact O-OD1 3.08Å; E1041-N1072 WeakPolarHBondContact CB-ND2 3.34Å; E1041-N1072 WeakPolarHBondContact OE2-CB 3.29Å; E1041-N1072 PolarHBondContact OE2-N 2.81Å; E1041-N1072 PolarHBondContact OE2-ND2 3.16Å; N1072-N1074 PolarHBondContact O-N 3.03Å; N1072-N1074 PolarHBondContact OD1-N 3.18Å; N1072-N1075 WeakPolarHBondContact O-CB 3.29Å
1073	A	89.8	Confident	88.3	Confident	50 Å²	50	48.1 Å²	48.1	41%	0.413	28%	0.275	S	S	.	.	S	Bend	trans	-74.9	-12.3	-170.1	0	0	0	0	0	115.7	K1035 Y1038 N1075	K1035-A1073 HydrophobicContact CB-CB 3.72Å; Y1038-A1073 HydrophobicContact CD2-CB 4.06Å; Y1038-A1073 HydrophobicContact CE2-CB 4.14Å; A1073-N1075 PolarHBondContact O-N 3.28Å
1074	N	93.5	Very high	87.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.292	C	S	.	.			trans	-82.4	55.6	172.7	-158.9	1.3	0	0	0	110.7	K1035 C1036 Y1038 Y1053 W1054 N1072 F1076	K1035-N1074 WeakPolarHBondContact O-CB 3.17Å; K1035-N1074 PolarHBondContact O-N 2.89Å; C1036-N1074 PolarHBondContact O-ND2 3.1Å; Y1038-N1074 VanDerWaalsContact O-CB 3.26Å; Y1038-N1074 WeakPolarHBondContact O-CB 3.43Å; Y1038-N1074 PolarHBondContact O-ND2 3.27Å; Y1053-N1074 VanDerWaalsContact CA-OD1 3.22Å; Y1053-N1074 WeakPolarHBondContact CA-OD1 3.34Å; Y1053-N1074 WeakPolarHBondContact CB-O 3.38Å; W1054-N1074 PolarHBondContact N-ND2 3.21Å; W1054-N1074 PolarHBondContact N-OD1 3.19Å; W1054-N1074 PolarHBondContact O-ND2 2.89Å; N1072-N1074 PolarHBondContact O-N 3.03Å; N1072-N1074 PolarHBondContact OD1-N 3.18Å; N1074-F1076 WeakPolarHBondContact OD1-CE2 3.35Å
1075	N	95.2	Very high	87.2	Confident	27 Å²	27	51.9 Å²	51.9	14%	0.144	30%	0.302	C	S	.	.			trans	-141.2	72.9	-167	-174.3	-14.7	0	0	0	110.5	R1051 F1064 Y1066 N1072 A1073	R1051-N1075 VanDerWaalsContact CG-OD1 3.25Å; R1051-N1075 WeakPolarHBondContact CG-OD1 3.43Å; R1051-N1075 PolarHBondContact NH1-OD1 3.01Å; F1064-N1075 HydrophobicContact CZ-CB 4.07Å; Y1066-N1075 VanDerWaalsContact CD2-ND2 3.26Å; Y1066-N1075 WeakPolarHBondContact CD2-ND2 3.44Å; Y1066-N1075 VanDerWaalsContact CE2-ND2 3.28Å; Y1066-N1075 WeakPolarHBondContact CE2-ND2 3.31Å; N1072-N1075 WeakPolarHBondContact O-CB 3.29Å; A1073-N1075 PolarHBondContact O-N 3.28Å
1076	F	93.8	Very high	86.9	Confident	7 Å²	7	49.5 Å²	49.5	3%	0.031	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-89.6	146.5	-175.1	-53.3	-68.7	0	0	0	111.9	R1051 W1052 N1074 T1078 K1081 C1082 E1085 C1086	R1051-F1076 CarbonylContact C-O 3.56Å; R1051-F1076 VanDerWaalsContact CA-O 3.25Å; R1051-F1076 WeakPolarHBondContact CA-O 3.5Å; R1051-F1076 WeakPolarHBondContact CB-O 3.22Å; R1051-F1076 VanDerWaalsContact CD-O 3.23Å; R1051-F1076 WeakPolarHBondContact CD-O 3.23Å; W1052-F1076 HydrophobicContact CB-CB 4.28Å; W1052-F1076 PolarHBondContact N-O 3.49Å; W1052-F1076 WeakPolarHBondContact O-CD2 3.37Å; W1052-F1076 PolarHBondContact O-N 3.4Å; N1074-F1076 WeakPolarHBondContact OD1-CE2 3.35Å; F1076-T1078 VanDerWaalsContact C-N 3.31Å; F1076-K1081 HydrophobicContact CB-CD 4.49Å; F1076-K1081 HydrophobicContact CB-CG 4.48Å; F1076-K1081 HydrophobicContact CD1-CD 4.13Å; F1076-K1081 HydrophobicContact CD1-CG 3.92Å; F1076-K1081 HydrophobicContact CG-CG 4.48Å; F1076-C1082 HydrophobicContact CB-CB 3.95Å; F1076-C1082 VanDerWaalsContact CD2-CA 3.45Å; F1076-C1082 HydrophobicContact CD2-CB 3.31Å; F1076-C1082 HydrophobicContact CE2-CB 4Å; F1076-C1082 HydrophobicContact CG-CB 3.8Å; F1076-E1085 HydrophobicContact CE1-CB 4.24Å; F1076-E1085 HydrophobicContact CE1-CG 4.42Å; F1076-E1085 VanDerWaalsContact CE1-OE2 3.31Å; F1076-E1085 WeakPolarHBondContact CE1-OE2 3.34Å; F1076-E1085 HydrophobicContact CZ-CB 4.22Å; F1076-C1086 VanDerWaalsContact CE2-SG 3.59Å
1077	D	89.3	Confident	86	Confident	83 Å²	83	52.5 Å²	52.5	44%	0.444	30%	0.304	S	S	.	.	S	Bend	trans	-65.7	-32.7	172	42	49.8	0	0	0	112.6	K1081	D1077-K1081 VanDerWaalsContact OD1-CD 3.22Å; D1077-K1081 WeakPolarHBondContact OD1-CD 3.45Å; D1077-K1081 IonicContact OD2-NZ 2.69Å; D1077-K1081 PolarHBondContact OD2-NZ 3.43Å
1078	T	88.4	Confident	84.7	Confident	66 Å²	66	55.4 Å²	55.4	41%	0.405	33%	0.334	S	S	.	.	S	Bend	trans	-138.8	153	-170.6	55.4	0	0	0	0	112.8	W1052 F1076 A1080 K1081 C1082	W1052-T1078 VanDerWaalsContact CD1-CA 3.48Å; F1076-T1078 VanDerWaalsContact C-N 3.31Å; T1078-A1080 VanDerWaalsContact C-N 3.33Å; T1078-A1080 PolarHBondContact O-N 2.99Å; T1078-K1081 VanDerWaalsContact OG1-CB 3.24Å; T1078-K1081 WeakPolarHBondContact OG1-CB 3.14Å; T1078-K1081 PolarHBondContact OG1-N 3.19Å; T1078-C1082 PolarHBondContact O-N 2.83Å
1079	E	84.6	Confident	82.8	Confident	68 Å²	68	60.3 Å²	60.3	32%	0.318	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-39.6	176.2	-167	172	-170.4	0	0	111.4	W1052 C1061 K1081 C1082 L1083	W1052-E1079 HydrophobicContact CD2-CB 3.66Å; W1052-E1079 HydrophobicContact CD2-CG 4.2Å; W1052-E1079 HydrophobicContact CE3-CB 3.64Å; W1052-E1079 HydrophobicContact CE3-CG 3.63Å; W1052-E1079 HydrophobicContact CG-CB 4.31Å; W1052-E1079 HydrophobicContact CH2-CB 3.78Å; W1052-E1079 HydrophobicContact CH2-CG 3.95Å; W1052-E1079 WeakPolarHBondContact CH2-OE2 3.42Å; W1052-E1079 HydrophobicContact CZ2-CB 3.82Å; W1052-E1079 HydrophobicContact CZ2-CG 4.49Å; W1052-E1079 HydrophobicContact CZ3-CB 3.71Å; W1052-E1079 HydrophobicContact CZ3-CG 3.5Å; W1052-E1079 WeakPolarHBondContact CZ3-OE2 3.21Å; C1061-E1079 HydrophobicContact CB-CG 3.85Å; E1079-K1081 PolarHBondContact O-N 3.36Å; E1079-C1082 WeakPolarHBondContact O-CB 3.41Å; E1079-C1082 PolarHBondContact O-N 3.03Å; E1079-L1083 HydrophobicContact CG-CD1 4.18Å; E1079-L1083 HydrophobicContact CG-CG 4.44Å; E1079-L1083 WeakPolarHBondContact O-CG 3.49Å; E1079-L1083 PolarHBondContact O-N 3.2Å
1080	A	79.3	Confident	81	Confident	71 Å²	71	63.5 Å²	63.5	59%	0.587	37%	0.37	S	S	*	.	H	α-helix	trans	-61.5	-45.3	179.7	0	0	0	0	0	112.7	T1078 L1083 A1084	T1078-A1080 VanDerWaalsContact C-N 3.33Å; T1078-A1080 PolarHBondContact O-N 2.99Å; A1080-L1083 PolarHBondContact O-N 3.43Å; A1080-A1084 WeakPolarHBondContact O-CB 3.07Å; A1080-A1084 PolarHBondContact O-N 3.35Å
1081	K	85.7	Confident	79.6	Confident	73 Å²	73	57 Å²	57	32%	0.317	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-45.2	175.6	-177.4	176.4	-178.2	169	0	111.6	F1076 D1077 T1078 E1079 L1083 A1084 E1085	F1076-K1081 HydrophobicContact CB-CD 4.49Å; F1076-K1081 HydrophobicContact CB-CG 4.48Å; F1076-K1081 HydrophobicContact CD1-CD 4.13Å; F1076-K1081 HydrophobicContact CD1-CG 3.92Å; F1076-K1081 HydrophobicContact CG-CG 4.48Å; D1077-K1081 VanDerWaalsContact OD1-CD 3.22Å; D1077-K1081 WeakPolarHBondContact OD1-CD 3.45Å; D1077-K1081 IonicContact OD2-NZ 2.69Å; D1077-K1081 PolarHBondContact OD2-NZ 3.43Å; T1078-K1081 VanDerWaalsContact OG1-CB 3.24Å; T1078-K1081 WeakPolarHBondContact OG1-CB 3.14Å; T1078-K1081 PolarHBondContact OG1-N 3.19Å; E1079-K1081 PolarHBondContact O-N 3.36Å; K1081-L1083 PolarHBondContact O-N 3.27Å; K1081-A1084 PolarHBondContact O-N 3.4Å; K1081-E1085 WeakPolarHBondContact CE-OE1 3.36Å; K1081-E1085 HydrophobicContact CG-CG 4.45Å; K1081-E1085 WeakPolarHBondContact CG-OE1 3.43Å; K1081-E1085 WeakPolarHBondContact O-CB 3.22Å; K1081-E1085 WeakPolarHBondContact O-CG 3.28Å; K1081-E1085 PolarHBondContact O-N 3.46Å
1082	C	92.8	Very high	78.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-56.9	-45.8	173.5	174.3	0	0	0	0	112.4	W1052 W1054 C1061 F1076 T1078 E1079 C1086	W1052-C1082 HydrophobicContact CB-CB 4.1Å; W1054-C1082 PolarHBondContact N-SG 2.99Å; C1061-C1082 HydrophobicContact CB-CB 3.82Å; C1061-C1082 WeakPolarHBondContact CB-SG 3.42Å; C1061-C1082 WeakPolarHBondContact SG-CB 3.49Å; C1061-C1082 CovalentContact SG-SG 2.02Å; C1061-C1082 PolarHBondContact SG-SG 3.39Å; F1076-C1082 HydrophobicContact CB-CB 3.95Å; F1076-C1082 VanDerWaalsContact CD2-CA 3.45Å; F1076-C1082 HydrophobicContact CD2-CB 3.31Å; F1076-C1082 HydrophobicContact CE2-CB 4Å; F1076-C1082 HydrophobicContact CG-CB 3.8Å; T1078-C1082 PolarHBondContact O-N 2.83Å; E1079-C1082 WeakPolarHBondContact O-CB 3.41Å; E1079-C1082 PolarHBondContact O-N 3.03Å; C1082-C1086 WeakPolarHBondContact O-CB 3.42Å; C1082-C1086 PolarHBondContact O-N 3.18Å; C1082-C1086 PolarHBondContact O-SG 2.76Å
1083	L	85.3	Confident	78.4	Confident	67 Å²	67	60.2 Å²	60.2	35%	0.351	37%	0.372	S	S	.	.	H	α-helix	trans	-67.4	-43.7	-179.2	-70.2	170.6	0	0	0	111.4	W1054 C1061 E1079 A1080 K1081 C1086 K1087	W1054-L1083 HydrophobicContact CZ3-CD2 4.04Å; C1061-L1083 HydrophobicContact CB-CD2 3.94Å; C1061-L1083 HydrophobicContact CB-CG 4.08Å; C1061-L1083 PolarHBondContact SG-N 2.93Å; E1079-L1083 HydrophobicContact CG-CD1 4.18Å; E1079-L1083 HydrophobicContact CG-CG 4.44Å; E1079-L1083 WeakPolarHBondContact O-CG 3.49Å; E1079-L1083 PolarHBondContact O-N 3.2Å; A1080-L1083 PolarHBondContact O-N 3.43Å; K1081-L1083 PolarHBondContact O-N 3.27Å; L1083-C1086 PolarHBondContact O-N 2.03Å; L1083-K1087 WeakPolarHBondContact O-CB 3.19Å; L1083-K1087 PolarHBondContact O-N 3.31Å
1084	A	78	Confident	78.4	Confident	88 Å²	88	58.3 Å²	58.3	73%	0.727	36%	0.356	S	S	*	.	H	α-helix	trans	-67.1	-37.7	-178.6	0	0	0	0	0	113	A1080 K1081	A1080-A1084 WeakPolarHBondContact O-CB 3.07Å; A1080-A1084 PolarHBondContact O-N 3.35Å; K1081-A1084 PolarHBondContact O-N 3.4Å
1085	E	81.6	Confident	78.1	Confident	62 Å²	62	64.8 Å²	64.8	29%	0.29	39%	0.386	S	S	.	.	H	α-helix	trans	-78.2	-17.4	179.2	-67.6	-174.2	-141.8	0	0	112.9	H1034 K1035 C1036 F1076 K1081	H1034-E1085 PolarHBondContact CE1-O 2.86Å; K1035-E1085 WeakPolarHBondContact CE-OE2 3.44Å; K1035-E1085 IonicContact NZ-OE2 2.76Å; K1035-E1085 PolarHBondContact NZ-OE2 3.18Å; C1036-E1085 PolarHBondContact SG-O 3.49Å; C1036-E1085 VanDerWaalsContact SG-O 3.32Å; F1076-E1085 HydrophobicContact CE1-CB 4.24Å; F1076-E1085 HydrophobicContact CE1-CG 4.42Å; F1076-E1085 VanDerWaalsContact CE1-OE2 3.31Å; F1076-E1085 WeakPolarHBondContact CE1-OE2 3.34Å; F1076-E1085 HydrophobicContact CZ-CB 4.22Å; K1081-E1085 WeakPolarHBondContact CE-OE1 3.36Å; K1081-E1085 HydrophobicContact CG-CG 4.45Å; K1081-E1085 WeakPolarHBondContact CG-OE1 3.43Å; K1081-E1085 WeakPolarHBondContact O-CB 3.22Å; K1081-E1085 WeakPolarHBondContact O-CG 3.28Å; K1081-E1085 PolarHBondContact O-N 3.46Å
1086	C	85.9	Confident	77.7	Confident	14 Å²	14	66.7 Å²	66.7	10%	0.095	39%	0.394	C	S	.	.	H	α-helix	trans	-125.4	-18.9	-162.3	-56	0	0	0	0	118	C1036 W1054 F1076 C1082 L1083 G1088	C1036-C1086 HydrophobicContact CB-CB 3.41Å; C1036-C1086 VanDerWaalsContact CB-CB 3.41Å; C1036-C1086 WeakPolarHBondContact CB-SG 2.99Å; C1036-C1086 WeakPolarHBondContact SG-CA 3.39Å; C1036-C1086 WeakPolarHBondContact SG-CB 3.22Å; C1036-C1086 CovalentContact SG-SG 2.01Å; C1036-C1086 PolarHBondContact SG-SG 2.82Å; W1054-C1086 HydrophobicContact CB-CB 3.6Å; W1054-C1086 VanDerWaalsContact CB-SG 3.59Å; W1054-C1086 HydrophobicContact CD2-CB 3.41Å; W1054-C1086 VanDerWaalsContact CD2-CB 3.41Å; W1054-C1086 HydrophobicContact CE3-CB 3.6Å; W1054-C1086 HydrophobicContact CG-CB 3.42Å; W1054-C1086 VanDerWaalsContact CG-CB 3.42Å; W1054-C1086 HydrophobicContact CZ3-CB 4.43Å; F1076-C1086 VanDerWaalsContact CE2-SG 3.59Å; C1082-C1086 WeakPolarHBondContact O-CB 3.42Å; C1082-C1086 PolarHBondContact O-N 3.18Å; C1082-C1086 PolarHBondContact O-SG 2.76Å; L1083-C1086 PolarHBondContact O-N 2.03Å; C1086-G1088 PolarHBondContact O-N 2.74Å
1087	K	72.5	Confident	77.5	Confident	87 Å²	87	71 Å²	71	38%	0.378	42%	0.422	S	S	.	.			trans	-87.2	80.4	-175.7	-171.9	-171.2	176.8	-166.8	0	111.7	W1054 L1083 N1130 G1131 N1133	W1054-K1087 HydrophobicContact CH2-CB 3.71Å; W1054-K1087 HydrophobicContact CH2-CG 3.88Å; W1054-K1087 HydrophobicContact CZ3-CB 3.88Å; W1054-K1087 HydrophobicContact CZ3-CG 4.39Å; L1083-K1087 WeakPolarHBondContact O-CB 3.19Å; L1083-K1087 PolarHBondContact O-N 3.31Å; K1087-N1130 PolarHBondContact NZ-O 3.21Å; K1087-G1131 VanDerWaalsContact CE-O 3.26Å; K1087-G1131 WeakPolarHBondContact CE-O 3.24Å; K1087-G1131 PolarHBondContact NZ-O 3.02Å; K1087-N1133 PolarHBondContact NZ-O 2.9Å
1088	G	60	Low	77.6	Confident	64 Å²	64	72.6 Å²	72.6	66%	0.66	43%	0.425	S	S	*	.			trans	-157.8	18.8	-168.5	0	0	0	0	0	121.7	C1086	C1086-G1088 PolarHBondContact O-N 2.74Å
1089	L	44.9	Very low	77.7	Confident	142 Å²	142	71.8 Å²	71.8	74%	0.743	42%	0.419	S	S	*	.			trans	-147	146.3	177.9	-64.4	171	0	0	0	111.7
1090	P	48.6	Very low	78.1	Confident	101 Å²	101	72.2 Å²	72.2	66%	0.656	43%	0.426	S	S	*	.			cis	-123.1	161.3	-42	38.6	-26.7	0	0	0	112.7	D1092	P1090-D1092 PolarHBondContact O-N 3.17Å
1091	A	52.4	Low	78.5	Confident	66 Å²	66	69.9 Å²	69.9	55%	0.545	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	46.4	-62.8	164.4	0	0	0	0	0	120.9	V1093 C1094	A1091-V1093 PolarHBondContact O-N 3.22Å; A1091-V1093 VanDerWaalsContact O-N 3.13Å; A1091-C1094 WeakPolarHBondContact O-CB 3.28Å; A1091-C1094 PolarHBondContact O-N 3.31Å; A1091-C1094 PolarHBondContact O-SG 3.34Å
1092	D	64.2	Low	78.5	Confident	92 Å²	92	72.3 Å²	72.3	49%	0.492	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-60.8	-28.1	-170.3	-174.1	53.3	0	0	0	113.5	P1090 C1094 Q1095 H1096	P1090-D1092 PolarHBondContact O-N 3.17Å; D1092-C1094 PolarHBondContact O-N 3.08Å; D1092-Q1095 PolarHBondContact O-N 3.29Å; D1092-Q1095 PolarHBondContact OD1-NE2 3.29Å; D1092-H1096 IonicContact OD2-CE1 3.41Å
1093	V	81.2	Confident	78.1	Confident	37 Å²	37	75 Å²	75	22%	0.224	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-42.6	-34.7	172.9	171.4	0	0	0	0	113.3	A1091 Q1095 G1131 N1132 F1134	A1091-V1093 PolarHBondContact O-N 3.22Å; A1091-V1093 VanDerWaalsContact O-N 3.13Å; V1093-Q1095 VanDerWaalsContact C-N 3.28Å; V1093-Q1095 PolarHBondContact O-N 3.4Å; V1093-G1131 VanDerWaalsContact CG1-C 3.44Å; V1093-G1131 WeakPolarHBondContact CG1-O 3.13Å; V1093-N1132 WeakPolarHBondContact O-CB 3.2Å; V1093-F1134 HydrophobicContact CG1-CZ 4.29Å
1094	C	88.6	Confident	78	Confident	9 Å²	9	82.1 Å²	82.1	6%	0.061	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-71	-16.2	-177.9	-58.3	0	0	0	0	114.3	A1091 D1092 F1112 N1132 C1144	A1091-C1094 WeakPolarHBondContact O-CB 3.28Å; A1091-C1094 PolarHBondContact O-N 3.31Å; A1091-C1094 PolarHBondContact O-SG 3.34Å; D1092-C1094 PolarHBondContact O-N 3.08Å; C1094-F1112 HydrophobicContact CB-CB 4.2Å; C1094-F1112 HydrophobicContact CB-CD1 4.02Å; C1094-F1112 HydrophobicContact CB-CG 4.26Å; C1094-F1112 WeakPolarHBondContact O-CD1 3.46Å; C1094-N1132 PolarHBondContact O-ND2 2.83Å; C1094-C1144 HydrophobicContact CB-CB 3.72Å; C1094-C1144 WeakPolarHBondContact CB-SG 3.26Å; C1094-C1144 WeakPolarHBondContact SG-CA 2.96Å; C1094-C1144 WeakPolarHBondContact SG-CB 3.25Å; C1094-C1144 CovalentContact SG-SG 2.03Å; C1094-C1144 PolarHBondContact SG-SG 2.62Å
1095	Q	87.2	Confident	78	Confident	137 Å²	137	79.3 Å²	79.3	64%	0.64	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-87.4	-15.8	-178.8	-58.2	-164.8	65.8	0	0	113.7	D1092 V1093	D1092-Q1095 PolarHBondContact O-N 3.29Å; D1092-Q1095 PolarHBondContact OD1-NE2 3.29Å; V1093-Q1095 VanDerWaalsContact C-N 3.28Å; V1093-Q1095 PolarHBondContact O-N 3.4Å
1096	H	87.2	Confident	78.3	Confident	67 Å²	67	84.8 Å²	84.8	31%	0.31	48%	0.475	S	S	.	.	S	Bend	trans	-68.6	150.6	179.7	-51.9	-28.8	0	0	0	111.7	D1092 N1132	D1092-H1096 IonicContact OD2-CE1 3.41Å; H1096-N1132 HydrophobicContact CB-CB 4.11Å; H1096-N1132 PolarHBondContact O-ND2 3.42Å
1097	P	88.9	Confident	78.4	Confident	96 Å²	96	88.9 Å²	88.9	62%	0.623	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-66.6	161.4	174.4	29.6	-36.5	0	0	0	111.7	D1099 N1130	P1097-D1099 PolarHBondContact O-N 2.74Å; P1097-N1130 PolarHBondContact O-ND2 3.41Å; P1097-N1130 PolarHBondContact O-OD1 3.25Å
1098	K	91.8	Very high	79.2	Confident	117 Å²	117	88.9 Å²	88.9	51%	0.509	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-58.2	135.9	164.8	72.9	-173.1	176.3	-169.7	0	109.8	Y1111 F1122	K1098-Y1111 HydrophobicContact CB-CD1 3.64Å; K1098-Y1111 HydrophobicContact CB-CD2 3.75Å; K1098-Y1111 HydrophobicContact CB-CE1 3.87Å; K1098-Y1111 HydrophobicContact CB-CE2 3.98Å; K1098-Y1111 HydrophobicContact CB-CG 3.58Å; K1098-Y1111 HydrophobicContact CD-CD1 4.22Å; K1098-Y1111 HydrophobicContact CD-CE1 3.63Å; K1098-Y1111 HydrophobicContact CD-CE2 4.44Å; K1098-Y1111 HydrophobicContact CG-CE1 4.31Å; K1098-Y1111 HydrophobicContact CG-CE2 4.5Å; K1098-F1122 HydrophobicContact CB-CD1 4.43Å; K1098-F1122 HydrophobicContact CB-CD2 4.2Å; K1098-F1122 HydrophobicContact CB-CE2 4.5Å; K1098-F1122 HydrophobicContact CB-CG 4.16Å; K1098-F1122 HydrophobicContact CD-CB 4.13Å
1099	D	91	Very high	80.8	Confident	50 Å²	50	88.9 Å²	88.9	27%	0.267	47%	0.473	S	S	.	.			trans	-134	108	-175.7	-177.6	4.5	0	0	0	110.8	P1097 G1101 F1122 Y1124 G1129 N1130	P1097-D1099 PolarHBondContact O-N 2.74Å; D1099-G1101 PolarHBondContact O-N 2.88Å; D1099-G1101 PolarHBondContact OD1-N 3.36Å; D1099-F1122 WeakPolarHBondContact O-CE2 3.37Å; D1099-Y1124 WeakPolarHBondContact O-CD2 3.33Å; D1099-G1129 WeakPolarHBondContact OD2-CA 3.42Å; D1099-N1130 HydrophobicContact CB-CB 4.18Å; D1099-N1130 VanDerWaalsContact CB-ND2 3.33Å; D1099-N1130 WeakPolarHBondContact CB-ND2 3.04Å; D1099-N1130 PolarHBondContact OD2-N 2.9Å
1100	V	92.2	Very high	83.2	Confident	76 Å²	76	84.9 Å²	84.9	46%	0.461	45%	0.447	S	S	.	.			trans	-66.7	-25.9	178.5	-174.3	0	0	0	0	110.6	Y1124 G1125	V1100-Y1124 WeakPolarHBondContact O-CD2 3.47Å; V1100-G1125 VanDerWaalsContact O-CA 3.3Å; V1100-G1125 WeakPolarHBondContact O-CA 3.48Å; V1100-G1125 PolarHBondContact O-N 3.29Å
1101	G	88.8	Confident	85.3	Confident	22 Å²	22	81 Å²	81	23%	0.227	42%	0.42	C	S	.	.			trans	68.7	-174.4	-173.6	0	0	0	0	0	113.7	D1099 C1127 G1128	D1099-G1101 PolarHBondContact O-N 2.88Å; D1099-G1101 PolarHBondContact OD1-N 3.36Å; G1101-C1127 CarbonylContact C-O 3.59Å; G1101-C1127 VanDerWaalsContact CA-O 3.32Å; G1101-C1127 WeakPolarHBondContact CA-O 3.27Å; G1101-G1128 WeakPolarHBondContact CA-O 3.26Å
1102	T	85.6	Confident	87.3	Confident	125 Å²	125	79.2 Å²	79.2	77%	0.767	40%	0.4	S	S	*	.	S	Bend	trans	-95.7	-11.9	-168	53	0	0	0	0	114.9	C1127	T1102-C1127 PolarHBondContact N-O 3.33Å
1103	C	85.1	Confident	88.6	Confident	56 Å²	56	75.6 Å²	75.6	38%	0.378	38%	0.381	S	S	.	.	S	Bend	trans	-83	160.2	174.5	-76.8	0	0	0	0	112.3	G1125 C1127	C1103-G1125 CarbonylContact C-O 3.55Å; C1103-G1125 WeakPolarHBondContact CB-O 3.48Å; C1103-G1125 WeakPolarHBondContact O-CA 3.32Å; C1103-C1127 HydrophobicContact CB-CB 3.82Å; C1103-C1127 WeakPolarHBondContact CB-SG 3.49Å; C1103-C1127 WeakPolarHBondContact SG-CB 3.49Å; C1103-C1127 CovalentContact SG-SG 2.03Å; C1103-C1127 PolarHBondContact SG-SG 2.81Å
1104	K	82.7	Confident	88.7	Confident	216 Å²	216	77 Å²	77	94%	0.939	39%	0.392	S	S	*	.			trans	-104.4	23.4	-176.3	-61.2	-173.9	178.1	-177.3	0	114.6
1105	G	77	Confident	88.5	Confident	29 Å²	29	83.3 Å²	83.3	30%	0.299	43%	0.425	S	S	.	.			trans	-74	161.8	173.7	0	0	0	0	0	112.8	G1125	G1105-G1125 VanDerWaalsContact CA-O 3.31Å; G1105-G1125 WeakPolarHBondContact CA-O 3.34Å; G1105-G1125 PolarHBondContact N-O 3.42Å; G1105-G1125 VanDerWaalsContact O-CA 3.3Å; G1105-G1125 WeakPolarHBondContact O-CA 3.45Å
1106	Y	87.6	Confident	88.5	Confident	177 Å²	177	80 Å²	80	69%	0.694	41%	0.411	S	S	*	.			trans	-117.2	71.8	-177	-159.5	-86.2	0	0	0	111	H1108 V1123	Y1106-H1108 AromaticContact CE1-CE1 3.97Å; Y1106-V1123 HydrophobicContact CD1-CG1 4.28Å; Y1106-V1123 HydrophobicContact CD2-CG1 3.72Å; Y1106-V1123 HydrophobicContact CE1-CG1 4.47Å; Y1106-V1123 HydrophobicContact CE1-CG2 4.02Å; Y1106-V1123 HydrophobicContact CE2-CG1 3.96Å; Y1106-V1123 HydrophobicContact CE2-CG2 3.97Å; Y1106-V1123 HydrophobicContact CG-CG1 3.9Å
1107	F	89.7	Confident	88.4	Confident	100 Å²	100	78.1 Å²	78.1	44%	0.439	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.1	-177.5	-57.7	-80.6	0	0	0	111.1	R1109 Y1124 G1126	F1107-R1109 PolarHBondContact O-N 3.28Å; F1107-Y1124 WeakPolarHBondContact CB-O 3.37Å; F1107-Y1124 WeakPolarHBondContact CD2-O 3.33Å; F1107-Y1124 PolarHBondContact N-O 2.79Å; F1107-Y1124 PolarHBondContact O-N 3.39Å; F1107-G1126 VanDerWaalsContact CD2-CA 3.5Å
1108	H	89.5	Confident	88.4	Confident	87 Å²	87	77.8 Å²	77.8	40%	0.403	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	135.5	172.1	-77.6	-46.6	0	0	0	111.9	Y1106	Y1106-H1108 AromaticContact CE1-CE1 3.97Å
1109	R	92.5	Very high	88.5	Confident	65 Å²	65	72.9 Å²	72.9	25%	0.245	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	168.4	-180	-63	-62.9	156.3	88	0	110.9	F1107 R1121 F1122 Y1124 N1133 F1134	F1107-R1109 PolarHBondContact O-N 3.28Å; R1109-R1121 CarbonylContact O-C 3.47Å; R1109-R1121 VanDerWaalsContact O-CA 3.31Å; R1109-R1121 WeakPolarHBondContact O-CA 3.05Å; R1109-R1121 WeakPolarHBondContact O-CG 3.48Å; R1109-F1122 HydrophobicContact CB-CD1 3.97Å; R1109-F1122 HydrophobicContact CB-CE1 3.53Å; R1109-F1122 HydrophobicContact CB-CZ 3.87Å; R1109-F1122 PolarHBondContact N-O 2.73Å; R1109-F1122 PolarHBondContact O-N 3.19Å; R1109-Y1124 HydrophobicContact CG-CD1 4.4Å; R1109-Y1124 HydrophobicContact CG-CG 4.36Å; R1109-N1133 WeakPolarHBondContact CD-OD1 3.49Å; R1109-N1133 VanDerWaalsContact CG-OD1 3.24Å; R1109-N1133 WeakPolarHBondContact CG-OD1 3.02Å; R1109-N1133 PolarHBondContact NH1-OD1 3.31Å; R1109-F1134 CarbonylContact C-O 3.45Å; R1109-F1134 WeakPolarHBondContact CA-O 3.48Å; R1109-F1134 WeakPolarHBondContact CB-O 3.48Å; R1109-F1134 WeakPolarHBondContact CD-O 3.41Å
1110	W	94.5	Very high	88.6	Confident	57 Å²	57	73.8 Å²	73.8	22%	0.216	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.9	176.7	-63.8	80.8	0	0	0	110.7	K1120 R1121 F1134 L1137 C1140	W1110-K1120 CarbonylContact C-O 3.24Å; W1110-K1120 VanDerWaalsContact CA-O 3.29Å; W1110-K1120 WeakPolarHBondContact CA-O 3.33Å; W1110-R1121 HydrophobicContact CD2-CB 4.09Å; W1110-R1121 HydrophobicContact CE3-CB 4.06Å; W1110-R1121 HydrophobicContact CH2-CB 4.03Å; W1110-R1121 HydrophobicContact CZ2-CB 4.05Å; W1110-R1121 HydrophobicContact CZ3-CB 4.03Å; W1110-F1134 HydrophobicContact CB-CB 4.38Å; W1110-F1134 PolarHBondContact N-O 2.84Å; W1110-F1134 WeakPolarHBondContact O-CD2 3.38Å; W1110-F1134 PolarHBondContact O-N 3.43Å; W1110-L1137 HydrophobicContact CD2-CB 3.79Å; W1110-L1137 HydrophobicContact CD2-CD1 4.38Å; W1110-L1137 HydrophobicContact CE3-CB 3.95Å; W1110-L1137 HydrophobicContact CE3-CD1 3.72Å; W1110-L1137 HydrophobicContact CE3-CG 4.32Å; W1110-L1137 HydrophobicContact CG-CB 4.35Å; W1110-L1137 HydrophobicContact CH2-CB 4.15Å; W1110-L1137 HydrophobicContact CH2-CD2 4.12Å; W1110-L1137 HydrophobicContact CH2-CG 4.49Å; W1110-L1137 HydrophobicContact CZ2-CB 3.99Å; W1110-L1137 HydrophobicContact CZ3-CB 4.13Å; W1110-L1137 HydrophobicContact CZ3-CD1 3.8Å; W1110-L1137 HydrophobicContact CZ3-CD2 4.17Å; W1110-L1137 HydrophobicContact CZ3-CG 4.25Å; W1110-C1140 HydrophobicContact CB-CB 4.16Å
1111	Y	94.6	Very high	88.5	Confident	21 Å²	21	75 Å²	75	8%	0.082	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	147.4	174.5	81.3	-78.6	0	0	0	109.6	K1098 D1113 C1119 K1120 F1122 N1132	K1098-Y1111 HydrophobicContact CB-CD1 3.64Å; K1098-Y1111 HydrophobicContact CB-CD2 3.75Å; K1098-Y1111 HydrophobicContact CB-CE1 3.87Å; K1098-Y1111 HydrophobicContact CB-CE2 3.98Å; K1098-Y1111 HydrophobicContact CB-CG 3.58Å; K1098-Y1111 HydrophobicContact CD-CD1 4.22Å; K1098-Y1111 HydrophobicContact CD-CE1 3.63Å; K1098-Y1111 HydrophobicContact CD-CE2 4.44Å; K1098-Y1111 HydrophobicContact CG-CE1 4.31Å; K1098-Y1111 HydrophobicContact CG-CE2 4.5Å; Y1111-D1113 HydrophobicContact CD2-CB 4.42Å; Y1111-D1113 HydrophobicContact CE2-CB 3.63Å; Y1111-D1113 PolarHBondContact O-N 3.33Å; Y1111-D1113 PolarHBondContact OH-OD2 3.08Å; Y1111-C1119 CarbonylContact O-C 3.55Å; Y1111-C1119 VanDerWaalsContact O-CA 3.27Å; Y1111-C1119 WeakPolarHBondContact O-CA 3.45Å; Y1111-K1120 HydrophobicContact CD1-CB 4.09Å; Y1111-K1120 VanDerWaalsContact CD1-O 3.32Å; Y1111-K1120 WeakPolarHBondContact CD1-O 3.18Å; Y1111-K1120 HydrophobicContact CE1-CB 3.51Å; Y1111-K1120 PolarHBondContact N-O 2.04Å; Y1111-K1120 PolarHBondContact O-N 3.24Å; Y1111-F1122 HydrophobicContact CD1-CB 4.19Å; Y1111-F1122 AromaticContact CD1-CD1 3.72Å; Y1111-F1122 HydrophobicContact CD1-CD1 3.72Å; Y1111-F1122 HydrophobicContact CD1-CE1 4.44Å; Y1111-F1122 HydrophobicContact CD1-CG 4.22Å; Y1111-F1122 HydrophobicContact CE1-CB 4.42Å; Y1111-F1122 HydrophobicContact CG-CD1 4.28Å; Y1111-N1132 VanDerWaalsContact CA-OD1 3.28Å; Y1111-N1132 WeakPolarHBondContact CA-OD1 3.22Å; Y1111-N1132 WeakPolarHBondContact CB-O 3.09Å
1112	F	93.7	Very high	88.7	Confident	28 Å²	28	74.7 Å²	74.7	12%	0.123	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	116.5	171.5	-171.3	-103.1	0	0	0	110	C1094 S1114 G1117 N1132 C1144 L1145	C1094-F1112 HydrophobicContact CB-CB 4.2Å; C1094-F1112 HydrophobicContact CB-CD1 4.02Å; C1094-F1112 HydrophobicContact CB-CG 4.26Å; C1094-F1112 WeakPolarHBondContact O-CD1 3.46Å; F1112-S1114 PolarHBondContact O-N 3.24Å; F1112-G1117 VanDerWaalsContact CE2-C 3.44Å; F1112-G1117 VanDerWaalsContact CE2-O 3.26Å; F1112-G1117 WeakPolarHBondContact CE2-O 3.17Å; F1112-N1132 PolarHBondContact N-ND2 3.02Å; F1112-N1132 PolarHBondContact N-OD1 2.85Å; F1112-N1132 PolarHBondContact O-ND2 2.96Å; F1112-C1144 HydrophobicContact CB-CB 3.98Å; F1112-C1144 HydrophobicContact CD1-CB 4.31Å; F1112-C1144 HydrophobicContact CD2-CB 3.45Å; F1112-C1144 VanDerWaalsContact CD2-CB 3.45Å; F1112-C1144 HydrophobicContact CE2-CB 3.92Å; F1112-C1144 HydrophobicContact CG-CB 3.66Å; F1112-L1145 HydrophobicContact CE2-CD2 3.67Å; F1112-L1145 HydrophobicContact CE2-CG 4.19Å; F1112-L1145 HydrophobicContact CZ-CD2 4.18Å
1113	D	90.8	Very high	89	Confident	16 Å²	16	70.5 Å²	70.5	9%	0.086	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	93.6	175.7	-170.1	-11.1	0	0	0	109	Y1111 N1115 I1116 G1117 W1118 K1120	Y1111-D1113 HydrophobicContact CD2-CB 4.42Å; Y1111-D1113 HydrophobicContact CE2-CB 3.63Å; Y1111-D1113 PolarHBondContact O-N 3.33Å; Y1111-D1113 PolarHBondContact OH-OD2 3.08Å; D1113-N1115 PolarHBondContact O-N 2.89Å; D1113-N1115 PolarHBondContact OD1-N 2.82Å; D1113-N1115 PolarHBondContact OD1-ND2 2.83Å; D1113-I1116 HydrophobicContact CB-CD1 4.36Å; D1113-I1116 HydrophobicContact CB-CG1 3.82Å; D1113-I1116 WeakPolarHBondContact O-CG1 3.47Å; D1113-I1116 PolarHBondContact O-N 2.78Å; D1113-G1117 PolarHBondContact O-N 2.78Å; D1113-W1118 PolarHBondContact N-O 3.42Å; D1113-K1120 HydrophobicContact CB-CD 4.1Å; D1113-K1120 WeakPolarHBondContact OD2-CD 3.39Å; D1113-K1120 IonicContact OD2-NZ 3.54Å; D1113-K1120 PolarHBondContact OD2-NZ 2.72Å
1114	S	84.8	Confident	89.3	Confident	65 Å²	65	69.1 Å²	69.1	46%	0.455	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.7	-176.4	51.6	0	0	0	0	114.2	F1112 I1116	F1112-S1114 PolarHBondContact O-N 3.24Å; S1114-I1116 VanDerWaalsContact C-N 3.35Å
1115	N	82.6	Confident	89.5	Confident	142 Å²	142	59 Å²	59	76%	0.759	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-25.2	177	-51.1	-82.2	0	0	0	113.2	D1113	D1113-N1115 PolarHBondContact O-N 2.89Å; D1113-N1115 PolarHBondContact OD1-N 2.82Å; D1113-N1115 PolarHBondContact OD1-ND2 2.83Å
1116	I	87.8	Confident	89.8	Confident	68 Å²	68	59.1 Å²	59.1	35%	0.349	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-14.6	177	62	160.2	0	0	0	113.3	D1113 S1114 W1118 K1120	D1113-I1116 HydrophobicContact CB-CD1 4.36Å; D1113-I1116 HydrophobicContact CB-CG1 3.82Å; D1113-I1116 WeakPolarHBondContact O-CG1 3.47Å; D1113-I1116 PolarHBondContact O-N 2.78Å; S1114-I1116 VanDerWaalsContact C-N 3.35Å; I1116-W1118 HydrophobicContact CD1-CB 3.84Å; I1116-W1118 HydrophobicContact CD1-CG 4.42Å; I1116-W1118 HydrophobicContact CG1-CB 4.21Å; I1116-K1120 HydrophobicContact CD1-CD 4.28Å; I1116-K1120 VanDerWaalsContact CD1-CE 3.4Å; I1116-K1120 HydrophobicContact CD1-CG 4.45Å
1117	G	86.2	Confident	89.6	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	20.1	-177.6	0	0	0	0	0	114.9	F1112 D1113	F1112-G1117 VanDerWaalsContact CE2-C 3.44Å; F1112-G1117 VanDerWaalsContact CE2-O 3.26Å; F1112-G1117 WeakPolarHBondContact CE2-O 3.17Å; D1113-G1117 PolarHBondContact O-N 2.78Å
1118	W	88.4	Confident	89.3	Confident	90 Å²	90	50.1 Å²	50.1	34%	0.341	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	153.6	-176.9	-61.9	91.2	0	0	0	113.2	P992 L993 D1113 I1116	P992-W1118 HydrophobicContact CB-CH2 4.41Å; P992-W1118 HydrophobicContact CB-CZ2 4.05Å; P992-W1118 HydrophobicContact CG-CZ2 3.95Å; L993-W1118 HydrophobicContact CD1-CZ2 4.14Å; D1113-W1118 PolarHBondContact N-O 3.42Å; I1116-W1118 HydrophobicContact CD1-CB 3.84Å; I1116-W1118 HydrophobicContact CD1-CG 4.42Å; I1116-W1118 HydrophobicContact CG1-CB 4.21Å
1119	C	93.9	Very high	88.8	Confident	13 Å²	13	47.2 Å²	47.2	9%	0.088	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.1	175.5	-69	0	0	0	0	112.7	Y1111 L1137 C1140 R1141	Y1111-C1119 CarbonylContact O-C 3.55Å; Y1111-C1119 VanDerWaalsContact O-CA 3.27Å; Y1111-C1119 WeakPolarHBondContact O-CA 3.45Å; C1119-L1137 HydrophobicContact CB-CD1 3.44Å; C1119-L1137 VanDerWaalsContact CB-CD1 3.44Å; C1119-C1140 HydrophobicContact CB-CB 3.82Å; C1119-C1140 WeakPolarHBondContact CB-SG 3.43Å; C1119-C1140 WeakPolarHBondContact SG-CB 3.3Å; C1119-C1140 CovalentContact SG-SG 2.03Å; C1119-C1140 PolarHBondContact SG-SG 3.47Å; C1119-R1141 PolarHBondContact SG-N 3.07Å
1120	K	92.5	Very high	88.6	Confident	70 Å²	70	46 Å²	46	30%	0.304	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	151.8	175.3	-81.1	176.6	178.1	156.1	0	111.8	W1110 Y1111 D1113 I1116	W1110-K1120 CarbonylContact C-O 3.24Å; W1110-K1120 VanDerWaalsContact CA-O 3.29Å; W1110-K1120 WeakPolarHBondContact CA-O 3.33Å; Y1111-K1120 HydrophobicContact CD1-CB 4.09Å; Y1111-K1120 VanDerWaalsContact CD1-O 3.32Å; Y1111-K1120 WeakPolarHBondContact CD1-O 3.18Å; Y1111-K1120 HydrophobicContact CE1-CB 3.51Å; Y1111-K1120 PolarHBondContact N-O 2.04Å; Y1111-K1120 PolarHBondContact O-N 3.24Å; D1113-K1120 HydrophobicContact CB-CD 4.1Å; D1113-K1120 WeakPolarHBondContact OD2-CD 3.39Å; D1113-K1120 IonicContact OD2-NZ 3.54Å; D1113-K1120 PolarHBondContact OD2-NZ 2.72Å; I1116-K1120 HydrophobicContact CD1-CD 4.28Å; I1116-K1120 VanDerWaalsContact CD1-CE 3.4Å; I1116-K1120 HydrophobicContact CD1-CG 4.45Å
1121	R	90.7	Very high	88.1	Confident	101 Å²	101	44 Å²	44	38%	0.381	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.9	172	-174.7	175.9	62.2	-173.3	-15.6	110.9	Q987 R1109 W1110	Q987-R1121 VanDerWaalsContact OE1-CZ 3.23Å; R1109-R1121 CarbonylContact O-C 3.47Å; R1109-R1121 VanDerWaalsContact O-CA 3.31Å; R1109-R1121 WeakPolarHBondContact O-CA 3.05Å; R1109-R1121 WeakPolarHBondContact O-CG 3.48Å; W1110-R1121 HydrophobicContact CD2-CB 4.09Å; W1110-R1121 HydrophobicContact CE3-CB 4.06Å; W1110-R1121 HydrophobicContact CH2-CB 4.03Å; W1110-R1121 HydrophobicContact CZ2-CB 4.05Å; W1110-R1121 HydrophobicContact CZ3-CB 4.03Å
1122	F	93.6	Very high	88.1	Confident	15 Å²	15	43 Å²	43	7%	0.066	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	177.4	166.8	76.9	-72.8	0	0	0	111.3	K1098 D1099 R1109 Y1111 N1133	K1098-F1122 HydrophobicContact CB-CD1 4.43Å; K1098-F1122 HydrophobicContact CB-CD2 4.2Å; K1098-F1122 HydrophobicContact CB-CE2 4.5Å; K1098-F1122 HydrophobicContact CB-CG 4.16Å; K1098-F1122 HydrophobicContact CD-CB 4.13Å; D1099-F1122 WeakPolarHBondContact O-CE2 3.37Å; R1109-F1122 HydrophobicContact CB-CD1 3.97Å; R1109-F1122 HydrophobicContact CB-CE1 3.53Å; R1109-F1122 HydrophobicContact CB-CZ 3.87Å; R1109-F1122 PolarHBondContact N-O 2.73Å; R1109-F1122 PolarHBondContact O-N 3.19Å; Y1111-F1122 HydrophobicContact CD1-CB 4.19Å; Y1111-F1122 AromaticContact CD1-CD1 3.72Å; Y1111-F1122 HydrophobicContact CD1-CD1 3.72Å; Y1111-F1122 HydrophobicContact CD1-CE1 4.44Å; Y1111-F1122 HydrophobicContact CD1-CG 4.22Å; Y1111-F1122 HydrophobicContact CE1-CB 4.42Å; Y1111-F1122 HydrophobicContact CG-CD1 4.28Å; F1122-N1133 HydrophobicContact CE1-CB 4.39Å; F1122-N1133 HydrophobicContact CZ-CB 3.87Å
1123	V	91.4	Very high	88.1	Confident	38 Å²	38	42.2 Å²	42.2	23%	0.23	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.5	171.5	179.6	0	0	0	0	108.2	Y1106	Y1106-V1123 HydrophobicContact CD1-CG1 4.28Å; Y1106-V1123 HydrophobicContact CD2-CG1 3.72Å; Y1106-V1123 HydrophobicContact CE1-CG1 4.47Å; Y1106-V1123 HydrophobicContact CE1-CG2 4.02Å; Y1106-V1123 HydrophobicContact CE2-CG1 3.96Å; Y1106-V1123 HydrophobicContact CE2-CG2 3.97Å; Y1106-V1123 HydrophobicContact CG-CG1 3.9Å
1124	Y	91.2	Very high	88.2	Confident	26 Å²	26	42 Å²	42	10%	0.102	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.2	174.4	176	-130.1	0	0	0	110.2	D1099 V1100 F1107 R1109 G1126 C1127 G1128 G1129 N1133	D1099-Y1124 WeakPolarHBondContact O-CD2 3.33Å; V1100-Y1124 WeakPolarHBondContact O-CD2 3.47Å; F1107-Y1124 WeakPolarHBondContact CB-O 3.37Å; F1107-Y1124 WeakPolarHBondContact CD2-O 3.33Å; F1107-Y1124 PolarHBondContact N-O 2.79Å; F1107-Y1124 PolarHBondContact O-N 3.39Å; R1109-Y1124 HydrophobicContact CG-CD1 4.4Å; R1109-Y1124 HydrophobicContact CG-CG 4.36Å; Y1124-G1126 VanDerWaalsContact CE1-CA 3.42Å; Y1124-G1126 WeakPolarHBondContact CE1-O 3.23Å; Y1124-G1126 VanDerWaalsContact CZ-C 3.43Å; Y1124-G1126 PolarHBondContact O-N 2.64Å; Y1124-G1126 VanDerWaalsContact O-N 3.15Å; Y1124-G1126 PolarHBondContact OH-O 2.79Å; Y1124-C1127 WeakPolarHBondContact OH-CA 3.39Å; Y1124-C1127 PolarHBondContact OH-N 3.31Å; Y1124-G1128 PolarHBondContact OH-N 3.2Å; Y1124-G1129 PolarHBondContact OH-N 3.3Å; Y1124-N1133 WeakPolarHBondContact CD2-ND2 3.43Å
1125	G	87.2	Confident	88.2	Confident	3 Å²	3	41.8 Å²	41.8	3%	0.031	25%	0.251	C	S	.	.			trans	-63.7	-12.1	177.8	0	0	0	0	0	115.1	V1100 C1103 G1105	V1100-G1125 VanDerWaalsContact O-CA 3.3Å; V1100-G1125 WeakPolarHBondContact O-CA 3.48Å; V1100-G1125 PolarHBondContact O-N 3.29Å; C1103-G1125 CarbonylContact C-O 3.55Å; C1103-G1125 WeakPolarHBondContact CB-O 3.48Å; C1103-G1125 WeakPolarHBondContact O-CA 3.32Å; G1105-G1125 VanDerWaalsContact CA-O 3.31Å; G1105-G1125 WeakPolarHBondContact CA-O 3.34Å; G1105-G1125 PolarHBondContact N-O 3.42Å; G1105-G1125 VanDerWaalsContact O-CA 3.3Å; G1105-G1125 WeakPolarHBondContact O-CA 3.45Å
1126	G	81.8	Confident	88.3	Confident	33 Å²	33	38.3 Å²	38.3	34%	0.34	24%	0.235	S	C	.	.	S	Bend	trans	96.1	-24.2	179.1	0	0	0	0	0	114.4	F1107 Y1124	F1107-G1126 VanDerWaalsContact CD2-CA 3.5Å; Y1124-G1126 VanDerWaalsContact CE1-CA 3.42Å; Y1124-G1126 WeakPolarHBondContact CE1-O 3.23Å; Y1124-G1126 VanDerWaalsContact CZ-C 3.43Å; Y1124-G1126 PolarHBondContact O-N 2.64Å; Y1124-G1126 VanDerWaalsContact O-N 3.15Å; Y1124-G1126 PolarHBondContact OH-O 2.79Å
1127	C	84.7	Confident	88.2	Confident	41 Å²	41	37.3 Å²	37.3	28%	0.277	23%	0.23	S	C	.	.	S	Bend	trans	-140.7	152.1	172.8	86.2	0	0	0	0	112	G1101 T1102 C1103 Y1124	G1101-C1127 CarbonylContact C-O 3.59Å; G1101-C1127 VanDerWaalsContact CA-O 3.32Å; G1101-C1127 WeakPolarHBondContact CA-O 3.27Å; T1102-C1127 PolarHBondContact N-O 3.33Å; C1103-C1127 HydrophobicContact CB-CB 3.82Å; C1103-C1127 WeakPolarHBondContact CB-SG 3.49Å; C1103-C1127 WeakPolarHBondContact SG-CB 3.49Å; C1103-C1127 CovalentContact SG-SG 2.03Å; C1103-C1127 PolarHBondContact SG-SG 2.81Å; Y1124-C1127 WeakPolarHBondContact OH-CA 3.39Å; Y1124-C1127 PolarHBondContact OH-N 3.31Å
1128	G	82.4	Confident	87.7	Confident	47 Å²	47	41.7 Å²	41.7	49%	0.485	24%	0.243	S	C	.	.	S	Bend	trans	84.8	12.6	170.3	0	0	0	0	0	116.2	G1101 Y1124	G1101-G1128 WeakPolarHBondContact CA-O 3.26Å; Y1124-G1128 PolarHBondContact OH-N 3.2Å
1129	G	80.3	Confident	87.4	Confident	25 Å²	25	40.7 Å²	40.7	26%	0.258	24%	0.243	S	C	.	.			trans	-95.5	152.6	180	0	0	0	0	0	114.4	D1099 Y1124	D1099-G1129 WeakPolarHBondContact OD2-CA 3.42Å; Y1124-G1129 PolarHBondContact OH-N 3.3Å
1130	N	87	Confident	87.3	Confident	39 Å²	39	40.1 Å²	40.1	21%	0.209	24%	0.239	C	C	.	.			trans	-74.8	-169.1	-178.3	78	37.2	0	0	0	115.8	K1087 P1097 D1099 N1132	K1087-N1130 PolarHBondContact NZ-O 3.21Å; P1097-N1130 PolarHBondContact O-ND2 3.41Å; P1097-N1130 PolarHBondContact O-OD1 3.25Å; D1099-N1130 HydrophobicContact CB-CB 4.18Å; D1099-N1130 VanDerWaalsContact CB-ND2 3.33Å; D1099-N1130 WeakPolarHBondContact CB-ND2 3.04Å; D1099-N1130 PolarHBondContact OD2-N 2.9Å; N1130-N1132 PolarHBondContact OD1-N 3.27Å
1131	G	85.6	Confident	87	Confident	17 Å²	17	41.3 Å²	41.3	18%	0.175	24%	0.241	C	C	.	.	S	Bend	trans	-59.9	-42.8	-179.3	0	0	0	0	0	115.1	K1087 V1093 N1133	K1087-G1131 VanDerWaalsContact CE-O 3.26Å; K1087-G1131 WeakPolarHBondContact CE-O 3.24Å; K1087-G1131 PolarHBondContact NZ-O 3.02Å; V1093-G1131 VanDerWaalsContact CG1-C 3.44Å; V1093-G1131 WeakPolarHBondContact CG1-O 3.13Å; G1131-N1133 PolarHBondContact O-N 3.31Å
1132	N	93.8	Very high	86.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.244	C	C	.	.			trans	-77.7	62.6	-171.5	-158.5	1.2	0	0	0	111.8	V1093 C1094 H1096 Y1111 F1112 N1130 F1134	V1093-N1132 WeakPolarHBondContact O-CB 3.2Å; C1094-N1132 PolarHBondContact O-ND2 2.83Å; H1096-N1132 HydrophobicContact CB-CB 4.11Å; H1096-N1132 PolarHBondContact O-ND2 3.42Å; Y1111-N1132 VanDerWaalsContact CA-OD1 3.28Å; Y1111-N1132 WeakPolarHBondContact CA-OD1 3.22Å; Y1111-N1132 WeakPolarHBondContact CB-O 3.09Å; F1112-N1132 PolarHBondContact N-ND2 3.02Å; F1112-N1132 PolarHBondContact N-OD1 2.85Å; F1112-N1132 PolarHBondContact O-ND2 2.96Å; N1130-N1132 PolarHBondContact OD1-N 3.27Å; N1132-F1134 VanDerWaalsContact OD1-CE2 3.3Å; N1132-F1134 WeakPolarHBondContact OD1-CE2 3.26Å
1133	N	94.2	Very high	85.9	Confident	11 Å²	11	42.1 Å²	42.1	6%	0.059	26%	0.259	C	S	.	.			trans	-154.5	83.7	-166.9	-179.7	-30.8	0	0	0	106.9	K1087 R1109 F1122 Y1124 G1131	K1087-N1133 PolarHBondContact NZ-O 2.9Å; R1109-N1133 WeakPolarHBondContact CD-OD1 3.49Å; R1109-N1133 VanDerWaalsContact CG-OD1 3.24Å; R1109-N1133 WeakPolarHBondContact CG-OD1 3.02Å; R1109-N1133 PolarHBondContact NH1-OD1 3.31Å; F1122-N1133 HydrophobicContact CE1-CB 4.39Å; F1122-N1133 HydrophobicContact CZ-CB 3.87Å; Y1124-N1133 WeakPolarHBondContact CD2-ND2 3.43Å; G1131-N1133 PolarHBondContact O-N 3.31Å
1134	F	92.8	Very high	85.7	Confident	12 Å²	12	41.5 Å²	41.5	5%	0.053	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-95.8	149	-179.5	-56.9	-74.4	0	0	0	109.9	V1093 R1109 W1110 N1132 E1139 C1140 T1143	V1093-F1134 HydrophobicContact CG1-CZ 4.29Å; R1109-F1134 CarbonylContact C-O 3.45Å; R1109-F1134 WeakPolarHBondContact CA-O 3.48Å; R1109-F1134 WeakPolarHBondContact CB-O 3.48Å; R1109-F1134 WeakPolarHBondContact CD-O 3.41Å; W1110-F1134 HydrophobicContact CB-CB 4.38Å; W1110-F1134 PolarHBondContact N-O 2.84Å; W1110-F1134 WeakPolarHBondContact O-CD2 3.38Å; W1110-F1134 PolarHBondContact O-N 3.43Å; N1132-F1134 VanDerWaalsContact OD1-CE2 3.3Å; N1132-F1134 WeakPolarHBondContact OD1-CE2 3.26Å; F1134-E1139 VanDerWaalsContact CA-OE1 3.28Å; F1134-E1139 WeakPolarHBondContact CA-OE1 3.12Å; F1134-E1139 HydrophobicContact CB-CB 4.44Å; F1134-E1139 HydrophobicContact CB-CG 4.09Å; F1134-E1139 HydrophobicContact CD1-CG 3.85Å; F1134-E1139 HydrophobicContact CG-CG 4.38Å; F1134-C1140 HydrophobicContact CB-CB 3.95Å; F1134-C1140 HydrophobicContact CD2-CB 3.34Å; F1134-C1140 VanDerWaalsContact CD2-SG 3.53Å; F1134-C1140 HydrophobicContact CE2-CB 3.92Å; F1134-C1140 HydrophobicContact CG-CB 3.72Å; F1134-T1143 HydrophobicContact CE1-CG2 3.85Å; F1134-T1143 HydrophobicContact CZ-CG2 3.95Å
1135	A	84.7	Confident	85.4	Confident	59 Å²	59	43.8 Å²	43.8	49%	0.488	27%	0.269	S	S	.	.	S	Bend	trans	-72.6	-34.8	175.5	0	0	0	0	0	112.1	E1139	A1135-E1139 WeakPolarHBondContact CA-OE2 3.26Å; A1135-E1139 WeakPolarHBondContact CB-OE2 3.11Å; A1135-E1139 VanDerWaalsContact N-CD 3.29Å; A1135-E1139 PolarHBondContact N-OE1 2.7Å; A1135-E1139 VanDerWaalsContact N-OE1 3.08Å; A1135-E1139 PolarHBondContact N-OE2 3.29Å
1136	T	84.1	Confident	84.3	Confident	69 Å²	69	47.7 Å²	47.7	42%	0.423	30%	0.296	S	S	.	.	S	Bend	trans	-127.8	159.5	-176.2	72	0	0	0	0	114	Q1138 E1139 C1140	T1136-Q1138 VanDerWaalsContact C-N 3.32Å; T1136-E1139 PolarHBondContact N-OE2 3.3Å; T1136-E1139 WeakPolarHBondContact OG1-CB 3.18Å; T1136-E1139 PolarHBondContact OG1-N 3.22Å; T1136-E1139 VanDerWaalsContact OG1-N 3.13Å; T1136-E1139 PolarHBondContact OG1-OE2 2.02Å; T1136-C1140 PolarHBondContact O-N 3.38Å
1137	L	86.2	Confident	82.4	Confident	48 Å²	48	51.4 Å²	51.4	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-40.3	171.9	172.8	57.5	0	0	0	111.5	W1110 C1119 C1140 R1141	W1110-L1137 HydrophobicContact CD2-CB 3.79Å; W1110-L1137 HydrophobicContact CD2-CD1 4.38Å; W1110-L1137 HydrophobicContact CE3-CB 3.95Å; W1110-L1137 HydrophobicContact CE3-CD1 3.72Å; W1110-L1137 HydrophobicContact CE3-CG 4.32Å; W1110-L1137 HydrophobicContact CG-CB 4.35Å; W1110-L1137 HydrophobicContact CH2-CB 4.15Å; W1110-L1137 HydrophobicContact CH2-CD2 4.12Å; W1110-L1137 HydrophobicContact CH2-CG 4.49Å; W1110-L1137 HydrophobicContact CZ2-CB 3.99Å; W1110-L1137 HydrophobicContact CZ3-CB 4.13Å; W1110-L1137 HydrophobicContact CZ3-CD1 3.8Å; W1110-L1137 HydrophobicContact CZ3-CD2 4.17Å; W1110-L1137 HydrophobicContact CZ3-CG 4.25Å; C1119-L1137 HydrophobicContact CB-CD1 3.44Å; C1119-L1137 VanDerWaalsContact CB-CD1 3.44Å; L1137-C1140 PolarHBondContact O-N 3.17Å; L1137-R1141 HydrophobicContact CD1-CG 4.04Å; L1137-R1141 HydrophobicContact CG-CG 4.47Å; L1137-R1141 WeakPolarHBondContact O-CB 3.41Å; L1137-R1141 WeakPolarHBondContact O-CG 2.99Å; L1137-R1141 PolarHBondContact O-N 2.81Å
1138	Q	75	Confident	80.4	Confident	118 Å²	118	60.9 Å²	60.9	55%	0.551	35%	0.347	S	S	*	.	H	α-helix	trans	-68.2	-43.4	-176.7	-171.4	64.2	5.4	0	0	111.6	T1136 R1141 T1142	T1136-Q1138 VanDerWaalsContact C-N 3.32Å; Q1138-R1141 PolarHBondContact O-N 2.96Å; Q1138-T1142 HydrophobicContact CG-CG2 4.49Å; Q1138-T1142 PolarHBondContact O-N 3.32Å; Q1138-T1142 PolarHBondContact O-OG1 3.39Å
1139	E	81.3	Confident	78.1	Confident	70 Å²	70	65.1 Å²	65.1	33%	0.327	36%	0.364	S	S	.	.	H	α-helix	trans	-53.8	-52.6	172.2	179.8	-165.9	157.3	0	0	111.3	F1134 A1135 T1136 R1141 T1142 T1143	F1134-E1139 VanDerWaalsContact CA-OE1 3.28Å; F1134-E1139 WeakPolarHBondContact CA-OE1 3.12Å; F1134-E1139 HydrophobicContact CB-CB 4.44Å; F1134-E1139 HydrophobicContact CB-CG 4.09Å; F1134-E1139 HydrophobicContact CD1-CG 3.85Å; F1134-E1139 HydrophobicContact CG-CG 4.38Å; A1135-E1139 WeakPolarHBondContact CA-OE2 3.26Å; A1135-E1139 WeakPolarHBondContact CB-OE2 3.11Å; A1135-E1139 VanDerWaalsContact N-CD 3.29Å; A1135-E1139 PolarHBondContact N-OE1 2.7Å; A1135-E1139 VanDerWaalsContact N-OE1 3.08Å; A1135-E1139 PolarHBondContact N-OE2 3.29Å; T1136-E1139 PolarHBondContact N-OE2 3.3Å; T1136-E1139 WeakPolarHBondContact OG1-CB 3.18Å; T1136-E1139 PolarHBondContact OG1-N 3.22Å; T1136-E1139 VanDerWaalsContact OG1-N 3.13Å; T1136-E1139 PolarHBondContact OG1-OE2 2.02Å; E1139-R1141 VanDerWaalsContact C-N 3.34Å; E1139-R1141 PolarHBondContact O-N 2.82Å; E1139-T1142 WeakPolarHBondContact CA-OG1 3.17Å; E1139-T1142 PolarHBondContact O-N 2.76Å; E1139-T1142 PolarHBondContact O-OG1 2.78Å; E1139-T1143 PolarHBondContact O-N 2.84Å; E1139-T1143 PolarHBondContact O-OG1 3.14Å; E1139-T1143 VanDerWaalsContact O-OG1 3.12Å
1140	C	92.4	Very high	75.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-55.9	-45.4	174.4	-179.9	0	0	0	0	112.5	W1110 C1119 F1134 T1136 L1137 T1143 C1144	W1110-C1140 HydrophobicContact CB-CB 4.16Å; C1119-C1140 HydrophobicContact CB-CB 3.82Å; C1119-C1140 WeakPolarHBondContact CB-SG 3.43Å; C1119-C1140 WeakPolarHBondContact SG-CB 3.3Å; C1119-C1140 CovalentContact SG-SG 2.03Å; C1119-C1140 PolarHBondContact SG-SG 3.47Å; F1134-C1140 HydrophobicContact CB-CB 3.95Å; F1134-C1140 HydrophobicContact CD2-CB 3.34Å; F1134-C1140 VanDerWaalsContact CD2-SG 3.53Å; F1134-C1140 HydrophobicContact CE2-CB 3.92Å; F1134-C1140 HydrophobicContact CG-CB 3.72Å; T1136-C1140 PolarHBondContact O-N 3.38Å; L1137-C1140 PolarHBondContact O-N 3.17Å; C1140-T1143 PolarHBondContact O-N 3.43Å; C1140-C1144 VanDerWaalsContact O-CB 3.27Å; C1140-C1144 WeakPolarHBondContact O-CB 3.36Å; C1140-C1144 PolarHBondContact O-N 3.3Å; C1140-C1144 PolarHBondContact O-SG 2.85Å
1141	R	85.8	Confident	73.2	Confident	96 Å²	96	73.4 Å²	73.4	36%	0.362	42%	0.42	S	S	.	.	H	α-helix	trans	-62.6	-47.4	177	-75.3	179.5	166.8	178	-5.1	111.4	C1119 L1137 Q1138 E1139 T1143 C1144 L1145	C1119-R1141 PolarHBondContact SG-N 3.07Å; L1137-R1141 HydrophobicContact CD1-CG 4.04Å; L1137-R1141 HydrophobicContact CG-CG 4.47Å; L1137-R1141 WeakPolarHBondContact O-CB 3.41Å; L1137-R1141 WeakPolarHBondContact O-CG 2.99Å; L1137-R1141 PolarHBondContact O-N 2.81Å; Q1138-R1141 PolarHBondContact O-N 2.96Å; E1139-R1141 VanDerWaalsContact C-N 3.34Å; E1139-R1141 PolarHBondContact O-N 2.82Å; R1141-T1143 PolarHBondContact O-N 2.75Å; R1141-C1144 PolarHBondContact O-N 3.24Å; R1141-L1145 HydrophobicContact CB-CD1 4.15Å; R1141-L1145 HydrophobicContact CG-CD1 3.92Å; R1141-L1145 WeakPolarHBondContact O-CA 3.39Å; R1141-L1145 VanDerWaalsContact O-CB 3.26Å; R1141-L1145 WeakPolarHBondContact O-CB 3.45Å; R1141-L1145 PolarHBondContact O-N 2.93Å
1142	T	79.5	Confident	70.6	Confident	71 Å²	71	80.1 Å²	80.1	44%	0.436	45%	0.452	S	S	.	.	H	α-helix	trans	-65.5	-36.1	179.9	48.4	0	0	0	0	112.9	Q1138 E1139 S1146	Q1138-T1142 HydrophobicContact CG-CG2 4.49Å; Q1138-T1142 PolarHBondContact O-N 3.32Å; Q1138-T1142 PolarHBondContact O-OG1 3.39Å; E1139-T1142 WeakPolarHBondContact CA-OG1 3.17Å; E1139-T1142 PolarHBondContact O-N 2.76Å; E1139-T1142 PolarHBondContact O-OG1 2.78Å; T1142-S1146 WeakPolarHBondContact O-CB 3.47Å; T1142-S1146 PolarHBondContact O-OG 2.79Å
1143	T	82.5	Confident	67.4	Low	61 Å²	61	86.6 Å²	86.6	37%	0.374	49%	0.487	S	S	.	.	H	α-helix	trans	-76.4	-33.1	178.4	-54.8	0	0	0	0	112.6	F1134 E1139 C1140 R1141	F1134-T1143 HydrophobicContact CE1-CG2 3.85Å; F1134-T1143 HydrophobicContact CZ-CG2 3.95Å; E1139-T1143 PolarHBondContact O-N 2.84Å; E1139-T1143 PolarHBondContact O-OG1 3.14Å; E1139-T1143 VanDerWaalsContact O-OG1 3.12Å; C1140-T1143 PolarHBondContact O-N 3.43Å; R1141-T1143 PolarHBondContact O-N 2.75Å
1144	C	88	Confident	64.4	Low	25 Å²	25	91.1 Å²	91.1	17%	0.169	52%	0.515	C	S	.	.	H	α-helix	trans	-109.6	-15.4	-169.7	-56.9	0	0	0	0	116.1	C1094 F1112 C1140 R1141	C1094-C1144 HydrophobicContact CB-CB 3.72Å; C1094-C1144 WeakPolarHBondContact CB-SG 3.26Å; C1094-C1144 WeakPolarHBondContact SG-CA 2.96Å; C1094-C1144 WeakPolarHBondContact SG-CB 3.25Å; C1094-C1144 CovalentContact SG-SG 2.03Å; C1094-C1144 PolarHBondContact SG-SG 2.62Å; F1112-C1144 HydrophobicContact CB-CB 3.98Å; F1112-C1144 HydrophobicContact CD1-CB 4.31Å; F1112-C1144 HydrophobicContact CD2-CB 3.45Å; F1112-C1144 VanDerWaalsContact CD2-CB 3.45Å; F1112-C1144 HydrophobicContact CE2-CB 3.92Å; F1112-C1144 HydrophobicContact CG-CB 3.66Å; C1140-C1144 VanDerWaalsContact O-CB 3.27Å; C1140-C1144 WeakPolarHBondContact O-CB 3.36Å; C1140-C1144 PolarHBondContact O-N 3.3Å; C1140-C1144 PolarHBondContact O-SG 2.85Å; R1141-C1144 PolarHBondContact O-N 3.24Å
1145	L	83.7	Confident	61.3	Low	74 Å²	74	96.6 Å²	96.6	39%	0.387	55%	0.55	S	S	.	.	H	α-helix	trans	-113.2	-20.9	-178.6	-62.8	173.9	0	0	0	114.4	F1112 R1141 S1147	F1112-L1145 HydrophobicContact CE2-CD2 3.67Å; F1112-L1145 HydrophobicContact CE2-CG 4.19Å; F1112-L1145 HydrophobicContact CZ-CD2 4.18Å; R1141-L1145 HydrophobicContact CB-CD1 4.15Å; R1141-L1145 HydrophobicContact CG-CD1 3.92Å; R1141-L1145 WeakPolarHBondContact O-CA 3.39Å; R1141-L1145 VanDerWaalsContact O-CB 3.26Å; R1141-L1145 WeakPolarHBondContact O-CB 3.45Å; R1141-L1145 PolarHBondContact O-N 2.93Å; L1145-S1147 VanDerWaalsContact C-N 3.29Å; L1145-S1147 PolarHBondContact O-N 2.94Å
1146	S	64.1	Low	58.5	Low	86 Å²	86	97.5 Å²	97.5	60%	0.601	56%	0.557	S	S	*	*	S	Bend	trans	-79.7	5	-168.3	-62.4	0	0	0	0	116.3	T1142	T1142-S1146 WeakPolarHBondContact O-CB 3.47Å; T1142-S1146 PolarHBondContact O-OG 2.79Å
1147	S	42.8	Very low	55.6	Low	110 Å²	110	99.7 Å²	99.7	77%	0.769	56%	0.563	S	S	*	*	S	Bend	trans	-108.1	47.7	-171.9	-170.6	0	0	0	0	113.9	L1145	L1145-S1147 VanDerWaalsContact C-N 3.29Å; L1145-S1147 PolarHBondContact O-N 2.94Å
1148	R	42.1	Very low	52.7	Low	240 Å²	240	104.4 Å²	104.4	91%	0.906	58%	0.578	S	S	*	*	S	Bend	trans	-136.4	1.7	-175.6	-84	-166.3	172.6	-172	-2.3	118
1149	T	34.9	Very low	50.4	Low	137 Å²	137	101.1 Å²	101.1	84%	0.84	57%	0.571	S	S	*	*			trans	-144.8	85.2	-175.2	52.7	0	0	0	0	114
1150	A	31.4	Very low	48.1	Very low	99 Å²	99	101.6 Å²	101.6	82%	0.818	58%	0.58	S	S	*	*			trans	179.7	93.4	156.8	0	0	0	0	0	112.4
1151	V	32.1	Very low	45	Very low	138 Å²	138	107.5 Å²	107.5	84%	0.836	61%	0.611	S	S	*	*			trans	-152.3	141.4	162.1	-157.9	0	0	0	0	111
1152	D	30.4	Very low	42.4	Very low	159 Å²	159	106 Å²	106	85%	0.85	61%	0.614	S	S	*	*			trans	80.1	163.7	153.3	-106.1	-45.4	0	0	0	124
1153	D	27.5	Very low	39.8	Very low	136 Å²	136	108.4 Å²	108.4	73%	0.727	63%	0.631	S	S	*	*			trans	-123.1	-176.5	-155.4	-177.2	27	0	0	0	113.8
1154	T	30.4	Very low	37.1	Very low	105 Å²	105	109.1 Å²	109.1	64%	0.644	64%	0.643	S	S	*	*			trans	92.4	86.7	162.7	69.9	0	0	0	0	120.7
1155	T	28	Very low	34.3	Very low	128 Å²	128	111.5 Å²	111.5	79%	0.785	67%	0.671	S	S	*	*			trans	50.7	125	131.6	59.4	0	0	0	0	123.9
1156	A	25.5	Very low	31.7	Very low	77 Å²	77	113.3 Å²	113.3	64%	0.636	70%	0.697	S	S	*	*			trans	87.4	137.4	146.1	0	0	0	0	0	120.9	L1002	L1002-A1156 HydrophobicContact CD1-CB 4.45Å; L1002-A1156 WeakPolarHBondContact CD1-O 3.42Å
1157	E	23.3	Very low	29.8	Very low	116 Å²	116	116 Å²	116	54%	0.542	71%	0.705	S	S	.	*			trans	49.9	126.8	155.8	-84.4	-177.9	129.6	0	0	118.2	T1001 L1002	T1001-E1157 CarbonylContact O-C 3.42Å; T1001-E1157 VanDerWaalsContact O-O 3.1Å; L1002-E1157 HydrophobicContact CD1-CB 4.09Å; L1002-E1157 HydrophobicContact CG-CB 4.08Å
1158	Y	27	Very low	29	Very low	147 Å²	147	118.2 Å²	118.2	58%	0.576	71%	0.707	S	S	*	*			cis	-154.7	-176.7	21.7	-113.9	-97.6	0	0	0	110.7	T1000 T1001	T1000-Y1158 PolarHBondContact N-O 3.16Å; T1000-Y1158 CarbonylContact O-C 3.59Å; T1000-Y1158 WeakPolarHBondContact O-CA 3.4Å; T1000-Y1158 WeakPolarHBondContact O-CB 3.44Å; T1000-Y1158 PolarHBondContact O-N 3.2Å; T1001-Y1158 HydrophobicContact CG2-CD2 4.43Å; T1001-Y1158 WeakPolarHBondContact OG1-CB 2.94Å
1159	A	26.5	Very low	28.2	Very low	48 Å²	48	110.7 Å²	110.7	40%	0.397	69%	0.691	S	S	.	*			trans	-97.1	-152.7	-169.7	0	0	0	0	0	117.2	E999 T1000	E999-A1159 CarbonylContact C-O 3.6Å; E999-A1159 WeakPolarHBondContact CA-O 3.39Å; E999-A1159 VanDerWaalsContact CD-CA 3.5Å; E999-A1159 WeakPolarHBondContact OE1-CA 3.39Å; E999-A1159 WeakPolarHBondContact OE2-CA 3.18Å; T1000-A1159 WeakPolarHBondContact CB-O 3.46Å; T1000-A1159 PolarHBondContact N-O 2.94Å; T1000-A1159 PolarHBondContact OG1-O 3.36Å
1160	P	32.7	Very low	27.8	Very low	80 Å²	80	110.6 Å²	110.6	52%	0.519	69%	0.686	S	S	.	*				-92.8	165.8	-116.7	-9.4	30.6	0	0	0	122.9	E999	E999-P1160 WeakPolarHBondContact OE1-CA 3.2Å; E999-P1160 WeakPolarHBondContact OE1-CB 3.44Å; E999-P1160 WeakPolarHBondContact OE1-CG 3.36Å
1161	L	26.7	Very low	27.5	Very low	125 Å²	125	116.8 Å²	116.8	65%	0.654	69%	0.689	S	S	*	*			trans	73.9	120.8	158.5	-48.6	147.9	0	0	0	121.1	I997 E999	I997-L1161 HydrophobicContact CG2-CB 3.68Å; I997-L1161 HydrophobicContact CG2-CD2 3.31Å; I997-L1161 HydrophobicContact CG2-CG 4.01Å; E999-L1161 VanDerWaalsContact N-N 3.11Å
1162	P	31.8	Very low	27.1	Very low	64 Å²	64	113.9 Å²	113.9	42%	0.416	69%	0.687	S	S	.	*			trans	-119.9	-176.3	177.5	31.7	-10.1	0	0	0	114.5	I997	I997-P1162 WeakPolarHBondContact CD1-O 3.48Å; I997-P1162 WeakPolarHBondContact CG1-O 3.27Å
1163	P	24.6	Very low	26.9	Very low	122 Å²	122	110.1 Å²	110.1	79%	0.792	69%	0.686	S	S	*	*			trans	-113.5	161.4	-179	39.7	-31	0	0	0	115.6
1164	A	25.7	Very low	26.7	Very low	76 Å²	76	111.9 Å²	111.9	63%	0.628	69%	0.689	S	S	*	*	S	Bend	trans	-94.2	158.6	165.1	0	0	0	0	0	111.1	P995	P995-A1164 HydrophobicContact CG-CB 4.28Å
1165	G	29.5	Very low	26.4	Very low	75 Å²	75	115.4 Å²	115.4	77%	0.773	70%	0.698	S	S	*	*			trans	69.2	83.8	171.1	0	0	0	0	0	114.8	D1167	G1165-D1167 PolarHBondContact O-N 3.12Å
1166	A	28.6	Very low	26.1	Very low	111 Å²	111	114.5 Å²	114.5	92%	0.917	70%	0.704	S	S	*	*			trans	-65.3	120.3	170.4	0	0	0	0	0	110.2
1167	D	23.7	Very low	26	Very low	144 Å²	144	114.4 Å²	114.4	77%	0.77	71%	0.711	S	S	*	*			trans	-73.6	148.2	-167.5	-176.4	42.1	0	0	0	114.5	G1165 S1169	G1165-D1167 PolarHBondContact O-N 3.12Å; D1167-S1169 PolarHBondContact O-N 3.11Å
1168	L	26.3	Very low	26	Very low	156 Å²	156	113.5 Å²	113.5	82%	0.817	72%	0.723	S	S	*	*			trans	-87.9	78.8	174	-154.5	94.2	0	0	0	111
1169	S	25	Very low	26	Very low	82 Å²	82	111.9 Å²	111.9	57%	0.573	73%	0.733	S	S	*	*			trans	58.3	111.7	157.6	60.8	0	0	0	0	118.2	D1167	D1167-S1169 PolarHBondContact O-N 3.11Å
1170	N	26.9	Very low	26	Very low	135 Å²	135	114.3 Å²	114.3	72%	0.722	75%	0.747	S	S	*	*				-167.4	130.3	107.5	-101.8	-59.9	0	0	0	114.4
1171	Y	25.2	Very low	25.6	Very low	229 Å²	229	116.8 Å²	116.8	90%	0.898	76%	0.761	S	S	*	*			trans	61	152.4	165.3	-90.3	-101.5	0	0	0	118.8
1172	G	23.5	Very low	25.4	Very low	77 Å²	77	116.4 Å²	116.4	79%	0.794	76%	0.764	S	S	*	*			trans	-101.8	158.1	172.3	0	0	0	0	0	112
1173	G	26.8	Very low	25	Very low	79 Å²	79	118.7 Å²	118.7	81%	0.814	78%	0.781	S	S	*	*			trans	-177.4	155	176.6	0	0	0	0	0	110.7
1174	E	22.3	Very low	25	Very low	173 Å²	173	117.9 Å²	117.9	81%	0.808	79%	0.785	S	S	*	*			trans	-94.5	168.2	-177	-66.6	160.4	105.6	0	0	112.1
1175	H	24.1	Very low	24.9	Very low	179 Å²	179	117.9 Å²	117.9	83%	0.829	79%	0.792	S	S	*	*			trans	88.2	108.5	164.9	-49.3	-69.1	0	0	0	120.6
1176	A	23	Very low	24.6	Very low	110 Å²	110	121.5 Å²	121.5	91%	0.909	79%	0.793	S	S	*	*			trans	-3.1	142.2	150	0	0	0	0	0	122.8
1177	G	22.6	Very low	24.3	Very low	75 Å²	75	122.8 Å²	122.8	77%	0.773	78%	0.784	S	S	*	*			trans	152.6	105.3	145.9	0	0	0	0	0	119.6
1178	A	24.7	Very low	24.4	Very low	97 Å²	97	122 Å²	122	80%	0.802	78%	0.784	S	S	*	*			trans	44.3	139.2	142.9	0	0	0	0	0	125.7
1179	S	25.6	Very low	24.3	Very low	113 Å²	113	124.6 Å²	124.6	79%	0.79	79%	0.785	S	S	*	*			trans	89.3	124.1	137.4	-69.9	0	0	0	0	125.3
1180	S	26.1	Very low	24.4	Very low	99 Å²	99	123.5 Å²	123.5	69%	0.692	79%	0.787	S	S	*	*			trans	85	132.6	139.9	75.6	0	0	0	0	122.7
1181	T	24.8	Very low	24.4	Very low	132 Å²	132	120.7 Å²	120.7	81%	0.81	78%	0.775	S	S	*	*			trans	45.9	138.3	147.7	52.8	0	0	0	0	120.6
1182	T	22.6	Very low	24.3	Very low	116 Å²	116	112.9 Å²	112.9	71%	0.712	75%	0.751	S	S	*	*			cis	-147.7	157	27.7	49.6	0	0	0	0	113.1
1183	S	23.7	Very low	24.2	Very low	112 Å²	112	115.8 Å²	115.8	78%	0.783	75%	0.747	S	S	*	*			trans	55.7	145.5	150.9	59.9	0	0	0	0	120.5
1184	A	23.8	Very low	24	Very low	106 Å²	106	115.5 Å²	115.5	88%	0.876	73%	0.733	S	S	*	*			cis	-162.4	132.2	-19.6	0	0	0	0	0	106.8
1185	G	24.1	Very low	24.1	Very low	75 Å²	75	114.9 Å²	114.9	77%	0.773	73%	0.729	S	S	*	*			trans	179.8	34.6	-169.3	0	0	0	0	0	115.3
1186	L	22.9	Very low	23.9	Very low	151 Å²	151	112.5 Å²	112.5	79%	0.791	71%	0.714	S	S	*	*			trans	-77.7	141.4	165.1	-72.1	162	0	0	0	107.5
1187	N	22.1	Very low	23.8	Very low	138 Å²	138	112.2 Å²	112.2	74%	0.738	70%	0.701	S	S	*	*			cis	58.9	121.8	11.6	-85	3.7	0	0	0	116.8
1188	V	26.6	Very low	23.7	Very low	127 Å²	127	119.6 Å²	119.6	77%	0.77	71%	0.705	S	S	*	*			trans	85.1	153.7	175.4	-171	0	0	0	0	115.8
1189	Y	24.3	Very low	23.5	Very low	211 Å²	211	120.7 Å²	120.7	83%	0.827	70%	0.702	S	S	*	*			trans	92.8	136.7	178.3	-56.7	-70.8	0	0	0	117
1190	G	26.8	Very low	23.7	Very low	60 Å²	60	121.2 Å²	121.2	62%	0.619	70%	0.703	S	S	*	*			cis	133.7	98.8	-17.5	0	0	0	0	0	117.6
1191	T	25.8	Very low	23.5	Very low	76 Å²	76	122.2 Å²	122.2	47%	0.466	71%	0.705	S	S	.	*			trans	60.6	128.2	155.9	75.6	0	0	0	0	122.4	E761 K764	E761-T1191 WeakPolarHBondContact OE1-CA 3.17Å; E761-T1191 WeakPolarHBondContact OE1-CB 3.49Å; E761-T1191 WeakPolarHBondContact OE1-CG2 3.48Å; K764-T1191 HydrophobicContact CD-CG2 4.32Å; K764-T1191 PolarHBondContact NZ-OG1 3.22Å
1192	T	23.5	Very low	23.4	Very low	64 Å²	64	122.6 Å²	122.6	39%	0.393	70%	0.702	S	S	.	*			trans	51.5	159.4	143.7	58	0	0	0	0	124	E761 K764	E761-T1192 WeakPolarHBondContact OE1-CG2 3.5Å; E761-T1192 PolarHBondContact OE1-N 3.27Å; K764-T1192 PolarHBondContact NZ-OG1 3.29Å
1193	I	22.2	Very low	23.5	Very low	139 Å²	139	120.6 Å²	120.6	71%	0.713	70%	0.704	S	S	*	*			trans	76.3	132.8	159.9	-20.2	179.9	0	0	0	118.5
1194	S	22.8	Very low	23.5	Very low	73 Å²	73	123 Å²	123	51%	0.51	71%	0.709	S	S	.	*			trans	-82.2	139.1	164.4	134.5	0	0	0	0	111
1195	E	23.1	Very low	23.6	Very low	159 Å²	159	121.2 Å²	121.2	74%	0.743	70%	0.7	S	S	*	*				-163.8	146.7	124.3	-112.9	-179.1	169.7	0	0	116.3
1196	Y	21.2	Very low	23.6	Very low	130 Å²	130	122.5 Å²	122.5	51%	0.51	70%	0.704	S	S	.	*			trans	20.6	119.3	137.4	-90.9	-106.4	0	0	0	121.9	L1265	Y1196-L1265 HydrophobicContact CE1-CD1 3.7Å; Y1196-L1265 HydrophobicContact CE2-CD1 4.16Å; Y1196-L1265 HydrophobicContact CE2-CG 4.24Å; Y1196-L1265 VanDerWaalsContact CZ-CD1 3.48Å; Y1196-L1265 WeakPolarHBondContact OH-CD1 3.42Å
1197	V	20.6	Very low	24	Very low	103 Å²	103	120.4 Å²	120.4	62%	0.624	70%	0.699	S	S	*	*				79.3	124.2	120.1	156.1	0	0	0	0	121.4
1198	R	20.3	Very low	24.2	Very low	230 Å²	230	123.1 Å²	123.1	87%	0.868	71%	0.707	S	S	*	*			trans	73.3	148.6	149.6	-80.1	169.2	-154.7	-179.5	6.5	121.5
1199	T	20.7	Very low	24.2	Very low	120 Å²	120	120.9 Å²	120.9	74%	0.736	71%	0.71	S	S	*	*			trans	-36.5	151.1	161.3	47.1	0	0	0	0	116
1200	P	29.5	Very low	24.3	Very low	124 Å²	124	117.6 Å²	117.6	81%	0.805	71%	0.707	S	S	*	*			trans	-84.3	146.5	-164.7	34.5	-37.5	0	0	0	114.9
1201	T	21.1	Very low	24.2	Very low	120 Å²	120	122.5 Å²	122.5	74%	0.736	71%	0.714	S	S	*	*			trans	-162	159.2	160.9	9	0	0	0	0	112.9
1202	D	23.4	Very low	24.1	Very low	140 Å²	140	124.6 Å²	124.6	75%	0.749	73%	0.726	S	S	*	*			trans	65.5	74.8	145.2	-54.4	-21.9	0	0	0	122.7
1203	G	24.5	Very low	24	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	74%	0.738	S	S	*	*			trans	69.7	-155.1	135.6	0	0	0	0	0	118.1
1204	N	23.7	Very low	24.1	Very low	163 Å²	163	126.6 Å²	126.6	87%	0.872	74%	0.735	S	S	*	*			cis	-162.8	143	-10.9	-122.3	-24.9	0	0	0	111.1
1205	G	25.7	Very low	24.1	Very low	68 Å²	68	131.9 Å²	131.9	70%	0.701	75%	0.748	S	S	*	*			trans	81.4	113.6	174.2	0	0	0	0	0	114.4
1206	A	23.8	Very low	24.4	Very low	102 Å²	102	127.8 Å²	127.8	84%	0.843	75%	0.748	S	S	*	*				84	140.2	65.4	0	0	0	0	0	112.4
1207	P	32.7	Very low	24.6	Very low	108 Å²	108	131.3 Å²	131.3	70%	0.701	77%	0.767	S	S	*	*			cis	-119.2	173.5	26.5	41.7	-31.6	0	0	0	117
1208	E	25	Very low	24.9	Very low	194 Å²	194	130.6 Å²	130.6	91%	0.907	77%	0.772	S	S	*	*			trans	60.5	102.6	155	-71.6	162.9	-177.4	0	0	119.3
1209	G	27.4	Very low	25.1	Very low	80 Å²	80	126.7 Å²	126.7	83%	0.825	77%	0.767	S	S	*	*			trans	166.7	96.8	171.4	0	0	0	0	0	113.7
1210	D	26.7	Very low	25.5	Very low	143 Å²	143	128.5 Å²	128.5	77%	0.765	77%	0.771	S	S	*	*			trans	-76.1	144.8	-168.1	-78.6	-32.2	0	0	0	117
1211	H	24.9	Very low	25.4	Very low	163 Å²	163	128.1 Å²	128.1	76%	0.755	76%	0.762	S	S	*	*			trans	60.3	148.5	139	-67.9	-35.8	0	0	0	122.5
1212	V	22.4	Very low	25.9	Very low	120 Å²	120	131.3 Å²	131.3	73%	0.727	77%	0.771	S	S	*	*			cis	-170.1	161.1	-21.6	80.8	0	0	0	0	112
1213	V	22.6	Very low	26.1	Very low	108 Å²	108	128.4 Å²	128.4	66%	0.655	77%	0.766	S	S	*	*			trans	84.5	111.9	152.2	156.3	0	0	0	0	124
1214	H	23.5	Very low	26.5	Very low	137 Å²	137	131.5 Å²	131.5	63%	0.634	77%	0.77	S	S	*	*			trans	78.6	117.2	131.9	-75.3	-10.3	0	0	0	128.1
1215	K	23.5	Very low	26.7	Very low	184 Å²	184	134.2 Å²	134.2	80%	0.8	77%	0.768	S	S	*	*				80.9	131.5	122.5	-67.5	170.1	-175.9	163	0	122.8
1216	G	28.5	Very low	27.1	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	77%	0.774	S	S	*	*			trans	143	79.4	153.2	0	0	0	0	0	114.6
1217	K	26	Very low	27.5	Very low	205 Å²	205	145.2 Å²	145.2	89%	0.891	77%	0.774	S	S	*	*				34.4	119.9	93.1	-71.6	-169.1	175	-173.9	0	115
1218	A	27	Very low	27.5	Very low	88 Å²	88	147.9 Å²	147.9	73%	0.727	78%	0.783	S	S	*	*			cis	88.3	144.9	33.8	0	0	0	0	0	116.1
1219	L	25.1	Very low	27.6	Very low	148 Å²	148	148.3 Å²	148.3	78%	0.775	78%	0.782	S	S	*	*			trans	71.2	137.4	-168.9	-79.1	61.5	0	0	0	113	L1221	L1219-L1221 HydrophobicContact CD2-CD1 3.76Å; L1219-L1221 HydrophobicContact CG-CD1 4.02Å; L1219-L1221 HydrophobicContact CG-CG 4.4Å
1220	L	28.3	Very low	27.6	Very low	157 Å²	157	148 Å²	148	82%	0.822	77%	0.771	S	S	*	*				-140.1	127.4	50.3	-152.2	69.1	0	0	0	110.4
1221	L	27.6	Very low	27.8	Very low	117 Å²	117	149.6 Å²	149.6	61%	0.613	77%	0.771	S	S	*	*				62.2	95.2	70.1	-83.1	174.7	0	0	0	116.9	L1219	L1219-L1221 HydrophobicContact CD2-CD1 3.76Å; L1219-L1221 HydrophobicContact CG-CD1 4.02Å; L1219-L1221 HydrophobicContact CG-CG 4.4Å
1222	M	31.6	Very low	27.9	Very low	186 Å²	186	150 Å²	150	92%	0.916	77%	0.767	S	S	*	*				-153.6	125.5	127.2	-77.3	-53.3	-169.7	0	0	106.7
1223	A	28	Very low	28.5	Very low	80 Å²	80	153.5 Å²	153.5	66%	0.661	78%	0.776	S	S	*	*			cis	112.7	96	18.4	0	0	0	0	0	112.5
1224	V	33	Very low	28.8	Very low	138 Å²	138	156.5 Å²	156.5	84%	0.836	78%	0.781	S	S	*	*			trans	-176.8	114.5	152.9	150.8	0	0	0	0	104.8
1225	R	28	Very low	29.2	Very low	220 Å²	220	156.7 Å²	156.7	83%	0.83	79%	0.786	S	S	*	*				56.3	132.4	90.7	-107.8	-174.5	-172.3	172.1	1.6	112.8
1226	E	34.1	Very low	29.4	Very low	177 Å²	177	153.1 Å²	153.1	83%	0.827	78%	0.779	S	S	*	*			cis	-135.4	-168.1	31.7	-68.4	-145.1	112.2	0	0	115.7
1227	R	32.4	Very low	29.3	Very low	225 Å²	225	155.7 Å²	155.7	85%	0.849	78%	0.775	S	S	*	*			trans	-92.2	150	178.4	-56.4	164.3	171.4	158.7	-7.2	110.1
1228	N	32.2	Very low	29.2	Very low	164 Å²	164	153.3 Å²	153.3	88%	0.877	77%	0.772	S	S	*	*				-162.8	145.2	102.7	-93.8	-26.2	0	0	0	111.7
1229	F	26.1	Very low	29.2	Very low	203 Å²	203	152.4 Å²	152.4	89%	0.89	76%	0.757	S	S	*	*			trans	-137.7	162.1	177.8	-167.2	-92.7	0	0	0	107.2
1230	A	28.1	Very low	29.2	Very low	72 Å²	72	148.9 Å²	148.9	60%	0.595	75%	0.749	S	S	*	*			trans	77.3	119.8	176.9	0	0	0	0	0	117.8
1231	F	30.5	Very low	29.1	Very low	177 Å²	177	143.1 Å²	143.1	78%	0.776	73%	0.727	S	S	*	*				96.7	109.4	129.5	-89.7	-130.1	0	0	0	120.8
1232	Y	27.5	Very low	29.1	Very low	171 Å²	171	143.1 Å²	143.1	67%	0.671	73%	0.732	S	S	*	*			trans	56	99.3	142.1	-72.6	-113.7	0	0	0	118.1	F1234	Y1232-F1234 HydrophobicContact CD1-CB 4.4Å
1233	Q	34.8	Very low	28.6	Very low	194 Å²	194	141.5 Å²	141.5	91%	0.907	73%	0.726	S	S	*	*				-122.2	92.9	106.1	-73.8	-153.7	-14.3	0	0	110.4
1234	F	29.2	Very low	28.8	Very low	172 Å²	172	143.3 Å²	143.3	75%	0.754	73%	0.731	S	S	*	*			trans	-110.5	63.7	172.4	-148.1	-70.8	0	0	0	108.8	Y1232	Y1232-F1234 HydrophobicContact CD1-CB 4.4Å
1235	L	31.8	Very low	28.3	Very low	141 Å²	141	145 Å²	145	74%	0.738	73%	0.73	S	S	*	*			trans	-170	122.2	174.3	-108.1	127.7	0	0	0	106.1
1236	T	27.8	Very low	28.1	Very low	108 Å²	108	139.9 Å²	139.9	66%	0.663	72%	0.723	S	S	*	*			cis	-146.5	118.2	0.3	4.8	0	0	0	0	105.6
1237	L	25.3	Very low	27.6	Very low	127 Å²	127	137.3 Å²	137.3	67%	0.665	72%	0.72	S	S	*	*				58.8	115.2	94.1	-80.5	168.9	0	0	0	114.3
1238	L	25	Very low	27.2	Very low	155 Å²	155	131.4 Å²	131.4	81%	0.812	71%	0.71	S	S	*	*			trans	68.6	136.6	154.7	-51.1	169.2	0	0	0	114.2
1239	V	27.2	Very low	26.7	Very low	69 Å²	69	132.5 Å²	132.5	42%	0.418	71%	0.708	S	S	.	*			cis	-171.4	161.5	8.2	102.2	0	0	0	0	106.5	Q1288 A1289	V1239-Q1288 HydrophobicContact CG1-CB 4.02Å; V1239-Q1288 HydrophobicContact CG2-CB 4.26Å; V1239-A1289 CarbonylContact C-O 3.52Å; V1239-A1289 WeakPolarHBondContact CG1-O 3.49Å
1240	A	24.7	Very low	27	Very low	74 Å²	74	127.6 Å²	127.6	61%	0.612	70%	0.696	S	S	*	*			cis	-167.9	-54.2	-36.7	0	0	0	0	0	116.2	A1289	A1240-A1289 VanDerWaalsContact N-C 3.29Å; A1240-A1289 PolarHBondContact N-O 3.05Å
1241	G	26	Very low	26.7	Very low	35 Å²	35	131 Å²	131	36%	0.361	71%	0.709	S	S	.	*			trans	-91.4	-178	-176.1	0	0	0	0	0	115.4	Q1288 A1289 V1290	G1241-Q1288 WeakPolarHBondContact CA-O 3.37Å; G1241-Q1288 PolarHBondContact N-O 2.54Å; G1241-Q1288 VanDerWaalsContact N-O 3.11Å; G1241-A1289 CarbonylContact O-C 3.5Å; G1241-V1290 PolarHBondContact O-N 3.47Å
1242	V	28.1	Very low	26.5	Very low	117 Å²	117	128.2 Å²	128.2	71%	0.709	71%	0.707	S	S	*	*			cis	-143.5	159.7	35.4	174.7	0	0	0	0	112.1	A1289	V1242-A1289 HydrophobicContact CG2-CB 4.05Å
1243	L	22	Very low	26.4	Very low	153 Å²	153	125.5 Å²	125.5	80%	0.801	71%	0.708	S	S	*	*			trans	-38.5	164.1	165.1	-63	162.1	0	0	0	115.7
1244	P	30.7	Very low	26.2	Very low	117 Å²	117	120.3 Å²	120.3	76%	0.76	69%	0.692	S	S	*	*			cis	-123.6	-149.6	0.5	23.4	3.7	0	0	0	110.1
1245	E	23.5	Very low	26.1	Very low	173 Å²	173	119 Å²	119	81%	0.808	69%	0.688	S	S	*	*			cis	-142	178.7	4.8	-106.6	-151.6	108.1	0	0	111.6
1246	T	23.7	Very low	26.3	Very low	113 Å²	113	116.2 Å²	116.2	69%	0.693	68%	0.68	S	S	*	*			trans	-72.9	163.2	165.3	53.9	0	0	0	0	112.1
1247	V	22.6	Very low	26.6	Very low	124 Å²	124	114.3 Å²	114.3	75%	0.752	67%	0.666	S	S	*	*			cis	-144.2	138.2	15.6	-172.2	0	0	0	0	108.9
1248	P	24.8	Very low	27.9	Very low	100 Å²	100	111.3 Å²	111.3	65%	0.649	66%	0.655	S	S	*	*			trans	-138.8	-178.5	130.1	39.3	-29.2	0	0	0	113.6
1249	F	22	Very low	28.6	Very low	188 Å²	188	107.4 Å²	107.4	83%	0.825	63%	0.634	S	S	*	*			trans	91.6	152.5	176.1	-57.6	-57.9	0	0	0	117.4
1250	P	32	Very low	29.1	Very low	99 Å²	99	110.4 Å²	110.4	64%	0.643	65%	0.647	S	S	*	*			cis	-138.9	157	-35.7	35.9	-20.8	0	0	0	114.3
1251	T	22.4	Very low	29.7	Very low	143 Å²	143	112.8 Å²	112.8	88%	0.877	65%	0.649	S	S	*	*			trans	-142.7	84.8	160.3	56.5	0	0	0	0	113.4
1252	T	25.3	Very low	30.9	Very low	119 Å²	119	113 Å²	113	73%	0.73	65%	0.647	S	S	*	*			trans	-143.7	110.3	158.8	50.3	0	0	0	0	110.3
1253	T	25.3	Very low	32.3	Very low	114 Å²	114	116.3 Å²	116.3	70%	0.699	65%	0.652	S	S	*	*			trans	56.9	168.7	148.3	52.3	0	0	0	0	119.8
1254	P	30.5	Very low	34.6	Very low	86 Å²	86	110.6 Å²	110.6	56%	0.558	63%	0.625	S	S	*	*				-120.8	-159.8	-50.3	39.5	-27.2	0	0	0	110.5
1255	E	28.5	Very low	36.2	Very low	145 Å²	145	108.7 Å²	108.7	68%	0.678	61%	0.608	S	S	*	*			trans	-1.5	134.4	151.7	-62	133.2	175.6	0	0	119.6	E759	E759-E1255 VanDerWaalsContact OE1-CA 3.29Å; E759-E1255 WeakPolarHBondContact OE1-CA 3.04Å
1256	S	35.1	Very low	37.4	Very low	81 Å²	81	106.7 Å²	106.7	57%	0.566	61%	0.61	S	S	*	*			trans	56.6	140.4	143.8	65	0	0	0	0	119.8	E759	E759-S1256 PolarHBondContact OE1-N 2.92Å; E759-S1256 PolarHBondContact OE2-N 3.1Å
1257	D	33.1	Very low	38.7	Very low	68 Å²	68	103.9 Å²	103.9	36%	0.364	60%	0.603	S	S	.	*			cis	-154	146.2	-6.4	-116.4	-55.5	0	0	0	105.7	E759 D760 E761	E759-D1257 WeakPolarHBondContact CB-OD2 3.47Å; D760-D1257 PolarHBondContact N-OD2 3.1Å; E761-D1257 HydrophobicContact CB-CB 4.47Å; E761-D1257 HydrophobicContact CG-CB 4.23Å
1258	C	54.3	Low	41.5	Very low	64 Å²	64	103.4 Å²	103.4	43%	0.432	59%	0.588	S	S	.	*			trans	-142.6	83.6	-176.5	-142	0	0	0	0	115.2	C1277	C1258-C1277 WeakPolarHBondContact CB-SG 3.05Å; C1258-C1277 WeakPolarHBondContact SG-CA 2.94Å; C1258-C1277 WeakPolarHBondContact SG-CB 3.32Å; C1258-C1277 CovalentContact SG-SG 2.05Å; C1258-C1277 PolarHBondContact SG-SG 3.46Å
1259	L	38.2	Very low	43.3	Very low	73 Å²	73	103.2 Å²	103.2	38%	0.382	58%	0.581	S	S	.	*			trans	-131.5	130.8	177.3	-86.5	163.9	0	0	0	114	Y861	Y861-L1259 HydrophobicContact CE1-CD1 3.71Å
1260	L	38.4	Very low	45.3	Very low	132 Å²	132	97.4 Å²	97.4	69%	0.691	56%	0.558	S	S	*	*			trans	65.4	119.2	160.8	-100.3	63.9	0	0	0	122.2
1261	L	37.8	Very low	46.6	Very low	125 Å²	125	95.5 Å²	95.5	65%	0.654	54%	0.544	S	S	*	.			trans	68.2	101	139.3	-74.5	165.5	0	0	0	120.6
1262	A	49.8	Very low	48.3	Very low	39 Å²	39	91.4 Å²	91.4	32%	0.322	53%	0.525	S	S	.	.			trans	-135.6	153.4	141.9	0	0	0	0	0	109.8	L1270	A1262-L1270 WeakPolarHBondContact O-CD1 3.36Å
1263	K	57.9	Low	49.8	Very low	187 Å²	187	89.5 Å²	89.5	81%	0.813	51%	0.51	S	S	*	.			trans	-110.7	136.1	171.5	-73.4	178	178.7	172.8	0	108.9
1264	C	71.5	Confident	51.1	Low	33 Å²	33	92.4 Å²	92.4	22%	0.223	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-65.3	151.6	176.9	-62.3	0	0	0	0	112.5	W1268 L1270 C1280	C1264-W1268 HydrophobicContact CB-CB 3.98Å; C1264-W1268 WeakPolarHBondContact CB-O 3.46Å; C1264-L1270 VanDerWaalsContact SG-CB 3.55Å; C1264-L1270 WeakPolarHBondContact SG-CG 3.13Å; C1264-C1280 WeakPolarHBondContact CA-SG 3.37Å; C1264-C1280 HydrophobicContact CB-CB 4.06Å; C1264-C1280 WeakPolarHBondContact CB-SG 3.45Å; C1264-C1280 WeakPolarHBondContact SG-CB 3.43Å; C1264-C1280 CovalentContact SG-SG 2.04Å; C1264-C1280 PolarHBondContact SG-SG 3.42Å
1265	L	63.7	Low	52	Low	76 Å²	76	97.2 Å²	97.2	40%	0.398	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-60.3	152.4	166.3	-65.1	-168.7	0	0	0	111.2	Y1196 G1267 W1268	Y1196-L1265 HydrophobicContact CE1-CD1 3.7Å; Y1196-L1265 HydrophobicContact CE2-CD1 4.16Å; Y1196-L1265 HydrophobicContact CE2-CG 4.24Å; Y1196-L1265 VanDerWaalsContact CZ-CD1 3.48Å; Y1196-L1265 WeakPolarHBondContact OH-CD1 3.42Å; L1265-G1267 PolarHBondContact O-N 3.27Å; L1265-W1268 PolarHBondContact O-N 3.09Å
1266	P	47.8	Very low	52.9	Low	132 Å²	132	92.2 Å²	92.2	86%	0.857	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	129.2	174	-27.7	35.7	0	0	0	112.5
1267	G	51.1	Low	54.1	Low	54 Å²	54	90.5 Å²	90.5	56%	0.557	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-10.5	-176.5	0	0	0	0	0	115.3	L1265 Y1282	L1265-G1267 PolarHBondContact O-N 3.27Å; G1267-Y1282 VanDerWaalsContact O-CD2 3.28Å; G1267-Y1282 WeakPolarHBondContact O-CD2 3.23Å
1268	W	81.7	Confident	55.7	Low	113 Å²	113	93.6 Å²	93.6	43%	0.428	52%	0.516	S	S	.	.			trans	-107.1	148.2	176.6	-67.5	65.7	0	0	0	111.4	C1264 L1265 C1280 T1281 Y1282	C1264-W1268 HydrophobicContact CB-CB 3.98Å; C1264-W1268 WeakPolarHBondContact CB-O 3.46Å; L1265-W1268 PolarHBondContact O-N 3.09Å; W1268-C1280 HydrophobicContact CB-CB 4.31Å; W1268-C1280 HydrophobicContact CE3-CB 4.23Å; W1268-T1281 CarbonylContact C-O 3.59Å; W1268-T1281 VanDerWaalsContact CA-O 3.32Å; W1268-T1281 WeakPolarHBondContact CA-O 3.29Å; W1268-Y1282 HydrophobicContact CG-CD2 4.45Å
1269	I	63.9	Low	56.2	Low	97 Å²	97	98.5 Å²	98.5	50%	0.497	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.7	-174.2	45.9	166.5	0	0	0	111.9	C1280 T1281 P1283	I1269-C1280 CarbonylContact O-C 3.54Å; I1269-C1280 WeakPolarHBondContact O-CA 3.35Å; I1269-T1281 WeakPolarHBondContact CG1-O 3.13Å; I1269-T1281 PolarHBondContact N-O 3.22Å; I1269-T1281 PolarHBondContact O-N 2.87Å; I1269-T1281 PolarHBondContact O-OG1 3.49Å; I1269-T1281 VanDerWaalsContact O-OG1 3.11Å; I1269-P1283 HydrophobicContact CD1-CG 4.27Å
1270	L	63.5	Low	57.8	Low	65 Å²	65	97.4 Å²	97.4	34%	0.34	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.1	-173.1	-129.7	159	0	0	0	111.8	A1262 C1264 Q1278 R1279	A1262-L1270 WeakPolarHBondContact O-CD1 3.36Å; C1264-L1270 VanDerWaalsContact SG-CB 3.55Å; C1264-L1270 WeakPolarHBondContact SG-CG 3.13Å; L1270-Q1278 HydrophobicContact CD2-CB 3.47Å; L1270-Q1278 VanDerWaalsContact CD2-CB 3.47Å; L1270-Q1278 HydrophobicContact CD2-CG 3.92Å; L1270-R1279 CarbonylContact C-O 3.55Å; L1270-R1279 WeakPolarHBondContact CA-O 3.05Å; L1270-R1279 VanDerWaalsContact CD2-N 3.32Å; L1270-R1279 WeakPolarHBondContact CD2-O 3.36Å
1271	V	58.3	Low	59.3	Low	60 Å²	60	92.8 Å²	92.8	36%	0.364	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	128.3	180	-177.1	0	0	0	0	107.8	R1279 T1281	V1271-R1279 PolarHBondContact N-O 2.8Å; V1271-R1279 VanDerWaalsContact O-CG 3.27Å; V1271-R1279 WeakPolarHBondContact O-CG 3.33Å; V1271-R1279 PolarHBondContact O-N 3.06Å; V1271-R1279 VanDerWaalsContact O-O 3.13Å; V1271-T1281 HydrophobicContact CB-CG2 4.47Å; V1271-T1281 HydrophobicContact CG2-CG2 4.05Å
1272	A	59.7	Low	60.1	Low	56 Å²	56	94.5 Å²	94.5	46%	0.463	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	157	173.6	0	0	0	0	0	111.7	C1277 Q1278	A1272-C1277 CarbonylContact C-O 3.53Å; A1272-C1277 VanDerWaalsContact CA-O 3.22Å; A1272-C1277 WeakPolarHBondContact CA-O 3.42Å; A1272-Q1278 HydrophobicContact CB-CG 3.84Å
1273	D	56.1	Low	59.6	Low	80 Å²	80	96.2 Å²	96.2	43%	0.428	51%	0.507	S	S	.	.			trans	-94.8	176.1	170.3	70.2	26.6	0	0	0	113.3	R1275 G1276 C1277	D1273-R1275 PolarHBondContact O-N 3.13Å; D1273-R1275 VanDerWaalsContact O-N 3.07Å; D1273-R1275 PolarHBondContact OD1-N 2.99Å; D1273-G1276 PolarHBondContact O-N 3.44Å; D1273-G1276 PolarHBondContact OD1-N 2.94Å; D1273-G1276 VanDerWaalsContact OD1-N 3.09Å; D1273-C1277 PolarHBondContact N-O 3.3Å; D1273-C1277 PolarHBondContact OD1-N 3.44Å
1274	D	51.4	Low	58.4	Low	175 Å²	175	91.4 Å²	91.4	94%	0.936	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-9.6	-176.7	-55	50.4	0	0	0	114.6
1275	R	50.9	Low	56.3	Low	186 Å²	186	96 Å²	96	70%	0.702	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	4.4	172.7	-80	-176	-80	-171.4	-4.7	113.4	D1273	D1273-R1275 PolarHBondContact O-N 3.13Å; D1273-R1275 VanDerWaalsContact O-N 3.07Å; D1273-R1275 PolarHBondContact OD1-N 2.99Å
1276	G	46.6	Very low	54.4	Low	41 Å²	41	98.8 Å²	98.8	42%	0.423	55%	0.55	S	S	.	.	S	Bend	trans	96.4	2.4	173.6	0	0	0	0	0	115	D1273	D1273-G1276 PolarHBondContact O-N 3.44Å; D1273-G1276 PolarHBondContact OD1-N 2.94Å; D1273-G1276 VanDerWaalsContact OD1-N 3.09Å
1277	C	59.8	Low	53.3	Low	45 Å²	45	96.2 Å²	96.2	30%	0.304	54%	0.539	S	S	.	.			trans	-82.8	138.1	-178.9	-64.2	0	0	0	0	112.1	C1258 A1272 D1273	C1258-C1277 WeakPolarHBondContact CB-SG 3.05Å; C1258-C1277 WeakPolarHBondContact SG-CA 2.94Å; C1258-C1277 WeakPolarHBondContact SG-CB 3.32Å; C1258-C1277 CovalentContact SG-SG 2.05Å; C1258-C1277 PolarHBondContact SG-SG 3.46Å; A1272-C1277 CarbonylContact C-O 3.53Å; A1272-C1277 VanDerWaalsContact CA-O 3.22Å; A1272-C1277 WeakPolarHBondContact CA-O 3.42Å; D1273-C1277 PolarHBondContact N-O 3.3Å; D1273-C1277 PolarHBondContact OD1-N 3.44Å
1278	Q	67	Low	52.1	Low	133 Å²	133	100.8 Å²	100.8	62%	0.621	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.4	-156.7	-88.7	-178.5	32.9	0	0	112.2	L1270 A1272	L1270-Q1278 HydrophobicContact CD2-CB 3.47Å; L1270-Q1278 VanDerWaalsContact CD2-CB 3.47Å; L1270-Q1278 HydrophobicContact CD2-CG 3.92Å; A1272-Q1278 HydrophobicContact CB-CG 3.84Å
1279	R	65.3	Low	49.5	Very low	166 Å²	166	96.8 Å²	96.8	63%	0.626	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.5	-179	61.9	164.7	-176.4	144.1	-0.6	114.6	L1270 V1271	L1270-R1279 CarbonylContact C-O 3.55Å; L1270-R1279 WeakPolarHBondContact CA-O 3.05Å; L1270-R1279 VanDerWaalsContact CD2-N 3.32Å; L1270-R1279 WeakPolarHBondContact CD2-O 3.36Å; V1271-R1279 PolarHBondContact N-O 2.8Å; V1271-R1279 VanDerWaalsContact O-CG 3.27Å; V1271-R1279 WeakPolarHBondContact O-CG 3.33Å; V1271-R1279 PolarHBondContact O-N 3.06Å; V1271-R1279 VanDerWaalsContact O-O 3.13Å
1280	C	71.7	Confident	47.8	Very low	51 Å²	51	96.3 Å²	96.3	35%	0.345	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	149.7	175.1	-62.2	0	0	0	0	113.4	C1264 W1268 I1269	C1264-C1280 WeakPolarHBondContact CA-SG 3.37Å; C1264-C1280 HydrophobicContact CB-CB 4.06Å; C1264-C1280 WeakPolarHBondContact CB-SG 3.45Å; C1264-C1280 WeakPolarHBondContact SG-CB 3.43Å; C1264-C1280 CovalentContact SG-SG 2.04Å; C1264-C1280 PolarHBondContact SG-SG 3.42Å; W1268-C1280 HydrophobicContact CB-CB 4.31Å; W1268-C1280 HydrophobicContact CE3-CB 4.23Å; I1269-C1280 CarbonylContact O-C 3.54Å; I1269-C1280 WeakPolarHBondContact O-CA 3.35Å
1281	T	68.9	Low	46.4	Very low	35 Å²	35	99.2 Å²	99.2	22%	0.215	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-141.8	169.3	179.7	68.3	0	0	0	0	111.6	W1268 I1269 V1271	W1268-T1281 CarbonylContact C-O 3.59Å; W1268-T1281 VanDerWaalsContact CA-O 3.32Å; W1268-T1281 WeakPolarHBondContact CA-O 3.29Å; I1269-T1281 WeakPolarHBondContact CG1-O 3.13Å; I1269-T1281 PolarHBondContact N-O 3.22Å; I1269-T1281 PolarHBondContact O-N 2.87Å; I1269-T1281 PolarHBondContact O-OG1 3.49Å; I1269-T1281 VanDerWaalsContact O-OG1 3.11Å; V1271-T1281 HydrophobicContact CB-CG2 4.47Å; V1271-T1281 HydrophobicContact CG2-CG2 4.05Å
1282	Y	55.4	Low	45.5	Very low	161 Å²	161	104.6 Å²	104.6	63%	0.631	58%	0.576	S	S	*	*			trans	-132.4	146.4	179.8	-172.5	-87.1	0	0	0	111.4	G1267 W1268	G1267-Y1282 VanDerWaalsContact O-CD2 3.28Å; G1267-Y1282 WeakPolarHBondContact O-CD2 3.23Å; W1268-Y1282 HydrophobicContact CG-CD2 4.45Å
1283	P	39.2	Very low	45.2	Very low	74 Å²	74	105.1 Å²	105.1	48%	0.481	58%	0.575	S	S	.	*			trans	-90	146.1	-168.8	-7.3	27.2	0	0	0	116.5	I1269	I1269-P1283 HydrophobicContact CD1-CG 4.27Å
1284	A	32	Very low	45.2	Very low	86 Å²	86	106.3 Å²	106.3	71%	0.711	59%	0.587	S	S	*	*			trans	96.4	130.8	140.9	0	0	0	0	0	123.3
1285	T	28.2	Very low	45.2	Very low	130 Å²	130	105.5 Å²	105.5	80%	0.798	58%	0.583	S	S	*	*			trans	90.5	127.2	135.3	37.6	0	0	0	0	125
1286	V	24.5	Very low	45.6	Very low	135 Å²	135	98.7 Å²	98.7	82%	0.818	56%	0.562	S	S	*	*			trans	73.4	103.5	145.4	174.4	0	0	0	0	117.1
1287	A	24.9	Very low	46.5	Very low	77 Å²	77	100.5 Å²	100.5	64%	0.636	57%	0.573	S	S	*	*				109.3	161.4	71.7	0	0	0	0	0	110.7
1288	Q	24.9	Very low	46.4	Very low	150 Å²	150	106.5 Å²	106.5	70%	0.701	60%	0.597	S	S	*	*			cis	-138.5	-103.4	12.6	-156.2	157.8	2	0	0	115.8	V1239 G1241	V1239-Q1288 HydrophobicContact CG1-CB 4.02Å; V1239-Q1288 HydrophobicContact CG2-CB 4.26Å; G1241-Q1288 WeakPolarHBondContact CA-O 3.37Å; G1241-Q1288 PolarHBondContact N-O 2.54Å; G1241-Q1288 VanDerWaalsContact N-O 3.11Å
1289	A	28	Very low	46.5	Very low	30 Å²	30	101.5 Å²	101.5	25%	0.248	58%	0.576	C	S	.	*			trans	-151.2	159.5	-155.7	0	0	0	0	0	117	V1239 A1240 G1241 V1242	V1239-A1289 CarbonylContact C-O 3.52Å; V1239-A1289 WeakPolarHBondContact CG1-O 3.49Å; A1240-A1289 VanDerWaalsContact N-C 3.29Å; A1240-A1289 PolarHBondContact N-O 3.05Å; G1241-A1289 CarbonylContact O-C 3.5Å; V1242-A1289 HydrophobicContact CG2-CB 4.05Å
1290	V	26.7	Very low	46.9	Very low	86 Å²	86	97.2 Å²	97.2	52%	0.521	57%	0.569	S	S	.	*			trans	84.1	142.3	149.7	162	0	0	0	0	115.6	G1241	G1241-V1290 PolarHBondContact O-N 3.47Å
1291	D	34.5	Very low	46.5	Very low	127 Å²	127	102.9 Å²	102.9	68%	0.679	60%	0.597	S	S	*	*			cis	-154.3	167	21.9	-128.9	-17.6	0	0	0	117.8
1292	E	39.4	Very low	45.7	Very low	173 Å²	173	106.7 Å²	106.7	81%	0.808	62%	0.616	S	S	*	*			trans	17.6	137.9	156.8	-71.9	172	162.7	0	0	126.5
1293	C	54.4	Low	46.8	Very low	67 Å²	67	101.9 Å²	101.9	45%	0.453	60%	0.599	S	S	.	*			trans	-88.1	140.3	156.9	-71.5	0	0	0	0	111.6	C1313	C1293-C1313 HydrophobicContact CB-CB 3.92Å; C1293-C1313 WeakPolarHBondContact CB-SG 3.5Å; C1293-C1313 VanDerWaalsContact SG-CA 3.56Å; C1293-C1313 WeakPolarHBondContact SG-CB 3.1Å; C1293-C1313 CovalentContact SG-SG 2.05Å; C1293-C1313 PolarHBondContact SG-SG 3.34Å
1294	P	55.9	Low	48.3	Very low	104 Å²	104	101 Å²	101	68%	0.675	59%	0.594	S	S	*	*			trans	-80.7	144.9	169.5	32.6	-34	0	0	0	113.1	V1296	P1294-V1296 PolarHBondContact O-N 3.5Å
1295	D	51.9	Low	50.1	Low	159 Å²	159	100.6 Å²	100.6	85%	0.85	58%	0.578	S	S	*	*			trans	-69.8	107.3	179.7	-96.8	-46.6	0	0	0	113.3	A1297	D1295-A1297 PolarHBondContact O-N 2.87Å
1296	V	58.5	Low	52.2	Low	42 Å²	42	96.7 Å²	96.7	26%	0.255	56%	0.555	S	S	.	*			trans	-89.6	92.9	162.7	-178.2	0	0	0	0	108.3	P1294 K1314	P1294-V1296 PolarHBondContact O-N 3.5Å; V1296-K1314 HydrophobicContact CB-CB 4.12Å; V1296-K1314 WeakPolarHBondContact CG2-O 3.33Å; V1296-K1314 WeakPolarHBondContact O-CD 3.13Å
1297	A	64.7	Low	54.3	Low	79 Å²	79	96.5 Å²	96.5	65%	0.653	54%	0.543	S	S	*	.			trans	-69.5	-47.1	-176.9	0	0	0	0	0	112.7	D1295	D1295-A1297 PolarHBondContact O-N 2.87Å
1298	E	58.9	Low	56	Low	172 Å²	172	95.2 Å²	95.2	80%	0.804	53%	0.525	S	S	*	.			trans	-137	154	-179	-68.3	177.1	141.4	0	0	109.5
1299	C	69.4	Low	57.1	Low	28 Å²	28	94.2 Å²	94.2	19%	0.189	53%	0.532	C	S	.	.			trans	-105.3	149.3	174.4	-77.3	0	0	0	0	111	C1316	C1299-C1316 WeakPolarHBondContact CA-SG 3.22Å; C1299-C1316 HydrophobicContact CB-CB 3.72Å; C1299-C1316 WeakPolarHBondContact CB-SG 3.03Å; C1299-C1316 WeakPolarHBondContact SG-CA 3.3Å; C1299-C1316 WeakPolarHBondContact SG-CB 3.3Å; C1299-C1316 CovalentContact SG-SG 2.04Å; C1299-C1316 PolarHBondContact SG-SG 3.4Å
1300	P	73	Confident	58.4	Low	75 Å²	75	99 Å²	99	49%	0.487	56%	0.558	S	S	.	*			trans	-57.3	143.9	172.4	-21.2	32.7	0	0	0	111	D1302 H1303	P1300-D1302 PolarHBondContact O-N 2.79Å; P1300-H1303 WeakPolarHBondContact O-CA 3.39Å; P1300-H1303 WeakPolarHBondContact O-CB 3.4Å; P1300-H1303 PolarHBondContact O-N 2.91Å
1301	D	63.8	Low	60.5	Low	171 Å²	171	98.8 Å²	98.8	91%	0.914	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-30	-167.1	-55.9	-88.7	0	0	0	115.1	H1303	D1301-H1303 PolarHBondContact O-N 3.23Å
1302	D	52.3	Low	61.8	Low	115 Å²	115	95.2 Å²	95.2	62%	0.615	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	8	174.5	-64.8	-44.2	0	0	0	113.5	P1300 V1319	P1300-D1302 PolarHBondContact O-N 2.79Å; D1302-V1319 PolarHBondContact O-N 3.44Å
1303	H	78.3	Confident	63.4	Low	59 Å²	59	88.4 Å²	88.4	27%	0.273	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.4	-177.6	-64.9	54.6	0	0	0	112.1	P1300 D1301 C1316 E1317	P1300-H1303 WeakPolarHBondContact O-CA 3.39Å; P1300-H1303 WeakPolarHBondContact O-CB 3.4Å; P1300-H1303 PolarHBondContact O-N 2.91Å; D1301-H1303 PolarHBondContact O-N 3.23Å; H1303-C1316 HydrophobicContact CB-CB 3.83Å; H1303-E1317 CarbonylContact C-O 3.22Å; H1303-E1317 WeakPolarHBondContact CA-O 3.5Å; H1303-E1317 WeakPolarHBondContact CB-O 3.07Å
1304	S	69.9	Low	64.4	Low	55 Å²	55	89 Å²	89	39%	0.385	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	149.5	169.6	58.9	0	0	0	0	111	V1306 C1316 E1317	S1304-V1306 PolarHBondContact O-N 2.64Å; S1304-C1316 CarbonylContact O-C 3.48Å; S1304-C1316 WeakPolarHBondContact O-CA 3.42Å; S1304-E1317 PolarHBondContact N-O 3.28Å; S1304-E1317 PolarHBondContact O-N 3.02Å; S1304-E1317 PolarHBondContact OG-O 2.78Å
1305	M	70.4	Confident	65.4	Low	78 Å²	78	90.4 Å²	90.4	38%	0.384	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119.8	171.1	-170.4	-177.9	-66	0	0	109.2	K1314	M1305-K1314 HydrophobicContact CG-CB 4.4Å; M1305-K1314 HydrophobicContact CG-CG 4.41Å; M1305-K1314 HydrophobicContact SD-CD 3.69Å; M1305-K1314 HydrophobicContact SD-CG 4.11Å
1306	V	71.3	Confident	66.5	Low	49 Å²	49	84.5 Å²	84.5	30%	0.297	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.4	-177.6	-178.6	0	0	0	0	108.6	S1304 R1315 E1317	S1304-V1306 PolarHBondContact O-N 2.64Å; V1306-R1315 PolarHBondContact N-O 3.16Å; V1306-R1315 PolarHBondContact O-N 3.35Å; V1306-R1315 VanDerWaalsContact O-O 3.05Å; V1306-E1317 HydrophobicContact CB-CB 4.31Å; V1306-E1317 HydrophobicContact CG2-CB 3.77Å
1307	F	70	Confident	66.9	Low	130 Å²	130	86.5 Å²	86.5	57%	0.57	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	133.6	173.6	-69.6	-93.1	0	0	0	110	P1309 K1314	F1307-P1309 WeakPolarHBondContact O-CD 3.39Å; F1307-K1314 HydrophobicContact CD1-CG 4.07Å; F1307-K1314 HydrophobicContact CE1-CG 3.64Å; F1307-K1314 HydrophobicContact CZ-CG 4.04Å
1308	D	59.2	Low	67.2	Low	51 Å²	51	86.6 Å²	86.6	27%	0.273	47%	0.474	S	S	.	.			trans	-73.2	117.1	167.3	174	-0.4	0	0	0	108.9	V1310 T1311 G1312 C1313	D1308-V1310 PolarHBondContact O-N 3.41Å; D1308-V1310 WeakPolarHBondContact OD1-CB 3.36Å; D1308-V1310 PolarHBondContact OD1-N 3.34Å; D1308-T1311 WeakPolarHBondContact CB-OG1 3.24Å; D1308-T1311 PolarHBondContact OD1-N 3.17Å; D1308-T1311 WeakPolarHBondContact OD2-CB 3.48Å; D1308-T1311 VanDerWaalsContact OD2-CG2 3.3Å; D1308-T1311 WeakPolarHBondContact OD2-CG2 3.35Å; D1308-T1311 PolarHBondContact OD2-OG1 3.34Å; D1308-G1312 VanDerWaalsContact O-CA 3.32Å; D1308-G1312 WeakPolarHBondContact O-CA 3.06Å; D1308-G1312 PolarHBondContact O-N 2.83Å; D1308-C1313 PolarHBondContact N-O 2.92Å
1309	P	48.9	Very low	67.1	Low	128 Å²	128	81.8 Å²	81.8	83%	0.831	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-7.1	-177.9	31.6	-36.6	0	0	0	113.9	F1307	F1307-P1309 WeakPolarHBondContact O-CD 3.39Å
1310	V	54.9	Low	65.9	Low	132 Å²	132	90.5 Å²	90.5	80%	0.8	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-37.1	179.4	-174.1	0	0	0	0	111.9	D1308	D1308-V1310 PolarHBondContact O-N 3.41Å; D1308-V1310 WeakPolarHBondContact OD1-CB 3.36Å; D1308-V1310 PolarHBondContact OD1-N 3.34Å
1311	T	70	Confident	63.8	Low	80 Å²	80	92.6 Å²	92.6	49%	0.491	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-16.7	179.8	62.4	0	0	0	0	114.1	D1308 C1313	D1308-T1311 WeakPolarHBondContact CB-OG1 3.24Å; D1308-T1311 PolarHBondContact OD1-N 3.17Å; D1308-T1311 WeakPolarHBondContact OD2-CB 3.48Å; D1308-T1311 VanDerWaalsContact OD2-CG2 3.3Å; D1308-T1311 WeakPolarHBondContact OD2-CG2 3.35Å; D1308-T1311 PolarHBondContact OD2-OG1 3.34Å; T1311-C1313 PolarHBondContact O-N 2.78Å; T1311-C1313 VanDerWaalsContact O-N 3.14Å; T1311-C1313 PolarHBondContact OG1-N 3.15Å
1312	G	62.2	Low	62.1	Low	53 Å²	53	89.3 Å²	89.3	55%	0.546	49%	0.489	S	S	.	.			trans	72.2	-8.9	-172.6	0	0	0	0	0	114.3	D1308	D1308-G1312 VanDerWaalsContact O-CA 3.32Å; D1308-G1312 WeakPolarHBondContact O-CA 3.06Å; D1308-G1312 PolarHBondContact O-N 2.83Å
1313	C	73	Confident	60.9	Low	29 Å²	29	90 Å²	90	20%	0.196	50%	0.497	C	S	.	.			trans	-69.5	149.6	178.3	-45.9	0	0	0	0	110.9	C1293 D1308 T1311	C1293-C1313 HydrophobicContact CB-CB 3.92Å; C1293-C1313 WeakPolarHBondContact CB-SG 3.5Å; C1293-C1313 VanDerWaalsContact SG-CA 3.56Å; C1293-C1313 WeakPolarHBondContact SG-CB 3.1Å; C1293-C1313 CovalentContact SG-SG 2.05Å; C1293-C1313 PolarHBondContact SG-SG 3.34Å; D1308-C1313 PolarHBondContact N-O 2.92Å; T1311-C1313 PolarHBondContact O-N 2.78Å; T1311-C1313 VanDerWaalsContact O-N 3.14Å; T1311-C1313 PolarHBondContact OG1-N 3.15Å
1314	K	75.7	Confident	58.3	Low	80 Å²	80	93.4 Å²	93.4	35%	0.348	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	135.7	168.4	-68	167.7	174	178.4	0	109.8	V1296 M1305 F1307	V1296-K1314 HydrophobicContact CB-CB 4.12Å; V1296-K1314 WeakPolarHBondContact CG2-O 3.33Å; V1296-K1314 WeakPolarHBondContact O-CD 3.13Å; M1305-K1314 HydrophobicContact CG-CB 4.4Å; M1305-K1314 HydrophobicContact CG-CG 4.41Å; M1305-K1314 HydrophobicContact SD-CD 3.69Å; M1305-K1314 HydrophobicContact SD-CG 4.11Å; F1307-K1314 HydrophobicContact CD1-CG 4.07Å; F1307-K1314 HydrophobicContact CE1-CG 3.64Å; F1307-K1314 HydrophobicContact CZ-CG 4.04Å
1315	R	76.8	Confident	56.1	Low	133 Å²	133	94.9 Å²	94.9	50%	0.502	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	175.4	162.9	82.7	172.7	-159.3	159.6	1.2	111.1	V1306 E1317	V1306-R1315 PolarHBondContact N-O 3.16Å; V1306-R1315 PolarHBondContact O-N 3.35Å; V1306-R1315 VanDerWaalsContact O-O 3.05Å; R1315-E1317 IonicContact CZ-OE2 3.36Å; R1315-E1317 IonicContact NE-OE2 2.76Å; R1315-E1317 PolarHBondContact NE-OE2 3.31Å; R1315-E1317 IonicContact NH2-OE1 3.63Å; R1315-E1317 IonicContact NH2-OE2 2.63Å; R1315-E1317 PolarHBondContact NH2-OE2 3.17Å
1316	C	75.9	Confident	53.8	Low	35 Å²	35	102.2 Å²	102.2	24%	0.236	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.8	135.7	174	-52.4	0	0	0	0	109.7	C1299 H1303 S1304	C1299-C1316 WeakPolarHBondContact CA-SG 3.22Å; C1299-C1316 HydrophobicContact CB-CB 3.72Å; C1299-C1316 WeakPolarHBondContact CB-SG 3.03Å; C1299-C1316 WeakPolarHBondContact SG-CA 3.3Å; C1299-C1316 WeakPolarHBondContact SG-CB 3.3Å; C1299-C1316 CovalentContact SG-SG 2.04Å; C1299-C1316 PolarHBondContact SG-SG 3.4Å; H1303-C1316 HydrophobicContact CB-CB 3.83Å; S1304-C1316 CarbonylContact O-C 3.48Å; S1304-C1316 WeakPolarHBondContact O-CA 3.42Å
1317	E	66.9	Low	51.5	Low	85 Å²	85	104.9 Å²	104.9	40%	0.397	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.7	133.1	-177.2	-170.9	152.5	172.7	0	0	112	H1303 S1304 V1306 R1315 V1319	H1303-E1317 CarbonylContact C-O 3.22Å; H1303-E1317 WeakPolarHBondContact CA-O 3.5Å; H1303-E1317 WeakPolarHBondContact CB-O 3.07Å; S1304-E1317 PolarHBondContact N-O 3.28Å; S1304-E1317 PolarHBondContact O-N 3.02Å; S1304-E1317 PolarHBondContact OG-O 2.78Å; V1306-E1317 HydrophobicContact CB-CB 4.31Å; V1306-E1317 HydrophobicContact CG2-CB 3.77Å; R1315-E1317 IonicContact CZ-OE2 3.36Å; R1315-E1317 IonicContact NE-OE2 2.76Å; R1315-E1317 PolarHBondContact NE-OE2 3.31Å; R1315-E1317 IonicContact NH2-OE1 3.63Å; R1315-E1317 IonicContact NH2-OE2 2.63Å; R1315-E1317 PolarHBondContact NH2-OE2 3.17Å; E1317-V1319 PolarHBondContact O-N 3.29Å
1318	L	71.4	Confident	49.2	Very low	80 Å²	80	105.3 Å²	105.3	42%	0.419	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.9	121.6	-161.6	-160.2	161.1	0	0	0	112.3	Y1320	L1318-Y1320 HydrophobicContact CD2-CD1 4.16Å; L1318-Y1320 HydrophobicContact CD2-CD2 4.36Å; L1318-Y1320 HydrophobicContact CD2-CE1 4.16Å; L1318-Y1320 HydrophobicContact CD2-CE2 4.36Å; L1318-Y1320 HydrophobicContact CD2-CG 4.27Å; L1318-Y1320 PolarHBondContact O-N 2.88Å
1319	V	56.7	Low	47.4	Very low	72 Å²	72	109.9 Å²	109.9	44%	0.436	61%	0.61	S	S	.	*			trans	-86.8	99.9	179.5	-176.5	0	0	0	0	109.5	D1302 E1317 T1321	D1302-V1319 PolarHBondContact O-N 3.44Å; E1317-V1319 PolarHBondContact O-N 3.29Å; V1319-T1321 PolarHBondContact O-N 3.33Å
1320	Y	42.5	Very low	46.2	Very low	210 Å²	210	109.1 Å²	109.1	82%	0.824	60%	0.603	S	S	*	*			trans	-66.6	95.4	178.8	-74.5	-80.5	0	0	0	112.5	L1318	L1318-Y1320 HydrophobicContact CD2-CD1 4.16Å; L1318-Y1320 HydrophobicContact CD2-CD2 4.36Å; L1318-Y1320 HydrophobicContact CD2-CE1 4.16Å; L1318-Y1320 HydrophobicContact CD2-CE2 4.36Å; L1318-Y1320 HydrophobicContact CD2-CG 4.27Å; L1318-Y1320 PolarHBondContact O-N 2.88Å
1321	T	29.3	Very low	44.8	Very low	120 Å²	120	107.9 Å²	107.9	74%	0.736	60%	0.6	S	S	*	*			trans	-106.7	132	157.3	65.4	0	0	0	0	109.4	V1319	V1319-T1321 PolarHBondContact O-N 3.33Å
1322	S	27.8	Very low	42.7	Very low	102 Å²	102	110.8 Å²	110.8	71%	0.713	62%	0.618	S	S	*	*			trans	-119.6	115.2	-175.4	60.1	0	0	0	0	111.7
1323	T	27.3	Very low	40.8	Very low	128 Å²	128	110.9 Å²	110.9	79%	0.785	62%	0.619	S	S	*	*			trans	66.1	130.5	160.9	61.8	0	0	0	0	116.7
1324	T	24.5	Very low	38.4	Very low	132 Å²	132	116.3 Å²	116.3	81%	0.81	65%	0.653	S	S	*	*			cis	-158.7	152.2	3.8	-4.8	0	0	0	0	113.7
1325	A	24.6	Very low	35.9	Very low	85 Å²	85	121.2 Å²	121.2	70%	0.702	68%	0.675	S	S	*	*			trans	73.7	83.8	145.4	0	0	0	0	0	121.6
1326	R	21.5	Very low	33.5	Very low	233 Å²	233	123.2 Å²	123.2	88%	0.879	69%	0.69	S	S	*	*				86.2	134.5	119.8	-84	-175.1	167	170.7	-3.9	123
1327	T	22.5	Very low	31.1	Very low	105 Å²	105	130.7 Å²	130.7	64%	0.644	72%	0.718	S	S	*	*			trans	76.1	100.5	142.2	48.3	0	0	0	0	121.2
1328	D	21	Very low	29.2	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	74%	0.74	S	S	*	*				103.3	132.2	114.4	-65.6	-15.4	0	0	0	122.7
1329	L	23.1	Very low	27.1	Very low	147 Å²	147	137.3 Å²	137.3	77%	0.77	76%	0.755	S	S	*	*			trans	75	89.3	146.5	-68.1	166.1	0	0	0	122
1330	T	23.7	Very low	25.9	Very low	111 Å²	111	143.6 Å²	143.6	68%	0.681	78%	0.776	S	S	*	*				49.6	118.3	117.8	59.2	0	0	0	0	122.2
1331	S	25.4	Very low	25.5	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	77%	0.769	S	S	*	*				82.3	135.5	126.7	78.8	0	0	0	0	122
1332	V	25.3	Very low	26.3	Very low	141 Å²	141	137.9 Å²	137.9	86%	0.855	76%	0.755	S	S	*	*			trans	55.4	110.4	153.1	-176.8	0	0	0	0	119.2
1333	G	22	Very low	26.7	Very low	55 Å²	55	139.9 Å²	139.9	57%	0.567	76%	0.758	S	S	*	*	S	Bend	trans	65.6	109.8	139.4	0	0	0	0	0	117.5	K1335	G1333-K1335 PolarHBondContact O-N 3.02Å
1334	P	23.4	Very low	27.3	Very low	142 Å²	142	138.3 Å²	138.3	92%	0.922	76%	0.758	S	S	*	*			trans	-61.9	109.4	-166.4	25.8	-35.4	0	0	0	113.5
1335	K	22.6	Very low	27.8	Very low	183 Å²	183	137.4 Å²	137.4	80%	0.796	75%	0.752	S	S	*	*			trans	-138.3	109.4	165.3	-75.9	-166.2	172.5	-170.8	0	111.1	G1333	G1333-K1335 PolarHBondContact O-N 3.02Å
1336	E	25.9	Very low	28.2	Very low	176 Å²	176	141 Å²	141	82%	0.822	76%	0.755	S	S	*	*			trans	41.2	93	144.1	-57.4	175.2	115.3	0	0	117.9
1337	K	25.7	Very low	29.5	Very low	192 Å²	192	137.2 Å²	137.2	84%	0.835	75%	0.752	S	S	*	*				-170.6	140.7	104.1	-99.4	158.6	-173.8	179.8	0	115.5
1338	E	26.4	Very low	31	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	74%	0.743	S	S	*	*			trans	50.2	86.6	152.2	-63.3	-178.7	143.8	0	0	118.9
1339	V	28.5	Very low	32.9	Very low	120 Å²	120	135.5 Å²	135.5	73%	0.727	74%	0.742	S	S	*	*			trans	-61.3	132.8	151.9	173.1	0	0	0	0	109.2	Q1341	V1339-Q1341 PolarHBondContact O-N 3.05Å
1340	K	30.7	Very low	34.7	Very low	204 Å²	204	129.6 Å²	129.6	89%	0.887	71%	0.713	S	S	*	*			trans	-69.3	100.6	160.1	-91.9	-175.2	175.6	177.2	0	108.1	C1342	K1340-C1342 PolarHBondContact O-N 3.03Å
1341	Q	34.6	Very low	36.8	Very low	145 Å²	145	126.5 Å²	126.5	68%	0.678	70%	0.702	S	S	*	*			trans	-54.9	119.9	-172.1	-162	65.7	13.5	0	0	111.1	V1339 N1343	V1339-Q1341 PolarHBondContact O-N 3.05Å; Q1341-N1343 PolarHBondContact O-N 3.34Å
1342	C	45.7	Very low	38.4	Very low	65 Å²	65	129.1 Å²	129.1	44%	0.439	71%	0.708	S	S	.	*			trans	-61.5	123.5	157.3	-65.6	0	0	0	0	106.5	K1340 A1344	K1340-C1342 PolarHBondContact O-N 3.03Å; C1342-A1344 PolarHBondContact O-N 2.85Å
1343	N	36.1	Very low	40.3	Very low	145 Å²	145	129.8 Å²	129.8	78%	0.775	71%	0.706	S	S	*	*			trans	-70	79.7	-179.6	-81.4	-5.2	0	0	0	110.2	Q1341 T1345	Q1341-N1343 PolarHBondContact O-N 3.34Å; N1343-T1345 PolarHBondContact O-N 2.66Å
1344	A	39.5	Very low	42.9	Very low	94 Å²	94	129 Å²	129	78%	0.777	69%	0.691	S	S	*	*			trans	-75.9	63	178.6	0	0	0	0	0	111	C1342	C1342-A1344 PolarHBondContact O-N 2.85Å
1345	T	34.8	Very low	45	Very low	113 Å²	113	128.6 Å²	128.6	69%	0.693	68%	0.679	S	S	*	*			trans	-95	107.6	158.1	48.4	0	0	0	0	107.9	N1343	N1343-T1345 PolarHBondContact O-N 2.66Å
1346	E	34.3	Very low	47.1	Very low	162 Å²	162	125 Å²	125	76%	0.757	67%	0.666	S	S	*	*	S	Bend	trans	69.9	143	169.8	-64.6	151.8	-154.1	0	0	116.2	I1348	E1346-I1348 PolarHBondContact O-N 3.38Å
1347	D	47.8	Very low	49.1	Very low	152 Å²	152	120 Å²	120	81%	0.813	65%	0.645	S	S	*	*			trans	-69.5	124.8	-176.1	-75.1	-67.5	0	0	0	111.6	V1349	D1347-V1349 HydrophobicContact CB-CG2 4.06Å; D1347-V1349 PolarHBondContact O-N 2.87Å
1348	I	53.7	Low	51.2	Low	90 Å²	90	115.8 Å²	115.8	46%	0.462	64%	0.635	S	S	.	*			trans	-75.1	77.7	171	-57.3	-178.5	0	0	0	108.6	E1346 C1350 M1356 P1364	E1346-I1348 PolarHBondContact O-N 3.38Å; I1348-C1350 PolarHBondContact O-N 2.98Å; I1348-M1356 VanDerWaalsContact O-CE 3.27Å; I1348-M1356 WeakPolarHBondContact O-CE 3.35Å; I1348-P1364 HydrophobicContact CD1-CG 4.42Å
1349	V	61.5	Low	52.6	Low	119 Å²	119	109 Å²	109	72%	0.721	61%	0.614	S	S	*	*			trans	-73.2	107.7	174.5	-177.9	0	0	0	0	109	D1347 G1351	D1347-V1349 HydrophobicContact CB-CG2 4.06Å; D1347-V1349 PolarHBondContact O-N 2.87Å; V1349-G1351 PolarHBondContact O-N 3.4Å
1350	C	60.8	Low	53.4	Low	23 Å²	23	109.2 Å²	109.2	16%	0.155	62%	0.621	C	S	.	*	P	Polyproline II helix	trans	-67.9	121.7	170.8	-57.5	0	0	0	0	109.8	I1348 C1354 M1356 C1366	I1348-C1350 PolarHBondContact O-N 2.98Å; C1350-C1354 HydrophobicContact CB-CB 4.06Å; C1350-M1356 WeakPolarHBondContact SG-CA 3.43Å; C1350-M1356 VanDerWaalsContact SG-CB 3.59Å; C1350-C1366 WeakPolarHBondContact CA-SG 3.07Å; C1350-C1366 HydrophobicContact CB-CB 3.86Å; C1350-C1366 WeakPolarHBondContact CB-SG 3.03Å; C1350-C1366 VanDerWaalsContact SG-CA 3.51Å; C1350-C1366 WeakPolarHBondContact SG-CB 3.49Å; C1350-C1366 CovalentContact SG-SG 2.04Å; C1350-C1366 PolarHBondContact SG-SG 3.27Å
1351	G	67.9	Low	54.3	Low	45 Å²	45	105.9 Å²	105.9	46%	0.464	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-63.5	160.9	178.1	0	0	0	0	0	112.9	V1349 L1353 C1354	V1349-G1351 PolarHBondContact O-N 3.4Å; G1351-L1353 PolarHBondContact O-N 2.94Å; G1351-C1354 WeakPolarHBondContact O-CB 3.18Å; G1351-C1354 PolarHBondContact O-N 3.04Å
1352	D	58.8	Low	55.2	Low	163 Å²	163	101.3 Å²	101.3	87%	0.872	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.6	133.4	-177.1	-67.8	-47.7	0	0	0	112.4
1353	L	66.3	Low	56.3	Low	155 Å²	155	101 Å²	101	81%	0.812	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.6	-5.7	-169.4	-69.8	70.2	0	0	0	116.9	G1351 P1369	G1351-L1353 PolarHBondContact O-N 2.94Å; L1353-P1369 WeakPolarHBondContact O-CD 3.17Å
1354	C	76.7	Confident	58	Low	38 Å²	38	96.7 Å²	96.7	26%	0.257	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-96	136.2	168.9	-59	0	0	0	0	111.5	C1350 G1351 C1366 L1367 C1368	C1350-C1354 HydrophobicContact CB-CB 4.06Å; G1351-C1354 WeakPolarHBondContact O-CB 3.18Å; G1351-C1354 PolarHBondContact O-N 3.04Å; C1354-C1366 HydrophobicContact CB-CB 4.35Å; C1354-L1367 WeakPolarHBondContact CA-O 3.05Å; C1354-C1368 HydrophobicContact CB-CB 4.12Å; C1354-C1368 WeakPolarHBondContact CB-SG 3.45Å; C1354-C1368 WeakPolarHBondContact SG-CB 3.42Å; C1354-C1368 CovalentContact SG-SG 2.04Å; C1354-C1368 PolarHBondContact SG-SG 3.46Å
1355	M	67.5	Low	59.6	Low	134 Å²	134	94.6 Å²	94.6	66%	0.66	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.9	130.8	178.8	-171.9	174.3	-67.4	0	0	111	I1357 L1367	M1355-I1357 PolarHBondContact O-N 3.09Å; M1355-L1367 PolarHBondContact N-O 3.13Å; M1355-L1367 PolarHBondContact O-N 3.3Å
1356	M	67	Low	61.7	Low	106 Å²	106	91.6 Å²	91.6	52%	0.522	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	125.9	171.5	-166.1	-174.1	-61.3	0	0	110.3	I1348 C1350 P1364 S1365	I1348-M1356 VanDerWaalsContact O-CE 3.27Å; I1348-M1356 WeakPolarHBondContact O-CE 3.35Å; C1350-M1356 WeakPolarHBondContact SG-CA 3.43Å; C1350-M1356 VanDerWaalsContact SG-CB 3.59Å; M1356-P1364 HydrophobicContact CG-CB 4.08Å; M1356-P1364 HydrophobicContact SD-CB 3.88Å; M1356-S1365 CarbonylContact C-O 3.53Å; M1356-S1365 WeakPolarHBondContact CA-O 3.49Å
1357	I	67.7	Low	63.5	Low	73 Å²	73	89.1 Å²	89.1	37%	0.374	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.1	173.2	53.1	164.7	0	0	0	109.6	M1355 S1365 L1367	M1355-I1357 PolarHBondContact O-N 3.09Å; I1357-S1365 PolarHBondContact N-O 2.03Å; I1357-S1365 PolarHBondContact O-N 3.49Å; I1357-S1365 VanDerWaalsContact O-O 3.1Å; I1357-S1365 PolarHBondContact O-OG 2.03Å; I1357-L1367 HydrophobicContact CD1-CB 3.83Å; I1357-L1367 HydrophobicContact CD1-CD1 4.42Å; I1357-L1367 HydrophobicContact CD1-CD2 4.35Å; I1357-L1367 HydrophobicContact CD1-CG 4.43Å; I1357-L1367 HydrophobicContact CG1-CB 4.09Å
1358	T	69.7	Low	64.9	Low	102 Å²	102	83.8 Å²	83.8	63%	0.626	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.2	170	37.1	0	0	0	0	109.9	C1363 P1364	T1358-C1363 WeakPolarHBondContact CA-O 3.12Å; T1358-P1364 HydrophobicContact CG2-CB 4.36Å
1359	G	55.4	Low	65	Low	41 Å²	41	84.1 Å²	84.1	42%	0.423	52%	0.518	S	S	.	.			trans	-74.7	176.8	175.4	0	0	0	0	0	112.8	D1361 G1362 C1363	G1359-D1361 PolarHBondContact O-N 3.23Å; G1359-G1362 PolarHBondContact O-N 3.02Å; G1359-G1362 VanDerWaalsContact O-N 3.08Å; G1359-C1363 PolarHBondContact N-O 3.45Å
1360	S	45	Very low	64.2	Low	125 Å²	125	87.5 Å²	87.5	87%	0.874	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-29.2	170	43.1	0	0	0	0	113.4	G1362	S1360-G1362 VanDerWaalsContact C-N 3.28Å; S1360-G1362 PolarHBondContact O-N 2.84Å
1361	D	50.5	Low	63.3	Low	133 Å²	133	89.9 Å²	89.9	71%	0.711	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	5.2	-171.9	-53.5	12.5	0	0	0	111.7	G1359 C1363	G1359-D1361 PolarHBondContact O-N 3.23Å; D1361-C1363 PolarHBondContact O-N 2.81Å
1362	G	53.1	Low	61.5	Low	49 Å²	49	96.2 Å²	96.2	51%	0.505	57%	0.573	S	S	.	*	S	Bend	trans	79.9	-21	-177.8	0	0	0	0	0	115	G1359 S1360	G1359-G1362 PolarHBondContact O-N 3.02Å; G1359-G1362 VanDerWaalsContact O-N 3.08Å; S1360-G1362 VanDerWaalsContact C-N 3.28Å; S1360-G1362 PolarHBondContact O-N 2.84Å
1363	C	69.2	Low	60.1	Low	59 Å²	59	93.7 Å²	93.7	40%	0.399	57%	0.568	S	S	.	*			trans	-66	137.4	179.2	-65.5	0	0	0	0	112.8	T1358 G1359 D1361	T1358-C1363 WeakPolarHBondContact CA-O 3.12Å; G1359-C1363 PolarHBondContact N-O 3.45Å; D1361-C1363 PolarHBondContact O-N 2.81Å
1364	P	71	Confident	58.3	Low	54 Å²	54	93.1 Å²	93.1	35%	0.351	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.8	146.5	171.8	30.2	-33.3	0	0	0	111.9	I1348 M1356 T1358	I1348-P1364 HydrophobicContact CD1-CG 4.42Å; M1356-P1364 HydrophobicContact CG-CB 4.08Å; M1356-P1364 HydrophobicContact SD-CB 3.88Å; T1358-P1364 HydrophobicContact CG2-CB 4.36Å
1365	S	73.9	Confident	55.8	Low	51 Å²	51	98.2 Å²	98.2	36%	0.357	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-149.2	164.6	177.9	66.7	0	0	0	0	110.2	M1356 I1357	M1356-S1365 CarbonylContact C-O 3.53Å; M1356-S1365 WeakPolarHBondContact CA-O 3.49Å; I1357-S1365 PolarHBondContact N-O 2.03Å; I1357-S1365 PolarHBondContact O-N 3.49Å; I1357-S1365 VanDerWaalsContact O-O 3.1Å; I1357-S1365 PolarHBondContact O-OG 2.03Å
1366	C	77.5	Confident	53.9	Low	49 Å²	49	96.4 Å²	96.4	33%	0.331	61%	0.606	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	122.7	-175	-58.5	0	0	0	0	112.4	C1350 C1354	C1350-C1366 WeakPolarHBondContact CA-SG 3.07Å; C1350-C1366 HydrophobicContact CB-CB 3.86Å; C1350-C1366 WeakPolarHBondContact CB-SG 3.03Å; C1350-C1366 VanDerWaalsContact SG-CA 3.51Å; C1350-C1366 WeakPolarHBondContact SG-CB 3.49Å; C1350-C1366 CovalentContact SG-SG 2.04Å; C1350-C1366 PolarHBondContact SG-SG 3.27Å; C1354-C1366 HydrophobicContact CB-CB 4.35Å
1367	L	73.4	Confident	51.9	Low	111 Å²	111	96.6 Å²	96.6	58%	0.581	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.7	110.8	172.8	-169.1	71.8	0	0	0	110.1	C1354 M1355 I1357	C1354-L1367 WeakPolarHBondContact CA-O 3.05Å; M1355-L1367 PolarHBondContact N-O 3.13Å; M1355-L1367 PolarHBondContact O-N 3.3Å; I1357-L1367 HydrophobicContact CD1-CB 3.83Å; I1357-L1367 HydrophobicContact CD1-CD1 4.42Å; I1357-L1367 HydrophobicContact CD1-CD2 4.35Å; I1357-L1367 HydrophobicContact CD1-CG 4.43Å; I1357-L1367 HydrophobicContact CG1-CB 4.09Å
1368	C	75.5	Confident	49.7	Very low	39 Å²	39	100.8 Å²	100.8	26%	0.264	64%	0.638	S	S	.	*			trans	-106.7	132	-179.4	-56.3	0	0	0	0	110.9	C1354 Q1370 G1371	C1354-C1368 HydrophobicContact CB-CB 4.12Å; C1354-C1368 WeakPolarHBondContact CB-SG 3.45Å; C1354-C1368 WeakPolarHBondContact SG-CB 3.42Å; C1354-C1368 CovalentContact SG-SG 2.04Å; C1354-C1368 PolarHBondContact SG-SG 3.46Å; C1368-Q1370 PolarHBondContact O-N 3.39Å; C1368-G1371 PolarHBondContact O-N 3.05Å; C1368-G1371 VanDerWaalsContact O-N 3.11Å
1369	P	56.9	Low	47.5	Very low	97 Å²	97	99.3 Å²	99.3	63%	0.63	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	15.4	-170.4	30	-37.1	0	0	0	116.1	L1353	L1353-P1369 WeakPolarHBondContact O-CD 3.17Å
1370	Q	45.6	Very low	45.8	Very low	191 Å²	191	103.3 Å²	103.3	89%	0.893	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.6	0.1	173.1	-68	-77.9	-83.7	0	0	113.1	C1368	C1368-Q1370 PolarHBondContact O-N 3.39Å
1371	G	41	Very low	44.8	Very low	73 Å²	73	103 Å²	103	75%	0.753	65%	0.645	S	S	*	*			trans	80.1	24.5	160	0	0	0	0	0	118.6	C1368	C1368-G1371 PolarHBondContact O-N 3.05Å; C1368-G1371 VanDerWaalsContact O-N 3.11Å
1372	E	29.5	Very low	43.3	Very low	178 Å²	178	102 Å²	102	83%	0.832	65%	0.648	S	S	*	*			trans	-138.3	143.4	175.5	-152.6	163.1	-136.4	0	0	111.5
1373	S	30.4	Very low	41.8	Very low	110 Å²	110	104.6 Å²	104.6	77%	0.769	67%	0.665	S	S	*	*			trans	-139.1	133.1	-173	57.7	0	0	0	0	111.9
1374	T	29.1	Very low	39.6	Very low	142 Å²	142	110.7 Å²	110.7	87%	0.871	69%	0.688	S	S	*	*			trans	-139.9	152.8	178.7	50.5	0	0	0	0	111.4
1375	V	24.1	Very low	37.6	Very low	146 Å²	146	113.4 Å²	113.4	89%	0.885	71%	0.706	S	S	*	*			trans	-138.3	144	-168.6	177.7	0	0	0	0	109.8
1376	A	26.8	Very low	35	Very low	95 Å²	95	119.6 Å²	119.6	79%	0.785	73%	0.729	S	S	*	*			trans	-147.8	136.1	172.1	0	0	0	0	0	111.4
1377	P	24	Very low	32.4	Very low	110 Å²	110	124 Å²	124	71%	0.714	75%	0.754	S	S	*	*			trans	-113.2	168.1	-177.2	40.4	-33.5	0	0	0	114.6
1378	L	22.8	Very low	29.9	Very low	161 Å²	161	127.2 Å²	127.2	84%	0.843	77%	0.766	S	S	*	*				167.7	117.2	128.7	-90.4	164.3	0	0	0	116
1379	A	22.7	Very low	27.8	Very low	71 Å²	71	131.2 Å²	131.2	59%	0.587	79%	0.792	S	S	*	*				80.9	113.1	123.3	0	0	0	0	0	125
1380	V	20.8	Very low	26.2	Very low	126 Å²	126	134.1 Å²	134.1	76%	0.764	80%	0.801	S	S	*	*				93.8	123.9	113.5	166.9	0	0	0	0	122.4
1381	T	22.4	Very low	25.1	Very low	119 Å²	119	129.4 Å²	129.4	73%	0.73	79%	0.79	S	S	*	*			trans	69.5	111.2	155.8	48.3	0	0	0	0	124.4
1382	S	20.1	Very low	24.3	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	79%	0.789	S	S	*	*				64.5	128.5	109.8	-50.3	0	0	0	0	124.7
1383	A	22.3	Very low	24.2	Very low	105 Å²	105	130.9 Å²	130.9	87%	0.868	79%	0.79	S	S	*	*			trans	85.5	147.3	142	0	0	0	0	0	121.3
1384	E	21.2	Very low	24.1	Very low	187 Å²	187	134 Å²	134	87%	0.874	79%	0.792	S	S	*	*			trans	-83.8	176.7	175.1	-46	168.5	124.6	0	0	110.7
1385	P	30.8	Very low	24.3	Very low	111 Å²	111	132 Å²	132	72%	0.721	78%	0.781	S	S	*	*			cis	-136.5	179	1.3	43	-25.8	0	0	0	116.2
1386	E	19	Very low	24.3	Very low	181 Å²	181	134 Å²	134	85%	0.846	78%	0.781	S	S	*	*			trans	42	148.6	149.1	-69.4	-172.9	156.6	0	0	124.9
1387	T	23	Very low	24.4	Very low	141 Å²	141	135.4 Å²	135.4	87%	0.865	79%	0.785	S	S	*	*			trans	99.7	130.9	159.3	-27.1	0	0	0	0	118.4
1388	E	21.1	Very low	24.6	Very low	178 Å²	178	134.7 Å²	134.7	83%	0.832	79%	0.789	S	S	*	*			trans	-83.2	164	175.8	-50.9	-172.2	147.7	0	0	113.3
1389	P	29.9	Very low	25.2	Very low	123 Å²	123	137.3 Å²	137.3	80%	0.799	79%	0.793	S	S	*	*				-153.9	146.9	91.9	38.5	-19.5	0	0	0	118.9
1390	L	23.2	Very low	25.7	Very low	158 Å²	158	143.9 Å²	143.9	83%	0.827	81%	0.809	S	S	*	*			trans	44.2	133.1	136.8	-149.9	71.6	0	0	0	124.5
1391	S	23	Very low	26.4	Very low	93 Å²	93	143.6 Å²	143.6	65%	0.65	81%	0.807	S	S	*	*			trans	89.1	119.9	143.3	50.7	0	0	0	0	126.2
1392	T	25	Very low	27.5	Very low	121 Å²	121	142.7 Å²	142.7	74%	0.742	80%	0.802	S	S	*	*			trans	72	113.3	133.4	54.6	0	0	0	0	127.2
1393	L	26.6	Very low	28.7	Very low	161 Å²	161	138.9 Å²	138.9	84%	0.843	78%	0.775	S	S	*	*				68	158.9	121.1	-67.2	170	0	0	0	126
1394	E	27.4	Very low	29.8	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	76%	0.761	S	S	*	*			trans	110.5	150.8	160.8	-67.1	-73.9	91.9	0	0	121
1395	P	35.2	Very low	31	Very low	99 Å²	99	136.9 Å²	136.9	64%	0.643	75%	0.746	S	S	*	*			trans	-146.7	-169.3	-146.7	44.5	-22.5	0	0	0	120.8
1396	E	22.8	Very low	31.8	Very low	188 Å²	188	135.8 Å²	135.8	88%	0.879	73%	0.729	S	S	*	*			trans	78.9	147.1	150.1	-71	-129.5	144.9	0	0	126.1
1397	S	29.2	Very low	33	Very low	126 Å²	126	131.9 Å²	131.9	88%	0.881	71%	0.712	S	S	*	*			trans	-169.3	162.4	163.8	-153.8	0	0	0	0	113.8
1398	A	27.7	Very low	34	Very low	95 Å²	95	129 Å²	129	79%	0.785	70%	0.703	S	S	*	*			trans	-152.1	166.6	-171.5	0	0	0	0	0	118
1399	K	35.7	Very low	35.5	Very low	216 Å²	216	126.1 Å²	126.1	94%	0.939	68%	0.684	S	S	*	*			trans	-147.2	168.9	175.1	-102.9	162.1	-176	167.9	0	113.3
1400	K	34.4	Very low	36.5	Very low	209 Å²	209	128.7 Å²	128.7	91%	0.909	68%	0.683	S	S	*	*			trans	-122.6	158	-148.9	-70.4	176	172.4	175.4	0	118.9
1401	T	34.8	Very low	37.1	Very low	120 Å²	120	125.8 Å²	125.8	74%	0.736	67%	0.669	S	S	*	*			trans	-145.5	171.2	160.8	-27.2	0	0	0	0	110.7
1402	T	44.2	Very low	37.4	Very low	100 Å²	100	124.1 Å²	124.1	61%	0.613	66%	0.656	S	S	*	*			trans	-108	170.5	-155.2	53	0	0	0	0	118.4
1403	C	45.6	Very low	37.9	Very low	30 Å²	30	124 Å²	124	20%	0.203	65%	0.65	C	S	.	*	H	α-helix	trans	-61.4	-44.9	-168.5	-147.7	0	0	0	0	114.6	E1405 K1406 M1407 C1430	C1403-E1405 PolarHBondContact O-N 3.33Å; C1403-K1406 WeakPolarHBondContact O-CB 3.42Å; C1403-K1406 PolarHBondContact O-N 3.01Å; C1403-M1407 PolarHBondContact O-N 2.93Å; C1403-C1430 HydrophobicContact CB-CB 4.25Å; C1403-C1430 WeakPolarHBondContact CB-SG 3.02Å; C1403-C1430 WeakPolarHBondContact SG-CB 3.19Å; C1403-C1430 CovalentContact SG-SG 2.05Å; C1403-C1430 PolarHBondContact SG-SG 3.41Å
1404	K	45.6	Very low	38.3	Very low	133 Å²	133	121 Å²	121	58%	0.578	64%	0.641	S	S	*	*	H	α-helix	trans	-66.7	-32.2	-166.3	-139.4	163.9	-170.7	164.1	0	113.6	K1406 T1433	K1404-K1406 VanDerWaalsContact C-N 3.35Å; K1404-T1433 VanDerWaalsContact NZ-CG2 3.3Å
1405	E	45.9	Very low	38.7	Very low	117 Å²	117	117.9 Å²	117.9	55%	0.547	64%	0.635	S	S	.	*	H	α-helix	trans	-75.2	-19.8	173.2	-70.7	-166.3	111.6	0	0	113.5	C1403	C1403-E1405 PolarHBondContact O-N 3.33Å
1406	K	49.5	Very low	38.4	Very low	87 Å²	87	114 Å²	114	38%	0.378	61%	0.611	S	S	.	*	H	α-helix	trans	-79.6	-49.9	179	-73.8	-170.4	167.5	-166.5	0	112.6	C1403 K1404 A1408 R1409 P1414	C1403-K1406 WeakPolarHBondContact O-CB 3.42Å; C1403-K1406 PolarHBondContact O-N 3.01Å; K1404-K1406 VanDerWaalsContact C-N 3.35Å; K1406-A1408 PolarHBondContact O-N 2.04Å; K1406-R1409 PolarHBondContact O-N 3.26Å; K1406-P1414 PolarHBondContact NZ-O 3.48Å; K1406-P1414 VanDerWaalsContact NZ-O 3.09Å
1407	M	43.7	Very low	39.5	Very low	99 Å²	99	112 Å²	112	49%	0.488	60%	0.601	S	S	.	*	H	α-helix	trans	-57.8	-34.1	179.4	-78.9	-169.3	89.5	0	0	112.7	C1403 R1409 K1410 C1430	C1403-M1407 PolarHBondContact O-N 2.93Å; M1407-R1409 PolarHBondContact O-N 3.5Å; M1407-K1410 PolarHBondContact O-N 3.17Å; M1407-C1430 HydrophobicContact CG-CB 4.41Å; M1407-C1430 VanDerWaalsContact CG-SG 3.55Å; M1407-C1430 HydrophobicContact SD-CB 3.49Å; M1407-C1430 WeakPolarHBondContact SD-CB 3.39Å; M1407-C1430 PolarHBondContact SD-SG 3.49Å
1408	A	42.6	Very low	39.9	Very low	82 Å²	82	110.8 Å²	110.8	68%	0.678	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-3.7	177.4	0	0	0	0	0	115	K1406	K1406-A1408 PolarHBondContact O-N 2.04Å
1409	R	53.6	Low	40.1	Very low	116 Å²	116	113.5 Å²	113.5	44%	0.438	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.3	0.8	-179.6	-66.7	-173.8	171	-156.3	-4.4	115.1	K1406 M1407 D1411	K1406-R1409 PolarHBondContact O-N 3.26Å; M1407-R1409 PolarHBondContact O-N 3.5Å; R1409-D1411 PolarHBondContact O-N 3.41Å; R1409-D1411 VanDerWaalsContact O-N 3.11Å
1410	K	51.3	Low	39.8	Very low	178 Å²	178	107.4 Å²	107.4	77%	0.774	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.8	-0.3	-172.6	-63	-171.7	175.4	-174.6	0	116	M1407 C1412	M1407-K1410 PolarHBondContact O-N 3.17Å; K1410-C1412 PolarHBondContact O-N 3.17Å
1411	D	35.5	Very low	39.8	Very low	97 Å²	97	99.5 Å²	99.5	52%	0.519	55%	0.545	S	S	.	.			trans	-73.7	86.9	168.8	-67.2	-49	0	0	0	111	R1409 L1413	R1409-D1411 PolarHBondContact O-N 3.41Å; R1409-D1411 VanDerWaalsContact O-N 3.11Å; D1411-L1413 PolarHBondContact O-N 3.36Å
1412	C	29.8	Very low	39.6	Very low	58 Å²	58	104.2 Å²	104.2	39%	0.392	56%	0.559	S	S	.	*			trans	-77.5	61.9	168.6	-159.1	0	0	0	0	111.2	K1410 C1428	K1410-C1412 PolarHBondContact O-N 3.17Å; C1412-C1428 HydrophobicContact CB-CB 4.28Å; C1412-C1428 WeakPolarHBondContact CB-SG 3.07Å; C1412-C1428 WeakPolarHBondContact SG-CB 3.43Å; C1412-C1428 CovalentContact SG-SG 2.06Å; C1412-C1428 PolarHBondContact SG-SG 2.81Å
1413	L	34.4	Very low	39.2	Very low	118 Å²	118	103.7 Å²	103.7	62%	0.618	57%	0.565	S	S	*	*			trans	-98.5	146.1	171.3	-85.8	163.4	0	0	0	110.8	D1411	D1411-L1413 PolarHBondContact O-N 3.36Å
1414	P	34.8	Very low	38.6	Very low	98 Å²	98	105.8 Å²	105.8	64%	0.636	59%	0.592	S	S	*	*	S	Bend	trans	-55.7	158.1	-167.8	-30.4	37	0	0	0	117	K1406	K1406-P1414 PolarHBondContact NZ-O 3.48Å; K1406-P1414 VanDerWaalsContact NZ-O 3.09Å
1415	P	35.6	Very low	37.9	Very low	109 Å²	109	105.2 Å²	105.2	71%	0.708	59%	0.594	S	S	*	*	S	Bend	cis	-93.7	98.3	-6.5	34.5	-29	0	0	0	111.6
1416	C	30.1	Very low	37.4	Very low	19 Å²	19	103.6 Å²	103.6	13%	0.128	60%	0.595	C	S	.	*	S	Bend	trans	-119.4	129.1	154.1	-72.4	0	0	0	0	105.3	I1418	C1416-I1418 PolarHBondContact O-N 3.04Å
1417	H	45.3	Very low	36.9	Very low	145 Å²	145	103.3 Å²	103.3	67%	0.671	60%	0.601	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.1	126.7	-174.3	-85.2	-87.1	0	0	0	110.7
1418	I	37.9	Very low	36.6	Very low	101 Å²	101	100.7 Å²	100.7	52%	0.518	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.1	117.9	168.7	-55.5	179.4	0	0	0	107.1	C1416 T1427	C1416-I1418 PolarHBondContact O-N 3.04Å; I1418-T1427 WeakPolarHBondContact CA-O 3.46Å
1419	F	31.9	Very low	36.8	Very low	152 Å²	152	100.8 Å²	100.8	67%	0.667	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.2	114.2	162.8	-72.9	-82.7	0	0	0	108.6	G1421 S1426 T1427	F1419-G1421 PolarHBondContact O-N 3.34Å; F1419-S1426 WeakPolarHBondContact O-CA 3.02Å; F1419-T1427 PolarHBondContact N-O 3.14Å; F1419-T1427 VanDerWaalsContact N-O 3.07Å; F1419-T1427 PolarHBondContact O-N 3Å; F1419-T1427 VanDerWaalsContact O-N 3.1Å
1420	A	30.3	Very low	36.4	Very low	88 Å²	88	95.8 Å²	95.8	73%	0.727	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.4	109.1	170.5	0	0	0	0	0	109.3
1421	G	32.8	Very low	35.9	Very low	42 Å²	42	93.1 Å²	93.1	43%	0.433	57%	0.567	S	S	.	*			trans	-72.2	155.3	171.5	0	0	0	0	0	111.6	F1419 A1423 G1424 I1425	F1419-G1421 PolarHBondContact O-N 3.34Å; G1421-A1423 PolarHBondContact O-N 2.77Å; G1421-G1424 PolarHBondContact O-N 2.87Å; G1421-I1425 PolarHBondContact N-O 3.2Å
1422	Q	32.2	Very low	35.9	Very low	220 Å²	220	95.4 Å²	95.4	100%	1.028	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	21.3	-172.6	-62.9	176.3	-73.1	0	0	115.5
1423	A	34.7	Very low	36.4	Very low	88 Å²	88	96.6 Å²	96.6	73%	0.727	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.8	22.2	177.3	0	0	0	0	0	112.9	G1421 I1425	G1421-A1423 PolarHBondContact O-N 2.77Å; A1423-I1425 PolarHBondContact O-N 3.38Å
1424	G	32.3	Very low	36.4	Very low	75 Å²	75	97.5 Å²	97.5	77%	0.773	59%	0.591	S	S	*	*	S	Bend	trans	76.2	20	176.2	0	0	0	0	0	115.1	G1421	G1421-G1424 PolarHBondContact O-N 2.87Å
1425	I	31.9	Very low	36.3	Very low	121 Å²	121	99.7 Å²	99.7	62%	0.621	60%	0.597	S	S	*	*			trans	-109.2	132.7	176.9	-60.1	172.6	0	0	0	108.5	G1421 A1423	G1421-I1425 PolarHBondContact N-O 3.2Å; A1423-I1425 PolarHBondContact O-N 3.38Å
1426	S	35.4	Very low	36	Very low	82 Å²	82	98.9 Å²	98.9	57%	0.573	60%	0.6	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.5	127.7	-167	9.3	0	0	0	0	112.5	F1419	F1419-S1426 WeakPolarHBondContact O-CA 3.02Å
1427	T	38.6	Very low	36.1	Very low	82 Å²	82	104 Å²	104	50%	0.503	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.3	129.4	-172.7	-51.1	0	0	0	0	112.2	I1418 F1419 V1429	I1418-T1427 WeakPolarHBondContact CA-O 3.46Å; F1419-T1427 PolarHBondContact N-O 3.14Å; F1419-T1427 VanDerWaalsContact N-O 3.07Å; F1419-T1427 PolarHBondContact O-N 3Å; F1419-T1427 VanDerWaalsContact O-N 3.1Å; T1427-V1429 HydrophobicContact CG2-CG2 4.38Å
1428	C	37.2	Very low	35.2	Very low	44 Å²	44	102.4 Å²	102.4	30%	0.297	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.7	137.2	174.7	-71.3	0	0	0	0	112.2	C1412	C1412-C1428 HydrophobicContact CB-CB 4.28Å; C1412-C1428 WeakPolarHBondContact CB-SG 3.07Å; C1412-C1428 WeakPolarHBondContact SG-CB 3.43Å; C1412-C1428 CovalentContact SG-SG 2.06Å; C1412-C1428 PolarHBondContact SG-SG 2.81Å
1429	V	47.2	Very low	34.9	Very low	84 Å²	84	107.8 Å²	107.8	51%	0.509	65%	0.653	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-144.1	131.8	175.2	-174	0	0	0	0	111.3	T1427	T1427-V1429 HydrophobicContact CG2-CG2 4.38Å
1430	C	45.3	Very low	34.6	Very low	11 Å²	11	108 Å²	108	7%	0.074	66%	0.657	C	S	.	*			trans	-84.6	136.8	162	-83.5	0	0	0	0	109.4	C1403 M1407 E1432	C1403-C1430 HydrophobicContact CB-CB 4.25Å; C1403-C1430 WeakPolarHBondContact CB-SG 3.02Å; C1403-C1430 WeakPolarHBondContact SG-CB 3.19Å; C1403-C1430 CovalentContact SG-SG 2.05Å; C1403-C1430 PolarHBondContact SG-SG 3.41Å; M1407-C1430 HydrophobicContact CG-CB 4.41Å; M1407-C1430 VanDerWaalsContact CG-SG 3.55Å; M1407-C1430 HydrophobicContact SD-CB 3.49Å; M1407-C1430 WeakPolarHBondContact SD-CB 3.39Å; M1407-C1430 PolarHBondContact SD-SG 3.49Å; C1430-E1432 VanDerWaalsContact C-N 3.34Å; C1430-E1432 PolarHBondContact O-N 2.84Å
1431	P	40.4	Very low	34.6	Very low	122 Å²	122	108.6 Å²	108.6	79%	0.792	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	3.9	-169.3	31.8	-37.3	0	0	0	116.7
1432	E	36.3	Very low	34.4	Very low	144 Å²	144	115.9 Å²	115.9	67%	0.673	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	10.2	-167.5	-65.9	-175	165.1	0	0	115.6	C1430	C1430-E1432 VanDerWaalsContact C-N 3.34Å; C1430-E1432 PolarHBondContact O-N 2.84Å
1433	T	39.1	Very low	34.1	Very low	84 Å²	84	110.7 Å²	110.7	52%	0.515	66%	0.657	S	S	.	*			trans	-147.5	132.4	173.9	44.9	0	0	0	0	110.9	K1404	K1404-T1433 VanDerWaalsContact NZ-CG2 3.3Å
1434	T	34.6	Very low	33.5	Very low	137 Å²	137	110.9 Å²	110.9	84%	0.84	66%	0.658	S	S	*	*			trans	-95.1	-8.2	-165.5	40.9	0	0	0	0	116.2
1435	D	33.5	Very low	33.1	Very low	143 Å²	143	114.3 Å²	114.3	77%	0.765	66%	0.659	S	S	*	*			trans	-117.5	137.9	-166.3	-64.1	-88.9	0	0	0	112
1436	A	29.9	Very low	32.8	Very low	92 Å²	92	113.6 Å²	113.6	76%	0.76	67%	0.671	S	S	*	*			trans	-98.4	-169.8	-161.6	0	0	0	0	0	112.3
1437	P	30.9	Very low	32.2	Very low	128 Å²	128	115.7 Å²	115.7	83%	0.831	68%	0.68	S	S	*	*			cis	-133.1	-174.2	38	37.3	-15.7	0	0	0	116.3
1438	V	27	Very low	31.7	Very low	110 Å²	110	116.5 Å²	116.5	67%	0.667	69%	0.689	S	S	*	*			trans	-105	153	-166.9	177.1	0	0	0	0	112.3
1439	F	31	Very low	31.3	Very low	214 Å²	214	120.3 Å²	120.3	94%	0.939	71%	0.713	S	S	*	*			trans	-140.2	161.3	155.5	-92.5	-78.8	0	0	0	110.7
1440	E	25.6	Very low	30.4	Very low	158 Å²	158	121.1 Å²	121.1	74%	0.738	73%	0.729	S	S	*	*			trans	-148.2	169.4	-146.2	-160.6	178.8	-119.9	0	0	112.8
1441	T	30.4	Very low	29.7	Very low	99 Å²	99	126.7 Å²	126.7	61%	0.607	76%	0.758	S	S	*	*			trans	71.6	154.5	167.3	72.5	0	0	0	0	118
1442	F	28.7	Very low	29.6	Very low	195 Å²	195	126 Å²	126	86%	0.855	75%	0.747	S	S	*	*			cis	-150.5	176.5	-10	-105.1	-28.4	0	0	0	109.1
1443	P	25.7	Very low	29.9	Very low	112 Å²	112	123.8 Å²	123.8	73%	0.727	75%	0.747	S	S	*	*			trans	-116.4	172.2	-146.6	44	-36.7	0	0	0	117.9
1444	A	23.5	Very low	30.4	Very low	91 Å²	91	122.3 Å²	122.3	75%	0.752	75%	0.748	S	S	*	*			trans	58.8	109.1	140.2	0	0	0	0	0	121.8
1445	N	22.8	Very low	31.4	Very low	148 Å²	148	118 Å²	118	79%	0.791	72%	0.721	S	S	*	*				58.6	97.2	115.8	-158.7	42.3	0	0	0	119
1446	A	25.3	Very low	33	Very low	106 Å²	106	113.2 Å²	113.2	88%	0.876	71%	0.707	S	S	*	*			trans	-129	111.9	160.7	0	0	0	0	0	109.8
1447	T	22.8	Very low	35	Very low	125 Å²	125	115.5 Å²	115.5	77%	0.767	71%	0.705	S	S	*	*			trans	-89.2	136.5	179.5	-46.8	0	0	0	0	110.8
1448	S	27.5	Very low	37.4	Very low	100 Å²	100	112.4 Å²	112.4	70%	0.699	68%	0.679	S	S	*	*			trans	-129.3	164.2	159.5	70	0	0	0	0	109.9
1449	P	30.2	Very low	40.4	Very low	123 Å²	123	107.2 Å²	107.2	80%	0.799	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-63.6	155.6	-167.6	-25.3	36.3	0	0	0	115	D1451	P1449-D1451 PolarHBondContact O-N 3.37Å
1450	A	28.7	Very low	43.1	Very low	102 Å²	102	99.4 Å²	99.4	84%	0.843	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-59.1	116.7	-175.5	0	0	0	0	0	112.7
1451	D	29.1	Very low	46.2	Very low	128 Å²	128	94.2 Å²	94.2	68%	0.684	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-78.5	145.2	174.9	-177.4	29.1	0	0	0	111.5	P1449 S1453	P1449-D1451 PolarHBondContact O-N 3.37Å; D1451-S1453 PolarHBondContact O-N 2.03Å; D1451-S1453 WeakPolarHBondContact OD2-CB 3.42Å; D1451-S1453 PolarHBondContact OD2-OG 3.01Å
1452	I	40.1	Very low	49	Very low	108 Å²	108	94 Å²	94	55%	0.554	59%	0.593	S	S	*	*	S	Bend	trans	-84.7	1.9	-170.3	-71.5	171.2	0	0	0	111.9	G1454	I1452-G1454 PolarHBondContact O-N 2.57Å
1453	S	42.1	Very low	52	Low	97 Å²	97	88.8 Å²	88.8	68%	0.678	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-0.4	-174.3	53.3	0	0	0	0	116.8	D1451	D1451-S1453 PolarHBondContact O-N 2.03Å; D1451-S1453 WeakPolarHBondContact OD2-CB 3.42Å; D1451-S1453 PolarHBondContact OD2-OG 3.01Å
1454	G	49.1	Very low	55.1	Low	52 Å²	52	85.9 Å²	85.9	54%	0.536	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	-17.6	-177.4	0	0	0	0	0	116.7	I1452	I1452-G1454 PolarHBondContact O-N 2.57Å
1455	V	56.3	Low	58.2	Low	46 Å²	46	85.7 Å²	85.7	28%	0.279	54%	0.535	S	S	.	.	S	Bend	trans	-96.9	118.4	178	177.8	0	0	0	0	108.1	L1457 C1459 T1460 Y1478	V1455-L1457 PolarHBondContact O-N 3.39Å; V1455-C1459 HydrophobicContact CG1-CB 3.68Å; V1455-T1460 HydrophobicContact CB-CG2 4.2Å; V1455-T1460 HydrophobicContact CG1-CG2 3.84Å; V1455-Y1478 HydrophobicContact CG1-CE1 4.23Å
1456	G	65.6	Low	61.2	Low	44 Å²	44	79.2 Å²	79.2	45%	0.454	50%	0.504	S	S	.	.			trans	-60.4	135.7	-171.7	0	0	0	0	0	112.3	K1458 C1459	G1456-K1458 PolarHBondContact O-N 2.79Å; G1456-C1459 WeakPolarHBondContact O-CB 3.04Å; G1456-C1459 PolarHBondContact O-N 3.37Å
1457	L	72.2	Confident	64	Low	140 Å²	140	82.6 Å²	82.6	73%	0.733	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-43.8	-40.6	-168.2	-68.7	169.9	0	0	0	115	V1455 C1459 T1460 E1461	V1455-L1457 PolarHBondContact O-N 3.39Å; L1457-C1459 PolarHBondContact O-N 2.81Å; L1457-T1460 PolarHBondContact O-N 2.88Å; L1457-T1460 PolarHBondContact O-OG1 2.84Å; L1457-E1461 PolarHBondContact O-N 2.81Å
1458	K	81.7	Confident	66.8	Low	62 Å²	62	78.6 Å²	78.6	27%	0.27	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-57.4	-29.7	177.7	67.5	163.2	-175.6	170.8	0	114.5	G1456 T1460 R1497 N1498 F1500 H1509	G1456-K1458 PolarHBondContact O-N 2.79Å; K1458-T1460 VanDerWaalsContact C-N 3.32Å; K1458-R1497 HydrophobicContact CB-CB 3.62Å; K1458-R1497 CarbonylContact O-C 3.6Å; K1458-N1498 WeakPolarHBondContact O-CA 3.4Å; K1458-N1498 WeakPolarHBondContact O-CB 3.37Å; K1458-N1498 PolarHBondContact O-N 3.46Å; K1458-F1500 HydrophobicContact CD-CE1 4.5Å; K1458-F1500 HydrophobicContact CD-CZ 4.2Å; K1458-F1500 VanDerWaalsContact NZ-CE1 3.32Å; K1458-H1509 PolarHBondContact NZ-CD2 2.89Å; K1458-H1509 PolarHBondContact NZ-CE1 3.34Å; K1458-H1509 VanDerWaalsContact NZ-CG 3.28Å; K1458-H1509 PolarHBondContact NZ-ND1 2.77Å; K1458-H1509 PolarHBondContact NZ-NE2 3.41Å
1459	C	91	Very high	68.9	Low	1 Å²	1	83.8 Å²	83.8	1%	0.007	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-82.5	-10.4	176.7	-55.3	0	0	0	0	112.5	V1455 G1456 L1457 Y1478 N1498 H1509 C1510	V1455-C1459 HydrophobicContact CG1-CB 3.68Å; G1456-C1459 WeakPolarHBondContact O-CB 3.04Å; G1456-C1459 PolarHBondContact O-N 3.37Å; L1457-C1459 PolarHBondContact O-N 2.81Å; C1459-Y1478 HydrophobicContact CB-CD1 4.06Å; C1459-Y1478 HydrophobicContact CB-CG 4.39Å; C1459-Y1478 WeakPolarHBondContact O-CD1 3.37Å; C1459-N1498 PolarHBondContact O-ND2 2.83Å; C1459-H1509 PolarHBondContact SG-O 3.27Å; C1459-C1510 HydrophobicContact CB-CB 3.66Å; C1459-C1510 WeakPolarHBondContact CB-SG 3.41Å; C1459-C1510 VanDerWaalsContact SG-CA 3.56Å; C1459-C1510 WeakPolarHBondContact SG-CB 3.32Å; C1459-C1510 CovalentContact SG-SG 2.03Å; C1459-C1510 PolarHBondContact SG-SG 3.42Å
1460	T	87.4	Confident	70.8	Confident	51 Å²	51	79.6 Å²	79.6	31%	0.313	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-6.1	-179.4	63.2	0	0	0	0	113.5	V1455 L1457 K1458	V1455-T1460 HydrophobicContact CB-CG2 4.2Å; V1455-T1460 HydrophobicContact CG1-CG2 3.84Å; L1457-T1460 PolarHBondContact O-N 2.88Å; L1457-T1460 PolarHBondContact O-OG1 2.84Å; K1458-T1460 VanDerWaalsContact C-N 3.32Å
1461	E	90.7	Very high	73.1	Confident	49 Å²	49	80.3 Å²	80.3	23%	0.229	47%	0.466	C	S	.	.	S	Bend	trans	-68.1	146.7	166.1	-65.4	168.9	-145	0	0	109.1	L1457 N1496 R1497 N1498	L1457-E1461 PolarHBondContact O-N 2.81Å; E1461-N1496 WeakPolarHBondContact OE2-CB 3.41Å; E1461-R1497 WeakPolarHBondContact OE1-CD 3.39Å; E1461-R1497 VanDerWaalsContact OE2-CB 3.27Å; E1461-R1497 WeakPolarHBondContact OE2-CB 3.27Å; E1461-R1497 WeakPolarHBondContact OE2-CG 3.5Å; E1461-R1497 PolarHBondContact OE2-N 2.9Å; E1461-N1498 HydrophobicContact CB-CB 4.22Å; E1461-N1498 WeakPolarHBondContact O-CB 3.17Å; E1461-N1498 PolarHBondContact O-ND2 2.93Å
1462	P	88.4	Confident	75.6	Confident	93 Å²	93	78.7 Å²	78.7	60%	0.604	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-70.1	173	-177.3	30	-36.6	0	0	0	112.5	D1464 N1496	P1462-D1464 PolarHBondContact O-N 3.1Å; P1462-N1496 PolarHBondContact O-ND2 2.7Å; P1462-N1496 PolarHBondContact O-OD1 2.86Å
1463	M	92	Very high	77.8	Confident	87 Å²	87	76.6 Å²	76.6	43%	0.429	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-60.6	128.7	165.3	-169.1	-155.1	-70.5	0	0	109.5	W1477 F1488	M1463-W1477 HydrophobicContact CB-CD2 3.63Å; M1463-W1477 HydrophobicContact CB-CE3 3.71Å; M1463-W1477 HydrophobicContact CB-CG 4.17Å; M1463-W1477 HydrophobicContact CB-CH2 4.19Å; M1463-W1477 HydrophobicContact CB-CZ2 4.1Å; M1463-W1477 HydrophobicContact CB-CZ3 4Å; M1463-W1477 HydrophobicContact CE-CD2 4.47Å; M1463-W1477 HydrophobicContact CE-CZ2 3.97Å; M1463-W1477 HydrophobicContact CG-CD2 4.04Å; M1463-W1477 HydrophobicContact CG-CG 4.08Å; M1463-W1477 VanDerWaalsContact N-CE3 3.31Å; M1463-F1488 HydrophobicContact CE-CB 3.96Å; M1463-F1488 HydrophobicContact CG-CB 3.91Å; M1463-F1488 HydrophobicContact CG-CD1 4.38Å; M1463-F1488 HydrophobicContact CG-CD2 3.95Å; M1463-F1488 HydrophobicContact CG-CG 3.84Å; M1463-F1488 HydrophobicContact SD-CB 3.66Å; M1463-F1488 HydrophobicContact SD-CD2 4.32Å; M1463-F1488 HydrophobicContact SD-CG 4.2Å
1464	D	91.6	Very high	80	Confident	51 Å²	51	75.7 Å²	75.7	27%	0.273	44%	0.44	S	S	.	.			trans	-133.6	108.5	175.3	-178.3	2.9	0	0	0	111	P1462 G1466 F1488 G1495 N1496	P1462-D1464 PolarHBondContact O-N 3.1Å; D1464-G1466 PolarHBondContact O-N 3.32Å; D1464-G1466 PolarHBondContact OD1-N 3.37Å; D1464-F1488 VanDerWaalsContact O-CE2 3.25Å; D1464-F1488 WeakPolarHBondContact O-CE2 3.27Å; D1464-G1495 WeakPolarHBondContact OD2-CA 3.35Å; D1464-N1496 HydrophobicContact CB-CB 4.12Å; D1464-N1496 VanDerWaalsContact CB-ND2 3.3Å; D1464-N1496 WeakPolarHBondContact CB-ND2 3.41Å; D1464-N1496 PolarHBondContact OD2-N 3.23Å
1465	M	88.3	Confident	82.2	Confident	86 Å²	86	74.5 Å²	74.5	42%	0.424	42%	0.419	S	S	.	.			trans	-61.4	-20.9	178.1	-177.9	162.8	-69.2	0	0	113	M1472 A1489 Y1490 S1491	M1465-M1472 HydrophobicContact CG-CE 4.09Å; M1465-M1472 HydrophobicContact CG-SD 4.19Å; M1465-M1472 HydrophobicContact SD-CE 3.63Å; M1465-M1472 HydrophobicContact SD-SD 4.24Å; M1465-A1489 WeakPolarHBondContact CG-O 3.31Å; M1465-Y1490 VanDerWaalsContact O-CD2 3.31Å; M1465-Y1490 WeakPolarHBondContact O-CD2 3.22Å; M1465-S1491 VanDerWaalsContact O-CB 3.23Å; M1465-S1491 WeakPolarHBondContact O-CB 3.23Å; M1465-S1491 PolarHBondContact O-N 3.24Å; M1465-S1491 PolarHBondContact O-OG 3.14Å
1466	G	85.9	Confident	84.1	Confident	13 Å²	13	74.7 Å²	74.7	13%	0.134	42%	0.415	C	S	.	.			trans	71.7	168.2	-166.8	0	0	0	0	0	112.7	D1464 S1491 C1493	D1464-G1466 PolarHBondContact O-N 3.32Å; D1464-G1466 PolarHBondContact OD1-N 3.37Å; G1466-S1491 WeakPolarHBondContact CA-OG 3.4Å; G1466-S1491 PolarHBondContact O-OG 3.24Å; G1466-C1493 WeakPolarHBondContact CA-O 2.88Å
1467	Q	82.9	Confident	85.5	Confident	177 Å²	177	74 Å²	74	83%	0.827	40%	0.399	S	S	*	.	S	Bend	trans	-103.8	8.7	-163.9	-60.8	172.3	10.5	0	0	113.4	C1493	Q1467-C1493 PolarHBondContact N-O 3.46Å
1468	C	81.5	Confident	86.5	Confident	41 Å²	41	67.8 Å²	67.8	28%	0.277	37%	0.366	S	S	.	.			trans	-88.1	148.5	-169	-77.2	0	0	0	0	114.1	G1470 S1491 C1493	C1468-G1470 PolarHBondContact O-N 3.01Å; C1468-S1491 WeakPolarHBondContact CB-O 3.43Å; C1468-S1491 PolarHBondContact N-OG 3.35Å; C1468-S1491 VanDerWaalsContact O-CB 3.27Å; C1468-S1491 WeakPolarHBondContact O-CB 3.35Å; C1468-C1493 HydrophobicContact CB-CB 4.17Å; C1468-C1493 WeakPolarHBondContact CB-SG 3.04Å; C1468-C1493 WeakPolarHBondContact SG-CB 3.49Å; C1468-C1493 PolarHBondContact SG-O 2.58Å; C1468-C1493 VanDerWaalsContact SG-O 3.36Å; C1468-C1493 CovalentContact SG-SG 2.03Å; C1468-C1493 PolarHBondContact SG-SG 2.84Å
1469	Q	71.8	Confident	87.1	Confident	209 Å²	209	65.7 Å²	65.7	98%	0.977	36%	0.357	S	S	*	.			trans	-94	42.6	177.6	-63.8	176.9	-2.9	0	0	111.1
1470	G	70.3	Confident	86.8	Confident	34 Å²	34	70.3 Å²	70.3	35%	0.351	38%	0.377	S	S	.	.	S	Bend	trans	-94.9	171.9	178.7	0	0	0	0	0	113.1	C1468 M1472	C1468-G1470 PolarHBondContact O-N 3.01Å; G1470-M1472 PolarHBondContact O-N 2.99Å
1471	P	76.4	Confident	86.6	Confident	117 Å²	117	76.4 Å²	76.4	76%	0.76	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-63.8	126.8	165.8	28.8	-33.1	0	0	0	109.2	V1473	P1471-V1473 PolarHBondContact O-N 3.27Å
1472	M	82.4	Confident	86.6	Confident	95 Å²	95	77.4 Å²	77.4	47%	0.468	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-63.4	131.4	179.3	-62.1	-67.8	179.4	0	0	110.9	M1465 G1470 A1489 Y1490 S1491	M1465-M1472 HydrophobicContact CG-CE 4.09Å; M1465-M1472 HydrophobicContact CG-SD 4.19Å; M1465-M1472 HydrophobicContact SD-CE 3.63Å; M1465-M1472 HydrophobicContact SD-SD 4.24Å; G1470-M1472 PolarHBondContact O-N 2.99Å; M1472-A1489 HydrophobicContact CB-CB 3.99Å; M1472-A1489 HydrophobicContact CG-CB 4.33Å; M1472-Y1490 CarbonylContact C-O 3.59Å; M1472-Y1490 WeakPolarHBondContact CA-O 3.42Å; M1472-S1491 WeakPolarHBondContact SD-CA 3.18Å
1473	V	85.1	Confident	86.5	Confident	63 Å²	63	77.2 Å²	77.2	38%	0.382	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.9	179	-177.6	0	0	0	0	108.6	P1471 R1475 Y1490	P1471-V1473 PolarHBondContact O-N 3.27Å; V1473-R1475 PolarHBondContact O-N 3.09Å; V1473-Y1490 PolarHBondContact N-O 3Å; V1473-Y1490 WeakPolarHBondContact O-CB 3.29Å; V1473-Y1490 PolarHBondContact O-N 2.87Å
1474	P	89.7	Confident	86.4	Confident	78 Å²	78	76 Å²	76	51%	0.506	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.9	175.9	27.2	-34.4	0	0	0	111	E1487	P1474-E1487 HydrophobicContact CB-CG 4.25Å; P1474-E1487 WeakPolarHBondContact CB-OE1 3.32Å
1475	R	94.4	Very high	86.6	Confident	28 Å²	28	73.9 Å²	73.9	11%	0.106	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	167.4	-175.6	-67.5	-63.4	-166.5	113.4	2.9	109.3	V1473 E1487 F1488 Y1490 H1499 F1500 Y1501	V1473-R1475 PolarHBondContact O-N 3.09Å; R1475-E1487 CarbonylContact O-C 3.09Å; R1475-E1487 VanDerWaalsContact O-CA 3.3Å; R1475-E1487 WeakPolarHBondContact O-CA 3.19Å; R1475-E1487 WeakPolarHBondContact O-CG 3.24Å; R1475-F1488 HydrophobicContact CB-CD1 4.19Å; R1475-F1488 HydrophobicContact CB-CE1 3.86Å; R1475-F1488 HydrophobicContact CB-CZ 4.18Å; R1475-F1488 PolarHBondContact N-O 3.44Å; R1475-F1488 PolarHBondContact O-N 3.34Å; R1475-Y1490 HydrophobicContact CG-CD1 4.3Å; R1475-Y1490 HydrophobicContact CG-CG 4.24Å; R1475-H1499 WeakPolarHBondContact CG-NE2 3.39Å; R1475-H1499 PolarHBondContact NH1-CE1 2.89Å; R1475-H1499 VanDerWaalsContact NH1-CE1 3.34Å; R1475-H1499 PolarHBondContact NH1-NE2 3.08Å; R1475-F1500 WeakPolarHBondContact CD-O 3.39Å; R1475-Y1501 VanDerWaalsContact CZ-CE1 3.44Å; R1475-Y1501 VanDerWaalsContact NH1-CE2 3.31Å; R1475-Y1501 VanDerWaalsContact NH1-CZ 3.28Å; R1475-Y1501 PolarHBondContact NH2-OH 3.27Å
1476	Y	95.8	Very high	86.8	Confident	49 Å²	49	72.5 Å²	72.5	19%	0.192	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146.3	179	-61.5	-89.9	0	0	0	111.9	E1486 E1487 F1500 S1502 K1503	Y1476-E1486 CarbonylContact C-O 3.49Å; Y1476-E1486 VanDerWaalsContact CA-O 3.28Å; Y1476-E1486 WeakPolarHBondContact CA-O 3.43Å; Y1476-E1487 HydrophobicContact CD1-CB 3.97Å; Y1476-E1487 HydrophobicContact CD1-CG 4.27Å; Y1476-E1487 HydrophobicContact CE1-CB 3.56Å; Y1476-E1487 HydrophobicContact CE1-CG 3.72Å; Y1476-E1487 HydrophobicContact CE2-CG 4.48Å; Y1476-E1487 VanDerWaalsContact CZ-OE2 3.29Å; Y1476-E1487 PolarHBondContact OH-OE2 3.43Å; Y1476-F1500 PolarHBondContact N-O 3.11Å; Y1476-F1500 WeakPolarHBondContact O-CD2 3.44Å; Y1476-F1500 PolarHBondContact O-N 3.32Å; Y1476-S1502 VanDerWaalsContact CD2-CA 3.48Å; Y1476-K1503 HydrophobicContact CD1-CB 3.81Å; Y1476-K1503 HydrophobicContact CD1-CG 4.19Å; Y1476-K1503 HydrophobicContact CD2-CB 4.37Å; Y1476-K1503 HydrophobicContact CE1-CB 3.77Å; Y1476-K1503 HydrophobicContact CE1-CG 4.32Å; Y1476-K1503 HydrophobicContact CE2-CB 4.3Å; Y1476-K1503 HydrophobicContact CG-CB 4.13Å
1477	W	95.2	Very high	87.1	Confident	30 Å²	30	77.3 Å²	77.3	11%	0.114	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.1	171.7	80.1	-62.6	0	0	0	109.4	M1463 N1479 C1485 E1486 F1488 N1498 C1506	M1463-W1477 HydrophobicContact CB-CD2 3.63Å; M1463-W1477 HydrophobicContact CB-CE3 3.71Å; M1463-W1477 HydrophobicContact CB-CG 4.17Å; M1463-W1477 HydrophobicContact CB-CH2 4.19Å; M1463-W1477 HydrophobicContact CB-CZ2 4.1Å; M1463-W1477 HydrophobicContact CB-CZ3 4Å; M1463-W1477 HydrophobicContact CE-CD2 4.47Å; M1463-W1477 HydrophobicContact CE-CZ2 3.97Å; M1463-W1477 HydrophobicContact CG-CD2 4.04Å; M1463-W1477 HydrophobicContact CG-CG 4.08Å; M1463-W1477 VanDerWaalsContact N-CE3 3.31Å; W1477-N1479 HydrophobicContact CH2-CB 3.68Å; W1477-N1479 HydrophobicContact CZ2-CB 3.46Å; W1477-N1479 VanDerWaalsContact CZ2-CB 3.46Å; W1477-N1479 HydrophobicContact CZ3-CB 4.28Å; W1477-C1485 CarbonylContact O-C 3.5Å; W1477-C1485 WeakPolarHBondContact O-CA 3.23Å; W1477-E1486 PolarHBondContact N-O 3.4Å; W1477-E1486 PolarHBondContact O-N 2.55Å; W1477-F1488 HydrophobicContact CB-CD1 3.77Å; W1477-F1488 HydrophobicContact CB-CE1 3.82Å; W1477-F1488 AromaticContact CD1-CD1 3.94Å; W1477-F1488 HydrophobicContact CG-CD1 4.12Å; W1477-N1498 WeakPolarHBondContact CA-O 3.48Å; W1477-N1498 WeakPolarHBondContact CB-O 3.34Å; W1477-C1506 VanDerWaalsContact C-SG 3.53Å
1478	Y	94.8	Very high	87.6	Confident	10 Å²	10	69.4 Å²	69.4	4%	0.039	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	110.7	173.3	178.6	-101.1	0	0	0	109.8	V1455 C1459 K1480 N1483 N1498 C1506 C1510 V1511	V1455-Y1478 HydrophobicContact CG1-CE1 4.23Å; C1459-Y1478 HydrophobicContact CB-CD1 4.06Å; C1459-Y1478 HydrophobicContact CB-CG 4.39Å; C1459-Y1478 WeakPolarHBondContact O-CD1 3.37Å; Y1478-K1480 HydrophobicContact CE1-CB 4.28Å; Y1478-K1480 PolarHBondContact O-N 3.42Å; Y1478-N1483 PolarHBondContact OH-OD1 3.3Å; Y1478-N1498 PolarHBondContact N-OD1 2.86Å; Y1478-N1498 PolarHBondContact O-ND2 3.5Å; Y1478-C1506 PolarHBondContact N-SG 2.92Å; Y1478-C1510 VanDerWaalsContact CB-CB 3.5Å; Y1478-C1510 HydrophobicContact CD1-CB 4Å; Y1478-C1510 HydrophobicContact CD2-CB 3.28Å; Y1478-C1510 HydrophobicContact CE2-CB 3.88Å; Y1478-C1510 HydrophobicContact CG-CB 3.32Å; Y1478-V1511 HydrophobicContact CD2-CG2 3.96Å; Y1478-V1511 HydrophobicContact CE2-CG2 3.73Å
1479	N	93.2	Very high	88	Confident	18 Å²	18	69.5 Å²	69.5	10%	0.096	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	109.2	172.4	-177.4	-14.7	0	0	0	109.1	W1477 E1481 T1482 N1483 V1484 E1486	W1477-N1479 HydrophobicContact CH2-CB 3.68Å; W1477-N1479 HydrophobicContact CZ2-CB 3.46Å; W1477-N1479 VanDerWaalsContact CZ2-CB 3.46Å; W1477-N1479 HydrophobicContact CZ3-CB 4.28Å; N1479-E1481 PolarHBondContact O-N 2.9Å; N1479-E1481 WeakPolarHBondContact OD1-CB 3.45Å; N1479-E1481 PolarHBondContact OD1-N 2.97Å; N1479-T1482 VanDerWaalsContact CB-OG1 3.3Å; N1479-T1482 WeakPolarHBondContact CB-OG1 3.46Å; N1479-T1482 VanDerWaalsContact CG-OG1 3.32Å; N1479-T1482 PolarHBondContact O-N 2.83Å; N1479-T1482 PolarHBondContact OD1-N 3.45Å; N1479-N1483 WeakPolarHBondContact O-CA 3.48Å; N1479-N1483 PolarHBondContact O-N 3.38Å; N1479-V1484 PolarHBondContact N-O 2.92Å; N1479-V1484 PolarHBondContact O-N 3.1Å; N1479-E1486 VanDerWaalsContact CB-CD 3.48Å; N1479-E1486 HydrophobicContact CB-CG 4.34Å; N1479-E1486 WeakPolarHBondContact CB-OE1 3.48Å; N1479-E1486 WeakPolarHBondContact CB-OE2 3.37Å; N1479-E1486 VanDerWaalsContact ND2-CD 3.29Å; N1479-E1486 PolarHBondContact ND2-OE1 3.22Å; N1479-E1486 PolarHBondContact ND2-OE2 3.3Å
1480	K	84.5	Confident	89	Confident	98 Å²	98	60.6 Å²	60.6	43%	0.426	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.4	-179.8	-173.6	-176.2	173.3	-171	0	113.3	Y1478 N1483	Y1478-K1480 HydrophobicContact CE1-CB 4.28Å; Y1478-K1480 PolarHBondContact O-N 3.42Å; K1480-N1483 PolarHBondContact O-ND2 3.4Å
1481	E	83.4	Confident	89.6	Confident	179 Å²	179	59.1 Å²	59.1	84%	0.836	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-43.5	-179.2	-57.4	-174.1	169.1	0	0	111.3	N1479	N1479-E1481 PolarHBondContact O-N 2.9Å; N1479-E1481 WeakPolarHBondContact OD1-CB 3.45Å; N1479-E1481 PolarHBondContact OD1-N 2.97Å
1482	T	91	Very high	89.8	Confident	69 Å²	69	55.5 Å²	55.5	42%	0.423	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-19.5	175.5	61.1	0	0	0	0	113	N1479 V1484 E1486	N1479-T1482 VanDerWaalsContact CB-OG1 3.3Å; N1479-T1482 WeakPolarHBondContact CB-OG1 3.46Å; N1479-T1482 VanDerWaalsContact CG-OG1 3.32Å; N1479-T1482 PolarHBondContact O-N 2.83Å; N1479-T1482 PolarHBondContact OD1-N 3.45Å; T1482-V1484 PolarHBondContact O-N 3.38Å; T1482-V1484 PolarHBondContact OG1-N 3.17Å; T1482-E1486 WeakPolarHBondContact CB-OE1 3.21Å; T1482-E1486 WeakPolarHBondContact CG2-OE1 3.45Å; T1482-E1486 PolarHBondContact OG1-OE1 3.22Å
1483	N	86.9	Confident	89.7	Confident	89 Å²	89	54 Å²	54	48%	0.476	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	26.3	-167.7	-59.3	-91.7	0	0	0	113.2	Y1478 N1479 K1480	Y1478-N1483 PolarHBondContact OH-OD1 3.3Å; N1479-N1483 WeakPolarHBondContact O-CA 3.48Å; N1479-N1483 PolarHBondContact O-N 3.38Å; K1480-N1483 PolarHBondContact O-ND2 3.4Å
1484	V	89.9	Confident	89.5	Confident	63 Å²	63	53.2 Å²	53.2	38%	0.382	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147.3	-178.6	177.1	0	0	0	0	110.4	N1479 T1482 E1486	N1479-V1484 PolarHBondContact N-O 2.92Å; N1479-V1484 PolarHBondContact O-N 3.1Å; T1482-V1484 PolarHBondContact O-N 3.38Å; T1482-V1484 PolarHBondContact OG1-N 3.17Å; V1484-E1486 HydrophobicContact CG1-CG 4.35Å
1485	C	95.3	Very high	89.2	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.034	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	111.6	168.8	-76.1	0	0	0	0	111	W1477 K1503 C1506 E1507	W1477-C1485 CarbonylContact O-C 3.5Å; W1477-C1485 WeakPolarHBondContact O-CA 3.23Å; C1485-K1503 HydrophobicContact CB-CG 4.29Å; C1485-C1506 HydrophobicContact CB-CB 3.61Å; C1485-C1506 WeakPolarHBondContact CB-SG 3.23Å; C1485-C1506 WeakPolarHBondContact SG-CB 3.05Å; C1485-C1506 CovalentContact SG-SG 2.03Å; C1485-C1506 PolarHBondContact SG-SG 2.76Å; C1485-E1507 HydrophobicContact CB-CG 3.75Å; C1485-E1507 PolarHBondContact SG-N 2.89Å
1486	E	92.7	Very high	89	Confident	57 Å²	57	51.1 Å²	51.1	27%	0.266	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	150.2	-172.9	-71.6	166.2	-163.4	0	0	110.5	Y1476 W1477 N1479 T1482 V1484	Y1476-E1486 CarbonylContact C-O 3.49Å; Y1476-E1486 VanDerWaalsContact CA-O 3.28Å; Y1476-E1486 WeakPolarHBondContact CA-O 3.43Å; W1477-E1486 PolarHBondContact N-O 3.4Å; W1477-E1486 PolarHBondContact O-N 2.55Å; N1479-E1486 VanDerWaalsContact CB-CD 3.48Å; N1479-E1486 HydrophobicContact CB-CG 4.34Å; N1479-E1486 WeakPolarHBondContact CB-OE1 3.48Å; N1479-E1486 WeakPolarHBondContact CB-OE2 3.37Å; N1479-E1486 VanDerWaalsContact ND2-CD 3.29Å; N1479-E1486 PolarHBondContact ND2-OE1 3.22Å; N1479-E1486 PolarHBondContact ND2-OE2 3.3Å; T1482-E1486 WeakPolarHBondContact CB-OE1 3.21Å; T1482-E1486 WeakPolarHBondContact CG2-OE1 3.45Å; T1482-E1486 PolarHBondContact OG1-OE1 3.22Å; V1484-E1486 HydrophobicContact CG1-CG 4.35Å
1487	E	92.6	Very high	88.7	Confident	114 Å²	114	57.2 Å²	57.2	53%	0.533	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135.4	178.3	-160.2	174.3	128.7	0	0	110.8	P1474 R1475 Y1476	P1474-E1487 HydrophobicContact CB-CG 4.25Å; P1474-E1487 WeakPolarHBondContact CB-OE1 3.32Å; R1475-E1487 CarbonylContact O-C 3.09Å; R1475-E1487 VanDerWaalsContact O-CA 3.3Å; R1475-E1487 WeakPolarHBondContact O-CA 3.19Å; R1475-E1487 WeakPolarHBondContact O-CG 3.24Å; Y1476-E1487 HydrophobicContact CD1-CB 3.97Å; Y1476-E1487 HydrophobicContact CD1-CG 4.27Å; Y1476-E1487 HydrophobicContact CE1-CB 3.56Å; Y1476-E1487 HydrophobicContact CE1-CG 3.72Å; Y1476-E1487 HydrophobicContact CE2-CG 4.48Å; Y1476-E1487 VanDerWaalsContact CZ-OE2 3.29Å; Y1476-E1487 PolarHBondContact OH-OE2 3.43Å
1488	F	93.6	Very high	88.6	Confident	11 Å²	11	55.8 Å²	55.8	5%	0.048	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	153.9	172.5	83.4	-82.8	0	0	0	111.9	M1463 D1464 R1475 W1477 Y1490 H1499	M1463-F1488 HydrophobicContact CE-CB 3.96Å; M1463-F1488 HydrophobicContact CG-CB 3.91Å; M1463-F1488 HydrophobicContact CG-CD1 4.38Å; M1463-F1488 HydrophobicContact CG-CD2 3.95Å; M1463-F1488 HydrophobicContact CG-CG 3.84Å; M1463-F1488 HydrophobicContact SD-CB 3.66Å; M1463-F1488 HydrophobicContact SD-CD2 4.32Å; M1463-F1488 HydrophobicContact SD-CG 4.2Å; D1464-F1488 VanDerWaalsContact O-CE2 3.25Å; D1464-F1488 WeakPolarHBondContact O-CE2 3.27Å; R1475-F1488 HydrophobicContact CB-CD1 4.19Å; R1475-F1488 HydrophobicContact CB-CE1 3.86Å; R1475-F1488 HydrophobicContact CB-CZ 4.18Å; R1475-F1488 PolarHBondContact N-O 3.44Å; R1475-F1488 PolarHBondContact O-N 3.34Å; W1477-F1488 HydrophobicContact CB-CD1 3.77Å; W1477-F1488 HydrophobicContact CB-CE1 3.82Å; W1477-F1488 AromaticContact CD1-CD1 3.94Å; W1477-F1488 HydrophobicContact CG-CD1 4.12Å; F1488-Y1490 HydrophobicContact CE2-CD2 4.1Å; F1488-Y1490 HydrophobicContact CE2-CG 4.44Å; F1488-Y1490 HydrophobicContact CZ-CD2 4.44Å; F1488-Y1490 PolarHBondContact O-N 3.21Å; F1488-H1499 HydrophobicContact CZ-CB 4.39Å; F1488-H1499 AromaticContact CZ-CD2 3.61Å
1489	A	89.9	Confident	88.6	Confident	43 Å²	43	57.2 Å²	57.2	36%	0.355	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	100.9	-176	0	0	0	0	0	109.9	M1465 M1472	M1465-A1489 WeakPolarHBondContact CG-O 3.31Å; M1472-A1489 HydrophobicContact CB-CB 3.99Å; M1472-A1489 HydrophobicContact CG-CB 4.33Å
1490	Y	91.5	Very high	88.7	Confident	22 Å²	22	56.5 Å²	56.5	9%	0.086	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.4	-175.8	176.8	-117.7	0	0	0	112.5	M1465 M1472 V1473 R1475 F1488 G1492 C1493 G1494 H1499	M1465-Y1490 VanDerWaalsContact O-CD2 3.31Å; M1465-Y1490 WeakPolarHBondContact O-CD2 3.22Å; M1472-Y1490 CarbonylContact C-O 3.59Å; M1472-Y1490 WeakPolarHBondContact CA-O 3.42Å; V1473-Y1490 PolarHBondContact N-O 3Å; V1473-Y1490 WeakPolarHBondContact O-CB 3.29Å; V1473-Y1490 PolarHBondContact O-N 2.87Å; R1475-Y1490 HydrophobicContact CG-CD1 4.3Å; R1475-Y1490 HydrophobicContact CG-CG 4.24Å; F1488-Y1490 HydrophobicContact CE2-CD2 4.1Å; F1488-Y1490 HydrophobicContact CE2-CG 4.44Å; F1488-Y1490 HydrophobicContact CZ-CD2 4.44Å; F1488-Y1490 PolarHBondContact O-N 3.21Å; Y1490-G1492 VanDerWaalsContact CE1-CA 3.43Å; Y1490-G1492 WeakPolarHBondContact CE1-O 3.5Å; Y1490-G1492 PolarHBondContact O-N 3.39Å; Y1490-C1493 WeakPolarHBondContact OH-CA 3.36Å; Y1490-C1493 PolarHBondContact OH-N 2.83Å; Y1490-G1494 PolarHBondContact OH-N 3.3Å; Y1490-H1499 AromaticContact CD1-CE1 3.64Å; Y1490-H1499 AromaticContact CD1-NE2 3.42Å; Y1490-H1499 WeakPolarHBondContact CD1-NE2 3.42Å; Y1490-H1499 AromaticContact CD2-NE2 3.92Å; Y1490-H1499 AromaticContact CE1-CE1 3.39Å; Y1490-H1499 WeakPolarHBondContact CE1-CE1 3.38Å; Y1490-H1499 AromaticContact CE1-NE2 3.7Å; Y1490-H1499 AromaticContact CE2-CE1 3.87Å; Y1490-H1499 AromaticContact CG-CE1 3.96Å; Y1490-H1499 AromaticContact CG-NE2 3.52Å; Y1490-H1499 AromaticContact CZ-CE1 3.5Å; Y1490-H1499 VanDerWaalsContact CZ-CE1 3.5Å
1491	S	82.8	Confident	89.1	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.021	32%	0.323	C	S	.	.			trans	-66.1	-4.1	-176.7	63.3	0	0	0	0	116.5	M1465 G1466 C1468 M1472 C1493	M1465-S1491 VanDerWaalsContact O-CB 3.23Å; M1465-S1491 WeakPolarHBondContact O-CB 3.23Å; M1465-S1491 PolarHBondContact O-N 3.24Å; M1465-S1491 PolarHBondContact O-OG 3.14Å; G1466-S1491 WeakPolarHBondContact CA-OG 3.4Å; G1466-S1491 PolarHBondContact O-OG 3.24Å; C1468-S1491 WeakPolarHBondContact CB-O 3.43Å; C1468-S1491 PolarHBondContact N-OG 3.35Å; C1468-S1491 VanDerWaalsContact O-CB 3.27Å; C1468-S1491 WeakPolarHBondContact O-CB 3.35Å; M1472-S1491 WeakPolarHBondContact SD-CA 3.18Å; S1491-C1493 PolarHBondContact OG-O 2.61Å
1492	G	80.4	Confident	89.4	Confident	41 Å²	41	53.2 Å²	53.2	42%	0.423	30%	0.296	S	S	.	.	S	Bend	trans	97.1	-26.4	-179.8	0	0	0	0	0	114.3	Y1490	Y1490-G1492 VanDerWaalsContact CE1-CA 3.43Å; Y1490-G1492 WeakPolarHBondContact CE1-O 3.5Å; Y1490-G1492 PolarHBondContact O-N 3.39Å
1493	C	81.7	Confident	89.3	Confident	63 Å²	63	53.7 Å²	53.7	43%	0.426	29%	0.293	S	S	.	.	S	Bend	trans	-151.9	150.6	175.5	35	0	0	0	0	114.4	G1466 Q1467 C1468 Y1490 S1491	G1466-C1493 WeakPolarHBondContact CA-O 2.88Å; Q1467-C1493 PolarHBondContact N-O 3.46Å; C1468-C1493 HydrophobicContact CB-CB 4.17Å; C1468-C1493 WeakPolarHBondContact CB-SG 3.04Å; C1468-C1493 WeakPolarHBondContact SG-CB 3.49Å; C1468-C1493 PolarHBondContact SG-O 2.58Å; C1468-C1493 VanDerWaalsContact SG-O 3.36Å; C1468-C1493 CovalentContact SG-SG 2.03Å; C1468-C1493 PolarHBondContact SG-SG 2.84Å; Y1490-C1493 WeakPolarHBondContact OH-CA 3.36Å; Y1490-C1493 PolarHBondContact OH-N 2.83Å; S1491-C1493 PolarHBondContact OG-O 2.61Å
1494	G	80.1	Confident	89.2	Confident	48 Å²	48	55.4 Å²	55.4	50%	0.495	30%	0.298	S	S	.	.	S	Bend	trans	89	15.6	170.4	0	0	0	0	0	116.6	Y1490	Y1490-G1494 PolarHBondContact OH-N 3.3Å
1495	G	83.4	Confident	89.1	Confident	26 Å²	26	56 Å²	56	27%	0.268	30%	0.296	S	S	.	.			trans	-90	168.2	173.8	0	0	0	0	0	114	D1464	D1464-G1495 WeakPolarHBondContact OD2-CA 3.35Å
1496	N	90.4	Very high	89	Confident	35 Å²	35	55.7 Å²	55.7	19%	0.187	30%	0.295	C	S	.	.			trans	-82.9	-166.3	-179.6	78.5	32.9	0	0	0	113.9	E1461 P1462 D1464 N1498 H1499	E1461-N1496 WeakPolarHBondContact OE2-CB 3.41Å; P1462-N1496 PolarHBondContact O-ND2 2.7Å; P1462-N1496 PolarHBondContact O-OD1 2.86Å; D1464-N1496 HydrophobicContact CB-CB 4.12Å; D1464-N1496 VanDerWaalsContact CB-ND2 3.3Å; D1464-N1496 WeakPolarHBondContact CB-ND2 3.41Å; D1464-N1496 PolarHBondContact OD2-N 3.23Å; N1496-N1498 PolarHBondContact OD1-N 2.81Å; N1496-H1499 WeakPolarHBondContact O-CB 3.42Å
1497	R	88.9	Confident	88.8	Confident	177 Å²	177	55.9 Å²	55.9	67%	0.668	30%	0.296	S	S	*	.	S	Bend	trans	-88.9	-6.6	-173.4	-54.9	177	170.6	149.7	-5.8	115.2	K1458 E1461 H1499	K1458-R1497 HydrophobicContact CB-CB 3.62Å; K1458-R1497 CarbonylContact O-C 3.6Å; E1461-R1497 WeakPolarHBondContact OE1-CD 3.39Å; E1461-R1497 VanDerWaalsContact OE2-CB 3.27Å; E1461-R1497 WeakPolarHBondContact OE2-CB 3.27Å; E1461-R1497 WeakPolarHBondContact OE2-CG 3.5Å; E1461-R1497 PolarHBondContact OE2-N 2.9Å; R1497-H1499 PolarHBondContact O-N 3.18Å
1498	N	94.1	Very high	88.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.297	C	S	.	.	S	Bend	trans	-80.8	58.1	173.7	-158.3	-5.2	0	0	0	110.4	K1458 C1459 E1461 W1477 Y1478 N1496	K1458-N1498 WeakPolarHBondContact O-CA 3.4Å; K1458-N1498 WeakPolarHBondContact O-CB 3.37Å; K1458-N1498 PolarHBondContact O-N 3.46Å; C1459-N1498 PolarHBondContact O-ND2 2.83Å; E1461-N1498 HydrophobicContact CB-CB 4.22Å; E1461-N1498 WeakPolarHBondContact O-CB 3.17Å; E1461-N1498 PolarHBondContact O-ND2 2.93Å; W1477-N1498 WeakPolarHBondContact CA-O 3.48Å; W1477-N1498 WeakPolarHBondContact CB-O 3.34Å; Y1478-N1498 PolarHBondContact N-OD1 2.86Å; Y1478-N1498 PolarHBondContact O-ND2 3.5Å; N1496-N1498 PolarHBondContact OD1-N 2.81Å
1499	H	94.1	Very high	87.9	Confident	40 Å²	40	56 Å²	56	19%	0.185	31%	0.308	C	S	.	.			trans	-149	107.5	-159	175.5	-144.1	0	0	0	110.5	R1475 F1488 Y1490 N1496 R1497	R1475-H1499 WeakPolarHBondContact CG-NE2 3.39Å; R1475-H1499 PolarHBondContact NH1-CE1 2.89Å; R1475-H1499 VanDerWaalsContact NH1-CE1 3.34Å; R1475-H1499 PolarHBondContact NH1-NE2 3.08Å; F1488-H1499 HydrophobicContact CZ-CB 4.39Å; F1488-H1499 AromaticContact CZ-CD2 3.61Å; Y1490-H1499 AromaticContact CD1-CE1 3.64Å; Y1490-H1499 AromaticContact CD1-NE2 3.42Å; Y1490-H1499 WeakPolarHBondContact CD1-NE2 3.42Å; Y1490-H1499 AromaticContact CD2-NE2 3.92Å; Y1490-H1499 AromaticContact CE1-CE1 3.39Å; Y1490-H1499 WeakPolarHBondContact CE1-CE1 3.38Å; Y1490-H1499 AromaticContact CE1-NE2 3.7Å; Y1490-H1499 AromaticContact CE2-CE1 3.87Å; Y1490-H1499 AromaticContact CG-CE1 3.96Å; Y1490-H1499 AromaticContact CG-NE2 3.52Å; Y1490-H1499 AromaticContact CZ-CE1 3.5Å; Y1490-H1499 VanDerWaalsContact CZ-CE1 3.5Å; N1496-H1499 WeakPolarHBondContact O-CB 3.42Å; R1497-H1499 PolarHBondContact O-N 3.18Å
1500	F	94.5	Very high	87.8	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.009	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-123.7	152.5	-170.3	-60.5	-88.6	0	0	0	111.2	K1458 R1475 Y1476 E1505 C1506 H1509 C1510	K1458-F1500 HydrophobicContact CD-CE1 4.5Å; K1458-F1500 HydrophobicContact CD-CZ 4.2Å; K1458-F1500 VanDerWaalsContact NZ-CE1 3.32Å; R1475-F1500 WeakPolarHBondContact CD-O 3.39Å; Y1476-F1500 PolarHBondContact N-O 3.11Å; Y1476-F1500 WeakPolarHBondContact O-CD2 3.44Å; Y1476-F1500 PolarHBondContact O-N 3.32Å; F1500-E1505 HydrophobicContact CB-CB 4.42Å; F1500-E1505 HydrophobicContact CD1-CB 4.4Å; F1500-E1505 HydrophobicContact CD1-CG 3.98Å; F1500-C1506 HydrophobicContact CB-CB 3.79Å; F1500-C1506 HydrophobicContact CD1-CB 4.22Å; F1500-C1506 HydrophobicContact CD2-CB 3.57Å; F1500-C1506 HydrophobicContact CE2-CB 4.19Å; F1500-C1506 HydrophobicContact CG-CB 3.59Å; F1500-H1509 HydrophobicContact CE1-CB 3.54Å; F1500-H1509 AromaticContact CE1-CD2 3.75Å; F1500-H1509 AromaticContact CE1-CG 3.86Å; F1500-H1509 HydrophobicContact CZ-CB 3.92Å; F1500-C1510 WeakPolarHBondContact CZ-SG 3.42Å
1501	Y	93.4	Very high	87.5	Confident	169 Å²	169	55 Å²	55	66%	0.663	30%	0.299	S	S	*	.	S	Bend	trans	-83.3	-24.7	-178.2	-78.4	-96.4	0	0	0	113.5	R1475 E1505	R1475-Y1501 VanDerWaalsContact CZ-CE1 3.44Å; R1475-Y1501 VanDerWaalsContact NH1-CE2 3.31Å; R1475-Y1501 VanDerWaalsContact NH1-CZ 3.28Å; R1475-Y1501 PolarHBondContact NH2-OH 3.27Å; Y1501-E1505 PolarHBondContact N-OE2 3.45Å
1502	S	89.4	Confident	87	Confident	39 Å²	39	64.3 Å²	64.3	27%	0.273	33%	0.334	S	S	.	.	S	Bend	trans	-141.9	164.6	174.1	89	0	0	0	0	111.2	Y1476 E1504 E1505 C1506	Y1476-S1502 VanDerWaalsContact CD2-CA 3.48Å; S1502-E1504 VanDerWaalsContact C-N 3.32Å; S1502-E1504 WeakPolarHBondContact CB-OE2 3.37Å; S1502-E1504 PolarHBondContact OG-N 3.03Å; S1502-E1504 PolarHBondContact OG-OE2 2.97Å; S1502-E1505 PolarHBondContact O-N 3.17Å; S1502-E1505 PolarHBondContact OG-N 3.36Å; S1502-C1506 PolarHBondContact O-N 2.85Å
1503	K	90.2	Very high	85.2	Confident	79 Å²	79	69.2 Å²	69.2	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-43.8	178.8	-174.4	179.8	160.1	-179.5	0	110.5	Y1476 C1485 E1505 C1506 E1507	Y1476-K1503 HydrophobicContact CD1-CB 3.81Å; Y1476-K1503 HydrophobicContact CD1-CG 4.19Å; Y1476-K1503 HydrophobicContact CD2-CB 4.37Å; Y1476-K1503 HydrophobicContact CE1-CB 3.77Å; Y1476-K1503 HydrophobicContact CE1-CG 4.32Å; Y1476-K1503 HydrophobicContact CE2-CB 4.3Å; Y1476-K1503 HydrophobicContact CG-CB 4.13Å; C1485-K1503 HydrophobicContact CB-CG 4.29Å; K1503-E1505 VanDerWaalsContact C-N 3.31Å; K1503-E1505 PolarHBondContact O-N 2.98Å; K1503-C1506 WeakPolarHBondContact O-CB 3.27Å; K1503-C1506 PolarHBondContact O-N 3.36Å; K1503-C1506 VanDerWaalsContact O-N 3.14Å; K1503-E1507 WeakPolarHBondContact CE-OE1 3.42Å; K1503-E1507 VanDerWaalsContact CE-OE2 3.31Å; K1503-E1507 WeakPolarHBondContact CE-OE2 3.48Å; K1503-E1507 HydrophobicContact CG-CG 4.29Å; K1503-E1507 IonicContact NZ-OE1 3.25Å; K1503-E1507 PolarHBondContact NZ-OE1 2.03Å; K1503-E1507 WeakPolarHBondContact O-CG 3.31Å; K1503-E1507 PolarHBondContact O-N 3.19Å
1504	E	84	Confident	83.3	Confident	125 Å²	125	73.8 Å²	73.8	58%	0.584	37%	0.37	S	S	*	.	H	α-helix	trans	-66	-32	-179.5	-47.8	76.6	-170.7	0	0	112.1	S1502 A1508	S1502-E1504 VanDerWaalsContact C-N 3.32Å; S1502-E1504 WeakPolarHBondContact CB-OE2 3.37Å; S1502-E1504 PolarHBondContact OG-N 3.03Å; S1502-E1504 PolarHBondContact OG-OE2 2.97Å; E1504-A1508 WeakPolarHBondContact O-CB 3.11Å; E1504-A1508 PolarHBondContact O-N 3.47Å
1505	E	88.2	Confident	80.9	Confident	75 Å²	75	79.8 Å²	79.8	35%	0.35	39%	0.385	S	S	.	.	H	α-helix	trans	-67.5	-39.9	173.3	-166.6	-165.3	-169.4	0	0	111.5	F1500 Y1501 S1502 K1503 H1509	F1500-E1505 HydrophobicContact CB-CB 4.42Å; F1500-E1505 HydrophobicContact CD1-CB 4.4Å; F1500-E1505 HydrophobicContact CD1-CG 3.98Å; Y1501-E1505 PolarHBondContact N-OE2 3.45Å; S1502-E1505 PolarHBondContact O-N 3.17Å; S1502-E1505 PolarHBondContact OG-N 3.36Å; K1503-E1505 VanDerWaalsContact C-N 3.31Å; K1503-E1505 PolarHBondContact O-N 2.98Å; E1505-H1509 WeakPolarHBondContact O-CB 3.18Å; E1505-H1509 PolarHBondContact O-CD2 2.88Å; E1505-H1509 PolarHBondContact O-N 3.32Å
1506	C	94.1	Very high	78.6	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-67.1	-48.8	174	177.6	0	0	0	0	111.1	W1477 Y1478 C1485 F1500 S1502 K1503 H1509 C1510	W1477-C1506 VanDerWaalsContact C-SG 3.53Å; Y1478-C1506 PolarHBondContact N-SG 2.92Å; C1485-C1506 HydrophobicContact CB-CB 3.61Å; C1485-C1506 WeakPolarHBondContact CB-SG 3.23Å; C1485-C1506 WeakPolarHBondContact SG-CB 3.05Å; C1485-C1506 CovalentContact SG-SG 2.03Å; C1485-C1506 PolarHBondContact SG-SG 2.76Å; F1500-C1506 HydrophobicContact CB-CB 3.79Å; F1500-C1506 HydrophobicContact CD1-CB 4.22Å; F1500-C1506 HydrophobicContact CD2-CB 3.57Å; F1500-C1506 HydrophobicContact CE2-CB 4.19Å; F1500-C1506 HydrophobicContact CG-CB 3.59Å; S1502-C1506 PolarHBondContact O-N 2.85Å; K1503-C1506 WeakPolarHBondContact O-CB 3.27Å; K1503-C1506 PolarHBondContact O-N 3.36Å; K1503-C1506 VanDerWaalsContact O-N 3.14Å; C1506-H1509 PolarHBondContact O-N 2.8Å; C1506-H1509 VanDerWaalsContact O-N 3.08Å; C1506-C1510 WeakPolarHBondContact O-CB 3.45Å; C1506-C1510 PolarHBondContact O-N 2.82Å
1507	E	88	Confident	75.8	Confident	61 Å²	61	87.3 Å²	87.3	29%	0.285	43%	0.433	S	S	.	.	H	α-helix	trans	-59.9	-52.6	-178.9	-70.6	-179.2	140.6	0	0	109.6	C1485 K1503 H1509 C1510 V1511	C1485-E1507 HydrophobicContact CB-CG 3.75Å; C1485-E1507 PolarHBondContact SG-N 2.89Å; K1503-E1507 WeakPolarHBondContact CE-OE1 3.42Å; K1503-E1507 VanDerWaalsContact CE-OE2 3.31Å; K1503-E1507 WeakPolarHBondContact CE-OE2 3.48Å; K1503-E1507 HydrophobicContact CG-CG 4.29Å; K1503-E1507 IonicContact NZ-OE1 3.25Å; K1503-E1507 PolarHBondContact NZ-OE1 2.03Å; K1503-E1507 WeakPolarHBondContact O-CG 3.31Å; K1503-E1507 PolarHBondContact O-N 3.19Å; E1507-H1509 PolarHBondContact O-N 3.36Å; E1507-C1510 PolarHBondContact O-N 2.77Å; E1507-V1511 HydrophobicContact CB-CB 4.14Å; E1507-V1511 HydrophobicContact CB-CG2 4.25Å; E1507-V1511 HydrophobicContact CG-CB 4.33Å; E1507-V1511 HydrophobicContact CG-CG2 3.94Å; E1507-V1511 CarbonylContact O-C 3.56Å; E1507-V1511 WeakPolarHBondContact O-CA 3.49Å; E1507-V1511 PolarHBondContact O-N 3.22Å
1508	A	81.8	Confident	72.8	Confident	69 Å²	69	89.6 Å²	89.6	57%	0.57	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-11.1	177.7	0	0	0	0	0	115.3	E1504	E1504-A1508 WeakPolarHBondContact O-CB 3.11Å; E1504-A1508 PolarHBondContact O-N 3.47Å
1509	H	85.2	Confident	69.8	Low	58 Å²	58	98 Å²	98	27%	0.269	48%	0.48	S	S	.	.	H	α-helix	trans	-104.6	-25.4	175.4	-97.2	-59.3	0	0	0	115	S171 K1458 C1459 F1500 E1505 C1506 E1507	S171-H1509 PolarHBondContact OG-CE1 2.74Å; S171-H1509 VanDerWaalsContact OG-CE1 3.3Å; S171-H1509 PolarHBondContact OG-NE2 3.28Å; K1458-H1509 PolarHBondContact NZ-CD2 2.89Å; K1458-H1509 PolarHBondContact NZ-CE1 3.34Å; K1458-H1509 VanDerWaalsContact NZ-CG 3.28Å; K1458-H1509 PolarHBondContact NZ-ND1 2.77Å; K1458-H1509 PolarHBondContact NZ-NE2 3.41Å; C1459-H1509 PolarHBondContact SG-O 3.27Å; F1500-H1509 HydrophobicContact CE1-CB 3.54Å; F1500-H1509 AromaticContact CE1-CD2 3.75Å; F1500-H1509 AromaticContact CE1-CG 3.86Å; F1500-H1509 HydrophobicContact CZ-CB 3.92Å; E1505-H1509 WeakPolarHBondContact O-CB 3.18Å; E1505-H1509 PolarHBondContact O-CD2 2.88Å; E1505-H1509 PolarHBondContact O-N 3.32Å; C1506-H1509 PolarHBondContact O-N 2.8Å; C1506-H1509 VanDerWaalsContact O-N 3.08Å; E1507-H1509 PolarHBondContact O-N 3.36Å
1510	C	88.6	Confident	66.6	Low	5 Å²	5	101.1 Å²	101.1	3%	0.034	50%	0.504	C	S	.	.	H	α-helix	trans	-132.4	-38.5	-167.6	-52.8	0	0	0	0	113.5	C1459 Y1478 F1500 C1506 E1507 R1512	C1459-C1510 HydrophobicContact CB-CB 3.66Å; C1459-C1510 WeakPolarHBondContact CB-SG 3.41Å; C1459-C1510 VanDerWaalsContact SG-CA 3.56Å; C1459-C1510 WeakPolarHBondContact SG-CB 3.32Å; C1459-C1510 CovalentContact SG-SG 2.03Å; C1459-C1510 PolarHBondContact SG-SG 3.42Å; Y1478-C1510 VanDerWaalsContact CB-CB 3.5Å; Y1478-C1510 HydrophobicContact CD1-CB 4Å; Y1478-C1510 HydrophobicContact CD2-CB 3.28Å; Y1478-C1510 HydrophobicContact CE2-CB 3.88Å; Y1478-C1510 HydrophobicContact CG-CB 3.32Å; F1500-C1510 WeakPolarHBondContact CZ-SG 3.42Å; C1506-C1510 WeakPolarHBondContact O-CB 3.45Å; C1506-C1510 PolarHBondContact O-N 2.82Å; E1507-C1510 PolarHBondContact O-N 2.77Å; C1510-R1512 PolarHBondContact O-N 2.87Å
1511	V	84.4	Confident	63.5	Low	38 Å²	38	109.8 Å²	109.8	23%	0.23	54%	0.544	C	S	.	.			trans	-80.5	110.5	172.1	179.8	0	0	0	0	108.1	Y1478 E1507	Y1478-V1511 HydrophobicContact CD2-CG2 3.96Å; Y1478-V1511 HydrophobicContact CE2-CG2 3.73Å; E1507-V1511 HydrophobicContact CB-CB 4.14Å; E1507-V1511 HydrophobicContact CB-CG2 4.25Å; E1507-V1511 HydrophobicContact CG-CB 4.33Å; E1507-V1511 HydrophobicContact CG-CG2 3.94Å; E1507-V1511 CarbonylContact O-C 3.56Å; E1507-V1511 WeakPolarHBondContact O-CA 3.49Å; E1507-V1511 PolarHBondContact O-N 3.22Å
1512	R	72.8	Confident	60.6	Low	199 Å²	199	107 Å²	107	75%	0.751	55%	0.546	S	S	*	.			trans	-93.6	115.3	172.5	-68.1	-169.8	63	155.1	-0.4	109.5	C1510 I1514	C1510-R1512 PolarHBondContact O-N 2.87Å; R1512-I1514 PolarHBondContact O-N 3.2Å
1513	D	41.9	Very low	57.6	Low	145 Å²	145	111.2 Å²	111.2	78%	0.775	57%	0.573	S	S	*	*			trans	-57.7	109.1	172.5	-56.7	-54.5	0	0	0	110.4
1514	I	40.8	Very low	54.4	Low	159 Å²	159	112.1 Å²	112.1	82%	0.815	60%	0.595	S	S	*	*			trans	-99.5	73.2	164.6	-53.9	178.3	0	0	0	106.5	R1512 P1516	R1512-I1514 PolarHBondContact O-N 3.2Å; I1514-P1516 WeakPolarHBondContact O-CD 3.4Å
1515	E	30.2	Very low	51.6	Low	174 Å²	174	114 Å²	114	81%	0.813	61%	0.609	S	S	*	*			trans	-66.8	124.5	168.5	-75.1	-163.7	133.1	0	0	109.4	S1517	E1515-S1517 PolarHBondContact O-N 3.18Å
1516	P	36.1	Very low	48.8	Very low	120 Å²	120	116 Å²	116	78%	0.779	63%	0.628	S	S	*	*			trans	-63.8	133.6	174.8	-21.5	33.9	0	0	0	110.9	I1514 Y1518	I1514-P1516 WeakPolarHBondContact O-CD 3.4Å; P1516-Y1518 PolarHBondContact O-N 2.88Å
1517	S	30.8	Very low	45.5	Very low	98 Å²	98	120.5 Å²	120.5	69%	0.685	67%	0.665	S	S	*	*			trans	-65.9	107.8	177.3	58	0	0	0	0	111	E1515 F1519	E1515-S1517 PolarHBondContact O-N 3.18Å; S1517-F1519 PolarHBondContact O-N 2.88Å
1518	Y	26.4	Very low	42.7	Very low	226 Å²	226	123.5 Å²	123.5	89%	0.886	69%	0.688	S	S	*	*			trans	-61	103.4	173.6	-147.9	-88.2	0	0	0	109.7	P1516	P1516-Y1518 PolarHBondContact O-N 2.88Å
1519	F	31.9	Very low	40.2	Very low	178 Å²	178	126.4 Å²	126.4	78%	0.781	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-75.3	124.7	166.1	-91.7	-94.1	0	0	0	108.3	S1517	S1517-F1519 PolarHBondContact O-N 2.88Å
1520	P	26.9	Very low	37.4	Very low	105 Å²	105	127.8 Å²	127.8	68%	0.682	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-67.6	134.1	166.7	28.9	-32.7	0	0	0	109.4
1521	E	27.6	Very low	34.7	Very low	183 Å²	183	132 Å²	132	86%	0.855	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-69.1	128.5	178	-172.1	171	-154.5	0	0	110.5
1522	P	32.4	Very low	32.1	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66.5	136	174.9	-20.9	33.3	0	0	0	111.4
1523	P	27.5	Very low	30	Very low	128 Å²	128	130.7 Å²	130.7	83%	0.831	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65.3	148.5	179.6	27.3	-34.9	0	0	0	112.1
1524	A	22.3	Very low	29.6	Very low	98 Å²	98	130.1 Å²	130.1	81%	0.81	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-62.8	137.7	-165.7	0	0	0	0	0	115.3
1525	L	26	Very low	29.3	Very low	166 Å²	166	131.6 Å²	131.6	87%	0.869	77%	0.766	S	S	*	*			trans	-114.4	153.4	146.8	-81.3	175.8	0	0	0	109.3
1526	P	30.1	Very low	29.8	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	76%	0.761	S	S	*	*			trans	-98.3	-179.2	-140.8	-7	27.9	0	0	0	114.6	V1528	P1526-V1528 PolarHBondContact O-N 2.97Å
1527	A	24.3	Very low	29.7	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	75%	0.751	S	S	*	*			trans	-43.1	131.6	170.2	0	0	0	0	0	114.6
1528	V	28.5	Very low	30	Very low	124 Å²	124	127.8 Å²	127.8	75%	0.752	75%	0.753	S	S	*	*				-147.6	131.7	121.8	136.1	0	0	0	0	108.2	P1526 A1530	P1526-V1528 PolarHBondContact O-N 2.97Å; V1528-A1530 HydrophobicContact CG1-CB 4.5Å; V1528-A1530 PolarHBondContact O-N 3.08Å
1529	P	30.1	Very low	29.9	Very low	130 Å²	130	125.3 Å²	125.3	84%	0.844	75%	0.749	S	S	*	*			trans	-77.3	120.8	176.4	30.8	-32.3	0	0	0	109.9
1530	A	25.7	Very low	30.4	Very low	86 Å²	86	121.9 Å²	121.9	71%	0.711	75%	0.745	S	S	*	*			trans	-136.2	133.7	-177.2	0	0	0	0	0	113	V1528	V1528-A1530 HydrophobicContact CG1-CB 4.5Å; V1528-A1530 PolarHBondContact O-N 3.08Å
1531	A	31.9	Very low	30.9	Very low	93 Å²	93	121.8 Å²	121.8	77%	0.769	74%	0.744	S	S	*	*			trans	32.5	90.7	154.8	0	0	0	0	0	119
1532	V	31	Very low	30.8	Very low	104 Å²	104	122.6 Å²	122.6	63%	0.63	74%	0.741	S	S	*	*				62	115.7	118.8	174.4	0	0	0	0	117.6	Q1534	V1532-Q1534 HydrophobicContact CG1-CG 4.21Å
1533	P	26.9	Very low	30.5	Very low	107 Å²	107	122.5 Å²	122.5	70%	0.695	74%	0.738	S	S	*	*			trans	-67.2	137.3	174	29.7	-34.3	0	0	0	111.4
1534	Q	33.8	Very low	31.4	Very low	132 Å²	132	121.7 Å²	121.7	62%	0.617	73%	0.732	S	S	*	*	S	Bend	trans	-138.2	150.7	178.4	-63.3	-172	-11.8	0	0	109.2	V1532	V1532-Q1534 HydrophobicContact CG1-CG 4.21Å
1535	F	35.5	Very low	31.6	Very low	190 Å²	190	122.4 Å²	122.4	83%	0.833	73%	0.729	S	S	*	*	S	Bend	cis	-125.6	119.2	11.3	-58.1	-95.6	0	0	0	110.9
1536	P	41.1	Very low	31.6	Very low	108 Å²	108	125.9 Å²	125.9	70%	0.701	73%	0.73	S	S	*	*	S	Bend	cis	-117.1	-136.8	-6.1	42	-22.8	0	0	0	109.2
1537	P	33.8	Very low	31.4	Very low	86 Å²	86	125.1 Å²	125.1	56%	0.558	73%	0.734	S	S	*	*			trans	-87.1	163.9	-163.9	39.7	-41.8	0	0	0	115.2
1538	T	37.2	Very low	32.1	Very low	119 Å²	119	126 Å²	126	73%	0.73	73%	0.731	S	S	*	*			trans	50.1	125.2	140.5	60.6	0	0	0	0	121
1539	E	24.1	Very low	31.8	Very low	174 Å²	174	126.8 Å²	126.8	81%	0.813	73%	0.731	S	S	*	*				5.2	170.2	107.5	-77	-164.8	128.1	0	0	119.8
1540	P	41	Very low	31.6	Very low	105 Å²	105	127.3 Å²	127.3	68%	0.682	73%	0.726	S	S	*	*			cis	-128.6	-116.8	-40	35.8	-17.4	0	0	0	107.9
1541	P	38.6	Very low	32.5	Very low	103 Å²	103	129 Å²	129	67%	0.669	73%	0.733	S	S	*	*				-107.6	-158.9	-73.5	33.9	-15.7	0	0	0	111.8
1542	Y	26.2	Very low	33.5	Very low	201 Å²	201	130.9 Å²	130.9	79%	0.788	74%	0.737	S	S	*	*			trans	92.7	106.4	139.4	-126.2	-116.6	0	0	0	120.7
1543	V	26	Very low	33.5	Very low	108 Å²	108	129.2 Å²	129.2	66%	0.655	74%	0.741	S	S	*	*				67.5	141.8	124.5	174.1	0	0	0	0	119.5
1544	P	45.5	Very low	33.6	Very low	110 Å²	110	129.5 Å²	129.5	71%	0.714	75%	0.746	S	S	*	*			trans	-108.1	153.2	-157.5	39.7	-33.1	0	0	0	116.7
1545	P	27.1	Very low	33.3	Very low	113 Å²	113	130 Å²	130	73%	0.734	76%	0.757	S	S	*	*			trans	-86	137.9	146.2	34.9	-28.9	0	0	0	109.8
1546	R	25.1	Very low	33.1	Very low	239 Å²	239	125.7 Å²	125.7	90%	0.902	75%	0.749	S	S	*	*				57	114.5	70.5	-75.5	-169.5	168.6	-137.7	-1.9	114.5
1547	A	26.8	Very low	32.4	Very low	100 Å²	100	127.9 Å²	127.9	83%	0.826	75%	0.754	S	S	*	*			trans	-64.4	156.7	166	0	0	0	0	0	111.7
1548	P	37.7	Very low	32.3	Very low	113 Å²	113	129.3 Å²	129.3	73%	0.734	76%	0.763	S	S	*	*				-152.7	174.7	99.4	42.3	-26	0	0	0	116.7
1549	L	22.1	Very low	32	Very low	142 Å²	142	129.5 Å²	129.5	74%	0.743	77%	0.766	S	S	*	*			trans	31.6	122.6	141.8	-67.9	163.5	0	0	0	121.9
1550	N	25.8	Very low	32.1	Very low	140 Å²	140	124.7 Å²	124.7	75%	0.749	76%	0.763	S	S	*	*			trans	58.6	146.1	132.5	-61.7	-3.9	0	0	0	122.7
1551	S	45.6	Very low	31.3	Very low	122 Å²	122	128 Å²	128	85%	0.853	77%	0.774	S	S	*	*			trans	78	153.9	162.7	-71.8	0	0	0	0	117.5
1552	P	52.4	Low	30.6	Very low	132 Å²	132	131.5 Å²	131.5	86%	0.857	78%	0.781	S	S	*	*				-119.1	162.3	-129.2	41.4	-35.2	0	0	0	117.3
1553	G	31	Very low	30.5	Very low	69 Å²	69	127.8 Å²	127.8	71%	0.711	79%	0.785	S	S	*	*			trans	173.4	113.9	162	0	0	0	0	0	117.1
1554	S	30.2	Very low	30.7	Very low	114 Å²	114	128 Å²	128	80%	0.797	79%	0.788	S	S	*	*			trans	59	127.3	139.6	-58.1	0	0	0	0	124.5
1555	V	25.6	Very low	29.7	Very low	141 Å²	141	130.2 Å²	130.2	86%	0.855	79%	0.793	S	S	*	*			trans	82.7	144	133.1	167.6	0	0	0	0	118.2
1556	P	33.3	Very low	29.5	Very low	100 Å²	100	131.5 Å²	131.5	65%	0.649	79%	0.789	S	S	*	*				-139.2	-168.4	-130	47.6	-32.6	0	0	0	118
1557	L	24.8	Very low	29.5	Very low	154 Å²	154	128 Å²	128	81%	0.806	78%	0.783	S	S	*	*			trans	75	158.7	159.3	-76.1	168	0	0	0	115.9
1558	P	32.4	Very low	29.6	Very low	116 Å²	116	129 Å²	129	75%	0.753	78%	0.781	S	S	*	*			cis	-138.4	-150.3	36.2	50.8	-30.5	0	0	0	114.1
1559	P	31.4	Very low	29.1	Very low	123 Å²	123	132.2 Å²	132.2	80%	0.799	79%	0.787	S	S	*	*				-130	171.8	-123.3	29.1	-3.1	0	0	0	117.3
1560	G	26.1	Very low	29.5	Very low	73 Å²	73	131.3 Å²	131.3	75%	0.753	79%	0.789	S	S	*	*			trans	-160.8	102.3	173.3	0	0	0	0	0	113	E1562	G1560-E1562 PolarHBondContact O-N 2.94Å
1561	I	24.5	Very low	30.2	Very low	176 Å²	176	129.5 Å²	129.5	90%	0.903	79%	0.785	S	S	*	*			trans	-25	110.3	-176.4	-52.6	173.7	0	0	0	117.1
1562	E	23.2	Very low	29.2	Very low	175 Å²	175	129.7 Å²	129.7	82%	0.818	78%	0.781	S	S	*	*			trans	-128.9	146.8	143.5	-76.4	-166	134.5	0	0	108.4	G1560	G1560-E1562 PolarHBondContact O-N 2.94Å
1563	S	24.2	Very low	27.7	Very low	124 Å²	124	130 Å²	130	87%	0.867	78%	0.776	S	S	*	*			trans	-174.1	105.5	157.3	-83.9	0	0	0	0	113.2
1564	P	29.3	Very low	27.3	Very low	111 Å²	111	131 Å²	131	72%	0.721	77%	0.772	S	S	*	*			trans	-110.7	158.8	152.7	35.9	-26.5	0	0	0	112.2
1565	L	24.5	Very low	26.9	Very low	158 Å²	158	131.1 Å²	131.1	83%	0.827	77%	0.773	S	S	*	*			trans	64.4	106.8	155.9	-66.7	163.2	0	0	0	120.8
1566	E	24.8	Very low	26.9	Very low	139 Å²	139	128 Å²	128	65%	0.65	76%	0.761	S	S	*	*				67.1	101.5	109.1	-141	64	-170.6	0	0	122.4
1567	Q	23.1	Very low	26.6	Very low	165 Å²	165	134.4 Å²	134.4	77%	0.771	77%	0.774	S	S	*	*			trans	75.6	160	143.6	-68.5	-172.1	39.8	0	0	120.4
1568	P	30.5	Very low	27.1	Very low	121 Å²	121	129.9 Å²	129.9	79%	0.786	77%	0.765	S	S	*	*			trans	-112.4	169	-145.9	41.7	-35.7	0	0	0	119.3
1569	Q	27.5	Very low	27.2	Very low	182 Å²	182	131.5 Å²	131.5	85%	0.85	77%	0.772	S	S	*	*			trans	-37.4	155.6	171.3	-74.9	-174.8	-47.4	0	0	117.9
1570	P	29.2	Very low	27.2	Very low	122 Å²	122	130.7 Å²	130.7	79%	0.792	78%	0.777	S	S	*	*				-146.5	-150.7	60.3	50.9	-30.4	0	0	0	114.8
1571	P	41.2	Very low	28	Very low	102 Å²	102	136.9 Å²	136.9	66%	0.662	79%	0.786	S	S	*	*			trans	-130.4	-159.2	-130.1	32.4	-4.8	0	0	0	115
1572	T	24.9	Very low	29	Very low	127 Å²	127	132 Å²	132	78%	0.779	78%	0.779	S	S	*	*			trans	73	152.4	171.2	78.1	0	0	0	0	114.6
1573	D	20.7	Very low	29.7	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	78%	0.783	S	S	*	*			cis	-156.7	172.9	-23.9	-141.7	-67.1	0	0	0	110
1574	S	22.4	Very low	30.4	Very low	91 Å²	91	130.2 Å²	130.2	64%	0.636	77%	0.772	S	S	*	*			trans	51.3	113.1	144	-69.5	0	0	0	0	122.7
1575	S	21.2	Very low	30.5	Very low	116 Å²	116	131.3 Å²	131.3	81%	0.811	78%	0.776	S	S	*	*				94.1	142.2	119.5	80.3	0	0	0	0	124.2
1576	A	26.3	Very low	31.3	Very low	75 Å²	75	127.3 Å²	127.3	62%	0.62	76%	0.758	S	S	*	*			trans	96.3	137.4	135.8	0	0	0	0	0	122.9
1577	Y	26.8	Very low	31.6	Very low	235 Å²	235	127.4 Å²	127.4	92%	0.922	76%	0.757	S	S	*	*			trans	63.5	150.7	169.2	-61.6	-81.5	0	0	0	119.3
1578	G	34.1	Very low	32.1	Very low	58 Å²	58	122.5 Å²	122.5	60%	0.598	74%	0.744	S	S	*	*			cis	158	123.3	-12.8	0	0	0	0	0	115.9
1579	T	35.3	Very low	32.6	Very low	150 Å²	150	121.8 Å²	121.8	92%	0.92	74%	0.74	S	S	*	*			trans	59.2	110.2	159.4	50.2	0	0	0	0	122.1
1580	A	30.5	Very low	32.6	Very low	107 Å²	107	116.5 Å²	116.5	88%	0.884	73%	0.734	S	S	*	*			trans	-168.5	171.2	141.3	0	0	0	0	0	110.2
1581	E	43.2	Very low	32.5	Very low	202 Å²	202	120.7 Å²	120.7	94%	0.944	74%	0.74	S	S	*	*			trans	-127.3	142.8	-163.7	-53.2	-179.8	134	0	0	116
1582	G	47.2	Very low	31.8	Very low	74 Å²	74	120.1 Å²	120.1	76%	0.763	74%	0.744	S	S	*	*			trans	103.6	116.3	146.2	0	0	0	0	0	123.4
1583	L	36.2	Very low	32.5	Very low	171 Å²	171	119.6 Å²	119.6	90%	0.895	74%	0.743	S	S	*	*			trans	72.9	174.3	150.5	-56.1	176.3	0	0	0	121.2
1584	S	39.8	Very low	32.9	Very low	91 Å²	91	121.2 Å²	121.2	64%	0.636	75%	0.746	S	S	*	*				-171.4	155	-68.8	61.7	0	0	0	0	116.1
1585	V	32	Very low	33.9	Very low	133 Å²	133	122 Å²	122	81%	0.806	75%	0.749	S	S	*	*			trans	81.8	158.7	163.5	-164.2	0	0	0	0	118.9
1586	T	40.2	Very low	34.3	Very low	74 Å²	74	121.9 Å²	121.9	45%	0.454	75%	0.746	S	S	.	*			trans	-111.6	-173.3	-160	44.2	0	0	0	0	115.4	P1698	T1586-P1698 CarbonylContact C-O 3.41Å
1587	F	31.6	Very low	34.4	Very low	142 Å²	142	129.6 Å²	129.6	62%	0.623	76%	0.759	S	S	*	*			cis	-162.8	175.7	40.7	-106.1	-79.4	0	0	0	115.8	P1698 P1699 Y1700	F1587-P1698 PolarHBondContact N-O 2.03Å; F1587-P1699 VanDerWaalsContact C-C 3.44Å; F1587-Y1700 VanDerWaalsContact CD1-O 3.23Å; F1587-Y1700 WeakPolarHBondContact CD1-O 3.27Å
1588	A	33.5	Very low	34.7	Very low	61 Å²	61	123.8 Å²	123.8	50%	0.504	75%	0.75	S	S	.	*	B	Isolated β-bridge	trans	91.8	161.2	148.2	0	0	0	0	0	123.7	P1699 Y1700	A1588-P1699 VanDerWaalsContact N-C 3.26Å; A1588-Y1700 PolarHBondContact N-O 3.47Å; A1588-Y1700 PolarHBondContact O-N 2.89Å
1589	P	41.9	Very low	34.5	Very low	107 Å²	107	125.4 Å²	125.4	70%	0.695	76%	0.757	S	S	*	*			trans	-142.5	179.7	-162.6	44.3	-24.9	0	0	0	120.2
1590	G	27.3	Very low	34.1	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	75%	0.752	S	S	*	*			trans	151.6	114.8	150.7	0	0	0	0	0	124.5
1591	F	26.7	Very low	34.2	Very low	209 Å²	209	126.8 Å²	126.8	92%	0.917	74%	0.744	S	S	*	*			trans	47.8	114.6	142.7	-69.4	-82.5	0	0	0	129.5
1592	A	26.8	Very low	33.3	Very low	91 Å²	91	124.8 Å²	124.8	75%	0.752	74%	0.737	S	S	*	*				69.6	152.4	115.5	0	0	0	0	0	127.7
1593	P	39.3	Very low	32.2	Very low	116 Å²	116	129.2 Å²	129.2	75%	0.753	74%	0.738	S	S	*	*			trans	-144.3	-157.8	-159.4	42.5	-18.4	0	0	0	118.9
1594	Q	28	Very low	31.8	Very low	172 Å²	172	126.2 Å²	126.2	80%	0.804	73%	0.731	S	S	*	*			trans	98.3	156.6	167	-59.3	-65	-5.6	0	0	118.5
1595	P	44.1	Very low	31.4	Very low	107 Å²	107	126.8 Å²	126.8	70%	0.695	73%	0.733	S	S	*	*			cis	-119.8	-139.5	-12.7	40.8	-22.7	0	0	0	110.6
1596	P	29.9	Very low	31.1	Very low	114 Å²	114	131 Å²	131	74%	0.74	74%	0.736	S	S	*	*			cis	-131.1	-171.5	-23.8	40.4	-21.6	0	0	0	115.2
1597	R	27.3	Very low	30.3	Very low	237 Å²	237	131.8 Å²	131.8	89%	0.894	74%	0.744	S	S	*	*			trans	-172.7	-175.4	176.2	-113.2	175.7	-164.5	-110.2	0.8	110.7
1598	P	34.8	Very low	30	Very low	113 Å²	113	130.8 Å²	130.8	73%	0.734	75%	0.75	S	S	*	*			cis	-136.9	176.4	-21.6	40	-22.6	0	0	0	116.1
1599	A	29.2	Very low	29.8	Very low	91 Å²	91	134.5 Å²	134.5	75%	0.752	76%	0.761	S	S	*	*			trans	-162.5	112.7	150.7	0	0	0	0	0	109.9
1600	Q	26.1	Very low	29.5	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.822	77%	0.767	S	S	*	*				85.6	144.5	70.2	-74.5	-96	-56.2	0	0	112.7
1601	P	32.8	Very low	29.8	Very low	110 Å²	110	140.5 Å²	140.5	71%	0.714	77%	0.768	S	S	*	*			cis	-108.2	-166.8	-6.6	10	16.4	0	0	0	111
1602	M	25.3	Very low	30	Very low	160 Å²	160	134.4 Å²	134.4	79%	0.788	76%	0.763	S	S	*	*			cis	-153.9	-160.3	-8.9	-125.8	179.1	102.2	0	0	112
1603	E	24.4	Very low	30.2	Very low	168 Å²	168	139.4 Å²	139.4	79%	0.785	77%	0.771	S	S	*	*			trans	-76.6	164.5	-179.2	-49.6	176.1	162.9	0	0	114
1604	S	26.1	Very low	30.1	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	77%	0.773	S	S	*	*			cis	-164.5	-175.4	0.2	-146.6	0	0	0	0	108.4
1605	P	33.2	Very low	30	Very low	103 Å²	103	135.2 Å²	135.2	67%	0.669	77%	0.773	S	S	*	*				-117.9	161.3	-52.2	20.9	0.1	0	0	0	114.1
1606	Y	24.4	Very low	29.2	Very low	222 Å²	222	137.9 Å²	137.9	87%	0.871	78%	0.781	S	S	*	*			trans	64.7	126.4	153.1	-86.3	-112.5	0	0	0	123.5
1607	S	23.4	Very low	29	Very low	90 Å²	90	139 Å²	139	63%	0.629	79%	0.785	S	S	*	*			trans	85.9	90.3	138.5	-62.9	0	0	0	0	124.7
1608	T	25.8	Very low	29.5	Very low	121 Å²	121	132.8 Å²	132.8	74%	0.742	78%	0.776	S	S	*	*				77.9	103.7	120.2	60.2	0	0	0	0	125.3
1609	L	28.4	Very low	29	Very low	139 Å²	139	138.7 Å²	138.7	73%	0.728	79%	0.785	S	S	*	*				75.7	103.3	126.6	-79.6	75.7	0	0	0	124.8
1610	F	35.5	Very low	29.3	Very low	187 Å²	187	139.7 Å²	139.7	82%	0.82	79%	0.787	S	S	*	*				75.6	177.2	128.9	-64	-54.7	0	0	0	121.8
1611	P	33.4	Very low	29.7	Very low	117 Å²	117	136.3 Å²	136.3	76%	0.76	78%	0.78	S	S	*	*				-147.4	162.7	-94.5	42.5	-20.1	0	0	0	120.8
1612	G	32.2	Very low	29.4	Very low	80 Å²	80	136.5 Å²	136.5	83%	0.825	78%	0.784	S	S	*	*			trans	71.7	159	158	0	0	0	0	0	118.3
1613	Q	31.6	Very low	30.3	Very low	196 Å²	196	134.6 Å²	134.6	92%	0.916	78%	0.783	S	S	*	*			cis	-147.7	179.8	-0.1	-112.8	-169.5	-46.4	0	0	109.7
1614	P	36.2	Very low	31.3	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	78%	0.781	S	S	*	*			trans	-104.9	162.6	-152.4	39.8	-38.9	0	0	0	119.8
1615	G	26.7	Very low	31.5	Very low	78 Å²	78	135.9 Å²	135.9	80%	0.804	79%	0.785	S	S	*	*			trans	-176	122.7	165.6	0	0	0	0	0	118.1
1616	L	26	Very low	31.3	Very low	163 Å²	163	138.9 Å²	138.9	85%	0.853	79%	0.794	S	S	*	*			trans	24.3	129.5	158.8	-60.3	176	0	0	0	124.7
1617	T	25.5	Very low	31.9	Very low	136 Å²	136	133.4 Å²	133.4	83%	0.834	79%	0.785	S	S	*	*			trans	73	160.5	145.3	49.6	0	0	0	0	120.3
1618	P	38.6	Very low	32.4	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	79%	0.794	S	S	*	*			trans	-106.2	163.9	-153.3	40	-35.9	0	0	0	118.1
1619	Y	23.6	Very low	32.8	Very low	238 Å²	238	139 Å²	139	93%	0.933	79%	0.793	S	S	*	*			trans	76.5	143.7	177.4	-70.5	-87.3	0	0	0	117.6
1620	S	36	Very low	32.7	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	79%	0.794	S	S	*	*			trans	-76.6	153	-175.5	-166.7	0	0	0	0	112.1
1621	P	35.3	Very low	32.5	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	79%	0.793	S	S	*	*			cis	-158.5	164.1	45.2	44	-21.3	0	0	0	122.7
1622	S	26.9	Very low	32	Very low	114 Å²	114	137.6 Å²	137.6	80%	0.797	80%	0.798	S	S	*	*			trans	72.3	169.4	149.4	-47.8	0	0	0	0	120.7
1623	P	42.6	Very low	31.9	Very low	119 Å²	119	139.3 Å²	139.3	77%	0.773	80%	0.798	S	S	*	*				-127.5	-146.4	-119.8	37.9	-11.6	0	0	0	114.1
1624	P	46.7	Very low	32.5	Very low	112 Å²	112	135.6 Å²	135.6	73%	0.727	79%	0.791	S	S	*	*			cis	-142.9	-163.7	-8.8	45.3	-24.3	0	0	0	118.1
1625	K	28.7	Very low	32.2	Very low	192 Å²	192	135.2 Å²	135.2	84%	0.835	79%	0.791	S	S	*	*			trans	83.9	104.5	157	-81.3	-169.5	175.8	-174.8	0	124.8
1626	L	29.5	Very low	32.7	Very low	166 Å²	166	137.4 Å²	137.4	87%	0.869	79%	0.791	S	S	*	*				66.2	169.5	129.1	-107.3	73.5	0	0	0	123.2
1627	P	38	Very low	34	Very low	106 Å²	106	135.1 Å²	135.1	69%	0.688	79%	0.786	S	S	*	*				-138.4	175.2	-123.3	42.8	-21.8	0	0	0	120.2
1628	Q	34.4	Very low	34.4	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	78%	0.779	S	S	*	*			trans	146.4	142.9	139.2	-83.7	-175.1	-11.4	0	0	119
1629	H	33.1	Very low	33.8	Very low	156 Å²	156	138.8 Å²	138.8	72%	0.722	79%	0.786	S	S	*	*			trans	50.5	124.5	150.7	-70.2	-71.1	0	0	0	127.4
1630	V	25.7	Very low	34	Very low	124 Å²	124	132.9 Å²	132.9	75%	0.752	78%	0.775	S	S	*	*			trans	55.7	128.1	133.4	-174.1	0	0	0	0	122.8
1631	P	33.1	Very low	33.8	Very low	123 Å²	123	133.7 Å²	133.7	80%	0.799	78%	0.777	S	S	*	*			trans	-131	155.7	154.3	39.2	-26.1	0	0	0	116.5
1632	L	22.6	Very low	33.5	Very low	167 Å²	167	138.1 Å²	138.1	87%	0.874	79%	0.786	S	S	*	*			trans	-156.2	171.4	167.2	-108.9	172.2	0	0	0	108.9
1633	S	28.5	Very low	33.9	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	79%	0.785	S	S	*	*			trans	82.7	163.6	166.9	84	0	0	0	0	119.5
1634	P	44.4	Very low	33.6	Very low	119 Å²	119	137.9 Å²	137.9	77%	0.773	78%	0.781	S	S	*	*			trans	-123.8	176.4	-155.3	44.5	-33.6	0	0	0	117.6
1635	S	30.8	Very low	32.6	Very low	115 Å²	115	138 Å²	138	80%	0.804	78%	0.784	S	S	*	*			trans	-171.3	166.1	156.7	36.6	0	0	0	0	113.9
1636	P	36.7	Very low	32.8	Very low	123 Å²	123	134.4 Å²	134.4	80%	0.799	78%	0.781	S	S	*	*			trans	-108.8	-147.8	-176.4	43.7	-33.3	0	0	0	115
1637	P	53.8	Low	33.2	Very low	116 Å²	116	132.2 Å²	132.2	75%	0.753	78%	0.777	S	S	*	*				-108.1	-157.7	-127.9	37.4	-14.4	0	0	0	113.2
1638	P	34.5	Very low	33.1	Very low	107 Å²	107	132.7 Å²	132.7	70%	0.695	78%	0.78	S	S	*	*			cis	-145.3	-177.9	6.4	45.4	-24.8	0	0	0	119.5
1639	Y	24.4	Very low	32.9	Very low	212 Å²	212	129.2 Å²	129.2	83%	0.831	77%	0.772	S	S	*	*			trans	50.8	118.6	151.3	-90.6	-118.2	0	0	0	121.4
1640	V	28.4	Very low	32.6	Very low	115 Å²	115	130.9 Å²	130.9	70%	0.697	77%	0.774	S	S	*	*				104.4	121	50.4	156.7	0	0	0	0	111.9
1641	P	31.1	Very low	32.8	Very low	128 Å²	128	129.6 Å²	129.6	83%	0.831	77%	0.77	S	S	*	*				-151.9	-179.7	92.6	39.2	-18.2	0	0	0	119.1
1642	K	29.9	Very low	32.6	Very low	199 Å²	199	129.2 Å²	129.2	87%	0.865	77%	0.767	S	S	*	*			trans	-71.2	177.5	-179.2	-104.4	-179.3	176.4	176.4	0	115.2
1643	P	34.8	Very low	32.7	Very low	120 Å²	120	126.3 Å²	126.3	78%	0.779	76%	0.761	S	S	*	*			cis	-134.2	-134.6	21.9	41.2	-16.1	0	0	0	116.1
1644	P	36.8	Very low	32.5	Very low	108 Å²	108	126.3 Å²	126.3	70%	0.701	76%	0.757	S	S	*	*				-135.8	168.2	-125.8	40.8	-17.9	0	0	0	121.9
1645	S	25.8	Very low	31.5	Very low	113 Å²	113	128.4 Å²	128.4	79%	0.79	76%	0.756	S	S	*	*			trans	65.3	160.1	159.4	76.2	0	0	0	0	120.4
1646	P	32.1	Very low	31.2	Very low	118 Å²	118	129.7 Å²	129.7	77%	0.766	75%	0.751	S	S	*	*			cis	-121.4	-165.7	-7.9	45.2	-29.1	0	0	0	113.3
1647	P	39.1	Very low	30.5	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	75%	0.75	S	S	*	*			trans	-104.9	-168.5	-168.8	43.9	-37	0	0	0	114.3
1648	P	34.8	Very low	29	Very low	116 Å²	116	134 Å²	134	75%	0.753	75%	0.752	S	S	*	*			cis	-125.8	-146.2	-5.3	46.2	-28.5	0	0	0	111.2
1649	P	30.5	Very low	28.5	Very low	100 Å²	100	134 Å²	134	65%	0.649	75%	0.754	S	S	*	*			cis	-133.4	-176.5	-18.1	43.1	-25.7	0	0	0	116.4
1650	Y	27.9	Very low	28.5	Very low	191 Å²	191	130.1 Å²	130.1	75%	0.749	75%	0.753	S	S	*	*			trans	64.7	119.4	159.6	-74.6	-67.3	0	0	0	123.6
1651	S	29.6	Very low	28.4	Very low	96 Å²	96	128.5 Å²	128.5	67%	0.671	75%	0.751	S	S	*	*			trans	-62.8	160.1	163.8	55.2	0	0	0	0	114.9
1652	P	29	Very low	28.1	Very low	115 Å²	115	128.7 Å²	128.7	75%	0.747	75%	0.745	S	S	*	*				-141.5	142.7	84	38	-21.5	0	0	0	114
1653	S	23.4	Very low	27.8	Very low	106 Å²	106	127 Å²	127	74%	0.741	74%	0.742	S	S	*	*				66.9	140.1	90.3	-50.6	0	0	0	0	115.6
1654	T	24.2	Very low	27.3	Very low	117 Å²	117	132.5 Å²	132.5	72%	0.718	75%	0.748	S	S	*	*			cis	-166.9	-178.5	-11.3	-74.3	0	0	0	0	106.4
1655	Q	24.8	Very low	27	Very low	162 Å²	162	132.6 Å²	132.6	76%	0.757	75%	0.749	S	S	*	*			trans	80.2	139.3	169.6	-48.5	176	12.7	0	0	113
1656	M	22.9	Very low	27.9	Very low	143 Å²	143	133.2 Å²	133.2	70%	0.704	75%	0.75	S	S	*	*			cis	-147.4	-176.4	0.7	-116.7	170.7	-154.1	0	0	107.7
1657	T	23.6	Very low	27.7	Very low	125 Å²	125	133.7 Å²	133.7	77%	0.767	75%	0.75	S	S	*	*			cis	-148.2	-166.3	17.8	-23.1	0	0	0	0	111.9
1658	Y	22.1	Very low	26.9	Very low	205 Å²	205	137.9 Å²	137.9	80%	0.804	76%	0.757	S	S	*	*			trans	-83	161.1	-176.2	-84.9	-96.6	0	0	0	118.5
1659	S	22.9	Very low	26.9	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	76%	0.755	S	S	*	*			trans	69.3	153.6	145.8	-63.2	0	0	0	0	118.5
1660	T	25.7	Very low	26.8	Very low	132 Å²	132	141.1 Å²	141.1	81%	0.81	76%	0.763	S	S	*	*			cis	-149	169.3	35.3	46.2	0	0	0	0	115.6
1661	A	25.9	Very low	26.5	Very low	81 Å²	81	140.7 Å²	140.7	67%	0.669	77%	0.765	S	S	*	*			trans	64.5	112	141.9	0	0	0	0	0	123.2
1662	D	24.9	Very low	26.2	Very low	132 Å²	132	144.2 Å²	144.2	71%	0.706	78%	0.775	S	S	*	*				73.7	105	118.8	-63.6	-38.8	0	0	0	125.1
1663	M	22.6	Very low	25.8	Very low	162 Å²	162	147.6 Å²	147.6	80%	0.798	78%	0.78	S	S	*	*				83.6	134.9	118.9	-64.7	-163.9	-160.3	0	0	123.3
1664	R	24.3	Very low	25.9	Very low	236 Å²	236	149.8 Å²	149.8	89%	0.891	78%	0.779	S	S	*	*			trans	87	162.4	146	-108.1	176.8	-178	-169.3	0.2	117.3
1665	P	30.9	Very low	26.1	Very low	111 Å²	111	152.8 Å²	152.8	72%	0.721	78%	0.778	S	S	*	*				-116.4	176	-99	41.5	-29.6	0	0	0	114.4
1666	P	45.1	Very low	25.9	Very low	125 Å²	125	149.8 Å²	149.8	81%	0.812	78%	0.775	S	S	*	*			trans	-102.3	151.8	-155.1	37.8	-35.5	0	0	0	116.9
1667	T	27.1	Very low	25.9	Very low	128 Å²	128	151.4 Å²	151.4	79%	0.785	78%	0.781	S	S	*	*			trans	-154.5	121.4	162.9	49.3	0	0	0	0	113.9
1668	F	23.1	Very low	25.9	Very low	207 Å²	207	152.6 Å²	152.6	91%	0.908	78%	0.781	S	S	*	*			trans	57.3	170	142.7	-82.3	-99.7	0	0	0	120.2
1669	P	35.6	Very low	26.9	Very low	110 Å²	110	148.2 Å²	148.2	71%	0.714	78%	0.778	S	S	*	*			trans	-120.3	-155.8	-145	47.4	-39.5	0	0	0	115.9
1670	E	26.4	Very low	26.8	Very low	174 Å²	174	148.2 Å²	148.2	81%	0.813	78%	0.778	S	S	*	*			trans	85.5	118.6	-171.9	-54.4	-158.3	111.8	0	0	113
1671	K	22.2	Very low	26.9	Very low	182 Å²	182	148.4 Å²	148.4	79%	0.791	78%	0.779	S	S	*	*			cis	88.8	103.2	42	-175.3	-162.9	-179	-170.1	0	112.4
1672	I	23.6	Very low	27.7	Very low	171 Å²	171	150.8 Å²	150.8	88%	0.877	79%	0.788	S	S	*	*			trans	-167	145.2	149.3	-100.6	149.1	0	0	0	108.2
1673	E	20.9	Very low	27.8	Very low	186 Å²	186	147.5 Å²	147.5	87%	0.869	79%	0.785	S	S	*	*			trans	-118	-177.9	174	-63.5	-175.6	121.9	0	0	110.1
1674	E	24.8	Very low	27.8	Very low	151 Å²	151	147.1 Å²	147.1	71%	0.706	79%	0.785	S	S	*	*			trans	89.3	162.4	151.2	-149.6	171.2	-143.5	0	0	119.2
1675	Y	27.9	Very low	27.9	Very low	180 Å²	180	145.3 Å²	145.3	71%	0.706	78%	0.784	S	S	*	*			trans	89.3	73	170.5	-60.1	-75.5	0	0	0	121.8
1676	S	22.7	Very low	28	Very low	99 Å²	99	145.3 Å²	145.3	69%	0.692	78%	0.784	S	S	*	*				37.5	110.3	96.9	-45	0	0	0	0	122
1677	E	21.3	Very low	27.2	Very low	178 Å²	178	149 Å²	149	83%	0.832	79%	0.79	S	S	*	*				72.5	151.8	116.7	-123.1	178.5	-131.2	0	0	124.9
1678	I	24.9	Very low	27	Very low	149 Å²	149	147.4 Å²	147.4	76%	0.764	79%	0.79	S	S	*	*			trans	89.3	139.8	158.3	-65.4	167.9	0	0	0	120
1679	P	42.2	Very low	27.1	Very low	113 Å²	113	143.7 Å²	143.7	73%	0.734	78%	0.784	S	S	*	*			trans	-128.8	175.3	-170.4	44.6	-30.4	0	0	0	117
1680	S	21.7	Very low	26.6	Very low	105 Å²	105	149.1 Å²	149.1	73%	0.734	79%	0.792	S	S	*	*			trans	175.4	145.6	137	44	0	0	0	0	117.9
1681	T	27.5	Very low	26.4	Very low	136 Å²	136	144 Å²	144	83%	0.834	79%	0.785	S	S	*	*			trans	69.8	156.8	151.1	43.7	0	0	0	0	123
1682	P	42.9	Very low	26.9	Very low	131 Å²	131	140.7 Å²	140.7	85%	0.851	78%	0.782	S	S	*	*			trans	-135	171.9	-155.4	43	-25	0	0	0	118.9
1683	G	26.1	Very low	27.1	Very low	64 Å²	64	141.8 Å²	141.8	66%	0.66	78%	0.784	S	S	*	*			trans	-172	119.1	163.8	0	0	0	0	0	110.3
1684	I	22.5	Very low	27.3	Very low	154 Å²	154	137.9 Å²	137.9	79%	0.79	78%	0.784	S	S	*	*				54.6	100.6	83.4	-46.5	171.9	0	0	0	115.2
1685	F	25.7	Very low	27.5	Very low	197 Å²	197	134.5 Å²	134.5	86%	0.864	79%	0.789	S	S	*	*				171.4	155.6	121	-103.6	-83.2	0	0	0	109.6
1686	P	34.1	Very low	27.2	Very low	112 Å²	112	134.8 Å²	134.8	73%	0.727	80%	0.799	S	S	*	*			trans	-111.7	150.8	-176.6	37.3	-25	0	0	0	114.6
1687	E	28.5	Very low	27.6	Very low	203 Å²	203	135 Å²	135	95%	0.949	80%	0.798	S	S	*	*			trans	-127.4	166.2	161.1	-85.4	-169.3	127.1	0	0	110.7
1688	A	22	Very low	28.2	Very low	94 Å²	94	130.5 Å²	130.5	78%	0.777	78%	0.784	S	S	*	*			trans	-117.8	-157.5	-172.4	0	0	0	0	0	111.6
1689	V	25.2	Very low	28.6	Very low	128 Å²	128	126.6 Å²	126.6	78%	0.776	77%	0.768	S	S	*	*			trans	93.7	95.4	168	-174	0	0	0	0	116.6
1690	Y	24.9	Very low	27.8	Very low	225 Å²	225	129.1 Å²	129.1	88%	0.882	76%	0.764	S	S	*	*			trans	57.2	139.8	141.1	-77.6	-99.1	0	0	0	123
1691	G	23.2	Very low	28.3	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	76%	0.757	S	S	*	*			trans	-135.4	152.9	148.5	0	0	0	0	0	110.5
1692	P	32.2	Very low	28	Very low	113 Å²	113	130.6 Å²	130.6	73%	0.734	76%	0.758	S	S	*	*			trans	-114.2	171.1	155.9	6.8	16.6	0	0	0	110
1693	E	28	Very low	27.5	Very low	194 Å²	194	130.4 Å²	130.4	91%	0.907	76%	0.757	S	S	*	*			cis	-157.3	-177.1	-6.4	-122	160.2	-178.2	0	0	109
1694	A	25.9	Very low	27.3	Very low	105 Å²	105	131.7 Å²	131.7	87%	0.868	76%	0.761	S	S	*	*			trans	-116.7	160.6	-174.2	0	0	0	0	0	114
1695	G	27.2	Very low	27.7	Very low	79 Å²	79	129.9 Å²	129.9	81%	0.814	76%	0.76	S	S	*	*			trans	177.2	137.1	169.9	0	0	0	0	0	115.9
1696	M	22.4	Very low	27.6	Very low	187 Å²	187	124.8 Å²	124.8	92%	0.921	75%	0.754	S	S	*	*			trans	-101.3	165	164.2	-60.1	168.1	156.7	0	0	109
1697	P	31.9	Very low	27.1	Very low	104 Å²	104	125.1 Å²	125.1	68%	0.675	75%	0.754	S	S	*	*				-153.7	-179.9	89.5	39.4	-19.6	0	0	0	116.3
1698	P	33	Very low	26.8	Very low	82 Å²	82	124.1 Å²	124.1	53%	0.532	75%	0.749	S	S	.	*			trans	-113.5	-158.6	172.7	39	-22.5	0	0	0	112	T1586 F1587	T1586-P1698 CarbonylContact C-O 3.41Å; F1587-P1698 PolarHBondContact N-O 2.03Å
1699	P	33.7	Very low	27.1	Very low	67 Å²	67	124.9 Å²	124.9	44%	0.435	75%	0.748	S	S	.	*				-129.5	-179.4	-80.5	40.7	-24.2	0	0	0	115.5	F1587 A1588	F1587-P1699 VanDerWaalsContact C-C 3.44Å; A1588-P1699 VanDerWaalsContact N-C 3.26Å
1700	Y	24.3	Very low	27.5	Very low	166 Å²	166	124.4 Å²	124.4	65%	0.651	75%	0.748	S	S	*	*	B	Isolated β-bridge	trans	63.2	173	165.9	-74.3	-69.8	0	0	0	117.1	F1587 A1588	F1587-Y1700 VanDerWaalsContact CD1-O 3.23Å; F1587-Y1700 WeakPolarHBondContact CD1-O 3.27Å; A1588-Y1700 PolarHBondContact N-O 3.47Å; A1588-Y1700 PolarHBondContact O-N 2.89Å
1701	P	32.2	Very low	27.4	Very low	89 Å²	89	124.3 Å²	124.3	58%	0.578	75%	0.748	S	S	*	*			cis	-128.1	-164.2	6.6	45.2	-28.7	0	0	0	116.2
1702	E	22.9	Very low	27.5	Very low	184 Å²	184	130.2 Å²	130.2	86%	0.86	76%	0.758	S	S	*	*			trans	-77.7	167	179.8	-58.3	174.9	107.5	0	0	115.6
1703	P	31.7	Very low	27.2	Very low	126 Å²	126	129.8 Å²	129.8	82%	0.818	76%	0.757	S	S	*	*				-139.6	146.8	128.5	38.1	-26.1	0	0	0	115.9
1704	A	21.9	Very low	27	Very low	92 Å²	92	123.9 Å²	123.9	76%	0.76	75%	0.748	S	S	*	*			trans	-88.8	-174.5	160.8	0	0	0	0	0	110
1705	P	29.8	Very low	27	Very low	116 Å²	116	125.3 Å²	125.3	75%	0.753	75%	0.749	S	S	*	*			cis	-143.8	-169.3	7.9	44.2	-24.4	0	0	0	116.8
1706	A	23.8	Very low	26.8	Very low	90 Å²	90	127.8 Å²	127.8	74%	0.744	75%	0.748	S	S	*	*			trans	71.9	163	147.5	0	0	0	0	0	118.4
1707	V	24.3	Very low	26.9	Very low	119 Å²	119	125.7 Å²	125.7	72%	0.721	74%	0.74	S	S	*	*			cis	-163.4	143.9	-20.7	129.6	0	0	0	0	109.2
1708	Q	21.9	Very low	26.4	Very low	181 Å²	181	129.3 Å²	129.3	85%	0.846	75%	0.747	S	S	*	*			trans	45.7	154.1	154.8	-65.2	169.3	-23.8	0	0	124.3
1709	S	28.4	Very low	25.9	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	76%	0.756	S	S	*	*			trans	-40.4	166.9	161.4	-115.8	0	0	0	0	116.3
1710	P	33.8	Very low	25.7	Very low	118 Å²	118	137.3 Å²	137.3	77%	0.766	78%	0.775	S	S	*	*			cis	-145.9	-165.7	29.8	44.1	-23.3	0	0	0	117.8
1711	Y	22.3	Very low	25.7	Very low	223 Å²	223	136.1 Å²	136.1	88%	0.875	78%	0.775	S	S	*	*			trans	-50.5	143.3	166.1	-74.6	-107.1	0	0	0	115.3
1712	E	26.1	Very low	25.6	Very low	190 Å²	190	136.9 Å²	136.9	89%	0.888	78%	0.775	S	S	*	*			trans	-175.5	158.9	143.1	-101.3	-176.1	-173.3	0	0	107.6
1713	S	25.7	Very low	26	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	78%	0.775	S	S	*	*			cis	-156.7	164.7	-33.6	51.8	0	0	0	0	108.1
1714	G	23.5	Very low	26.4	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	77%	0.771	S	S	*	*			trans	-83.5	170.1	-174.7	0	0	0	0	0	115.1
1715	P	26.8	Very low	27.3	Very low	135 Å²	135	145.3 Å²	145.3	88%	0.877	78%	0.779	S	S	*	*				-119.3	153.8	126.4	34.8	-33.4	0	0	0	113.8
1716	T	22.6	Very low	28.3	Very low	131 Å²	131	145.1 Å²	145.1	80%	0.804	77%	0.771	S	S	*	*			trans	-95.1	156.4	-159.1	-41	0	0	0	0	114.2
1717	I	24.9	Very low	30.1	Very low	144 Å²	144	143.2 Å²	143.2	74%	0.738	75%	0.75	S	S	*	*			trans	136.5	97.8	140.6	-66.9	159.3	0	0	0	115.7
1718	Q	21.9	Very low	32.5	Very low	179 Å²	179	145 Å²	145	84%	0.836	75%	0.745	S	S	*	*			trans	48.2	117.3	133.9	-53.5	-177.6	5.8	0	0	124.1
1719	R	21.7	Very low	34.8	Very low	188 Å²	188	136.6 Å²	136.6	71%	0.709	71%	0.706	S	S	*	*			trans	39.8	135.1	132.7	-122	-175.1	-166.5	-144.9	2	121.7	Q1721	R1719-Q1721 VanDerWaalsContact CZ-CD 3.5Å; R1719-Q1721 VanDerWaalsContact NH2-CD 3.3Å
1720	P	28.5	Very low	36.5	Very low	130 Å²	130	135.9 Å²	135.9	84%	0.844	70%	0.699	S	S	*	*				-138.6	-175.7	98.4	38.7	-27	0	0	0	114.9
1721	Q	25.5	Very low	38	Very low	140 Å²	140	134.9 Å²	134.9	65%	0.654	69%	0.687	S	S	*	*			trans	-129.3	158.6	-175.4	-67.4	-172	-82.4	0	0	114.9	R1719	R1719-Q1721 VanDerWaalsContact CZ-CD 3.5Å; R1719-Q1721 VanDerWaalsContact NH2-CD 3.3Å
1722	D	30	Very low	39.9	Very low	106 Å²	106	127.3 Å²	127.3	57%	0.567	68%	0.677	S	S	*	*			trans	39.1	116.1	158.5	-167.5	10.9	0	0	0	119.3	R1724	D1722-R1724 IonicContact OD1-NE 3.11Å; D1722-R1724 IonicContact OD2-CZ 2.92Å; D1722-R1724 IonicContact OD2-NE 3.3Å; D1722-R1724 IonicContact OD2-NH2 2.67Å; D1722-R1724 PolarHBondContact OD2-NH2 2.83Å; D1722-R1724 VanDerWaalsContact OD2-NH2 3.16Å
1723	Q	31.3	Very low	41.8	Very low	184 Å²	184	121.2 Å²	121.2	86%	0.86	65%	0.648	S	S	*	*			trans	-151.7	157.8	135.1	-120.1	173.7	44.2	0	0	113.7
1724	R	39.3	Very low	43.8	Very low	196 Å²	196	122.7 Å²	122.7	74%	0.74	65%	0.647	S	S	*	*			trans	-104.6	166	-163.6	-57.6	169.3	-163.5	177.5	3.9	111.8	D1722 L1726	D1722-R1724 IonicContact OD1-NE 3.11Å; D1722-R1724 IonicContact OD2-CZ 2.92Å; D1722-R1724 IonicContact OD2-NE 3.3Å; D1722-R1724 IonicContact OD2-NH2 2.67Å; D1722-R1724 PolarHBondContact OD2-NH2 2.83Å; D1722-R1724 VanDerWaalsContact OD2-NH2 3.16Å; R1724-L1726 PolarHBondContact O-N 2.95Å
1725	Q	42	Very low	46.3	Very low	199 Å²	199	119.7 Å²	119.7	93%	0.93	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-57.2	128.3	-179.1	-71.9	169.9	-50.8	0	0	112.6
1726	L	49.3	Very low	48.4	Very low	112 Å²	112	115.9 Å²	115.9	59%	0.586	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-75.5	151	178.4	-90.6	67.1	0	0	0	112.2	R1724 Y1728	R1724-L1726 PolarHBondContact O-N 2.95Å; L1726-Y1728 HydrophobicContact CB-CD2 4.19Å; L1726-Y1728 HydrophobicContact CB-CE2 3.52Å; L1726-Y1728 HydrophobicContact CD2-CE2 4.36Å; L1726-Y1728 WeakPolarHBondContact CD2-OH 3.06Å
1727	V	63.4	Low	51.1	Low	49 Å²	49	114.6 Å²	114.6	30%	0.297	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-96.8	134.4	170.3	-178.7	0	0	0	0	109.3	P1735 L1743 N1762 F1767	V1727-P1735 HydrophobicContact CG1-CG 4.28Å; V1727-P1735 WeakPolarHBondContact O-CG 3.12Å; V1727-L1743 HydrophobicContact CB-CD1 4.24Å; V1727-L1743 HydrophobicContact CG1-CD1 4.07Å; V1727-L1743 HydrophobicContact CG1-CD2 4.42Å; V1727-L1743 HydrophobicContact CG2-CD1 4.13Å; V1727-N1762 HydrophobicContact CG1-CB 4.24Å; V1727-N1762 WeakPolarHBondContact CG1-ND2 3.49Å; V1727-N1762 WeakPolarHBondContact CG2-ND2 3.17Å; V1727-F1767 HydrophobicContact CG1-CD1 4.25Å; V1727-F1767 HydrophobicContact CG1-CD2 4.49Å; V1727-F1767 HydrophobicContact CG1-CE1 3.86Å; V1727-F1767 HydrophobicContact CG1-CE2 4.07Å; V1727-F1767 HydrophobicContact CG1-CZ 3.76Å
1728	Y	73.6	Confident	53.3	Low	157 Å²	157	113 Å²	113	62%	0.616	56%	0.556	S	S	*	*			trans	-132.7	152.9	179.6	-66.6	-83.1	0	0	0	111	L1726 F1767	L1726-Y1728 HydrophobicContact CB-CD2 4.19Å; L1726-Y1728 HydrophobicContact CB-CE2 3.52Å; L1726-Y1728 HydrophobicContact CD2-CE2 4.36Å; L1726-Y1728 WeakPolarHBondContact CD2-OH 3.06Å; Y1728-F1767 WeakPolarHBondContact O-CZ 3.19Å
1729	C	70.3	Confident	55.4	Low	5 Å²	5	115.4 Å²	115.4	3%	0.034	56%	0.564	C	S	.	*			trans	-75.1	145.8	163.8	-58.6	0	0	0	0	110.1	D1731 G1732 E1733 I1734 P1735 C1769	C1729-D1731 PolarHBondContact O-N 3.29Å; C1729-G1732 PolarHBondContact O-N 3.47Å; C1729-G1732 VanDerWaalsContact O-N 3.08Å; C1729-E1733 HydrophobicContact CB-CB 4.4Å; C1729-E1733 WeakPolarHBondContact CB-O 3.34Å; C1729-E1733 PolarHBondContact SG-O 2.76Å; C1729-I1734 VanDerWaalsContact SG-C 3.6Å; C1729-P1735 WeakPolarHBondContact SG-CA 3.02Å; C1729-P1735 VanDerWaalsContact SG-N 3.37Å; C1729-C1769 HydrophobicContact CB-CB 3.81Å; C1729-C1769 WeakPolarHBondContact CB-SG 3.22Å; C1729-C1769 WeakPolarHBondContact SG-CB 3.3Å; C1729-C1769 CovalentContact SG-SG 2.01Å; C1729-C1769 PolarHBondContact SG-SG 3.47Å
1730	P	65.2	Low	57.3	Low	94 Å²	94	110.7 Å²	110.7	61%	0.61	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-25.8	178.1	28	-34.6	0	0	0	112.7	G1732 Y1760	P1730-G1732 PolarHBondContact O-N 3.24Å; P1730-Y1760 HydrophobicContact CG-CD1 3.43Å; P1730-Y1760 VanDerWaalsContact CG-CD1 3.43Å; P1730-Y1760 HydrophobicContact CG-CE1 3.52Å; P1730-Y1760 HydrophobicContact CG-CG 3.98Å
1731	D	64.3	Low	59.3	Low	98 Å²	98	106.6 Å²	106.6	52%	0.524	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	2.4	176.4	-51.3	-47.6	0	0	0	112.8	C1729 E1733 Y1760	C1729-D1731 PolarHBondContact O-N 3.29Å; D1731-E1733 PolarHBondContact O-N 2.61Å; D1731-Y1760 PolarHBondContact OD2-OH 2.99Å
1732	G	61.9	Low	61.7	Low	64 Å²	64	101.8 Å²	101.8	66%	0.66	51%	0.514	S	S	*	.	S	Bend	trans	80.9	-12	-178.2	0	0	0	0	0	115.5	C1729 P1730	C1729-G1732 PolarHBondContact O-N 3.47Å; C1729-G1732 VanDerWaalsContact O-N 3.08Å; P1730-G1732 PolarHBondContact O-N 3.24Å
1733	E	65.4	Low	63.8	Low	62 Å²	62	98.3 Å²	98.3	29%	0.29	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-60.8	161.3	172.8	-71.4	-159.7	-150.8	0	0	112.7	C1729 D1731 S1770	C1729-E1733 HydrophobicContact CB-CB 4.4Å; C1729-E1733 WeakPolarHBondContact CB-O 3.34Å; C1729-E1733 PolarHBondContact SG-O 2.76Å; D1731-E1733 PolarHBondContact O-N 2.61Å; E1733-S1770 WeakPolarHBondContact OE2-CA 3.37Å; E1733-S1770 WeakPolarHBondContact OE2-CB 3.36Å; E1733-S1770 PolarHBondContact OE2-OG 3.47Å
1734	I	68.7	Low	66.3	Low	133 Å²	133	90.2 Å²	90.2	68%	0.682	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-73.7	129.3	176.5	-53.6	178.7	0	0	0	108.7	C1729 M1736	C1729-I1734 VanDerWaalsContact SG-C 3.6Å; I1734-M1736 PolarHBondContact O-N 2.05Å
1735	P	75.8	Confident	68.4	Low	7 Å²	7	87.4 Å²	87.4	5%	0.045	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-53.5	127.2	168.7	-27.1	35.8	0	0	0	110.7	V1727 C1729 Q1737 L1743 F1767	V1727-P1735 HydrophobicContact CG1-CG 4.28Å; V1727-P1735 WeakPolarHBondContact O-CG 3.12Å; C1729-P1735 WeakPolarHBondContact SG-CA 3.02Å; C1729-P1735 VanDerWaalsContact SG-N 3.37Å; P1735-Q1737 PolarHBondContact O-N 3.47Å; P1735-L1743 HydrophobicContact CB-CD2 3.33Å; P1735-L1743 HydrophobicContact CG-CD2 4.31Å; P1735-F1767 HydrophobicContact CB-CD2 3.76Å; P1735-F1767 HydrophobicContact CB-CE2 3.88Å; P1735-F1767 HydrophobicContact CG-CD2 4.35Å; P1735-F1767 HydrophobicContact CG-CE2 3.96Å
1736	M	71.8	Confident	70.3	Confident	55 Å²	55	78.3 Å²	78.3	27%	0.271	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-58.8	125.6	177.8	-66.1	-164.8	77	0	0	109.1	I1734 V1744 P1754 S1757 C1768	I1734-M1736 PolarHBondContact O-N 2.05Å; M1736-V1744 HydrophobicContact CB-CB 4.03Å; M1736-V1744 HydrophobicContact CB-CG2 3.92Å; M1736-V1744 WeakPolarHBondContact O-CB 3.1Å; M1736-V1744 WeakPolarHBondContact O-CG2 3.46Å; M1736-V1744 PolarHBondContact O-N 2.93Å; M1736-P1754 HydrophobicContact CE-CG 3.64Å; M1736-P1754 HydrophobicContact SD-CG 3.8Å; M1736-S1757 WeakPolarHBondContact SD-CB 3.28Å; M1736-C1768 HydrophobicContact CB-CB 4.14Å; M1736-C1768 WeakPolarHBondContact CB-O 3.37Å; M1736-C1768 HydrophobicContact CG-CB 4.26Å; M1736-C1768 PolarHBondContact N-O 2.78Å; M1736-C1768 HydrophobicContact SD-CB 4.08Å
1737	Q	77.6	Confident	71.5	Confident	104 Å²	104	76.8 Å²	76.8	49%	0.486	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-121.3	145.1	176.4	-70.3	166.4	30.1	0	0	109	P1735 G1741 T1742 L1743	P1735-Q1737 PolarHBondContact O-N 3.47Å; Q1737-G1741 PolarHBondContact OE1-O 2.58Å; Q1737-T1742 CarbonylContact C-O 3.53Å; Q1737-T1742 VanDerWaalsContact CA-O 3.31Å; Q1737-T1742 WeakPolarHBondContact CA-O 3.25Å; Q1737-L1743 HydrophobicContact CG-CD2 4.06Å
1738	Y	72.7	Confident	71.6	Confident	111 Å²	111	76.6 Å²	76.6	44%	0.435	40%	0.398	S	S	.	.			trans	-64.5	164.2	162.2	-62.4	-73.3	0	0	0	109.5	N1740 G1741 T1742 V1744	Y1738-N1740 WeakPolarHBondContact CB-OD1 3.43Å; Y1738-N1740 PolarHBondContact O-N 3.05Å; Y1738-G1741 PolarHBondContact O-N 3.09Å; Y1738-T1742 HydrophobicContact CD2-CG2 4.4Å; Y1738-T1742 WeakPolarHBondContact CD2-O 3.12Å; Y1738-T1742 PolarHBondContact N-O 3.38Å; Y1738-V1744 HydrophobicContact CD1-CG2 4.24Å; Y1738-V1744 HydrophobicContact CD2-CG2 4.07Å; Y1738-V1744 HydrophobicContact CE1-CG2 4.15Å; Y1738-V1744 HydrophobicContact CE2-CB 4.35Å; Y1738-V1744 HydrophobicContact CE2-CG2 3.99Å; Y1738-V1744 HydrophobicContact CG-CG2 4.21Å
1739	K	64.3	Low	71.1	Confident	230 Å²	230	72.8 Å²	72.8	100%	1	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-11	-179.4	-71	-170.2	175.1	-172.9	0	115.5
1740	N	63.2	Low	70.6	Confident	89 Å²	89	78 Å²	78	48%	0.476	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	16.6	176.7	68	-2.3	0	0	0	113.5	T591 Y1738 T1742	T591-N1740 PolarHBondContact O-ND2 2.84Å; T591-N1740 VanDerWaalsContact O-ND2 3.16Å; Y1738-N1740 WeakPolarHBondContact CB-OD1 3.43Å; Y1738-N1740 PolarHBondContact O-N 3.05Å; N1740-T1742 PolarHBondContact ND2-OG1 2.9Å; N1740-T1742 PolarHBondContact O-N 3.05Å; N1740-T1742 VanDerWaalsContact O-N 3.14Å; N1740-T1742 WeakPolarHBondContact OD1-CB 3.45Å; N1740-T1742 PolarHBondContact OD1-N 3.34Å; N1740-T1742 PolarHBondContact OD1-OG1 3.02Å
1741	G	69.7	Low	70	Confident	43 Å²	43	80.8 Å²	80.8	44%	0.443	44%	0.44	S	S	.	.	S	Bend	trans	73.2	-3.1	-178.3	0	0	0	0	0	115.3	Q1737 Y1738 L1743	Q1737-G1741 PolarHBondContact OE1-O 2.58Å; Y1738-G1741 PolarHBondContact O-N 3.09Å; G1741-L1743 PolarHBondContact O-N 3.31Å
1742	T	75.6	Confident	70.6	Confident	40 Å²	40	82 Å²	82	25%	0.245	44%	0.44	C	S	.	.			trans	-71.6	122.7	177.8	-58	0	0	0	0	109.4	T591 Q1737 Y1738 N1740 V1744	T591-T1742 PolarHBondContact OG1-OG1 3.25Å; Q1737-T1742 CarbonylContact C-O 3.53Å; Q1737-T1742 VanDerWaalsContact CA-O 3.31Å; Q1737-T1742 WeakPolarHBondContact CA-O 3.25Å; Y1738-T1742 HydrophobicContact CD2-CG2 4.4Å; Y1738-T1742 WeakPolarHBondContact CD2-O 3.12Å; Y1738-T1742 PolarHBondContact N-O 3.38Å; N1740-T1742 PolarHBondContact ND2-OG1 2.9Å; N1740-T1742 PolarHBondContact O-N 3.05Å; N1740-T1742 VanDerWaalsContact O-N 3.14Å; N1740-T1742 WeakPolarHBondContact OD1-CB 3.45Å; N1740-T1742 PolarHBondContact OD1-N 3.34Å; N1740-T1742 PolarHBondContact OD1-OG1 3.02Å; T1742-V1744 PolarHBondContact O-N 2.93Å
1743	L	75.3	Confident	71.6	Confident	33 Å²	33	79.9 Å²	79.9	17%	0.173	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-51.3	132	173.3	-70.5	165.3	0	0	0	111.3	V1727 P1735 Q1737 G1741 R1745 F1767	V1727-L1743 HydrophobicContact CB-CD1 4.24Å; V1727-L1743 HydrophobicContact CG1-CD1 4.07Å; V1727-L1743 HydrophobicContact CG1-CD2 4.42Å; V1727-L1743 HydrophobicContact CG2-CD1 4.13Å; P1735-L1743 HydrophobicContact CB-CD2 3.33Å; P1735-L1743 HydrophobicContact CG-CD2 4.31Å; Q1737-L1743 HydrophobicContact CG-CD2 4.06Å; G1741-L1743 PolarHBondContact O-N 3.31Å; L1743-R1745 VanDerWaalsContact C-N 3.34Å; L1743-R1745 PolarHBondContact O-N 3.31Å; L1743-F1767 HydrophobicContact CB-CB 4.23Å; L1743-F1767 HydrophobicContact CD2-CB 4.43Å; L1743-F1767 HydrophobicContact CD2-CD2 4.39Å; L1743-F1767 HydrophobicContact CD2-CG 4.48Å
1744	V	83.1	Confident	72.1	Confident	14 Å²	14	80 Å²	80	9%	0.085	42%	0.421	C	S	.	.			trans	-69.8	93	172.5	179.5	0	0	0	0	107.6	M1736 Y1738 T1742 F1767 C1768	M1736-V1744 HydrophobicContact CB-CB 4.03Å; M1736-V1744 HydrophobicContact CB-CG2 3.92Å; M1736-V1744 WeakPolarHBondContact O-CB 3.1Å; M1736-V1744 WeakPolarHBondContact O-CG2 3.46Å; M1736-V1744 PolarHBondContact O-N 2.93Å; Y1738-V1744 HydrophobicContact CD1-CG2 4.24Å; Y1738-V1744 HydrophobicContact CD2-CG2 4.07Å; Y1738-V1744 HydrophobicContact CE1-CG2 4.15Å; Y1738-V1744 HydrophobicContact CE2-CB 4.35Å; Y1738-V1744 HydrophobicContact CE2-CG2 3.99Å; Y1738-V1744 HydrophobicContact CG-CG2 4.21Å; T1742-V1744 PolarHBondContact O-N 2.93Å; V1744-F1767 CarbonylContact O-C 3.5Å; V1744-F1767 VanDerWaalsContact O-CA 3.28Å; V1744-F1767 WeakPolarHBondContact O-CA 2.8Å; V1744-C1768 HydrophobicContact CB-CB 4.27Å; V1744-C1768 HydrophobicContact CG1-CB 4.14Å; V1744-C1768 PolarHBondContact O-N 3.44Å
1745	R	83.8	Confident	72.3	Confident	137 Å²	137	80.7 Å²	80.7	52%	0.517	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-67.4	147.8	-179	-72	170.2	176	-96.4	-11.9	111.3	L1743 D1765 Y1766	L1743-R1745 VanDerWaalsContact C-N 3.34Å; L1743-R1745 PolarHBondContact O-N 3.31Å; R1745-D1765 IonicContact CZ-OD1 3.61Å; R1745-D1765 IonicContact CZ-OD2 2.8Å; R1745-D1765 VanDerWaalsContact CZ-OD2 3.31Å; R1745-D1765 IonicContact NH1-OD1 2.79Å; R1745-D1765 PolarHBondContact NH1-OD1 3.25Å; R1745-D1765 IonicContact NH1-OD2 3.16Å; R1745-D1765 PolarHBondContact NH1-OD2 2.06Å; R1745-D1765 IonicContact NH2-OD1 3.8Å; R1745-D1765 IonicContact NH2-OD2 3.7Å; R1745-D1765 PolarHBondContact NH2-OD2 3.49Å; R1745-Y1766 VanDerWaalsContact CA-O 3.28Å; R1745-Y1766 WeakPolarHBondContact CA-O 3.46Å
1746	C	81.3	Confident	72.1	Confident	7 Å²	7	87.4 Å²	87.4	5%	0.047	46%	0.46	C	S	.	.			trans	-141.4	178.1	179.6	61.4	0	0	0	0	111.3	F1752 C1753 C1759 Y1766 F1767	C1746-F1752 HydrophobicContact CB-CB 4.45Å; C1746-C1753 VanDerWaalsContact CB-SG 3.56Å; C1746-C1759 HydrophobicContact CB-CB 3.81Å; C1746-C1759 WeakPolarHBondContact CB-SG 3.41Å; C1746-C1759 WeakPolarHBondContact SG-CA 2.99Å; C1746-C1759 WeakPolarHBondContact SG-CB 3.35Å; C1746-C1759 CovalentContact SG-SG 2.03Å; C1746-C1759 PolarHBondContact SG-SG 3.44Å; C1746-Y1766 PolarHBondContact N-O 2.86Å; C1746-Y1766 VanDerWaalsContact N-O 3.15Å; C1746-Y1766 WeakPolarHBondContact O-CB 3.3Å; C1746-F1767 VanDerWaalsContact SG-CA 3.58Å; C1746-F1767 PolarHBondContact SG-N 3.46Å; C1746-F1767 PolarHBondContact SG-O 3.39Å; C1746-F1767 VanDerWaalsContact SG-O 3.34Å
1747	L	74.8	Confident	72.4	Confident	81 Å²	81	85.7 Å²	85.7	42%	0.424	45%	0.454	S	S	.	.			trans	-138.3	142.2	171.1	-69.5	174.2	0	0	0	109.8	G1749 Q1750 Y1766	L1747-G1749 PolarHBondContact O-N 3.21Å; L1747-Q1750 PolarHBondContact O-N 3.46Å; L1747-Y1766 HydrophobicContact CD2-CD2 4.3Å
1748	P	65.7	Low	72.5	Confident	44 Å²	44	88 Å²	88	29%	0.286	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	124.1	178.6	-24.4	33.3	0	0	0	112	Y1766	P1748-Y1766 HydrophobicContact CG-CD1 3.86Å; P1748-Y1766 HydrophobicContact CG-CE1 3.28Å; P1748-Y1766 HydrophobicContact CG-CE2 4.27Å
1749	G	63.4	Low	73	Confident	77 Å²	77	84.9 Å²	84.9	79%	0.794	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	4.1	175.4	0	0	0	0	0	116.6	L1747	L1747-G1749 PolarHBondContact O-N 3.21Å
1750	Q	58.7	Low	73.9	Confident	116 Å²	116	76.1 Å²	76.1	54%	0.542	41%	0.413	S	S	.	.	S	Bend	trans	-106.9	3.4	176.2	-61.7	-166.2	30.8	0	0	114.6	L1747 F1752	L1747-Q1750 PolarHBondContact O-N 3.46Å; Q1750-F1752 HydrophobicContact CB-CD2 3.75Å; Q1750-F1752 HydrophobicContact CB-CE2 3.52Å; Q1750-F1752 HydrophobicContact CB-CZ 4.19Å; Q1750-F1752 HydrophobicContact CG-CE2 4.32Å; Q1750-F1752 PolarHBondContact O-N 3.02Å
1751	N	53.8	Low	74.7	Confident	151 Å²	151	75.8 Å²	75.8	81%	0.807	41%	0.407	S	S	*	.			trans	51.3	29.8	172.8	-66.4	1.1	0	0	0	116.3	C1753	N1751-C1753 PolarHBondContact O-N 3.03Å; N1751-C1753 VanDerWaalsContact O-N 3.14Å
1752	F	76.8	Confident	74.5	Confident	123 Å²	123	76.7 Å²	76.7	54%	0.539	40%	0.402	S	S	.	.			trans	-67.3	-7.4	176.6	-69.9	-57.3	0	0	0	115.2	C1746 Q1750	C1746-F1752 HydrophobicContact CB-CB 4.45Å; Q1750-F1752 HydrophobicContact CB-CD2 3.75Å; Q1750-F1752 HydrophobicContact CB-CE2 3.52Å; Q1750-F1752 HydrophobicContact CB-CZ 4.19Å; Q1750-F1752 HydrophobicContact CG-CE2 4.32Å; Q1750-F1752 PolarHBondContact O-N 3.02Å
1753	C	82.3	Confident	74	Confident	21 Å²	21	77 Å²	77	14%	0.142	41%	0.413	C	S	.	.	S	Bend	trans	-81.9	132.2	176.4	-62.8	0	0	0	0	110.4	C1746 N1751 S1757 C1768	C1746-C1753 VanDerWaalsContact CB-SG 3.56Å; N1751-C1753 PolarHBondContact O-N 3.03Å; N1751-C1753 VanDerWaalsContact O-N 3.14Å; C1753-S1757 VanDerWaalsContact CB-OG 3.3Å; C1753-S1757 WeakPolarHBondContact CB-OG 3.4Å; C1753-C1768 WeakPolarHBondContact CA-SG 3.4Å; C1753-C1768 HydrophobicContact CB-CB 3.81Å; C1753-C1768 WeakPolarHBondContact CB-SG 2.99Å; C1753-C1768 WeakPolarHBondContact SG-CB 3.31Å; C1753-C1768 CovalentContact SG-SG 2.04Å; C1753-C1768 PolarHBondContact SG-SG 2.8Å
1754	P	76.5	Confident	73.6	Confident	63 Å²	63	82.7 Å²	82.7	41%	0.409	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-60.8	165	-179.3	24.5	-34.1	0	0	0	113.1	M1736 K1756 S1757	M1736-P1754 HydrophobicContact CE-CG 3.64Å; M1736-P1754 HydrophobicContact SD-CG 3.8Å; P1754-K1756 PolarHBondContact O-N 3.29Å; P1754-S1757 WeakPolarHBondContact CD-OG 3.3Å; P1754-S1757 WeakPolarHBondContact CG-OG 3.39Å; P1754-S1757 VanDerWaalsContact N-OG 3.12Å; P1754-S1757 PolarHBondContact O-N 2.94Å; P1754-S1757 PolarHBondContact O-OG 3.47Å
1755	V	72.1	Confident	73.1	Confident	148 Å²	148	84.8 Å²	84.8	90%	0.897	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	133.2	-177.5	-169.4	0	0	0	0	110.7
1756	K	71	Confident	73.3	Confident	149 Å²	149	81.6 Å²	81.6	65%	0.648	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	40.1	-166.6	-54	-171.5	179.2	-172.9	0	115.1	P1754 S1770 T1771	P1754-K1756 PolarHBondContact O-N 3.29Å; K1756-S1770 CarbonylContact O-C 3.37Å; K1756-S1770 WeakPolarHBondContact O-CA 3.49Å; K1756-T1771 PolarHBondContact O-N 3.02Å; K1756-T1771 PolarHBondContact O-OG1 2.84Å
1757	S	79.2	Confident	73.4	Confident	19 Å²	19	81.3 Å²	81.3	13%	0.133	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	156.7	167.2	66.4	0	0	0	0	112.8	M1736 C1753 P1754 C1769	M1736-S1757 WeakPolarHBondContact SD-CB 3.28Å; C1753-S1757 VanDerWaalsContact CB-OG 3.3Å; C1753-S1757 WeakPolarHBondContact CB-OG 3.4Å; P1754-S1757 WeakPolarHBondContact CD-OG 3.3Å; P1754-S1757 WeakPolarHBondContact CG-OG 3.39Å; P1754-S1757 VanDerWaalsContact N-OG 3.12Å; P1754-S1757 PolarHBondContact O-N 2.94Å; P1754-S1757 PolarHBondContact O-OG 3.47Å; S1757-C1769 CarbonylContact C-O 3.48Å; S1757-C1769 WeakPolarHBondContact CA-O 3.37Å; S1757-C1769 WeakPolarHBondContact CB-O 3.42Å
1758	R	79.6	Confident	74	Confident	152 Å²	152	77.5 Å²	77.5	57%	0.574	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.2	-175.3	-75.2	179.3	179.3	173.2	2.5	112	Y1760 C1768 C1769 T1771	R1758-Y1760 HydrophobicContact CB-CD2 4.28Å; R1758-Y1760 HydrophobicContact CB-CE2 3.68Å; R1758-C1768 CarbonylContact O-C 3.48Å; R1758-C1768 VanDerWaalsContact O-CA 3.25Å; R1758-C1768 WeakPolarHBondContact O-CA 3.07Å; R1758-C1769 PolarHBondContact N-O 3.4Å; R1758-C1769 PolarHBondContact O-N 3.49Å; R1758-T1771 HydrophobicContact CB-CG2 4.28Å; R1758-T1771 HydrophobicContact CG-CG2 3.77Å
1759	C	83.1	Confident	74.8	Confident	45 Å²	45	75.4 Å²	75.4	30%	0.304	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.1	179.3	-174	0	0	0	0	111.4	C1746	C1746-C1759 HydrophobicContact CB-CB 3.81Å; C1746-C1759 WeakPolarHBondContact CB-SG 3.41Å; C1746-C1759 WeakPolarHBondContact SG-CA 2.99Å; C1746-C1759 WeakPolarHBondContact SG-CB 3.35Å; C1746-C1759 CovalentContact SG-SG 2.03Å; C1746-C1759 PolarHBondContact SG-SG 3.44Å
1760	Y	82.6	Confident	75.6	Confident	47 Å²	47	73.5 Å²	73.5	18%	0.184	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	166.8	-179.1	-71.1	-74	0	0	0	111.8	P1730 D1731 R1758 Y1766 F1767 C1769	P1730-Y1760 HydrophobicContact CG-CD1 3.43Å; P1730-Y1760 VanDerWaalsContact CG-CD1 3.43Å; P1730-Y1760 HydrophobicContact CG-CE1 3.52Å; P1730-Y1760 HydrophobicContact CG-CG 3.98Å; D1731-Y1760 PolarHBondContact OD2-OH 2.99Å; R1758-Y1760 HydrophobicContact CB-CD2 4.28Å; R1758-Y1760 HydrophobicContact CB-CE2 3.68Å; Y1760-Y1766 CarbonylContact O-C 3.45Å; Y1760-Y1766 VanDerWaalsContact O-CA 3.23Å; Y1760-Y1766 WeakPolarHBondContact O-CA 3.41Å; Y1760-F1767 PolarHBondContact N-O 2.68Å; Y1760-F1767 PolarHBondContact O-N 3.2Å; Y1760-C1769 HydrophobicContact CD2-CB 3.63Å; Y1760-C1769 VanDerWaalsContact CD2-SG 3.52Å; Y1760-C1769 HydrophobicContact CE2-CB 3.8Å
1761	F	81.3	Confident	75.9	Confident	81 Å²	81	70.5 Å²	70.5	36%	0.355	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	126.2	-176.5	-175.7	-111.8	0	0	0	110.5	G1763 D1765 Y1766	F1761-G1763 WeakPolarHBondContact CZ-O 3.21Å; F1761-D1765 WeakPolarHBondContact CA-O 3.38Å; F1761-D1765 VanDerWaalsContact CD2-C 3.45Å; F1761-D1765 VanDerWaalsContact CD2-O 3.22Å; F1761-D1765 WeakPolarHBondContact CD2-O 3.19Å; F1761-Y1766 HydrophobicContact CB-CD1 3.67Å; F1761-Y1766 HydrophobicContact CB-CE1 3.61Å; F1761-Y1766 AromaticContact CD2-CD1 3.67Å; F1761-Y1766 HydrophobicContact CD2-CD1 3.67Å; F1761-Y1766 AromaticContact CD2-CD2 3.85Å; F1761-Y1766 HydrophobicContact CD2-CD2 3.85Å; F1761-Y1766 AromaticContact CD2-CE1 3.68Å; F1761-Y1766 HydrophobicContact CD2-CE1 3.68Å; F1761-Y1766 AromaticContact CD2-CE2 3.87Å; F1761-Y1766 HydrophobicContact CD2-CE2 3.87Å; F1761-Y1766 AromaticContact CD2-CG 3.75Å; F1761-Y1766 HydrophobicContact CD2-CG 3.75Å; F1761-Y1766 AromaticContact CD2-CZ 3.78Å; F1761-Y1766 HydrophobicContact CE2-CD2 4.22Å; F1761-Y1766 HydrophobicContact CE2-CE2 4.09Å; F1761-Y1766 HydrophobicContact CG-CD1 4.05Å; F1761-Y1766 AromaticContact CG-CE1 3.82Å; F1761-Y1766 HydrophobicContact CG-CE1 3.82Å
1762	N	64.5	Low	75.7	Confident	62 Å²	62	66.1 Å²	66.1	33%	0.332	36%	0.355	S	S	.	.			trans	-92.3	-2.6	-176.4	61.8	8.9	0	0	0	114.2	V1727 L1764 D1765 F1767	V1727-N1762 HydrophobicContact CG1-CB 4.24Å; V1727-N1762 WeakPolarHBondContact CG1-ND2 3.49Å; V1727-N1762 WeakPolarHBondContact CG2-ND2 3.17Å; N1762-L1764 PolarHBondContact OD1-N 3.44Å; N1762-D1765 PolarHBondContact N-O 3.1Å; N1762-D1765 PolarHBondContact OD1-N 2.92Å; N1762-D1765 PolarHBondContact OD1-O 3.07Å; N1762-F1767 HydrophobicContact CB-CE1 3.7Å; N1762-F1767 HydrophobicContact CB-CZ 4.32Å
1763	G	64.8	Low	73.6	Confident	47 Å²	47	69.5 Å²	69.5	49%	0.485	37%	0.373	S	S	.	.	S	Bend	trans	109.5	-18.5	-172	0	0	0	0	0	113.8	F1761	F1761-G1763 WeakPolarHBondContact CZ-O 3.21Å
1764	L	67.8	Low	71	Confident	153 Å²	153	77.9 Å²	77.9	80%	0.801	40%	0.403	S	S	*	.	S	Bend	trans	-122.9	-41.1	178.1	-63.3	173.9	0	0	0	112.3	N1762	N1762-L1764 PolarHBondContact OD1-N 3.44Å
1765	D	71.8	Confident	68.4	Low	57 Å²	57	81.5 Å²	81.5	31%	0.305	41%	0.414	S	S	.	.			trans	-141.8	155.3	-170.8	-93.8	-45.4	0	0	0	113.4	R1745 F1761 N1762	R1745-D1765 IonicContact CZ-OD1 3.61Å; R1745-D1765 IonicContact CZ-OD2 2.8Å; R1745-D1765 VanDerWaalsContact CZ-OD2 3.31Å; R1745-D1765 IonicContact NH1-OD1 2.79Å; R1745-D1765 PolarHBondContact NH1-OD1 3.25Å; R1745-D1765 IonicContact NH1-OD2 3.16Å; R1745-D1765 PolarHBondContact NH1-OD2 2.06Å; R1745-D1765 IonicContact NH2-OD1 3.8Å; R1745-D1765 IonicContact NH2-OD2 3.7Å; R1745-D1765 PolarHBondContact NH2-OD2 3.49Å; F1761-D1765 WeakPolarHBondContact CA-O 3.38Å; F1761-D1765 VanDerWaalsContact CD2-C 3.45Å; F1761-D1765 VanDerWaalsContact CD2-O 3.22Å; F1761-D1765 WeakPolarHBondContact CD2-O 3.19Å; N1762-D1765 PolarHBondContact N-O 3.1Å; N1762-D1765 PolarHBondContact OD1-N 2.92Å; N1762-D1765 PolarHBondContact OD1-O 3.07Å
1766	Y	87.5	Confident	66.3	Low	70 Å²	70	81.4 Å²	81.4	28%	0.275	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.1	175	-71.7	-77.4	0	0	0	111.8	R1745 C1746 L1747 P1748 Y1760 F1761	R1745-Y1766 VanDerWaalsContact CA-O 3.28Å; R1745-Y1766 WeakPolarHBondContact CA-O 3.46Å; C1746-Y1766 PolarHBondContact N-O 2.86Å; C1746-Y1766 VanDerWaalsContact N-O 3.15Å; C1746-Y1766 WeakPolarHBondContact O-CB 3.3Å; L1747-Y1766 HydrophobicContact CD2-CD2 4.3Å; P1748-Y1766 HydrophobicContact CG-CD1 3.86Å; P1748-Y1766 HydrophobicContact CG-CE1 3.28Å; P1748-Y1766 HydrophobicContact CG-CE2 4.27Å; Y1760-Y1766 CarbonylContact O-C 3.45Å; Y1760-Y1766 VanDerWaalsContact O-CA 3.23Å; Y1760-Y1766 WeakPolarHBondContact O-CA 3.41Å; F1761-Y1766 HydrophobicContact CB-CD1 3.67Å; F1761-Y1766 HydrophobicContact CB-CE1 3.61Å; F1761-Y1766 AromaticContact CD2-CD1 3.67Å; F1761-Y1766 HydrophobicContact CD2-CD1 3.67Å; F1761-Y1766 AromaticContact CD2-CD2 3.85Å; F1761-Y1766 HydrophobicContact CD2-CD2 3.85Å; F1761-Y1766 AromaticContact CD2-CE1 3.68Å; F1761-Y1766 HydrophobicContact CD2-CE1 3.68Å; F1761-Y1766 AromaticContact CD2-CE2 3.87Å; F1761-Y1766 HydrophobicContact CD2-CE2 3.87Å; F1761-Y1766 AromaticContact CD2-CG 3.75Å; F1761-Y1766 HydrophobicContact CD2-CG 3.75Å; F1761-Y1766 AromaticContact CD2-CZ 3.78Å; F1761-Y1766 HydrophobicContact CE2-CD2 4.22Å; F1761-Y1766 HydrophobicContact CE2-CE2 4.09Å; F1761-Y1766 HydrophobicContact CG-CD1 4.05Å; F1761-Y1766 AromaticContact CG-CE1 3.82Å; F1761-Y1766 HydrophobicContact CG-CE1 3.82Å
1767	F	85	Confident	64	Low	2 Å²	2	81.1 Å²	81.1	1%	0.009	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	159	-176	61.5	-79.2	0	0	0	112.9	V1727 Y1728 P1735 L1743 V1744 C1746 Y1760 N1762 C1769	V1727-F1767 HydrophobicContact CG1-CD1 4.25Å; V1727-F1767 HydrophobicContact CG1-CD2 4.49Å; V1727-F1767 HydrophobicContact CG1-CE1 3.86Å; V1727-F1767 HydrophobicContact CG1-CE2 4.07Å; V1727-F1767 HydrophobicContact CG1-CZ 3.76Å; Y1728-F1767 WeakPolarHBondContact O-CZ 3.19Å; P1735-F1767 HydrophobicContact CB-CD2 3.76Å; P1735-F1767 HydrophobicContact CB-CE2 3.88Å; P1735-F1767 HydrophobicContact CG-CD2 4.35Å; P1735-F1767 HydrophobicContact CG-CE2 3.96Å; L1743-F1767 HydrophobicContact CB-CB 4.23Å; L1743-F1767 HydrophobicContact CD2-CB 4.43Å; L1743-F1767 HydrophobicContact CD2-CD2 4.39Å; L1743-F1767 HydrophobicContact CD2-CG 4.48Å; V1744-F1767 CarbonylContact O-C 3.5Å; V1744-F1767 VanDerWaalsContact O-CA 3.28Å; V1744-F1767 WeakPolarHBondContact O-CA 2.8Å; C1746-F1767 VanDerWaalsContact SG-CA 3.58Å; C1746-F1767 PolarHBondContact SG-N 3.46Å; C1746-F1767 PolarHBondContact SG-O 3.39Å; C1746-F1767 VanDerWaalsContact SG-O 3.34Å; Y1760-F1767 PolarHBondContact N-O 2.68Å; Y1760-F1767 PolarHBondContact O-N 3.2Å; N1762-F1767 HydrophobicContact CB-CE1 3.7Å; N1762-F1767 HydrophobicContact CB-CZ 4.32Å; F1767-C1769 VanDerWaalsContact CE2-SG 3.53Å
1768	C	87.1	Confident	61.5	Low	0 Å²	0	86.4 Å²	86.4	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.6	-179.4	-57.9	0	0	0	0	113.2	M1736 V1744 C1753 R1758	M1736-C1768 HydrophobicContact CB-CB 4.14Å; M1736-C1768 WeakPolarHBondContact CB-O 3.37Å; M1736-C1768 HydrophobicContact CG-CB 4.26Å; M1736-C1768 PolarHBondContact N-O 2.78Å; M1736-C1768 HydrophobicContact SD-CB 4.08Å; V1744-C1768 HydrophobicContact CB-CB 4.27Å; V1744-C1768 HydrophobicContact CG1-CB 4.14Å; V1744-C1768 PolarHBondContact O-N 3.44Å; C1753-C1768 WeakPolarHBondContact CA-SG 3.4Å; C1753-C1768 HydrophobicContact CB-CB 3.81Å; C1753-C1768 WeakPolarHBondContact CB-SG 2.99Å; C1753-C1768 WeakPolarHBondContact SG-CB 3.31Å; C1753-C1768 CovalentContact SG-SG 2.04Å; C1753-C1768 PolarHBondContact SG-SG 2.8Å; R1758-C1768 CarbonylContact O-C 3.48Å; R1758-C1768 VanDerWaalsContact O-CA 3.25Å; R1758-C1768 WeakPolarHBondContact O-CA 3.07Å
1769	C	82.6	Confident	59	Low	0 Å²	0	83.3 Å²	83.3	0%	0	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.4	171.5	-61.5	0	0	0	0	109	C1729 S1757 R1758 Y1760 F1767	C1729-C1769 HydrophobicContact CB-CB 3.81Å; C1729-C1769 WeakPolarHBondContact CB-SG 3.22Å; C1729-C1769 WeakPolarHBondContact SG-CB 3.3Å; C1729-C1769 CovalentContact SG-SG 2.01Å; C1729-C1769 PolarHBondContact SG-SG 3.47Å; S1757-C1769 CarbonylContact C-O 3.48Å; S1757-C1769 WeakPolarHBondContact CA-O 3.37Å; S1757-C1769 WeakPolarHBondContact CB-O 3.42Å; R1758-C1769 PolarHBondContact N-O 3.4Å; R1758-C1769 PolarHBondContact O-N 3.49Å; Y1760-C1769 HydrophobicContact CD2-CB 3.63Å; Y1760-C1769 VanDerWaalsContact CD2-SG 3.52Å; Y1760-C1769 HydrophobicContact CE2-CB 3.8Å; F1767-C1769 VanDerWaalsContact CE2-SG 3.53Å
1770	S	78.6	Confident	56.7	Low	37 Å²	37	83.9 Å²	83.9	26%	0.259	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	167.8	175.3	30.6	0	0	0	0	112.6	E1733 K1756	E1733-S1770 WeakPolarHBondContact OE2-CA 3.37Å; E1733-S1770 WeakPolarHBondContact OE2-CB 3.36Å; E1733-S1770 PolarHBondContact OE2-OG 3.47Å; K1756-S1770 CarbonylContact O-C 3.37Å; K1756-S1770 WeakPolarHBondContact O-CA 3.49Å
1771	T	65.6	Low	54.1	Low	54 Å²	54	88.3 Å²	88.3	33%	0.331	48%	0.475	S	S	.	.			trans	-144	69.3	175.4	63.5	0	0	0	0	108.9	K1756 R1758	K1756-T1771 PolarHBondContact O-N 3.02Å; K1756-T1771 PolarHBondContact O-OG1 2.84Å; R1758-T1771 HydrophobicContact CB-CG2 4.28Å; R1758-T1771 HydrophobicContact CG-CG2 3.77Å
1772	A	50.7	Low	51.7	Low	58 Å²	58	86.9 Å²	86.9	48%	0.479	47%	0.474	S	S	.	.			trans	-138.9	90.3	-167.1	0	0	0	0	0	113.5	Y1774	A1772-Y1774 PolarHBondContact O-N 2.78Å
1773	E	31	Very low	49.9	Very low	194 Å²	194	89.4 Å²	89.4	91%	0.907	49%	0.491	S	S	*	.			trans	-66	109	167	-58.6	166.7	150	0	0	110.2
1774	Y	28.1	Very low	48.2	Very low	197 Å²	197	96.2 Å²	96.2	77%	0.773	51%	0.507	S	S	*	.			trans	-179.6	123.4	134.3	-120.2	-102.9	0	0	0	113.8	A1772	A1772-Y1774 PolarHBondContact O-N 2.78Å
1775	E	22.8	Very low	46.2	Very low	140 Å²	140	93.8 Å²	93.8	65%	0.654	50%	0.503	S	S	*	.			trans	42.5	155.7	145.2	-65.2	-175.7	163.4	0	0	126
1776	M	26.6	Very low	44.8	Very low	146 Å²	146	95.7 Å²	95.7	72%	0.719	52%	0.519	S	S	*	.			trans	84.7	97.5	155.9	-80.9	172.6	-82.2	0	0	121.6
1777	D	24.7	Very low	42.1	Very low	142 Å²	142	103.2 Å²	103.2	76%	0.759	55%	0.548	S	S	*	.				87.2	134.3	115.8	-75.3	-17.2	0	0	0	124.5
1778	V	25.6	Very low	39.4	Very low	130 Å²	130	112.5 Å²	112.5	79%	0.788	59%	0.589	S	S	*	*			trans	50.1	92.8	155.5	-173.4	0	0	0	0	116.1
1779	A	27.7	Very low	37	Very low	88 Å²	88	121.8 Å²	121.8	73%	0.727	65%	0.653	S	S	*	*				74.5	162.9	58.7	0	0	0	0	0	113.6
1780	P	33.7	Very low	34.7	Very low	57 Å²	57	127.9 Å²	127.9	37%	0.37	69%	0.686	S	S	.	*				-132	-160.4	-106.2	36.1	-14.9	0	0	0	113.1	V113 A114	V113-P1780 WeakPolarHBondContact O-CB 3.49Å; A114-P1780 WeakPolarHBondContact O-CB 3.23Å
1781	H	28.2	Very low	32.4	Very low	139 Å²	139	132.6 Å²	132.6	64%	0.644	71%	0.709	S	S	*	*				179.3	141.6	128.2	-90.5	-48.7	0	0	0	114.6	T115 Q116	T115-H1781 WeakPolarHBondContact CB-O 3.21Å; T115-H1781 PolarHBondContact OG1-O 2.94Å; Q116-H1781 PolarHBondContact NE2-O 3.43Å
1782	P	31.6	Very low	30.6	Very low	52 Å²	52	137 Å²	137	34%	0.338	73%	0.73	S	S	.	*			trans	-104.3	-136	-138.8	5.1	19.9	0	0	0	114	V113 A114 T115	V113-P1782 HydrophobicContact CG1-CB 3.96Å; V113-P1782 HydrophobicContact CG1-CG 3.9Å; A114-P1782 HydrophobicContact CB-CB 4.42Å; T115-P1782 VanDerWaalsContact OG1-CA 3.31Å; T115-P1782 WeakPolarHBondContact OG1-CA 3.11Å
1783	V	26.6	Very low	29.4	Very low	114 Å²	114	141.6 Å²	141.6	69%	0.691	74%	0.744	S	S	*	*			trans	87.4	127.9	164.7	179.3	0	0	0	0	115.3
1784	K	28.3	Very low	29.3	Very low	190 Å²	190	138.4 Å²	138.4	83%	0.826	73%	0.734	S	S	*	*			cis	-158.1	161.7	-10	-119.4	179.3	-157.7	171.9	0	113.2
1785	S	27.3	Very low	29.4	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	73%	0.732	S	S	*	*			trans	-95.2	171.7	155.4	-169.1	0	0	0	0	108
1786	P	40.6	Very low	29.8	Very low	98 Å²	98	134.1 Å²	134.1	64%	0.636	74%	0.737	S	S	*	*			cis	-139	-173.9	11.2	45.1	-27.7	0	0	0	115.9
1787	Y	32.6	Very low	30.1	Very low	228 Å²	228	133.2 Å²	133.2	89%	0.894	74%	0.738	S	S	*	*				-150.2	155	121.7	-111.2	-76.3	0	0	0	111.2
1788	K	27.3	Very low	30.5	Very low	197 Å²	197	132.4 Å²	132.4	86%	0.857	74%	0.737	S	S	*	*			trans	-127.9	139.8	169.8	-82.7	-171.6	174.6	-171.4	0	109.1
1789	S	37	Very low	31	Very low	194 Å²	194	132.6 Å²	132.6	100%	1.357	73%	0.732	S	S	*	*			trans	-155.3	0	146.2	58.1	0	0	0	0	106.7

Retrieved 1,789 of 1,789 residues in 1476.5 ms (Link to these results)

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