A0A087X7T8_POEFO Loading...

Activity-dependent neuroprotector homeobox b

AlphaFold DB , UniProt , Accession A0A087X7T8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,058 aa.

						>A0A087X7T8_POEFO|A0A087X7T8
MFQLPVNNLTSLRKARRNVKKVLGDIGLEFCRDHLQDYKDFNPPEVYIKHTTWEDVCMWEPSHTKVQDYRSKPFCCSGCLFSSKYFSAYKSHFRNVHSEDFENNILLNCPYCTFNGNKKTLETHIKLFHMPNNSVRQGPGAVAAAGAGGIMMKDGLLKRTVDNVEQAVYYCKKCTYRDPLYNVVRKHIYREHFQQVAHPYIVKPGEKTNSHNGGTTESSTTHGGNANQIHCKKCLFVPRTYEALVQHVIEDHERIGYQVTAMIGHTSVIVPRPKPLVMFPAKAQGDKTIIGMGPKGAVMATPRSSASQQLSRAAAAAVAASKAAFNSHSFLTGLKHDSLGLKAGSVQPFSLGNHHIRGTLPGNAQVSVPQQSHAAKQLISTNSLRSPLVAGASSSLKSNPLGSRVQAAATTVAAVTAKKGGSSVLGTSYTQKWKICTICNELFPENVYSAHFEKEHKAEKVPAVANYIMKIHNFTSKCLYCNRYLPSDTLLNHMLIHGLSCPYCRATFNDVEKMVAHMRLSHPEEKVGPRTDSPLTFDLTLQQGNPKNVQLIVTTYNMRDAPEESVAFHAQNSTSSISSNLSASLLGGKRLMPQQPSKTSSGLSDIPQIKSAPQASVPYKRDVGKTLCPLCFSILKGPISDSLAHHLRERHQVIQTVHPVEKKLTYKCIHCLGVYTSNMTASTITLHLVHCRGVGKSQNGQDTRVAQSSRVSQSQSSALKRPGFDSSDTSAPKRRRPGPPGQRAHPRDLNGPSYFEENPNEPVVLALDPKGQESKSYESRKAFLTQYFNRAPYPTQREVDKLASSLWLWRSDVSGHFVGTRRKCVQECESQQPSVLLGFSMHDLSKLRHDLEFDAEDAYEGKHGKQRTSRTRKGLSEQALQRHRELVAANGGVEQPQEGELAGKEEDLLPKPSTVGRDQTKTISSTLPQKMPLDLSEPISIDSESDEEEQQRNDKKPGAAAHIHGNQQFTGSKERLETRTDIKMVSDLDDMSDDDDEDEDDDDDDDDDDEDDEGELVENGFCATENSGRDSLPIIIPKFVPSSARNQRDGAQLGKQQS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	46.3	Very low	237 Å²	237	131.2 Å²	131.2	100%	1.167	70%	0.696	S	S	*	*				0	119.8	0	-76	160	54.7	0	0	109.3
2	F	28.6	Very low	47.5	Very low	212 Å²	212	124.3 Å²	124.3	93%	0.93	66%	0.659	S	S	*	*			trans	-89.4	108.2	166	-76.8	-79.5	0	0	0	109.2	L4	F2-L4 PolarHBondContact O-N 3Å
3	Q	35.3	Very low	48.8	Very low	176 Å²	176	123.3 Å²	123.3	82%	0.822	64%	0.64	S	S	*	*			trans	-76	107.4	171.2	-169.8	169.5	27.3	0	0	108.6
4	L	35.9	Very low	50.1	Low	122 Å²	122	127.2 Å²	127.2	64%	0.639	65%	0.65	S	S	*	*			trans	-52.7	134.4	175.1	-75.7	167.5	0	0	0	109.8	F2 V6	F2-L4 PolarHBondContact O-N 3Å; L4-V6 WeakPolarHBondContact O-CG2 3.1Å; L4-V6 PolarHBondContact O-N 3.11Å
5	P	38.7	Very low	51.3	Low	107 Å²	107	120.1 Å²	120.1	70%	0.695	62%	0.618	S	S	*	*			trans	-66.6	100.9	-174.7	25.5	-33.7	0	0	0	110.5	N7	P5-N7 PolarHBondContact O-N 3.33Å
6	V	54.3	Low	52.4	Low	74 Å²	74	126.3 Å²	126.3	45%	0.448	63%	0.631	S	S	.	*			trans	-68.2	102.3	-174.5	-174.7	0	0	0	0	110	L4 L9 L12	L4-V6 WeakPolarHBondContact O-CG2 3.1Å; L4-V6 PolarHBondContact O-N 3.11Å; V6-L9 HydrophobicContact CB-CD2 4.05Å; V6-L9 HydrophobicContact CG1-CD2 3.93Å; V6-L9 WeakPolarHBondContact O-CG 3.26Å; V6-L12 HydrophobicContact CG1-CD1 3.25Å
7	N	51.8	Low	53.9	Low	131 Å²	131	131.8 Å²	131.8	70%	0.701	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	155.9	174.5	-70.2	-58	0	0	0	111.2	P5 L9 L12	P5-N7 PolarHBondContact O-N 3.33Å; N7-L9 VanDerWaalsContact C-N 3.35Å; N7-L9 PolarHBondContact O-N 3.31Å; N7-L12 WeakPolarHBondContact O-CD1 3.33Å
8	N	54.3	Low	54.7	Low	123 Å²	123	131.6 Å²	131.6	66%	0.658	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.1	35	176.7	-61.7	-35.6	0	0	0	115.8	T10 S11 L12	N8-T10 PolarHBondContact O-N 3.23Å; N8-S11 PolarHBondContact O-N 3.48Å; N8-L12 PolarHBondContact O-N 3.02Å
9	L	59.7	Low	55.7	Low	84 Å²	84	128.4 Å²	128.4	44%	0.44	63%	0.634	S	S	.	*	H	α-helix	trans	-46.3	-34.7	172.1	-75	175	0	0	0	113.9	V6 N7 R13	V6-L9 HydrophobicContact CB-CD2 4.05Å; V6-L9 HydrophobicContact CG1-CD2 3.93Å; V6-L9 WeakPolarHBondContact O-CG 3.26Å; N7-L9 VanDerWaalsContact C-N 3.35Å; N7-L9 PolarHBondContact O-N 3.31Å; L9-R13 VanDerWaalsContact O-CB 3.27Å; L9-R13 WeakPolarHBondContact O-CB 3.17Å; L9-R13 WeakPolarHBondContact O-CD 3.32Å; L9-R13 WeakPolarHBondContact O-CG 3.38Å; L9-R13 PolarHBondContact O-N 2.7Å
10	T	59	Low	56.6	Low	101 Å²	101	126.7 Å²	126.7	62%	0.62	62%	0.623	S	S	*	*	H	α-helix	trans	-63.7	-43.1	176.9	-48.6	0	0	0	0	112.4	N8 K14	N8-T10 PolarHBondContact O-N 3.23Å; T10-K14 WeakPolarHBondContact O-CG 3.34Å; T10-K14 PolarHBondContact O-N 3.28Å
11	S	60.4	Low	57.5	Low	76 Å²	76	127.4 Å²	127.4	53%	0.531	62%	0.622	S	S	.	*	H	α-helix	trans	-73.7	-41	177.2	-54.1	0	0	0	0	111.2	N8 R13 K14 A15	N8-S11 PolarHBondContact O-N 3.48Å; S11-R13 VanDerWaalsContact C-N 3.35Å; S11-R13 PolarHBondContact O-N 3.06Å; S11-K14 CarbonylContact O-C 3.34Å; S11-K14 PolarHBondContact O-N 3.37Å; S11-K14 VanDerWaalsContact O-N 3.15Å; S11-A15 PolarHBondContact O-N 3.4Å
12	L	60.6	Low	59.7	Low	49 Å²	49	120 Å²	120	26%	0.257	59%	0.59	S	S	.	*	H	α-helix	trans	-59.6	-42.4	173.9	-75.2	163.6	0	0	0	112.1	V6 N7 N8 K14 A15 K20 L23	V6-L12 HydrophobicContact CG1-CD1 3.25Å; N7-L12 WeakPolarHBondContact O-CD1 3.33Å; N8-L12 PolarHBondContact O-N 3.02Å; L12-K14 VanDerWaalsContact C-N 3.34Å; L12-K14 PolarHBondContact O-N 3.35Å; L12-A15 WeakPolarHBondContact O-CB 3.41Å; L12-A15 PolarHBondContact O-N 2.66Å; L12-K20 WeakPolarHBondContact O-CE 3.21Å; L12-L23 HydrophobicContact CD2-CD1 3.55Å
13	R	64.6	Low	62	Low	111 Å²	111	113.8 Å²	113.8	42%	0.419	57%	0.566	S	S	.	*	H	α-helix	trans	-62.7	-39.4	174.5	-75.9	168.4	-179.4	178	-1.2	111.8	L9 S11 K20	L9-R13 VanDerWaalsContact O-CB 3.27Å; L9-R13 WeakPolarHBondContact O-CB 3.17Å; L9-R13 WeakPolarHBondContact O-CD 3.32Å; L9-R13 WeakPolarHBondContact O-CG 3.38Å; L9-R13 PolarHBondContact O-N 2.7Å; S11-R13 VanDerWaalsContact C-N 3.35Å; S11-R13 PolarHBondContact O-N 3.06Å; R13-K20 WeakPolarHBondContact O-CE 3.31Å; R13-K20 PolarHBondContact O-NZ 2.73Å
14	K	66.6	Low	64	Low	178 Å²	178	107 Å²	107	77%	0.774	54%	0.544	S	S	*	.	H	α-helix	trans	-73.3	-18.4	175.6	-74.1	-176.5	174.1	-166.4	0	114.8	T10 S11 L12	T10-K14 WeakPolarHBondContact O-CG 3.34Å; T10-K14 PolarHBondContact O-N 3.28Å; S11-K14 CarbonylContact O-C 3.34Å; S11-K14 PolarHBondContact O-N 3.37Å; S11-K14 VanDerWaalsContact O-N 3.15Å; L12-K14 VanDerWaalsContact C-N 3.34Å; L12-K14 PolarHBondContact O-N 3.35Å
15	A	68.4	Low	66	Low	21 Å²	21	104.7 Å²	104.7	17%	0.174	53%	0.532	C	S	.	.	S	Bend	trans	-65.1	145.6	-175.6	0	0	0	0	0	113	S11 L12 V19 K20	S11-A15 PolarHBondContact O-N 3.4Å; L12-A15 WeakPolarHBondContact O-CB 3.41Å; L12-A15 PolarHBondContact O-N 2.66Å; A15-V19 HydrophobicContact CB-CB 4.11Å; A15-V19 HydrophobicContact CB-CG1 3.98Å; A15-K20 HydrophobicContact CB-CG 4.26Å; A15-K20 WeakPolarHBondContact O-CE 3.41Å; A15-K20 PolarHBondContact O-NZ 3.34Å
16	R	69.9	Low	68	Low	218 Å²	218	103.6 Å²	103.6	82%	0.823	52%	0.52	S	S	*	.			trans	-59.3	153.1	174.8	-68.8	-176.5	175.6	-176.7	-2.4	110.8	N18 V19 K20	R16-N18 VanDerWaalsContact C-N 3.25Å; R16-N18 PolarHBondContact O-N 2.7Å; R16-N18 VanDerWaalsContact O-N 3.15Å; R16-V19 HydrophobicContact CB-CG2 4.5Å; R16-V19 PolarHBondContact O-N 3.5Å; R16-K20 PolarHBondContact O-N 3.09Å
17	R	76.9	Confident	69.1	Low	220 Å²	220	101.7 Å²	101.7	83%	0.83	52%	0.515	S	S	*	.	H	α-helix	trans	-51.4	-41.7	-173.8	-166.8	-179	-73.3	-172.9	0.2	112.6	K20 K21	R17-K20 WeakPolarHBondContact O-CB 3.38Å; R17-K20 PolarHBondContact O-N 3.48Å; R17-K21 PolarHBondContact O-N 3.08Å; R17-K21 VanDerWaalsContact O-N 3.15Å
18	N	67.6	Low	70.3	Confident	128 Å²	128	100.4 Å²	100.4	68%	0.684	51%	0.507	S	S	*	.	H	α-helix	trans	-68.3	-36.3	-179.3	-58.8	5.9	0	0	0	112.8	R16 K20 K21 V22	R16-N18 VanDerWaalsContact C-N 3.25Å; R16-N18 PolarHBondContact O-N 2.7Å; R16-N18 VanDerWaalsContact O-N 3.15Å; N18-K20 VanDerWaalsContact C-N 3.34Å; N18-K21 WeakPolarHBondContact O-CB 3.33Å; N18-K21 PolarHBondContact O-N 3.41Å; N18-V22 WeakPolarHBondContact O-CG2 3.23Å; N18-V22 PolarHBondContact O-N 3.37Å
19	V	73.9	Confident	71.5	Confident	71 Å²	71	99.6 Å²	99.6	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-67.4	-37.2	177.1	179.4	0	0	0	0	110.8	A15 R16 K21 L23	A15-V19 HydrophobicContact CB-CB 4.11Å; A15-V19 HydrophobicContact CB-CG1 3.98Å; R16-V19 HydrophobicContact CB-CG2 4.5Å; R16-V19 PolarHBondContact O-N 3.5Å; V19-K21 VanDerWaalsContact C-N 3.33Å; V19-L23 HydrophobicContact CG1-CD1 3.83Å; V19-L23 HydrophobicContact CG1-CG 4.44Å; V19-L23 WeakPolarHBondContact O-CB 3.36Å; V19-L23 VanDerWaalsContact O-CG 3.3Å; V19-L23 WeakPolarHBondContact O-CG 3.19Å; V19-L23 PolarHBondContact O-N 3.4Å
20	K	74.5	Confident	72.4	Confident	95 Å²	95	101.4 Å²	101.4	41%	0.413	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-38.2	172.6	-70.3	165.8	174.4	148.9	0	112	L12 R13 A15 R16 R17 N18 G24	L12-K20 WeakPolarHBondContact O-CE 3.21Å; R13-K20 WeakPolarHBondContact O-CE 3.31Å; R13-K20 PolarHBondContact O-NZ 2.73Å; A15-K20 HydrophobicContact CB-CG 4.26Å; A15-K20 WeakPolarHBondContact O-CE 3.41Å; A15-K20 PolarHBondContact O-NZ 3.34Å; R16-K20 PolarHBondContact O-N 3.09Å; R17-K20 WeakPolarHBondContact O-CB 3.38Å; R17-K20 PolarHBondContact O-N 3.48Å; N18-K20 VanDerWaalsContact C-N 3.34Å; K20-G24 PolarHBondContact O-N 3.48Å; K20-G24 VanDerWaalsContact O-N 3.12Å
21	K	74.6	Confident	73	Confident	141 Å²	141	100 Å²	100	61%	0.613	50%	0.498	S	S	*	.	H	α-helix	trans	-63.4	-56.1	174.9	-170.1	-174.1	171.6	-177	0	110.9	R17 N18 V19 L23 G24 D25	R17-K21 PolarHBondContact O-N 3.08Å; R17-K21 VanDerWaalsContact O-N 3.15Å; N18-K21 WeakPolarHBondContact O-CB 3.33Å; N18-K21 PolarHBondContact O-N 3.41Å; V19-K21 VanDerWaalsContact C-N 3.33Å; K21-L23 VanDerWaalsContact C-N 3.3Å; K21-L23 PolarHBondContact O-N 3.05Å; K21-G24 CarbonylContact O-C 3.56Å; K21-G24 WeakPolarHBondContact O-CA 3.44Å; K21-G24 PolarHBondContact O-N 3.37Å; K21-D25 VanDerWaalsContact O-CG 3.31Å; K21-D25 PolarHBondContact O-N 3.37Å
22	V	78.4	Confident	73.8	Confident	81 Å²	81	103.6 Å²	103.6	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-56.5	-40.9	-179.5	172.4	0	0	0	0	112.4	N18 G24 D25 I26	N18-V22 WeakPolarHBondContact O-CG2 3.23Å; N18-V22 PolarHBondContact O-N 3.37Å; V22-G24 VanDerWaalsContact C-N 3.31Å; V22-G24 PolarHBondContact O-N 2.95Å; V22-D25 PolarHBondContact O-N 3.46Å; V22-I26 HydrophobicContact CG1-CD1 3.87Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.36Å; V22-I26 PolarHBondContact O-N 2.82Å
23	L	75.9	Confident	74.7	Confident	82 Å²	82	105.5 Å²	105.5	43%	0.429	51%	0.51	S	S	.	.	H	α-helix	trans	-71.6	-24.4	176.5	-67.8	170.3	0	0	0	113.3	L12 V19 K21 I26 G27	L12-L23 HydrophobicContact CD2-CD1 3.55Å; V19-L23 HydrophobicContact CG1-CD1 3.83Å; V19-L23 HydrophobicContact CG1-CG 4.44Å; V19-L23 WeakPolarHBondContact O-CB 3.36Å; V19-L23 VanDerWaalsContact O-CG 3.3Å; V19-L23 WeakPolarHBondContact O-CG 3.19Å; V19-L23 PolarHBondContact O-N 3.4Å; K21-L23 VanDerWaalsContact C-N 3.3Å; K21-L23 PolarHBondContact O-N 3.05Å; L23-I26 HydrophobicContact CD2-CD1 4.45Å; L23-G27 PolarHBondContact O-N 3.15Å
24	G	77.8	Confident	75.2	Confident	35 Å²	35	104.1 Å²	104.1	36%	0.361	51%	0.508	S	S	.	.	H	α-helix	trans	-72.3	-43.3	167.6	0	0	0	0	0	112.2	K20 K21 V22 G27 L28	K20-G24 PolarHBondContact O-N 3.48Å; K20-G24 VanDerWaalsContact O-N 3.12Å; K21-G24 CarbonylContact O-C 3.56Å; K21-G24 WeakPolarHBondContact O-CA 3.44Å; K21-G24 PolarHBondContact O-N 3.37Å; V22-G24 VanDerWaalsContact C-N 3.31Å; V22-G24 PolarHBondContact O-N 2.95Å; G24-G27 CarbonylContact O-C 3.54Å; G24-G27 WeakPolarHBondContact O-CA 3.46Å; G24-G27 PolarHBondContact O-N 3.02Å; G24-G27 VanDerWaalsContact O-N 3.13Å; G24-L28 WeakPolarHBondContact O-CG 2.93Å; G24-L28 PolarHBondContact O-N 2.82Å
25	D	77.8	Confident	75.5	Confident	73 Å²	73	101.3 Å²	101.3	39%	0.39	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-45	178.3	-60.5	-35.4	0	0	0	111.1	K21 V22 G27 L28 E29	K21-D25 VanDerWaalsContact O-CG 3.31Å; K21-D25 PolarHBondContact O-N 3.37Å; V22-D25 PolarHBondContact O-N 3.46Å; D25-G27 VanDerWaalsContact C-N 3.35Å; D25-G27 PolarHBondContact O-N 3.15Å; D25-L28 PolarHBondContact O-N 3.33Å; D25-E29 PolarHBondContact O-N 2.92Å
26	I	80.2	Confident	75.8	Confident	84 Å²	84	105 Å²	105	43%	0.431	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-39.5	172.3	-66.8	163.9	0	0	0	111.3	V22 L23 L28 E29 F30	V22-I26 HydrophobicContact CG1-CD1 3.87Å; V22-I26 VanDerWaalsContact O-CG1 3.3Å; V22-I26 WeakPolarHBondContact O-CG1 3.36Å; V22-I26 PolarHBondContact O-N 2.82Å; L23-I26 HydrophobicContact CD2-CD1 4.45Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 3.44Å; I26-E29 WeakPolarHBondContact O-CB 3.26Å; I26-E29 PolarHBondContact O-N 2.91Å; I26-F30 PolarHBondContact O-N 2.93Å
27	G	78.3	Confident	75.9	Confident	34 Å²	34	99.7 Å²	99.7	35%	0.351	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-32.1	175.6	0	0	0	0	0	113.4	L23 G24 D25 C31	L23-G27 PolarHBondContact O-N 3.15Å; G24-G27 CarbonylContact O-C 3.54Å; G24-G27 WeakPolarHBondContact O-CA 3.46Å; G24-G27 PolarHBondContact O-N 3.02Å; G24-G27 VanDerWaalsContact O-N 3.13Å; D25-G27 VanDerWaalsContact C-N 3.35Å; D25-G27 PolarHBondContact O-N 3.15Å; G27-C31 WeakPolarHBondContact O-CB 3.37Å; G27-C31 PolarHBondContact O-N 3.22Å; G27-C31 PolarHBondContact O-SG 3.06Å
28	L	76.1	Confident	75.4	Confident	103 Å²	103	97.2 Å²	97.2	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-75.9	-33	174.1	-71.7	167.9	0	0	0	112.3	G24 D25 I26 R32	G24-L28 WeakPolarHBondContact O-CG 2.93Å; G24-L28 PolarHBondContact O-N 2.82Å; D25-L28 PolarHBondContact O-N 3.33Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 3.44Å; L28-R32 WeakPolarHBondContact O-CG 3.35Å; L28-R32 PolarHBondContact O-N 3.06Å; L28-R32 VanDerWaalsContact O-N 3.12Å; L28-R32 PolarHBondContact O-NE 3.32Å
29	E	79.9	Confident	75.2	Confident	107 Å²	107	97.7 Å²	97.7	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-61.1	-56	170.1	-166.3	165.2	-138.9	0	0	110.8	D25 I26 C31 R32 D33	D25-E29 PolarHBondContact O-N 2.92Å; I26-E29 WeakPolarHBondContact O-CB 3.26Å; I26-E29 PolarHBondContact O-N 2.91Å; E29-C31 PolarHBondContact O-N 2.87Å; E29-C31 VanDerWaalsContact O-N 3.15Å; E29-R32 WeakPolarHBondContact O-CA 3.41Å; E29-R32 WeakPolarHBondContact O-CB 3.26Å; E29-R32 PolarHBondContact O-N 3.09Å; E29-D33 PolarHBondContact O-N 3.39Å
30	F	78	Confident	74.5	Confident	121 Å²	121	101.6 Å²	101.6	53%	0.531	51%	0.509	S	S	.	.	H	α-helix	trans	-58.5	-33	178.5	-143	-92.1	0	0	0	113.6	I26 H34	I26-F30 PolarHBondContact O-N 2.93Å; F30-H34 AromaticContact CD1-CD2 3.9Å; F30-H34 AromaticContact CD1-NE2 3.88Å; F30-H34 AromaticContact CE1-CD2 3.94Å; F30-H34 AromaticContact CE1-NE2 3.41Å; F30-H34 WeakPolarHBondContact CE1-NE2 3.4Å; F30-H34 PolarHBondContact O-N 2.89Å
31	C	72.4	Confident	73.7	Confident	71 Å²	71	104.6 Å²	104.6	48%	0.48	52%	0.522	S	S	.	.	H	α-helix	trans	-70.6	-32.8	172.4	-76.4	0	0	0	0	113.4	G27 E29 L35	G27-C31 WeakPolarHBondContact O-CB 3.37Å; G27-C31 PolarHBondContact O-N 3.22Å; G27-C31 PolarHBondContact O-SG 3.06Å; E29-C31 PolarHBondContact O-N 2.87Å; E29-C31 VanDerWaalsContact O-N 3.15Å; C31-L35 WeakPolarHBondContact O-CB 3.45Å; C31-L35 WeakPolarHBondContact O-CD1 3.06Å; C31-L35 VanDerWaalsContact O-CG 3.24Å; C31-L35 WeakPolarHBondContact O-CG 3.08Å; C31-L35 PolarHBondContact O-N 2.78Å; C31-L35 VanDerWaalsContact O-N 3.1Å
32	R	76.5	Confident	72.8	Confident	152 Å²	152	104.7 Å²	104.7	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-73.4	-39.1	176.2	-77.3	174	-68.7	-144.5	0.1	111.4	L28 E29 L35 Q36	L28-R32 WeakPolarHBondContact O-CG 3.35Å; L28-R32 PolarHBondContact O-N 3.06Å; L28-R32 VanDerWaalsContact O-N 3.12Å; L28-R32 PolarHBondContact O-NE 3.32Å; E29-R32 WeakPolarHBondContact O-CA 3.41Å; E29-R32 WeakPolarHBondContact O-CB 3.26Å; E29-R32 PolarHBondContact O-N 3.09Å; R32-L35 CarbonylContact O-C 3.58Å; R32-L35 PolarHBondContact O-N 3.12Å; R32-Q36 PolarHBondContact O-N 2.93Å
33	D	80.8	Confident	71.8	Confident	89 Å²	89	103.2 Å²	103.2	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-63	-49.4	177.1	-60.5	-19.6	0	0	0	110.6	E29 L35 Q36 D37	E29-D33 PolarHBondContact O-N 3.39Å; D33-L35 VanDerWaalsContact C-N 3.31Å; D33-L35 PolarHBondContact O-N 3.3Å; D33-Q36 CarbonylContact O-C 3.37Å; D33-Q36 WeakPolarHBondContact O-CA 3.22Å; D33-Q36 VanDerWaalsContact O-CB 3.29Å; D33-Q36 WeakPolarHBondContact O-CB 3.47Å; D33-Q36 PolarHBondContact O-N 2.87Å; D33-D37 PolarHBondContact O-N 3.41Å
34	H	75.1	Confident	71	Confident	82 Å²	82	103 Å²	103	38%	0.38	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-32.9	173.4	-79	-29.1	0	0	0	113.7	F30 Q36 D37 Y38	F30-H34 AromaticContact CD1-CD2 3.9Å; F30-H34 AromaticContact CD1-NE2 3.88Å; F30-H34 AromaticContact CE1-CD2 3.94Å; F30-H34 AromaticContact CE1-NE2 3.41Å; F30-H34 WeakPolarHBondContact CE1-NE2 3.4Å; F30-H34 PolarHBondContact O-N 2.89Å; H34-Q36 PolarHBondContact O-N 3.46Å; H34-D37 WeakPolarHBondContact CA-OD2 3.33Å; H34-D37 IonicContact CE1-OD2 2.66Å; H34-D37 IonicContact CG-OD2 3.67Å; H34-D37 IonicContact ND1-OD2 3.71Å; H34-D37 PolarHBondContact ND1-OD2 3.17Å; H34-D37 PolarHBondContact O-N 3.13Å; H34-Y38 WeakPolarHBondContact O-CD2 3.23Å; H34-Y38 PolarHBondContact O-N 2.9Å
35	L	72.3	Confident	70	Confident	119 Å²	119	107.1 Å²	107.1	62%	0.623	54%	0.535	S	S	*	.	H	α-helix	trans	-68.3	-18.7	171.1	-78.9	169.8	0	0	0	113.1	C31 R32 D33 K39	C31-L35 WeakPolarHBondContact O-CB 3.45Å; C31-L35 WeakPolarHBondContact O-CD1 3.06Å; C31-L35 VanDerWaalsContact O-CG 3.24Å; C31-L35 WeakPolarHBondContact O-CG 3.08Å; C31-L35 PolarHBondContact O-N 2.78Å; C31-L35 VanDerWaalsContact O-N 3.1Å; R32-L35 CarbonylContact O-C 3.58Å; R32-L35 PolarHBondContact O-N 3.12Å; D33-L35 VanDerWaalsContact C-N 3.31Å; D33-L35 PolarHBondContact O-N 3.3Å; L35-K39 WeakPolarHBondContact O-CG 3.46Å
36	Q	74.2	Confident	69	Low	100 Å²	100	108.1 Å²	108.1	47%	0.467	54%	0.543	S	S	.	.	H	α-helix	trans	-82.5	-41.7	169.7	-173.1	61.3	44.6	0	0	111	R32 D33 H34 Y38 K39	R32-Q36 PolarHBondContact O-N 2.93Å; D33-Q36 CarbonylContact O-C 3.37Å; D33-Q36 WeakPolarHBondContact O-CA 3.22Å; D33-Q36 VanDerWaalsContact O-CB 3.29Å; D33-Q36 WeakPolarHBondContact O-CB 3.47Å; D33-Q36 PolarHBondContact O-N 2.87Å; H34-Q36 PolarHBondContact O-N 3.46Å; Q36-Y38 PolarHBondContact O-N 2.83Å; Q36-K39 PolarHBondContact O-N 3.12Å; Q36-K39 VanDerWaalsContact O-N 3.16Å
37	D	73.7	Confident	67.8	Low	105 Å²	105	111.8 Å²	111.8	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-53.6	-38.3	174.6	-65	-30.5	0	0	0	112.6	D33 H34	D33-D37 PolarHBondContact O-N 3.41Å; H34-D37 WeakPolarHBondContact CA-OD2 3.33Å; H34-D37 IonicContact CE1-OD2 2.66Å; H34-D37 IonicContact CG-OD2 3.67Å; H34-D37 IonicContact ND1-OD2 3.71Å; H34-D37 PolarHBondContact ND1-OD2 3.17Å; H34-D37 PolarHBondContact O-N 3.13Å
38	Y	64.9	Low	66.9	Low	169 Å²	169	114.2 Å²	114.2	66%	0.663	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-3.3	-177.4	-70.7	-65	0	0	0	115.2	H34 Q36 D40 F41	H34-Y38 WeakPolarHBondContact O-CD2 3.23Å; H34-Y38 PolarHBondContact O-N 2.9Å; Q36-Y38 PolarHBondContact O-N 2.83Å; Y38-D40 VanDerWaalsContact C-N 3.31Å; Y38-D40 PolarHBondContact O-N 3.38Å; Y38-F41 PolarHBondContact O-N 2.96Å
39	K	63.7	Low	65.9	Low	138 Å²	138	115.6 Å²	115.6	60%	0.6	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-31.9	179.2	-89.3	174	-167.7	170.2	0	113.7	L35 Q36 F41	L35-K39 WeakPolarHBondContact O-CG 3.46Å; Q36-K39 PolarHBondContact O-N 3.12Å; Q36-K39 VanDerWaalsContact O-N 3.16Å; K39-F41 PolarHBondContact O-N 2.94Å
40	D	60.5	Low	64.4	Low	152 Å²	152	117.9 Å²	117.9	81%	0.813	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-11.1	-177	-62.3	-17	0	0	0	112.2	Y38 N42	Y38-D40 VanDerWaalsContact C-N 3.31Å; Y38-D40 PolarHBondContact O-N 3.38Å; D40-N42 PolarHBondContact O-N 2.95Å
41	F	56.3	Low	63	Low	159 Å²	159	115.3 Å²	115.3	70%	0.697	56%	0.563	S	S	*	*			trans	-97.7	79	178.6	-161.6	-91.9	0	0	0	111.7	Y38 K39 P43	Y38-F41 PolarHBondContact O-N 2.96Å; K39-F41 PolarHBondContact O-N 2.94Å; F41-P43 HydrophobicContact CE1-CB 4.21Å; F41-P43 VanDerWaalsContact O-CD 3.26Å; F41-P43 WeakPolarHBondContact O-CD 3.36Å
42	N	56.2	Low	61.7	Low	143 Å²	143	118.9 Å²	118.9	77%	0.765	58%	0.583	S	S	*	*			trans	-88.9	103.5	169.1	-168.7	24.6	0	0	0	109.7	D40	D40-N42 PolarHBondContact O-N 2.95Å
43	P	56.8	Low	60.4	Low	49 Å²	49	121.2 Å²	121.2	32%	0.318	59%	0.592	S	S	.	*			trans	-67.8	143	-174.5	27.7	-34.6	0	0	0	111.5	F41 E45 I48	F41-P43 HydrophobicContact CE1-CB 4.21Å; F41-P43 VanDerWaalsContact O-CD 3.26Å; F41-P43 WeakPolarHBondContact O-CD 3.36Å; P43-E45 PolarHBondContact O-N 3.3Å; P43-I48 HydrophobicContact CG-CD1 4.36Å; P43-I48 HydrophobicContact CG-CG1 4.38Å
44	P	59.3	Low	58.5	Low	79 Å²	79	125.7 Å²	125.7	51%	0.513	61%	0.61	S	S	.	*			trans	-53.6	137	177.5	-27.7	34.5	0	0	0	112.6	V46 Y47	P44-V46 PolarHBondContact O-N 3.42Å; P44-Y47 HydrophobicContact CB-CD2 4.04Å; P44-Y47 HydrophobicContact CB-CE2 4.28Å; P44-Y47 HydrophobicContact CG-CD2 4.25Å; P44-Y47 HydrophobicContact CG-CE2 4.21Å; P44-Y47 PolarHBondContact O-N 2.82Å
45	E	56.1	Low	56.9	Low	121 Å²	121	125.5 Å²	125.5	57%	0.565	61%	0.612	S	S	*	*	H	α-helix	trans	-55.8	-24.8	-170.4	-146.4	-163.4	173	0	0	113.9	P43 Y47 I48 K49	P43-E45 PolarHBondContact O-N 3.3Å; E45-Y47 VanDerWaalsContact C-N 3.34Å; E45-Y47 PolarHBondContact O-N 2.87Å; E45-I48 PolarHBondContact O-N 2.87Å; E45-K49 HydrophobicContact CG-CD 4.38Å; E45-K49 WeakPolarHBondContact O-CG 3.23Å; E45-K49 PolarHBondContact O-N 2.89Å; E45-K49 WeakPolarHBondContact OE1-CE 3.22Å; E45-K49 IonicContact OE1-NZ 2.73Å; E45-K49 PolarHBondContact OE1-NZ 2.87Å; E45-K49 IonicContact OE2-NZ 3.48Å; E45-K49 PolarHBondContact OE2-NZ 3.34Å
46	V	58.4	Low	55.6	Low	93 Å²	93	125.5 Å²	125.5	56%	0.564	62%	0.617	S	S	*	*	H	α-helix	trans	-54.7	-44.8	172.4	-179.3	0	0	0	0	111.8	P44 K49 H50	P44-V46 PolarHBondContact O-N 3.42Å; V46-K49 PolarHBondContact O-N 3.12Å; V46-H50 PolarHBondContact O-CD2 2.8Å; V46-H50 PolarHBondContact O-N 2.9Å; V46-H50 VanDerWaalsContact O-N 3.15Å
47	Y	54.8	Low	54	Low	161 Å²	161	124.6 Å²	124.6	63%	0.631	62%	0.621	S	S	*	*	H	α-helix	trans	-68.4	-37.5	179.6	-66.4	-74.6	0	0	0	111.7	P44 E45 H50 T51	P44-Y47 HydrophobicContact CB-CD2 4.04Å; P44-Y47 HydrophobicContact CB-CE2 4.28Å; P44-Y47 HydrophobicContact CG-CD2 4.25Å; P44-Y47 HydrophobicContact CG-CE2 4.21Å; P44-Y47 PolarHBondContact O-N 2.82Å; E45-Y47 VanDerWaalsContact C-N 3.34Å; E45-Y47 PolarHBondContact O-N 2.87Å; Y47-H50 PolarHBondContact O-N 2.72Å; Y47-T51 PolarHBondContact O-N 2.76Å; Y47-T51 VanDerWaalsContact O-N 3.13Å; Y47-T51 PolarHBondContact O-OG1 3.08Å
48	I	58.6	Low	52.2	Low	85 Å²	85	126.3 Å²	126.3	44%	0.436	63%	0.627	S	S	.	*	H	α-helix	trans	-65.3	-40.7	177.1	-54	177.4	0	0	0	110.4	P43 E45	P43-I48 HydrophobicContact CG-CD1 4.36Å; P43-I48 HydrophobicContact CG-CG1 4.38Å; E45-I48 PolarHBondContact O-N 2.87Å
49	K	54.7	Low	50.8	Low	132 Å²	132	126.7 Å²	126.7	57%	0.574	63%	0.627	S	S	*	*	H	α-helix	trans	-74.9	-19.7	-179.5	-72.8	170.6	177.9	169.4	0	114.4	E45 V46	E45-K49 HydrophobicContact CG-CD 4.38Å; E45-K49 WeakPolarHBondContact O-CG 3.23Å; E45-K49 PolarHBondContact O-N 2.89Å; E45-K49 WeakPolarHBondContact OE1-CE 3.22Å; E45-K49 IonicContact OE1-NZ 2.73Å; E45-K49 PolarHBondContact OE1-NZ 2.87Å; E45-K49 IonicContact OE2-NZ 3.48Å; E45-K49 PolarHBondContact OE2-NZ 3.34Å; V46-K49 PolarHBondContact O-N 3.12Å
50	H	48.8	Very low	49.5	Very low	156 Å²	156	126 Å²	126	72%	0.722	63%	0.626	S	S	*	*	H	α-helix	trans	-110.6	2.1	-179.5	-65.4	-54.3	0	0	0	115	V46 Y47	V46-H50 PolarHBondContact O-CD2 2.8Å; V46-H50 PolarHBondContact O-N 2.9Å; V46-H50 VanDerWaalsContact O-N 3.15Å; Y47-H50 PolarHBondContact O-N 2.72Å
51	T	48.1	Very low	48.6	Very low	67 Å²	67	123 Å²	123	41%	0.411	62%	0.615	S	S	.	*	S	Bend	trans	-103.4	120.5	167.6	39.6	0	0	0	0	110.3	Y47 W53	Y47-T51 PolarHBondContact O-N 2.76Å; Y47-T51 VanDerWaalsContact O-N 3.13Å; Y47-T51 PolarHBondContact O-OG1 3.08Å; T51-W53 PolarHBondContact O-N 2.9Å; T51-W53 PolarHBondContact OG1-NE1 3.39Å
52	T	45	Very low	48.1	Very low	146 Å²	146	118.7 Å²	118.7	90%	0.896	61%	0.605	S	S	*	*			trans	-76.6	100.6	171	48.8	0	0	0	0	109.2
53	W	49.3	Very low	47.3	Very low	200 Å²	200	120 Å²	120	76%	0.758	61%	0.606	S	S	*	*			trans	-83.8	124.9	172.2	-60.3	84.9	0	0	0	109.9	T51 D55	T51-W53 PolarHBondContact O-N 2.9Å; T51-W53 PolarHBondContact OG1-NE1 3.39Å; W53-D55 PolarHBondContact O-N 2.89Å
54	E	42.6	Very low	46.9	Very low	183 Å²	183	120.7 Å²	120.7	86%	0.855	61%	0.609	S	S	*	*			trans	-66	118.7	157.1	-66.1	178.7	153.8	0	0	107.1	V56	E54-V56 PolarHBondContact O-N 2.88Å
55	D	41	Very low	46.1	Very low	78 Å²	78	124.8 Å²	124.8	42%	0.417	62%	0.619	S	S	.	*			trans	-64.5	106.7	178.8	177.4	18.1	0	0	0	109	W53 C57 M58 R872	W53-D55 PolarHBondContact O-N 2.89Å; D55-C57 PolarHBondContact O-N 2.95Å; D55-C57 VanDerWaalsContact O-N 3.08Å; D55-C57 WeakPolarHBondContact OD1-CA 3.31Å; D55-C57 WeakPolarHBondContact OD1-CB 3.41Å; D55-C57 PolarHBondContact OD1-N 3.06Å; D55-C57 PolarHBondContact OD1-SG 3.46Å; D55-M58 HydrophobicContact CB-CB 4.5Å; D55-M58 HydrophobicContact CB-CG 3.92Å; D55-M58 WeakPolarHBondContact O-CA 3.32Å; D55-M58 VanDerWaalsContact O-CB 3.27Å; D55-M58 WeakPolarHBondContact O-CB 3.33Å; D55-M58 PolarHBondContact O-N 2.97Å; D55-R872 IonicContact OD2-CZ 3.16Å; D55-R872 IonicContact OD2-NH2 2.79Å; D55-R872 PolarHBondContact OD2-NH2 2.89Å
56	V	45.1	Very low	45.4	Very low	120 Å²	120	124.8 Å²	124.8	73%	0.727	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-62	-17.8	177.6	-175.6	0	0	0	0	111.4	E54 M58 W59	E54-V56 PolarHBondContact O-N 2.88Å; V56-M58 PolarHBondContact O-N 2.93Å; V56-W59 WeakPolarHBondContact O-CB 3.26Å; V56-W59 PolarHBondContact O-N 3Å; V56-W59 VanDerWaalsContact O-N 3.11Å
57	C	41.1	Very low	44.9	Very low	81 Å²	81	125.1 Å²	125.1	55%	0.547	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-79.2	-3.7	171.5	-48.6	0	0	0	0	113.3	D55 W59 R872	D55-C57 PolarHBondContact O-N 2.95Å; D55-C57 VanDerWaalsContact O-N 3.08Å; D55-C57 WeakPolarHBondContact OD1-CA 3.31Å; D55-C57 WeakPolarHBondContact OD1-CB 3.41Å; D55-C57 PolarHBondContact OD1-N 3.06Å; D55-C57 PolarHBondContact OD1-SG 3.46Å; C57-W59 VanDerWaalsContact C-N 3.32Å; C57-R872 VanDerWaalsContact CB-NH2 3.26Å; C57-R872 VanDerWaalsContact O-CZ 3.29Å; C57-R872 PolarHBondContact O-NH1 2.82Å; C57-R872 PolarHBondContact O-NH2 2.9Å
58	M	35.6	Very low	44.5	Very low	140 Å²	140	123 Å²	123	69%	0.69	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-89.4	7	162.4	-62.7	-64	-66.1	0	0	112.3	D55 V56 E60	D55-M58 HydrophobicContact CB-CB 4.5Å; D55-M58 HydrophobicContact CB-CG 3.92Å; D55-M58 WeakPolarHBondContact O-CA 3.32Å; D55-M58 VanDerWaalsContact O-CB 3.27Å; D55-M58 WeakPolarHBondContact O-CB 3.33Å; D55-M58 PolarHBondContact O-N 2.97Å; V56-M58 PolarHBondContact O-N 2.93Å; M58-E60 VanDerWaalsContact C-N 3.31Å; M58-E60 PolarHBondContact O-N 2.92Å
59	W	35.8	Very low	44.1	Very low	177 Å²	177	128.3 Å²	128.3	67%	0.67	64%	0.638	S	S	*	*			trans	-66.7	92.2	165	-174.7	-83	0	0	0	109.7	V56 C57 P61 T64	V56-W59 WeakPolarHBondContact O-CB 3.26Å; V56-W59 PolarHBondContact O-N 3Å; V56-W59 VanDerWaalsContact O-N 3.11Å; C57-W59 VanDerWaalsContact C-N 3.32Å; W59-P61 WeakPolarHBondContact O-CD 3.39Å; W59-T64 HydrophobicContact CZ2-CG2 3.87Å
60	E	35.1	Very low	44.8	Very low	125 Å²	125	124 Å²	124	58%	0.584	62%	0.618	S	S	*	*			trans	-76.1	121.7	-178.9	-151.9	-174.7	115.7	0	0	110.5	M58 S62 H63	M58-E60 VanDerWaalsContact C-N 3.31Å; M58-E60 PolarHBondContact O-N 2.92Å; E60-S62 WeakPolarHBondContact CG-OG 3.45Å; E60-S62 PolarHBondContact O-N 3.34Å; E60-S62 VanDerWaalsContact O-N 3.09Å; E60-S62 WeakPolarHBondContact OE1-CB 3.38Å; E60-S62 PolarHBondContact OE1-OG 2.81Å; E60-H63 PolarHBondContact O-N 3.37Å
61	P	42.8	Very low	45.2	Very low	89 Å²	89	121 Å²	121	58%	0.578	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-63.2	-18	-176.9	-24.9	35.6	0	0	0	114.6	W59 H63 T64	W59-P61 WeakPolarHBondContact O-CD 3.39Å; P61-H63 VanDerWaalsContact C-N 3.34Å; P61-H63 PolarHBondContact O-N 2.83Å; P61-T64 CarbonylContact O-C 3.58Å; P61-T64 VanDerWaalsContact O-C 3.27Å; P61-T64 PolarHBondContact O-N 2.88Å
62	S	45.9	Very low	46.7	Very low	68 Å²	68	122.4 Å²	122.4	48%	0.476	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-55.1	-42.8	178.7	53.3	0	0	0	0	113.1	E60 T64	E60-S62 WeakPolarHBondContact CG-OG 3.45Å; E60-S62 PolarHBondContact O-N 3.34Å; E60-S62 VanDerWaalsContact O-N 3.09Å; E60-S62 WeakPolarHBondContact OE1-CB 3.38Å; E60-S62 PolarHBondContact OE1-OG 2.81Å; S62-T64 VanDerWaalsContact C-N 3.28Å; S62-T64 PolarHBondContact O-N 2.92Å
63	H	39.3	Very low	48.1	Very low	171 Å²	171	118.7 Å²	118.7	79%	0.792	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-76.9	-10.2	-177.9	-81.8	-83.6	0	0	0	114.4	E60 P61	E60-H63 PolarHBondContact O-N 3.37Å; P61-H63 VanDerWaalsContact C-N 3.34Å; P61-H63 PolarHBondContact O-N 2.83Å
64	T	46.6	Very low	49.6	Very low	62 Å²	62	112.6 Å²	112.6	38%	0.38	57%	0.572	S	S	.	*	S	Bend	trans	-128.6	87.8	167.4	56.4	0	0	0	0	110.4	W59 P61 S62 V66	W59-T64 HydrophobicContact CZ2-CG2 3.87Å; P61-T64 CarbonylContact O-C 3.58Å; P61-T64 VanDerWaalsContact O-C 3.27Å; P61-T64 PolarHBondContact O-N 2.88Å; S62-T64 VanDerWaalsContact C-N 3.28Å; S62-T64 PolarHBondContact O-N 2.92Å; T64-V66 PolarHBondContact O-N 2.66Å
65	K	42.4	Very low	51.5	Low	165 Å²	165	105.7 Å²	105.7	72%	0.717	54%	0.544	S	S	*	.			trans	-32.2	122.9	168.7	-70.5	-168.9	176.3	-167	0	110.2	Q67	K65-Q67 VanDerWaalsContact O-CG 3.28Å; K65-Q67 WeakPolarHBondContact O-CG 3.3Å; K65-Q67 PolarHBondContact O-N 2.67Å
66	V	42.3	Very low	53.4	Low	121 Å²	121	102.1 Å²	102.1	73%	0.733	53%	0.525	S	S	*	.			trans	-44.1	106.8	-176.8	178.4	0	0	0	0	108.9	T64 D68	T64-V66 PolarHBondContact O-N 2.66Å; V66-D68 VanDerWaalsContact C-N 3.33Å; V66-D68 PolarHBondContact O-N 2.62Å
67	Q	47.5	Very low	54.8	Low	100 Å²	100	101.5 Å²	101.5	47%	0.467	53%	0.526	S	S	.	.			trans	-79.7	89.7	-173.8	-67.5	-146.3	22	0	0	109	K65 Y69 R70	K65-Q67 VanDerWaalsContact O-CG 3.28Å; K65-Q67 WeakPolarHBondContact O-CG 3.3Å; K65-Q67 PolarHBondContact O-N 2.67Å; Q67-Y69 PolarHBondContact O-N 3.49Å; Q67-R70 VanDerWaalsContact OE1-CZ 3.3Å
68	D	47.7	Very low	56.2	Low	117 Å²	117	100.2 Å²	100.2	63%	0.626	53%	0.527	S	S	*	.			trans	-36.4	128.3	171	-73.4	-47.4	0	0	0	110.7	V66 R70	V66-D68 VanDerWaalsContact C-N 3.33Å; V66-D68 PolarHBondContact O-N 2.62Å; D68-R70 WeakPolarHBondContact O-CG 3.35Å; D68-R70 PolarHBondContact O-N 3.46Å
69	Y	50	Low	58.3	Low	196 Å²	196	95.5 Å²	95.5	77%	0.769	51%	0.507	S	S	*	.			trans	-54.2	102.5	-167.3	178.4	-94.4	0	0	0	111.7	Q67 S71	Q67-Y69 PolarHBondContact O-N 3.49Å; Y69-S71 PolarHBondContact O-N 3.48Å
70	R	68.3	Low	60.3	Low	43 Å²	43	91.8 Å²	91.8	16%	0.162	50%	0.5	C	S	.	.			trans	-76.3	97.4	-165.2	-55.2	-174	179.7	-99.3	25.5	110.6	Q67 D68 K72 C75 C76 C79 L80	Q67-R70 VanDerWaalsContact OE1-CZ 3.3Å; D68-R70 WeakPolarHBondContact O-CG 3.35Å; D68-R70 PolarHBondContact O-N 3.46Å; R70-K72 PolarHBondContact O-N 3.4Å; R70-C75 WeakPolarHBondContact CB-SG 3.33Å; R70-C75 WeakPolarHBondContact CD-SG 3.29Å; R70-C76 PolarHBondContact NH2-O 3.5Å; R70-C79 PolarHBondContact NH2-O 3.45Å; R70-L80 VanDerWaalsContact NH1-C 3.29Å; R70-L80 PolarHBondContact NH1-O 3Å
71	S	58.3	Low	62.5	Low	93 Å²	93	89.1 Å²	89.1	65%	0.65	49%	0.486	S	S	*	.			trans	-64.5	-20.1	-177.1	60	0	0	0	0	114.4	Y69	Y69-S71 PolarHBondContact O-N 3.48Å
72	K	77.9	Confident	64.4	Low	95 Å²	95	86.2 Å²	86.2	41%	0.413	47%	0.468	S	S	.	.	S	Bend	trans	-95.6	144	-173.6	-58.1	175.6	-170.6	168.3	0	111.8	R70 F74 C75 S82	R70-K72 PolarHBondContact O-N 3.4Å; K72-F74 PolarHBondContact O-N 3.01Å; K72-C75 PolarHBondContact O-SG 2.86Å; K72-S82 VanDerWaalsContact CD-O 3.26Å; K72-S82 WeakPolarHBondContact CD-O 3.37Å; K72-S82 PolarHBondContact NZ-O 3.45Å
73	P	74.9	Confident	66.1	Low	69 Å²	69	83.4 Å²	83.4	45%	0.448	45%	0.448	S	S	.	.	S	Bend	trans	-69.2	-25.3	-170.8	25.8	-36.2	0	0	0	116
74	F	80.9	Confident	68.2	Low	71 Å²	71	82.1 Å²	82.1	31%	0.311	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.2	179.4	-55	-77	0	0	0	110	K72 S82 S83 F86 Y89	K72-F74 PolarHBondContact O-N 3.01Å; F74-S82 CarbonylContact O-C 3.58Å; F74-S82 WeakPolarHBondContact O-CA 3.29Å; F74-S83 PolarHBondContact N-O 3.38Å; F74-S83 VanDerWaalsContact N-O 3.08Å; F74-S83 PolarHBondContact O-N 2.96Å; F74-F86 AromaticContact CD1-CD2 3.94Å; F74-F86 HydrophobicContact CD1-CD2 3.94Å; F74-F86 HydrophobicContact CD2-CB 4.44Å; F74-F86 HydrophobicContact CE1-CB 4.1Å; F74-F86 AromaticContact CE1-CD2 3.79Å; F74-F86 HydrophobicContact CE1-CD2 3.79Å; F74-F86 HydrophobicContact CE1-CG 4.37Å; F74-F86 HydrophobicContact CE2-CB 4.03Å; F74-F86 HydrophobicContact CZ-CB 3.84Å; F74-F86 HydrophobicContact CZ-CD2 4.39Å; F74-Y89 HydrophobicContact CB-CD1 4.44Å; F74-Y89 HydrophobicContact CB-CD2 4.1Å; F74-Y89 HydrophobicContact CB-CG 3.83Å
75	C	82.9	Confident	69.8	Low	39 Å²	39	86 Å²	86	26%	0.264	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.8	-174.1	-62.8	0	0	0	0	110.4	R70 K72 Y89	R70-C75 WeakPolarHBondContact CB-SG 3.33Å; R70-C75 WeakPolarHBondContact CD-SG 3.29Å; K72-C75 PolarHBondContact O-SG 2.86Å; C75-Y89 VanDerWaalsContact O-CE2 3.31Å; C75-Y89 WeakPolarHBondContact O-CE2 3.49Å
76	C	81.2	Confident	71.4	Confident	3 Å²	3	83.7 Å²	83.7	2%	0.02	44%	0.439	C	S	.	.			trans	-78.4	142.2	169.6	-163.1	0	0	0	0	110.3	R70 G78 F81 H92 H97	R70-C76 PolarHBondContact NH2-O 3.5Å; C76-G78 PolarHBondContact SG-N 2.9Å; C76-F81 HydrophobicContact CB-CB 4.27Å; C76-F81 PolarHBondContact N-O 2.86Å; C76-H92 WeakPolarHBondContact CB-NE2 3.02Å; C76-H92 PolarHBondContact SG-NE2 2.88Å; C76-H97 PolarHBondContact SG-CD2 2.81Å; C76-H97 PolarHBondContact SG-NE2 3.41Å; C76-H97 VanDerWaalsContact SG-NE2 3.37Å
77	S	75.3	Confident	73.3	Confident	106 Å²	106	82 Å²	82	74%	0.741	43%	0.433	S	S	*	.	S	Bend	trans	-80.1	-34	170.7	47.3	0	0	0	0	112.3
78	G	68.8	Low	74.9	Confident	55 Å²	55	79.1 Å²	79.1	57%	0.567	43%	0.426	S	S	*	.	S	Bend	trans	-83.4	-9.2	-175.2	0	0	0	0	0	115.8	C76	C76-G78 PolarHBondContact SG-N 2.9Å
79	C	80	Confident	76.6	Confident	41 Å²	41	76.1 Å²	76.1	28%	0.277	41%	0.407	S	S	.	.	S	Bend	trans	-158.2	-179.3	178	70.3	0	0	0	0	112.4	R70 F81 H92 H97	R70-C79 PolarHBondContact NH2-O 3.45Å; C79-F81 PolarHBondContact O-N 2.72Å; C79-H92 PolarHBondContact SG-CE1 2.94Å; C79-H92 PolarHBondContact SG-NE2 2.88Å; C79-H97 PolarHBondContact SG-NE2 2.88Å
80	L	77.6	Confident	78.2	Confident	99 Å²	99	71.5 Å²	71.5	52%	0.518	39%	0.39	S	S	.	.	S	Bend	trans	-74.9	-1.7	-178	-65	177.8	0	0	0	114.9	R70 S82	R70-L80 VanDerWaalsContact NH1-C 3.29Å; R70-L80 PolarHBondContact NH1-O 3Å; L80-S82 PolarHBondContact O-N 2.74Å
81	F	81.9	Confident	78.9	Confident	68 Å²	68	71.5 Å²	71.5	30%	0.298	40%	0.397	S	S	.	.			trans	-61.9	132.3	-178.2	-175.3	-89.8	0	0	0	114	C76 C79 A88 H92	C76-F81 HydrophobicContact CB-CB 4.27Å; C76-F81 PolarHBondContact N-O 2.86Å; C79-F81 PolarHBondContact O-N 2.72Å; F81-A88 HydrophobicContact CZ-CB 4.49Å; F81-H92 HydrophobicContact CD1-CB 3.84Å; F81-H92 AromaticContact CD1-CD2 3.41Å; F81-H92 VanDerWaalsContact CD1-CD2 3.41Å; F81-H92 WeakPolarHBondContact CD1-CD2 3.48Å; F81-H92 AromaticContact CD1-CG 3.47Å; F81-H92 VanDerWaalsContact CD1-CG 3.47Å; F81-H92 HydrophobicContact CD2-CB 4.23Å; F81-H92 AromaticContact CD2-CG 3.87Å; F81-H92 AromaticContact CD2-ND1 3.84Å; F81-H92 HydrophobicContact CE1-CB 3.68Å; F81-H92 AromaticContact CE1-CG 3.86Å; F81-H92 HydrophobicContact CE2-CB 4.06Å; F81-H92 HydrophobicContact CG-CB 4.12Å; F81-H92 AromaticContact CG-CD2 3.64Å; F81-H92 AromaticContact CG-CE1 3.9Å; F81-H92 AromaticContact CG-CG 3.48Å; F81-H92 VanDerWaalsContact CG-CG 3.48Å; F81-H92 AromaticContact CG-ND1 3.64Å; F81-H92 AromaticContact CG-NE2 3.9Å; F81-H92 HydrophobicContact CZ-CB 3.78Å
82	S	83.4	Confident	80.2	Confident	28 Å²	28	68 Å²	68	20%	0.196	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	143.9	171.1	65.1	0	0	0	0	112.7	K72 F74 L80	K72-S82 VanDerWaalsContact CD-O 3.26Å; K72-S82 WeakPolarHBondContact CD-O 3.37Å; K72-S82 PolarHBondContact NZ-O 3.45Å; F74-S82 CarbonylContact O-C 3.58Å; F74-S82 WeakPolarHBondContact O-CA 3.29Å; L80-S82 PolarHBondContact O-N 2.74Å
83	S	81.9	Confident	80.2	Confident	9 Å²	9	67 Å²	67	6%	0.063	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.2	-168.3	176.1	0	0	0	0	113.3	F74 Y85	F74-S83 PolarHBondContact N-O 3.38Å; F74-S83 VanDerWaalsContact N-O 3.08Å; F74-S83 PolarHBondContact O-N 2.96Å; S83-Y85 VanDerWaalsContact C-N 3.33Å; S83-Y85 PolarHBondContact OG-N 3.45Å; S83-Y85 PolarHBondContact OG-O 3.24Å
84	K	82	Confident	80.4	Confident	145 Å²	145	70 Å²	70	63%	0.63	37%	0.369	S	S	*	.	S	Bend	trans	-74.6	-23.9	168.1	-171.9	178.6	178.9	-175.5	0	112.3
85	Y	80.1	Confident	80.3	Confident	142 Å²	142	71.5 Å²	71.5	56%	0.557	38%	0.38	S	S	*	.			trans	-116.6	131.5	-172.2	-55.7	-82.7	0	0	0	112.3	S83 S87 A88 Y89	S83-Y85 VanDerWaalsContact C-N 3.33Å; S83-Y85 PolarHBondContact OG-N 3.45Å; S83-Y85 PolarHBondContact OG-O 3.24Å; Y85-S87 VanDerWaalsContact C-N 3.26Å; Y85-S87 PolarHBondContact O-N 2.67Å; Y85-A88 PolarHBondContact O-N 3.45Å; Y85-Y89 PolarHBondContact O-N 3.15Å; Y85-Y89 VanDerWaalsContact O-N 3.17Å
86	F	76.9	Confident	79.9	Confident	118 Å²	118	73.7 Å²	73.7	52%	0.518	39%	0.392	S	S	.	.	H	α-helix	trans	-64	-29.9	177.2	-177.4	-110.8	0	0	0	112.9	F74 Y89 K90	F74-F86 AromaticContact CD1-CD2 3.94Å; F74-F86 HydrophobicContact CD1-CD2 3.94Å; F74-F86 HydrophobicContact CD2-CB 4.44Å; F74-F86 HydrophobicContact CE1-CB 4.1Å; F74-F86 AromaticContact CE1-CD2 3.79Å; F74-F86 HydrophobicContact CE1-CD2 3.79Å; F74-F86 HydrophobicContact CE1-CG 4.37Å; F74-F86 HydrophobicContact CE2-CB 4.03Å; F74-F86 HydrophobicContact CZ-CB 3.84Å; F74-F86 HydrophobicContact CZ-CD2 4.39Å; F86-Y89 HydrophobicContact CD2-CD1 4.12Å; F86-Y89 HydrophobicContact CE2-CD1 4.16Å; F86-Y89 PolarHBondContact O-N 3.15Å; F86-K90 HydrophobicContact CE1-CD 4.31Å; F86-K90 VanDerWaalsContact O-CB 3.27Å; F86-K90 WeakPolarHBondContact O-CB 3.48Å; F86-K90 PolarHBondContact O-N 3.13Å
87	S	81.5	Confident	79.7	Confident	85 Å²	85	74.6 Å²	74.6	59%	0.594	40%	0.395	S	S	*	.	H	α-helix	trans	-60	-51.2	174.8	48.2	0	0	0	0	112	Y85 K90 S91	Y85-S87 VanDerWaalsContact C-N 3.26Å; Y85-S87 PolarHBondContact O-N 2.67Å; S87-K90 PolarHBondContact O-N 2.96Å; S87-S91 WeakPolarHBondContact O-CB 3.48Å; S87-S91 PolarHBondContact O-N 3.05Å
88	A	81.3	Confident	79.2	Confident	40 Å²	40	71.9 Å²	71.9	33%	0.331	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-38.3	177.4	0	0	0	0	0	112.1	F81 Y85 S91 H92	F81-A88 HydrophobicContact CZ-CB 4.49Å; Y85-A88 PolarHBondContact O-N 3.45Å; A88-S91 PolarHBondContact O-N 3.19Å; A88-H92 WeakPolarHBondContact O-CB 3.49Å; A88-H92 PolarHBondContact O-N 3.36Å
89	Y	84.4	Confident	78.8	Confident	54 Å²	54	76 Å²	76	21%	0.212	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-47.2	172	173.5	-103.2	0	0	0	112.5	F74 C75 Y85 F86 S91 H92 F93	F74-Y89 HydrophobicContact CB-CD1 4.44Å; F74-Y89 HydrophobicContact CB-CD2 4.1Å; F74-Y89 HydrophobicContact CB-CG 3.83Å; C75-Y89 VanDerWaalsContact O-CE2 3.31Å; C75-Y89 WeakPolarHBondContact O-CE2 3.49Å; Y85-Y89 PolarHBondContact O-N 3.15Å; Y85-Y89 VanDerWaalsContact O-N 3.17Å; F86-Y89 HydrophobicContact CD2-CD1 4.12Å; F86-Y89 HydrophobicContact CE2-CD1 4.16Å; F86-Y89 PolarHBondContact O-N 3.15Å; Y89-S91 VanDerWaalsContact C-N 3.32Å; Y89-S91 PolarHBondContact O-N 3.28Å; Y89-H92 PolarHBondContact O-N 2.92Å; Y89-F93 WeakPolarHBondContact O-CB 3.06Å; Y89-F93 PolarHBondContact O-N 3.36Å
90	K	82.4	Confident	78	Confident	98 Å²	98	78 Å²	78	43%	0.426	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-34.4	177.1	-173.9	175.3	-178.4	179.8	0	112.2	F86 S87 R94	F86-K90 HydrophobicContact CE1-CD 4.31Å; F86-K90 VanDerWaalsContact O-CB 3.27Å; F86-K90 WeakPolarHBondContact O-CB 3.48Å; F86-K90 PolarHBondContact O-N 3.13Å; S87-K90 PolarHBondContact O-N 2.96Å; K90-R94 WeakPolarHBondContact O-CG 3.39Å; K90-R94 PolarHBondContact O-N 2.88Å
91	S	82.9	Confident	77.2	Confident	43 Å²	43	78.7 Å²	78.7	30%	0.301	39%	0.388	S	S	.	.	H	α-helix	trans	-70.7	-45.3	175.4	-150.7	0	0	0	0	111.6	S87 A88 Y89 R94 N95	S87-S91 WeakPolarHBondContact O-CB 3.48Å; S87-S91 PolarHBondContact O-N 3.05Å; A88-S91 PolarHBondContact O-N 3.19Å; Y89-S91 VanDerWaalsContact C-N 3.32Å; Y89-S91 PolarHBondContact O-N 3.28Å; S91-R94 PolarHBondContact O-N 3.45Å; S91-R94 PolarHBondContact OG-NH2 2.8Å; S91-R94 VanDerWaalsContact OG-NH2 3.08Å; S91-N95 WeakPolarHBondContact O-CB 3.48Å; S91-N95 PolarHBondContact O-N 3.36Å; S91-N95 PolarHBondContact O-OD1 3.17Å; S91-N95 VanDerWaalsContact O-OD1 3.08Å
92	H	85.5	Confident	76.2	Confident	19 Å²	19	80 Å²	80	9%	0.088	40%	0.395	C	S	.	.	H	α-helix	trans	-56	-51.9	173.3	163.3	69	0	0	0	111.7	C76 C79 F81 A88 Y89 R94 N95 V96 H97	C76-H92 WeakPolarHBondContact CB-NE2 3.02Å; C76-H92 PolarHBondContact SG-NE2 2.88Å; C79-H92 PolarHBondContact SG-CE1 2.94Å; C79-H92 PolarHBondContact SG-NE2 2.88Å; F81-H92 HydrophobicContact CD1-CB 3.84Å; F81-H92 AromaticContact CD1-CD2 3.41Å; F81-H92 VanDerWaalsContact CD1-CD2 3.41Å; F81-H92 WeakPolarHBondContact CD1-CD2 3.48Å; F81-H92 AromaticContact CD1-CG 3.47Å; F81-H92 VanDerWaalsContact CD1-CG 3.47Å; F81-H92 HydrophobicContact CD2-CB 4.23Å; F81-H92 AromaticContact CD2-CG 3.87Å; F81-H92 AromaticContact CD2-ND1 3.84Å; F81-H92 HydrophobicContact CE1-CB 3.68Å; F81-H92 AromaticContact CE1-CG 3.86Å; F81-H92 HydrophobicContact CE2-CB 4.06Å; F81-H92 HydrophobicContact CG-CB 4.12Å; F81-H92 AromaticContact CG-CD2 3.64Å; F81-H92 AromaticContact CG-CE1 3.9Å; F81-H92 AromaticContact CG-CG 3.48Å; F81-H92 VanDerWaalsContact CG-CG 3.48Å; F81-H92 AromaticContact CG-ND1 3.64Å; F81-H92 AromaticContact CG-NE2 3.9Å; F81-H92 HydrophobicContact CZ-CB 3.78Å; A88-H92 WeakPolarHBondContact O-CB 3.49Å; A88-H92 PolarHBondContact O-N 3.36Å; Y89-H92 PolarHBondContact O-N 2.92Å; H92-R94 VanDerWaalsContact C-N 3.33Å; H92-R94 PolarHBondContact O-N 2.78Å; H92-N95 PolarHBondContact O-N 2.96Å; H92-N95 VanDerWaalsContact O-N 3.07Å; H92-V96 WeakPolarHBondContact ND1-CG2 3.36Å; H92-V96 WeakPolarHBondContact O-CB 3.3Å; H92-V96 PolarHBondContact O-N 3.48Å; H92-H97 AromaticContact NE2-CD2 3.72Å; H92-H97 AromaticContact NE2-NE2 3.82Å
93	F	79.4	Confident	75.1	Confident	74 Å²	74	81.3 Å²	81.3	33%	0.325	40%	0.4	S	S	.	.	H	α-helix	trans	-58	-42.8	-179	-173.6	-92.5	0	0	0	112.6	Y89 H97 F101	Y89-F93 WeakPolarHBondContact O-CB 3.06Å; Y89-F93 PolarHBondContact O-N 3.36Å; F93-H97 PolarHBondContact O-N 2.82Å; F93-F101 HydrophobicContact CE1-CD2 4.29Å; F93-F101 HydrophobicContact CE1-CE2 4.39Å; F93-F101 HydrophobicContact CZ-CD2 4.08Å; F93-F101 HydrophobicContact CZ-CE2 4.33Å
94	R	78.4	Confident	74.1	Confident	134 Å²	134	87 Å²	87	51%	0.506	43%	0.43	S	S	.	.	H	α-helix	trans	-70.8	-25.9	176.3	-73.5	-171	-16.2	-99.4	-34.1	114.7	K90 S91 H92 S98	K90-R94 WeakPolarHBondContact O-CG 3.39Å; K90-R94 PolarHBondContact O-N 2.88Å; S91-R94 PolarHBondContact O-N 3.45Å; S91-R94 PolarHBondContact OG-NH2 2.8Å; S91-R94 VanDerWaalsContact OG-NH2 3.08Å; H92-R94 VanDerWaalsContact C-N 3.33Å; H92-R94 PolarHBondContact O-N 2.78Å; R94-S98 WeakPolarHBondContact O-CB 3.41Å
95	N	77.9	Confident	73.5	Confident	102 Å²	102	83 Å²	83	55%	0.545	42%	0.415	S	S	.	.	H	α-helix	trans	-106.4	-16.3	-168.1	-67.1	24	0	0	0	113	S91 H92	S91-N95 WeakPolarHBondContact O-CB 3.48Å; S91-N95 PolarHBondContact O-N 3.36Å; S91-N95 PolarHBondContact O-OD1 3.17Å; S91-N95 VanDerWaalsContact O-OD1 3.08Å; H92-N95 PolarHBondContact O-N 2.96Å; H92-N95 VanDerWaalsContact O-N 3.07Å
96	V	76	Confident	73.2	Confident	84 Å²	84	81.7 Å²	81.7	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-115.8	-33.2	-177.8	-177.9	0	0	0	0	112.1	H92	H92-V96 WeakPolarHBondContact ND1-CG2 3.36Å; H92-V96 WeakPolarHBondContact O-CB 3.3Å; H92-V96 PolarHBondContact O-N 3.48Å
97	H	75.1	Confident	73.3	Confident	22 Å²	22	79.5 Å²	79.5	10%	0.102	41%	0.41	C	S	.	.	S	Bend	trans	-113.9	20.2	-179	-64.7	-65.7	0	0	0	112.9	C76 C79 H92 F93 E99 D100 F101	C76-H97 PolarHBondContact SG-CD2 2.81Å; C76-H97 PolarHBondContact SG-NE2 3.41Å; C76-H97 VanDerWaalsContact SG-NE2 3.37Å; C79-H97 PolarHBondContact SG-NE2 2.88Å; H92-H97 AromaticContact NE2-CD2 3.72Å; H92-H97 AromaticContact NE2-NE2 3.82Å; F93-H97 PolarHBondContact O-N 2.82Å; H97-E99 PolarHBondContact O-N 3.14Å; H97-D100 HydrophobicContact CB-CB 4.46Å; H97-D100 IonicContact CE1-OD2 3.91Å; H97-D100 IonicContact CG-OD2 3.13Å; H97-D100 IonicContact ND1-OD2 2.78Å; H97-D100 PolarHBondContact ND1-OD2 3.41Å; H97-F101 WeakPolarHBondContact O-CB 3.45Å; H97-F101 PolarHBondContact O-N 3.37Å
98	S	66.4	Low	73.1	Confident	50 Å²	50	81 Å²	81	35%	0.35	41%	0.411	S	S	.	.	H	α-helix	trans	-59.4	-44.3	176	35.2	0	0	0	0	112.6	R94 F101 E102	R94-S98 WeakPolarHBondContact O-CB 3.41Å; S98-F101 PolarHBondContact O-N 2.91Å; S98-E102 PolarHBondContact O-N 2.98Å
99	E	60.6	Low	73.1	Confident	142 Å²	142	79.7 Å²	79.7	66%	0.664	40%	0.399	S	S	*	.	H	α-helix	trans	-75.7	-40.7	-176.7	-59.3	-169	-171.9	0	0	111.3	H97 F101 E102 N103	H97-E99 PolarHBondContact O-N 3.14Å; E99-F101 VanDerWaalsContact C-N 3.26Å; E99-F101 PolarHBondContact O-N 3.49Å; E99-E102 PolarHBondContact O-N 3.17Å; E99-N103 WeakPolarHBondContact O-CB 3.44Å; E99-N103 VanDerWaalsContact O-CG 3.29Å; E99-N103 PolarHBondContact O-N 3.35Å; E99-N103 PolarHBondContact O-ND2 3.43Å
100	D	61.8	Low	72.9	Confident	83 Å²	83	81.9 Å²	81.9	44%	0.444	42%	0.42	S	S	.	.	H	α-helix	trans	-54.9	-45.2	170.2	-60.1	-34.8	0	0	0	111.1	H97 N104	H97-D100 HydrophobicContact CB-CB 4.46Å; H97-D100 IonicContact CE1-OD2 3.91Å; H97-D100 IonicContact CG-OD2 3.13Å; H97-D100 IonicContact ND1-OD2 2.78Å; H97-D100 PolarHBondContact ND1-OD2 3.41Å; D100-N104 VanDerWaalsContact O-CB 3.27Å; D100-N104 WeakPolarHBondContact O-CB 3.32Å; D100-N104 PolarHBondContact O-N 2.77Å; D100-N104 PolarHBondContact O-ND2 2.88Å
101	F	60.7	Low	72.4	Confident	112 Å²	112	84.4 Å²	84.4	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-66.8	-46.8	-179.6	-171.2	-112.2	0	0	0	111.8	F93 H97 S98 E99 N103 I105	F93-F101 HydrophobicContact CE1-CD2 4.29Å; F93-F101 HydrophobicContact CE1-CE2 4.39Å; F93-F101 HydrophobicContact CZ-CD2 4.08Å; F93-F101 HydrophobicContact CZ-CE2 4.33Å; H97-F101 WeakPolarHBondContact O-CB 3.45Å; H97-F101 PolarHBondContact O-N 3.37Å; S98-F101 PolarHBondContact O-N 2.91Å; E99-F101 VanDerWaalsContact C-N 3.26Å; E99-F101 PolarHBondContact O-N 3.49Å; F101-N103 PolarHBondContact O-N 3.16Å; F101-I105 HydrophobicContact CD1-CD1 3.63Å; F101-I105 HydrophobicContact CD2-CD1 3.9Å; F101-I105 HydrophobicContact CD2-CG1 4.45Å; F101-I105 HydrophobicContact CE1-CD1 3.5Å; F101-I105 HydrophobicContact CE2-CD1 3.78Å; F101-I105 HydrophobicContact CE2-CG1 4.46Å; F101-I105 HydrophobicContact CG-CD1 3.84Å; F101-I105 HydrophobicContact CZ-CD1 3.58Å; F101-I105 VanDerWaalsContact O-CD1 3.27Å; F101-I105 WeakPolarHBondContact O-CD1 3.36Å; F101-I105 WeakPolarHBondContact O-CG1 3.41Å; F101-I105 PolarHBondContact O-N 3.16Å
102	E	62.3	Low	72.3	Confident	95 Å²	95	84.9 Å²	84.9	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-69.2	-29.7	178	-72.4	-156.7	153.6	0	0	114.1	S98 E99 K118	S98-E102 PolarHBondContact O-N 2.98Å; E99-E102 PolarHBondContact O-N 3.17Å; E102-K118 HydrophobicContact CB-CD 4.48Å; E102-K118 IonicContact OE1-NZ 2.76Å; E102-K118 PolarHBondContact OE1-NZ 3.07Å; E102-K118 WeakPolarHBondContact OE2-CD 3.21Å; E102-K118 IonicContact OE2-NZ 2.77Å; E102-K118 PolarHBondContact OE2-NZ 3.28Å
103	N	60.3	Low	72.2	Confident	57 Å²	57	90.4 Å²	90.4	31%	0.305	47%	0.466	S	S	.	.	H	α-helix	trans	-80.4	-33	177.8	-69	-52.6	0	0	0	112.7	E99 F101 N117 K119	E99-N103 WeakPolarHBondContact O-CB 3.44Å; E99-N103 VanDerWaalsContact O-CG 3.29Å; E99-N103 PolarHBondContact O-N 3.35Å; E99-N103 PolarHBondContact O-ND2 3.43Å; F101-N103 PolarHBondContact O-N 3.16Å; N103-N117 WeakPolarHBondContact O-CB 3.42Å; N103-K119 PolarHBondContact OD1-NZ 2.82Å
104	N	61.1	Low	72.4	Confident	129 Å²	129	90.5 Å²	90.5	69%	0.69	47%	0.466	S	S	*	.	H	α-helix	trans	-90.6	-13.3	-177.8	-71.9	-69.6	0	0	0	114.9	D100 L106	D100-N104 VanDerWaalsContact O-CB 3.27Å; D100-N104 WeakPolarHBondContact O-CB 3.32Å; D100-N104 PolarHBondContact O-N 2.77Å; D100-N104 PolarHBondContact O-ND2 2.88Å; N104-L106 PolarHBondContact O-N 2.86Å
105	I	69.3	Low	72.4	Confident	61 Å²	61	88.1 Å²	88.1	31%	0.313	46%	0.464	S	S	.	.			trans	-76.9	113.7	173.4	-67.8	162.7	0	0	0	110.3	F101 L107 N117	F101-I105 HydrophobicContact CD1-CD1 3.63Å; F101-I105 HydrophobicContact CD2-CD1 3.9Å; F101-I105 HydrophobicContact CD2-CG1 4.45Å; F101-I105 HydrophobicContact CE1-CD1 3.5Å; F101-I105 HydrophobicContact CE2-CD1 3.78Å; F101-I105 HydrophobicContact CE2-CG1 4.46Å; F101-I105 HydrophobicContact CG-CD1 3.84Å; F101-I105 HydrophobicContact CZ-CD1 3.58Å; F101-I105 VanDerWaalsContact O-CD1 3.27Å; F101-I105 WeakPolarHBondContact O-CD1 3.36Å; F101-I105 WeakPolarHBondContact O-CG1 3.41Å; F101-I105 PolarHBondContact O-N 3.16Å; I105-L107 HydrophobicContact CG2-CD2 3.59Å; I105-L107 HydrophobicContact CG2-CG 3.96Å; I105-L107 PolarHBondContact O-N 3.2Å; I105-L107 VanDerWaalsContact O-N 3.15Å; I105-N117 WeakPolarHBondContact O-CA 3.47Å
106	L	73.9	Confident	72.7	Confident	113 Å²	113	83.6 Å²	83.6	59%	0.592	44%	0.441	S	S	*	.			trans	-72.4	101.2	163.1	-60.6	179.6	0	0	0	109.9	N104 G116	N104-L106 PolarHBondContact O-N 2.86Å; L106-G116 CarbonylContact C-O 3.6Å
107	L	77.9	Confident	72.9	Confident	73 Å²	73	81.7 Å²	81.7	38%	0.382	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	150.3	170.4	-63.2	175.9	0	0	0	109.6	I105 N115 G116 K118 L121	I105-L107 HydrophobicContact CG2-CD2 3.59Å; I105-L107 HydrophobicContact CG2-CG 3.96Å; I105-L107 PolarHBondContact O-N 3.2Å; I105-L107 VanDerWaalsContact O-N 3.15Å; L107-N115 CarbonylContact O-C 3.37Å; L107-N115 VanDerWaalsContact O-CA 3.24Å; L107-N115 WeakPolarHBondContact O-CA 3.43Å; L107-G116 PolarHBondContact N-O 2.96Å; L107-G116 PolarHBondContact O-N 3Å; L107-K118 HydrophobicContact CD1-CB 4.21Å; L107-L121 HydrophobicContact CB-CD2 3.42Å; L107-L121 VanDerWaalsContact CB-CD2 3.42Å; L107-L121 HydrophobicContact CD1-CD2 4.41Å
108	N	77.3	Confident	73.1	Confident	116 Å²	116	84 Å²	84	62%	0.62	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	143.8	178.2	-69.9	-113	0	0	0	109.2
109	C	82.2	Confident	73.7	Confident	12 Å²	12	87.7 Å²	87.7	8%	0.081	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-67	135.4	179	-174.2	0	0	0	0	111.8	Y111 F114 L121 H124 H129	C109-Y111 PolarHBondContact O-N 3.01Å; C109-Y111 PolarHBondContact SG-N 2.83Å; C109-Y111 VanDerWaalsContact SG-N 3.4Å; C109-F114 HydrophobicContact CB-CB 4.22Å; C109-F114 WeakPolarHBondContact CB-O 3.26Å; C109-F114 PolarHBondContact N-O 3.19Å; C109-L121 HydrophobicContact CB-CD1 3.63Å; C109-H124 VanDerWaalsContact SG-CD2 3.55Å; C109-H124 PolarHBondContact SG-NE2 2.67Å; C109-H129 PolarHBondContact SG-CD2 3.42Å
110	P	78.6	Confident	74.8	Confident	100 Å²	100	83.8 Å²	83.8	65%	0.649	43%	0.433	S	S	*	.	S	Bend	trans	-65.9	-13.1	173.1	-21.6	33.7	0	0	0	114.4	I125	P110-I125 HydrophobicContact CG-CD1 4.44Å
111	Y	72.3	Confident	75.8	Confident	152 Å²	152	80.4 Å²	80.4	60%	0.596	42%	0.415	S	S	*	.	S	Bend	trans	-121.9	-15.7	-166.5	-54.7	-76.4	0	0	0	114.4	C109 I125 H129	C109-Y111 PolarHBondContact O-N 3.01Å; C109-Y111 PolarHBondContact SG-N 2.83Å; C109-Y111 VanDerWaalsContact SG-N 3.4Å; Y111-I125 HydrophobicContact CD2-CG1 4.43Å; Y111-I125 HydrophobicContact CD2-CG2 4.45Å; Y111-I125 HydrophobicContact CE2-CG2 4.11Å; Y111-H129 VanDerWaalsContact CB-CG 3.48Å; Y111-H129 HydrophobicContact CD2-CB 3.73Å; Y111-H129 AromaticContact CD2-CG 3.93Å; Y111-H129 HydrophobicContact CE2-CB 4.34Å; Y111-H129 HydrophobicContact CG-CB 3.99Å; Y111-H129 AromaticContact CG-CG 3.9Å
112	C	82	Confident	76.8	Confident	53 Å²	53	80.3 Å²	80.3	36%	0.358	42%	0.416	S	S	.	.	S	Bend	trans	-155.7	-175.3	173.5	77.3	0	0	0	0	111.7	F114 H124 H129	C112-F114 VanDerWaalsContact C-N 3.26Å; C112-F114 PolarHBondContact O-N 2.84Å; C112-F114 VanDerWaalsContact SG-CB 3.56Å; C112-F114 PolarHBondContact SG-N 2.77Å; C112-F114 VanDerWaalsContact SG-N 3.44Å; C112-H124 PolarHBondContact SG-CE1 2.96Å; C112-H124 PolarHBondContact SG-NE2 3.18Å; C112-H129 PolarHBondContact SG-NE2 3.23Å
113	T	83.8	Confident	77.8	Confident	134 Å²	134	79.5 Å²	79.5	82%	0.822	42%	0.418	S	S	*	.	S	Bend	trans	-77.7	-0.6	-178.4	47.9	0	0	0	0	115.1	N115	T113-N115 PolarHBondContact O-ND2 3.18Å
114	F	83.4	Confident	79	Confident	76 Å²	76	77.4 Å²	77.4	33%	0.333	41%	0.407	S	S	.	.			trans	-61.2	141.5	177.3	-176.9	-94.1	0	0	0	111.7	C109 C112 L121 H124	C109-F114 HydrophobicContact CB-CB 4.22Å; C109-F114 WeakPolarHBondContact CB-O 3.26Å; C109-F114 PolarHBondContact N-O 3.19Å; C112-F114 VanDerWaalsContact C-N 3.26Å; C112-F114 PolarHBondContact O-N 2.84Å; C112-F114 VanDerWaalsContact SG-CB 3.56Å; C112-F114 PolarHBondContact SG-N 2.77Å; C112-F114 VanDerWaalsContact SG-N 3.44Å; F114-L121 HydrophobicContact CD1-CD1 4.05Å; F114-L121 HydrophobicContact CE1-CD1 4.48Å; F114-H124 VanDerWaalsContact CB-CE1 3.41Å; F114-H124 WeakPolarHBondContact CB-CE1 3.1Å; F114-H124 WeakPolarHBondContact CB-NE2 3.48Å; F114-H124 HydrophobicContact CD1-CB 3.71Å; F114-H124 AromaticContact CD1-CD2 3.5Å; F114-H124 AromaticContact CD1-CG 3.31Å; F114-H124 AromaticContact CD1-ND1 3.68Å; F114-H124 AromaticContact CD1-NE2 3.99Å; F114-H124 AromaticContact CD2-ND1 3.85Å; F114-H124 HydrophobicContact CE1-CB 3.55Å; F114-H124 AromaticContact CE1-CG 3.71Å; F114-H124 HydrophobicContact CG-CB 4.39Å; F114-H124 AromaticContact CG-CD2 3.88Å; F114-H124 AromaticContact CG-CE1 3.65Å; F114-H124 AromaticContact CG-CG 3.64Å; F114-H124 AromaticContact CG-ND1 3.48Å; F114-H124 WeakPolarHBondContact CG-ND1 3.43Å; F114-H124 AromaticContact CG-NE2 3.89Å; F114-H124 HydrophobicContact CZ-CB 4.11Å
115	N	78.3	Confident	80.2	Confident	85 Å²	85	73.2 Å²	73.2	46%	0.455	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.9	177.2	56.1	97.5	0	0	0	109.7	L107 T113	L107-N115 CarbonylContact O-C 3.37Å; L107-N115 VanDerWaalsContact O-CA 3.24Å; L107-N115 WeakPolarHBondContact O-CA 3.43Å; T113-N115 PolarHBondContact O-ND2 3.18Å
116	G	82.4	Confident	80.9	Confident	6 Å²	6	77.3 Å²	77.3	6%	0.062	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	167.2	-172.1	0	0	0	0	0	111.8	L106 L107	L106-G116 CarbonylContact C-O 3.6Å; L107-G116 PolarHBondContact N-O 2.96Å; L107-G116 PolarHBondContact O-N 3Å
117	N	81.2	Confident	81.2	Confident	45 Å²	45	78.2 Å²	78.2	24%	0.241	40%	0.404	C	S	.	.			trans	-64.1	165.5	172.7	68.5	22.5	0	0	0	111.5	N103 I105 K119 T120 L121	N103-N117 WeakPolarHBondContact O-CB 3.42Å; I105-N117 WeakPolarHBondContact O-CA 3.47Å; N117-K119 VanDerWaalsContact C-N 3.29Å; N117-K119 PolarHBondContact O-N 3.15Å; N117-K119 VanDerWaalsContact O-N 3.13Å; N117-K119 PolarHBondContact OD1-N 2.89Å; N117-T120 PolarHBondContact N-OG1 3.1Å; N117-T120 PolarHBondContact O-N 3Å; N117-T120 VanDerWaalsContact O-N 3.09Å; N117-T120 PolarHBondContact O-OG1 3.07Å; N117-T120 WeakPolarHBondContact OD1-CB 3.5Å; N117-T120 WeakPolarHBondContact OD1-CG2 3.2Å; N117-T120 PolarHBondContact OD1-N 3.15Å; N117-T120 PolarHBondContact OD1-OG1 3.29Å; N117-L121 WeakPolarHBondContact O-CB 3.07Å; N117-L121 PolarHBondContact O-N 3.4Å
118	K	79.6	Confident	81.1	Confident	70 Å²	70	81.6 Å²	81.6	30%	0.304	42%	0.416	S	S	.	.	H	α-helix	trans	-45.6	-48.7	-176.9	-178.9	175.8	172.5	-176	0	113.8	E102 L107 L121 E122	E102-K118 HydrophobicContact CB-CD 4.48Å; E102-K118 IonicContact OE1-NZ 2.76Å; E102-K118 PolarHBondContact OE1-NZ 3.07Å; E102-K118 WeakPolarHBondContact OE2-CD 3.21Å; E102-K118 IonicContact OE2-NZ 2.77Å; E102-K118 PolarHBondContact OE2-NZ 3.28Å; L107-K118 HydrophobicContact CD1-CB 4.21Å; K118-L121 PolarHBondContact O-N 2.91Å; K118-E122 WeakPolarHBondContact CE-OE1 3.49Å; K118-E122 VanDerWaalsContact CG-OE1 3.25Å; K118-E122 WeakPolarHBondContact CG-OE1 3.41Å; K118-E122 WeakPolarHBondContact O-CB 3.5Å; K118-E122 VanDerWaalsContact O-CG 3.27Å; K118-E122 WeakPolarHBondContact O-CG 3.32Å; K118-E122 PolarHBondContact O-N 2.82Å
119	K	79	Confident	81.2	Confident	128 Å²	128	78.8 Å²	78.8	56%	0.557	40%	0.399	S	S	*	.	H	α-helix	trans	-65.6	-45.7	-179.2	-65.7	165.2	-177.7	155.5	0	112.8	N103 N117 T123	N103-K119 PolarHBondContact OD1-NZ 2.82Å; N117-K119 VanDerWaalsContact C-N 3.29Å; N117-K119 PolarHBondContact O-N 3.15Å; N117-K119 VanDerWaalsContact O-N 3.13Å; N117-K119 PolarHBondContact OD1-N 2.89Å; K119-T123 PolarHBondContact O-N 3.07Å; K119-T123 VanDerWaalsContact O-N 3.11Å; K119-T123 PolarHBondContact O-OG1 3.37Å
120	T	82.8	Confident	80.9	Confident	59 Å²	59	83.7 Å²	83.7	36%	0.362	42%	0.422	S	S	.	.	H	α-helix	trans	-72	-29.2	178	52.1	0	0	0	0	112.8	N117 T123 H124	N117-T120 PolarHBondContact N-OG1 3.1Å; N117-T120 PolarHBondContact O-N 3Å; N117-T120 VanDerWaalsContact O-N 3.09Å; N117-T120 PolarHBondContact O-OG1 3.07Å; N117-T120 WeakPolarHBondContact OD1-CB 3.5Å; N117-T120 WeakPolarHBondContact OD1-CG2 3.2Å; N117-T120 PolarHBondContact OD1-N 3.15Å; N117-T120 PolarHBondContact OD1-OG1 3.29Å; T120-T123 WeakPolarHBondContact CA-OG1 3.32Å; T120-T123 PolarHBondContact O-OG1 2.99Å; T120-T123 VanDerWaalsContact O-OG1 3.1Å; T120-H124 WeakPolarHBondContact O-CB 3.47Å; T120-H124 PolarHBondContact O-N 3.11Å
121	L	82.9	Confident	79.5	Confident	13 Å²	13	84.6 Å²	84.6	7%	0.068	43%	0.428	C	S	.	.	H	α-helix	trans	-74.4	-40.3	173.4	179.7	59.9	0	0	0	112	L107 C109 F114 N117 K118 H124 I125	L107-L121 HydrophobicContact CB-CD2 3.42Å; L107-L121 VanDerWaalsContact CB-CD2 3.42Å; L107-L121 HydrophobicContact CD1-CD2 4.41Å; C109-L121 HydrophobicContact CB-CD1 3.63Å; F114-L121 HydrophobicContact CD1-CD1 4.05Å; F114-L121 HydrophobicContact CE1-CD1 4.48Å; N117-L121 WeakPolarHBondContact O-CB 3.07Å; N117-L121 PolarHBondContact O-N 3.4Å; K118-L121 PolarHBondContact O-N 2.91Å; L121-H124 PolarHBondContact O-N 3.36Å; L121-I125 HydrophobicContact CD1-CD1 3.93Å; L121-I125 HydrophobicContact CD1-CG1 3.97Å; L121-I125 HydrophobicContact CD2-CD1 4.44Å; L121-I125 HydrophobicContact CG-CD1 3.87Å; L121-I125 HydrophobicContact CG-CG1 4.35Å; L121-I125 WeakPolarHBondContact O-CB 3.31Å; L121-I125 VanDerWaalsContact O-CG1 3.31Å; L121-I125 WeakPolarHBondContact O-CG1 3.48Å; L121-I125 PolarHBondContact O-N 3.22Å
122	E	82.8	Confident	78.3	Confident	109 Å²	109	84.1 Å²	84.1	51%	0.509	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-43.1	175	-77.3	168.1	-168.6	0	0	111.5	K118 K126	K118-E122 WeakPolarHBondContact CE-OE1 3.49Å; K118-E122 VanDerWaalsContact CG-OE1 3.25Å; K118-E122 WeakPolarHBondContact CG-OE1 3.41Å; K118-E122 WeakPolarHBondContact O-CB 3.5Å; K118-E122 VanDerWaalsContact O-CG 3.27Å; K118-E122 WeakPolarHBondContact O-CG 3.32Å; K118-E122 PolarHBondContact O-N 2.82Å; E122-K126 VanDerWaalsContact O-CB 3.25Å; E122-K126 WeakPolarHBondContact O-CB 3.33Å; E122-K126 PolarHBondContact O-N 3.19Å
123	T	82.1	Confident	76.5	Confident	78 Å²	78	89.4 Å²	89.4	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-67.7	-40.8	173.5	55.2	0	0	0	0	112.3	K119 T120 K126 L127	K119-T123 PolarHBondContact O-N 3.07Å; K119-T123 VanDerWaalsContact O-N 3.11Å; K119-T123 PolarHBondContact O-OG1 3.37Å; T120-T123 WeakPolarHBondContact CA-OG1 3.32Å; T120-T123 PolarHBondContact O-OG1 2.99Å; T120-T123 VanDerWaalsContact O-OG1 3.1Å; T123-K126 PolarHBondContact O-N 3.29Å; T123-L127 WeakPolarHBondContact O-CB 3.45Å; T123-L127 VanDerWaalsContact O-CG 3.26Å; T123-L127 WeakPolarHBondContact O-CG 3.5Å; T123-L127 PolarHBondContact O-N 3.47Å
124	H	86.4	Confident	74.9	Confident	14 Å²	14	86.9 Å²	86.9	7%	0.065	45%	0.448	C	S	.	.	H	α-helix	trans	-58.6	-48.7	173.7	165.2	81.3	0	0	0	112.2	C109 C112 F114 T120 L121 K126 L127 F128 H129	C109-H124 VanDerWaalsContact SG-CD2 3.55Å; C109-H124 PolarHBondContact SG-NE2 2.67Å; C112-H124 PolarHBondContact SG-CE1 2.96Å; C112-H124 PolarHBondContact SG-NE2 3.18Å; F114-H124 VanDerWaalsContact CB-CE1 3.41Å; F114-H124 WeakPolarHBondContact CB-CE1 3.1Å; F114-H124 WeakPolarHBondContact CB-NE2 3.48Å; F114-H124 HydrophobicContact CD1-CB 3.71Å; F114-H124 AromaticContact CD1-CD2 3.5Å; F114-H124 AromaticContact CD1-CG 3.31Å; F114-H124 AromaticContact CD1-ND1 3.68Å; F114-H124 AromaticContact CD1-NE2 3.99Å; F114-H124 AromaticContact CD2-ND1 3.85Å; F114-H124 HydrophobicContact CE1-CB 3.55Å; F114-H124 AromaticContact CE1-CG 3.71Å; F114-H124 HydrophobicContact CG-CB 4.39Å; F114-H124 AromaticContact CG-CD2 3.88Å; F114-H124 AromaticContact CG-CE1 3.65Å; F114-H124 AromaticContact CG-CG 3.64Å; F114-H124 AromaticContact CG-ND1 3.48Å; F114-H124 WeakPolarHBondContact CG-ND1 3.43Å; F114-H124 AromaticContact CG-NE2 3.89Å; F114-H124 HydrophobicContact CZ-CB 4.11Å; T120-H124 WeakPolarHBondContact O-CB 3.47Å; T120-H124 PolarHBondContact O-N 3.11Å; L121-H124 PolarHBondContact O-N 3.36Å; H124-K126 VanDerWaalsContact C-N 3.3Å; H124-K126 PolarHBondContact O-N 3.1Å; H124-L127 PolarHBondContact O-N 2.94Å; H124-F128 AromaticContact CE1-CD2 3.88Å; H124-F128 AromaticContact ND1-CD2 3.35Å; H124-F128 WeakPolarHBondContact ND1-CD2 3.41Å; H124-F128 AromaticContact ND1-CE2 3.97Å; H124-F128 WeakPolarHBondContact O-CB 3.4Å; H124-F128 WeakPolarHBondContact O-CD2 3.29Å; H124-F128 PolarHBondContact O-N 3.31Å; H124-H129 AromaticContact CE1-NE2 3.73Å; H124-H129 AromaticContact NE2-CD2 3.35Å; H124-H129 PolarHBondContact NE2-CD2 3.47Å; H124-H129 AromaticContact NE2-NE2 3.24Å; H124-H129 PolarHBondContact NE2-NE2 3.18Å
125	I	86.4	Confident	72.8	Confident	41 Å²	41	89.2 Å²	89.2	21%	0.21	47%	0.468	C	S	.	.	H	α-helix	trans	-61.2	-41.8	176.6	-68.4	168.9	0	0	0	110.2	P110 Y111 L121 L127 H129 M130	P110-I125 HydrophobicContact CG-CD1 4.44Å; Y111-I125 HydrophobicContact CD2-CG1 4.43Å; Y111-I125 HydrophobicContact CD2-CG2 4.45Å; Y111-I125 HydrophobicContact CE2-CG2 4.11Å; L121-I125 HydrophobicContact CD1-CD1 3.93Å; L121-I125 HydrophobicContact CD1-CG1 3.97Å; L121-I125 HydrophobicContact CD2-CD1 4.44Å; L121-I125 HydrophobicContact CG-CD1 3.87Å; L121-I125 HydrophobicContact CG-CG1 4.35Å; L121-I125 WeakPolarHBondContact O-CB 3.31Å; L121-I125 VanDerWaalsContact O-CG1 3.31Å; L121-I125 WeakPolarHBondContact O-CG1 3.48Å; L121-I125 PolarHBondContact O-N 3.22Å; I125-L127 VanDerWaalsContact C-N 3.34Å; I125-L127 PolarHBondContact O-N 3.16Å; I125-H129 HydrophobicContact CG2-CB 4.34Å; I125-H129 CarbonylContact O-C 3.52Å; I125-H129 WeakPolarHBondContact O-CA 3.37Å; I125-H129 PolarHBondContact O-N 3.23Å; I125-M130 PolarHBondContact O-N 2.78Å
126	K	83.9	Confident	70.8	Confident	147 Å²	147	96.3 Å²	96.3	64%	0.639	49%	0.489	S	S	*	.	H	α-helix	trans	-65.2	-31.8	178.4	-176.5	169.1	-177.3	-179.9	0	114	E122 T123 H124 M130	E122-K126 VanDerWaalsContact O-CB 3.25Å; E122-K126 WeakPolarHBondContact O-CB 3.33Å; E122-K126 PolarHBondContact O-N 3.19Å; T123-K126 PolarHBondContact O-N 3.29Å; H124-K126 VanDerWaalsContact C-N 3.3Å; H124-K126 PolarHBondContact O-N 3.1Å; K126-M130 HydrophobicContact CB-SD 4.04Å; K126-M130 HydrophobicContact CG-SD 3.79Å
127	L	79.5	Confident	68.7	Low	131 Å²	131	105.8 Å²	105.8	69%	0.686	53%	0.531	S	S	*	.	H	α-helix	trans	-89.2	-37.6	-178.7	-69.7	169.7	0	0	0	113.4	T123 H124 I125	T123-L127 WeakPolarHBondContact O-CB 3.45Å; T123-L127 VanDerWaalsContact O-CG 3.26Å; T123-L127 WeakPolarHBondContact O-CG 3.5Å; T123-L127 PolarHBondContact O-N 3.47Å; H124-L127 PolarHBondContact O-N 2.94Å; I125-L127 VanDerWaalsContact C-N 3.34Å; I125-L127 PolarHBondContact O-N 3.16Å
128	F	76.2	Confident	66.2	Low	145 Å²	145	107 Å²	107	64%	0.636	56%	0.555	S	S	*	*	H	α-helix	trans	-110.3	-14.9	-170.5	-62	-77.6	0	0	0	114.5	H124	H124-F128 AromaticContact CE1-CD2 3.88Å; H124-F128 AromaticContact ND1-CD2 3.35Å; H124-F128 WeakPolarHBondContact ND1-CD2 3.41Å; H124-F128 AromaticContact ND1-CE2 3.97Å; H124-F128 WeakPolarHBondContact O-CB 3.4Å; H124-F128 WeakPolarHBondContact O-CD2 3.29Å; H124-F128 PolarHBondContact O-N 3.31Å
129	H	78.9	Confident	64.3	Low	57 Å²	57	110.4 Å²	110.4	26%	0.264	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-136.1	-10.6	-170	-60.7	-53.2	0	0	0	116.1	C109 Y111 C112 H124 I125	C109-H129 PolarHBondContact SG-CD2 3.42Å; Y111-H129 VanDerWaalsContact CB-CG 3.48Å; Y111-H129 HydrophobicContact CD2-CB 3.73Å; Y111-H129 AromaticContact CD2-CG 3.93Å; Y111-H129 HydrophobicContact CE2-CB 4.34Å; Y111-H129 HydrophobicContact CG-CB 3.99Å; Y111-H129 AromaticContact CG-CG 3.9Å; C112-H129 PolarHBondContact SG-NE2 3.23Å; H124-H129 AromaticContact CE1-NE2 3.73Å; H124-H129 AromaticContact NE2-CD2 3.35Å; H124-H129 PolarHBondContact NE2-CD2 3.47Å; H124-H129 AromaticContact NE2-NE2 3.24Å; H124-H129 PolarHBondContact NE2-NE2 3.18Å; I125-H129 HydrophobicContact CG2-CB 4.34Å; I125-H129 CarbonylContact O-C 3.52Å; I125-H129 WeakPolarHBondContact O-CA 3.37Å; I125-H129 PolarHBondContact O-N 3.23Å
130	M	76.4	Confident	62	Low	115 Å²	115	107.8 Å²	107.8	57%	0.567	59%	0.593	S	S	*	*	S	Bend	trans	-72.8	125.3	167.3	-84.4	-173.8	60.9	0	0	110.2	I125 K126 N132	I125-M130 PolarHBondContact O-N 2.78Å; K126-M130 HydrophobicContact CB-SD 4.04Å; K126-M130 HydrophobicContact CG-SD 3.79Å; M130-N132 PolarHBondContact O-N 3.14Å; M130-N132 VanDerWaalsContact O-N 3.1Å
131	P	49.2	Very low	59.6	Low	119 Å²	119	110.2 Å²	110.2	77%	0.773	62%	0.619	S	S	*	*			trans	-69.6	109.8	174.4	28.2	-32.8	0	0	0	109.3	N133	P131-N133 PolarHBondContact O-N 2.81Å
132	N	46.7	Very low	57.2	Low	142 Å²	142	116.4 Å²	116.4	76%	0.759	66%	0.657	S	S	*	*			trans	-71.6	98.1	-178	-158.5	19.2	0	0	0	109.8	M130 S134	M130-N132 PolarHBondContact O-N 3.14Å; M130-N132 VanDerWaalsContact O-N 3.1Å; N132-S134 PolarHBondContact O-N 3.02Å
133	N	44.4	Very low	54.7	Low	164 Å²	164	115.6 Å²	115.6	88%	0.877	67%	0.669	S	S	*	*			trans	-80.2	66	-174.5	-170.1	35.1	0	0	0	111.5	P131	P131-N133 PolarHBondContact O-N 2.81Å
134	S	49.5	Very low	52.4	Low	81 Å²	81	116.4 Å²	116.4	57%	0.566	68%	0.684	S	S	*	*			trans	-127.7	32.4	-168.8	68.4	0	0	0	0	114	N132	N132-S134 PolarHBondContact O-N 3.02Å
135	V	39.5	Very low	49.7	Very low	125 Å²	125	120.9 Å²	120.9	76%	0.758	72%	0.723	S	S	*	*			trans	-142.8	98	172.1	-173.7	0	0	0	0	112.3
136	R	37	Very low	46.8	Very low	234 Å²	234	123 Å²	123	88%	0.883	76%	0.755	S	S	*	*			trans	-179.5	143.4	134	-103.3	168.4	-178.3	-95.7	-4.8	111.7
137	Q	38.2	Very low	44.2	Very low	204 Å²	204	121 Å²	121	95%	0.953	77%	0.766	S	S	*	*	S	Bend	trans	73.5	118.1	-166.3	-49.8	-178	30.4	0	0	112.5
138	G	28.9	Very low	41.6	Very low	71 Å²	71	118.9 Å²	118.9	73%	0.732	78%	0.776	S	S	*	*			cis	-150.4	174.2	-6.4	0	0	0	0	0	111.2
139	P	39.9	Very low	39.2	Very low	142 Å²	142	115.9 Å²	115.9	92%	0.922	79%	0.785	S	S	*	*			trans	-84.3	132.2	-170.5	32.4	-33.9	0	0	0	113.5
140	G	30.6	Very low	37	Very low	72 Å²	72	121 Å²	121	74%	0.742	81%	0.813	S	S	*	*			trans	168.1	156.1	169	0	0	0	0	0	114.3
141	A	31.2	Very low	34.8	Very low	110 Å²	110	124.5 Å²	124.5	91%	0.909	83%	0.83	S	S	*	*			trans	66.7	138.4	173.7	0	0	0	0	0	118.4
142	V	33.3	Very low	34.4	Very low	143 Å²	143	127.4 Å²	127.4	87%	0.867	84%	0.836	S	S	*	*			trans	-108.5	169.9	-171.2	-72.8	0	0	0	0	112.6
143	A	31.1	Very low	33.5	Very low	93 Å²	93	130.6 Å²	130.6	77%	0.769	84%	0.843	S	S	*	*			trans	84.1	156	148.4	0	0	0	0	0	120.5
144	A	32.3	Very low	32.9	Very low	95 Å²	95	130.2 Å²	130.2	79%	0.785	84%	0.841	S	S	*	*			trans	61.3	122	176.8	0	0	0	0	0	115.8
145	A	30.1	Very low	32.1	Very low	107 Å²	107	129.5 Å²	129.5	88%	0.884	85%	0.846	S	S	*	*			cis	67.6	118.6	28.8	0	0	0	0	0	114.6
146	G	26.7	Very low	32.1	Very low	85 Å²	85	131.1 Å²	131.1	88%	0.876	85%	0.85	S	S	*	*			trans	165.3	128.2	177.9	0	0	0	0	0	111.6
147	A	27.7	Very low	31.9	Very low	107 Å²	107	128 Å²	128	88%	0.884	85%	0.85	S	S	*	*			trans	-104.2	158.2	-173.6	0	0	0	0	0	113.1
148	G	25.1	Very low	32	Very low	86 Å²	86	126.8 Å²	126.8	89%	0.887	84%	0.841	S	S	*	*			trans	79.2	164.7	156.7	0	0	0	0	0	116.8
149	G	25.4	Very low	32.4	Very low	81 Å²	81	134.3 Å²	134.3	84%	0.835	85%	0.848	S	S	*	*			trans	150	72.7	177.6	0	0	0	0	0	114.3
150	I	33.3	Very low	32.3	Very low	166 Å²	166	131.9 Å²	131.9	85%	0.851	83%	0.831	S	S	*	*			trans	-64.9	135.3	165.3	-62.6	162.6	0	0	0	108.8
151	M	31.1	Very low	32.6	Very low	187 Å²	187	134.7 Å²	134.7	92%	0.921	83%	0.833	S	S	*	*			trans	-156.1	130.5	144.5	-87.7	-135.6	153.1	0	0	111.9
152	M	39.3	Very low	33.1	Very low	181 Å²	181	135.8 Å²	135.8	89%	0.892	82%	0.823	S	S	*	*			trans	-97.5	144.1	156.9	-62.1	-175.8	-174.9	0	0	108.8
153	K	29.6	Very low	33.4	Very low	209 Å²	209	135 Å²	135	91%	0.909	82%	0.815	S	S	*	*			trans	-160	140.1	138.2	-140.6	170.2	178.5	169.1	0	112.5
154	D	31.5	Very low	34.3	Very low	155 Å²	155	136.1 Å²	136.1	83%	0.829	81%	0.811	S	S	*	*			trans	-87.9	160.8	164.6	-172.9	17.2	0	0	0	110
155	G	31.8	Very low	35.3	Very low	66 Å²	66	138.1 Å²	138.1	68%	0.68	80%	0.804	S	S	*	*			trans	148.5	76.4	176.7	0	0	0	0	0	116.5	L157	G155-L157 PolarHBondContact O-N 3Å
156	L	40.9	Very low	36.6	Very low	160 Å²	160	138 Å²	138	84%	0.838	79%	0.785	S	S	*	*			trans	-7	116.2	152	176.4	67.3	0	0	0	117.6
157	L	32.8	Very low	38.3	Very low	168 Å²	168	135.6 Å²	135.6	88%	0.88	76%	0.758	S	S	*	*			trans	-154.6	142.8	139.8	-105.1	-171.9	0	0	0	112.2	G155	G155-L157 PolarHBondContact O-N 3Å
158	K	40.3	Very low	40.7	Very low	179 Å²	179	131.7 Å²	131.7	78%	0.778	72%	0.723	S	S	*	*			trans	-115.8	118	-170.6	178.8	-177.3	-179.7	-179.9	0	111.4
159	R	35.5	Very low	43.6	Very low	228 Å²	228	130.7 Å²	130.7	86%	0.86	69%	0.693	S	S	*	*			trans	-155.4	72.2	166.8	-145.3	173.5	-73.1	175.6	-2.5	115.2
160	T	38.8	Very low	46.4	Very low	92 Å²	92	129.8 Å²	129.8	56%	0.564	67%	0.665	S	S	*	*			trans	26.9	118.2	139.2	53.9	0	0	0	0	120.3
161	V	36.1	Very low	48.8	Very low	131 Å²	131	122 Å²	122	79%	0.794	63%	0.625	S	S	*	*			trans	-135.2	107.9	134.4	179.3	0	0	0	0	108.6	N163	V161-N163 PolarHBondContact O-N 3.11Å; V161-N163 VanDerWaalsContact O-N 3.16Å; V161-N163 PolarHBondContact O-ND2 3.22Å
162	D	41.5	Very low	51.1	Low	132 Å²	132	118.6 Å²	118.6	71%	0.706	61%	0.605	S	S	*	*			trans	-68.8	107.9	-174.8	-58.3	-86.5	0	0	0	112.7	V164	D162-V164 HydrophobicContact CB-CG2 4.48Å
163	N	41.4	Very low	52.7	Low	128 Å²	128	116.6 Å²	116.6	68%	0.684	59%	0.591	S	S	*	*			trans	-99.6	77.5	164.7	-76.8	-96.9	0	0	0	108.7	V161 E165	V161-N163 PolarHBondContact O-N 3.11Å; V161-N163 VanDerWaalsContact O-N 3.16Å; V161-N163 PolarHBondContact O-ND2 3.22Å; N163-E165 PolarHBondContact O-N 2.91Å
164	V	49.1	Very low	55.1	Low	115 Å²	115	108.8 Å²	108.8	70%	0.697	56%	0.562	S	S	*	*			trans	-68.5	112.2	172.8	179.3	0	0	0	0	108.5	D162 Q166	D162-V164 HydrophobicContact CB-CG2 4.48Å; V164-Q166 VanDerWaalsContact C-N 3.32Å; V164-Q166 PolarHBondContact O-N 2.81Å
165	E	53.7	Low	57.3	Low	137 Å²	137	107.8 Å²	107.8	64%	0.64	56%	0.562	S	S	*	*			trans	-69.9	85.1	179.2	-170	177.4	-179.2	0	0	110.4	N163 A167 S267	N163-E165 PolarHBondContact O-N 2.91Å; E165-A167 PolarHBondContact O-N 2.74Å; E165-S267 VanDerWaalsContact CG-CB 3.41Å; E165-S267 WeakPolarHBondContact OE1-CB 3.41Å; E165-S267 PolarHBondContact OE1-OG 3.08Å
166	Q	56.1	Low	59.8	Low	104 Å²	104	108.5 Å²	108.5	49%	0.486	55%	0.545	S	S	.	.			trans	-68.5	101.5	-179.2	-167.1	77.7	59.5	0	0	110	V164 V168	V164-Q166 VanDerWaalsContact C-N 3.32Å; V164-Q166 PolarHBondContact O-N 2.81Å; Q166-V168 PolarHBondContact O-N 3.48Å; Q166-V168 VanDerWaalsContact O-N 3.14Å
167	A	63.4	Low	61.8	Low	36 Å²	36	108.3 Å²	108.3	30%	0.298	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	114.3	172.5	0	0	0	0	0	110.2	E165 Y169	E165-A167 PolarHBondContact O-N 2.74Å; A167-Y169 HydrophobicContact CB-CE2 4.08Å
168	V	78.1	Confident	64.3	Low	24 Å²	24	102.1 Å²	102.1	15%	0.145	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.4	174.3	-178.9	0	0	0	0	108.9	Q166 R177 T266	Q166-V168 PolarHBondContact O-N 3.48Å; Q166-V168 VanDerWaalsContact O-N 3.14Å; V168-R177 HydrophobicContact CG1-CB 4.3Å; V168-T266 PolarHBondContact N-O 3.48Å; V168-T266 PolarHBondContact O-N 2.88Å
169	Y	85.4	Confident	66.2	Low	65 Å²	65	96.7 Å²	96.7	26%	0.255	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	150.2	176.8	-58.9	-86.6	0	0	0	109.9	A167 R177 D178 P179 Y181 I263 G264 H265	A167-Y169 HydrophobicContact CB-CE2 4.08Å; Y169-R177 CarbonylContact O-C 3.58Å; Y169-R177 VanDerWaalsContact O-CA 3.3Å; Y169-R177 WeakPolarHBondContact O-CA 3.5Å; Y169-D178 PolarHBondContact N-O 3.08Å; Y169-D178 PolarHBondContact O-N 3Å; Y169-D178 VanDerWaalsContact O-O 3.09Å; Y169-P179 WeakPolarHBondContact CD2-O 3.46Å; Y169-Y181 AromaticContact CD1-CD2 3.75Å; Y169-Y181 HydrophobicContact CD1-CD2 3.75Å; Y169-Y181 HydrophobicContact CD1-CG 4.44Å; Y169-Y181 AromaticContact CE1-CD2 3.86Å; Y169-Y181 HydrophobicContact CE1-CD2 3.86Å; Y169-Y181 HydrophobicContact CE1-CG 4.4Å; Y169-Y181 HydrophobicContact CG-CD2 4.32Å; Y169-I263 HydrophobicContact CD1-CG2 3.95Å; Y169-I263 HydrophobicContact CG-CG2 4.48Å; Y169-G264 CarbonylContact C-O 3.59Å; Y169-G264 VanDerWaalsContact CA-O 3.31Å; Y169-G264 WeakPolarHBondContact CA-O 3.43Å; Y169-H265 HydrophobicContact CD1-CB 3.94Å; Y169-H265 HydrophobicContact CE1-CB 3.96Å
170	Y	84.8	Confident	68.4	Low	63 Å²	63	91.1 Å²	91.1	25%	0.247	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	152.5	178.8	64.2	-82.8	0	0	0	112.6	K172 Y176 I263 G264 T266	Y170-K172 HydrophobicContact CE2-CG 4.26Å; Y170-Y176 WeakPolarHBondContact CA-O 3.14Å; Y170-I263 CarbonylContact O-C 3.58Å; Y170-I263 WeakPolarHBondContact O-CA 3.42Å; Y170-G264 WeakPolarHBondContact CD1-O 3.15Å; Y170-G264 VanDerWaalsContact CE1-C 3.48Å; Y170-G264 PolarHBondContact N-O 3.44Å; Y170-G264 PolarHBondContact O-N 2.99Å; Y170-T266 HydrophobicContact CE1-CG2 3.81Å
171	C	84.4	Confident	70.4	Confident	2 Å²	2	89.5 Å²	89.5	1%	0.014	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	132.7	171.8	-175.7	0	0	0	0	109.9	K173 Y176 V184 I188 H192	C171-K173 VanDerWaalsContact C-N 3.26Å; C171-K173 PolarHBondContact O-N 3.07Å; C171-K173 PolarHBondContact SG-N 3Å; C171-Y176 PolarHBondContact N-O 3Å; C171-V184 HydrophobicContact CB-CG1 4.45Å; C171-I188 HydrophobicContact CB-CG1 4.33Å; C171-H192 PolarHBondContact SG-CD2 3.44Å; C171-H192 PolarHBondContact SG-NE2 3.44Å
172	K	79.6	Confident	72.2	Confident	116 Å²	116	88.4 Å²	88.4	50%	0.504	44%	0.444	S	S	.	.	S	Bend	trans	-82.4	3.4	172.5	-68.5	168.1	173.8	150.6	0	113.8	Y170 A261 M262 I263	Y170-K172 HydrophobicContact CE2-CG 4.26Å; K172-A261 VanDerWaalsContact CD-O 3.31Å; K172-A261 WeakPolarHBondContact CD-O 3.2Å; K172-A261 PolarHBondContact NZ-O 2.99Å; K172-M262 WeakPolarHBondContact CB-O 3.37Å; K172-M262 PolarHBondContact N-O 2.96Å; K172-I263 VanDerWaalsContact CE-O 3.25Å; K172-I263 WeakPolarHBondContact CE-O 3.17Å; K172-I263 PolarHBondContact NZ-O 2.93Å
173	K	72.2	Confident	74.1	Confident	138 Å²	138	84.3 Å²	84.3	60%	0.6	42%	0.424	S	S	*	.	S	Bend	trans	-118.3	-6.4	179.1	-74.4	-157.8	-179.5	-69.3	0	115.1	C171 M262	C171-K173 VanDerWaalsContact C-N 3.26Å; C171-K173 PolarHBondContact O-N 3.07Å; C171-K173 PolarHBondContact SG-N 3Å; K173-M262 HydrophobicContact CD-CE 3.6Å; K173-M262 HydrophobicContact CD-SD 4.22Å; K173-M262 HydrophobicContact CG-CE 3.98Å
174	C	80.1	Confident	76	Confident	45 Å²	45	78.2 Å²	78.2	30%	0.304	39%	0.391	S	S	.	.	S	Bend	trans	-151.5	-173.9	170.6	72.5	0	0	0	0	109.8	Y176 H187 H192	C174-Y176 VanDerWaalsContact C-N 3.31Å; C174-Y176 PolarHBondContact O-N 2.61Å; C174-Y176 WeakPolarHBondContact SG-CB 3.37Å; C174-Y176 PolarHBondContact SG-N 3.36Å; C174-Y176 VanDerWaalsContact SG-N 3.37Å; C174-H187 PolarHBondContact SG-NE2 2.99Å; C174-H192 PolarHBondContact SG-NE2 2.96Å
175	T	77.3	Confident	77.4	Confident	135 Å²	135	76.1 Å²	76.1	83%	0.828	37%	0.371	S	S	*	.	S	Bend	trans	-80.1	-4.8	179.8	46.2	0	0	0	0	114.8	R177	T175-R177 WeakPolarHBondContact O-CG 3.4Å
176	Y	83.4	Confident	78.4	Confident	81 Å²	81	76.9 Å²	76.9	32%	0.318	37%	0.372	S	S	.	.			trans	-63.8	131.3	-174.3	-170.9	-99.1	0	0	0	113.1	Y170 C171 C174 D178 V183 V184 H187	Y170-Y176 WeakPolarHBondContact CA-O 3.14Å; C171-Y176 PolarHBondContact N-O 3Å; C174-Y176 VanDerWaalsContact C-N 3.31Å; C174-Y176 PolarHBondContact O-N 2.61Å; C174-Y176 WeakPolarHBondContact SG-CB 3.37Å; C174-Y176 PolarHBondContact SG-N 3.36Å; C174-Y176 VanDerWaalsContact SG-N 3.37Å; Y176-D178 HydrophobicContact CE1-CB 4.26Å; Y176-V183 HydrophobicContact CE1-CG1 4.4Å; Y176-V183 VanDerWaalsContact OH-CG1 3.23Å; Y176-V183 WeakPolarHBondContact OH-CG1 3.2Å; Y176-V184 HydrophobicContact CE1-CG2 4.43Å; Y176-H187 HydrophobicContact CD1-CB 3.65Å; Y176-H187 AromaticContact CD1-CD2 3.75Å; Y176-H187 AromaticContact CD1-CG 3.41Å; Y176-H187 VanDerWaalsContact CD1-CG 3.41Å; Y176-H187 AromaticContact CD1-ND1 3.87Å; Y176-H187 AromaticContact CD2-ND1 3.97Å; Y176-H187 HydrophobicContact CE1-CB 3.54Å; Y176-H187 AromaticContact CE1-CG 3.8Å; Y176-H187 HydrophobicContact CG-CB 4.39Å; Y176-H187 AromaticContact CG-CD2 3.99Å; Y176-H187 AromaticContact CG-CG 3.72Å; Y176-H187 AromaticContact CG-ND1 3.7Å
177	R	83.4	Confident	79.6	Confident	155 Å²	155	73.3 Å²	73.3	59%	0.585	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	145.8	179	-40.3	-162.2	179	-160	0.7	110.2	V168 Y169 T175	V168-R177 HydrophobicContact CG1-CB 4.3Å; Y169-R177 CarbonylContact O-C 3.58Å; Y169-R177 VanDerWaalsContact O-CA 3.3Å; Y169-R177 WeakPolarHBondContact O-CA 3.5Å; T175-R177 WeakPolarHBondContact O-CG 3.4Å
178	D	85.1	Confident	80.3	Confident	38 Å²	38	71.6 Å²	71.6	20%	0.203	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	143.3	176.2	-165.6	-79.1	0	0	0	110.3	Y169 Y176 L180 V183 V184	Y169-D178 PolarHBondContact N-O 3.08Å; Y169-D178 PolarHBondContact O-N 3Å; Y169-D178 VanDerWaalsContact O-O 3.09Å; Y176-D178 HydrophobicContact CE1-CB 4.26Å; D178-L180 PolarHBondContact O-N 3.09Å; D178-L180 WeakPolarHBondContact OD1-CA 3.47Å; D178-L180 VanDerWaalsContact OD1-CB 3.3Å; D178-L180 WeakPolarHBondContact OD1-CB 3.39Å; D178-L180 PolarHBondContact OD1-N 3.11Å; D178-V183 HydrophobicContact CB-CB 4.21Å; D178-V183 HydrophobicContact CB-CG1 4.11Å; D178-V184 HydrophobicContact CB-CG2 3.67Å
179	P	81.2	Confident	79.8	Confident	65 Å²	65	72.2 Å²	72.2	42%	0.422	34%	0.341	S	S	.	.	S	Bend	trans	-61.7	-20.7	173.6	-23.2	35	0	0	0	114.4	Y169	Y169-P179 WeakPolarHBondContact CD2-O 3.46Å
180	L	82.4	Confident	79	Confident	112 Å²	112	76.6 Å²	76.6	59%	0.586	36%	0.357	S	S	*	.			trans	-100	111.1	-178.9	-58.8	177.3	0	0	0	110.9	D178 N182 V183 V184	D178-L180 PolarHBondContact O-N 3.09Å; D178-L180 WeakPolarHBondContact OD1-CA 3.47Å; D178-L180 VanDerWaalsContact OD1-CB 3.3Å; D178-L180 WeakPolarHBondContact OD1-CB 3.39Å; D178-L180 PolarHBondContact OD1-N 3.11Å; L180-N182 PolarHBondContact O-N 3.21Å; L180-N182 VanDerWaalsContact O-N 3.08Å; L180-V183 HydrophobicContact CB-CB 4.17Å; L180-V183 HydrophobicContact CB-CG2 3.73Å; L180-V183 HydrophobicContact CD1-CG2 4.02Å; L180-V183 HydrophobicContact CG-CG2 4.49Å; L180-V183 WeakPolarHBondContact O-CB 3.45Å; L180-V183 PolarHBondContact O-N 3.33Å; L180-V184 PolarHBondContact O-N 3.41Å
181	Y	79	Confident	78.2	Confident	58 Å²	58	77.9 Å²	77.9	23%	0.227	37%	0.365	C	S	.	.	H	α-helix	trans	-44.4	-44.4	173.8	174.2	-99.8	0	0	0	113.1	Y169 V183 V184 R185 T260 I263	Y169-Y181 AromaticContact CD1-CD2 3.75Å; Y169-Y181 HydrophobicContact CD1-CD2 3.75Å; Y169-Y181 HydrophobicContact CD1-CG 4.44Å; Y169-Y181 AromaticContact CE1-CD2 3.86Å; Y169-Y181 HydrophobicContact CE1-CD2 3.86Å; Y169-Y181 HydrophobicContact CE1-CG 4.4Å; Y169-Y181 HydrophobicContact CG-CD2 4.32Å; Y181-V183 VanDerWaalsContact C-N 3.3Å; Y181-V183 PolarHBondContact O-N 3.19Å; Y181-V184 PolarHBondContact O-N 3.3Å; Y181-R185 WeakPolarHBondContact O-CB 2.85Å; Y181-R185 PolarHBondContact O-N 3.44Å; Y181-R185 PolarHBondContact OH-NE 3.36Å; Y181-R185 PolarHBondContact OH-NH2 3.24Å; Y181-T260 WeakPolarHBondContact OH-CG2 3.48Å; Y181-T260 PolarHBondContact OH-OG1 3.45Å; Y181-I263 HydrophobicContact CD2-CD1 3.84Å; Y181-I263 HydrophobicContact CD2-CG2 4.03Å; Y181-I263 HydrophobicContact CE2-CB 4.27Å; Y181-I263 HydrophobicContact CE2-CD1 3.34Å; Y181-I263 HydrophobicContact CE2-CG1 4.37Å; Y181-I263 HydrophobicContact CE2-CG2 4.04Å
182	N	74.3	Confident	77.4	Confident	108 Å²	108	79.3 Å²	79.3	58%	0.578	37%	0.372	S	S	*	.	H	α-helix	trans	-65.7	-28.5	-179	-69.9	-28.7	0	0	0	113.7	L180 K186	L180-N182 PolarHBondContact O-N 3.21Å; L180-N182 VanDerWaalsContact O-N 3.08Å; N182-K186 WeakPolarHBondContact O-CG 3.14Å; N182-K186 PolarHBondContact O-N 2.91Å
183	V	81.9	Confident	76.7	Confident	46 Å²	46	74 Å²	74	28%	0.279	35%	0.348	S	S	.	.	H	α-helix	trans	-75.8	-46.5	177.7	177.9	0	0	0	0	110	Y176 D178 L180 Y181 R185 K186 H187	Y176-V183 HydrophobicContact CE1-CG1 4.4Å; Y176-V183 VanDerWaalsContact OH-CG1 3.23Å; Y176-V183 WeakPolarHBondContact OH-CG1 3.2Å; D178-V183 HydrophobicContact CB-CB 4.21Å; D178-V183 HydrophobicContact CB-CG1 4.11Å; L180-V183 HydrophobicContact CB-CB 4.17Å; L180-V183 HydrophobicContact CB-CG2 3.73Å; L180-V183 HydrophobicContact CD1-CG2 4.02Å; L180-V183 HydrophobicContact CG-CG2 4.49Å; L180-V183 WeakPolarHBondContact O-CB 3.45Å; L180-V183 PolarHBondContact O-N 3.33Å; Y181-V183 VanDerWaalsContact C-N 3.3Å; Y181-V183 PolarHBondContact O-N 3.19Å; V183-R185 PolarHBondContact O-N 3.01Å; V183-K186 PolarHBondContact O-N 3.34Å; V183-H187 PolarHBondContact O-N 3.37Å
184	V	80.3	Confident	76.2	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.3	-37.6	171.6	-172	0	0	0	0	111.4	C171 Y176 D178 L180 Y181 H187 I188 I263	C171-V184 HydrophobicContact CB-CG1 4.45Å; Y176-V184 HydrophobicContact CE1-CG2 4.43Å; D178-V184 HydrophobicContact CB-CG2 3.67Å; L180-V184 PolarHBondContact O-N 3.41Å; Y181-V184 PolarHBondContact O-N 3.3Å; V184-H187 PolarHBondContact O-N 3.27Å; V184-I188 HydrophobicContact CG1-CD1 4.19Å; V184-I188 WeakPolarHBondContact O-CG1 3.13Å; V184-I188 PolarHBondContact O-N 3Å; V184-I263 HydrophobicContact CG1-CG1 4.1Å; V184-I263 HydrophobicContact CG1-CG2 4.45Å
185	R	79.9	Confident	74.9	Confident	71 Å²	71	78.7 Å²	78.7	27%	0.268	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-47.8	175.1	-147.2	-175.7	-157.9	179.2	8.1	111.9	Y181 V183 I188 Y189 V259 T260 I263	Y181-R185 WeakPolarHBondContact O-CB 2.85Å; Y181-R185 PolarHBondContact O-N 3.44Å; Y181-R185 PolarHBondContact OH-NE 3.36Å; Y181-R185 PolarHBondContact OH-NH2 3.24Å; V183-R185 PolarHBondContact O-N 3.01Å; R185-I188 PolarHBondContact O-N 3.33Å; R185-Y189 HydrophobicContact CB-CE2 4.42Å; R185-Y189 HydrophobicContact CG-CD2 4.22Å; R185-Y189 HydrophobicContact CG-CE2 3.6Å; R185-Y189 WeakPolarHBondContact O-CD2 3.18Å; R185-Y189 PolarHBondContact O-N 3.36Å; R185-V259 HydrophobicContact CG-CG1 3.91Å; R185-T260 PolarHBondContact NH2-OG1 3.15Å; R185-I263 HydrophobicContact CB-CD1 3.92Å; R185-I263 HydrophobicContact CG-CD1 3.91Å
186	K	74.6	Confident	73.7	Confident	152 Å²	152	73.9 Å²	73.9	66%	0.661	34%	0.338	S	S	*	.	H	α-helix	trans	-61.8	-41.2	175	-78.7	-179.1	175.1	-174	0	112.5	N182 V183 Y189 R190	N182-K186 WeakPolarHBondContact O-CG 3.14Å; N182-K186 PolarHBondContact O-N 2.91Å; V183-K186 PolarHBondContact O-N 3.34Å; K186-Y189 PolarHBondContact O-N 3.1Å; K186-R190 PolarHBondContact O-N 3.46Å; K186-R190 VanDerWaalsContact O-N 3.08Å
187	H	82	Confident	72.3	Confident	29 Å²	29	70.3 Å²	70.3	13%	0.134	33%	0.326	C	S	.	.	H	α-helix	trans	-56.1	-49.7	172.3	167.8	81.5	0	0	0	111.4	C174 Y176 V183 V184 Y189 R190 E191 H192	C174-H187 PolarHBondContact SG-NE2 2.99Å; Y176-H187 HydrophobicContact CD1-CB 3.65Å; Y176-H187 AromaticContact CD1-CD2 3.75Å; Y176-H187 AromaticContact CD1-CG 3.41Å; Y176-H187 VanDerWaalsContact CD1-CG 3.41Å; Y176-H187 AromaticContact CD1-ND1 3.87Å; Y176-H187 AromaticContact CD2-ND1 3.97Å; Y176-H187 HydrophobicContact CE1-CB 3.54Å; Y176-H187 AromaticContact CE1-CG 3.8Å; Y176-H187 HydrophobicContact CG-CB 4.39Å; Y176-H187 AromaticContact CG-CD2 3.99Å; Y176-H187 AromaticContact CG-CG 3.72Å; Y176-H187 AromaticContact CG-ND1 3.7Å; V183-H187 PolarHBondContact O-N 3.37Å; V184-H187 PolarHBondContact O-N 3.27Å; H187-Y189 PolarHBondContact O-N 3.21Å; H187-R190 PolarHBondContact O-N 2.83Å; H187-E191 WeakPolarHBondContact CE1-CG 3.46Å; H187-E191 PolarHBondContact O-N 3.47Å; H187-H192 AromaticContact NE2-CD2 2.82Å; H187-H192 PolarHBondContact NE2-CD2 2.73Å; H187-H192 AromaticContact NE2-CE1 3.22Å; H187-H192 PolarHBondContact NE2-CE1 3.48Å; H187-H192 AromaticContact NE2-CG 3.94Å; H187-H192 AromaticContact NE2-NE2 2.2Å; H187-H192 PolarHBondContact NE2-NE2 2.77Å
188	I	76.3	Confident	71	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.9	-43.5	178.3	-69.3	164.3	0	0	0	111.4	C171 V184 R185 R190 H192 F193 V259 M262 I263	C171-I188 HydrophobicContact CB-CG1 4.33Å; V184-I188 HydrophobicContact CG1-CD1 4.19Å; V184-I188 WeakPolarHBondContact O-CG1 3.13Å; V184-I188 PolarHBondContact O-N 3Å; R185-I188 PolarHBondContact O-N 3.33Å; I188-R190 PolarHBondContact O-N 3.37Å; I188-H192 HydrophobicContact CG2-CB 4.37Å; I188-H192 PolarHBondContact O-N 3.23Å; I188-H192 VanDerWaalsContact O-N 3.12Å; I188-F193 WeakPolarHBondContact O-CB 3.42Å; I188-F193 PolarHBondContact O-N 2.86Å; I188-V259 HydrophobicContact CB-CG1 4.03Å; I188-V259 HydrophobicContact CG2-CB 4.13Å; I188-V259 HydrophobicContact CG2-CG1 3.58Å; I188-V259 HydrophobicContact CG2-CG2 3.81Å; I188-M262 HydrophobicContact CD1-CB 4.16Å; I188-M262 HydrophobicContact CG2-CE 3.63Å; I188-I263 HydrophobicContact CD1-CD1 4.25Å; I188-I263 HydrophobicContact CD1-CG1 3.39Å
189	Y	69.3	Low	69.5	Low	37 Å²	37	70.6 Å²	70.6	15%	0.145	34%	0.34	C	S	.	.	H	α-helix	trans	-62.8	-23.9	177.6	-70.8	-47.9	0	0	0	114	R185 K186 H187 F193 I249 V259	R185-Y189 HydrophobicContact CB-CE2 4.42Å; R185-Y189 HydrophobicContact CG-CD2 4.22Å; R185-Y189 HydrophobicContact CG-CE2 3.6Å; R185-Y189 WeakPolarHBondContact O-CD2 3.18Å; R185-Y189 PolarHBondContact O-N 3.36Å; K186-Y189 PolarHBondContact O-N 3.1Å; H187-Y189 PolarHBondContact O-N 3.21Å; Y189-F193 HydrophobicContact CD1-CG 4.31Å; Y189-F193 WeakPolarHBondContact O-CB 3.41Å; Y189-I249 HydrophobicContact CD1-CD1 3.37Å; Y189-I249 HydrophobicContact CD1-CG1 3.9Å; Y189-I249 HydrophobicContact CD2-CD1 3.95Å; Y189-I249 HydrophobicContact CE1-CD1 3.5Å; Y189-I249 VanDerWaalsContact CE1-CD1 3.5Å; Y189-I249 HydrophobicContact CE1-CG1 3.54Å; Y189-I249 HydrophobicContact CE1-CG2 4.22Å; Y189-I249 HydrophobicContact CE2-CD1 4.04Å; Y189-I249 HydrophobicContact CE2-CG2 4.17Å; Y189-I249 HydrophobicContact CG-CD1 3.64Å; Y189-I249 WeakPolarHBondContact OH-CG2 3.41Å; Y189-V259 HydrophobicContact CD1-CB 4.3Å; Y189-V259 HydrophobicContact CD1-CG1 3.98Å; Y189-V259 HydrophobicContact CD1-CG2 3.81Å; Y189-V259 HydrophobicContact CE1-CB 3.67Å; Y189-V259 HydrophobicContact CE1-CG1 3.55Å; Y189-V259 HydrophobicContact CE1-CG2 3.52Å; Y189-V259 HydrophobicContact CE2-CG1 4.31Å; Y189-V259 HydrophobicContact CG-CG1 4.49Å
190	R	67.9	Low	68	Low	157 Å²	157	70.5 Å²	70.5	59%	0.592	33%	0.331	S	S	*	.	H	α-helix	trans	-92.3	-57.1	177.1	-162	176.9	65.6	-119.3	-12.3	112.3	K186 H187 I188	K186-R190 PolarHBondContact O-N 3.46Å; K186-R190 VanDerWaalsContact O-N 3.08Å; H187-R190 PolarHBondContact O-N 2.83Å; I188-R190 PolarHBondContact O-N 3.37Å
191	E	68.4	Low	66.6	Low	90 Å²	90	66.9 Å²	66.9	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-88.2	-23.1	-167.2	-51.8	-54.9	157.2	0	0	114.8	H187	H187-E191 WeakPolarHBondContact CE1-CG 3.46Å; H187-E191 PolarHBondContact O-N 3.47Å
192	H	67.4	Low	65.3	Low	33 Å²	33	67 Å²	67	15%	0.153	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-18.3	-172.9	-60.4	-42.4	0	0	0	113.8	C171 C174 H187 I188 M262	C171-H192 PolarHBondContact SG-CD2 3.44Å; C171-H192 PolarHBondContact SG-NE2 3.44Å; C174-H192 PolarHBondContact SG-NE2 2.96Å; H187-H192 AromaticContact NE2-CD2 2.82Å; H187-H192 PolarHBondContact NE2-CD2 2.73Å; H187-H192 AromaticContact NE2-CE1 3.22Å; H187-H192 PolarHBondContact NE2-CE1 3.48Å; H187-H192 AromaticContact NE2-CG 3.94Å; H187-H192 AromaticContact NE2-NE2 2.2Å; H187-H192 PolarHBondContact NE2-NE2 2.77Å; I188-H192 HydrophobicContact CG2-CB 4.37Å; I188-H192 PolarHBondContact O-N 3.23Å; I188-H192 VanDerWaalsContact O-N 3.12Å; H192-M262 HydrophobicContact CB-CE 3.9Å
193	F	65.6	Low	64	Low	3 Å²	3	68.7 Å²	68.7	1%	0.013	32%	0.321	C	S	.	.	S	Bend	trans	-84.7	-18.7	-177.4	-168.8	-105	0	0	0	113.5	I188 Y189 Q195 V196 A197 V245 I255 V259	I188-F193 WeakPolarHBondContact O-CB 3.42Å; I188-F193 PolarHBondContact O-N 2.86Å; Y189-F193 HydrophobicContact CD1-CG 4.31Å; Y189-F193 WeakPolarHBondContact O-CB 3.41Å; F193-Q195 PolarHBondContact O-N 2.81Å; F193-V196 HydrophobicContact CD2-CB 3.77Å; F193-V196 HydrophobicContact CD2-CG1 4.05Å; F193-V196 HydrophobicContact CD2-CG2 4.42Å; F193-V196 HydrophobicContact CE2-CB 3.75Å; F193-V196 HydrophobicContact CE2-CG1 3.59Å; F193-V196 HydrophobicContact CG-CB 4.49Å; F193-V196 HydrophobicContact CZ-CB 4.49Å; F193-V196 HydrophobicContact CZ-CG1 4.37Å; F193-V196 CarbonylContact O-C 3.59Å; F193-V196 WeakPolarHBondContact O-CA 3.36Å; F193-V196 WeakPolarHBondContact O-CB 3.49Å; F193-V196 PolarHBondContact O-N 3.08Å; F193-A197 HydrophobicContact CD1-CB 4.36Å; F193-A197 HydrophobicContact CE1-CB 4.01Å; F193-A197 PolarHBondContact O-N 2.85Å; F193-V245 HydrophobicContact CD1-CG1 4.1Å; F193-V245 HydrophobicContact CE1-CG1 4.29Å; F193-I255 HydrophobicContact CE2-CG2 3.43Å; F193-I255 VanDerWaalsContact CE2-CG2 3.43Å; F193-I255 HydrophobicContact CZ-CG2 3.38Å; F193-V259 HydrophobicContact CD2-CG2 3.73Å; F193-V259 HydrophobicContact CE2-CG2 4.28Å
194	Q	60.3	Low	62.4	Low	119 Å²	119	71.6 Å²	71.6	56%	0.556	34%	0.341	S	S	*	.	H	α-helix	trans	-55.4	-37.2	177.5	-136.3	177.4	24.1	0	0	112.7	V196 Y241	Q194-V196 VanDerWaalsContact C-N 3.32Å; Q194-V196 PolarHBondContact O-N 3.2Å; Q194-Y241 HydrophobicContact CG-CE1 4.29Å
195	Q	53.7	Low	60.7	Low	164 Å²	164	74.8 Å²	74.8	77%	0.766	37%	0.373	S	S	*	.	H	α-helix	trans	-72.8	-21.8	174.7	-62.2	176.8	0.8	0	0	113.4	F193	F193-Q195 PolarHBondContact O-N 2.81Å
196	V	51.7	Low	58.6	Low	33 Å²	33	80.5 Å²	80.5	20%	0.2	40%	0.403	C	S	.	.	H	α-helix	trans	-94.1	-25	-178	-174.5	0	0	0	0	111.8	F193 Q194 P199	F193-V196 HydrophobicContact CD2-CB 3.77Å; F193-V196 HydrophobicContact CD2-CG1 4.05Å; F193-V196 HydrophobicContact CD2-CG2 4.42Å; F193-V196 HydrophobicContact CE2-CB 3.75Å; F193-V196 HydrophobicContact CE2-CG1 3.59Å; F193-V196 HydrophobicContact CG-CB 4.49Å; F193-V196 HydrophobicContact CZ-CB 4.49Å; F193-V196 HydrophobicContact CZ-CG1 4.37Å; F193-V196 CarbonylContact O-C 3.59Å; F193-V196 WeakPolarHBondContact O-CA 3.36Å; F193-V196 WeakPolarHBondContact O-CB 3.49Å; F193-V196 PolarHBondContact O-N 3.08Å; Q194-V196 VanDerWaalsContact C-N 3.32Å; Q194-V196 PolarHBondContact O-N 3.2Å; V196-P199 VanDerWaalsContact O-CD 3.28Å; V196-P199 WeakPolarHBondContact O-CD 3.29Å
197	A	54.5	Low	56.9	Low	7 Å²	7	82.7 Å²	82.7	6%	0.058	41%	0.413	C	S	.	.	H	α-helix	trans	-71.9	-28.9	170.7	0	0	0	0	0	112.6	F193 P199 Y200 I201 Y241	F193-A197 HydrophobicContact CD1-CB 4.36Å; F193-A197 HydrophobicContact CE1-CB 4.01Å; F193-A197 PolarHBondContact O-N 2.85Å; A197-P199 VanDerWaalsContact C-N 3.35Å; A197-P199 VanDerWaalsContact O-N 3.11Å; A197-Y200 WeakPolarHBondContact O-CB 3.48Å; A197-Y200 PolarHBondContact O-N 3.34Å; A197-I201 HydrophobicContact CB-CD1 4.36Å; A197-I201 PolarHBondContact O-N 3.34Å; A197-Y241 HydrophobicContact CB-CE2 4.36Å; A197-Y241 WeakPolarHBondContact CB-OH 3.33Å
198	H	54.8	Low	54.6	Low	115 Å²	115	88.1 Å²	88.1	53%	0.532	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-36.1	-173.3	-139	-77	0	0	0	116.5	Y200	H198-Y200 VanDerWaalsContact C-N 3.26Å; H198-Y200 PolarHBondContact O-N 3.2Å
199	P	53.7	Low	52.4	Low	83 Å²	83	95.4 Å²	95.4	54%	0.539	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.9	175	-21.2	35.1	0	0	0	115.5	V196 A197	V196-P199 VanDerWaalsContact O-CD 3.28Å; V196-P199 WeakPolarHBondContact O-CD 3.29Å; A197-P199 VanDerWaalsContact C-N 3.35Å; A197-P199 VanDerWaalsContact O-N 3.11Å
200	Y	50.2	Low	50.5	Low	64 Å²	64	99.5 Å²	99.5	25%	0.251	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-16.8	-179.4	-62.1	-83.6	0	0	0	113.2	A197 H198 K232 K233 I255	A197-Y200 WeakPolarHBondContact O-CB 3.48Å; A197-Y200 PolarHBondContact O-N 3.34Å; H198-Y200 VanDerWaalsContact C-N 3.26Å; H198-Y200 PolarHBondContact O-N 3.2Å; Y200-K232 WeakPolarHBondContact O-CB 3.24Å; Y200-K233 HydrophobicContact CD1-CG 3.98Å; Y200-K233 HydrophobicContact CE1-CD 4.44Å; Y200-K233 HydrophobicContact CE1-CG 3.73Å; Y200-I255 HydrophobicContact CE2-CD1 4.09Å
201	I	53.4	Low	48.9	Very low	36 Å²	36	100.2 Å²	100.2	19%	0.185	53%	0.531	C	S	.	.			trans	-79.6	136.7	173.1	-56.3	169.3	0	0	0	108.5	A197 K203 I229 Y241	A197-I201 HydrophobicContact CB-CD1 4.36Å; A197-I201 PolarHBondContact O-N 3.34Å; I201-K203 HydrophobicContact CG2-CG 4.43Å; I201-I229 HydrophobicContact CG2-CG2 4.14Å; I201-Y241 HydrophobicContact CD1-CD2 4.31Å; I201-Y241 HydrophobicContact CD1-CE2 3.68Å; I201-Y241 HydrophobicContact CG1-CE2 4.38Å
202	V	50.6	Low	47.2	Very low	60 Å²	60	102.9 Å²	102.9	36%	0.364	55%	0.548	S	S	.	.			trans	-114.6	122.2	161.1	178.5	0	0	0	0	106.8	K232	V202-K232 HydrophobicContact CG2-CD 4.35Å
203	K	48.3	Very low	45.4	Very low	144 Å²	144	105 Å²	105	63%	0.626	58%	0.579	S	S	*	*			trans	-89.1	128.3	165.9	-69.1	-176.7	-179.9	178.6	0	108.2	I201 G205	I201-K203 HydrophobicContact CG2-CG 4.43Å; K203-G205 PolarHBondContact O-N 2.89Å; K203-G205 VanDerWaalsContact O-N 3.08Å
204	P	47.5	Very low	43.5	Very low	106 Å²	106	108.5 Å²	108.5	69%	0.688	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	102.8	167	-15.9	31	0	0	0	108.9
205	G	45.9	Very low	42.2	Very low	67 Å²	67	109.1 Å²	109.1	69%	0.691	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	175	-41.8	177.6	0	0	0	0	0	117.2	K203 K207	K203-G205 PolarHBondContact O-N 2.89Å; K203-G205 VanDerWaalsContact O-N 3.08Å; G205-K207 PolarHBondContact O-N 2.76Å; G205-K207 VanDerWaalsContact O-N 3.12Å
206	E	35.6	Very low	41.3	Very low	192 Å²	192	107.1 Å²	107.1	90%	0.897	63%	0.627	S	S	*	*			trans	-82.5	98	-170.4	-69.4	178.7	129.2	0	0	112.6
207	K	38.7	Very low	40.3	Very low	197 Å²	197	113 Å²	113	86%	0.857	65%	0.653	S	S	*	*			trans	-108.3	134.2	164.4	-72.1	-178.4	178	179.6	0	109.9	G205	G205-K207 PolarHBondContact O-N 2.76Å; G205-K207 VanDerWaalsContact O-N 3.12Å
208	T	32.3	Very low	39.2	Very low	144 Å²	144	117.3 Å²	117.3	88%	0.883	68%	0.682	S	S	*	*			trans	-124.8	93.3	166.5	34.7	0	0	0	0	110.9
209	N	30.8	Very low	38.1	Very low	152 Å²	152	116.6 Å²	116.6	81%	0.813	69%	0.69	S	S	*	*			trans	25.8	125.3	156.9	-61.9	-8.8	0	0	0	121.2
210	S	29.4	Very low	37	Very low	124 Å²	124	118 Å²	118	87%	0.867	70%	0.697	S	S	*	*				-153.8	156.9	112.9	-80.4	0	0	0	0	111
211	H	34.2	Very low	36.2	Very low	172 Å²	172	120.2 Å²	120.2	80%	0.796	72%	0.718	S	S	*	*			trans	-59.8	161	179.6	-70	-17	0	0	0	113.7
212	N	33.4	Very low	35.3	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	75%	0.75	S	S	*	*			cis	-164.7	177.7	-12.3	-99.6	-3.5	0	0	0	106.5
213	G	29	Very low	34.2	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	77%	0.772	S	S	*	*			cis	152.8	146.2	-2.1	0	0	0	0	0	110.4
214	G	25.6	Very low	33.4	Very low	78 Å²	78	124.8 Å²	124.8	80%	0.804	78%	0.777	S	S	*	*			trans	174.1	155.9	-176.4	0	0	0	0	0	112.3
215	T	32.9	Very low	32.8	Very low	132 Å²	132	127 Å²	127	81%	0.81	78%	0.782	S	S	*	*			trans	-136.8	158.9	-158.1	51.1	0	0	0	0	111
216	T	33.9	Very low	32.8	Very low	121 Å²	121	127.3 Å²	127.3	74%	0.742	78%	0.779	S	S	*	*			cis	-163	178	6.7	1.8	0	0	0	0	107.9
217	E	32	Very low	33.5	Very low	158 Å²	158	124.9 Å²	124.9	74%	0.738	77%	0.772	S	S	*	*			cis	-141.1	-168.7	0.3	-66.9	-160.1	162.9	0	0	111.4
218	S	31.9	Very low	34.3	Very low	97 Å²	97	121.6 Å²	121.6	68%	0.678	76%	0.76	S	S	*	*			trans	18.9	148.8	130.6	72.1	0	0	0	0	121.8
219	S	30.9	Very low	35.7	Very low	100 Å²	100	116.8 Å²	116.8	70%	0.699	73%	0.728	S	S	*	*			cis	-168.4	149.9	-17.8	-179.5	0	0	0	0	106.1
220	T	29.9	Very low	37.3	Very low	111 Å²	111	112.8 Å²	112.8	68%	0.681	70%	0.704	S	S	*	*				-176.8	153.9	58.2	-45.4	0	0	0	0	109.6
221	T	33.2	Very low	39.1	Very low	111 Å²	111	106.9 Å²	106.9	68%	0.681	66%	0.663	S	S	*	*			trans	23.4	127.3	162	54.6	0	0	0	0	120.3
222	H	35.2	Very low	40.4	Very low	187 Å²	187	104.9 Å²	104.9	87%	0.866	65%	0.652	S	S	*	*				-151.3	159.1	56.5	-93.8	-94.9	0	0	0	112.5
223	G	28.3	Very low	41.7	Very low	79 Å²	79	104.6 Å²	104.6	81%	0.814	64%	0.644	S	S	*	*			trans	-125	158.3	177	0	0	0	0	0	113.8
224	G	30.9	Very low	43.6	Very low	71 Å²	71	103.7 Å²	103.7	73%	0.732	63%	0.625	S	S	*	*			trans	156.2	70.1	171.2	0	0	0	0	0	116.7
225	N	35.8	Very low	45.4	Very low	151 Å²	151	106.2 Å²	106.2	81%	0.807	62%	0.619	S	S	*	*			trans	-167.4	52.2	156.5	-106.2	-42.8	0	0	0	113.3	N227	N225-N227 VanDerWaalsContact C-N 3.28Å; N225-N227 PolarHBondContact O-N 3.35Å
226	A	45.9	Very low	47.3	Very low	75 Å²	75	104.6 Å²	104.6	62%	0.62	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-1.8	-174.8	0	0	0	0	0	115.6
227	N	48.4	Very low	48.9	Very low	141 Å²	141	101.9 Å²	101.9	75%	0.754	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	24.9	-164.1	-72	-4.9	0	0	0	115.2	N225 I229	N225-N227 VanDerWaalsContact C-N 3.28Å; N225-N227 PolarHBondContact O-N 3.35Å; N227-I229 PolarHBondContact O-N 3.08Å
228	Q	56.1	Low	50.7	Low	128 Å²	128	94.7 Å²	94.7	60%	0.598	55%	0.551	S	S	*	*			trans	-73.9	97	169.7	-82.4	-166.6	-7	0	0	111.1	V237	Q228-V237 HydrophobicContact CB-CG1 3.84Å; Q228-V237 HydrophobicContact CG-CG1 3.85Å
229	I	62.4	Low	51.9	Low	43 Å²	43	101.9 Å²	101.9	22%	0.221	56%	0.564	C	S	.	*			trans	-82.1	116.6	172.1	-37.1	178.5	0	0	0	108.2	I201 N227 P238 L244	I201-I229 HydrophobicContact CG2-CG2 4.14Å; N227-I229 PolarHBondContact O-N 3.08Å; I229-P238 VanDerWaalsContact O-CD 3.24Å; I229-P238 WeakPolarHBondContact O-CD 3.44Å; I229-L244 HydrophobicContact CB-CD2 4.33Å; I229-L244 HydrophobicContact CG2-CD2 3.51Å
230	H	64	Low	53.8	Low	68 Å²	68	100.4 Å²	100.4	32%	0.315	55%	0.55	S	S	.	*			trans	-114.8	148	-177.6	59.4	26.8	0	0	0	113.3	K232 F236 V237	H230-K232 PolarHBondContact O-N 3.47Å; H230-F236 CarbonylContact C-O 3.58Å; H230-F236 WeakPolarHBondContact CA-O 3.44Å; H230-V237 HydrophobicContact CB-CG1 4.43Å; H230-V237 HydrophobicContact CB-CG2 4Å
231	C	67.8	Low	55.4	Low	0 Å²	0	97.4 Å²	97.4	0%	0	53%	0.527	C	S	.	.			trans	-74.6	111	177	-174.3	0	0	0	0	111.6	K233 C234 L235 F236 L244 H252	C231-K233 PolarHBondContact O-N 2.88Å; C231-C234 WeakPolarHBondContact CB-SG 3.39Å; C231-C234 PolarHBondContact O-N 3.47Å; C231-C234 PolarHBondContact SG-SG 3.44Å; C231-L235 WeakPolarHBondContact O-CA 3.47Å; C231-L235 PolarHBondContact O-N 3.34Å; C231-F236 HydrophobicContact CB-CB 4.24Å; C231-F236 PolarHBondContact N-O 3.44Å; C231-L244 HydrophobicContact CB-CD1 3.57Å; C231-H252 PolarHBondContact SG-NE2 3.41Å; C231-H252 VanDerWaalsContact SG-NE2 3.36Å
232	K	61.8	Low	57	Low	130 Å²	130	98.1 Å²	98.1	57%	0.565	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-1.2	179.8	-163.7	172.8	-178.2	174.8	0	115.7	Y200 V202 H230	Y200-K232 WeakPolarHBondContact O-CB 3.24Å; V202-K232 HydrophobicContact CG2-CD 4.35Å; H230-K232 PolarHBondContact O-N 3.47Å
233	K	59.6	Low	58.6	Low	138 Å²	138	91.1 Å²	91.1	60%	0.6	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-27.5	-178.7	-82.7	-71.1	-178.3	-171.5	0	115.1	Y200 C231 H252	Y200-K233 HydrophobicContact CD1-CG 3.98Å; Y200-K233 HydrophobicContact CE1-CD 4.44Å; Y200-K233 HydrophobicContact CE1-CG 3.73Å; C231-K233 PolarHBondContact O-N 2.88Å; K233-H252 WeakPolarHBondContact CB-NE2 3.47Å
234	C	69.4	Low	60.6	Low	59 Å²	59	87.7 Å²	87.7	40%	0.399	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.3	-2.2	-172.6	60.4	0	0	0	0	113.3	C231 F236 H247	C231-C234 WeakPolarHBondContact CB-SG 3.39Å; C231-C234 PolarHBondContact O-N 3.47Å; C231-C234 PolarHBondContact SG-SG 3.44Å; C234-F236 PolarHBondContact O-N 3.37Å; C234-H247 PolarHBondContact SG-NE2 3.07Å
235	L	63.9	Low	62.3	Low	131 Å²	131	85.1 Å²	85.1	69%	0.686	43%	0.43	S	S	*	.			trans	62.3	14.5	-177	-52.1	177.2	0	0	0	115.5	C231 V237	C231-L235 WeakPolarHBondContact O-CA 3.47Å; C231-L235 PolarHBondContact O-N 3.34Å; L235-V237 VanDerWaalsContact O-CG2 3.29Å; L235-V237 WeakPolarHBondContact O-CG2 3.45Å; L235-V237 PolarHBondContact O-N 2.7Å
236	F	72.4	Confident	63.8	Low	97 Å²	97	82.5 Å²	82.5	43%	0.425	41%	0.413	S	S	.	.			trans	-57.5	130.9	169.5	-177	-113.7	0	0	0	110.7	H230 C231 C234 P238 H247	H230-F236 CarbonylContact C-O 3.58Å; H230-F236 WeakPolarHBondContact CA-O 3.44Å; C231-F236 HydrophobicContact CB-CB 4.24Å; C231-F236 PolarHBondContact N-O 3.44Å; C234-F236 PolarHBondContact O-N 3.37Å; F236-P238 VanDerWaalsContact C-CD 3.42Å; F236-P238 HydrophobicContact CD1-CB 4.28Å; F236-P238 HydrophobicContact CD1-CG 4.12Å; F236-P238 HydrophobicContact CE1-CB 3.84Å; F236-P238 HydrophobicContact CE1-CG 4.18Å; F236-P238 WeakPolarHBondContact O-CD 3.27Å; F236-H247 WeakPolarHBondContact CB-NE2 3.48Å; F236-H247 HydrophobicContact CD1-CB 3.82Å; F236-H247 AromaticContact CD1-CD2 3.37Å; F236-H247 WeakPolarHBondContact CD1-CD2 3.49Å; F236-H247 AromaticContact CD1-CE1 3.93Å; F236-H247 AromaticContact CD1-CG 3.32Å; F236-H247 AromaticContact CD1-ND1 3.69Å; F236-H247 AromaticContact CD1-NE2 3.78Å; F236-H247 HydrophobicContact CE1-CB 3.71Å; F236-H247 AromaticContact CE1-CG 3.68Å; F236-H247 AromaticContact CG-CD2 3.97Å; F236-H247 AromaticContact CG-CE1 3.89Å; F236-H247 AromaticContact CG-NE2 3.87Å
237	V	67.3	Low	65.1	Low	64 Å²	64	79.7 Å²	79.7	39%	0.388	39%	0.387	S	S	.	.			trans	-114.2	79.2	-175.4	-166.1	0	0	0	0	110.9	Q228 H230 L235	Q228-V237 HydrophobicContact CB-CG1 3.84Å; Q228-V237 HydrophobicContact CG-CG1 3.85Å; H230-V237 HydrophobicContact CB-CG1 4.43Å; H230-V237 HydrophobicContact CB-CG2 4Å; L235-V237 VanDerWaalsContact O-CG2 3.29Å; L235-V237 WeakPolarHBondContact O-CG2 3.45Å; L235-V237 PolarHBondContact O-N 2.7Å
238	P	69.4	Low	66	Low	7 Å²	7	73.3 Å²	73.3	5%	0.045	35%	0.353	C	S	.	.			trans	-67.7	151.2	174.8	27.1	-34.1	0	0	0	112.1	I229 F236 T240 A243 L244	I229-P238 VanDerWaalsContact O-CD 3.24Å; I229-P238 WeakPolarHBondContact O-CD 3.44Å; F236-P238 VanDerWaalsContact C-CD 3.42Å; F236-P238 HydrophobicContact CD1-CB 4.28Å; F236-P238 HydrophobicContact CD1-CG 4.12Å; F236-P238 HydrophobicContact CE1-CB 3.84Å; F236-P238 HydrophobicContact CE1-CG 4.18Å; F236-P238 WeakPolarHBondContact O-CD 3.27Å; P238-T240 VanDerWaalsContact C-N 3.35Å; P238-A243 HydrophobicContact CB-CB 3.78Å; P238-L244 HydrophobicContact CB-CB 4.41Å; P238-L244 HydrophobicContact CG-CB 3.48Å; P238-L244 VanDerWaalsContact CG-CB 3.48Å; P238-L244 HydrophobicContact CG-CD1 3.82Å; P238-L244 HydrophobicContact CG-CG 4.15Å
239	R	58	Low	66.5	Low	249 Å²	249	68.3 Å²	68.3	94%	0.94	33%	0.33	S	S	*	.	S	Bend	trans	-81.7	-10.2	179.9	-61.5	-176.3	-176.7	-127.4	3.1	114
240	T	69.6	Low	66.6	Low	68 Å²	68	72.1 Å²	72.1	42%	0.417	35%	0.347	S	S	.	.	S	Bend	trans	-139.8	158.7	177.8	64.5	0	0	0	0	111.2	P238 E242 A243 L244	P238-T240 VanDerWaalsContact C-N 3.35Å; T240-E242 VanDerWaalsContact C-N 3.28Å; T240-E242 PolarHBondContact O-N 3.35Å; T240-A243 PolarHBondContact O-N 3.24Å; T240-A243 WeakPolarHBondContact OG1-CB 3.22Å; T240-A243 PolarHBondContact OG1-N 3.41Å; T240-L244 PolarHBondContact O-N 3.34Å
241	Y	63.9	Low	66.3	Low	49 Å²	49	74.2 Å²	74.2	19%	0.192	36%	0.361	C	S	.	.	H	α-helix	trans	-64.7	-35.9	175.8	172	-109.8	0	0	0	111.5	Q194 A197 I201 L244 V245	Q194-Y241 HydrophobicContact CG-CE1 4.29Å; A197-Y241 HydrophobicContact CB-CE2 4.36Å; A197-Y241 WeakPolarHBondContact CB-OH 3.33Å; I201-Y241 HydrophobicContact CD1-CD2 4.31Å; I201-Y241 HydrophobicContact CD1-CE2 3.68Å; I201-Y241 HydrophobicContact CG1-CE2 4.38Å; Y241-L244 WeakPolarHBondContact O-CB 3.5Å; Y241-L244 PolarHBondContact O-N 3.24Å; Y241-L244 VanDerWaalsContact O-N 3.16Å; Y241-V245 HydrophobicContact CD1-CG2 4.35Å; Y241-V245 HydrophobicContact CD2-CG2 4.33Å; Y241-V245 HydrophobicContact CE1-CG2 3.8Å; Y241-V245 HydrophobicContact CE2-CG2 3.76Å; Y241-V245 VanDerWaalsContact CZ-CG2 3.46Å; Y241-V245 WeakPolarHBondContact O-CG2 3.45Å; Y241-V245 PolarHBondContact O-N 3.43Å
242	E	66.1	Low	66.1	Low	125 Å²	125	76 Å²	76	58%	0.584	37%	0.369	S	S	*	.	H	α-helix	trans	-65.5	-41.4	180	-64.6	62.1	-136.9	0	0	110.8	T240 L244 V245 Q246	T240-E242 VanDerWaalsContact C-N 3.28Å; T240-E242 PolarHBondContact O-N 3.35Å; E242-L244 VanDerWaalsContact C-N 3.34Å; E242-V245 PolarHBondContact O-N 3.05Å; E242-Q246 PolarHBondContact O-N 2.85Å
243	A	68.6	Low	65.8	Low	41 Å²	41	76.5 Å²	76.5	34%	0.339	37%	0.373	S	S	.	.	H	α-helix	trans	-68.6	-31.6	173.7	0	0	0	0	0	112.3	P238 T240 H247	P238-A243 HydrophobicContact CB-CB 3.78Å; T240-A243 PolarHBondContact O-N 3.24Å; T240-A243 WeakPolarHBondContact OG1-CB 3.22Å; T240-A243 PolarHBondContact OG1-N 3.41Å; A243-H247 WeakPolarHBondContact O-CB 3.37Å; A243-H247 PolarHBondContact O-N 3.15Å
244	L	71.4	Confident	65.6	Low	7 Å²	7	78 Å²	78	4%	0.037	38%	0.375	C	S	.	.	H	α-helix	trans	-65.4	-45.9	169.9	-176	56.3	0	0	0	111.7	I229 C231 P238 T240 Y241 E242 H247 V248	I229-L244 HydrophobicContact CB-CD2 4.33Å; I229-L244 HydrophobicContact CG2-CD2 3.51Å; C231-L244 HydrophobicContact CB-CD1 3.57Å; P238-L244 HydrophobicContact CB-CB 4.41Å; P238-L244 HydrophobicContact CG-CB 3.48Å; P238-L244 VanDerWaalsContact CG-CB 3.48Å; P238-L244 HydrophobicContact CG-CD1 3.82Å; P238-L244 HydrophobicContact CG-CG 4.15Å; T240-L244 PolarHBondContact O-N 3.34Å; Y241-L244 WeakPolarHBondContact O-CB 3.5Å; Y241-L244 PolarHBondContact O-N 3.24Å; Y241-L244 VanDerWaalsContact O-N 3.16Å; E242-L244 VanDerWaalsContact C-N 3.34Å; L244-H247 PolarHBondContact O-N 3.02Å; L244-V248 HydrophobicContact CD1-CG2 3.88Å; L244-V248 HydrophobicContact CG-CG2 4.3Å; L244-V248 VanDerWaalsContact O-CB 3.3Å; L244-V248 WeakPolarHBondContact O-CB 3.41Å; L244-V248 WeakPolarHBondContact O-CG2 3.42Å; L244-V248 PolarHBondContact O-N 3.21Å
245	V	67.3	Low	65	Low	17 Å²	17	75.5 Å²	75.5	10%	0.103	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-44.6	178.5	170	0	0	0	0	110.5	F193 Y241 E242 V248 I249	F193-V245 HydrophobicContact CD1-CG1 4.1Å; F193-V245 HydrophobicContact CE1-CG1 4.29Å; Y241-V245 HydrophobicContact CD1-CG2 4.35Å; Y241-V245 HydrophobicContact CD2-CG2 4.33Å; Y241-V245 HydrophobicContact CE1-CG2 3.8Å; Y241-V245 HydrophobicContact CE2-CG2 3.76Å; Y241-V245 VanDerWaalsContact CZ-CG2 3.46Å; Y241-V245 WeakPolarHBondContact O-CG2 3.45Å; Y241-V245 PolarHBondContact O-N 3.43Å; E242-V245 PolarHBondContact O-N 3.05Å; V245-V248 PolarHBondContact O-N 3.19Å; V245-I249 HydrophobicContact CG1-CD1 3.62Å; V245-I249 HydrophobicContact CG1-CG1 4.47Å; V245-I249 WeakPolarHBondContact O-CD1 3.38Å; V245-I249 WeakPolarHBondContact O-CG1 3.4Å; V245-I249 PolarHBondContact O-N 3.03Å
246	Q	67.3	Low	64.7	Low	95 Å²	95	69.7 Å²	69.7	44%	0.444	33%	0.329	S	S	.	.	H	α-helix	trans	-61.7	-50.1	177.4	-167.9	66.2	17.1	0	0	112.1	E242 V248 I249 E250	E242-Q246 PolarHBondContact O-N 2.85Å; Q246-V248 VanDerWaalsContact C-N 3.32Å; Q246-V248 PolarHBondContact O-N 3.21Å; Q246-I249 WeakPolarHBondContact O-CA 3.44Å; Q246-I249 WeakPolarHBondContact O-CB 3.35Å; Q246-I249 PolarHBondContact O-N 2.91Å; Q246-E250 PolarHBondContact NE2-OE1 2.76Å; Q246-E250 PolarHBondContact O-N 3.3Å
247	H	73.6	Confident	64.2	Low	17 Å²	17	72 Å²	72	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-57.7	-41.8	175.6	164.9	71.2	0	0	0	112.7	C234 F236 A243 L244 I249 E250 D251	C234-H247 PolarHBondContact SG-NE2 3.07Å; F236-H247 WeakPolarHBondContact CB-NE2 3.48Å; F236-H247 HydrophobicContact CD1-CB 3.82Å; F236-H247 AromaticContact CD1-CD2 3.37Å; F236-H247 WeakPolarHBondContact CD1-CD2 3.49Å; F236-H247 AromaticContact CD1-CE1 3.93Å; F236-H247 AromaticContact CD1-CG 3.32Å; F236-H247 AromaticContact CD1-ND1 3.69Å; F236-H247 AromaticContact CD1-NE2 3.78Å; F236-H247 HydrophobicContact CE1-CB 3.71Å; F236-H247 AromaticContact CE1-CG 3.68Å; F236-H247 AromaticContact CG-CD2 3.97Å; F236-H247 AromaticContact CG-CE1 3.89Å; F236-H247 AromaticContact CG-NE2 3.87Å; A243-H247 WeakPolarHBondContact O-CB 3.37Å; A243-H247 PolarHBondContact O-N 3.15Å; L244-H247 PolarHBondContact O-N 3.02Å; H247-I249 VanDerWaalsContact C-N 3.25Å; H247-I249 PolarHBondContact O-N 2.99Å; H247-E250 PolarHBondContact O-N 3.12Å; H247-D251 IonicContact CE1-OD2 2.66Å; H247-D251 PolarHBondContact CE1-OD2 3.18Å; H247-D251 IonicContact CG-OD2 2.81Å; H247-D251 IonicContact ND1-OD2 3.22Å; H247-D251 PolarHBondContact ND1-OD2 3.1Å; H247-D251 WeakPolarHBondContact O-CB 3.35Å; H247-D251 PolarHBondContact O-N 3.04Å
248	V	66.8	Low	63.8	Low	6 Å²	6	73.4 Å²	73.4	4%	0.036	34%	0.339	C	S	.	.	H	α-helix	trans	-70.9	-19.4	177	171.7	0	0	0	0	112.5	L244 V245 Q246 H252 I255	L244-V248 HydrophobicContact CD1-CG2 3.88Å; L244-V248 HydrophobicContact CG-CG2 4.3Å; L244-V248 VanDerWaalsContact O-CB 3.3Å; L244-V248 WeakPolarHBondContact O-CB 3.41Å; L244-V248 WeakPolarHBondContact O-CG2 3.42Å; L244-V248 PolarHBondContact O-N 3.21Å; V245-V248 PolarHBondContact O-N 3.19Å; Q246-V248 VanDerWaalsContact C-N 3.32Å; Q246-V248 PolarHBondContact O-N 3.21Å; V248-H252 WeakPolarHBondContact O-CB 3.46Å; V248-I255 HydrophobicContact CG1-CD1 3.42Å; V248-I255 VanDerWaalsContact CG1-CD1 3.42Å
249	I	66.3	Low	63.6	Low	24 Å²	24	73.2 Å²	73.2	12%	0.123	34%	0.337	C	S	.	.	H	α-helix	trans	-82.4	-40.3	172.3	-71.2	162.2	0	0	0	111.2	Y189 V245 Q246 H247	Y189-I249 HydrophobicContact CD1-CD1 3.37Å; Y189-I249 HydrophobicContact CD1-CG1 3.9Å; Y189-I249 HydrophobicContact CD2-CD1 3.95Å; Y189-I249 HydrophobicContact CE1-CD1 3.5Å; Y189-I249 VanDerWaalsContact CE1-CD1 3.5Å; Y189-I249 HydrophobicContact CE1-CG1 3.54Å; Y189-I249 HydrophobicContact CE1-CG2 4.22Å; Y189-I249 HydrophobicContact CE2-CD1 4.04Å; Y189-I249 HydrophobicContact CE2-CG2 4.17Å; Y189-I249 HydrophobicContact CG-CD1 3.64Å; Y189-I249 WeakPolarHBondContact OH-CG2 3.41Å; V245-I249 HydrophobicContact CG1-CD1 3.62Å; V245-I249 HydrophobicContact CG1-CG1 4.47Å; V245-I249 WeakPolarHBondContact O-CD1 3.38Å; V245-I249 WeakPolarHBondContact O-CG1 3.4Å; V245-I249 PolarHBondContact O-N 3.03Å; Q246-I249 WeakPolarHBondContact O-CA 3.44Å; Q246-I249 WeakPolarHBondContact O-CB 3.35Å; Q246-I249 PolarHBondContact O-N 2.91Å; H247-I249 VanDerWaalsContact C-N 3.25Å; H247-I249 PolarHBondContact O-N 2.99Å
250	E	64.8	Low	64	Low	122 Å²	122	63.6 Å²	63.6	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-82.5	-58.4	-174.9	-69.2	173.7	162	0	0	111.9	Q246 H247 H252	Q246-E250 PolarHBondContact NE2-OE1 2.76Å; Q246-E250 PolarHBondContact O-N 3.3Å; H247-E250 PolarHBondContact O-N 3.12Å; E250-H252 PolarHBondContact O-N 3.15Å
251	D	58	Low	64.1	Low	112 Å²	112	63 Å²	63	60%	0.599	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.2	-174.5	-68.5	-46.5	0	0	0	113.5	H247	H247-D251 IonicContact CE1-OD2 2.66Å; H247-D251 PolarHBondContact CE1-OD2 3.18Å; H247-D251 IonicContact CG-OD2 2.81Å; H247-D251 IonicContact ND1-OD2 3.22Å; H247-D251 PolarHBondContact ND1-OD2 3.1Å; H247-D251 WeakPolarHBondContact O-CB 3.35Å; H247-D251 PolarHBondContact O-N 3.04Å
252	H	62.4	Low	64.2	Low	39 Å²	39	61.7 Å²	61.7	18%	0.181	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	49.4	-179.2	-61	-11.4	0	0	0	112.8	C231 K233 V248 E250 R254 I255	C231-H252 PolarHBondContact SG-NE2 3.41Å; C231-H252 VanDerWaalsContact SG-NE2 3.36Å; K233-H252 WeakPolarHBondContact CB-NE2 3.47Å; V248-H252 WeakPolarHBondContact O-CB 3.46Å; E250-H252 PolarHBondContact O-N 3.15Å; H252-R254 PolarHBondContact O-N 3.11Å; H252-I255 HydrophobicContact CB-CD1 4.31Å; H252-I255 WeakPolarHBondContact O-CB 3.19Å; H252-I255 PolarHBondContact O-N 3.45Å
253	E	56.8	Low	65	Low	139 Å²	139	56.2 Å²	56.2	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-27.5	-38.2	177.2	-168.3	-165	-165.9	0	0	116.6	I255 G256 Y257	E253-I255 PolarHBondContact O-N 2.76Å; E253-G256 PolarHBondContact O-N 2.9Å; E253-Y257 PolarHBondContact O-N 2.92Å
254	R	54	Low	65.5	Low	169 Å²	169	54.3 Å²	54.3	64%	0.638	26%	0.263	S	S	*	.	H	α-helix	trans	-47.5	-30.7	173.8	-170.6	179.1	-62.2	-154.3	-2.7	113.6	H252 N678	H252-R254 PolarHBondContact O-N 3.11Å; R254-N678 PolarHBondContact NH2-O 3.1Å
255	I	57.1	Low	65.7	Low	8 Å²	8	60.8 Å²	60.8	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-84.7	-36	-179.3	-72.2	169.3	0	0	0	111.6	F193 Y200 V248 H252 E253 Y257 Q258 V259	F193-I255 HydrophobicContact CE2-CG2 3.43Å; F193-I255 VanDerWaalsContact CE2-CG2 3.43Å; F193-I255 HydrophobicContact CZ-CG2 3.38Å; Y200-I255 HydrophobicContact CE2-CD1 4.09Å; V248-I255 HydrophobicContact CG1-CD1 3.42Å; V248-I255 VanDerWaalsContact CG1-CD1 3.42Å; H252-I255 HydrophobicContact CB-CD1 4.31Å; H252-I255 WeakPolarHBondContact O-CB 3.19Å; H252-I255 PolarHBondContact O-N 3.45Å; E253-I255 PolarHBondContact O-N 2.76Å; I255-Y257 PolarHBondContact O-N 2.88Å; I255-Q258 WeakPolarHBondContact O-CB 3.18Å; I255-Q258 PolarHBondContact O-N 2.83Å; I255-V259 PolarHBondContact O-N 3.39Å
256	G	57	Low	65.8	Low	8 Å²	8	62.2 Å²	62.2	8%	0.082	30%	0.302	C	S	.	.	H	α-helix	trans	-57.8	-31.2	173.8	0	0	0	0	0	112.8	E253 T260	E253-G256 PolarHBondContact O-N 2.9Å; G256-T260 VanDerWaalsContact O-CB 3.32Å; G256-T260 WeakPolarHBondContact O-CB 3.31Å; G256-T260 PolarHBondContact O-N 3.28Å; G256-T260 PolarHBondContact O-OG1 2.94Å
257	Y	61.8	Low	65	Low	146 Å²	146	60.7 Å²	60.7	57%	0.573	30%	0.302	S	S	*	.	H	α-helix	trans	-65.4	-37.7	173.2	-166	-92.1	0	0	0	112.9	E253 I255 T260 A261 F632	E253-Y257 PolarHBondContact O-N 2.92Å; I255-Y257 PolarHBondContact O-N 2.88Å; Y257-T260 PolarHBondContact O-N 2.8Å; Y257-A261 WeakPolarHBondContact O-CB 3.5Å; Y257-A261 PolarHBondContact O-N 3.37Å; Y257-F632 HydrophobicContact CE1-CE2 4.2Å
258	Q	59.3	Low	64	Low	94 Å²	94	62.9 Å²	62.9	44%	0.439	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-41.9	179	-172.8	175.2	1.9	0	0	111.6	I255 A261 M262	I255-Q258 WeakPolarHBondContact O-CB 3.18Å; I255-Q258 PolarHBondContact O-N 2.83Å; Q258-A261 PolarHBondContact O-N 2.98Å; Q258-M262 WeakPolarHBondContact O-CG 3.47Å; Q258-M262 PolarHBondContact O-N 3.43Å; Q258-M262 VanDerWaalsContact O-N 3.14Å
259	V	65	Low	63.2	Low	2 Å²	2	69.3 Å²	69.3	1%	0.012	35%	0.349	C	S	.	.	H	α-helix	trans	-68.2	-38.5	174.1	165.4	0	0	0	0	111.7	R185 I188 Y189 F193 I255 A261 M262 I263	R185-V259 HydrophobicContact CG-CG1 3.91Å; I188-V259 HydrophobicContact CB-CG1 4.03Å; I188-V259 HydrophobicContact CG2-CB 4.13Å; I188-V259 HydrophobicContact CG2-CG1 3.58Å; I188-V259 HydrophobicContact CG2-CG2 3.81Å; Y189-V259 HydrophobicContact CD1-CB 4.3Å; Y189-V259 HydrophobicContact CD1-CG1 3.98Å; Y189-V259 HydrophobicContact CD1-CG2 3.81Å; Y189-V259 HydrophobicContact CE1-CB 3.67Å; Y189-V259 HydrophobicContact CE1-CG1 3.55Å; Y189-V259 HydrophobicContact CE1-CG2 3.52Å; Y189-V259 HydrophobicContact CE2-CG1 4.31Å; Y189-V259 HydrophobicContact CG-CG1 4.49Å; F193-V259 HydrophobicContact CD2-CG2 3.73Å; F193-V259 HydrophobicContact CE2-CG2 4.28Å; I255-V259 PolarHBondContact O-N 3.39Å; V259-A261 PolarHBondContact O-N 3.44Å; V259-M262 WeakPolarHBondContact O-CB 3.18Å; V259-M262 PolarHBondContact O-N 3.41Å; V259-M262 VanDerWaalsContact O-N 3.14Å; V259-I263 PolarHBondContact O-N 3.39Å
260	T	67.4	Low	62.1	Low	47 Å²	47	72.2 Å²	72.2	29%	0.288	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-42	173.8	-55.6	0	0	0	0	111.5	Y181 R185 G256 Y257 M262 I263	Y181-T260 WeakPolarHBondContact OH-CG2 3.48Å; Y181-T260 PolarHBondContact OH-OG1 3.45Å; R185-T260 PolarHBondContact NH2-OG1 3.15Å; G256-T260 VanDerWaalsContact O-CB 3.32Å; G256-T260 WeakPolarHBondContact O-CB 3.31Å; G256-T260 PolarHBondContact O-N 3.28Å; G256-T260 PolarHBondContact O-OG1 2.94Å; Y257-T260 PolarHBondContact O-N 2.8Å; T260-M262 PolarHBondContact O-N 3.18Å; T260-I263 PolarHBondContact O-N 3.29Å
261	A	71.7	Confident	60.9	Low	55 Å²	55	71.6 Å²	71.6	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-65.1	-25.4	175.2	0	0	0	0	0	113.2	K172 Y257 Q258 V259 I263	K172-A261 VanDerWaalsContact CD-O 3.31Å; K172-A261 WeakPolarHBondContact CD-O 3.2Å; K172-A261 PolarHBondContact NZ-O 2.99Å; Y257-A261 WeakPolarHBondContact O-CB 3.5Å; Y257-A261 PolarHBondContact O-N 3.37Å; Q258-A261 PolarHBondContact O-N 2.98Å; V259-A261 PolarHBondContact O-N 3.44Å; A261-I263 VanDerWaalsContact C-N 3.31Å
262	M	64.8	Low	59.7	Low	22 Å²	22	77.4 Å²	77.4	11%	0.108	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.7	172.9	-75.3	172.1	42.5	0	0	114.2	K172 K173 I188 H192 Q258 V259 T260	K172-M262 WeakPolarHBondContact CB-O 3.37Å; K172-M262 PolarHBondContact N-O 2.96Å; K173-M262 HydrophobicContact CD-CE 3.6Å; K173-M262 HydrophobicContact CD-SD 4.22Å; K173-M262 HydrophobicContact CG-CE 3.98Å; I188-M262 HydrophobicContact CD1-CB 4.16Å; I188-M262 HydrophobicContact CG2-CE 3.63Å; H192-M262 HydrophobicContact CB-CE 3.9Å; Q258-M262 WeakPolarHBondContact O-CG 3.47Å; Q258-M262 PolarHBondContact O-N 3.43Å; Q258-M262 VanDerWaalsContact O-N 3.14Å; V259-M262 WeakPolarHBondContact O-CB 3.18Å; V259-M262 PolarHBondContact O-N 3.41Å; V259-M262 VanDerWaalsContact O-N 3.14Å; T260-M262 PolarHBondContact O-N 3.18Å
263	I	82.7	Confident	58.6	Low	10 Å²	10	80.9 Å²	80.9	5%	0.051	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.2	168.7	-63.2	171.6	0	0	0	109.3	Y169 Y170 K172 Y181 V184 R185 I188 V259 T260 A261	Y169-I263 HydrophobicContact CD1-CG2 3.95Å; Y169-I263 HydrophobicContact CG-CG2 4.48Å; Y170-I263 CarbonylContact O-C 3.58Å; Y170-I263 WeakPolarHBondContact O-CA 3.42Å; K172-I263 VanDerWaalsContact CE-O 3.25Å; K172-I263 WeakPolarHBondContact CE-O 3.17Å; K172-I263 PolarHBondContact NZ-O 2.93Å; Y181-I263 HydrophobicContact CD2-CD1 3.84Å; Y181-I263 HydrophobicContact CD2-CG2 4.03Å; Y181-I263 HydrophobicContact CE2-CB 4.27Å; Y181-I263 HydrophobicContact CE2-CD1 3.34Å; Y181-I263 HydrophobicContact CE2-CG1 4.37Å; Y181-I263 HydrophobicContact CE2-CG2 4.04Å; V184-I263 HydrophobicContact CG1-CG1 4.1Å; V184-I263 HydrophobicContact CG1-CG2 4.45Å; R185-I263 HydrophobicContact CB-CD1 3.92Å; R185-I263 HydrophobicContact CG-CD1 3.91Å; I188-I263 HydrophobicContact CD1-CD1 4.25Å; I188-I263 HydrophobicContact CD1-CG1 3.39Å; V259-I263 PolarHBondContact O-N 3.39Å; T260-I263 PolarHBondContact O-N 3.29Å; A261-I263 VanDerWaalsContact C-N 3.31Å
264	G	79.1	Confident	57.3	Low	2 Å²	2	83.3 Å²	83.3	2%	0.021	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	152.6	162	0	0	0	0	0	110.6	Y169 Y170	Y169-G264 CarbonylContact C-O 3.59Å; Y169-G264 VanDerWaalsContact CA-O 3.31Å; Y169-G264 WeakPolarHBondContact CA-O 3.43Å; Y170-G264 WeakPolarHBondContact CD1-O 3.15Å; Y170-G264 VanDerWaalsContact CE1-C 3.48Å; Y170-G264 PolarHBondContact N-O 3.44Å; Y170-G264 PolarHBondContact O-N 2.99Å
265	H	75.8	Confident	56.2	Low	142 Å²	142	80.6 Å²	80.6	66%	0.657	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.3	165.7	63.1	-92.8	0	0	0	107.9	Y169	Y169-H265 HydrophobicContact CD1-CB 3.94Å; Y169-H265 HydrophobicContact CE1-CB 3.96Å
266	T	70.8	Confident	55.1	Low	47 Å²	47	88.2 Å²	88.2	29%	0.288	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	120.8	168.6	39.6	0	0	0	0	106.2	V168 Y170 V268	V168-T266 PolarHBondContact N-O 3.48Å; V168-T266 PolarHBondContact O-N 2.88Å; Y170-T266 HydrophobicContact CE1-CG2 3.81Å; T266-V268 PolarHBondContact O-N 3.35Å
267	S	50	Low	54	Low	64 Å²	64	92.3 Å²	92.3	45%	0.448	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	110.9	157.6	35.6	0	0	0	0	107.8	E165	E165-S267 VanDerWaalsContact CG-CB 3.41Å; E165-S267 WeakPolarHBondContact OE1-CB 3.41Å; E165-S267 PolarHBondContact OE1-OG 3.08Å
268	V	52.5	Low	52.7	Low	63 Å²	63	93.7 Å²	93.7	38%	0.382	50%	0.503	S	S	.	.			trans	-100.3	121.2	169.5	-179.3	0	0	0	0	105.2	T266 V270	T266-V268 PolarHBondContact O-N 3.35Å; V268-V270 HydrophobicContact CB-CG2 4.03Å; V268-V270 HydrophobicContact CG1-CG2 3.75Å; V268-V270 PolarHBondContact O-N 3.31Å
269	I	49.2	Very low	51.3	Low	140 Å²	140	97.4 Å²	97.4	72%	0.718	52%	0.519	S	S	*	.			trans	-67.7	93.7	165.7	-58.1	173.2	0	0	0	105.6	P271	I269-P271 VanDerWaalsContact O-CD 3.32Å; I269-P271 WeakPolarHBondContact O-CD 3.31Å
270	V	43	Very low	49.8	Very low	85 Å²	85	103.1 Å²	103.1	52%	0.515	56%	0.555	S	S	.	*			trans	-87.5	110.4	175.5	177.9	0	0	0	0	107.1	V268 R272	V268-V270 HydrophobicContact CB-CG2 4.03Å; V268-V270 HydrophobicContact CG1-CG2 3.75Å; V268-V270 PolarHBondContact O-N 3.31Å; V270-R272 PolarHBondContact O-N 3.35Å
271	P	40.7	Very low	48.1	Very low	110 Å²	110	105.7 Å²	105.7	71%	0.714	58%	0.582	S	S	*	*			trans	-59.9	125.7	165.7	-15	30.3	0	0	0	107.1	I269 P273	I269-P271 VanDerWaalsContact O-CD 3.32Å; I269-P271 WeakPolarHBondContact O-CD 3.31Å; P271-P273 WeakPolarHBondContact O-CD 3.36Å; P271-P273 VanDerWaalsContact O-N 3.15Å
272	R	33.3	Very low	46	Very low	233 Å²	233	113 Å²	113	88%	0.879	60%	0.603	S	S	*	*			trans	-47.2	125.6	174.7	-106.3	-171.1	177.2	-166.1	1.1	108.7	V270 K274	V270-R272 PolarHBondContact O-N 3.35Å; R272-K274 PolarHBondContact O-N 2.93Å
273	P	38.5	Very low	44.4	Very low	113 Å²	113	116.4 Å²	116.4	73%	0.734	64%	0.635	S	S	*	*			trans	-54.4	114.6	165	-23.2	33.8	0	0	0	107.5	P271	P271-P273 WeakPolarHBondContact O-CD 3.36Å; P271-P273 VanDerWaalsContact O-N 3.15Å
274	K	29.2	Very low	42	Very low	189 Å²	189	125.4 Å²	125.4	82%	0.822	68%	0.677	S	S	*	*			trans	-61.5	133.8	173.3	-73.8	-177.8	177.3	178.6	0	107.1	R272 L276	R272-K274 PolarHBondContact O-N 2.93Å; K274-L276 PolarHBondContact O-N 3.16Å
275	P	31.2	Very low	39.7	Very low	112 Å²	112	129 Å²	129	73%	0.727	71%	0.713	S	S	*	*			trans	-53.7	128.6	169.9	-23.8	33.6	0	0	0	109	V277	P275-V277 HydrophobicContact CB-CG2 4.27Å; P275-V277 PolarHBondContact O-N 3.49Å
276	L	33.7	Very low	37.5	Very low	168 Å²	168	128 Å²	128	88%	0.88	71%	0.713	S	S	*	*			trans	-72.6	77	170.5	-87.3	167.4	0	0	0	108.6	K274 M278	K274-L276 PolarHBondContact O-N 3.16Å; L276-M278 VanDerWaalsContact C-N 3.33Å; L276-M278 PolarHBondContact O-N 3.41Å
277	V	34.7	Very low	36.1	Very low	95 Å²	95	133.6 Å²	133.6	58%	0.576	73%	0.733	S	S	*	*			trans	-70.9	96.4	165.2	-170	0	0	0	0	106.6	P275 F279	P275-V277 HydrophobicContact CB-CG2 4.27Å; P275-V277 PolarHBondContact O-N 3.49Å; V277-F279 HydrophobicContact CB-CD2 4.37Å; V277-F279 HydrophobicContact CB-CE2 4.04Å; V277-F279 HydrophobicContact CG1-CD2 3.86Å; V277-F279 HydrophobicContact CG1-CE1 4.36Å; V277-F279 HydrophobicContact CG1-CE2 3.35Å; V277-F279 HydrophobicContact CG1-CZ 3.65Å; V277-F279 PolarHBondContact O-N 2.83Å
278	M	34.4	Very low	35.5	Very low	174 Å²	174	136 Å²	136	86%	0.857	75%	0.745	S	S	*	*			trans	-65.6	96.3	171.9	-77.1	177.5	58.2	0	0	109.4	L276	L276-M278 VanDerWaalsContact C-N 3.33Å; L276-M278 PolarHBondContact O-N 3.41Å
279	F	29.4	Very low	34.6	Very low	173 Å²	173	139.9 Å²	139.9	76%	0.759	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-86.9	128.1	157.3	-69.8	-71	0	0	0	108.4	V277	V277-F279 HydrophobicContact CB-CD2 4.37Å; V277-F279 HydrophobicContact CB-CE2 4.04Å; V277-F279 HydrophobicContact CG1-CD2 3.86Å; V277-F279 HydrophobicContact CG1-CE1 4.36Å; V277-F279 HydrophobicContact CG1-CE2 3.35Å; V277-F279 HydrophobicContact CG1-CZ 3.65Å; V277-F279 PolarHBondContact O-N 2.83Å
280	P	33	Very low	33.9	Very low	121 Å²	121	140.5 Å²	140.5	79%	0.786	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-68.9	149.6	-177.2	28.2	-34.6	0	0	0	111.6
281	A	31.7	Very low	33.2	Very low	102 Å²	102	139.5 Å²	139.5	84%	0.843	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64.2	140.2	170.9	0	0	0	0	0	110.5
282	K	28.8	Very low	32.7	Very low	209 Å²	209	143.6 Å²	143.6	91%	0.909	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.8	125.4	-171.2	-170.2	177.1	-174.5	177.8	0	111.5
283	A	31	Very low	32.5	Very low	93 Å²	93	136 Å²	136	77%	0.769	78%	0.779	S	S	*	*			trans	-123.9	110	168.7	0	0	0	0	0	110.7
284	Q	31.1	Very low	32.8	Very low	199 Å²	199	136.2 Å²	136.2	93%	0.93	78%	0.78	S	S	*	*			trans	38.9	107.5	143.5	-160.6	163.6	-22.1	0	0	119.6
285	G	31.4	Very low	33	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	78%	0.784	S	S	*	*			trans	172.5	91.1	170.4	0	0	0	0	0	115.1
286	D	29.9	Very low	32.7	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	79%	0.791	S	S	*	*			trans	30.5	132.6	147.8	-88.5	-19	0	0	0	124.2
287	K	40.4	Very low	32.6	Very low	164 Å²	164	132.3 Å²	132.3	71%	0.713	79%	0.786	S	S	*	*			trans	61.1	137.9	133	-59.1	161.7	-170.9	149.3	0	118.9
288	T	37.3	Very low	32.3	Very low	114 Å²	114	133.6 Å²	133.6	70%	0.699	79%	0.794	S	S	*	*			cis	-167.8	155.5	0.6	11	0	0	0	0	110.7
289	I	34.6	Very low	32.2	Very low	145 Å²	145	133.8 Å²	133.8	74%	0.744	80%	0.795	S	S	*	*			trans	68.9	127.6	143.8	-69.2	166.9	0	0	0	120.7
290	I	34.8	Very low	32.2	Very low	153 Å²	153	130 Å²	130	79%	0.785	80%	0.796	S	S	*	*			trans	25	137	140.5	-47	171.9	0	0	0	119
291	G	28.6	Very low	32.2	Very low	63 Å²	63	130.5 Å²	130.5	65%	0.649	80%	0.796	S	S	*	*			cis	133.7	152.9	2.1	0	0	0	0	0	113.3
292	M	30.3	Very low	32.6	Very low	196 Å²	196	131.4 Å²	131.4	97%	0.966	79%	0.794	S	S	*	*			trans	53.9	128	165.6	-66	163.7	53.8	0	0	120
293	G	28.8	Very low	32.5	Very low	74 Å²	74	132.5 Å²	132.5	76%	0.763	79%	0.792	S	S	*	*			trans	165.3	142.6	155	0	0	0	0	0	115.9
294	P	45.3	Very low	32.3	Very low	118 Å²	118	132.7 Å²	132.7	77%	0.766	79%	0.788	S	S	*	*			trans	-132.6	162.9	-154.4	40	-21.7	0	0	0	118.2
295	K	31.7	Very low	32	Very low	208 Å²	208	128.5 Å²	128.5	90%	0.904	78%	0.78	S	S	*	*			trans	51.6	107.1	147.1	-68	176.3	178.4	-177.3	0	120.4
296	G	26.5	Very low	31.8	Very low	85 Å²	85	130.1 Å²	130.1	88%	0.876	79%	0.787	S	S	*	*				98.5	130.8	116.8	0	0	0	0	0	120.8
297	A	30.6	Very low	31.9	Very low	93 Å²	93	129.1 Å²	129.1	77%	0.769	79%	0.789	S	S	*	*			trans	-161.9	124	147.4	0	0	0	0	0	107.7
298	V	29.6	Very low	31.4	Very low	122 Å²	122	129.3 Å²	129.3	74%	0.739	79%	0.793	S	S	*	*				59.6	122.8	73.1	-103.9	0	0	0	0	119.4
299	M	31.8	Very low	31	Very low	178 Å²	178	131.1 Å²	131.1	88%	0.877	79%	0.793	S	S	*	*			trans	64.9	161.5	161	-47.6	-48.1	-173.4	0	0	117.7
300	A	28.8	Very low	30.7	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	79%	0.794	S	S	*	*			cis	-145.7	162.3	5.2	0	0	0	0	0	113.5
301	T	32.9	Very low	30.3	Very low	130 Å²	130	128.3 Å²	128.3	80%	0.798	79%	0.788	S	S	*	*			trans	-82.2	163.7	164.8	-13.5	0	0	0	0	110.8
302	P	41.6	Very low	30.3	Very low	122 Å²	122	137 Å²	137	79%	0.792	80%	0.801	S	S	*	*				-152	-179	79.3	40.8	-20.4	0	0	0	117.9
303	R	26.3	Very low	30.2	Very low	232 Å²	232	132.4 Å²	132.4	88%	0.875	79%	0.794	S	S	*	*			trans	-45.8	164.5	160.4	-69.4	169.5	-176.2	163.1	-1.9	114.4
304	S	26.7	Very low	30.1	Very low	97 Å²	97	133.8 Å²	133.8	68%	0.678	80%	0.798	S	S	*	*			cis	-170.9	168.6	-9.8	48	0	0	0	0	111.7
305	S	25.2	Very low	29.2	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	80%	0.8	S	S	*	*			trans	42.8	109.7	143.1	62.1	0	0	0	0	121.3
306	A	26.3	Very low	29	Very low	111 Å²	111	127.6 Å²	127.6	92%	0.917	80%	0.796	S	S	*	*			trans	-159.9	160.5	133.1	0	0	0	0	0	109.7
307	S	31.9	Very low	29.1	Very low	101 Å²	101	128.4 Å²	128.4	71%	0.706	79%	0.794	S	S	*	*			trans	-121.5	163.4	-172.9	58.5	0	0	0	0	113.6
308	Q	29	Very low	28.9	Very low	168 Å²	168	130.7 Å²	130.7	79%	0.785	80%	0.798	S	S	*	*			trans	82.7	143	155.5	-70.6	-170.5	14.4	0	0	121.4
309	Q	29.3	Very low	28.9	Very low	152 Å²	152	129.2 Å²	129.2	71%	0.71	80%	0.799	S	S	*	*			trans	76.7	119.9	149	-75.8	-177.8	7.1	0	0	122.7
310	L	28	Very low	28.7	Very low	147 Å²	147	125.4 Å²	125.4	77%	0.77	80%	0.796	S	S	*	*				53.1	126.4	123	-59.3	170.4	0	0	0	118.8
311	S	26.6	Very low	28.7	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	80%	0.795	S	S	*	*			cis	-164.6	149.1	4.2	-77.7	0	0	0	0	111.3
312	R	29.2	Very low	28.5	Very low	247 Å²	247	129.4 Å²	129.4	93%	0.932	80%	0.798	S	S	*	*				-178.3	151.3	129.7	-103.1	160.4	-178.6	135.1	0.8	114
313	A	27.9	Very low	27.8	Very low	99 Å²	99	128 Å²	128	82%	0.818	80%	0.797	S	S	*	*			trans	72.6	101.1	158.7	0	0	0	0	0	120.9
314	A	27.4	Very low	27.7	Very low	103 Å²	103	121.1 Å²	121.1	85%	0.851	79%	0.79	S	S	*	*				92	144.9	129.6	0	0	0	0	0	122.5
315	A	26.8	Very low	27.8	Very low	96 Å²	96	126.4 Å²	126.4	79%	0.793	80%	0.801	S	S	*	*			trans	72.6	70.7	154.2	0	0	0	0	0	121.1
316	A	27	Very low	27.8	Very low	100 Å²	100	128.3 Å²	128.3	83%	0.826	80%	0.802	S	S	*	*				34.5	127.7	124.2	0	0	0	0	0	123.6
317	A	27.3	Very low	28	Very low	102 Å²	102	128 Å²	128	84%	0.843	79%	0.793	S	S	*	*			trans	76.4	151.2	136.4	0	0	0	0	0	121.3
318	V	27.3	Very low	28.1	Very low	141 Å²	141	131.7 Å²	131.7	86%	0.855	80%	0.799	S	S	*	*			trans	-148.5	149.5	-164.6	161.1	0	0	0	0	111.8
319	A	28.6	Very low	28.4	Very low	91 Å²	91	127.9 Å²	127.9	75%	0.752	79%	0.791	S	S	*	*			trans	76.4	154.6	159.9	0	0	0	0	0	122.3
320	A	29.3	Very low	28.5	Very low	98 Å²	98	129.7 Å²	129.7	81%	0.81	80%	0.797	S	S	*	*			trans	70.2	143.5	161.5	0	0	0	0	0	117.9
321	S	29	Very low	28.8	Very low	110 Å²	110	130.1 Å²	130.1	77%	0.769	80%	0.799	S	S	*	*			cis	-161.2	-171.1	-6.7	-137	0	0	0	0	113.7
322	K	27.4	Very low	28.9	Very low	199 Å²	199	132.7 Å²	132.7	87%	0.865	81%	0.811	S	S	*	*			trans	-38.4	157.1	160.8	-67	166.4	-175.8	170.1	0	113.8
323	A	27.6	Very low	28.9	Very low	92 Å²	92	124.3 Å²	124.3	76%	0.76	80%	0.801	S	S	*	*			cis	-170.8	-155.7	-5.3	0	0	0	0	0	109.6
324	A	23.6	Very low	29.2	Very low	88 Å²	88	127 Å²	127	73%	0.727	80%	0.801	S	S	*	*			trans	72.9	162.8	170.2	0	0	0	0	0	116.8
325	F	28.7	Very low	29.2	Very low	207 Å²	207	130.5 Å²	130.5	91%	0.908	80%	0.797	S	S	*	*			cis	-160.9	-156.4	-39	-111.3	-62.5	0	0	0	107.8
326	N	26.5	Very low	29.3	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	79%	0.79	S	S	*	*			trans	-31.4	161.4	165.8	-108	-19.2	0	0	0	117.2
327	S	30.4	Very low	29.2	Very low	104 Å²	104	133.8 Å²	133.8	73%	0.727	78%	0.783	S	S	*	*			cis	-166.6	-171.4	16.7	31.3	0	0	0	0	113.3
328	H	33.9	Very low	29.4	Very low	179 Å²	179	133.1 Å²	133.1	83%	0.829	77%	0.772	S	S	*	*			trans	-41.8	146	178.9	-81.1	-100.5	0	0	0	120.3
329	S	34	Very low	29.5	Very low	88 Å²	88	135 Å²	135	62%	0.615	78%	0.777	S	S	*	*			trans	80.9	119.7	137.2	-75.6	0	0	0	0	123.5
330	F	31.9	Very low	29.5	Very low	191 Å²	191	134 Å²	134	84%	0.838	78%	0.775	S	S	*	*			trans	58.2	112	144.3	-57.3	-57.5	0	0	0	122.2
331	L	33.3	Very low	29.7	Very low	156 Å²	156	137.2 Å²	137.2	82%	0.817	78%	0.778	S	S	*	*			trans	27.5	120.5	137.6	-55.8	176.5	0	0	0	120.2
332	T	30.8	Very low	29.5	Very low	145 Å²	145	141 Å²	141	89%	0.89	78%	0.78	S	S	*	*				152.1	144.8	111	-59.5	0	0	0	0	110.9
333	G	28	Very low	29.5	Very low	71 Å²	71	136.6 Å²	136.6	73%	0.732	78%	0.781	S	S	*	*			trans	127.9	126.8	152.8	0	0	0	0	0	118.2
334	L	33.6	Very low	29.4	Very low	156 Å²	156	135.9 Å²	135.9	82%	0.817	78%	0.783	S	S	*	*			trans	-68.3	153.2	179.5	-83.5	55.8	0	0	0	115.6
335	K	28.4	Very low	29.5	Very low	177 Å²	177	137 Å²	137	77%	0.77	79%	0.785	S	S	*	*				46.2	153.8	127.1	-57.1	-168.9	167.5	-157.6	0	120.7
336	H	28.6	Very low	29.4	Very low	137 Å²	137	133.1 Å²	133.1	63%	0.634	78%	0.778	S	S	*	*			cis	-163.4	162.8	6.6	-136.7	-126	0	0	0	109.8
337	D	26.1	Very low	29.4	Very low	128 Å²	128	133.7 Å²	133.7	68%	0.684	78%	0.776	S	S	*	*			trans	51.6	168.7	150.6	-78.5	-29.9	0	0	0	122.7
338	S	31.1	Very low	29.9	Very low	88 Å²	88	133.9 Å²	133.9	62%	0.615	78%	0.775	S	S	*	*			cis	-178.2	161.2	-42.8	-93.2	0	0	0	0	110
339	L	29.3	Very low	29.3	Very low	181 Å²	181	134.3 Å²	134.3	95%	0.948	78%	0.775	S	S	*	*			trans	70.1	147.9	172.5	-44.2	176.1	0	0	0	116.6
340	G	28.3	Very low	29	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	78%	0.78	S	S	*	*			cis	169.4	157	-13.3	0	0	0	0	0	115.6
341	L	32.8	Very low	28.8	Very low	165 Å²	165	134.1 Å²	134.1	86%	0.864	78%	0.783	S	S	*	*			trans	75.5	124.6	154	-64.4	167.3	0	0	0	124.1
342	K	26.1	Very low	28.3	Very low	188 Å²	188	129.8 Å²	129.8	82%	0.817	78%	0.776	S	S	*	*			trans	61.6	106.6	138.5	-75.2	-171.1	170.4	-172.8	0	123.6
343	A	26.4	Very low	28.2	Very low	107 Å²	107	129.2 Å²	129.2	88%	0.884	77%	0.767	S	S	*	*				47.1	134	111.2	0	0	0	0	0	123
344	G	25.3	Very low	28.4	Very low	77 Å²	77	132.7 Å²	132.7	79%	0.794	76%	0.764	S	S	*	*			trans	148.7	85.7	148.5	0	0	0	0	0	119.3
345	S	26	Very low	28.2	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	76%	0.757	S	S	*	*			trans	41.6	143.6	144.2	-140.1	0	0	0	0	124.9
346	V	27.2	Very low	28.3	Very low	125 Å²	125	130.5 Å²	130.5	76%	0.758	76%	0.755	S	S	*	*			trans	52.2	119.1	157	-69.2	0	0	0	0	123.2
347	Q	26.9	Very low	28.3	Very low	163 Å²	163	135.8 Å²	135.8	76%	0.762	77%	0.769	S	S	*	*				42	161.4	123	-60.7	-67	-5.8	0	0	122
348	P	41	Very low	28.3	Very low	107 Å²	107	132.2 Å²	132.2	70%	0.695	76%	0.763	S	S	*	*			cis	-135	-180	-8.1	25	0.8	0	0	0	116.6
349	F	21.2	Very low	27.9	Very low	189 Å²	189	135.3 Å²	135.3	83%	0.829	78%	0.778	S	S	*	*			trans	23	127.1	151	-78.1	-91.1	0	0	0	125
350	S	25.9	Very low	27.8	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	77%	0.774	S	S	*	*			trans	45.1	134.9	130.4	-60.9	0	0	0	0	124.4
351	L	27.7	Very low	28	Very low	171 Å²	171	136.8 Å²	136.8	90%	0.895	78%	0.777	S	S	*	*				164.8	124.7	93.5	-177.1	64.4	0	0	0	115.2
352	G	23.9	Very low	27.5	Very low	65 Å²	65	132.4 Å²	132.4	67%	0.67	77%	0.771	S	S	*	*			trans	69.5	175.6	153.1	0	0	0	0	0	119.6
353	N	28.2	Very low	27.5	Very low	133 Å²	133	131.2 Å²	131.2	71%	0.711	77%	0.774	S	S	*	*			cis	-163.3	135.2	-25.9	-141.9	12.4	0	0	0	112.5
354	H	32	Very low	27.5	Very low	143 Å²	143	130.3 Å²	130.3	66%	0.662	77%	0.766	S	S	*	*			trans	61.9	163.3	160.7	-62.5	-35.3	0	0	0	119.2
355	H	30.2	Very low	27.5	Very low	145 Å²	145	135.3 Å²	135.3	67%	0.671	77%	0.769	S	S	*	*			cis	-155.6	148.7	2.3	-111.5	-28.3	0	0	0	111.7
356	I	29.6	Very low	27.4	Very low	142 Å²	142	136.3 Å²	136.3	73%	0.728	77%	0.77	S	S	*	*			trans	52.9	134	136.6	-62.1	168.4	0	0	0	119.3
357	R	28.3	Very low	27.3	Very low	248 Å²	248	136 Å²	136	94%	0.936	77%	0.773	S	S	*	*			cis	-156.5	156.3	13.8	-152.7	168.9	178.6	165.7	-1.2	108
358	G	26.5	Very low	27.4	Very low	54 Å²	54	134.6 Å²	134.6	56%	0.557	78%	0.776	S	S	*	*			cis	167.4	-161.9	-5.5	0	0	0	0	0	112
359	T	23.7	Very low	27.8	Very low	152 Å²	152	134.6 Å²	134.6	93%	0.933	78%	0.776	S	S	*	*			trans	91.3	161.9	-177.9	73.9	0	0	0	0	117.1
360	L	26.8	Very low	28.1	Very low	163 Å²	163	133.8 Å²	133.8	85%	0.853	78%	0.775	S	S	*	*			trans	-121.1	178.8	-157.5	-110.1	71.6	0	0	0	111.2
361	P	32.5	Very low	28.1	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	78%	0.776	S	S	*	*			cis	-129.8	180	-27.6	37	-20.6	0	0	0	112.6
362	G	22.8	Very low	28.4	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	76%	0.762	S	S	*	*			trans	171.2	8.9	169.6	0	0	0	0	0	124.9
363	N	25.7	Very low	28.6	Very low	163 Å²	163	139 Å²	139	87%	0.872	77%	0.774	S	S	*	*			trans	34.7	119.8	170.1	-68.2	3.1	0	0	0	121.8
364	A	25.6	Very low	28.7	Very low	88 Å²	88	136.5 Å²	136.5	73%	0.727	77%	0.772	S	S	*	*			trans	-62.3	154.3	157.2	0	0	0	0	0	111.4
365	Q	25.7	Very low	28.5	Very low	181 Å²	181	134.3 Å²	134.3	85%	0.846	78%	0.779	S	S	*	*			cis	63.5	130.1	47.8	-62.5	-68.8	-0.3	0	0	113.6
366	V	24.3	Very low	28.5	Very low	134 Å²	134	136.1 Å²	136.1	81%	0.812	79%	0.785	S	S	*	*			trans	-131.9	141.9	-167.6	173.4	0	0	0	0	110.8
367	S	25.2	Very low	28.4	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	78%	0.784	S	S	*	*			trans	-113.5	177	177.5	-63.2	0	0	0	0	112.7
368	V	28.5	Very low	28.3	Very low	135 Å²	135	131 Å²	131	82%	0.818	77%	0.771	S	S	*	*			trans	-122.7	159.3	-167.9	173.3	0	0	0	0	108
369	P	49.4	Very low	28.3	Very low	107 Å²	107	135.3 Å²	135.3	70%	0.695	78%	0.78	S	S	*	*			cis	-128.8	-163.8	-11.2	31.9	-9.5	0	0	0	114.8
370	Q	26.7	Very low	28.4	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.804	77%	0.765	S	S	*	*			trans	98.8	164.5	142.1	-152	150.6	-34.4	0	0	120.9
371	Q	27.6	Very low	28.4	Very low	163 Å²	163	130.7 Å²	130.7	76%	0.762	76%	0.763	S	S	*	*			trans	-76	-180	-167.4	-76.2	160.6	-68.9	0	0	115.5
372	S	33.6	Very low	28.1	Very low	85 Å²	85	132.1 Å²	132.1	59%	0.594	76%	0.764	S	S	*	*			cis	175.9	113.8	-49.4	60.8	0	0	0	0	111.5
373	H	27.9	Very low	28.3	Very low	201 Å²	201	133 Å²	133	93%	0.931	76%	0.758	S	S	*	*			trans	-167.2	166.9	167.5	-85.3	-79.7	0	0	0	108.7
374	A	29.5	Very low	28.5	Very low	80 Å²	80	131.7 Å²	131.7	66%	0.661	75%	0.751	S	S	*	*			cis	-168.5	158.2	-35.8	0	0	0	0	0	109.8
375	A	28.6	Very low	28.6	Very low	97 Å²	97	138.5 Å²	138.5	80%	0.802	76%	0.757	S	S	*	*			trans	64.5	164.1	166.3	0	0	0	0	0	117.4
376	K	30.2	Very low	28.6	Very low	184 Å²	184	135.1 Å²	135.1	80%	0.8	75%	0.754	S	S	*	*			cis	-160.9	-176.6	-23.5	-115.5	-179.8	178.7	173.6	0	109.5
377	Q	27.6	Very low	30.1	Very low	153 Å²	153	133.7 Å²	133.7	72%	0.715	75%	0.747	S	S	*	*			trans	77.9	151.2	166.3	-41.2	-54.1	37.5	0	0	118
378	L	26.6	Very low	30.1	Very low	128 Å²	128	135.4 Å²	135.4	67%	0.67	75%	0.747	S	S	*	*			cis	-165.8	151	-25.1	-99.3	178.3	0	0	0	109.1
379	I	27	Very low	30.3	Very low	145 Å²	145	135 Å²	135	74%	0.744	74%	0.744	S	S	*	*			trans	54.4	141.8	140.6	-71.4	171.9	0	0	0	120.1
380	S	25.2	Very low	29.3	Very low	86 Å²	86	134.5 Å²	134.5	60%	0.601	75%	0.749	S	S	*	*			cis	-169.7	169	-4.9	-110.8	0	0	0	0	112.7
381	T	26.3	Very low	29.2	Very low	132 Å²	132	130 Å²	130	81%	0.81	75%	0.749	S	S	*	*			trans	64.3	158.8	154.5	52.2	0	0	0	0	119.1
382	N	26.4	Very low	29.2	Very low	151 Å²	151	126.9 Å²	126.9	81%	0.807	75%	0.751	S	S	*	*			cis	-141.3	176.6	-1.7	-149.4	-6.9	0	0	0	113
383	S	27.1	Very low	29	Very low	90 Å²	90	128 Å²	128	63%	0.629	76%	0.758	S	S	*	*			trans	-86.2	162.5	-179.8	-175.2	0	0	0	0	114.5
384	L	29.2	Very low	29	Very low	137 Å²	137	123.9 Å²	123.9	72%	0.717	75%	0.753	S	S	*	*				168	131.9	118.3	-84.8	164.3	0	0	0	116.2
385	R	28.9	Very low	29	Very low	230 Å²	230	124.6 Å²	124.6	87%	0.868	75%	0.753	S	S	*	*			trans	66.1	129.4	141.8	-67.8	176.5	-175.9	-173	3.1	124.5
386	S	24.6	Very low	29.1	Very low	110 Å²	110	127.5 Å²	127.5	77%	0.769	75%	0.754	S	S	*	*			trans	-75.1	-160.6	161.1	-25.6	0	0	0	0	112.8
387	P	56.3	Low	28.9	Very low	104 Å²	104	127.3 Å²	127.3	68%	0.675	75%	0.753	S	S	*	*			cis	-140.2	-154.6	-8.8	25.7	2.6	0	0	0	114.2
388	L	26	Very low	28.8	Very low	154 Å²	154	125.4 Å²	125.4	81%	0.806	76%	0.756	S	S	*	*			trans	84.4	156.1	154.7	-58.6	165.4	0	0	0	119.8
389	V	31.7	Very low	28.9	Very low	127 Å²	127	125.4 Å²	125.4	77%	0.77	76%	0.757	S	S	*	*			cis	-164.7	151.3	-40.9	93.8	0	0	0	0	112.8
390	A	27.7	Very low	29.6	Very low	96 Å²	96	124.2 Å²	124.2	79%	0.793	76%	0.759	S	S	*	*			trans	56.5	144.1	155.2	0	0	0	0	0	125.4
391	G	24.8	Very low	29.8	Very low	78 Å²	78	127.1 Å²	127.1	80%	0.804	77%	0.767	S	S	*	*			trans	92.5	157.8	151.2	0	0	0	0	0	118.8
392	A	27.7	Very low	29.7	Very low	96 Å²	96	124.7 Å²	124.7	79%	0.793	77%	0.768	S	S	*	*			cis	-164.7	145	-26.8	0	0	0	0	0	112.3
393	S	28.8	Very low	29.9	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	76%	0.757	S	S	*	*			trans	52.4	116.5	150	-57	0	0	0	0	124.7
394	S	29.1	Very low	30	Very low	116 Å²	116	126.6 Å²	126.6	81%	0.811	76%	0.762	S	S	*	*			trans	73.5	161.2	139.2	84.4	0	0	0	0	119.3
395	S	28.5	Very low	30.1	Very low	95 Å²	95	124 Å²	124	66%	0.664	75%	0.752	S	S	*	*			cis	-160.2	150.1	3.4	-145.3	0	0	0	0	114.7
396	L	30.8	Very low	30.2	Very low	157 Å²	157	120.9 Å²	120.9	82%	0.822	75%	0.748	S	S	*	*			trans	64.2	156.1	165	-44.5	-174.6	0	0	0	117.2
397	K	26.2	Very low	30.4	Very low	181 Å²	181	119.5 Å²	119.5	79%	0.787	74%	0.742	S	S	*	*			cis	-161.9	148.7	26.4	-154.9	174.5	-170.3	174.7	0	113.7
398	S	26.9	Very low	29.2	Very low	112 Å²	112	118.4 Å²	118.4	78%	0.783	74%	0.742	S	S	*	*			trans	59.6	135.4	153.9	48.9	0	0	0	0	122.9
399	N	27.6	Very low	29.5	Very low	129 Å²	129	113.6 Å²	113.6	69%	0.69	73%	0.725	S	S	*	*			trans	-102.3	171.3	172.2	-153.4	-3.4	0	0	0	109.9
400	P	41.6	Very low	29.7	Very low	120 Å²	120	112.2 Å²	112.2	78%	0.779	72%	0.717	S	S	*	*				-147.4	178.8	87.4	38.5	-19.7	0	0	0	116.5
401	L	28.8	Very low	29.9	Very low	147 Å²	147	113.2 Å²	113.2	77%	0.77	71%	0.713	S	S	*	*			trans	-83.2	153.7	-158	-75.9	62.9	0	0	0	116.6
402	G	25.9	Very low	30.4	Very low	81 Å²	81	116.4 Å²	116.4	84%	0.835	72%	0.717	S	S	*	*			trans	-137.5	120.7	146.4	0	0	0	0	0	109.2
403	S	28.8	Very low	30.4	Very low	81 Å²	81	116.9 Å²	116.9	57%	0.566	72%	0.72	S	S	*	*			trans	-91.1	151.6	-159.9	-162.5	0	0	0	0	115.9	Q542	S403-Q542 PolarHBondContact OG-NE2 3.36Å; S403-Q542 PolarHBondContact OG-OE1 3.28Å
404	R	30.1	Very low	30.4	Very low	199 Å²	199	116.8 Å²	116.8	75%	0.751	73%	0.726	S	S	*	*			trans	-149.6	121.7	165.6	176	177.2	176	179.1	-1.2	109.3	Q406	R404-Q406 PolarHBondContact O-N 2.92Å
405	V	30.3	Very low	30.5	Very low	83 Å²	83	118.1 Å²	118.1	50%	0.503	73%	0.729	S	S	.	*			trans	-61.4	133.5	172.4	-179.8	0	0	0	0	109.9	Q542	V405-Q542 HydrophobicContact CG2-CG 4.3Å
406	Q	31.2	Very low	30.6	Very low	165 Å²	165	120.7 Å²	120.7	77%	0.771	74%	0.741	S	S	*	*			trans	-120.8	128.1	173.3	-62	-172.4	14.3	0	0	109.2	R404	R404-Q406 PolarHBondContact O-N 2.92Å
407	A	30.4	Very low	30.5	Very low	80 Å²	80	118.2 Å²	118.2	66%	0.661	74%	0.744	S	S	*	*			trans	-94.8	118	164.5	0	0	0	0	0	107.9
408	A	30.8	Very low	30.6	Very low	81 Å²	81	119.5 Å²	119.5	67%	0.669	75%	0.749	S	S	*	*			trans	-95.6	130.2	173.7	0	0	0	0	0	109.6
409	A	31.4	Very low	30.9	Very low	53 Å²	53	124.3 Å²	124.3	44%	0.438	76%	0.756	S	S	.	*			trans	-123.5	120.8	171.3	0	0	0	0	0	108	D488	A409-D488 HydrophobicContact CB-CB 3.7Å
410	T	35.8	Very low	30.8	Very low	99 Å²	99	121.9 Å²	121.9	61%	0.607	76%	0.762	S	S	*	*			trans	-90.4	119.6	-167.8	-37.3	0	0	0	0	111.1	I435	T410-I435 HydrophobicContact CG2-CD1 4.39Å
411	T	31.3	Very low	30.1	Very low	117 Å²	117	120.1 Å²	120.1	72%	0.718	77%	0.765	S	S	*	*			trans	-88.4	150.5	170.2	48.6	0	0	0	0	111
412	V	36.1	Very low	30.1	Very low	145 Å²	145	118.3 Å²	118.3	88%	0.879	76%	0.764	S	S	*	*			trans	-122.3	134	170.2	-69.5	0	0	0	0	109.9
413	A	27.2	Very low	30.2	Very low	105 Å²	105	119.2 Å²	119.2	87%	0.868	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-103.1	142.7	172.7	0	0	0	0	0	109.5
414	A	29.1	Very low	30.2	Very low	106 Å²	106	121.5 Å²	121.5	88%	0.876	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-98.6	132	179.6	0	0	0	0	0	111.3
415	V	31.1	Very low	30.5	Very low	144 Å²	144	120.1 Å²	120.1	87%	0.873	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-94.5	164.8	170.8	-69.1	0	0	0	0	111.2
416	T	30.5	Very low	30.4	Very low	149 Å²	149	119.4 Å²	119.4	91%	0.914	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-84.2	144.5	-171.3	43.4	0	0	0	0	113.9
417	A	30	Very low	30.5	Very low	106 Å²	106	118.8 Å²	118.8	88%	0.876	79%	0.792	S	S	*	*			trans	-142.5	162.5	169.5	0	0	0	0	0	110.5
418	K	28.3	Very low	30.6	Very low	208 Å²	208	119.9 Å²	119.9	90%	0.904	80%	0.795	S	S	*	*			trans	-126.9	111.7	-156.3	-164.7	178.8	-176.1	-178	0	113.5
419	K	32.3	Very low	31.2	Very low	212 Å²	212	124.2 Å²	124.2	92%	0.922	80%	0.795	S	S	*	*			trans	33.6	114.1	157.5	-168.2	177.8	-178.4	179.9	0	119.8
420	G	25.1	Very low	31.7	Very low	79 Å²	79	127.5 Å²	127.5	81%	0.814	81%	0.81	S	S	*	*			trans	-169.3	142.7	158.6	0	0	0	0	0	111.9
421	G	28.1	Very low	32.6	Very low	82 Å²	82	128 Å²	128	85%	0.845	81%	0.805	S	S	*	*			trans	-111.4	177.3	174.2	0	0	0	0	0	111.7
422	S	28.9	Very low	34.2	Very low	109 Å²	109	127.8 Å²	127.8	76%	0.762	79%	0.794	S	S	*	*			cis	-156.6	166.8	14.5	-171.1	0	0	0	0	112.1
423	S	27.1	Very low	35.9	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	78%	0.779	S	S	*	*			trans	21.4	137.3	145.7	62	0	0	0	0	120.7
424	V	29.5	Very low	38	Very low	129 Å²	129	124.5 Å²	124.5	78%	0.782	75%	0.745	S	S	*	*			cis	-164.9	169.2	9.9	81	0	0	0	0	111.8
425	L	35.5	Very low	40.2	Very low	170 Å²	170	122.8 Å²	122.8	89%	0.89	72%	0.72	S	S	*	*			trans	62.7	106.4	170.7	-72.9	171.6	0	0	0	118.3
426	G	27.8	Very low	42.3	Very low	68 Å²	68	115.9 Å²	115.9	70%	0.701	68%	0.679	S	S	*	*			trans	163.5	118.3	165.7	0	0	0	0	0	111	S428	G426-S428 VanDerWaalsContact C-N 3.27Å; G426-S428 PolarHBondContact O-N 2.9Å
427	T	33.6	Very low	44.3	Very low	151 Å²	151	112 Å²	112	93%	0.926	65%	0.654	S	S	*	*			trans	-80.1	72.4	-178.6	51.6	0	0	0	0	111.4	Y429	T427-Y429 PolarHBondContact O-N 3.43Å
428	S	33.8	Very low	46.2	Very low	104 Å²	104	109.7 Å²	109.7	73%	0.727	63%	0.627	S	S	*	*			trans	-68.2	90.9	174.9	60.3	0	0	0	0	110.6	G426 T430	G426-S428 VanDerWaalsContact C-N 3.27Å; G426-S428 PolarHBondContact O-N 2.9Å; S428-T430 PolarHBondContact O-N 3.09Å
429	Y	42.8	Very low	48.3	Very low	172 Å²	172	101.9 Å²	101.9	68%	0.675	60%	0.598	S	S	*	*			trans	-59.6	102.1	165.9	179	-92.9	0	0	0	108.2	T427 Q431	T427-Y429 PolarHBondContact O-N 3.43Å; Y429-Q431 HydrophobicContact CD1-CG 4.32Å; Y429-Q431 PolarHBondContact O-N 3.48Å
430	T	41.6	Very low	50.3	Low	121 Å²	121	97.5 Å²	97.5	74%	0.742	59%	0.585	S	S	*	*			trans	-62.8	103.4	173.3	52.4	0	0	0	0	107.4	S428 K432	S428-T430 PolarHBondContact O-N 3.09Å; T430-K432 PolarHBondContact O-N 3.33Å
431	Q	55.5	Low	52.8	Low	109 Å²	109	99.1 Å²	99.1	51%	0.509	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-52.9	116.5	-177.4	-70.4	-178.8	-5	0	0	108.8	Y429 W433	Y429-Q431 HydrophobicContact CD1-CG 4.32Å; Y429-Q431 PolarHBondContact O-N 3.48Å; Q431-W433 PolarHBondContact O-N 3.38Å; Q431-W433 PolarHBondContact O-NE1 2.81Å
432	K	63.7	Low	54.9	Low	113 Å²	113	100.2 Å²	100.2	49%	0.491	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-73.1	121.7	179.5	-178.4	176.7	170.8	-131.8	0	107.7	T430 E445	T430-K432 PolarHBondContact O-N 3.33Å; K432-E445 HydrophobicContact CB-CB 4.13Å; K432-E445 VanDerWaalsContact CD-OE2 3.31Å; K432-E445 WeakPolarHBondContact CD-OE2 3.41Å; K432-E445 VanDerWaalsContact CE-OE2 3.29Å; K432-E445 WeakPolarHBondContact CE-OE2 3.36Å; K432-E445 IonicContact NZ-OE2 3.66Å; K432-E445 PolarHBondContact NZ-OE2 3.26Å; K432-E445 VanDerWaalsContact O-CB 3.26Å; K432-E445 WeakPolarHBondContact O-CB 3.44Å; K432-E445 PolarHBondContact O-N 3.27Å
433	W	73.1	Confident	57.1	Low	145 Å²	145	96.7 Å²	96.7	55%	0.549	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136	177.1	-64.7	80	0	0	0	110	Q431 L442 F443 P444	Q431-W433 PolarHBondContact O-N 3.38Å; Q431-W433 PolarHBondContact O-NE1 2.81Å; W433-L442 HydrophobicContact CB-CD2 4.1Å; W433-L442 HydrophobicContact CE3-CB 4.21Å; W433-F443 CarbonylContact C-O 3.51Å; W433-F443 WeakPolarHBondContact CA-O 3.28Å; W433-P444 HydrophobicContact CE3-CG 4.21Å; W433-P444 HydrophobicContact CH2-CG 3.87Å; W433-P444 HydrophobicContact CZ2-CG 4.24Å; W433-P444 HydrophobicContact CZ3-CG 3.86Å
434	K	71.7	Confident	59.5	Low	36 Å²	36	93 Å²	93	16%	0.157	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.8	171	-87	-179.4	161.3	170.2	0	108.9	F443 E445 Y448 T536	K434-F443 PolarHBondContact N-O 3.41Å; K434-F443 PolarHBondContact O-N 3.2Å; K434-E445 WeakPolarHBondContact CD-OE1 3.48Å; K434-E445 WeakPolarHBondContact CE-OE1 3.35Å; K434-E445 WeakPolarHBondContact CE-OE2 3.49Å; K434-E445 IonicContact NZ-OE1 2.84Å; K434-E445 PolarHBondContact NZ-OE1 3.4Å; K434-E445 IonicContact NZ-OE2 2.65Å; K434-Y448 HydrophobicContact CB-CD2 3.36Å; K434-Y448 HydrophobicContact CB-CE2 3.68Å; K434-Y448 HydrophobicContact CB-CG 3.88Å; K434-Y448 HydrophobicContact CD-CD1 3.61Å; K434-Y448 HydrophobicContact CD-CD2 3.9Å; K434-Y448 HydrophobicContact CD-CE1 3.93Å; K434-Y448 HydrophobicContact CD-CE2 4.18Å; K434-Y448 HydrophobicContact CD-CG 3.6Å; K434-Y448 HydrophobicContact CG-CD2 4.29Å; K434-Y448 HydrophobicContact CG-CG 4.41Å; K434-T536 PolarHBondContact NZ-OG1 2.87Å
435	I	74.8	Confident	61.5	Low	70 Å²	70	89 Å²	89	36%	0.359	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.1	168.5	-59	169.3	0	0	0	107.3	T410 T437 E441 L442	T410-I435 HydrophobicContact CG2-CD1 4.39Å; I435-T437 PolarHBondContact O-N 2.82Å; I435-E441 WeakPolarHBondContact CA-O 3.2Å; I435-L442 HydrophobicContact CD1-CD2 4.3Å; I435-L442 HydrophobicContact CG1-CD2 3.44Å; I435-L442 VanDerWaalsContact CG1-CD2 3.44Å; I435-L442 HydrophobicContact CG1-CG 3.94Å
436	C	75.4	Confident	63.3	Low	0 Å²	0	86.8 Å²	86.8	0%	0	46%	0.464	C	S	.	.			trans	-73.1	126.6	172.9	-177.2	0	0	0	0	110.5	I438 C439 N440 E441 F443 Y448 H456	C436-I438 PolarHBondContact O-N 2.95Å; C436-I438 VanDerWaalsContact O-N 3.14Å; C436-C439 VanDerWaalsContact CB-SG 3.53Å; C436-N440 WeakPolarHBondContact O-CA 3.38Å; C436-N440 PolarHBondContact O-N 3.35Å; C436-E441 PolarHBondContact N-O 2.85Å; C436-F443 HydrophobicContact CB-CD2 4.37Å; C436-F443 HydrophobicContact CB-CE2 4.17Å; C436-Y448 HydrophobicContact CB-CE2 3.99Å; C436-H456 VanDerWaalsContact SG-CD2 3.55Å; C436-H456 PolarHBondContact SG-NE2 3.21Å
437	T	72.3	Confident	65.5	Low	66 Å²	66	86.8 Å²	86.8	41%	0.405	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-4.1	-179.2	52	0	0	0	0	114.4	I435	I435-T437 PolarHBondContact O-N 2.82Å
438	I	69	Low	67.6	Low	58 Å²	58	79.8 Å²	79.8	30%	0.297	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-46.9	-177.6	-57.6	177.2	0	0	0	111.3	C436 F452 H456 N548	C436-I438 PolarHBondContact O-N 2.95Å; C436-I438 VanDerWaalsContact O-N 3.14Å; I438-F452 HydrophobicContact CD1-CD2 4.41Å; I438-F452 HydrophobicContact CD1-CE2 3.48Å; I438-F452 VanDerWaalsContact CD1-CE2 3.48Å; I438-F452 HydrophobicContact CD1-CZ 3.79Å; I438-F452 HydrophobicContact CG1-CE2 4.13Å; I438-H456 HydrophobicContact CD1-CB 3.9Å; I438-N548 HydrophobicContact CD1-CB 4.14Å; I438-N548 WeakPolarHBondContact CD1-OD1 3.21Å
439	C	73.3	Confident	69.4	Low	44 Å²	44	76.9 Å²	76.9	30%	0.297	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-12.7	176.1	66.8	0	0	0	0	115	C436 E441 H451	C436-C439 VanDerWaalsContact CB-SG 3.53Å; C439-E441 HydrophobicContact CB-CG 4.36Å; C439-E441 PolarHBondContact O-N 2.96Å; C439-H451 PolarHBondContact SG-NE2 2.9Å
440	N	73.3	Confident	70.8	Confident	121 Å²	121	71.5 Å²	71.5	65%	0.647	38%	0.377	S	S	*	.			trans	64.1	13.2	-173.4	-57	-74.4	0	0	0	116.1	C436	C436-N440 WeakPolarHBondContact O-CA 3.38Å; C436-N440 PolarHBondContact O-N 3.35Å
441	E	77.9	Confident	72.5	Confident	112 Å²	112	66.8 Å²	66.8	52%	0.523	35%	0.347	S	S	.	.			trans	-81	152.2	175.8	-62.5	177	158.9	0	0	112.4	I435 C436 C439 F443	I435-E441 WeakPolarHBondContact CA-O 3.2Å; C436-E441 PolarHBondContact N-O 2.85Å; C439-E441 HydrophobicContact CB-CG 4.36Å; C439-E441 PolarHBondContact O-N 2.96Å; E441-F443 HydrophobicContact CB-CD2 4.47Å; E441-F443 HydrophobicContact CB-CE2 3.59Å; E441-F443 HydrophobicContact CB-CZ 3.73Å; E441-F443 WeakPolarHBondContact OE2-CZ 3.48Å
442	L	72.9	Confident	73.2	Confident	106 Å²	106	61.7 Å²	61.7	56%	0.555	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	117.4	-178	-88.1	161.5	0	0	0	111	W433 I435	W433-L442 HydrophobicContact CB-CD2 4.1Å; W433-L442 HydrophobicContact CE3-CB 4.21Å; I435-L442 HydrophobicContact CD1-CD2 4.3Å; I435-L442 HydrophobicContact CG1-CD2 3.44Å; I435-L442 VanDerWaalsContact CG1-CD2 3.44Å; I435-L442 HydrophobicContact CG1-CG 3.94Å
443	F	75.1	Confident	73.4	Confident	35 Å²	35	60.9 Å²	60.9	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.5	177.4	-59.3	-79.5	0	0	0	112.1	W433 K434 C436 E441 Y448 H451	W433-F443 CarbonylContact C-O 3.51Å; W433-F443 WeakPolarHBondContact CA-O 3.28Å; K434-F443 PolarHBondContact N-O 3.41Å; K434-F443 PolarHBondContact O-N 3.2Å; C436-F443 HydrophobicContact CB-CD2 4.37Å; C436-F443 HydrophobicContact CB-CE2 4.17Å; E441-F443 HydrophobicContact CB-CD2 4.47Å; E441-F443 HydrophobicContact CB-CE2 3.59Å; E441-F443 HydrophobicContact CB-CZ 3.73Å; E441-F443 WeakPolarHBondContact OE2-CZ 3.48Å; F443-Y448 HydrophobicContact CB-CD2 4.34Å; F443-Y448 HydrophobicContact CD2-CD2 4.41Å; F443-H451 AromaticContact CD2-CD2 3.77Å; F443-H451 HydrophobicContact CE1-CB 4.44Å; F443-H451 AromaticContact CE1-ND1 4Å; F443-H451 AromaticContact CE2-CD2 3.35Å; F443-H451 WeakPolarHBondContact CE2-CD2 3.41Å; F443-H451 AromaticContact CE2-CE1 3.54Å; F443-H451 AromaticContact CE2-CG 3.63Å; F443-H451 AromaticContact CE2-ND1 3.74Å; F443-H451 AromaticContact CE2-NE2 3.3Å; F443-H451 VanDerWaalsContact CE2-NE2 3.3Å; F443-H451 WeakPolarHBondContact CE2-NE2 3.27Å; F443-H451 HydrophobicContact CZ-CB 4.44Å; F443-H451 AromaticContact CZ-CD2 3.84Å; F443-H451 AromaticContact CZ-CE1 3.45Å; F443-H451 VanDerWaalsContact CZ-CE1 3.45Å; F443-H451 WeakPolarHBondContact CZ-CE1 3.31Å; F443-H451 AromaticContact CZ-CG 3.63Å; F443-H451 AromaticContact CZ-ND1 3.38Å; F443-H451 WeakPolarHBondContact CZ-ND1 3.42Å; F443-H451 AromaticContact CZ-NE2 3.74Å
444	P	77.3	Confident	73.2	Confident	22 Å²	22	61.2 Å²	61.2	14%	0.143	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	140.1	161.8	-24.6	36.8	0	0	0	111.3	W433 N446 V447 Y448	W433-P444 HydrophobicContact CE3-CG 4.21Å; W433-P444 HydrophobicContact CH2-CG 3.87Å; W433-P444 HydrophobicContact CZ2-CG 4.24Å; W433-P444 HydrophobicContact CZ3-CG 3.86Å; P444-N446 WeakPolarHBondContact CB-OD1 3.24Å; P444-N446 PolarHBondContact O-N 3.35Å; P444-N446 VanDerWaalsContact O-N 3.09Å; P444-V447 HydrophobicContact CB-CG2 4.33Å; P444-V447 PolarHBondContact O-N 3.4Å; P444-Y448 PolarHBondContact O-N 3.46Å
445	E	71.6	Confident	72.8	Confident	45 Å²	45	64.3 Å²	64.3	21%	0.21	34%	0.341	C	S	.	.	H	α-helix	trans	-51.6	-34.9	-176.7	177.7	82.4	-128.3	0	0	113.2	K432 K434	K432-E445 HydrophobicContact CB-CB 4.13Å; K432-E445 VanDerWaalsContact CD-OE2 3.31Å; K432-E445 WeakPolarHBondContact CD-OE2 3.41Å; K432-E445 VanDerWaalsContact CE-OE2 3.29Å; K432-E445 WeakPolarHBondContact CE-OE2 3.36Å; K432-E445 IonicContact NZ-OE2 3.66Å; K432-E445 PolarHBondContact NZ-OE2 3.26Å; K432-E445 VanDerWaalsContact O-CB 3.26Å; K432-E445 WeakPolarHBondContact O-CB 3.44Å; K432-E445 PolarHBondContact O-N 3.27Å; K434-E445 WeakPolarHBondContact CD-OE1 3.48Å; K434-E445 WeakPolarHBondContact CE-OE1 3.35Å; K434-E445 WeakPolarHBondContact CE-OE2 3.49Å; K434-E445 IonicContact NZ-OE1 2.84Å; K434-E445 PolarHBondContact NZ-OE1 3.4Å; K434-E445 IonicContact NZ-OE2 2.65Å
446	N	72.3	Confident	72.2	Confident	125 Å²	125	62.4 Å²	62.4	67%	0.668	33%	0.331	S	S	*	.	H	α-helix	trans	-74.4	-20.5	177.5	62.2	-43.6	0	0	0	114.4	P444	P444-N446 WeakPolarHBondContact CB-OD1 3.24Å; P444-N446 PolarHBondContact O-N 3.35Å; P444-N446 VanDerWaalsContact O-N 3.09Å
447	V	74.9	Confident	71.6	Confident	67 Å²	67	70.9 Å²	70.9	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-97.8	-29.3	176.7	-174.8	0	0	0	0	111.2	P444 S449 A450 H451	P444-V447 HydrophobicContact CB-CG2 4.33Å; P444-V447 PolarHBondContact O-N 3.4Å; V447-S449 VanDerWaalsContact C-N 3.34Å; V447-S449 PolarHBondContact O-N 3.25Å; V447-A450 PolarHBondContact O-N 2.9Å; V447-H451 PolarHBondContact O-N 3.1Å
448	Y	77.2	Confident	71	Confident	4 Å²	4	68.3 Å²	68.3	2%	0.016	35%	0.353	C	S	.	.	H	α-helix	trans	-47.9	-49.1	-176.9	-175.8	-91.5	0	0	0	114	K434 C436 F443 P444 A450 H451 F452 D538	K434-Y448 HydrophobicContact CB-CD2 3.36Å; K434-Y448 HydrophobicContact CB-CE2 3.68Å; K434-Y448 HydrophobicContact CB-CG 3.88Å; K434-Y448 HydrophobicContact CD-CD1 3.61Å; K434-Y448 HydrophobicContact CD-CD2 3.9Å; K434-Y448 HydrophobicContact CD-CE1 3.93Å; K434-Y448 HydrophobicContact CD-CE2 4.18Å; K434-Y448 HydrophobicContact CD-CG 3.6Å; K434-Y448 HydrophobicContact CG-CD2 4.29Å; K434-Y448 HydrophobicContact CG-CG 4.41Å; C436-Y448 HydrophobicContact CB-CE2 3.99Å; F443-Y448 HydrophobicContact CB-CD2 4.34Å; F443-Y448 HydrophobicContact CD2-CD2 4.41Å; P444-Y448 PolarHBondContact O-N 3.46Å; Y448-A450 VanDerWaalsContact C-N 3.33Å; Y448-A450 PolarHBondContact O-N 3.49Å; Y448-H451 PolarHBondContact O-N 2.89Å; Y448-F452 WeakPolarHBondContact O-CB 3.36Å; Y448-F452 PolarHBondContact O-N 2.98Å; Y448-D538 VanDerWaalsContact CE1-OD2 3.29Å; Y448-D538 WeakPolarHBondContact CE1-OD2 3.44Å; Y448-D538 PolarHBondContact OH-OD2 3.3Å
449	S	71.1	Confident	71.1	Confident	44 Å²	44	67.8 Å²	67.8	31%	0.308	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-34.6	-177.6	-56	0	0	0	0	113	V447 E453	V447-S449 VanDerWaalsContact C-N 3.34Å; V447-S449 PolarHBondContact O-N 3.25Å; S449-E453 WeakPolarHBondContact O-CB 3.4Å; S449-E453 PolarHBondContact O-N 3.21Å; S449-E453 VanDerWaalsContact O-N 3.12Å
450	A	73.3	Confident	71.1	Confident	59 Å²	59	69.8 Å²	69.8	49%	0.488	35%	0.353	S	S	.	.	H	α-helix	trans	-73.2	-38.9	177	0	0	0	0	0	111.6	V447 Y448 K454	V447-A450 PolarHBondContact O-N 2.9Å; Y448-A450 VanDerWaalsContact C-N 3.33Å; Y448-A450 PolarHBondContact O-N 3.49Å; A450-K454 WeakPolarHBondContact O-CB 3.45Å; A450-K454 PolarHBondContact O-N 3.13Å
451	H	77.1	Confident	71.4	Confident	22 Å²	22	64.1 Å²	64.1	10%	0.102	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-49.3	171.3	162.2	76.7	0	0	0	111.5	C439 F443 V447 Y448 E453 K454 E455 H456	C439-H451 PolarHBondContact SG-NE2 2.9Å; F443-H451 AromaticContact CD2-CD2 3.77Å; F443-H451 HydrophobicContact CE1-CB 4.44Å; F443-H451 AromaticContact CE1-ND1 4Å; F443-H451 AromaticContact CE2-CD2 3.35Å; F443-H451 WeakPolarHBondContact CE2-CD2 3.41Å; F443-H451 AromaticContact CE2-CE1 3.54Å; F443-H451 AromaticContact CE2-CG 3.63Å; F443-H451 AromaticContact CE2-ND1 3.74Å; F443-H451 AromaticContact CE2-NE2 3.3Å; F443-H451 VanDerWaalsContact CE2-NE2 3.3Å; F443-H451 WeakPolarHBondContact CE2-NE2 3.27Å; F443-H451 HydrophobicContact CZ-CB 4.44Å; F443-H451 AromaticContact CZ-CD2 3.84Å; F443-H451 AromaticContact CZ-CE1 3.45Å; F443-H451 VanDerWaalsContact CZ-CE1 3.45Å; F443-H451 WeakPolarHBondContact CZ-CE1 3.31Å; F443-H451 AromaticContact CZ-CG 3.63Å; F443-H451 AromaticContact CZ-ND1 3.38Å; F443-H451 WeakPolarHBondContact CZ-ND1 3.42Å; F443-H451 AromaticContact CZ-NE2 3.74Å; V447-H451 PolarHBondContact O-N 3.1Å; Y448-H451 PolarHBondContact O-N 2.89Å; H451-E453 VanDerWaalsContact C-N 3.33Å; H451-E453 PolarHBondContact O-N 3.18Å; H451-K454 PolarHBondContact O-N 3.44Å; H451-E455 PolarHBondContact O-N 3.47Å; H451-H456 AromaticContact CE1-NE2 3.85Å; H451-H456 AromaticContact NE2-CD2 3.85Å; H451-H456 AromaticContact NE2-NE2 3.46Å; H451-H456 PolarHBondContact NE2-NE2 2.88Å
452	F	69.3	Low	71.6	Confident	1 Å²	1	60 Å²	60	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-36.1	-177.8	-159.8	-101.5	0	0	0	112.9	I438 Y448 H456 A458 D538 N548 Q550	I438-F452 HydrophobicContact CD1-CD2 4.41Å; I438-F452 HydrophobicContact CD1-CE2 3.48Å; I438-F452 VanDerWaalsContact CD1-CE2 3.48Å; I438-F452 HydrophobicContact CD1-CZ 3.79Å; I438-F452 HydrophobicContact CG1-CE2 4.13Å; Y448-F452 WeakPolarHBondContact O-CB 3.36Å; Y448-F452 PolarHBondContact O-N 2.98Å; F452-H456 WeakPolarHBondContact O-CB 3.49Å; F452-H456 PolarHBondContact O-N 3Å; F452-A458 HydrophobicContact CD1-CB 3.38Å; F452-A458 HydrophobicContact CE1-CB 3.31Å; F452-A458 HydrophobicContact CG-CB 4.45Å; F452-A458 HydrophobicContact CZ-CB 4.33Å; F452-D538 HydrophobicContact CE1-CB 4.21Å; F452-D538 HydrophobicContact CE2-CB 3.97Å; F452-D538 HydrophobicContact CZ-CB 3.59Å; F452-N548 HydrophobicContact CZ-CB 4.43Å; F452-Q550 HydrophobicContact CD1-CB 4.22Å; F452-Q550 HydrophobicContact CE1-CB 4Å
453	E	69.2	Low	72.2	Confident	96 Å²	96	55 Å²	55	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-70.5	-44.8	175	-177.4	160.1	-132.1	0	0	112.3	S449 H451 K457 K460	S449-E453 WeakPolarHBondContact O-CB 3.4Å; S449-E453 PolarHBondContact O-N 3.21Å; S449-E453 VanDerWaalsContact O-N 3.12Å; H451-E453 VanDerWaalsContact C-N 3.33Å; H451-E453 PolarHBondContact O-N 3.18Å; E453-K457 WeakPolarHBondContact O-CA 3.37Å; E453-K457 PolarHBondContact O-N 3.23Å; E453-K460 WeakPolarHBondContact OE1-CE 3.42Å; E453-K460 IonicContact OE1-NZ 2.7Å; E453-K460 PolarHBondContact OE1-NZ 3.31Å; E453-K460 IonicContact OE2-NZ 2.66Å; E453-K460 PolarHBondContact OE2-NZ 2.86Å
454	K	69.1	Low	72.7	Confident	152 Å²	152	54.3 Å²	54.3	66%	0.661	28%	0.278	S	S	*	.	H	α-helix	trans	-78.7	-52.5	-173.8	-173.3	-175.4	169.2	-123.1	0	113.5	A450 H451	A450-K454 WeakPolarHBondContact O-CB 3.45Å; A450-K454 PolarHBondContact O-N 3.13Å; H451-K454 PolarHBondContact O-N 3.44Å
455	E	62.6	Low	73.1	Confident	102 Å²	102	53.3 Å²	53.3	48%	0.477	27%	0.271	S	S	.	.	H	α-helix	trans	-87.1	-21.3	-171.7	-54.4	-54.9	146.7	0	0	112.5	H451	H451-E455 PolarHBondContact O-N 3.47Å
456	H	62.1	Low	73.7	Confident	30 Å²	30	55.8 Å²	55.8	14%	0.139	29%	0.286	C	S	.	.	H	α-helix	trans	-117.9	4.6	-177.9	-58.6	-27.6	0	0	0	114.3	C436 I438 H451 F452 A458 N548	C436-H456 VanDerWaalsContact SG-CD2 3.55Å; C436-H456 PolarHBondContact SG-NE2 3.21Å; I438-H456 HydrophobicContact CD1-CB 3.9Å; H451-H456 AromaticContact CE1-NE2 3.85Å; H451-H456 AromaticContact NE2-CD2 3.85Å; H451-H456 AromaticContact NE2-NE2 3.46Å; H451-H456 PolarHBondContact NE2-NE2 2.88Å; F452-H456 WeakPolarHBondContact O-CB 3.49Å; F452-H456 PolarHBondContact O-N 3Å; H456-A458 PolarHBondContact O-N 2.97Å; H456-A458 VanDerWaalsContact O-N 3.12Å; H456-N548 PolarHBondContact O-ND2 3.19Å
457	K	62.6	Low	74.2	Confident	178 Å²	178	50.3 Å²	50.3	77%	0.774	26%	0.256	S	S	*	.			trans	49.8	39.1	172	-59.2	-177.1	-179.4	178.6	0	113	E453	E453-K457 WeakPolarHBondContact O-CA 3.37Å; E453-K457 PolarHBondContact O-N 3.23Å
458	A	60.3	Low	74.8	Confident	11 Å²	11	47.1 Å²	47.1	9%	0.091	24%	0.237	C	C	.	.			trans	-76.2	132.4	-168.7	0	0	0	0	0	112.9	F452 H456 K460 N548	F452-A458 HydrophobicContact CD1-CB 3.38Å; F452-A458 HydrophobicContact CE1-CB 3.31Å; F452-A458 HydrophobicContact CG-CB 4.45Å; F452-A458 HydrophobicContact CZ-CB 4.33Å; H456-A458 PolarHBondContact O-N 2.97Å; H456-A458 VanDerWaalsContact O-N 3.12Å; A458-K460 PolarHBondContact O-N 2.66Å; A458-N548 CarbonylContact C-O 3.2Å; A458-N548 VanDerWaalsContact CA-O 3.26Å; A458-N548 WeakPolarHBondContact CA-O 3.4Å; A458-N548 HydrophobicContact CB-CB 3.99Å
459	E	71.3	Confident	75.2	Confident	47 Å²	47	47.7 Å²	47.7	22%	0.22	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	112.4	175.7	-161.5	174.6	103.3	0	0	109.2	V461 R519 K547 N548 V549 Q550	E459-V461 HydrophobicContact CG-CG2 4.32Å; E459-V461 PolarHBondContact O-N 3.29Å; E459-R519 IonicContact OE1-CZ 2.76Å; E459-R519 IonicContact OE1-NE 3.66Å; E459-R519 PolarHBondContact OE1-NE 2.91Å; E459-R519 IonicContact OE1-NH2 3.09Å; E459-R519 PolarHBondContact OE1-NH2 3.33Å; E459-R519 IonicContact OE2-CZ 3.13Å; E459-R519 IonicContact OE2-NE 2.77Å; E459-R519 PolarHBondContact OE2-NE 2.77Å; E459-R519 IonicContact OE2-NH2 3.44Å; E459-R519 PolarHBondContact OE2-NH2 2.75Å; E459-R519 VanDerWaalsContact OE2-NH2 3.09Å; E459-K547 WeakPolarHBondContact OE2-CD 3.35Å; E459-K547 IonicContact OE2-NZ 3.79Å; E459-K547 PolarHBondContact OE2-NZ 2.77Å; E459-N548 PolarHBondContact N-O 2.86Å; E459-V549 WeakPolarHBondContact O-CA 3.25Å; E459-Q550 PolarHBondContact O-N 3.24Å
460	K	73.6	Confident	75.7	Confident	86 Å²	86	49.1 Å²	49.1	37%	0.374	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	117.5	174.9	-69.9	171.8	-177.9	161	0	109.4	E453 A458 Q550 I552	E453-K460 WeakPolarHBondContact OE1-CE 3.42Å; E453-K460 IonicContact OE1-NZ 2.7Å; E453-K460 PolarHBondContact OE1-NZ 3.31Å; E453-K460 IonicContact OE2-NZ 2.66Å; E453-K460 PolarHBondContact OE2-NZ 2.86Å; A458-K460 PolarHBondContact O-N 2.66Å; K460-Q550 WeakPolarHBondContact CA-O 3.47Å; K460-Q550 HydrophobicContact CG-CB 4.36Å; K460-I552 HydrophobicContact CB-CD1 4.04Å; K460-I552 HydrophobicContact CD-CD1 4.21Å; K460-I552 HydrophobicContact CG-CD1 4.07Å
461	V	79.4	Confident	75.9	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.4	-178.6	177.4	0	0	0	0	109.1	E459 V515 M518 V549 Q550 L551 I552	E459-V461 HydrophobicContact CG-CG2 4.32Å; E459-V461 PolarHBondContact O-N 3.29Å; V461-V515 HydrophobicContact CG1-CG2 4.21Å; V461-V515 HydrophobicContact CG2-CG2 4.2Å; V461-M518 HydrophobicContact CG1-CB 4.45Å; V461-M518 HydrophobicContact CG1-CE 4.01Å; V461-M518 HydrophobicContact CG1-CG 4.4Å; V461-V549 HydrophobicContact CB-CG1 4.11Å; V461-V549 HydrophobicContact CG2-CG1 3.86Å; V461-Q550 PolarHBondContact N-O 2.75Å; V461-L551 HydrophobicContact CG1-CD1 4.42Å; V461-I552 PolarHBondContact O-N 3.12Å
462	P	81.5	Confident	75.7	Confident	27 Å²	27	54.2 Å²	54.2	18%	0.175	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	141.7	179.4	32.7	-35.3	0	0	0	110.8	P502 Y503 M518 V527 I552	P462-P502 HydrophobicContact CB-CG 4.24Å; P462-P502 HydrophobicContact CG-CG 4.14Å; P462-Y503 HydrophobicContact CG-CE2 4.49Å; P462-M518 HydrophobicContact CG-CE 4.16Å; P462-M518 HydrophobicContact CG-SD 4.43Å; P462-M518 WeakPolarHBondContact O-CE 3.39Å; P462-V527 HydrophobicContact CB-CG2 4.26Å; P462-V527 HydrophobicContact CG-CG2 3.98Å; P462-I552 WeakPolarHBondContact CA-O 3.43Å
463	A	85.3	Confident	75.4	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	160.6	173.7	0	0	0	0	0	110.8	L499 M514 L551 I552 V553 T554	A463-L499 HydrophobicContact CB-CB 4.46Å; A463-M514 HydrophobicContact CB-CE 3.66Å; A463-M514 HydrophobicContact CB-SD 3.82Å; A463-L551 HydrophobicContact CB-CD1 3.91Å; A463-I552 PolarHBondContact N-O 2.8Å; A463-V553 HydrophobicContact CB-CG1 4.36Å; A463-V553 HydrophobicContact CB-CG2 4.33Å; A463-V553 WeakPolarHBondContact O-CA 3.43Å; A463-T554 PolarHBondContact O-N 3.46Å
464	V	85.2	Confident	75.6	Confident	21 Å²	21	61.7 Å²	61.7	13%	0.127	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.1	-177.2	177.8	0	0	0	0	110.2	N466 S500 P502	V464-N466 WeakPolarHBondContact CG1-OD1 3.27Å; V464-S500 WeakPolarHBondContact CB-OG 3.18Å; V464-S500 PolarHBondContact N-O 3.48Å; V464-S500 PolarHBondContact O-N 3.02Å; V464-S500 PolarHBondContact O-OG 2.95Å; V464-S500 VanDerWaalsContact O-OG 3.12Å; V464-P502 HydrophobicContact CG2-CB 3.79Å
465	A	86.7	Confident	76	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	65.9	177.7	0	0	0	0	0	110.3	Y467 I468 M494 L499 V553 T554	A465-Y467 HydrophobicContact CB-CE1 4.24Å; A465-Y467 PolarHBondContact O-N 2.85Å; A465-I468 HydrophobicContact CB-CB 4.35Å; A465-I468 HydrophobicContact CB-CG1 3.97Å; A465-I468 PolarHBondContact O-N 2.9Å; A465-M494 HydrophobicContact CB-CE 3.82Å; A465-L499 HydrophobicContact CB-CD2 4.08Å; A465-V553 HydrophobicContact CB-CG1 3.69Å; A465-T554 PolarHBondContact N-O 2.97Å
466	N	83.8	Confident	77.1	Confident	98 Å²	98	52.1 Å²	52.1	52%	0.524	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	-11.4	-178	-69.1	-9.4	0	0	0	114.6	V464 Y556	V464-N466 WeakPolarHBondContact CG1-OD1 3.27Å; N466-Y556 WeakPolarHBondContact O-CB 3.49Å
467	Y	83.8	Confident	78.2	Confident	10 Å²	10	51.8 Å²	51.8	4%	0.039	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-2.8	172.9	61.6	-93.4	0	0	0	113.5	A465 C478 L479 Y480 M494 H497 G498	A465-Y467 HydrophobicContact CB-CE1 4.24Å; A465-Y467 PolarHBondContact O-N 2.85Å; Y467-C478 CarbonylContact O-C 3.59Å; Y467-C478 WeakPolarHBondContact O-CA 3.15Å; Y467-L479 WeakPolarHBondContact O-CB 3.39Å; Y467-L479 WeakPolarHBondContact O-CG 3.49Å; Y467-L479 PolarHBondContact O-N 3.39Å; Y467-Y480 AromaticContact CD1-CD2 3.79Å; Y467-Y480 HydrophobicContact CD1-CD2 3.79Å; Y467-Y480 AromaticContact CD1-CE2 3.37Å; Y467-Y480 HydrophobicContact CD1-CE2 3.37Å; Y467-Y480 AromaticContact CD1-CZ 3.9Å; Y467-Y480 AromaticContact CD2-CD2 3.97Å; Y467-Y480 HydrophobicContact CD2-CD2 3.97Å; Y467-Y480 HydrophobicContact CD2-CE2 4.41Å; Y467-Y480 HydrophobicContact CD2-CG 4.37Å; Y467-Y480 HydrophobicContact CE1-CD2 4.49Å; Y467-Y480 HydrophobicContact CE1-CE2 4.14Å; Y467-Y480 HydrophobicContact CG-CD1 4.39Å; Y467-Y480 AromaticContact CG-CD2 3.5Å; Y467-Y480 HydrophobicContact CG-CD2 3.5Å; Y467-Y480 VanDerWaalsContact CG-CD2 3.5Å; Y467-Y480 HydrophobicContact CG-CE1 4.42Å; Y467-Y480 AromaticContact CG-CE2 3.54Å; Y467-Y480 HydrophobicContact CG-CE2 3.54Å; Y467-Y480 AromaticContact CG-CG 3.96Å; Y467-Y480 HydrophobicContact CG-CG 3.96Å; Y467-M494 HydrophobicContact CE2-CG 4.43Å; Y467-M494 WeakPolarHBondContact OH-CA 3.27Å; Y467-M494 PolarHBondContact OH-O 3.42Å; Y467-H497 HydrophobicContact CD2-CB 4.33Å; Y467-H497 HydrophobicContact CE1-CB 4.26Å; Y467-H497 HydrophobicContact CE2-CB 3.66Å; Y467-G498 WeakPolarHBondContact CE1-O 3.22Å; Y467-G498 PolarHBondContact OH-O 2.8Å
468	I	87.3	Confident	79.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.4	172.1	-60.4	-59.9	0	0	0	108.7	A465 C478 L485 L490 M494 T555 Y556	A465-I468 HydrophobicContact CB-CB 4.35Å; A465-I468 HydrophobicContact CB-CG1 3.97Å; A465-I468 PolarHBondContact O-N 2.9Å; I468-C478 HydrophobicContact CD1-CB 3.8Å; I468-L485 HydrophobicContact CD1-CD1 4.24Å; I468-L490 HydrophobicContact CD1-CD1 4.13Å; I468-L490 HydrophobicContact CG2-CD1 4.15Å; I468-M494 HydrophobicContact CD1-CG 3.81Å; I468-M494 HydrophobicContact CD1-SD 4.49Å; I468-M494 HydrophobicContact CG1-CE 4.44Å; I468-M494 HydrophobicContact CG1-CG 3.64Å; I468-M494 HydrophobicContact CG1-SD 4.05Å; I468-T555 HydrophobicContact CB-CG2 3.95Å; I468-T555 HydrophobicContact CG2-CG2 3.71Å; I468-T555 WeakPolarHBondContact O-CB 3.34Å; I468-Y556 WeakPolarHBondContact O-CB 2.86Å; I468-Y556 PolarHBondContact O-N 3.36Å
469	M	84.4	Confident	80.6	Confident	15 Å²	15	46.2 Å²	46.2	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.5	170.4	-177.4	174.6	65.8	0	0	109.2	I471 S476 K477 L479 Y556 M558	M469-I471 HydrophobicContact CE-CD1 4.01Å; M469-I471 HydrophobicContact CE-CG1 4.15Å; M469-I471 PolarHBondContact O-N 3.44Å; M469-S476 CarbonylContact O-C 3.59Å; M469-S476 WeakPolarHBondContact O-CA 3.46Å; M469-K477 HydrophobicContact CE-CD 4.19Å; M469-K477 PolarHBondContact N-O 3.09Å; M469-K477 PolarHBondContact O-N 3.3Å; M469-L479 HydrophobicContact CB-CD2 4.43Å; M469-L479 HydrophobicContact CE-CD2 4.41Å; M469-Y556 HydrophobicContact CB-CD1 4.49Å; M469-Y556 HydrophobicContact CG-CD1 4.32Å; M469-M558 HydrophobicContact SD-CG 4.25Å; M469-M558 HydrophobicContact SD-SD 3.93Å
470	K	81.3	Confident	81.2	Confident	75 Å²	75	51.6 Å²	51.6	33%	0.326	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	121.5	176.7	-169.2	178.2	-176.3	-178	0	109	S533 L535	K470-S533 PolarHBondContact NZ-O 2.92Å; K470-L535 HydrophobicContact CD-CD2 4.4Å
471	I	77.6	Confident	81.8	Confident	84 Å²	84	50 Å²	50	43%	0.431	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-39.5	-177.1	-65.3	-177.8	0	0	0	111.2	M469 T475 K477 Y484	M469-I471 HydrophobicContact CE-CD1 4.01Å; M469-I471 HydrophobicContact CE-CG1 4.15Å; M469-I471 PolarHBondContact O-N 3.44Å; I471-T475 PolarHBondContact N-O 3.34Å; I471-T475 VanDerWaalsContact N-O 3.16Å; I471-K477 HydrophobicContact CD1-CB 3.51Å; I471-K477 HydrophobicContact CD1-CD 4.26Å; I471-K477 HydrophobicContact CD1-CG 4.47Å; I471-K477 HydrophobicContact CG1-CB 4.29Å; I471-Y484 HydrophobicContact CD1-CD1 4.14Å; I471-Y484 HydrophobicContact CD1-CE1 3.63Å
472	H	73.8	Confident	82	Confident	104 Å²	104	55 Å²	55	48%	0.481	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	167	175.5	-173.6	-118.4	0	0	0	110.3	F474 T475	H472-F474 AromaticContact CE1-CD2 3.84Å; H472-F474 PolarHBondContact O-N 3.22Å; H472-T475 WeakPolarHBondContact CB-OG1 3.22Å; H472-T475 PolarHBondContact N-O 3.09Å; H472-T475 PolarHBondContact O-N 2.82Å; H472-T475 VanDerWaalsContact O-N 3.17Å; H472-T475 VanDerWaalsContact O-O 3.04Å
473	N	61.7	Low	82.1	Confident	117 Å²	117	59.2 Å²	59.2	63%	0.626	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.9	-180	-69.6	-59.5	0	0	0	114.6
474	F	73.8	Confident	82.1	Confident	136 Å²	136	65.1 Å²	65.1	60%	0.596	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	-2.5	-179.8	-56.9	-73.3	0	0	0	114.3	H472 P486 S487	H472-F474 AromaticContact CE1-CD2 3.84Å; H472-F474 PolarHBondContact O-N 3.22Å; F474-P486 WeakPolarHBondContact O-CA 3.5Å; F474-S487 WeakPolarHBondContact CA-OG 3.29Å; F474-S487 PolarHBondContact O-N 3.13Å; F474-S487 PolarHBondContact O-OG 2.58Å
475	T	77.8	Confident	82.2	Confident	52 Å²	52	64.1 Å²	64.1	32%	0.319	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	129.5	-178.9	59	0	0	0	0	112.6	I471 H472 L485	I471-T475 PolarHBondContact N-O 3.34Å; I471-T475 VanDerWaalsContact N-O 3.16Å; H472-T475 WeakPolarHBondContact CB-OG1 3.22Å; H472-T475 PolarHBondContact N-O 3.09Å; H472-T475 PolarHBondContact O-N 2.82Å; H472-T475 VanDerWaalsContact O-N 3.17Å; H472-T475 VanDerWaalsContact O-O 3.04Å; T475-L485 WeakPolarHBondContact CA-O 3.25Å
476	S	85.4	Confident	82	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	154.2	171.6	-60.9	0	0	0	0	110.2	M469 L485 L490	M469-S476 CarbonylContact O-C 3.59Å; M469-S476 WeakPolarHBondContact O-CA 3.46Å; S476-L485 PolarHBondContact N-O 3.16Å; S476-L485 WeakPolarHBondContact O-CB 3.5Å; S476-L485 PolarHBondContact O-N 2.88Å; S476-L490 WeakPolarHBondContact OG-CD2 3.33Å
477	K	85.5	Confident	81.6	Confident	22 Å²	22	64.3 Å²	64.3	10%	0.096	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.2	176.2	-180	-174.9	178.4	-169.9	0	109.5	M469 I471 L479 N482 R483 Y484	M469-K477 HydrophobicContact CE-CD 4.19Å; M469-K477 PolarHBondContact N-O 3.09Å; M469-K477 PolarHBondContact O-N 3.3Å; I471-K477 HydrophobicContact CD1-CB 3.51Å; I471-K477 HydrophobicContact CD1-CD 4.26Å; I471-K477 HydrophobicContact CD1-CG 4.47Å; I471-K477 HydrophobicContact CG1-CB 4.29Å; K477-L479 HydrophobicContact CD-CD2 4.43Å; K477-N482 WeakPolarHBondContact CE-OD1 3.21Å; K477-N482 PolarHBondContact NZ-OD1 3.12Å; K477-R483 WeakPolarHBondContact CA-O 3.35Å; K477-Y484 HydrophobicContact CB-CD1 4.25Å; K477-Y484 HydrophobicContact CB-CE1 4.34Å; K477-Y484 HydrophobicContact CD-CE1 4.34Å
478	C	88	Confident	81.3	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.9	163.5	176	0	0	0	0	109.4	Y467 I468 N482 R483 L485 H493	Y467-C478 CarbonylContact O-C 3.59Å; Y467-C478 WeakPolarHBondContact O-CA 3.15Å; I468-C478 HydrophobicContact CD1-CB 3.8Å; C478-N482 CarbonylContact O-C 3.54Å; C478-N482 WeakPolarHBondContact O-CA 3.5Å; C478-N482 PolarHBondContact O-N 3.45Å; C478-R483 PolarHBondContact N-O 3.47Å; C478-R483 PolarHBondContact O-N 3.29Å; C478-R483 VanDerWaalsContact O-N 3.08Å; C478-L485 HydrophobicContact CB-CD1 3.82Å; C478-H493 WeakPolarHBondContact CB-NE2 3.38Å; C478-H493 PolarHBondContact SG-NE2 2.39Å
479	L	85.3	Confident	81.1	Confident	73 Å²	73	70.9 Å²	70.9	38%	0.382	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-45.6	176.6	-58	178.7	0	0	0	110.3	Y467 M469 K477 C481 N482	Y467-L479 WeakPolarHBondContact O-CB 3.39Å; Y467-L479 WeakPolarHBondContact O-CG 3.49Å; Y467-L479 PolarHBondContact O-N 3.39Å; M469-L479 HydrophobicContact CB-CD2 4.43Å; M469-L479 HydrophobicContact CE-CD2 4.41Å; K477-L479 HydrophobicContact CD-CD2 4.43Å; L479-C481 PolarHBondContact O-N 3.45Å; L479-C481 VanDerWaalsContact O-N 3.11Å; L479-N482 PolarHBondContact O-N 2.79Å; L479-N482 VanDerWaalsContact O-N 3.09Å
480	Y	85.1	Confident	81.2	Confident	159 Å²	159	70.2 Å²	70.2	62%	0.624	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.2	-178.8	-70.4	-10.3	0	0	0	115.3	Y467 H497	Y467-Y480 AromaticContact CD1-CD2 3.79Å; Y467-Y480 HydrophobicContact CD1-CD2 3.79Å; Y467-Y480 AromaticContact CD1-CE2 3.37Å; Y467-Y480 HydrophobicContact CD1-CE2 3.37Å; Y467-Y480 AromaticContact CD1-CZ 3.9Å; Y467-Y480 AromaticContact CD2-CD2 3.97Å; Y467-Y480 HydrophobicContact CD2-CD2 3.97Å; Y467-Y480 HydrophobicContact CD2-CE2 4.41Å; Y467-Y480 HydrophobicContact CD2-CG 4.37Å; Y467-Y480 HydrophobicContact CE1-CD2 4.49Å; Y467-Y480 HydrophobicContact CE1-CE2 4.14Å; Y467-Y480 HydrophobicContact CG-CD1 4.39Å; Y467-Y480 AromaticContact CG-CD2 3.5Å; Y467-Y480 HydrophobicContact CG-CD2 3.5Å; Y467-Y480 VanDerWaalsContact CG-CD2 3.5Å; Y467-Y480 HydrophobicContact CG-CE1 4.42Å; Y467-Y480 AromaticContact CG-CE2 3.54Å; Y467-Y480 HydrophobicContact CG-CE2 3.54Å; Y467-Y480 AromaticContact CG-CG 3.96Å; Y467-Y480 HydrophobicContact CG-CG 3.96Å; Y480-H497 HydrophobicContact CD2-CB 4.17Å; Y480-H497 AromaticContact CD2-ND1 3.91Å
481	C	84.8	Confident	81.3	Confident	54 Å²	54	67.4 Å²	67.4	37%	0.365	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	13.3	173.2	69.5	0	0	0	0	113.7	L479 R483 H493	L479-C481 PolarHBondContact O-N 3.45Å; L479-C481 VanDerWaalsContact O-N 3.11Å; C481-R483 PolarHBondContact O-N 3.39Å; C481-R483 WeakPolarHBondContact SG-CB 3.12Å; C481-H493 PolarHBondContact SG-CE1 2.89Å; C481-H493 PolarHBondContact SG-NE2 3.07Å; C481-H493 VanDerWaalsContact SG-NE2 3.41Å
482	N	83.8	Confident	81.6	Confident	107 Å²	107	68.2 Å²	68.2	57%	0.572	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	21.4	179.7	-154	6.3	0	0	0	115.2	K477 C478 L479	K477-N482 WeakPolarHBondContact CE-OD1 3.21Å; K477-N482 PolarHBondContact NZ-OD1 3.12Å; C478-N482 CarbonylContact O-C 3.54Å; C478-N482 WeakPolarHBondContact O-CA 3.5Å; C478-N482 PolarHBondContact O-N 3.45Å; L479-N482 PolarHBondContact O-N 2.79Å; L479-N482 VanDerWaalsContact O-N 3.09Å
483	R	83.9	Confident	82.1	Confident	114 Å²	114	63.7 Å²	63.7	43%	0.43	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136.7	-165.7	-166.3	174.6	-173.5	-106.1	-1.2	113	K477 C478 C481 L485	K477-R483 WeakPolarHBondContact CA-O 3.35Å; C478-R483 PolarHBondContact N-O 3.47Å; C478-R483 PolarHBondContact O-N 3.29Å; C478-R483 VanDerWaalsContact O-N 3.08Å; C481-R483 PolarHBondContact O-N 3.39Å; C481-R483 WeakPolarHBondContact SG-CB 3.12Å; R483-L485 HydrophobicContact CG-CD2 4.42Å
484	Y	85.9	Confident	83.2	Confident	124 Å²	124	58.1 Å²	58.1	49%	0.486	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	140.3	170.4	-60.9	-91.9	0	0	0	111.4	I471 K477	I471-Y484 HydrophobicContact CD1-CD1 4.14Å; I471-Y484 HydrophobicContact CD1-CE1 3.63Å; K477-Y484 HydrophobicContact CB-CD1 4.25Å; K477-Y484 HydrophobicContact CB-CE1 4.34Å; K477-Y484 HydrophobicContact CD-CE1 4.34Å
485	L	86.6	Confident	83.9	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	119.4	-166.6	-58.4	160.2	0	0	0	110.2	I468 T475 S476 C478 R483 L490 H493	I468-L485 HydrophobicContact CD1-CD1 4.24Å; T475-L485 WeakPolarHBondContact CA-O 3.25Å; S476-L485 PolarHBondContact N-O 3.16Å; S476-L485 WeakPolarHBondContact O-CB 3.5Å; S476-L485 PolarHBondContact O-N 2.88Å; C478-L485 HydrophobicContact CB-CD1 3.82Å; R483-L485 HydrophobicContact CG-CD2 4.42Å; L485-L490 HydrophobicContact CB-CD1 4.06Å; L485-L490 HydrophobicContact CD1-CD1 3.68Å; L485-H493 HydrophobicContact CD1-CB 4.18Å; L485-H493 WeakPolarHBondContact CD1-CD2 3.47Å; L485-H493 HydrophobicContact CD2-CB 3.9Å
486	P	82.2	Confident	84.4	Confident	64 Å²	64	54.9 Å²	54.9	42%	0.416	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	144.2	163.5	-22.8	34	0	0	0	111.3	F474 D488 T489 L490	F474-P486 WeakPolarHBondContact O-CA 3.5Å; P486-D488 PolarHBondContact O-N 3.17Å; P486-D488 VanDerWaalsContact O-N 3.14Å; P486-T489 WeakPolarHBondContact CD-OG1 3.49Å; P486-T489 PolarHBondContact O-N 3.23Å; P486-T489 PolarHBondContact O-OG1 2.91Å; P486-L490 PolarHBondContact O-N 3.38Å
487	S	76.2	Confident	84.3	Confident	38 Å²	38	57.5 Å²	57.5	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-47.5	-42.9	-179.7	-61.2	0	0	0	0	113.6	F474 T489 L490	F474-S487 WeakPolarHBondContact CA-OG 3.29Å; F474-S487 PolarHBondContact O-N 3.13Å; F474-S487 PolarHBondContact O-OG 2.58Å; S487-T489 PolarHBondContact O-N 3.14Å; S487-T489 VanDerWaalsContact O-N 3.11Å; S487-L490 WeakPolarHBondContact O-CB 3.37Å; S487-L490 PolarHBondContact O-N 3.39Å
488	D	76.4	Confident	84.4	Confident	89 Å²	89	56.5 Å²	56.5	48%	0.476	28%	0.283	S	S	.	.	H	α-helix	trans	-57.2	-28.4	179.6	-35.7	-16.1	0	0	0	113	A409 P486	A409-D488 HydrophobicContact CB-CB 3.7Å; P486-D488 PolarHBondContact O-N 3.17Å; P486-D488 VanDerWaalsContact O-N 3.14Å
489	T	83.8	Confident	84.4	Confident	58 Å²	58	56.5 Å²	56.5	36%	0.356	28%	0.283	S	S	.	.	H	α-helix	trans	-101.1	-8.7	-179.6	68.6	0	0	0	0	113.4	P486 S487 N492 H493	P486-T489 WeakPolarHBondContact CD-OG1 3.49Å; P486-T489 PolarHBondContact O-N 3.23Å; P486-T489 PolarHBondContact O-OG1 2.91Å; S487-T489 PolarHBondContact O-N 3.14Å; S487-T489 VanDerWaalsContact O-N 3.11Å; T489-N492 PolarHBondContact O-N 3.33Å; T489-H493 WeakPolarHBondContact O-CB 3.32Å; T489-H493 PolarHBondContact O-N 3.3Å
490	L	85.5	Confident	84.4	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-69.2	-50.3	-164.4	-174.3	46.9	0	0	0	112	I468 S476 L485 P486 S487 N492 H493 M494 L535 F537	I468-L490 HydrophobicContact CD1-CD1 4.13Å; I468-L490 HydrophobicContact CG2-CD1 4.15Å; S476-L490 WeakPolarHBondContact OG-CD2 3.33Å; L485-L490 HydrophobicContact CB-CD1 4.06Å; L485-L490 HydrophobicContact CD1-CD1 3.68Å; P486-L490 PolarHBondContact O-N 3.38Å; S487-L490 WeakPolarHBondContact O-CB 3.37Å; S487-L490 PolarHBondContact O-N 3.39Å; L490-N492 PolarHBondContact O-N 3.02Å; L490-H493 WeakPolarHBondContact O-CB 3.24Å; L490-H493 PolarHBondContact O-N 3.45Å; L490-H493 VanDerWaalsContact O-N 3.07Å; L490-M494 HydrophobicContact CD1-CG 4.35Å; L490-M494 HydrophobicContact CD1-SD 3.68Å; L490-M494 HydrophobicContact CG-SD 3.61Å; L490-M494 VanDerWaalsContact O-CG 3.32Å; L490-M494 WeakPolarHBondContact O-CG 3.48Å; L490-M494 PolarHBondContact O-N 3.42Å; L490-M494 VanDerWaalsContact O-SD 3.35Å; L490-L535 HydrophobicContact CD2-CD1 3.55Å; L490-L535 HydrophobicContact CG-CD1 4.21Å; L490-F537 HydrophobicContact CB-CZ 4.49Å; L490-F537 HydrophobicContact CG-CZ 4.43Å
491	L	85.1	Confident	84.5	Confident	16 Å²	16	46.7 Å²	46.7	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-46.3	174.8	178.7	62.8	0	0	0	112.1	H493 M494 L495 L499 F537 L539 L551	L491-H493 PolarHBondContact O-N 2.96Å; L491-M494 PolarHBondContact O-N 2.8Å; L491-M494 VanDerWaalsContact O-N 3.16Å; L491-L495 HydrophobicContact CD1-CD1 4.28Å; L491-L495 HydrophobicContact CD1-CG 4.37Å; L491-L495 HydrophobicContact CG-CD1 4.17Å; L491-L495 WeakPolarHBondContact O-CG 3.49Å; L491-L495 PolarHBondContact O-N 2.41Å; L491-L499 HydrophobicContact CD1-CD1 4.34Å; L491-F537 HydrophobicContact CB-CD1 3.9Å; L491-F537 HydrophobicContact CB-CD2 4.46Å; L491-F537 HydrophobicContact CB-CE1 3.77Å; L491-F537 HydrophobicContact CB-CE2 4.35Å; L491-F537 HydrophobicContact CB-CG 4.24Å; L491-F537 HydrophobicContact CB-CZ 4Å; L491-F537 HydrophobicContact CD1-CD2 4.2Å; L491-F537 HydrophobicContact CD1-CE2 4.44Å; L491-F537 HydrophobicContact CD1-CG 4.42Å; L491-F537 HydrophobicContact CD2-CB 4.03Å; L491-F537 HydrophobicContact CD2-CD1 4.21Å; L491-F537 HydrophobicContact CD2-CG 4.06Å; L491-F537 HydrophobicContact CG-CG 4.48Å; L491-L539 HydrophobicContact CD2-CD1 4.08Å; L491-L539 HydrophobicContact CD2-CD2 3.9Å; L491-L539 HydrophobicContact CD2-CG 4.46Å; L491-L551 HydrophobicContact CD1-CD2 3.6Å
492	N	82.6	Confident	84.5	Confident	101 Å²	101	46.3 Å²	46.3	54%	0.54	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-27.5	176.8	-75.4	-68.6	0	0	0	112.8	T489 L490 I496	T489-N492 PolarHBondContact O-N 3.33Å; L490-N492 PolarHBondContact O-N 3.02Å; N492-I496 WeakPolarHBondContact O-CD1 3.35Å; N492-I496 WeakPolarHBondContact O-CG1 3.46Å
493	H	83.9	Confident	84.2	Confident	9 Å²	9	44.1 Å²	44.1	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-83.9	-37.5	175.2	179.1	73	0	0	0	112.7	C478 C481 L485 T489 L490 L491 L495 I496 H497	C478-H493 WeakPolarHBondContact CB-NE2 3.38Å; C478-H493 PolarHBondContact SG-NE2 2.39Å; C481-H493 PolarHBondContact SG-CE1 2.89Å; C481-H493 PolarHBondContact SG-NE2 3.07Å; C481-H493 VanDerWaalsContact SG-NE2 3.41Å; L485-H493 HydrophobicContact CD1-CB 4.18Å; L485-H493 WeakPolarHBondContact CD1-CD2 3.47Å; L485-H493 HydrophobicContact CD2-CB 3.9Å; T489-H493 WeakPolarHBondContact O-CB 3.32Å; T489-H493 PolarHBondContact O-N 3.3Å; L490-H493 WeakPolarHBondContact O-CB 3.24Å; L490-H493 PolarHBondContact O-N 3.45Å; L490-H493 VanDerWaalsContact O-N 3.07Å; L491-H493 PolarHBondContact O-N 2.96Å; H493-L495 VanDerWaalsContact C-N 3.28Å; H493-L495 PolarHBondContact O-N 3.02Å; H493-I496 WeakPolarHBondContact O-CB 3.43Å; H493-I496 PolarHBondContact O-N 3.05Å; H493-H497 AromaticContact CD2-CD2 3.95Å; H493-H497 AromaticContact CE1-CD2 3.37Å; H493-H497 PolarHBondContact CE1-CD2 3.3Å; H493-H497 AromaticContact CE1-NE2 3.19Å; H493-H497 PolarHBondContact CE1-NE2 3.01Å; H493-H497 AromaticContact NE2-CD2 3.21Å; H493-H497 PolarHBondContact NE2-CD2 3.14Å; H493-H497 AromaticContact NE2-NE2 3.33Å; H493-H497 PolarHBondContact NE2-NE2 3.02Å; H493-H497 PolarHBondContact O-N 3.18Å
494	M	86.1	Confident	84.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-36.5	175.8	-70.2	150.2	71.4	0	0	111.4	A465 Y467 I468 L490 L491 I496 H497 G498 L499 F537 V553	A465-M494 HydrophobicContact CB-CE 3.82Å; Y467-M494 HydrophobicContact CE2-CG 4.43Å; Y467-M494 WeakPolarHBondContact OH-CA 3.27Å; Y467-M494 PolarHBondContact OH-O 3.42Å; I468-M494 HydrophobicContact CD1-CG 3.81Å; I468-M494 HydrophobicContact CD1-SD 4.49Å; I468-M494 HydrophobicContact CG1-CE 4.44Å; I468-M494 HydrophobicContact CG1-CG 3.64Å; I468-M494 HydrophobicContact CG1-SD 4.05Å; L490-M494 HydrophobicContact CD1-CG 4.35Å; L490-M494 HydrophobicContact CD1-SD 3.68Å; L490-M494 HydrophobicContact CG-SD 3.61Å; L490-M494 VanDerWaalsContact O-CG 3.32Å; L490-M494 WeakPolarHBondContact O-CG 3.48Å; L490-M494 PolarHBondContact O-N 3.42Å; L490-M494 VanDerWaalsContact O-SD 3.35Å; L491-M494 PolarHBondContact O-N 2.8Å; L491-M494 VanDerWaalsContact O-N 3.16Å; M494-I496 PolarHBondContact O-N 3Å; M494-H497 PolarHBondContact O-N 3.14Å; M494-G498 CarbonylContact O-C 3.58Å; M494-G498 WeakPolarHBondContact O-CA 3.16Å; M494-G498 PolarHBondContact O-N 2.68Å; M494-L499 HydrophobicContact CB-CD2 3.8Å; M494-L499 HydrophobicContact CB-CG 4.4Å; M494-L499 HydrophobicContact CE-CD2 3.87Å; M494-F537 HydrophobicContact CE-CE2 4.3Å; M494-V553 HydrophobicContact CE-CB 3.85Å; M494-V553 HydrophobicContact CE-CG1 3.48Å; M494-V553 VanDerWaalsContact CE-CG1 3.48Å; M494-V553 HydrophobicContact CE-CG2 3.94Å
495	L	88.1	Confident	84.1	Confident	35 Å²	35	45.6 Å²	45.6	18%	0.183	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-11.5	172.6	-64.5	168.8	0	0	0	114.3	L491 H493 L499 N509 V511	L491-L495 HydrophobicContact CD1-CD1 4.28Å; L491-L495 HydrophobicContact CD1-CG 4.37Å; L491-L495 HydrophobicContact CG-CD1 4.17Å; L491-L495 WeakPolarHBondContact O-CG 3.49Å; L491-L495 PolarHBondContact O-N 2.41Å; H493-L495 VanDerWaalsContact C-N 3.28Å; H493-L495 PolarHBondContact O-N 3.02Å; L495-L499 HydrophobicContact CD2-CD1 3.79Å; L495-L499 HydrophobicContact CD2-CG 4.33Å; L495-L499 HydrophobicContact CG-CD1 4.5Å; L495-N509 WeakPolarHBondContact O-CA 3.2Å; L495-N509 WeakPolarHBondContact O-CB 3.46Å; L495-V511 HydrophobicContact CD1-CG2 3.84Å; L495-V511 HydrophobicContact CD2-CG2 3.74Å; L495-V511 HydrophobicContact CG-CG2 4.38Å
496	I	87.4	Confident	83.9	Confident	85 Å²	85	47.5 Å²	47.5	44%	0.436	25%	0.254	S	S	.	.	H	α-helix	trans	-84.4	-30.1	171.8	-66.9	168.1	0	0	0	111.5	N492 H493 M494	N492-I496 WeakPolarHBondContact O-CD1 3.35Å; N492-I496 WeakPolarHBondContact O-CG1 3.46Å; H493-I496 WeakPolarHBondContact O-CB 3.43Å; H493-I496 PolarHBondContact O-N 3.05Å; M494-I496 PolarHBondContact O-N 3Å
497	H	83.3	Confident	84.2	Confident	58 Å²	58	49 Å²	49	27%	0.269	26%	0.262	S	S	.	.	H	α-helix	trans	-97.2	-11.8	176.8	-72.9	-71.4	0	0	0	113.8	Y467 Y480 H493 M494	Y467-H497 HydrophobicContact CD2-CB 4.33Å; Y467-H497 HydrophobicContact CE1-CB 4.26Å; Y467-H497 HydrophobicContact CE2-CB 3.66Å; Y480-H497 HydrophobicContact CD2-CB 4.17Å; Y480-H497 AromaticContact CD2-ND1 3.91Å; H493-H497 AromaticContact CD2-CD2 3.95Å; H493-H497 AromaticContact CE1-CD2 3.37Å; H493-H497 PolarHBondContact CE1-CD2 3.3Å; H493-H497 AromaticContact CE1-NE2 3.19Å; H493-H497 PolarHBondContact CE1-NE2 3.01Å; H493-H497 AromaticContact NE2-CD2 3.21Å; H493-H497 PolarHBondContact NE2-CD2 3.14Å; H493-H497 AromaticContact NE2-NE2 3.33Å; H493-H497 PolarHBondContact NE2-NE2 3.02Å; H493-H497 PolarHBondContact O-N 3.18Å; M494-H497 PolarHBondContact O-N 3.14Å
498	G	87.4	Confident	84.7	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.01	26%	0.257	C	S	.	.			trans	90.4	140.5	-176.2	0	0	0	0	0	112.4	Y467 M494 F508 N509	Y467-G498 WeakPolarHBondContact CE1-O 3.22Å; Y467-G498 PolarHBondContact OH-O 2.8Å; M494-G498 CarbonylContact O-C 3.58Å; M494-G498 WeakPolarHBondContact O-CA 3.16Å; M494-G498 PolarHBondContact O-N 2.68Å; G498-F508 WeakPolarHBondContact CA-O 3.25Å; G498-N509 WeakPolarHBondContact CA-OD1 3.3Å; G498-N509 PolarHBondContact N-OD1 3.11Å
499	L	88.6	Confident	85.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.6	167.4	-68.6	172.3	0	0	0	108.4	A463 A465 L491 M494 L495 T507 F508 M514 L551 V553	A463-L499 HydrophobicContact CB-CB 4.46Å; A465-L499 HydrophobicContact CB-CD2 4.08Å; L491-L499 HydrophobicContact CD1-CD1 4.34Å; M494-L499 HydrophobicContact CB-CD2 3.8Å; M494-L499 HydrophobicContact CB-CG 4.4Å; M494-L499 HydrophobicContact CE-CD2 3.87Å; L495-L499 HydrophobicContact CD2-CD1 3.79Å; L495-L499 HydrophobicContact CD2-CG 4.33Å; L495-L499 HydrophobicContact CG-CD1 4.5Å; L499-T507 CarbonylContact O-C 3.58Å; L499-T507 WeakPolarHBondContact O-CA 3.39Å; L499-F508 PolarHBondContact N-O 3.15Å; L499-F508 PolarHBondContact O-N 2.77Å; L499-M514 HydrophobicContact CB-CE 3.89Å; L499-M514 HydrophobicContact CB-SD 3.56Å; L499-M514 VanDerWaalsContact CB-SD 3.56Å; L499-M514 HydrophobicContact CD1-CE 3.6Å; L499-M514 HydrophobicContact CD1-SD 4.43Å; L499-M514 HydrophobicContact CG-CE 4.39Å; L499-L551 HydrophobicContact CD1-CD2 3.95Å; L499-V553 HydrophobicContact CD2-CG1 4.01Å
500	S	86.6	Confident	85.4	Confident	24 Å²	24	49.1 Å²	49.1	17%	0.168	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139	177.2	49.6	0	0	0	0	111.5	V464 A506	V464-S500 WeakPolarHBondContact CB-OG 3.18Å; V464-S500 PolarHBondContact N-O 3.48Å; V464-S500 PolarHBondContact O-N 3.02Å; V464-S500 PolarHBondContact O-OG 2.95Å; V464-S500 VanDerWaalsContact O-OG 3.12Å; S500-A506 CarbonylContact C-O 3.51Å; S500-A506 WeakPolarHBondContact CA-O 3.46Å
501	C	87	Confident	85.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-63.4	133.6	166.2	176.9	0	0	0	0	109.3	Y503 R505 A506 F508 H517	C501-Y503 VanDerWaalsContact C-N 3.25Å; C501-Y503 PolarHBondContact O-N 2.98Å; C501-R505 VanDerWaalsContact O-CA 3.22Å; C501-R505 WeakPolarHBondContact O-CA 3.49Å; C501-R505 PolarHBondContact O-N 3.43Å; C501-R505 VanDerWaalsContact O-N 3.08Å; C501-A506 PolarHBondContact N-O 2.9Å; C501-F508 HydrophobicContact CB-CE2 4.12Å; C501-H517 PolarHBondContact SG-NE2 2.83Å
502	P	83.4	Confident	85.4	Confident	46 Å²	46	52 Å²	52	30%	0.299	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-34.9	178.4	23.1	-32.7	0	0	0	112.9	P462 V464	P462-P502 HydrophobicContact CB-CG 4.24Å; P462-P502 HydrophobicContact CG-CG 4.14Å; V464-P502 HydrophobicContact CG2-CB 3.79Å
503	Y	78.9	Confident	85.4	Confident	62 Å²	62	53.4 Å²	53.4	24%	0.243	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-47.8	-167	-49.7	-52.4	0	0	0	113.4	P462 C501 M518 H522 E525 V527	P462-Y503 HydrophobicContact CG-CE2 4.49Å; C501-Y503 VanDerWaalsContact C-N 3.25Å; C501-Y503 PolarHBondContact O-N 2.98Å; Y503-M518 HydrophobicContact CD2-SD 3.92Å; Y503-M518 HydrophobicContact CE2-SD 3.7Å; Y503-H522 HydrophobicContact CD2-CB 3.65Å; Y503-H522 AromaticContact CD2-CD2 3.86Å; Y503-H522 AromaticContact CD2-CG 3.48Å; Y503-H522 VanDerWaalsContact CD2-CG 3.48Å; Y503-H522 AromaticContact CD2-ND1 3.83Å; Y503-H522 HydrophobicContact CE2-CB 3.99Å; Y503-E525 WeakPolarHBondContact CD1-OE2 3.38Å; Y503-E525 HydrophobicContact CE1-CG 4.08Å; Y503-E525 WeakPolarHBondContact CE1-OE1 3.45Å; Y503-E525 VanDerWaalsContact CE1-OE2 3.26Å; Y503-E525 WeakPolarHBondContact CE1-OE2 3.27Å; Y503-E525 HydrophobicContact CE2-CB 4.36Å; Y503-E525 PolarHBondContact OH-O 3.17Å; Y503-V527 WeakPolarHBondContact OH-CG2 3.31Å
504	C	83.8	Confident	85.4	Confident	60 Å²	60	53 Å²	53	41%	0.405	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	0.5	-178.8	70.4	0	0	0	0	114.5	A506 H517	C504-A506 PolarHBondContact O-N 3.09Å; C504-A506 VanDerWaalsContact SG-CB 3.57Å; C504-H517 PolarHBondContact SG-CE1 2.97Å; C504-H517 PolarHBondContact SG-NE2 3.1Å
505	R	82.6	Confident	85.3	Confident	208 Å²	208	53 Å²	53	79%	0.785	27%	0.27	S	S	*	.			trans	59.3	1.9	-177	-64.6	177	169.3	150.3	-4.5	116.6	C501	C501-R505 VanDerWaalsContact O-CA 3.22Å; C501-R505 WeakPolarHBondContact O-CA 3.49Å; C501-R505 PolarHBondContact O-N 3.43Å; C501-R505 VanDerWaalsContact O-N 3.08Å
506	A	82.8	Confident	85.2	Confident	41 Å²	41	53.3 Å²	53.3	34%	0.339	28%	0.277	S	S	.	.			trans	-57.4	141.1	175	0	0	0	0	0	112	S500 C501 C504 F508	S500-A506 CarbonylContact C-O 3.51Å; S500-A506 WeakPolarHBondContact CA-O 3.46Å; C501-A506 PolarHBondContact N-O 2.9Å; C504-A506 PolarHBondContact O-N 3.09Å; C504-A506 VanDerWaalsContact SG-CB 3.57Å; A506-F508 HydrophobicContact CB-CE2 3.76Å; A506-F508 HydrophobicContact CB-CZ 3.89Å; A506-F508 WeakPolarHBondContact O-CD2 3.49Å; A506-F508 VanDerWaalsContact O-CE2 3.23Å; A506-F508 WeakPolarHBondContact O-CE2 3.26Å
507	T	87.7	Confident	85.1	Confident	97 Å²	97	50.6 Å²	50.6	60%	0.595	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.3	-171.4	48.9	0	0	0	0	113.1	L499	L499-T507 CarbonylContact O-C 3.58Å; L499-T507 WeakPolarHBondContact O-CA 3.39Å
508	F	87.9	Confident	85	Confident	35 Å²	35	48.6 Å²	48.6	15%	0.154	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.1	-173.2	-60.4	-85.4	0	0	0	111.3	G498 L499 C501 A506 D510 K513 M514 H517	G498-F508 WeakPolarHBondContact CA-O 3.25Å; L499-F508 PolarHBondContact N-O 3.15Å; L499-F508 PolarHBondContact O-N 2.77Å; C501-F508 HydrophobicContact CB-CE2 4.12Å; A506-F508 HydrophobicContact CB-CE2 3.76Å; A506-F508 HydrophobicContact CB-CZ 3.89Å; A506-F508 WeakPolarHBondContact O-CD2 3.49Å; A506-F508 VanDerWaalsContact O-CE2 3.23Å; A506-F508 WeakPolarHBondContact O-CE2 3.26Å; F508-D510 PolarHBondContact O-N 3.23Å; F508-K513 HydrophobicContact CD1-CB 4.2Å; F508-M514 HydrophobicContact CB-CB 3.65Å; F508-M514 HydrophobicContact CB-CG 4.09Å; F508-M514 HydrophobicContact CB-SD 4.29Å; F508-M514 HydrophobicContact CD1-CB 4.32Å; F508-M514 HydrophobicContact CD2-CB 4.03Å; F508-M514 HydrophobicContact CD2-CG 3.7Å; F508-M514 HydrophobicContact CD2-SD 4.23Å; F508-M514 HydrophobicContact CE2-CG 4.42Å; F508-M514 HydrophobicContact CG-CB 3.72Å; F508-M514 HydrophobicContact CG-CG 3.94Å; F508-H517 HydrophobicContact CE1-CB 3.69Å; F508-H517 AromaticContact CE1-CG 3.99Å; F508-H517 HydrophobicContact CE2-CB 4.31Å; F508-H517 AromaticContact CE2-CD2 3.32Å; F508-H517 WeakPolarHBondContact CE2-CD2 3.47Å; F508-H517 AromaticContact CE2-CG 3.89Å; F508-H517 AromaticContact CE2-NE2 3.95Å; F508-H517 HydrophobicContact CZ-CB 3.52Å; F508-H517 AromaticContact CZ-CD2 3.22Å; F508-H517 WeakPolarHBondContact CZ-CD2 3.38Å; F508-H517 AromaticContact CZ-CG 3.27Å; F508-H517 AromaticContact CZ-NE2 3.94Å
509	N	88.2	Confident	84.8	Confident	104 Å²	104	53.1 Å²	53.1	56%	0.556	27%	0.27	S	S	*	.	S	Bend	trans	-87.4	17.2	176.2	-58	-61	0	0	0	112.6	L495 G498	L495-N509 WeakPolarHBondContact O-CA 3.2Å; L495-N509 WeakPolarHBondContact O-CB 3.46Å; G498-N509 WeakPolarHBondContact CA-OD1 3.3Å; G498-N509 PolarHBondContact N-OD1 3.11Å
510	D	87.2	Confident	84.4	Confident	47 Å²	47	60 Å²	60	25%	0.251	31%	0.306	S	S	.	.	S	Bend	trans	-159.2	124.3	-166.2	-176	-15.2	0	0	0	108.8	F508 E512 K513 M514	F508-D510 PolarHBondContact O-N 3.23Å; D510-E512 PolarHBondContact OD1-N 2.89Å; D510-K513 HydrophobicContact CB-CB 4.2Å; D510-K513 HydrophobicContact CB-CD 3.98Å; D510-K513 HydrophobicContact CB-CG 4.19Å; D510-K513 VanDerWaalsContact OD2-CD 3.31Å; D510-K513 WeakPolarHBondContact OD2-CD 3.3Å; D510-K513 WeakPolarHBondContact OD2-CE 3.43Å; D510-K513 IonicContact OD2-NZ 2.8Å; D510-K513 PolarHBondContact OD2-NZ 2.98Å; D510-M514 PolarHBondContact O-N 3.13Å
511	V	84.9	Confident	83.9	Confident	15 Å²	15	62 Å²	62	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-38.8	-177.8	-175.5	0	0	0	0	110.9	L495 K513 M514 V515 L539 L551	L495-V511 HydrophobicContact CD1-CG2 3.84Å; L495-V511 HydrophobicContact CD2-CG2 3.74Å; L495-V511 HydrophobicContact CG-CG2 4.38Å; V511-K513 PolarHBondContact O-N 2.84Å; V511-M514 PolarHBondContact O-N 3.34Å; V511-V515 HydrophobicContact CG1-CG2 3.89Å; V511-V515 WeakPolarHBondContact O-CB 3.48Å; V511-V515 VanDerWaalsContact O-CG2 3.23Å; V511-V515 WeakPolarHBondContact O-CG2 3.36Å; V511-V515 PolarHBondContact O-N 2.87Å; V511-L539 HydrophobicContact CG1-CD1 3.94Å; V511-L539 HydrophobicContact CG2-CD1 4.18Å; V511-L551 HydrophobicContact CG2-CD2 4.46Å
512	E	84.8	Confident	83.5	Confident	62 Å²	62	64.1 Å²	64.1	29%	0.29	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-38.1	-177.2	-59.5	-163.3	146.7	0	0	110.7	D510 A516 L541 Q543	D510-E512 PolarHBondContact OD1-N 2.89Å; E512-A516 VanDerWaalsContact O-CB 3.3Å; E512-A516 WeakPolarHBondContact O-CB 3.33Å; E512-A516 PolarHBondContact O-N 3.17Å; E512-L541 HydrophobicContact CG-CD1 4.1Å; E512-L541 HydrophobicContact CG-CD2 4.19Å; E512-L541 HydrophobicContact CG-CG 4.04Å; E512-Q543 PolarHBondContact OE2-NE2 3.25Å
513	K	83.1	Confident	82.4	Confident	132 Å²	132	66.7 Å²	66.7	57%	0.574	35%	0.346	S	S	*	.	H	α-helix	trans	-73.9	-36	177.9	-64.6	175.8	-172.3	149.5	0	113	F508 D510 V511 H517	F508-K513 HydrophobicContact CD1-CB 4.2Å; D510-K513 HydrophobicContact CB-CB 4.2Å; D510-K513 HydrophobicContact CB-CD 3.98Å; D510-K513 HydrophobicContact CB-CG 4.19Å; D510-K513 VanDerWaalsContact OD2-CD 3.31Å; D510-K513 WeakPolarHBondContact OD2-CD 3.3Å; D510-K513 WeakPolarHBondContact OD2-CE 3.43Å; D510-K513 IonicContact OD2-NZ 2.8Å; D510-K513 PolarHBondContact OD2-NZ 2.98Å; V511-K513 PolarHBondContact O-N 2.84Å; K513-H517 WeakPolarHBondContact O-CB 3.31Å; K513-H517 PolarHBondContact O-N 3.27Å
514	M	84.1	Confident	81.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-67.7	-41.8	174.7	-167.6	168.4	56.8	0	0	111.8	A463 L499 F508 D510 V511 H517 M518 L551	A463-M514 HydrophobicContact CB-CE 3.66Å; A463-M514 HydrophobicContact CB-SD 3.82Å; L499-M514 HydrophobicContact CB-CE 3.89Å; L499-M514 HydrophobicContact CB-SD 3.56Å; L499-M514 VanDerWaalsContact CB-SD 3.56Å; L499-M514 HydrophobicContact CD1-CE 3.6Å; L499-M514 HydrophobicContact CD1-SD 4.43Å; L499-M514 HydrophobicContact CG-CE 4.39Å; F508-M514 HydrophobicContact CB-CB 3.65Å; F508-M514 HydrophobicContact CB-CG 4.09Å; F508-M514 HydrophobicContact CB-SD 4.29Å; F508-M514 HydrophobicContact CD1-CB 4.32Å; F508-M514 HydrophobicContact CD2-CB 4.03Å; F508-M514 HydrophobicContact CD2-CG 3.7Å; F508-M514 HydrophobicContact CD2-SD 4.23Å; F508-M514 HydrophobicContact CE2-CG 4.42Å; F508-M514 HydrophobicContact CG-CB 3.72Å; F508-M514 HydrophobicContact CG-CG 3.94Å; D510-M514 PolarHBondContact O-N 3.13Å; V511-M514 PolarHBondContact O-N 3.34Å; M514-H517 PolarHBondContact O-N 3.43Å; M514-M518 PolarHBondContact O-N 2.94Å; M514-L551 HydrophobicContact CE-CD1 3.48Å; M514-L551 VanDerWaalsContact CE-CD1 3.48Å
515	V	84.3	Confident	79.7	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.006	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-43.8	175.1	173.8	0	0	0	0	110.6	V461 V511 M518 R519 L541 V549	V461-V515 HydrophobicContact CG1-CG2 4.21Å; V461-V515 HydrophobicContact CG2-CG2 4.2Å; V511-V515 HydrophobicContact CG1-CG2 3.89Å; V511-V515 WeakPolarHBondContact O-CB 3.48Å; V511-V515 VanDerWaalsContact O-CG2 3.23Å; V511-V515 WeakPolarHBondContact O-CG2 3.36Å; V511-V515 PolarHBondContact O-N 2.87Å; V515-M518 PolarHBondContact O-N 2.99Å; V515-R519 VanDerWaalsContact O-CG 3.31Å; V515-R519 WeakPolarHBondContact O-CG 3.44Å; V515-R519 PolarHBondContact O-N 2.89Å; V515-R519 VanDerWaalsContact O-N 3.08Å; V515-L541 HydrophobicContact CG1-CD2 4.4Å; V515-V549 HydrophobicContact CG2-CG1 4.06Å
516	A	84.3	Confident	77.9	Confident	40 Å²	40	74.9 Å²	74.9	33%	0.331	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-44.5	174.5	0	0	0	0	0	112.2	E512 R519 L520	E512-A516 VanDerWaalsContact O-CB 3.3Å; E512-A516 WeakPolarHBondContact O-CB 3.33Å; E512-A516 PolarHBondContact O-N 3.17Å; A516-R519 PolarHBondContact O-N 2.94Å; A516-L520 WeakPolarHBondContact O-CB 3.39Å; A516-L520 VanDerWaalsContact O-CG 3.23Å; A516-L520 WeakPolarHBondContact O-CG 3.23Å; A516-L520 PolarHBondContact O-N 2.66Å
517	H	85.9	Confident	76.3	Confident	28 Å²	28	77 Å²	77	13%	0.13	40%	0.395	C	S	.	.	H	α-helix	trans	-60.9	-44.7	174.3	161.8	62.2	0	0	0	112.3	C501 C504 F508 K513 M514 R519 L520 S521 H522	C501-H517 PolarHBondContact SG-NE2 2.83Å; C504-H517 PolarHBondContact SG-CE1 2.97Å; C504-H517 PolarHBondContact SG-NE2 3.1Å; F508-H517 HydrophobicContact CE1-CB 3.69Å; F508-H517 AromaticContact CE1-CG 3.99Å; F508-H517 HydrophobicContact CE2-CB 4.31Å; F508-H517 AromaticContact CE2-CD2 3.32Å; F508-H517 WeakPolarHBondContact CE2-CD2 3.47Å; F508-H517 AromaticContact CE2-CG 3.89Å; F508-H517 AromaticContact CE2-NE2 3.95Å; F508-H517 HydrophobicContact CZ-CB 3.52Å; F508-H517 AromaticContact CZ-CD2 3.22Å; F508-H517 WeakPolarHBondContact CZ-CD2 3.38Å; F508-H517 AromaticContact CZ-CG 3.27Å; F508-H517 AromaticContact CZ-NE2 3.94Å; K513-H517 WeakPolarHBondContact O-CB 3.31Å; K513-H517 PolarHBondContact O-N 3.27Å; M514-H517 PolarHBondContact O-N 3.43Å; H517-R519 VanDerWaalsContact C-N 3.31Å; H517-R519 PolarHBondContact O-N 3.12Å; H517-L520 PolarHBondContact O-N 2.68Å; H517-L520 VanDerWaalsContact O-N 3.15Å; H517-S521 VanDerWaalsContact CE1-CB 3.41Å; H517-S521 WeakPolarHBondContact CE1-CB 3.37Å; H517-S521 PolarHBondContact CE1-OG 3.25Å; H517-S521 WeakPolarHBondContact ND1-CB 3.28Å; H517-S521 PolarHBondContact ND1-OG 2.86Å; H517-S521 WeakPolarHBondContact O-CB 3.36Å; H517-S521 PolarHBondContact O-N 3.43Å; H517-S521 PolarHBondContact O-OG 3.29Å; H517-H522 AromaticContact CE1-CD2 3.69Å; H517-H522 AromaticContact CE1-NE2 3.48Å; H517-H522 PolarHBondContact CE1-NE2 2.95Å; H517-H522 AromaticContact NE2-CD2 3.57Å; H517-H522 AromaticContact NE2-NE2 3.53Å
518	M	82.3	Confident	74.1	Confident	17 Å²	17	74.6 Å²	74.6	8%	0.084	39%	0.39	C	S	.	.	H	α-helix	trans	-56.1	-47.7	177.2	-158.2	70.2	66.2	0	0	111	V461 P462 Y503 M514 V515 L520 H522	V461-M518 HydrophobicContact CG1-CB 4.45Å; V461-M518 HydrophobicContact CG1-CE 4.01Å; V461-M518 HydrophobicContact CG1-CG 4.4Å; P462-M518 HydrophobicContact CG-CE 4.16Å; P462-M518 HydrophobicContact CG-SD 4.43Å; P462-M518 WeakPolarHBondContact O-CE 3.39Å; Y503-M518 HydrophobicContact CD2-SD 3.92Å; Y503-M518 HydrophobicContact CE2-SD 3.7Å; M514-M518 PolarHBondContact O-N 2.94Å; V515-M518 PolarHBondContact O-N 2.99Å; M518-L520 VanDerWaalsContact C-N 3.33Å; M518-L520 PolarHBondContact O-N 3.03Å; M518-H522 CarbonylContact O-C 3.6Å; M518-H522 WeakPolarHBondContact O-CA 3.12Å; M518-H522 PolarHBondContact O-N 3.47Å; M518-H522 HydrophobicContact SD-CB 4.16Å
519	R	82.4	Confident	71.7	Confident	95 Å²	95	79.5 Å²	79.5	36%	0.358	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-29.3	178.5	-68.6	169.4	179.2	167.1	4.3	114.3	E459 V515 A516 H517	E459-R519 IonicContact OE1-CZ 2.76Å; E459-R519 IonicContact OE1-NE 3.66Å; E459-R519 PolarHBondContact OE1-NE 2.91Å; E459-R519 IonicContact OE1-NH2 3.09Å; E459-R519 PolarHBondContact OE1-NH2 3.33Å; E459-R519 IonicContact OE2-CZ 3.13Å; E459-R519 IonicContact OE2-NE 2.77Å; E459-R519 PolarHBondContact OE2-NE 2.77Å; E459-R519 IonicContact OE2-NH2 3.44Å; E459-R519 PolarHBondContact OE2-NH2 2.75Å; E459-R519 VanDerWaalsContact OE2-NH2 3.09Å; V515-R519 VanDerWaalsContact O-CG 3.31Å; V515-R519 WeakPolarHBondContact O-CG 3.44Å; V515-R519 PolarHBondContact O-N 2.89Å; V515-R519 VanDerWaalsContact O-N 3.08Å; A516-R519 PolarHBondContact O-N 2.94Å; H517-R519 VanDerWaalsContact C-N 3.31Å; H517-R519 PolarHBondContact O-N 3.12Å
520	L	79.6	Confident	69.6	Low	146 Å²	146	85.1 Å²	85.1	76%	0.764	44%	0.439	S	S	*	.	H	α-helix	trans	-97.6	-23.8	-175.1	-69.5	171.6	0	0	0	113.9	A516 H517 M518	A516-L520 WeakPolarHBondContact O-CB 3.39Å; A516-L520 VanDerWaalsContact O-CG 3.23Å; A516-L520 WeakPolarHBondContact O-CG 3.23Å; A516-L520 PolarHBondContact O-N 2.66Å; H517-L520 PolarHBondContact O-N 2.68Å; H517-L520 VanDerWaalsContact O-N 3.15Å; M518-L520 VanDerWaalsContact C-N 3.33Å; M518-L520 PolarHBondContact O-N 3.03Å
521	S	76.4	Confident	67.3	Low	65 Å²	65	89.3 Å²	89.3	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-117.5	-22	-174.2	-54.8	0	0	0	0	113.9	H517	H517-S521 VanDerWaalsContact CE1-CB 3.41Å; H517-S521 WeakPolarHBondContact CE1-CB 3.37Å; H517-S521 PolarHBondContact CE1-OG 3.25Å; H517-S521 WeakPolarHBondContact ND1-CB 3.28Å; H517-S521 PolarHBondContact ND1-OG 2.86Å; H517-S521 WeakPolarHBondContact O-CB 3.36Å; H517-S521 PolarHBondContact O-N 3.43Å; H517-S521 PolarHBondContact O-OG 3.29Å
522	H	79.2	Confident	65.4	Low	45 Å²	45	92.7 Å²	92.7	21%	0.208	48%	0.484	C	S	.	.			trans	-137.7	53.5	-176.4	-55.1	-67.8	0	0	0	112.4	Y503 H517 M518 E524	Y503-H522 HydrophobicContact CD2-CB 3.65Å; Y503-H522 AromaticContact CD2-CD2 3.86Å; Y503-H522 AromaticContact CD2-CG 3.48Å; Y503-H522 VanDerWaalsContact CD2-CG 3.48Å; Y503-H522 AromaticContact CD2-ND1 3.83Å; Y503-H522 HydrophobicContact CE2-CB 3.99Å; H517-H522 AromaticContact CE1-CD2 3.69Å; H517-H522 AromaticContact CE1-NE2 3.48Å; H517-H522 PolarHBondContact CE1-NE2 2.95Å; H517-H522 AromaticContact NE2-CD2 3.57Å; H517-H522 AromaticContact NE2-NE2 3.53Å; M518-H522 CarbonylContact O-C 3.6Å; M518-H522 WeakPolarHBondContact O-CA 3.12Å; M518-H522 PolarHBondContact O-N 3.47Å; M518-H522 HydrophobicContact SD-CB 4.16Å; H522-E524 PolarHBondContact O-N 2.63Å
523	P	59.5	Low	64	Low	100 Å²	100	94.2 Å²	94.2	65%	0.649	50%	0.501	S	S	*	.	S	Bend	trans	-71.6	-21.9	-166.3	28.1	-36.3	0	0	0	116.2
524	E	51.8	Low	63.3	Low	180 Å²	180	90.4 Å²	90.4	84%	0.841	49%	0.49	S	S	*	.	S	Bend	trans	-106.9	-12.2	-170.9	-59.6	-155.9	132.6	0	0	115.2	H522 K526	H522-E524 PolarHBondContact O-N 2.63Å; E524-K526 PolarHBondContact O-N 3.13Å
525	E	55	Low	62.9	Low	122 Å²	122	91.5 Å²	91.5	57%	0.57	50%	0.496	S	S	*	.			trans	-83.1	86.5	-170.9	-162	174.1	163.6	0	0	113.2	Y503 V527	Y503-E525 WeakPolarHBondContact CD1-OE2 3.38Å; Y503-E525 HydrophobicContact CE1-CG 4.08Å; Y503-E525 WeakPolarHBondContact CE1-OE1 3.45Å; Y503-E525 VanDerWaalsContact CE1-OE2 3.26Å; Y503-E525 WeakPolarHBondContact CE1-OE2 3.27Å; Y503-E525 HydrophobicContact CE2-CB 4.36Å; Y503-E525 PolarHBondContact OH-O 3.17Å; E525-V527 PolarHBondContact O-N 3.21Å
526	K	45.2	Very low	62.6	Low	201 Å²	201	93.6 Å²	93.6	87%	0.874	51%	0.509	S	S	*	.			trans	-76.3	104.5	173.3	-68.7	179.1	-177.2	172.5	0	111.2	E524 G528	E524-K526 PolarHBondContact O-N 3.13Å; K526-G528 PolarHBondContact O-N 3.4Å
527	V	49.4	Very low	62.3	Low	84 Å²	84	93.4 Å²	93.4	51%	0.509	50%	0.5	S	S	.	.			trans	-63.1	121.1	179.1	-177.9	0	0	0	0	111.9	P462 Y503 E525	P462-V527 HydrophobicContact CB-CG2 4.26Å; P462-V527 HydrophobicContact CG-CG2 3.98Å; Y503-V527 WeakPolarHBondContact OH-CG2 3.31Å; E525-V527 PolarHBondContact O-N 3.21Å
528	G	41.5	Very low	61.8	Low	48 Å²	48	93.9 Å²	93.9	50%	0.495	50%	0.504	S	S	.	.			trans	-74.8	172.3	171.7	0	0	0	0	0	113.7	K526 R530	K526-G528 PolarHBondContact O-N 3.4Å; G528-R530 PolarHBondContact O-N 2.99Å; G528-R530 VanDerWaalsContact O-N 3.11Å
529	P	36.1	Very low	61.7	Low	138 Å²	138	94.5 Å²	94.5	90%	0.896	51%	0.507	S	S	*	.			trans	-64.8	113.3	-174.5	-19.3	32.3	0	0	0	112.3
530	R	45.4	Very low	60.9	Low	222 Å²	222	93 Å²	93	84%	0.838	51%	0.509	S	S	*	.			trans	-96.5	141.7	163.2	-69.2	-166.2	175.4	-144.7	-0.2	109.7	G528	G528-R530 PolarHBondContact O-N 2.99Å; G528-R530 VanDerWaalsContact O-N 3.11Å
531	T	38.6	Very low	60.4	Low	135 Å²	135	87.1 Å²	87.1	83%	0.828	48%	0.478	S	S	*	.			trans	-85.5	-15.9	-160.5	38.2	0	0	0	0	115.4
532	D	45.7	Very low	59.4	Low	86 Å²	86	88.9 Å²	88.9	46%	0.46	48%	0.479	S	S	.	.	S	Bend	trans	-85.4	128.7	-176.3	-59.7	-84.1	0	0	0	111.8	P534 N557	D532-P534 WeakPolarHBondContact O-CD 3.27Å; D532-P534 VanDerWaalsContact O-CG 3.26Å; D532-P534 WeakPolarHBondContact O-CG 3.42Å; D532-N557 PolarHBondContact OD1-ND2 2.9Å
533	S	54	Low	57.7	Low	93 Å²	93	93.8 Å²	93.8	65%	0.65	50%	0.502	S	S	*	.			trans	-59.9	97.8	-171.5	-65.3	0	0	0	0	113.7	K470	K470-S533 PolarHBondContact NZ-O 2.92Å
534	P	69.5	Low	57	Low	53 Å²	53	92.4 Å²	92.4	34%	0.344	51%	0.506	S	S	.	.			trans	-76.4	172.7	-172.2	-7.1	25.6	0	0	0	111.1	D532 T536 I552	D532-P534 WeakPolarHBondContact O-CD 3.27Å; D532-P534 VanDerWaalsContact O-CG 3.26Å; D532-P534 WeakPolarHBondContact O-CG 3.42Å; P534-T536 PolarHBondContact O-N 3.08Å; P534-I552 HydrophobicContact CB-CG2 3.7Å; P534-I552 HydrophobicContact CG-CG2 3.92Å
535	L	75.7	Confident	56.5	Low	22 Å²	22	90.1 Å²	90.1	12%	0.115	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	100.4	167.2	-61.3	-175.9	0	0	0	109.6	K470 L490 F537 V553 T555	K470-L535 HydrophobicContact CD-CD2 4.4Å; L490-L535 HydrophobicContact CD2-CD1 3.55Å; L490-L535 HydrophobicContact CG-CD1 4.21Å; L535-F537 HydrophobicContact CB-CD2 4.46Å; L535-F537 HydrophobicContact CB-CE2 3.65Å; L535-F537 HydrophobicContact CB-CZ 4.04Å; L535-F537 HydrophobicContact CD1-CE2 4.47Å; L535-F537 HydrophobicContact CD1-CZ 4.34Å; L535-V553 HydrophobicContact CB-CB 4.42Å; L535-V553 PolarHBondContact N-O 3.36Å; L535-V553 PolarHBondContact O-N 3Å; L535-T555 HydrophobicContact CD1-CG2 3.5Å; L535-T555 HydrophobicContact CG-CG2 3.9Å
536	T	76.8	Confident	56.3	Low	46 Å²	46	89 Å²	89	28%	0.282	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	124.1	173.8	58.3	0	0	0	0	110.6	K434 P534 L551	K434-T536 PolarHBondContact NZ-OG1 2.87Å; P534-T536 PolarHBondContact O-N 3.08Å; T536-L551 WeakPolarHBondContact CA-O 3.46Å
537	F	78	Confident	56.9	Low	35 Å²	35	84 Å²	84	15%	0.154	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122	171.4	-57.5	-84.2	0	0	0	110.5	L490 L491 M494 L535 L551 V553	L490-F537 HydrophobicContact CB-CZ 4.49Å; L490-F537 HydrophobicContact CG-CZ 4.43Å; L491-F537 HydrophobicContact CB-CD1 3.9Å; L491-F537 HydrophobicContact CB-CD2 4.46Å; L491-F537 HydrophobicContact CB-CE1 3.77Å; L491-F537 HydrophobicContact CB-CE2 4.35Å; L491-F537 HydrophobicContact CB-CG 4.24Å; L491-F537 HydrophobicContact CB-CZ 4Å; L491-F537 HydrophobicContact CD1-CD2 4.2Å; L491-F537 HydrophobicContact CD1-CE2 4.44Å; L491-F537 HydrophobicContact CD1-CG 4.42Å; L491-F537 HydrophobicContact CD2-CB 4.03Å; L491-F537 HydrophobicContact CD2-CD1 4.21Å; L491-F537 HydrophobicContact CD2-CG 4.06Å; L491-F537 HydrophobicContact CG-CG 4.48Å; M494-F537 HydrophobicContact CE-CE2 4.3Å; L535-F537 HydrophobicContact CB-CD2 4.46Å; L535-F537 HydrophobicContact CB-CE2 3.65Å; L535-F537 HydrophobicContact CB-CZ 4.04Å; L535-F537 HydrophobicContact CD1-CE2 4.47Å; L535-F537 HydrophobicContact CD1-CZ 4.34Å; F537-L551 HydrophobicContact CB-CB 4.37Å; F537-L551 HydrophobicContact CD2-CD2 4.48Å; F537-L551 PolarHBondContact N-O 3.06Å; F537-L551 PolarHBondContact O-N 3.01Å; F537-V553 HydrophobicContact CD2-CG2 4Å; F537-V553 HydrophobicContact CE2-CG2 4Å
538	D	76.1	Confident	57.8	Low	38 Å²	38	81.2 Å²	81.2	20%	0.203	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.9	-178.7	-60.3	-30.8	0	0	0	109.6	Y448 F452 Q550	Y448-D538 VanDerWaalsContact CE1-OD2 3.29Å; Y448-D538 WeakPolarHBondContact CE1-OD2 3.44Å; Y448-D538 PolarHBondContact OH-OD2 3.3Å; F452-D538 HydrophobicContact CE1-CB 4.21Å; F452-D538 HydrophobicContact CE2-CB 3.97Å; F452-D538 HydrophobicContact CZ-CB 3.59Å; D538-Q550 WeakPolarHBondContact OD1-CG 3.43Å; D538-Q550 PolarHBondContact OD1-NE2 3.47Å
539	L	79.1	Confident	59.5	Low	30 Å²	30	78.9 Å²	78.9	16%	0.157	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.4	-169.6	-63.8	172	0	0	0	112	L491 V511 V549 L551	L491-L539 HydrophobicContact CD2-CD1 4.08Å; L491-L539 HydrophobicContact CD2-CD2 3.9Å; L491-L539 HydrophobicContact CD2-CG 4.46Å; V511-L539 HydrophobicContact CG1-CD1 3.94Å; V511-L539 HydrophobicContact CG2-CD1 4.18Å; L539-V549 PolarHBondContact N-O 3.41Å; L539-V549 PolarHBondContact O-N 2.83Å; L539-L551 HydrophobicContact CD1-CB 4.15Å; L539-L551 HydrophobicContact CD1-CD2 4.32Å
540	T	67.2	Low	61.4	Low	63 Å²	63	72.6 Å²	72.6	39%	0.387	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	100.7	177.7	55.8	0	0	0	0	110.2	N548	T540-N548 WeakPolarHBondContact CG2-OD1 3.25Å
541	L	69.3	Low	63.2	Low	24 Å²	24	62 Å²	62	13%	0.126	36%	0.359	C	S	.	.			trans	-76.7	135.5	178.1	-118.6	69.7	0	0	0	110.4	E512 V515 V549	E512-L541 HydrophobicContact CG-CD1 4.1Å; E512-L541 HydrophobicContact CG-CD2 4.19Å; E512-L541 HydrophobicContact CG-CG 4.04Å; V515-L541 HydrophobicContact CG1-CD2 4.4Å; L541-V549 HydrophobicContact CD1-CG2 4.48Å
542	Q	54.3	Low	65.3	Low	102 Å²	102	57.6 Å²	57.6	48%	0.477	33%	0.33	S	S	.	.			trans	-105.2	-15.6	-171.5	-63.6	-168.4	-4.8	0	0	114.5	S403 V405	S403-Q542 PolarHBondContact OG-NE2 3.36Å; S403-Q542 PolarHBondContact OG-OE1 3.28Å; V405-Q542 HydrophobicContact CG2-CG 4.3Å
543	Q	44.1	Very low	67.1	Low	147 Å²	147	53.5 Å²	53.5	69%	0.687	31%	0.308	S	S	*	.	S	Bend	trans	-91.8	111	-179.5	-60.4	-163.2	61.7	0	0	111.6	E512	E512-Q543 PolarHBondContact OE2-NE2 3.25Å
544	G	44.8	Very low	68.6	Low	72 Å²	72	52.7 Å²	52.7	74%	0.742	30%	0.299	S	S	*	.	S	Bend	trans	76.4	75.9	167.2	0	0	0	0	0	115.2
545	N	40.8	Very low	69.1	Low	131 Å²	131	51.1 Å²	51.1	70%	0.701	29%	0.288	S	S	*	.	S	Bend	trans	71.5	120	-177	-160.1	-34.4	0	0	0	112.4	K547	N545-K547 PolarHBondContact O-N 3.45Å
546	P	49.7	Very low	68.9	Low	100 Å²	100	54.7 Å²	54.7	65%	0.649	30%	0.301	S	S	*	.			trans	-75.9	70.5	-171.5	33	-37.8	0	0	0	112.2	N548	P546-N548 PolarHBondContact O-N 3.39Å
547	K	59.7	Low	68.1	Low	94 Å²	94	55 Å²	55	41%	0.409	30%	0.301	S	S	.	.			trans	-70	113.8	164.2	-72.4	-177.1	162.7	-165.4	0	108.5	E459 N545	E459-K547 WeakPolarHBondContact OE2-CD 3.35Å; E459-K547 IonicContact OE2-NZ 3.79Å; E459-K547 PolarHBondContact OE2-NZ 2.77Å; N545-K547 PolarHBondContact O-N 3.45Å
548	N	67.4	Low	66.6	Low	26 Å²	26	58.5 Å²	58.5	14%	0.139	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	139.9	163.9	-57.6	-56.2	0	0	0	108.2	I438 F452 H456 A458 E459 T540 P546	I438-N548 HydrophobicContact CD1-CB 4.14Å; I438-N548 WeakPolarHBondContact CD1-OD1 3.21Å; F452-N548 HydrophobicContact CZ-CB 4.43Å; H456-N548 PolarHBondContact O-ND2 3.19Å; A458-N548 CarbonylContact C-O 3.2Å; A458-N548 VanDerWaalsContact CA-O 3.26Å; A458-N548 WeakPolarHBondContact CA-O 3.4Å; A458-N548 HydrophobicContact CB-CB 3.99Å; E459-N548 PolarHBondContact N-O 2.86Å; T540-N548 WeakPolarHBondContact CG2-OD1 3.25Å; P546-N548 PolarHBondContact O-N 3.39Å
549	V	77.7	Confident	65.1	Low	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120	-179.2	176.1	0	0	0	0	107.9	E459 V461 V515 L539 L541	E459-V549 WeakPolarHBondContact O-CA 3.25Å; V461-V549 HydrophobicContact CB-CG1 4.11Å; V461-V549 HydrophobicContact CG2-CG1 3.86Å; V515-V549 HydrophobicContact CG2-CG1 4.06Å; L539-V549 PolarHBondContact N-O 3.41Å; L539-V549 PolarHBondContact O-N 2.83Å; L541-V549 HydrophobicContact CD1-CG2 4.48Å
550	Q	76.4	Confident	63.3	Low	5 Å²	5	70.7 Å²	70.7	2%	0.023	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	100.8	168.3	-174.3	161.6	80.8	0	0	107.8	F452 E459 K460 V461 D538 I552	F452-Q550 HydrophobicContact CD1-CB 4.22Å; F452-Q550 HydrophobicContact CE1-CB 4Å; E459-Q550 PolarHBondContact O-N 3.24Å; K460-Q550 WeakPolarHBondContact CA-O 3.47Å; K460-Q550 HydrophobicContact CG-CB 4.36Å; V461-Q550 PolarHBondContact N-O 2.75Å; D538-Q550 WeakPolarHBondContact OD1-CG 3.43Å; D538-Q550 PolarHBondContact OD1-NE2 3.47Å; Q550-I552 HydrophobicContact CG-CG1 4.26Å; Q550-I552 PolarHBondContact O-N 2.93Å
551	L	82.7	Confident	61.5	Low	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.8	177.5	-178.7	71.8	0	0	0	108.8	V461 A463 L491 L499 V511 M514 T536 F537 L539 V553	V461-L551 HydrophobicContact CG1-CD1 4.42Å; A463-L551 HydrophobicContact CB-CD1 3.91Å; L491-L551 HydrophobicContact CD1-CD2 3.6Å; L499-L551 HydrophobicContact CD1-CD2 3.95Å; V511-L551 HydrophobicContact CG2-CD2 4.46Å; M514-L551 HydrophobicContact CE-CD1 3.48Å; M514-L551 VanDerWaalsContact CE-CD1 3.48Å; T536-L551 WeakPolarHBondContact CA-O 3.46Å; F537-L551 HydrophobicContact CB-CB 4.37Å; F537-L551 HydrophobicContact CD2-CD2 4.48Å; F537-L551 PolarHBondContact N-O 3.06Å; F537-L551 PolarHBondContact O-N 3.01Å; L539-L551 HydrophobicContact CD1-CB 4.15Å; L539-L551 HydrophobicContact CD1-CD2 4.32Å; L551-V553 HydrophobicContact CD2-CG2 3.89Å; L551-V553 HydrophobicContact CG-CG2 3.8Å
552	I	82.1	Confident	59.8	Low	43 Å²	43	75.5 Å²	75.5	22%	0.221	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	103.3	-179.3	-56.4	178.3	0	0	0	107.6	K460 V461 P462 A463 P534 Q550	K460-I552 HydrophobicContact CB-CD1 4.04Å; K460-I552 HydrophobicContact CD-CD1 4.21Å; K460-I552 HydrophobicContact CG-CD1 4.07Å; V461-I552 PolarHBondContact O-N 3.12Å; P462-I552 WeakPolarHBondContact CA-O 3.43Å; A463-I552 PolarHBondContact N-O 2.8Å; P534-I552 HydrophobicContact CB-CG2 3.7Å; P534-I552 HydrophobicContact CG-CG2 3.92Å; Q550-I552 HydrophobicContact CG-CG1 4.26Å; Q550-I552 PolarHBondContact O-N 2.93Å
553	V	84.7	Confident	59	Low	0 Å²	0	79.8 Å²	79.8	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.2	-178.3	-160.9	0	0	0	0	112	A463 A465 M494 L499 L535 F537 L551	A463-V553 HydrophobicContact CB-CG1 4.36Å; A463-V553 HydrophobicContact CB-CG2 4.33Å; A463-V553 WeakPolarHBondContact O-CA 3.43Å; A465-V553 HydrophobicContact CB-CG1 3.69Å; M494-V553 HydrophobicContact CE-CB 3.85Å; M494-V553 HydrophobicContact CE-CG1 3.48Å; M494-V553 VanDerWaalsContact CE-CG1 3.48Å; M494-V553 HydrophobicContact CE-CG2 3.94Å; L499-V553 HydrophobicContact CD2-CG1 4.01Å; L535-V553 HydrophobicContact CB-CB 4.42Å; L535-V553 PolarHBondContact N-O 3.36Å; L535-V553 PolarHBondContact O-N 3Å; F537-V553 HydrophobicContact CD2-CG2 4Å; F537-V553 HydrophobicContact CE2-CG2 4Å; L551-V553 HydrophobicContact CD2-CG2 3.89Å; L551-V553 HydrophobicContact CG-CG2 3.8Å
554	T	84	Confident	58.7	Low	76 Å²	76	81.3 Å²	81.3	47%	0.466	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.6	168.4	-53.9	0	0	0	0	109.5	A463 A465	A463-T554 PolarHBondContact O-N 3.46Å; A465-T554 PolarHBondContact N-O 2.97Å
555	T	81.1	Confident	58.1	Low	19 Å²	19	83 Å²	83	12%	0.117	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	164.2	176.8	54.2	0	0	0	0	111	I468 L535 N557	I468-T555 HydrophobicContact CB-CG2 3.95Å; I468-T555 HydrophobicContact CG2-CG2 3.71Å; I468-T555 WeakPolarHBondContact O-CB 3.34Å; L535-T555 HydrophobicContact CD1-CG2 3.5Å; L535-T555 HydrophobicContact CG-CG2 3.9Å; T555-N557 PolarHBondContact O-N 3.48Å; T555-N557 VanDerWaalsContact O-N 3.17Å
556	Y	71.4	Confident	57.8	Low	98 Å²	98	83.5 Å²	83.5	38%	0.384	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	118.3	175.2	-176	-98.9	0	0	0	111.6	N466 I468 M469 M558	N466-Y556 WeakPolarHBondContact O-CB 3.49Å; I468-Y556 WeakPolarHBondContact O-CB 2.86Å; I468-Y556 PolarHBondContact O-N 3.36Å; M469-Y556 HydrophobicContact CB-CD1 4.49Å; M469-Y556 HydrophobicContact CG-CD1 4.32Å; Y556-M558 HydrophobicContact CE1-CG 4.46Å; Y556-M558 HydrophobicContact CE1-SD 3.9Å
557	N	59.3	Low	57.2	Low	52 Å²	52	82.2 Å²	82.2	28%	0.278	44%	0.441	S	S	.	.			trans	-94.8	131	173.4	-166.4	2.1	0	0	0	109.4	D532 T555 R559 D560	D532-N557 PolarHBondContact OD1-ND2 2.9Å; T555-N557 PolarHBondContact O-N 3.48Å; T555-N557 VanDerWaalsContact O-N 3.17Å; N557-R559 PolarHBondContact O-N 3.22Å; N557-R559 VanDerWaalsContact O-N 3.13Å; N557-R559 PolarHBondContact OD1-N 3.34Å; N557-D560 HydrophobicContact CB-CB 4.44Å; N557-D560 PolarHBondContact ND2-OD2 3.21Å
558	M	46.1	Very low	55.6	Low	108 Å²	108	87.3 Å²	87.3	53%	0.532	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-3.5	175.7	-77.5	-72.4	-44.4	0	0	113.4	M469 Y556 R704	M469-M558 HydrophobicContact SD-CG 4.25Å; M469-M558 HydrophobicContact SD-SD 3.93Å; Y556-M558 HydrophobicContact CE1-CG 4.46Å; Y556-M558 HydrophobicContact CE1-SD 3.9Å; M558-R704 PolarHBondContact SD-NH1 2.95Å; M558-R704 VanDerWaalsContact SD-NH1 3.45Å; M558-R704 PolarHBondContact SD-NH2 3Å; M558-R704 VanDerWaalsContact SD-NH2 3.4Å
559	R	44.4	Very low	53.8	Low	226 Å²	226	95.8 Å²	95.8	85%	0.853	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-16.6	-177.2	-65.5	-171.7	173.3	-146.4	-4.4	114.9	N557	N557-R559 PolarHBondContact O-N 3.22Å; N557-R559 VanDerWaalsContact O-N 3.13Å; N557-R559 PolarHBondContact OD1-N 3.34Å
560	D	43	Very low	51.4	Low	98 Å²	98	100 Å²	100	52%	0.524	54%	0.537	S	S	.	.			trans	-112.8	81.1	-179.4	-61.4	-69	0	0	0	110.4	N557 P562	N557-D560 HydrophobicContact CB-CB 4.44Å; N557-D560 PolarHBondContact ND2-OD2 3.21Å; D560-P562 VanDerWaalsContact O-CD 3.32Å; D560-P562 WeakPolarHBondContact O-CD 3.44Å
561	A	28.7	Very low	49.2	Very low	81 Å²	81	108.9 Å²	108.9	67%	0.669	58%	0.578	S	S	*	*			trans	-91.6	106.3	163.3	0	0	0	0	0	108.1	E563	A561-E563 PolarHBondContact O-N 2.72Å
562	P	34.3	Very low	46.4	Very low	108 Å²	108	115.8 Å²	115.8	70%	0.701	62%	0.615	S	S	*	*			trans	-70.7	130.2	172.1	29.3	-33	0	0	0	109.3	D560 E564	D560-P562 VanDerWaalsContact O-CD 3.32Å; D560-P562 WeakPolarHBondContact O-CD 3.44Å; P562-E564 PolarHBondContact O-N 3.49Å
563	E	37	Very low	43.7	Very low	191 Å²	191	119.2 Å²	119.2	89%	0.893	64%	0.643	S	S	*	*	S	Bend	trans	-70.5	-0.6	-177.3	-62	-175.3	114.5	0	0	113.7	A561 S565	A561-E563 PolarHBondContact O-N 2.72Å; E563-S565 PolarHBondContact O-N 3.47Å
564	E	37.7	Very low	40.9	Very low	180 Å²	180	125.5 Å²	125.5	84%	0.841	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	67.1	-170.1	-160.9	175.1	-134.9	0	0	112.9	P562	P562-E564 PolarHBondContact O-N 3.49Å
565	S	32.6	Very low	38.2	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.9	13.6	162.8	-75.8	0	0	0	0	113.4	E563 A567	E563-S565 PolarHBondContact O-N 3.47Å; S565-A567 PolarHBondContact O-N 3.05Å
566	V	34.8	Very low	35.6	Very low	143 Å²	143	130.5 Å²	130.5	87%	0.867	72%	0.72	S	S	*	*			trans	-87	43.5	-175.8	-154.5	0	0	0	0	111.9
567	A	35.5	Very low	33.4	Very low	72 Å²	72	133.7 Å²	133.7	60%	0.595	74%	0.742	S	S	*	*			trans	-150.8	158.9	177.4	0	0	0	0	0	111	S565	S565-A567 PolarHBondContact O-N 3.05Å
568	F	27.8	Very low	31.9	Very low	202 Å²	202	136.3 Å²	136.3	89%	0.886	76%	0.764	S	S	*	*			trans	65.7	64.4	179.1	-64.1	-82.6	0	0	0	117.3
569	H	28	Very low	30.9	Very low	203 Å²	203	137.3 Å²	137.3	94%	0.94	78%	0.782	S	S	*	*				-148.2	81.4	129.8	-116.8	-48	0	0	0	112.6
570	A	28.6	Very low	30.1	Very low	89 Å²	89	133.8 Å²	133.8	74%	0.736	78%	0.78	S	S	*	*			trans	-139.8	167.3	161.4	0	0	0	0	0	107.4
571	Q	28.7	Very low	29.3	Very low	191 Å²	191	136.3 Å²	136.3	89%	0.893	79%	0.793	S	S	*	*			trans	68.5	92.1	-169.1	-52.2	-81.1	-7.2	0	0	113.8
572	N	25.6	Very low	29.3	Very low	145 Å²	145	137.7 Å²	137.7	78%	0.775	80%	0.798	S	S	*	*				175.6	117.1	105.2	-172.7	-1.7	0	0	0	110.7
573	S	24.8	Very low	28.9	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	81%	0.807	S	S	*	*			trans	-169.6	91.1	160.6	-82.2	0	0	0	0	112
574	T	26.5	Very low	28.2	Very low	132 Å²	132	133.7 Å²	133.7	81%	0.81	80%	0.8	S	S	*	*			trans	-167.7	148.3	138.7	19.1	0	0	0	0	113.9
575	S	25.6	Very low	27.8	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	80%	0.799	S	S	*	*			trans	52.9	93.5	152.3	58.3	0	0	0	0	121.1
576	S	26.5	Very low	27.9	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	81%	0.805	S	S	*	*				27.3	136	115.1	61.9	0	0	0	0	121.6
577	I	26.9	Very low	27.6	Very low	165 Å²	165	132 Å²	132	85%	0.846	80%	0.8	S	S	*	*				-173.6	149.6	108.7	-94.1	155.3	0	0	0	110.5
578	S	26.8	Very low	27.1	Very low	106 Å²	106	132.2 Å²	132.2	74%	0.741	81%	0.809	S	S	*	*			trans	-82.2	148.8	178.1	-45.6	0	0	0	0	112.9
579	S	26.2	Very low	27.1	Very low	130 Å²	130	132.6 Å²	132.6	91%	0.909	81%	0.81	S	S	*	*			trans	-172.7	170.7	139.4	-90.3	0	0	0	0	113.7
580	N	25.9	Very low	27	Very low	151 Å²	151	134 Å²	134	81%	0.807	81%	0.807	S	S	*	*			trans	-119.2	160.4	-165.1	-105.3	-26.4	0	0	0	112.8
581	L	27.3	Very low	26.8	Very low	151 Å²	151	136.9 Å²	136.9	79%	0.791	81%	0.809	S	S	*	*			trans	72.5	119.9	152.4	-67.7	159.7	0	0	0	121.4
582	S	29	Very low	26.8	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	80%	0.804	S	S	*	*				65.2	110.2	125.2	-55	0	0	0	0	122.8
583	A	24.8	Very low	27.4	Very low	108 Å²	108	133.8 Å²	133.8	89%	0.893	80%	0.802	S	S	*	*			trans	-146.7	162.5	143.9	0	0	0	0	0	109.7
584	S	23.9	Very low	27.3	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	81%	0.805	S	S	*	*			trans	-160.2	164	-167.7	-165.1	0	0	0	0	114.3
585	L	29.2	Very low	27.4	Very low	154 Å²	154	139 Å²	139	81%	0.806	80%	0.804	S	S	*	*			trans	70.5	154.9	171.1	-48.2	173	0	0	0	115
586	L	33.2	Very low	27.7	Very low	166 Å²	166	140.1 Å²	140.1	87%	0.869	81%	0.809	S	S	*	*			cis	-137.4	167.2	4.2	-70.6	167.4	0	0	0	109.5
587	G	28.3	Very low	27.5	Very low	74 Å²	74	139.9 Å²	139.9	76%	0.763	81%	0.807	S	S	*	*			cis	163.1	141.9	-10.5	0	0	0	0	0	116
588	G	26.6	Very low	27.5	Very low	76 Å²	76	140.9 Å²	140.9	78%	0.784	81%	0.805	S	S	*	*			trans	106.2	151	162.7	0	0	0	0	0	116.4
589	K	26.9	Very low	27.4	Very low	210 Å²	210	141.9 Å²	141.9	91%	0.913	81%	0.807	S	S	*	*			cis	-161.7	151.6	8.5	-50.3	166.2	-171.3	161.4	0	107.4
590	R	26	Very low	27.2	Very low	232 Å²	232	140.7 Å²	140.7	88%	0.875	80%	0.799	S	S	*	*			cis	-155.5	151.5	-7.8	-154.1	-156	-54	-125.6	8	110.9
591	L	24	Very low	27.2	Very low	149 Å²	149	139.5 Å²	139.5	78%	0.78	80%	0.802	S	S	*	*			trans	-25.2	137.3	168.4	-65	153.7	0	0	0	123.2
592	M	29.7	Very low	27	Very low	161 Å²	161	136 Å²	136	79%	0.793	80%	0.803	S	S	*	*				28.4	155.9	108.7	-71	-63.2	105.5	0	0	120.7
593	P	36.9	Very low	27	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	81%	0.809	S	S	*	*			cis	-163	-171.9	46.9	48.3	-26.1	0	0	0	122
594	Q	24.1	Very low	27.1	Very low	189 Å²	189	138 Å²	138	88%	0.883	80%	0.796	S	S	*	*			trans	88.9	156.9	148.8	-74.1	-155.3	11.9	0	0	124
595	Q	26.9	Very low	27.1	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	80%	0.796	S	S	*	*			trans	-109.3	162.5	-175.3	-166.9	-172.2	13	0	0	109.2
596	P	32	Very low	27.1	Very low	122 Å²	122	138 Å²	138	79%	0.792	79%	0.787	S	S	*	*				-149.7	-159	116.4	39.9	-23.1	0	0	0	113.8
597	S	23.5	Very low	27.1	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	78%	0.784	S	S	*	*			trans	-148.4	171.6	178.2	60.9	0	0	0	0	111.9
598	K	27.4	Very low	26.9	Very low	185 Å²	185	139.4 Å²	139.4	80%	0.804	78%	0.78	S	S	*	*			trans	101.5	123.5	167	-57.8	178.3	180	179.5	0	118.7
599	T	23.8	Very low	26.9	Very low	128 Å²	128	144 Å²	144	79%	0.785	79%	0.785	S	S	*	*			trans	42.3	128	138.5	61.7	0	0	0	0	120.2
600	S	22.9	Very low	26.8	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	78%	0.779	S	S	*	*				175.4	164.3	73.9	47.5	0	0	0	0	113.9
601	S	24.2	Very low	26.7	Very low	125 Å²	125	137.3 Å²	137.3	87%	0.874	78%	0.777	S	S	*	*			trans	54.7	123.6	150.3	-56.6	0	0	0	0	122.9
602	G	24.8	Very low	26.6	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	78%	0.776	S	S	*	*			trans	166.4	118.4	160.4	0	0	0	0	0	115.2
603	L	27.2	Very low	27.1	Very low	170 Å²	170	132.1 Å²	132.1	89%	0.89	77%	0.772	S	S	*	*			trans	-51	148.3	172.4	-95.8	62.7	0	0	0	113.6
604	S	26.8	Very low	26.5	Very low	90 Å²	90	135.3 Å²	135.3	63%	0.629	78%	0.777	S	S	*	*			cis	-149.8	-156.5	-0.9	-60.5	0	0	0	0	109.1
605	D	25.2	Very low	26.5	Very low	139 Å²	139	131.2 Å²	131.2	74%	0.743	78%	0.776	S	S	*	*			cis	-157.4	-178.6	0.4	-136.3	-51.7	0	0	0	112.3
606	I	28.5	Very low	26.4	Very low	121 Å²	121	128.5 Å²	128.5	62%	0.621	78%	0.776	S	S	*	*			trans	-148.2	154.2	-176.1	-8.6	176.9	0	0	0	112	Q608	I606-Q608 HydrophobicContact CG2-CB 4.34Å; I606-Q608 HydrophobicContact CG2-CG 4.33Å
607	P	33	Very low	26.1	Very low	122 Å²	122	129.1 Å²	129.1	79%	0.792	78%	0.777	S	S	*	*				-139.9	129.8	80.6	33.4	-16	0	0	0	113.8
608	Q	24.6	Very low	26.3	Very low	148 Å²	148	129.9 Å²	129.9	69%	0.692	78%	0.779	S	S	*	*				58.7	116.6	76.1	-103.6	-160.3	33.6	0	0	116.9	I606	I606-Q608 HydrophobicContact CG2-CB 4.34Å; I606-Q608 HydrophobicContact CG2-CG 4.33Å
609	I	27.3	Very low	26.4	Very low	172 Å²	172	132.3 Å²	132.3	88%	0.882	79%	0.785	S	S	*	*			trans	-146.7	159	140.5	-100.9	160.6	0	0	0	107.9
610	K	25.1	Very low	26.5	Very low	183 Å²	183	133.8 Å²	133.8	80%	0.796	78%	0.781	S	S	*	*			trans	-87.1	173.6	-167.2	-58	150.2	-175.9	172.1	0	110.7
611	S	23.1	Very low	26.9	Very low	119 Å²	119	140.2 Å²	140.2	83%	0.832	79%	0.789	S	S	*	*			cis	-158.8	-173.5	21.9	56.9	0	0	0	0	112.7
612	A	22.5	Very low	27.2	Very low	90 Å²	90	140.4 Å²	140.4	74%	0.744	78%	0.78	S	S	*	*			trans	-141.9	-177.8	174.5	0	0	0	0	0	109
613	P	40.2	Very low	28.2	Very low	111 Å²	111	141.7 Å²	141.7	72%	0.721	77%	0.772	S	S	*	*			cis	-136.3	-165.9	-2.8	43.5	-25.3	0	0	0	114.7
614	Q	23.7	Very low	28.9	Very low	178 Å²	178	134.9 Å²	134.9	83%	0.832	74%	0.742	S	S	*	*			trans	64.9	111	158.6	-63.8	-67.3	-3.2	0	0	120.9
615	A	23.8	Very low	30	Very low	103 Å²	103	138.8 Å²	138.8	85%	0.851	75%	0.748	S	S	*	*			trans	-156.3	154.4	141.9	0	0	0	0	0	109.5
616	S	24.1	Very low	31.8	Very low	112 Å²	112	133 Å²	133	78%	0.783	72%	0.718	S	S	*	*			trans	-120.7	-178.3	-171.2	65.4	0	0	0	0	113.6
617	V	25.5	Very low	33.6	Very low	135 Å²	135	131.4 Å²	131.4	82%	0.818	71%	0.71	S	S	*	*			trans	107.6	123.9	169.6	-177.7	0	0	0	0	115.2
618	P	28.3	Very low	35.6	Very low	112 Å²	112	125.6 Å²	125.6	73%	0.727	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-99.3	144.7	-174.4	37.1	-33.7	0	0	0	114
619	Y	28.9	Very low	37.8	Very low	237 Å²	237	120.9 Å²	120.9	93%	0.929	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-86.5	138.6	165.8	-140.8	-93.1	0	0	0	111.4
620	K	27	Very low	39.9	Very low	158 Å²	158	113.4 Å²	113.4	69%	0.687	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-84.6	135	-163.3	-66.6	-173	178.9	-178.9	0	113.7	D622	K620-D622 PolarHBondContact O-N 3.41Å
621	R	31.8	Very low	42	Very low	240 Å²	240	107 Å²	107	91%	0.906	59%	0.594	S	S	*	*			trans	-83.4	86.5	152.9	-64.7	-172	-172.3	105.1	-1.5	108.4	V623	R621-V623 PolarHBondContact O-N 3.13Å
622	D	30.3	Very low	44.4	Very low	130 Å²	130	106.7 Å²	106.7	70%	0.695	58%	0.578	S	S	*	*			trans	-71.4	94.3	173.7	-79.3	-48.4	0	0	0	110.3	K620 G624	K620-D622 PolarHBondContact O-N 3.41Å; D622-G624 PolarHBondContact O-N 2.93Å
623	V	46.3	Very low	46.8	Very low	106 Å²	106	104.7 Å²	104.7	64%	0.642	56%	0.558	S	S	*	*			trans	-71.5	76.1	170.6	-176.3	0	0	0	0	108.4	R621 K625	R621-V623 PolarHBondContact O-N 3.13Å; V623-K625 PolarHBondContact O-N 3.26Å
624	G	41.5	Very low	48.4	Very low	26 Å²	26	104.8 Å²	104.8	27%	0.268	55%	0.552	S	S	.	*			trans	-60.5	115.1	-176	0	0	0	0	0	112.2	D622 T626	D622-G624 PolarHBondContact O-N 2.93Å; G624-T626 VanDerWaalsContact C-N 3.33Å; G624-T626 PolarHBondContact O-N 3.35Å; G624-T626 PolarHBondContact O-OG1 3.15Å; G624-T626 VanDerWaalsContact O-OG1 3.09Å
625	K	49.8	Very low	51	Low	173 Å²	173	97.2 Å²	97.2	75%	0.752	52%	0.517	S	S	*	.			trans	-63.3	91.1	170.9	-68.3	176.6	-175.6	173.9	0	109.1	V623 I634	V623-K625 PolarHBondContact O-N 3.26Å; K625-I634 HydrophobicContact CB-CG2 3.99Å; K625-I634 HydrophobicContact CG-CG2 4.16Å
626	T	62.2	Low	52.4	Low	16 Å²	16	101.7 Å²	101.7	10%	0.098	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121	-172.8	-58.1	0	0	0	0	109.2	G624 L635 I639 L643	G624-T626 VanDerWaalsContact C-N 3.33Å; G624-T626 PolarHBondContact O-N 3.35Å; G624-T626 PolarHBondContact O-OG1 3.15Å; G624-T626 VanDerWaalsContact O-OG1 3.09Å; T626-L635 PolarHBondContact N-O 2.75Å; T626-L635 VanDerWaalsContact O-CB 3.31Å; T626-L635 WeakPolarHBondContact O-CB 3.49Å; T626-L635 WeakPolarHBondContact O-CG 3.48Å; T626-L635 PolarHBondContact O-N 3.02Å; T626-I639 HydrophobicContact CG2-CG2 3.96Å; T626-L643 HydrophobicContact CG2-CB 4.21Å; T626-L643 HydrophobicContact CG2-CD2 4.29Å
627	L	66.2	Low	54.2	Low	88 Å²	88	97.5 Å²	97.5	46%	0.461	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132	178.9	-57.8	-176.4	0	0	0	110.3	P629 S633 I634	L627-P629 VanDerWaalsContact O-CD 3.32Å; L627-P629 WeakPolarHBondContact O-CD 3.35Å; L627-S633 WeakPolarHBondContact CA-O 3.42Å; L627-I634 HydrophobicContact CD2-CB 4.31Å; L627-I634 HydrophobicContact CD2-CG1 3.53Å
628	C	75.8	Confident	55.9	Low	0 Å²	0	95.3 Å²	95.3	0%	0	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-65.6	124.1	169.2	177.1	0	0	0	0	110.9	L630 C631 F632 S633 L635 L643 H646 H651	C628-L630 PolarHBondContact O-N 3.47Å; C628-L630 PolarHBondContact SG-N 3.44Å; C628-L630 VanDerWaalsContact SG-N 3.42Å; C628-C631 PolarHBondContact O-N 2.97Å; C628-F632 VanDerWaalsContact O-CA 3.24Å; C628-F632 WeakPolarHBondContact O-CA 3.47Å; C628-F632 PolarHBondContact O-N 3.15Å; C628-S633 PolarHBondContact N-O 3.26Å; C628-S633 VanDerWaalsContact N-O 3.14Å; C628-L635 HydrophobicContact CB-CD1 4.39Å; C628-L643 HydrophobicContact CB-CD1 4.24Å; C628-H646 VanDerWaalsContact CB-NE2 3.35Å; C628-H646 WeakPolarHBondContact CB-NE2 3.48Å; C628-H646 PolarHBondContact SG-CD2 2.82Å; C628-H646 PolarHBondContact SG-NE2 2.8Å; C628-H651 PolarHBondContact SG-NE2 2.99Å; C628-H651 VanDerWaalsContact SG-NE2 3.45Å
629	P	70	Confident	57.5	Low	50 Å²	50	95 Å²	95	33%	0.325	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-4.6	178.8	-25.3	37.4	0	0	0	116.1	L627	L627-P629 VanDerWaalsContact O-CD 3.32Å; L627-P629 WeakPolarHBondContact O-CD 3.35Å
630	L	71.2	Confident	59.3	Low	15 Å²	15	87.5 Å²	87.5	8%	0.079	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-20.8	-178.6	-63.3	178.9	0	0	0	114.5	C628 L647 H651 V653 A681 I684	C628-L630 PolarHBondContact O-N 3.47Å; C628-L630 PolarHBondContact SG-N 3.44Å; C628-L630 VanDerWaalsContact SG-N 3.42Å; L630-L647 HydrophobicContact CD1-CD2 3.83Å; L630-L647 HydrophobicContact CG-CD2 4.3Å; L630-H651 WeakPolarHBondContact CB-CE1 3.32Å; L630-H651 WeakPolarHBondContact CB-ND1 3.32Å; L630-H651 HydrophobicContact CD1-CB 3.92Å; L630-V653 HydrophobicContact CD1-CG2 3.81Å; L630-A681 HydrophobicContact CD2-CB 3.99Å; L630-I684 HydrophobicContact CD1-CG2 4.46Å; L630-I684 HydrophobicContact CD2-CB 4.32Å; L630-I684 HydrophobicContact CD2-CD1 4.05Å; L630-I684 HydrophobicContact CD2-CG2 4.24Å
631	C	70.1	Confident	61.4	Low	49 Å²	49	84.9 Å²	84.9	33%	0.331	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.2	-1.5	175.8	67.1	0	0	0	0	114.8	C628 S633 H646 H651	C628-C631 PolarHBondContact O-N 2.97Å; C631-S633 PolarHBondContact O-N 2.91Å; C631-S633 PolarHBondContact SG-OG 2.92Å; C631-H646 PolarHBondContact SG-CE1 3.32Å; C631-H646 PolarHBondContact SG-NE2 3.4Å; C631-H651 PolarHBondContact SG-NE2 3.41Å
632	F	73.3	Confident	63.5	Low	111 Å²	111	74.6 Å²	74.6	49%	0.487	41%	0.412	S	S	.	.			trans	55.7	17	-178.1	-54.4	-82	0	0	0	115.6	Y257 C628	Y257-F632 HydrophobicContact CE1-CE2 4.2Å; C628-F632 VanDerWaalsContact O-CA 3.24Å; C628-F632 WeakPolarHBondContact O-CA 3.47Å; C628-F632 PolarHBondContact O-N 3.15Å
633	S	73.4	Confident	65.7	Low	48 Å²	48	69.4 Å²	69.4	34%	0.336	38%	0.384	S	S	.	.			trans	-62	137.4	171	-59.5	0	0	0	0	110.9	L627 C628 C631 L635 H646	L627-S633 WeakPolarHBondContact CA-O 3.42Å; C628-S633 PolarHBondContact N-O 3.26Å; C628-S633 VanDerWaalsContact N-O 3.14Å; C631-S633 PolarHBondContact O-N 2.91Å; C631-S633 PolarHBondContact SG-OG 2.92Å; S633-L635 PolarHBondContact O-N 3.33Å; S633-H646 PolarHBondContact OG-CE1 2.95Å
634	I	74.3	Confident	67.1	Low	114 Å²	114	66 Å²	66	59%	0.585	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	114.3	175.2	-62.7	163.4	0	0	0	108.9	K625 L627	K625-I634 HydrophobicContact CB-CG2 3.99Å; K625-I634 HydrophobicContact CG-CG2 4.16Å; L627-I634 HydrophobicContact CD2-CB 4.31Å; L627-I634 HydrophobicContact CD2-CG1 3.53Å
635	L	76.8	Confident	68.7	Low	19 Å²	19	70.2 Å²	70.2	10%	0.099	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137.9	175.7	-48.1	-179.9	0	0	0	109.2	T626 C628 S633 L643 H646	T626-L635 PolarHBondContact N-O 2.75Å; T626-L635 VanDerWaalsContact O-CB 3.31Å; T626-L635 WeakPolarHBondContact O-CB 3.49Å; T626-L635 WeakPolarHBondContact O-CG 3.48Å; T626-L635 PolarHBondContact O-N 3.02Å; C628-L635 HydrophobicContact CB-CD1 4.39Å; S633-L635 PolarHBondContact O-N 3.33Å; L635-L643 HydrophobicContact CD1-CB 4.15Å; L635-L643 HydrophobicContact CD1-CD1 3.89Å; L635-H646 HydrophobicContact CD1-CB 3.65Å; L635-H646 HydrophobicContact CD2-CB 3.88Å; L635-H646 WeakPolarHBondContact CD2-ND1 3.44Å; L635-H646 HydrophobicContact CG-CB 4.44Å
636	K	53.9	Low	70.1	Confident	196 Å²	196	62.9 Å²	62.9	85%	0.852	35%	0.349	S	S	*	.			trans	-122	87.5	-170.4	-167.7	-179.9	-177.7	-174.6	0	109.5
637	G	61.1	Low	71.1	Confident	24 Å²	24	62.2 Å²	62.2	25%	0.247	34%	0.344	C	S	.	.	S	Bend	trans	173.2	-168.4	-177.4	0	0	0	0	0	111	I639	G637-I639 PolarHBondContact O-N 2.68Å
638	P	62.4	Low	71.7	Confident	89 Å²	89	63.8 Å²	63.8	58%	0.578	34%	0.344	S	S	*	.			trans	-55.4	135.8	172.5	-24.6	35.1	0	0	0	111.5	S640 D641 S642	P638-S640 PolarHBondContact O-N 2.8Å; P638-D641 PolarHBondContact O-N 3.22Å; P638-S642 WeakPolarHBondContact O-CB 3.17Å; P638-S642 PolarHBondContact O-N 2.8Å; P638-S642 VanDerWaalsContact O-N 3.07Å; P638-S642 PolarHBondContact O-OG 3.03Å
639	I	61.7	Low	71.7	Confident	105 Å²	105	69.1 Å²	69.1	54%	0.538	37%	0.369	S	S	.	.	H	α-helix	trans	-58.7	-46.2	-166.6	-59.9	176.4	0	0	0	112	T626 G637 L643	T626-I639 HydrophobicContact CG2-CG2 3.96Å; G637-I639 PolarHBondContact O-N 2.68Å; I639-L643 VanDerWaalsContact O-CB 3.27Å; I639-L643 WeakPolarHBondContact O-CB 3.31Å
640	S	65.3	Low	71.9	Confident	81 Å²	81	74.6 Å²	74.6	57%	0.566	38%	0.383	S	S	*	.	H	α-helix	trans	-65.8	-56.7	177.4	167.2	0	0	0	0	111.6	P638 L643 A644	P638-S640 PolarHBondContact O-N 2.8Å; S640-L643 PolarHBondContact O-N 2.96Å; S640-A644 WeakPolarHBondContact O-CB 3.45Å; S640-A644 PolarHBondContact O-N 2.85Å
641	D	73	Confident	72	Confident	103 Å²	103	74.9 Å²	74.9	55%	0.551	38%	0.384	S	S	*	.	H	α-helix	trans	-81.9	-35.8	-158.8	-49.8	-32.3	0	0	0	112	P638 L643 A644 H645	P638-D641 PolarHBondContact O-N 3.22Å; D641-L643 VanDerWaalsContact C-N 3.29Å; D641-L643 PolarHBondContact O-N 3.13Å; D641-A644 PolarHBondContact O-N 3.4Å; D641-H645 WeakPolarHBondContact O-CB 3.32Å; D641-H645 PolarHBondContact O-N 3.4Å
642	S	75.5	Confident	72.5	Confident	24 Å²	24	75.4 Å²	75.4	17%	0.168	38%	0.382	C	S	.	.	H	α-helix	trans	-63.4	-37.6	172.2	64.9	0	0	0	0	111.6	P638 H646	P638-S642 WeakPolarHBondContact O-CB 3.17Å; P638-S642 PolarHBondContact O-N 2.8Å; P638-S642 VanDerWaalsContact O-N 3.07Å; P638-S642 PolarHBondContact O-OG 3.03Å; S642-H646 WeakPolarHBondContact O-CB 3.27Å; S642-H646 PolarHBondContact O-N 2.77Å; S642-H646 VanDerWaalsContact O-N 3.08Å
643	L	76.1	Confident	72.8	Confident	20 Å²	20	70.1 Å²	70.1	11%	0.105	36%	0.358	C	S	.	.	H	α-helix	trans	-68.7	-43.9	173.8	-180	59.9	0	0	0	112	T626 C628 L635 I639 S640 D641 H645 H646 L647	T626-L643 HydrophobicContact CG2-CB 4.21Å; T626-L643 HydrophobicContact CG2-CD2 4.29Å; C628-L643 HydrophobicContact CB-CD1 4.24Å; L635-L643 HydrophobicContact CD1-CB 4.15Å; L635-L643 HydrophobicContact CD1-CD1 3.89Å; I639-L643 VanDerWaalsContact O-CB 3.27Å; I639-L643 WeakPolarHBondContact O-CB 3.31Å; S640-L643 PolarHBondContact O-N 2.96Å; D641-L643 VanDerWaalsContact C-N 3.29Å; D641-L643 PolarHBondContact O-N 3.13Å; L643-H645 VanDerWaalsContact C-N 3.34Å; L643-H645 PolarHBondContact O-N 2.75Å; L643-H646 PolarHBondContact O-N 2.87Å; L643-L647 HydrophobicContact CD1-CD1 3.9Å; L643-L647 HydrophobicContact CD1-CG 3.94Å; L643-L647 HydrophobicContact CG-CD1 3.85Å; L643-L647 HydrophobicContact CG-CG 4.34Å; L643-L647 VanDerWaalsContact O-CB 3.28Å; L643-L647 WeakPolarHBondContact O-CB 3.05Å; L643-L647 WeakPolarHBondContact O-CG 3.44Å; L643-L647 PolarHBondContact O-N 3.4Å
644	A	75	Confident	73.3	Confident	36 Å²	36	70 Å²	70	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-63.1	-39	177.5	0	0	0	0	0	112.3	S640 D641 R648	S640-A644 WeakPolarHBondContact O-CB 3.45Å; S640-A644 PolarHBondContact O-N 2.85Å; D641-A644 PolarHBondContact O-N 3.4Å; A644-R648 WeakPolarHBondContact O-CD 3.37Å; A644-R648 VanDerWaalsContact O-CG 3.22Å; A644-R648 WeakPolarHBondContact O-CG 3.45Å; A644-R648 PolarHBondContact O-N 3.18Å
645	H	75.4	Confident	73.6	Confident	113 Å²	113	68.1 Å²	68.1	52%	0.523	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-53.2	175.8	-152.3	-87.5	0	0	0	110.9	D641 L643 L647 R648 E649	D641-H645 WeakPolarHBondContact O-CB 3.32Å; D641-H645 PolarHBondContact O-N 3.4Å; L643-H645 VanDerWaalsContact C-N 3.34Å; L643-H645 PolarHBondContact O-N 2.75Å; H645-L647 VanDerWaalsContact C-N 3.34Å; H645-L647 PolarHBondContact O-N 2.9Å; H645-R648 WeakPolarHBondContact O-CB 3.42Å; H645-R648 PolarHBondContact O-N 3.46Å; H645-R648 VanDerWaalsContact O-N 3.08Å; H645-E649 IonicContact CE1-OE1 2.72Å; H645-E649 PolarHBondContact CE1-OE1 3.22Å; H645-E649 VanDerWaalsContact CE1-OE1 3.24Å; H645-E649 IonicContact CE1-OE2 3.18Å; H645-E649 PolarHBondContact CE1-OE2 3.34Å; H645-E649 IonicContact CG-OE2 2.67Å; H645-E649 IonicContact ND1-OE1 3.9Å; H645-E649 IonicContact ND1-OE2 2.66Å; H645-E649 PolarHBondContact ND1-OE2 3.33Å; H645-E649 PolarHBondContact O-N 3.37Å
646	H	79.8	Confident	73.5	Confident	20 Å²	20	69.6 Å²	69.6	9%	0.093	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-40	179.4	175	94.1	0	0	0	113	C628 C631 S633 L635 S642 L643 R648 R650 H651	C628-H646 VanDerWaalsContact CB-NE2 3.35Å; C628-H646 WeakPolarHBondContact CB-NE2 3.48Å; C628-H646 PolarHBondContact SG-CD2 2.82Å; C628-H646 PolarHBondContact SG-NE2 2.8Å; C631-H646 PolarHBondContact SG-CE1 3.32Å; C631-H646 PolarHBondContact SG-NE2 3.4Å; S633-H646 PolarHBondContact OG-CE1 2.95Å; L635-H646 HydrophobicContact CD1-CB 3.65Å; L635-H646 HydrophobicContact CD2-CB 3.88Å; L635-H646 WeakPolarHBondContact CD2-ND1 3.44Å; L635-H646 HydrophobicContact CG-CB 4.44Å; S642-H646 WeakPolarHBondContact O-CB 3.27Å; S642-H646 PolarHBondContact O-N 2.77Å; S642-H646 VanDerWaalsContact O-N 3.08Å; L643-H646 PolarHBondContact O-N 2.87Å; H646-R648 VanDerWaalsContact C-N 3.32Å; H646-R648 PolarHBondContact O-N 3.47Å; H646-R650 WeakPolarHBondContact O-CB 3.38Å; H646-R650 PolarHBondContact O-N 2.87Å; H646-H651 AromaticContact CD2-CD2 3.69Å; H646-H651 AromaticContact CD2-NE2 3.97Å; H646-H651 AromaticContact NE2-CD2 2.89Å; H646-H651 PolarHBondContact NE2-CD2 3.19Å; H646-H651 AromaticContact NE2-CE1 3.69Å; H646-H651 AromaticContact NE2-NE2 2.41Å; H646-H651 PolarHBondContact NE2-NE2 3.36Å
647	L	81.9	Confident	74.4	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	33%	0.333	C	S	.	.	I	π-helix	trans	-63.9	-36.4	175.7	-76.1	173.2	0	0	0	112.1	L630 L643 H645 H651 Q652 V653 Q655 Y666	L630-L647 HydrophobicContact CD1-CD2 3.83Å; L630-L647 HydrophobicContact CG-CD2 4.3Å; L643-L647 HydrophobicContact CD1-CD1 3.9Å; L643-L647 HydrophobicContact CD1-CG 3.94Å; L643-L647 HydrophobicContact CG-CD1 3.85Å; L643-L647 HydrophobicContact CG-CG 4.34Å; L643-L647 VanDerWaalsContact O-CB 3.28Å; L643-L647 WeakPolarHBondContact O-CB 3.05Å; L643-L647 WeakPolarHBondContact O-CG 3.44Å; L643-L647 PolarHBondContact O-N 3.4Å; H645-L647 VanDerWaalsContact C-N 3.34Å; H645-L647 PolarHBondContact O-N 2.9Å; L647-H651 HydrophobicContact CD2-CB 4.46Å; L647-H651 CarbonylContact O-C 3.52Å; L647-H651 WeakPolarHBondContact O-CA 3.28Å; L647-H651 VanDerWaalsContact O-CB 3.31Å; L647-H651 WeakPolarHBondContact O-CB 3.31Å; L647-H651 PolarHBondContact O-N 3.48Å; L647-Q652 PolarHBondContact O-N 3.19Å; L647-V653 CarbonylContact C-O 3.43Å; L647-V653 VanDerWaalsContact C-O 3.23Å; L647-V653 HydrophobicContact CB-CG2 4.01Å; L647-V653 HydrophobicContact CD2-CG2 3.82Å; L647-V653 HydrophobicContact CG-CG2 4.42Å; L647-V653 PolarHBondContact O-N 3.26Å; L647-Q655 HydrophobicContact CD1-CB 4.34Å; L647-Y666 HydrophobicContact CD1-CD1 4.31Å; L647-Y666 HydrophobicContact CD1-CE1 3.97Å; L647-Y666 HydrophobicContact CD2-CE1 4.47Å
648	R	80.1	Confident	74.5	Confident	121 Å²	121	65.2 Å²	65.2	46%	0.457	33%	0.333	S	S	.	.	I	π-helix	trans	-70.9	-54.8	174.6	-69.5	164.8	-172.2	-96.1	5.6	111	A644 H645 H646 Q652 V653 I654 I669	A644-R648 WeakPolarHBondContact O-CD 3.37Å; A644-R648 VanDerWaalsContact O-CG 3.22Å; A644-R648 WeakPolarHBondContact O-CG 3.45Å; A644-R648 PolarHBondContact O-N 3.18Å; H645-R648 WeakPolarHBondContact O-CB 3.42Å; H645-R648 PolarHBondContact O-N 3.46Å; H645-R648 VanDerWaalsContact O-N 3.08Å; H646-R648 VanDerWaalsContact C-N 3.32Å; H646-R648 PolarHBondContact O-N 3.47Å; R648-Q652 WeakPolarHBondContact O-CA 3.38Å; R648-Q652 PolarHBondContact O-N 2.76Å; R648-Q652 PolarHBondContact O-NE2 3.5Å; R648-V653 PolarHBondContact N-O 2.85Å; R648-I654 HydrophobicContact CG-CG1 4.26Å; R648-I669 HydrophobicContact CG-CD1 4.41Å
649	E	75.8	Confident	74.2	Confident	112 Å²	112	66.4 Å²	66.4	52%	0.523	34%	0.34	S	S	.	.	I	π-helix	trans	-67.5	-58.5	-175	-66.7	179.6	123.9	0	0	113.4	H645 Q652	H645-E649 IonicContact CE1-OE1 2.72Å; H645-E649 PolarHBondContact CE1-OE1 3.22Å; H645-E649 VanDerWaalsContact CE1-OE1 3.24Å; H645-E649 IonicContact CE1-OE2 3.18Å; H645-E649 PolarHBondContact CE1-OE2 3.34Å; H645-E649 IonicContact CG-OE2 2.67Å; H645-E649 IonicContact ND1-OE1 3.9Å; H645-E649 IonicContact ND1-OE2 2.66Å; H645-E649 PolarHBondContact ND1-OE2 3.33Å; H645-E649 PolarHBondContact O-N 3.37Å; E649-Q652 PolarHBondContact O-NE2 3Å
650	R	74.1	Confident	73.8	Confident	166 Å²	166	67.3 Å²	67.3	63%	0.626	35%	0.351	S	S	*	.	I	π-helix	trans	-80.1	-38	-172.4	-60.7	-57.8	-170.6	95.3	-3.5	111.9	H646 R692	H646-R650 WeakPolarHBondContact O-CB 3.38Å; H646-R650 PolarHBondContact O-N 2.87Å; R650-R692 PolarHBondContact O-NH2 3.26Å
651	H	73.8	Confident	73.5	Confident	20 Å²	20	67.1 Å²	67.1	9%	0.093	34%	0.341	C	S	.	.	I	π-helix	trans	-101.8	-18.2	-175.4	-64.9	-79	0	0	0	114.6	C628 L630 C631 H646 L647 V653 L688 R692	C628-H651 PolarHBondContact SG-NE2 2.99Å; C628-H651 VanDerWaalsContact SG-NE2 3.45Å; L630-H651 WeakPolarHBondContact CB-CE1 3.32Å; L630-H651 WeakPolarHBondContact CB-ND1 3.32Å; L630-H651 HydrophobicContact CD1-CB 3.92Å; C631-H651 PolarHBondContact SG-NE2 3.41Å; H646-H651 AromaticContact CD2-CD2 3.69Å; H646-H651 AromaticContact CD2-NE2 3.97Å; H646-H651 AromaticContact NE2-CD2 2.89Å; H646-H651 PolarHBondContact NE2-CD2 3.19Å; H646-H651 AromaticContact NE2-CE1 3.69Å; H646-H651 AromaticContact NE2-NE2 2.41Å; H646-H651 PolarHBondContact NE2-NE2 3.36Å; L647-H651 HydrophobicContact CD2-CB 4.46Å; L647-H651 CarbonylContact O-C 3.52Å; L647-H651 WeakPolarHBondContact O-CA 3.28Å; L647-H651 VanDerWaalsContact O-CB 3.31Å; L647-H651 WeakPolarHBondContact O-CB 3.31Å; L647-H651 PolarHBondContact O-N 3.48Å; H651-V653 HydrophobicContact CB-CG2 3.89Å; H651-V653 PolarHBondContact O-N 3.08Å; H651-L688 WeakPolarHBondContact O-CD1 3.09Å; H651-L688 WeakPolarHBondContact O-CD2 3.18Å; H651-R692 PolarHBondContact O-NH2 3.1Å
652	Q	79.1	Confident	73	Confident	61 Å²	61	70.8 Å²	70.8	29%	0.285	35%	0.352	S	S	.	.			trans	55.4	41	-174.4	-60.3	-67.8	-25.1	0	0	112.3	L647 R648 E649 I669 H670	L647-Q652 PolarHBondContact O-N 3.19Å; R648-Q652 WeakPolarHBondContact O-CA 3.38Å; R648-Q652 PolarHBondContact O-N 2.76Å; R648-Q652 PolarHBondContact O-NE2 3.5Å; E649-Q652 PolarHBondContact O-NE2 3Å; Q652-I669 WeakPolarHBondContact O-CB 3.43Å; Q652-I669 WeakPolarHBondContact O-CG1 3.34Å; Q652-I669 PolarHBondContact O-N 2.79Å; Q652-H670 WeakPolarHBondContact CB-NE2 3.36Å
653	V	80.9	Confident	72.5	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.7	173.5	-58.2	0	0	0	0	111.9	L630 L647 R648 H651 Y666 K667 L688	L630-V653 HydrophobicContact CD1-CG2 3.81Å; L647-V653 CarbonylContact C-O 3.43Å; L647-V653 VanDerWaalsContact C-O 3.23Å; L647-V653 HydrophobicContact CB-CG2 4.01Å; L647-V653 HydrophobicContact CD2-CG2 3.82Å; L647-V653 HydrophobicContact CG-CG2 4.42Å; L647-V653 PolarHBondContact O-N 3.26Å; R648-V653 PolarHBondContact N-O 2.85Å; H651-V653 HydrophobicContact CB-CG2 3.89Å; H651-V653 PolarHBondContact O-N 3.08Å; V653-Y666 HydrophobicContact CG2-CD1 4.31Å; V653-K667 CarbonylContact C-O 3.56Å; V653-K667 WeakPolarHBondContact CA-O 3.28Å; V653-K667 WeakPolarHBondContact CB-O 3.44Å; V653-L688 HydrophobicContact CG1-CD1 3.73Å; V653-L688 HydrophobicContact CG1-CD2 3.7Å; V653-L688 HydrophobicContact CG1-CG 4.24Å
654	I	84.2	Confident	72.1	Confident	46 Å²	46	78 Å²	78	24%	0.236	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.1	173.3	-58.2	172.6	0	0	0	108.3	R648 T656 K667 I669	R648-I654 HydrophobicContact CG-CG1 4.26Å; I654-T656 HydrophobicContact CG2-CG2 4.05Å; I654-K667 PolarHBondContact N-O 2.95Å; I654-K667 PolarHBondContact O-N 3.35Å; I654-I669 HydrophobicContact CD1-CD1 4.29Å; I654-I669 HydrophobicContact CD1-CG1 4.01Å; I654-I669 HydrophobicContact CG1-CD1 3.98Å; I654-I669 HydrophobicContact CG1-CG1 3.86Å
655	Q	78.9	Confident	72.1	Confident	74 Å²	74	76.4 Å²	76.4	35%	0.346	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.4	173.4	-163.9	178.3	57.3	0	0	109.8	L647 L664 T665 Y666	L647-Q655 HydrophobicContact CD1-CB 4.34Å; Q655-L664 HydrophobicContact CG-CD2 4.12Å; Q655-T665 CarbonylContact C-O 3.27Å; Q655-T665 WeakPolarHBondContact CA-O 3.08Å; Q655-Y666 HydrophobicContact CB-CD1 4.21Å; Q655-Y666 HydrophobicContact CB-CE1 4.16Å; Q655-Y666 HydrophobicContact CG-CD1 4.19Å; Q655-Y666 HydrophobicContact CG-CE1 3.84Å; Q655-Y666 PolarHBondContact NE2-OH 2.91Å
656	T	75.5	Confident	72.5	Confident	49 Å²	49	71.9 Å²	71.9	30%	0.301	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	152.3	-177.8	60	0	0	0	0	110.4	I654 T665	I654-T656 HydrophobicContact CG2-CG2 4.05Å; T656-T665 PolarHBondContact N-O 2.65Å; T656-T665 CarbonylContact O-C 3.37Å; T656-T665 WeakPolarHBondContact O-CA 3.23Å; T656-T665 PolarHBondContact O-N 3.12Å; T656-T665 VanDerWaalsContact O-O 3.05Å; T656-T665 PolarHBondContact O-OG1 3.43Å; T656-T665 PolarHBondContact OG1-OG1 2.84Å
657	V	72.5	Confident	72.5	Confident	74 Å²	74	73.9 Å²	73.9	45%	0.448	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.9	178.9	179.8	0	0	0	0	110	P659 K663 L664	V657-P659 WeakPolarHBondContact O-CD 3.4Å; V657-K663 WeakPolarHBondContact CA-O 3.43Å; V657-L664 HydrophobicContact CG2-CD2 4.07Å
658	H	63.3	Low	72.5	Confident	55 Å²	55	73.8 Å²	73.8	26%	0.255	36%	0.356	S	S	.	.			trans	-64.8	124.5	175.3	-163	-139.2	0	0	0	109.9	V660 E661 K662 K663 T665	H658-V660 VanDerWaalsContact C-N 3.27Å; H658-V660 PolarHBondContact O-N 3.15Å; H658-E661 HydrophobicContact CB-CB 4.19Å; H658-E661 IonicContact CE1-OE1 3.36Å; H658-E661 IonicContact ND1-OE1 3.13Å; H658-E661 PolarHBondContact ND1-OE1 3.27Å; H658-K662 WeakPolarHBondContact O-CA 3.35Å; H658-K662 PolarHBondContact O-N 3.01Å; H658-K663 PolarHBondContact N-O 2.83Å; H658-T665 HydrophobicContact CB-CG2 3.69Å
659	P	56.3	Low	72.6	Confident	113 Å²	113	70.8 Å²	70.8	73%	0.734	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-37.8	-175	-27.9	36	0	0	0	113.8	V657	V657-P659 WeakPolarHBondContact O-CD 3.4Å
660	V	53.1	Low	72.7	Confident	125 Å²	125	69.8 Å²	69.8	76%	0.758	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-46.9	-177	-175.6	0	0	0	0	111.9	H658	H658-V660 VanDerWaalsContact C-N 3.27Å; H658-V660 PolarHBondContact O-N 3.15Å
661	E	60	Low	72.7	Confident	77 Å²	77	64.7 Å²	64.7	36%	0.36	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-10.3	-172.6	-72.3	-175.9	-109.2	0	0	114.9	H658 K663	H658-E661 HydrophobicContact CB-CB 4.19Å; H658-E661 IonicContact CE1-OE1 3.36Å; H658-E661 IonicContact ND1-OE1 3.13Å; H658-E661 PolarHBondContact ND1-OE1 3.27Å; E661-K663 HydrophobicContact CB-CB 4.45Å; E661-K663 HydrophobicContact CB-CD 4.15Å; E661-K663 HydrophobicContact CB-CG 4.28Å; E661-K663 PolarHBondContact O-N 2.66Å; E661-K663 WeakPolarHBondContact OE2-CD 3.3Å; E661-K663 WeakPolarHBondContact OE2-CE 3.34Å; E661-K663 IonicContact OE2-NZ 2.76Å; E661-K663 PolarHBondContact OE2-NZ 2.77Å
662	K	61.4	Low	72.8	Confident	179 Å²	179	65.7 Å²	65.7	78%	0.778	34%	0.338	S	S	*	.			trans	56.5	8.5	-173.6	-56.9	-179.8	-178.6	177	0	115.3	H658	H658-K662 WeakPolarHBondContact O-CA 3.35Å; H658-K662 PolarHBondContact O-N 3.01Å
663	K	64.4	Low	72.9	Confident	114 Å²	114	63.9 Å²	63.9	50%	0.496	34%	0.336	S	S	.	.			trans	-84.4	152.8	176.9	-65.9	167.5	-161.7	163.6	0	111.4	V657 H658 E661	V657-K663 WeakPolarHBondContact CA-O 3.43Å; H658-K663 PolarHBondContact N-O 2.83Å; E661-K663 HydrophobicContact CB-CB 4.45Å; E661-K663 HydrophobicContact CB-CD 4.15Å; E661-K663 HydrophobicContact CB-CG 4.28Å; E661-K663 PolarHBondContact O-N 2.66Å; E661-K663 WeakPolarHBondContact OE2-CD 3.3Å; E661-K663 WeakPolarHBondContact OE2-CE 3.34Å; E661-K663 IonicContact OE2-NZ 2.76Å; E661-K663 PolarHBondContact OE2-NZ 2.77Å
664	L	67.6	Low	72.8	Confident	83 Å²	83	67.2 Å²	67.2	44%	0.435	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	141.5	170.1	-66.4	168.3	0	0	0	110.9	Q655 V657 S677	Q655-L664 HydrophobicContact CG-CD2 4.12Å; V657-L664 HydrophobicContact CG2-CD2 4.07Å; L664-S677 WeakPolarHBondContact O-CB 3.49Å; L664-S677 PolarHBondContact O-N 3.42Å; L664-S677 PolarHBondContact O-OG 3.21Å
665	T	75.9	Confident	72.5	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160	179.5	71.1	0	0	0	0	109.3	Q655 T656 H658 V674 Y675 T676	Q655-T665 CarbonylContact C-O 3.27Å; Q655-T665 WeakPolarHBondContact CA-O 3.08Å; T656-T665 PolarHBondContact N-O 2.65Å; T656-T665 CarbonylContact O-C 3.37Å; T656-T665 WeakPolarHBondContact O-CA 3.23Å; T656-T665 PolarHBondContact O-N 3.12Å; T656-T665 VanDerWaalsContact O-O 3.05Å; T656-T665 PolarHBondContact O-OG1 3.43Å; T656-T665 PolarHBondContact OG1-OG1 2.84Å; H658-T665 HydrophobicContact CB-CG2 3.69Å; T665-V674 HydrophobicContact CG2-CG1 4.15Å; T665-V674 WeakPolarHBondContact OG1-CG1 3.45Å; T665-Y675 CarbonylContact C-O 3.58Å; T665-Y675 VanDerWaalsContact CA-O 3.27Å; T665-Y675 WeakPolarHBondContact CA-O 3.3Å; T665-Y675 WeakPolarHBondContact CB-O 3.36Å; T665-T676 HydrophobicContact CG2-CG2 3.88Å
666	Y	83.6	Confident	72.3	Confident	19 Å²	19	64.2 Å²	64.2	8%	0.075	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.8	175.7	-56.8	-78.4	0	0	0	108.9	L647 V653 Q655 Y675 I684	L647-Y666 HydrophobicContact CD1-CD1 4.31Å; L647-Y666 HydrophobicContact CD1-CE1 3.97Å; L647-Y666 HydrophobicContact CD2-CE1 4.47Å; V653-Y666 HydrophobicContact CG2-CD1 4.31Å; Q655-Y666 HydrophobicContact CB-CD1 4.21Å; Q655-Y666 HydrophobicContact CB-CE1 4.16Å; Q655-Y666 HydrophobicContact CG-CD1 4.19Å; Q655-Y666 HydrophobicContact CG-CE1 3.84Å; Q655-Y666 PolarHBondContact NE2-OH 2.91Å; Y666-Y675 PolarHBondContact N-O 2.94Å; Y666-Y675 WeakPolarHBondContact O-CB 3.38Å; Y666-Y675 VanDerWaalsContact O-CD2 3.29Å; Y666-Y675 WeakPolarHBondContact O-CD2 3.33Å; Y666-Y675 PolarHBondContact O-N 2.67Å; Y666-I684 HydrophobicContact CD2-CD1 4.16Å
667	K	79.2	Confident	71.6	Confident	61 Å²	61	64.5 Å²	64.5	27%	0.265	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.2	177.8	-172.2	177.6	-178.7	-174.5	0	109.4	V653 I654 L672 G673 V674	V653-K667 CarbonylContact C-O 3.56Å; V653-K667 WeakPolarHBondContact CA-O 3.28Å; V653-K667 WeakPolarHBondContact CB-O 3.44Å; I654-K667 PolarHBondContact N-O 2.95Å; I654-K667 PolarHBondContact O-N 3.35Å; K667-L672 VanDerWaalsContact CE-O 3.31Å; K667-L672 WeakPolarHBondContact CE-O 3.27Å; K667-G673 CarbonylContact C-O 3.59Å; K667-G673 WeakPolarHBondContact CA-O 3.36Å; K667-V674 HydrophobicContact CB-CG2 4.44Å; K667-V674 HydrophobicContact CD-CG2 4.42Å; K667-V674 HydrophobicContact CG-CG2 4.11Å
668	C	83.8	Confident	70.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	132.4	173.3	174.1	0	0	0	0	110.1	H670 L672 G673 Y675 H687 L688	C668-H670 VanDerWaalsContact C-N 3.32Å; C668-H670 PolarHBondContact SG-N 2.76Å; C668-H670 VanDerWaalsContact SG-N 3.39Å; C668-L672 WeakPolarHBondContact O-CA 3.41Å; C668-L672 PolarHBondContact O-N 3.21Å; C668-G673 PolarHBondContact N-O 3.45Å; C668-Y675 HydrophobicContact CB-CE2 3.87Å; C668-H687 PolarHBondContact SG-NE2 2.79Å; C668-L688 HydrophobicContact CB-CD2 4.13Å
669	I	80.8	Confident	70.7	Confident	58 Å²	58	66.3 Å²	66.3	30%	0.297	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-35.7	179.1	-68.6	174.6	0	0	0	110.8	R648 Q652 I654	R648-I669 HydrophobicContact CG-CD1 4.41Å; Q652-I669 WeakPolarHBondContact O-CB 3.43Å; Q652-I669 WeakPolarHBondContact O-CG1 3.34Å; Q652-I669 PolarHBondContact O-N 2.79Å; I654-I669 HydrophobicContact CD1-CD1 4.29Å; I654-I669 HydrophobicContact CD1-CG1 4.01Å; I654-I669 HydrophobicContact CG1-CD1 3.98Å; I654-I669 HydrophobicContact CG1-CG1 3.86Å
670	H	77.8	Confident	71.1	Confident	91 Å²	91	63.5 Å²	63.5	42%	0.421	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-47.1	-173.8	-54.7	-62.2	0	0	0	114.1	Q652 C668 C691	Q652-H670 WeakPolarHBondContact CB-NE2 3.36Å; C668-H670 VanDerWaalsContact C-N 3.32Å; C668-H670 PolarHBondContact SG-N 2.76Å; C668-H670 VanDerWaalsContact SG-N 3.39Å; H670-C691 HydrophobicContact CB-CB 4.45Å; H670-C691 WeakPolarHBondContact CB-SG 2.87Å
671	C	74.4	Confident	71.7	Confident	59 Å²	59	59 Å²	59	40%	0.399	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-6.7	-178.8	71.9	0	0	0	0	114.8	G673 H687	C671-G673 PolarHBondContact O-N 2.87Å; C671-G673 VanDerWaalsContact O-N 3.1Å; C671-G673 PolarHBondContact SG-N 3.22Å; C671-H687 PolarHBondContact SG-CE1 2.77Å; C671-H687 PolarHBondContact SG-NE2 2.81Å
672	L	76.3	Confident	71.6	Confident	40 Å²	40	59.2 Å²	59.2	21%	0.209	32%	0.321	C	S	.	.			trans	61.8	7	-172	-51.1	178.6	0	0	0	115.6	K667 C668	K667-L672 VanDerWaalsContact CE-O 3.31Å; K667-L672 WeakPolarHBondContact CE-O 3.27Å; C668-L672 WeakPolarHBondContact O-CA 3.41Å; C668-L672 PolarHBondContact O-N 3.21Å
673	G	80.3	Confident	72	Confident	23 Å²	23	53.7 Å²	53.7	24%	0.237	30%	0.302	C	S	.	.			trans	-60.4	139.7	173.5	0	0	0	0	0	112	K667 C668 C671 Y675	K667-G673 CarbonylContact C-O 3.59Å; K667-G673 WeakPolarHBondContact CA-O 3.36Å; C668-G673 PolarHBondContact N-O 3.45Å; C671-G673 PolarHBondContact O-N 2.87Å; C671-G673 VanDerWaalsContact O-N 3.1Å; C671-G673 PolarHBondContact SG-N 3.22Å; G673-Y675 VanDerWaalsContact O-CE2 3.25Å; G673-Y675 WeakPolarHBondContact O-CE2 3.42Å
674	V	79.1	Confident	72.3	Confident	70 Å²	70	48.4 Å²	48.4	42%	0.424	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.6	-173.8	179.2	0	0	0	0	109.7	T665 K667	T665-V674 HydrophobicContact CG2-CG1 4.15Å; T665-V674 WeakPolarHBondContact OG1-CG1 3.45Å; K667-V674 HydrophobicContact CB-CG2 4.44Å; K667-V674 HydrophobicContact CD-CG2 4.42Å; K667-V674 HydrophobicContact CG-CG2 4.11Å
675	Y	78.7	Confident	72.3	Confident	28 Å²	28	47.1 Å²	47.1	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	107.1	-179.8	-56.3	-78	0	0	0	109.2	T665 Y666 C668 G673 M679 I684 H687	T665-Y675 CarbonylContact C-O 3.58Å; T665-Y675 VanDerWaalsContact CA-O 3.27Å; T665-Y675 WeakPolarHBondContact CA-O 3.3Å; T665-Y675 WeakPolarHBondContact CB-O 3.36Å; Y666-Y675 PolarHBondContact N-O 2.94Å; Y666-Y675 WeakPolarHBondContact O-CB 3.38Å; Y666-Y675 VanDerWaalsContact O-CD2 3.29Å; Y666-Y675 WeakPolarHBondContact O-CD2 3.33Å; Y666-Y675 PolarHBondContact O-N 2.67Å; C668-Y675 HydrophobicContact CB-CE2 3.87Å; G673-Y675 VanDerWaalsContact O-CE2 3.25Å; G673-Y675 WeakPolarHBondContact O-CE2 3.42Å; Y675-M679 HydrophobicContact CD1-CE 3.78Å; Y675-M679 HydrophobicContact CD1-SD 3.73Å; Y675-M679 HydrophobicContact CE1-CE 4.33Å; Y675-M679 HydrophobicContact CG-SD 4.41Å; Y675-I684 HydrophobicContact CD1-CG1 4.11Å; Y675-I684 HydrophobicContact CD2-CG2 4.2Å; Y675-I684 HydrophobicContact CG-CB 4.48Å; Y675-I684 HydrophobicContact CG-CD1 4.37Å; Y675-I684 HydrophobicContact CG-CG1 3.91Å; Y675-I684 HydrophobicContact CG-CG2 4.15Å; Y675-H687 HydrophobicContact CE1-CB 4.27Å; Y675-H687 AromaticContact CE2-CD2 3.63Å; Y675-H687 AromaticContact CZ-CD2 3.4Å; Y675-H687 AromaticContact CZ-CG 3.59Å; Y675-H687 AromaticContact CZ-NE2 3.99Å; Y675-H687 PolarHBondContact OH-CD2 3.45Å; Y675-H687 PolarHBondContact OH-CE1 2.89Å; Y675-H687 PolarHBondContact OH-ND1 3.24Å; Y675-H687 PolarHBondContact OH-NE2 2.78Å
676	T	74.9	Confident	72.2	Confident	30 Å²	30	51.1 Å²	51.1	18%	0.184	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	145.4	175.1	40.2	0	0	0	0	110.9	T665 N678 M679	T665-T676 HydrophobicContact CG2-CG2 3.88Å; T676-N678 WeakPolarHBondContact CB-OD1 3.35Å; T676-N678 PolarHBondContact O-N 3.21Å; T676-N678 PolarHBondContact O-OD1 3.2Å; T676-N678 PolarHBondContact OG1-OD1 3.39Å; T676-M679 WeakPolarHBondContact O-CB 3.3Å; T676-M679 PolarHBondContact O-N 3.3Å
677	S	59.7	Low	71.8	Confident	54 Å²	54	52.2 Å²	52.2	38%	0.378	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	4.8	-176.8	48.1	0	0	0	0	115.5	L664	L664-S677 WeakPolarHBondContact O-CB 3.49Å; L664-S677 PolarHBondContact O-N 3.42Å; L664-S677 PolarHBondContact O-OG 3.21Å
678	N	56.5	Low	71.6	Confident	98 Å²	98	49.5 Å²	49.5	52%	0.524	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-22.8	165.1	60.8	-7.9	0	0	0	113.3	R254 T676	R254-N678 PolarHBondContact NH2-O 3.1Å; T676-N678 WeakPolarHBondContact CB-OD1 3.35Å; T676-N678 PolarHBondContact O-N 3.21Å; T676-N678 PolarHBondContact O-OD1 3.2Å; T676-N678 PolarHBondContact OG1-OD1 3.39Å
679	M	61.8	Low	70.9	Confident	69 Å²	69	53.9 Å²	53.9	34%	0.34	32%	0.316	S	S	.	.	S	Bend	trans	-67.9	141.8	177.5	-63.1	-175.1	71.7	0	0	111.2	Y675 T676 T683 I684	Y675-M679 HydrophobicContact CD1-CE 3.78Å; Y675-M679 HydrophobicContact CD1-SD 3.73Å; Y675-M679 HydrophobicContact CE1-CE 4.33Å; Y675-M679 HydrophobicContact CG-SD 4.41Å; T676-M679 WeakPolarHBondContact O-CB 3.3Å; T676-M679 PolarHBondContact O-N 3.3Å; M679-T683 HydrophobicContact CE-CG2 3.68Å; M679-I684 HydrophobicContact CB-CG1 4.46Å
680	T	64.7	Low	70	Confident	54 Å²	54	57.4 Å²	57.4	33%	0.331	33%	0.331	S	S	.	.			trans	-67	139	178.9	54	0	0	0	0	111.1	S682 T683 I684	T680-S682 PolarHBondContact O-N 3.47Å; T680-S682 VanDerWaalsContact O-N 3.1Å; T680-T683 WeakPolarHBondContact O-CB 3.5Å; T680-T683 PolarHBondContact O-N 3.31Å; T680-T683 PolarHBondContact OG1-OG1 2.8Å; T680-I684 PolarHBondContact O-N 3.08Å
681	A	65.6	Low	69.5	Low	31 Å²	31	54 Å²	54	26%	0.256	32%	0.318	S	S	.	.	H	α-helix	trans	-55.9	-29.6	177.1	0	0	0	0	0	112.2	L630 I684 T685	L630-A681 HydrophobicContact CD2-CB 3.99Å; A681-I684 PolarHBondContact O-N 3.37Å; A681-T685 VanDerWaalsContact O-CB 3.28Å; A681-T685 WeakPolarHBondContact O-CB 3.3Å; A681-T685 PolarHBondContact O-N 3.47Å; A681-T685 PolarHBondContact O-OG1 2.94Å
682	S	58.1	Low	69	Low	81 Å²	81	56.2 Å²	56.2	57%	0.566	32%	0.318	S	S	*	.	H	α-helix	trans	-59.1	-41.6	171.2	-42.2	0	0	0	0	113.1	T680 L686	T680-S682 PolarHBondContact O-N 3.47Å; T680-S682 VanDerWaalsContact O-N 3.1Å; S682-L686 VanDerWaalsContact O-CB 3.23Å; S682-L686 WeakPolarHBondContact O-CB 3.33Å; S682-L686 PolarHBondContact O-N 2.96Å
683	T	69.3	Low	67.7	Low	63 Å²	63	57.3 Å²	57.3	39%	0.387	34%	0.339	S	S	.	.	H	α-helix	trans	-70.4	-41.7	178.3	-55.2	0	0	0	0	111.1	M679 T680 H687	M679-T683 HydrophobicContact CE-CG2 3.68Å; T680-T683 WeakPolarHBondContact O-CB 3.5Å; T680-T683 PolarHBondContact O-N 3.31Å; T680-T683 PolarHBondContact OG1-OG1 2.8Å; T683-H687 WeakPolarHBondContact O-CB 3.19Å; T683-H687 PolarHBondContact O-N 3.27Å
684	I	70.1	Confident	66.2	Low	3 Å²	3	62 Å²	62	2%	0.015	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-45	175.6	-53.2	-179.4	0	0	0	109.8	L630 Y666 Y675 M679 T680 A681 H687 L688	L630-I684 HydrophobicContact CD1-CG2 4.46Å; L630-I684 HydrophobicContact CD2-CB 4.32Å; L630-I684 HydrophobicContact CD2-CD1 4.05Å; L630-I684 HydrophobicContact CD2-CG2 4.24Å; Y666-I684 HydrophobicContact CD2-CD1 4.16Å; Y675-I684 HydrophobicContact CD1-CG1 4.11Å; Y675-I684 HydrophobicContact CD2-CG2 4.2Å; Y675-I684 HydrophobicContact CG-CB 4.48Å; Y675-I684 HydrophobicContact CG-CD1 4.37Å; Y675-I684 HydrophobicContact CG-CG1 3.91Å; Y675-I684 HydrophobicContact CG-CG2 4.15Å; M679-I684 HydrophobicContact CB-CG1 4.46Å; T680-I684 PolarHBondContact O-N 3.08Å; A681-I684 PolarHBondContact O-N 3.37Å; I684-H687 PolarHBondContact O-N 3.44Å; I684-L688 HydrophobicContact CG2-CD1 3.92Å; I684-L688 HydrophobicContact CG2-CG 4.5Å; I684-L688 WeakPolarHBondContact O-CB 3.43Å; I684-L688 WeakPolarHBondContact O-CD1 3.44Å; I684-L688 WeakPolarHBondContact O-CG 3.36Å; I684-L688 PolarHBondContact O-N 3.45Å
685	T	68.4	Low	64.4	Low	56 Å²	56	61.7 Å²	61.7	34%	0.344	37%	0.373	S	S	.	.	H	α-helix	trans	-67.2	-43.4	179.5	-56.5	0	0	0	0	112.1	A681 H687 L688 V689	A681-T685 VanDerWaalsContact O-CB 3.28Å; A681-T685 WeakPolarHBondContact O-CB 3.3Å; A681-T685 PolarHBondContact O-N 3.47Å; A681-T685 PolarHBondContact O-OG1 2.94Å; T685-H687 VanDerWaalsContact C-N 3.32Å; T685-H687 PolarHBondContact O-N 3.12Å; T685-L688 PolarHBondContact O-N 3.17Å; T685-L688 VanDerWaalsContact O-N 3.16Å; T685-V689 HydrophobicContact CG2-CG2 4.46Å; T685-V689 WeakPolarHBondContact O-CG2 3.44Å; T685-V689 PolarHBondContact O-N 2.85Å
686	L	73.5	Confident	62.4	Low	86 Å²	86	69.8 Å²	69.8	45%	0.45	41%	0.409	S	S	.	.	H	α-helix	trans	-58.8	-45.1	174.6	178.8	63	0	0	0	111.1	S682 V689 H690	S682-L686 VanDerWaalsContact O-CB 3.23Å; S682-L686 WeakPolarHBondContact O-CB 3.33Å; S682-L686 PolarHBondContact O-N 2.96Å; L686-V689 PolarHBondContact O-N 3.29Å; L686-H690 PolarHBondContact O-CD2 3.48Å; L686-H690 VanDerWaalsContact O-CD2 3.28Å; L686-H690 PolarHBondContact O-N 3.33Å; L686-H690 VanDerWaalsContact O-N 3.12Å
687	H	74.5	Confident	60.4	Low	42 Å²	42	73.6 Å²	73.6	19%	0.194	44%	0.436	C	S	.	.	H	α-helix	trans	-58.1	-49.8	172.7	166.5	63.7	0	0	0	111.5	C668 C671 Y675 T683 I684 T685 V689 H690 C691	C668-H687 PolarHBondContact SG-NE2 2.79Å; C671-H687 PolarHBondContact SG-CE1 2.77Å; C671-H687 PolarHBondContact SG-NE2 2.81Å; Y675-H687 HydrophobicContact CE1-CB 4.27Å; Y675-H687 AromaticContact CE2-CD2 3.63Å; Y675-H687 AromaticContact CZ-CD2 3.4Å; Y675-H687 AromaticContact CZ-CG 3.59Å; Y675-H687 AromaticContact CZ-NE2 3.99Å; Y675-H687 PolarHBondContact OH-CD2 3.45Å; Y675-H687 PolarHBondContact OH-CE1 2.89Å; Y675-H687 PolarHBondContact OH-ND1 3.24Å; Y675-H687 PolarHBondContact OH-NE2 2.78Å; T683-H687 WeakPolarHBondContact O-CB 3.19Å; T683-H687 PolarHBondContact O-N 3.27Å; I684-H687 PolarHBondContact O-N 3.44Å; T685-H687 VanDerWaalsContact C-N 3.32Å; T685-H687 PolarHBondContact O-N 3.12Å; H687-V689 VanDerWaalsContact C-N 3.33Å; H687-V689 PolarHBondContact O-N 3.36Å; H687-H690 PolarHBondContact O-N 2.92Å; H687-C691 VanDerWaalsContact CE1-CB 3.46Å; H687-C691 WeakPolarHBondContact CE1-CB 3.31Å; H687-C691 WeakPolarHBondContact O-CB 3.25Å; H687-C691 PolarHBondContact O-N 3.06Å
688	L	75.8	Confident	59.1	Low	4 Å²	4	80.5 Å²	80.5	2%	0.021	46%	0.463	C	S	.	.	H	α-helix	trans	-62.6	-37.4	-177.7	-71.5	164.5	0	0	0	112.8	H651 V653 C668 I684 T685 C691 R692	H651-L688 WeakPolarHBondContact O-CD1 3.09Å; H651-L688 WeakPolarHBondContact O-CD2 3.18Å; V653-L688 HydrophobicContact CG1-CD1 3.73Å; V653-L688 HydrophobicContact CG1-CD2 3.7Å; V653-L688 HydrophobicContact CG1-CG 4.24Å; C668-L688 HydrophobicContact CB-CD2 4.13Å; I684-L688 HydrophobicContact CG2-CD1 3.92Å; I684-L688 HydrophobicContact CG2-CG 4.5Å; I684-L688 WeakPolarHBondContact O-CB 3.43Å; I684-L688 WeakPolarHBondContact O-CD1 3.44Å; I684-L688 WeakPolarHBondContact O-CG 3.36Å; I684-L688 PolarHBondContact O-N 3.45Å; T685-L688 PolarHBondContact O-N 3.17Å; T685-L688 VanDerWaalsContact O-N 3.16Å; L688-C691 PolarHBondContact O-N 2.82Å; L688-R692 WeakPolarHBondContact O-CB 3.3Å; L688-R692 WeakPolarHBondContact O-CD 3.32Å; L688-R692 WeakPolarHBondContact O-CG 3.11Å; L688-R692 PolarHBondContact O-N 3.33Å
689	V	68.1	Low	57.7	Low	92 Å²	92	83.5 Å²	83.5	56%	0.558	48%	0.479	S	S	*	.	H	α-helix	trans	-63	-52.1	174.6	169.6	0	0	0	0	110.5	T685 L686 H687 C691 R692 G693	T685-V689 HydrophobicContact CG2-CG2 4.46Å; T685-V689 WeakPolarHBondContact O-CG2 3.44Å; T685-V689 PolarHBondContact O-N 2.85Å; L686-V689 PolarHBondContact O-N 3.29Å; H687-V689 VanDerWaalsContact C-N 3.33Å; H687-V689 PolarHBondContact O-N 3.36Å; V689-C691 VanDerWaalsContact C-N 3.31Å; V689-C691 PolarHBondContact O-N 3.49Å; V689-R692 PolarHBondContact O-N 3.47Å; V689-G693 PolarHBondContact O-N 2.91Å
690	H	63	Low	56.2	Low	132 Å²	132	83 Å²	83	61%	0.611	49%	0.492	S	S	*	.	H	α-helix	trans	-61.4	-39.6	176	-78.3	-68.6	0	0	0	112.4	L686 H687 R692 G693 V694	L686-H690 PolarHBondContact O-CD2 3.48Å; L686-H690 VanDerWaalsContact O-CD2 3.28Å; L686-H690 PolarHBondContact O-N 3.33Å; L686-H690 VanDerWaalsContact O-N 3.12Å; H687-H690 PolarHBondContact O-N 2.92Å; H690-R692 VanDerWaalsContact C-N 3.34Å; H690-R692 PolarHBondContact O-N 3.3Å; H690-G693 PolarHBondContact O-N 3.38Å; H690-V694 VanDerWaalsContact O-CG2 3.22Å; H690-V694 WeakPolarHBondContact O-CG2 3.36Å
691	C	67.8	Low	54.4	Low	20 Å²	20	90 Å²	90	14%	0.135	52%	0.521	C	S	.	.	H	α-helix	trans	-72.6	-25.2	-176.9	-155.4	0	0	0	0	113.7	H670 H687 L688 V689	H670-C691 HydrophobicContact CB-CB 4.45Å; H670-C691 WeakPolarHBondContact CB-SG 2.87Å; H687-C691 VanDerWaalsContact CE1-CB 3.46Å; H687-C691 WeakPolarHBondContact CE1-CB 3.31Å; H687-C691 WeakPolarHBondContact O-CB 3.25Å; H687-C691 PolarHBondContact O-N 3.06Å; L688-C691 PolarHBondContact O-N 2.82Å; V689-C691 VanDerWaalsContact C-N 3.31Å; V689-C691 PolarHBondContact O-N 3.49Å
692	R	62.8	Low	52.8	Low	105 Å²	105	94.7 Å²	94.7	40%	0.396	54%	0.541	S	S	.	.	H	α-helix	trans	-73.4	-32.5	170.1	-73.9	165.4	-176.7	-166.3	0.6	112	R650 H651 L688 V689 H690 V694 G695	R650-R692 PolarHBondContact O-NH2 3.26Å; H651-R692 PolarHBondContact O-NH2 3.1Å; L688-R692 WeakPolarHBondContact O-CB 3.3Å; L688-R692 WeakPolarHBondContact O-CD 3.32Å; L688-R692 WeakPolarHBondContact O-CG 3.11Å; L688-R692 PolarHBondContact O-N 3.33Å; V689-R692 PolarHBondContact O-N 3.47Å; H690-R692 VanDerWaalsContact C-N 3.34Å; H690-R692 PolarHBondContact O-N 3.3Å; R692-V694 VanDerWaalsContact C-N 3.29Å; R692-V694 PolarHBondContact O-N 3.44Å; R692-G695 PolarHBondContact O-N 3.33Å
693	G	49.6	Very low	51.5	Low	63 Å²	63	96 Å²	96	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-65	-26.9	178.3	0	0	0	0	0	114.5	V689 H690 G695	V689-G693 PolarHBondContact O-N 2.91Å; H690-G693 PolarHBondContact O-N 3.38Å; G693-G695 VanDerWaalsContact C-N 3.3Å; G693-G695 PolarHBondContact O-N 2.86Å
694	V	48.5	Very low	49.9	Very low	122 Å²	122	99.9 Å²	99.9	74%	0.739	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-1.5	-178.3	-140	0	0	0	0	113.9	H690 R692	H690-V694 VanDerWaalsContact O-CG2 3.22Å; H690-V694 WeakPolarHBondContact O-CG2 3.36Å; R692-V694 VanDerWaalsContact C-N 3.29Å; R692-V694 PolarHBondContact O-N 3.44Å
695	G	40.9	Very low	48	Very low	62 Å²	62	105.3 Å²	105.3	64%	0.639	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	7.8	-170.8	0	0	0	0	0	116.1	R692 G693	R692-G695 PolarHBondContact O-N 3.33Å; G693-G695 VanDerWaalsContact C-N 3.3Å; G693-G695 PolarHBondContact O-N 2.86Å
696	K	37.8	Very low	46	Very low	198 Å²	198	105.8 Å²	105.8	86%	0.861	60%	0.597	S	S	*	*			trans	-140.7	69.4	-174.3	-72.3	-165.4	173.9	-168.8	0	113.3
697	S	31.5	Very low	43.9	Very low	110 Å²	110	110.8 Å²	110.8	77%	0.769	62%	0.618	S	S	*	*	S	Bend	trans	-146.3	114.1	161.7	57.4	0	0	0	0	110.5
698	Q	32.5	Very low	41.7	Very low	199 Å²	199	113.8 Å²	113.8	93%	0.93	64%	0.644	S	S	*	*			trans	49.5	120.2	159.2	-151.2	152.4	3.3	0	0	120.6
699	N	27	Very low	39.3	Very low	161 Å²	161	118.5 Å²	118.5	86%	0.861	68%	0.677	S	S	*	*			trans	-69.8	144.6	170.5	-179.1	30.8	0	0	0	112.7
700	G	29.9	Very low	37.5	Very low	60 Å²	60	125.7 Å²	125.7	62%	0.619	69%	0.694	S	S	*	*			trans	90.9	81.7	145.2	0	0	0	0	0	120.3
701	Q	28.5	Very low	35.8	Very low	199 Å²	199	125.6 Å²	125.6	93%	0.93	70%	0.702	S	S	*	*				-179.6	136.6	109.2	-95.1	177.8	9.8	0	0	112.1
702	D	30.5	Very low	33.9	Very low	130 Å²	130	129.8 Å²	129.8	70%	0.695	73%	0.732	S	S	*	*			trans	-79.2	163.5	171.3	-99.1	-80.2	0	0	0	109.7
703	T	32.4	Very low	32.3	Very low	110 Å²	110	133.3 Å²	133.3	68%	0.675	75%	0.753	S	S	*	*				-175.4	111.5	69.1	-59.3	0	0	0	0	113.7
704	R	35.6	Very low	31.1	Very low	143 Å²	143	135.6 Å²	135.6	54%	0.54	76%	0.759	S	S	.	*			trans	61.4	169.3	145.6	-61.2	177.8	-168.1	-158.1	1.9	117.7	M558	M558-R704 PolarHBondContact SD-NH1 2.95Å; M558-R704 VanDerWaalsContact SD-NH1 3.45Å; M558-R704 PolarHBondContact SD-NH2 3Å; M558-R704 VanDerWaalsContact SD-NH2 3.4Å
705	V	30.4	Very low	30.2	Very low	117 Å²	117	138.5 Å²	138.5	71%	0.709	77%	0.765	S	S	*	*			cis	-152.6	129.9	-21.7	127.8	0	0	0	0	104.4
706	A	26.3	Very low	29.8	Very low	67 Å²	67	141.2 Å²	141.2	55%	0.554	77%	0.774	S	S	*	*			cis	84.5	87.4	47.8	0	0	0	0	0	115.7
707	Q	29.4	Very low	29.4	Very low	190 Å²	190	138 Å²	138	89%	0.888	78%	0.776	S	S	*	*			trans	-169.5	157.8	151.3	-104	-174.2	59.7	0	0	108.7
708	S	26.8	Very low	29.2	Very low	106 Å²	106	137 Å²	137	74%	0.741	78%	0.775	S	S	*	*			cis	-150.5	166.2	-19.2	-163.8	0	0	0	0	109.9
709	S	25.8	Very low	29	Very low	103 Å²	103	134.9 Å²	134.9	72%	0.72	77%	0.769	S	S	*	*			trans	-98.6	148.9	178.8	57.3	0	0	0	0	113.2
710	R	31.7	Very low	28.9	Very low	242 Å²	242	136.4 Å²	136.4	91%	0.913	77%	0.768	S	S	*	*			trans	175.8	150.6	144.9	-100.4	169.8	-174.2	-162.6	1.7	109.8
711	V	27	Very low	28.9	Very low	130 Å²	130	144.7 Å²	144.7	79%	0.788	78%	0.781	S	S	*	*			cis	-148.7	159.6	-15.1	85.1	0	0	0	0	109.4
712	S	27.7	Very low	29	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	78%	0.778	S	S	*	*			trans	-92.6	146.4	168.1	-52.5	0	0	0	0	110.7
713	Q	28.6	Very low	28.7	Very low	179 Å²	179	138.3 Å²	138.3	84%	0.836	78%	0.775	S	S	*	*			trans	-146.5	132.8	146.3	-134.6	172.8	17.7	0	0	112.6
714	S	25.2	Very low	28.3	Very low	110 Å²	110	142.5 Å²	142.5	77%	0.769	78%	0.784	S	S	*	*			trans	-143.2	121.9	169.1	56.1	0	0	0	0	106.6
715	Q	29.8	Very low	27.7	Very low	183 Å²	183	142.1 Å²	142.1	86%	0.855	79%	0.792	S	S	*	*			trans	-132.7	154.2	166.6	-76.7	-164.4	-9	0	0	109.4
716	S	30.7	Very low	27.4	Very low	120 Å²	120	141.7 Å²	141.7	84%	0.839	80%	0.795	S	S	*	*			trans	-142.5	113.2	-166.8	55.5	0	0	0	0	110.8
717	S	29.5	Very low	27.3	Very low	130 Å²	130	143.5 Å²	143.5	91%	0.909	80%	0.804	S	S	*	*			trans	-161.9	149.6	163.3	49	0	0	0	0	108.3
718	A	27.3	Very low	27	Very low	90 Å²	90	141.7 Å²	141.7	74%	0.744	80%	0.8	S	S	*	*			trans	-117.9	150.6	-172.5	0	0	0	0	0	112
719	L	28.8	Very low	27.2	Very low	154 Å²	154	142.2 Å²	142.2	81%	0.806	80%	0.799	S	S	*	*				172.4	145	116.3	-92.7	163.9	0	0	0	113.7
720	K	25.6	Very low	27.1	Very low	192 Å²	192	142.7 Å²	142.7	84%	0.835	80%	0.802	S	S	*	*			trans	71.8	123.2	159.4	-64.8	172	-179.4	-176.6	0	119.9
721	R	29.6	Very low	27.4	Very low	235 Å²	235	135.6 Å²	135.6	89%	0.887	80%	0.795	S	S	*	*			trans	-84	177.2	152.4	-53.1	179.8	175.7	164.8	-4.8	109.3
722	P	31.1	Very low	27.8	Very low	134 Å²	134	135.3 Å²	135.3	87%	0.87	80%	0.796	S	S	*	*				-114.1	176.2	55.3	39.4	-34.5	0	0	0	113.6
723	G	23.4	Very low	27.9	Very low	61 Å²	61	139.1 Å²	139.1	63%	0.629	80%	0.799	S	S	*	*			cis	151.6	134.9	-8.4	0	0	0	0	0	112.6
724	F	24.9	Very low	28	Very low	198 Å²	198	141.5 Å²	141.5	87%	0.868	80%	0.8	S	S	*	*			trans	63.7	155.2	-175	-99.4	-131.3	0	0	0	115.3
725	D	22.1	Very low	28.1	Very low	134 Å²	134	147.8 Å²	147.8	72%	0.717	81%	0.807	S	S	*	*			cis	-135.7	-174.4	5	-151.2	-20	0	0	0	112.1
726	S	24.1	Very low	28.5	Very low	108 Å²	108	150.7 Å²	150.7	76%	0.755	81%	0.81	S	S	*	*			trans	-102.7	-159.5	-163	-158.6	0	0	0	0	115.7
727	S	24.9	Very low	28.6	Very low	106 Å²	106	151.2 Å²	151.2	74%	0.741	81%	0.811	S	S	*	*			trans	101	79.6	157.6	-54.8	0	0	0	0	119.7
728	D	23.1	Very low	28.6	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	80%	0.799	S	S	*	*				65.6	-173.5	119	-127.5	-75.6	0	0	0	122.6
729	T	29.6	Very low	29.2	Very low	117 Å²	117	149.9 Å²	149.9	72%	0.718	80%	0.803	S	S	*	*			trans	-99.1	151.9	-152.8	52.9	0	0	0	0	114
730	S	25.2	Very low	29.6	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	80%	0.804	S	S	*	*				172.4	155.7	119.4	51	0	0	0	0	111.6
731	A	38.1	Very low	29.7	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	80%	0.797	S	S	*	*			trans	-133.2	108	172.9	0	0	0	0	0	110.9
732	P	34.7	Very low	29.6	Very low	125 Å²	125	141.1 Å²	141.1	81%	0.812	80%	0.8	S	S	*	*			trans	-79.8	160.1	168.7	-14.1	30.9	0	0	0	112.4
733	K	29.2	Very low	29.5	Very low	188 Å²	188	146.7 Å²	146.7	82%	0.817	80%	0.804	S	S	*	*			trans	-107.6	153.9	-170.1	-69.3	166.7	179.8	160.5	0	112.8
734	R	31.8	Very low	29.6	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.868	82%	0.815	S	S	*	*			trans	67.5	134.8	151	-72.2	165.4	167.4	-160.8	-3.4	118.7
735	R	26.9	Very low	29.8	Very low	242 Å²	242	147.6 Å²	147.6	91%	0.913	81%	0.812	S	S	*	*				-157.9	138.6	94.7	-97.8	160.4	-168.5	-102.5	3.4	111.7
736	R	37.5	Very low	30.9	Very low	243 Å²	243	145.9 Å²	145.9	92%	0.917	81%	0.808	S	S	*	*			trans	-102.2	146.4	157.4	-80.4	-176.4	175.2	174.4	-2.5	107.3
737	P	33	Very low	31.4	Very low	132 Å²	132	150.5 Å²	150.5	86%	0.857	81%	0.809	S	S	*	*			trans	-119.9	147.7	131.4	-5.5	26	0	0	0	113.4
738	G	29.2	Very low	31.7	Very low	65 Å²	65	150.8 Å²	150.8	67%	0.67	80%	0.802	S	S	*	*			trans	-139.5	-155.3	152.7	0	0	0	0	0	105.8
739	P	41.3	Very low	32.1	Very low	127 Å²	127	150.4 Å²	150.4	83%	0.825	80%	0.799	S	S	*	*			cis	-96.6	-145.2	-6.7	44.3	-36.5	0	0	0	108.3
740	P	36.5	Very low	32.1	Very low	126 Å²	126	152.1 Å²	152.1	82%	0.818	80%	0.804	S	S	*	*			cis	-128.5	-176.3	-16.6	40.6	-24	0	0	0	114.3
741	G	26.5	Very low	32.2	Very low	68 Å²	68	149.9 Å²	149.9	70%	0.701	80%	0.799	S	S	*	*			trans	175.2	128.1	163.7	0	0	0	0	0	115.6
742	Q	29.4	Very low	32	Very low	202 Å²	202	151.8 Å²	151.8	94%	0.944	80%	0.804	S	S	*	*			trans	81.9	134.6	158.6	-57.9	-175.9	-6.5	0	0	121.5
743	R	27.9	Very low	31.9	Very low	252 Å²	252	150.9 Å²	150.9	95%	0.951	80%	0.8	S	S	*	*			trans	-137	165.3	158.4	-94.9	-174.8	172.6	178.1	-1.8	106.5
744	A	24.8	Very low	32	Very low	103 Å²	103	152.5 Å²	152.5	85%	0.851	80%	0.803	S	S	*	*			trans	98.5	107.5	171.9	0	0	0	0	0	117.3
745	H	30.7	Very low	31.8	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.806	80%	0.798	S	S	*	*			trans	-83.9	-174.7	156.7	-148.1	-131.2	0	0	0	107.3
746	P	44.4	Very low	32.2	Very low	99 Å²	99	145.7 Å²	145.7	64%	0.643	79%	0.789	S	S	*	*			cis	-156.9	179.7	22.2	49.2	-28.4	0	0	0	121.2
747	R	34.7	Very low	32.2	Very low	205 Å²	205	139.3 Å²	139.3	77%	0.774	77%	0.769	S	S	*	*			trans	68.1	154.2	156.6	-62.8	-166.5	125.4	136	4.8	119.1
748	D	31.5	Very low	32.3	Very low	112 Å²	112	137.8 Å²	137.8	60%	0.599	75%	0.754	S	S	*	*			cis	-158.6	158	-24.8	-90.7	-18.4	0	0	0	105.1
749	L	30.7	Very low	33.2	Very low	143 Å²	143	140 Å²	140	75%	0.749	76%	0.757	S	S	*	*				-173.4	150.7	68.6	-86.7	170.5	0	0	0	112.8
750	N	31	Very low	33.3	Very low	153 Å²	153	141.1 Å²	141.1	82%	0.818	76%	0.756	S	S	*	*			trans	63.6	96.5	147.6	-63.4	-10.5	0	0	0	122.2
751	G	25.9	Very low	33.8	Very low	67 Å²	67	141.2 Å²	141.2	69%	0.691	75%	0.746	S	S	*	*			trans	-162	124.6	150.1	0	0	0	0	0	110.9	S753	G751-S753 PolarHBondContact O-N 2.89Å; G751-S753 VanDerWaalsContact O-N 3.1Å
752	P	34.8	Very low	35.1	Very low	131 Å²	131	142.9 Å²	142.9	85%	0.851	74%	0.744	S	S	*	*			trans	-81.5	94.8	-168.6	30.2	-34.4	0	0	0	114.7
753	S	32.3	Very low	36.8	Very low	107 Å²	107	135 Å²	135	75%	0.748	71%	0.709	S	S	*	*			trans	48.6	101.3	149.3	65.1	0	0	0	0	119.7	G751	G751-S753 PolarHBondContact O-N 2.89Å; G751-S753 VanDerWaalsContact O-N 3.1Å
754	Y	31.3	Very low	39	Very low	222 Å²	222	129 Å²	129	87%	0.871	70%	0.7	S	S	*	*			trans	-57.1	151.5	141.2	-170.4	-98.4	0	0	0	110.2	E756	Y754-E756 PolarHBondContact O-N 3.23Å; Y754-E756 VanDerWaalsContact O-N 3.15Å
755	F	27.7	Very low	41.6	Very low	172 Å²	172	125.1 Å²	125.1	75%	0.754	67%	0.665	S	S	*	*			trans	-86.6	86	179.9	-154.2	-81.7	0	0	0	110.9	E757	F755-E757 PolarHBondContact O-N 3.35Å
756	E	35.6	Very low	43.7	Very low	156 Å²	156	119.3 Å²	119.3	73%	0.729	65%	0.648	S	S	*	*			trans	-78.4	110.1	175.3	-171.1	167.2	-154.7	0	0	110.3	Y754 N758	Y754-E756 PolarHBondContact O-N 3.23Å; Y754-E756 VanDerWaalsContact O-N 3.15Å; E756-N758 PolarHBondContact O-N 3.39Å
757	E	36	Very low	45.4	Very low	109 Å²	109	117.1 Å²	117.1	51%	0.509	63%	0.63	S	S	.	*			trans	-80.1	88.2	-176.5	-163.5	-176	-149.2	0	0	111	F755 R797	F755-E757 PolarHBondContact O-N 3.35Å; E757-R797 VanDerWaalsContact CD-CZ 3.41Å; E757-R797 IonicContact OE1-CZ 3Å; E757-R797 IonicContact OE1-NE 2.79Å; E757-R797 PolarHBondContact OE1-NE 2.97Å; E757-R797 IonicContact OE1-NH2 2.78Å; E757-R797 IonicContact OE2-CZ 3.67Å; E757-R797 IonicContact OE2-NE 3.97Å; E757-R797 IonicContact OE2-NH2 3.81Å; E757-R797 PolarHBondContact OE2-NH2 3.34Å
758	N	35.2	Very low	47.4	Very low	100 Å²	100	111.8 Å²	111.8	54%	0.535	62%	0.617	S	S	.	*			trans	-43.8	126.1	-179.3	-76.8	-76.4	0	0	0	113	E756 N760	E756-N758 PolarHBondContact O-N 3.39Å; N758-N760 PolarHBondContact O-N 3.01Å; N758-N760 VanDerWaalsContact O-N 3.17Å
759	P	48.3	Very low	49.4	Very low	113 Å²	113	106.6 Å²	106.6	73%	0.734	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-5.6	179.6	29	-35.1	0	0	0	114
760	N	44.2	Very low	51.4	Low	149 Å²	149	107.3 Å²	107.3	80%	0.797	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	5.5	-175.1	-69.5	-5.8	0	0	0	114.5	N758	N758-N760 PolarHBondContact O-N 3.01Å; N758-N760 VanDerWaalsContact O-N 3.17Å
761	E	46	Very low	53.2	Low	129 Å²	129	102.4 Å²	102.4	60%	0.603	57%	0.572	S	S	*	*	S	Bend	trans	-77.8	122.9	175.6	-167.5	173.2	-155.9	0	0	110.4	V763	E761-V763 PolarHBondContact O-N 2.89Å
762	P	54.2	Low	55.3	Low	103 Å²	103	100.5 Å²	100.5	67%	0.669	55%	0.545	S	S	*	.			trans	-71.3	119.5	-174.3	27.8	-34	0	0	0	111.1	V764	P762-V764 PolarHBondContact O-N 3.1Å
763	V	66.1	Low	57.2	Low	36 Å²	36	97.4 Å²	97.4	22%	0.218	52%	0.519	C	S	.	.			trans	-58.9	105.1	175.5	-178.3	0	0	0	0	109.6	E761 L765 R797 E798 K801	E761-V763 PolarHBondContact O-N 2.89Å; V763-L765 HydrophobicContact CG1-CD2 4.43Å; V763-L765 PolarHBondContact O-N 2.77Å; V763-R797 HydrophobicContact CG1-CB 4.37Å; V763-R797 HydrophobicContact CG2-CB 3.87Å; V763-E798 HydrophobicContact CG1-CB 4.5Å; V763-E798 HydrophobicContact CG1-CG 3.76Å; V763-K801 HydrophobicContact CB-CD 3.97Å; V763-K801 HydrophobicContact CG1-CD 4.33Å; V763-K801 PolarHBondContact O-NZ 3.08Å
764	V	74.3	Confident	58.9	Low	125 Å²	125	97.8 Å²	97.8	76%	0.758	52%	0.522	S	S	*	.			trans	-70.8	125.7	173.1	-176.9	0	0	0	0	107.9	P762	P762-V764 PolarHBondContact O-N 3.1Å
765	L	79.2	Confident	61.3	Low	23 Å²	23	91.7 Å²	91.7	12%	0.12	50%	0.5	C	S	.	.			trans	-98.5	145.2	177	-72	-179.3	0	0	0	109.1	V763 L767 P769 Y787 E798 K801 L802	V763-L765 HydrophobicContact CG1-CD2 4.43Å; V763-L765 PolarHBondContact O-N 2.77Å; L765-L767 WeakPolarHBondContact CB-O 3.46Å; L765-L767 PolarHBondContact O-N 2.86Å; L765-P769 HydrophobicContact CD1-CG 3.69Å; L765-Y787 HydrophobicContact CB-CE2 4.06Å; L765-Y787 HydrophobicContact CD2-CE2 4.26Å; L765-Y787 WeakPolarHBondContact CD2-OH 3.19Å; L765-E798 HydrophobicContact CD2-CB 3.93Å; L765-E798 HydrophobicContact CD2-CG 4Å; L765-K801 HydrophobicContact CD1-CD 3.86Å; L765-K801 HydrophobicContact CD1-CG 4Å; L765-K801 HydrophobicContact CD2-CB 4.46Å; L765-K801 HydrophobicContact CD2-CD 4.31Å; L765-K801 HydrophobicContact CG-CD 3.94Å; L765-K801 HydrophobicContact CG-CG 4.46Å; L765-L802 HydrophobicContact CD1-CD2 4.12Å; L765-L802 HydrophobicContact CD1-CG 4.46Å; L765-L802 HydrophobicContact CD2-CD2 4.39Å; L765-L802 HydrophobicContact CD2-CG 4.07Å
766	A	74.8	Confident	64	Low	52 Å²	52	86.7 Å²	86.7	43%	0.43	49%	0.486	S	S	.	.	S	Bend	trans	-65.9	-25.6	-179	0	0	0	0	0	113.5	Y787 A791	A766-Y787 HydrophobicContact CB-CE1 4.14Å; A766-Y787 HydrophobicContact CB-CE2 3.94Å; A766-Y787 PolarHBondContact N-OH 3.17Å; A766-A791 HydrophobicContact CB-CB 3.75Å
767	L	80.3	Confident	66.3	Low	52 Å²	52	85.4 Å²	85.4	27%	0.272	48%	0.476	S	S	.	.	S	Bend	trans	-135.2	145.8	167.5	-61.5	174.9	0	0	0	108.5	L765 P769 F783 Q786 Y787	L765-L767 WeakPolarHBondContact CB-O 3.46Å; L765-L767 PolarHBondContact O-N 2.86Å; L767-P769 WeakPolarHBondContact O-CD 3.27Å; L767-F783 HydrophobicContact CB-CE2 3.83Å; L767-F783 HydrophobicContact CB-CZ 3.85Å; L767-F783 HydrophobicContact CD1-CE2 4.22Å; L767-Q786 HydrophobicContact CD1-CB 4Å; L767-Y787 HydrophobicContact CB-CD2 4.11Å
768	D	75.6	Confident	68.7	Low	94 Å²	94	87.5 Å²	87.5	50%	0.503	49%	0.485	S	S	.	.			trans	-79.7	119.6	177.4	-163.9	-13.9	0	0	0	110.7	K770	D768-K770 VanDerWaalsContact C-N 3.3Å; D768-K770 PolarHBondContact O-N 3.14Å; D768-K770 VanDerWaalsContact OD1-CG 3.3Å; D768-K770 WeakPolarHBondContact OD1-CG 3.22Å; D768-K770 PolarHBondContact OD1-N 3.31Å; D768-K770 IonicContact OD1-NZ 3.95Å; D768-K770 IonicContact OD2-NZ 3.54Å; D768-K770 PolarHBondContact OD2-NZ 3.04Å
769	P	75	Confident	71	Confident	3 Å²	3	84.9 Å²	84.9	2%	0.019	48%	0.475	C	S	.	.			trans	-78.4	-5.5	-179.9	32.2	-38	0	0	0	114.6	L765 L767 G771 Q772 F783 L806	L765-P769 HydrophobicContact CD1-CG 3.69Å; L767-P769 WeakPolarHBondContact O-CD 3.27Å; P769-G771 PolarHBondContact O-N 2.94Å; P769-Q772 VanDerWaalsContact O-CB 3.27Å; P769-Q772 WeakPolarHBondContact O-CB 3.39Å; P769-Q772 WeakPolarHBondContact O-CG 3.41Å; P769-Q772 PolarHBondContact O-N 2.8Å; P769-F783 HydrophobicContact CB-CE1 3.83Å; P769-F783 HydrophobicContact CB-CZ 3.96Å; P769-L806 HydrophobicContact CB-CD2 3.87Å; P769-L806 HydrophobicContact CB-CG 4.31Å
770	K	71.3	Confident	72.9	Confident	157 Å²	157	81.5 Å²	81.5	68%	0.683	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	130.7	-178.9	-76.5	176.3	-157.7	124	0	112	D768 Q772	D768-K770 VanDerWaalsContact C-N 3.3Å; D768-K770 PolarHBondContact O-N 3.14Å; D768-K770 VanDerWaalsContact OD1-CG 3.3Å; D768-K770 WeakPolarHBondContact OD1-CG 3.22Å; D768-K770 PolarHBondContact OD1-N 3.31Å; D768-K770 IonicContact OD1-NZ 3.95Å; D768-K770 IonicContact OD2-NZ 3.54Å; D768-K770 PolarHBondContact OD2-NZ 3.04Å; K770-Q772 VanDerWaalsContact C-N 3.28Å; K770-Q772 PolarHBondContact O-N 3.36Å
771	G	68.4	Low	74.9	Confident	50 Å²	50	79.2 Å²	79.2	52%	0.515	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	2.7	179.9	0	0	0	0	0	115.1	P769 K775	P769-G771 PolarHBondContact O-N 2.94Å; G771-K775 WeakPolarHBondContact O-CE 3.41Å
772	Q	70.7	Confident	76.8	Confident	27 Å²	27	75.4 Å²	75.4	13%	0.126	42%	0.421	C	S	.	.			trans	-83	-25	165.6	-61.1	-72.6	8.5	0	0	112.1	P769 K770 S774 K775 R780 F783 L806	P769-Q772 VanDerWaalsContact O-CB 3.27Å; P769-Q772 WeakPolarHBondContact O-CB 3.39Å; P769-Q772 WeakPolarHBondContact O-CG 3.41Å; P769-Q772 PolarHBondContact O-N 2.8Å; K770-Q772 VanDerWaalsContact C-N 3.28Å; K770-Q772 PolarHBondContact O-N 3.36Å; Q772-S774 VanDerWaalsContact C-N 3.34Å; Q772-S774 PolarHBondContact O-N 2.89Å; Q772-K775 WeakPolarHBondContact O-CB 3.2Å; Q772-K775 PolarHBondContact O-N 3.35Å; Q772-R780 WeakPolarHBondContact O-CD 3.44Å; Q772-R780 VanDerWaalsContact O-CG 3.23Å; Q772-R780 WeakPolarHBondContact O-CG 3.21Å; Q772-F783 HydrophobicContact CG-CB 4.28Å; Q772-F783 HydrophobicContact CG-CD1 4.26Å; Q772-F783 HydrophobicContact CG-CD2 3.91Å; Q772-F783 HydrophobicContact CG-CE2 4.28Å; Q772-F783 HydrophobicContact CG-CG 3.87Å; Q772-L806 HydrophobicContact CB-CD2 3.48Å; Q772-L806 VanDerWaalsContact CB-CD2 3.48Å; Q772-L806 HydrophobicContact CG-CD2 4.14Å
773	E	74.6	Confident	78.6	Confident	67 Å²	67	70.8 Å²	70.8	31%	0.313	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-45.1	-172.2	-67	172.5	-130	0	0	113.9	S805 W807	E773-S805 WeakPolarHBondContact CG-O 3.36Å; E773-W807 PolarHBondContact OE2-NE1 3.36Å
774	S	69.3	Low	79.7	Confident	115 Å²	115	69.3 Å²	69.3	80%	0.804	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	11	-177.4	66.1	0	0	0	0	114.8	Q772	Q772-S774 VanDerWaalsContact C-N 3.34Å; Q772-S774 PolarHBondContact O-N 2.89Å
775	K	80.1	Confident	80.4	Confident	93 Å²	93	65.9 Å²	65.9	40%	0.404	36%	0.361	S	S	.	.	S	Bend	trans	-91.5	166.7	179.6	-61.1	-172	-170.6	160.1	0	112.4	G771 Q772 R780	G771-K775 WeakPolarHBondContact O-CE 3.41Å; Q772-K775 WeakPolarHBondContact O-CB 3.2Å; Q772-K775 PolarHBondContact O-N 3.35Å; K775-R780 PolarHBondContact O-NE 3.07Å
776	S	85.5	Confident	80.7	Confident	67 Å²	67	70 Å²	70	47%	0.469	38%	0.38	S	S	.	.			trans	-52.1	148.9	175.3	70.2	0	0	0	0	111.5	E778 S779 R780	S776-E778 PolarHBondContact O-N 3.03Å; S776-S779 WeakPolarHBondContact O-CB 3.36Å; S776-S779 PolarHBondContact O-N 3.08Å; S776-S779 PolarHBondContact OG-N 3.32Å; S776-S779 PolarHBondContact OG-OG 2.98Å; S776-R780 PolarHBondContact O-N 3.42Å
777	Y	84	Confident	81.3	Confident	129 Å²	129	67.6 Å²	67.6	51%	0.506	36%	0.359	S	S	.	.	H	α-helix	trans	-54.3	-38.2	178.7	176.8	-104.8	0	0	0	111.7	R780 K781 L808	Y777-R780 PolarHBondContact O-N 2.83Å; Y777-K781 WeakPolarHBondContact O-CB 3.49Å; Y777-K781 PolarHBondContact O-N 3.14Å; Y777-L808 HydrophobicContact CD2-CD2 3.65Å; Y777-L808 HydrophobicContact CE2-CD2 3.6Å
778	E	85.4	Confident	81.8	Confident	153 Å²	153	66 Å²	66	72%	0.715	35%	0.35	S	S	*	.	H	α-helix	trans	-64.5	-42.7	174	-175.2	164.2	-136	0	0	113.3	S776 R780 K781 A782	S776-E778 PolarHBondContact O-N 3.03Å; E778-R780 VanDerWaalsContact C-N 3.29Å; E778-R780 PolarHBondContact O-N 3.49Å; E778-K781 CarbonylContact O-C 3.55Å; E778-K781 WeakPolarHBondContact O-CB 3.48Å; E778-K781 PolarHBondContact O-N 3.35Å; E778-A782 WeakPolarHBondContact O-CB 3.45Å; E778-A782 PolarHBondContact O-N 3.4Å
779	S	84.9	Confident	82.2	Confident	46 Å²	46	67.3 Å²	67.3	32%	0.322	36%	0.357	S	S	.	.	H	α-helix	trans	-58.9	-42.1	174	-60.3	0	0	0	0	111.8	S776 A782 F783	S776-S779 WeakPolarHBondContact O-CB 3.36Å; S776-S779 PolarHBondContact O-N 3.08Å; S776-S779 PolarHBondContact OG-N 3.32Å; S776-S779 PolarHBondContact OG-OG 2.98Å; S779-A782 PolarHBondContact O-N 3.21Å; S779-F783 PolarHBondContact O-N 3.05Å
780	R	86.8	Confident	82.5	Confident	42 Å²	42	75.4 Å²	75.4	16%	0.158	39%	0.387	C	S	.	.	H	α-helix	trans	-68.2	-36.4	178.2	-67.6	-174	-89	149.2	-3.9	111.9	Q772 K775 S776 Y777 E778 F783 L784 L806 W807 L808	Q772-R780 WeakPolarHBondContact O-CD 3.44Å; Q772-R780 VanDerWaalsContact O-CG 3.23Å; Q772-R780 WeakPolarHBondContact O-CG 3.21Å; K775-R780 PolarHBondContact O-NE 3.07Å; S776-R780 PolarHBondContact O-N 3.42Å; Y777-R780 PolarHBondContact O-N 2.83Å; E778-R780 VanDerWaalsContact C-N 3.29Å; E778-R780 PolarHBondContact O-N 3.49Å; R780-F783 PolarHBondContact O-N 3.31Å; R780-L784 PolarHBondContact O-N 3.49Å; R780-L784 VanDerWaalsContact O-N 3.11Å; R780-L806 WeakPolarHBondContact CD-O 3.31Å; R780-L806 PolarHBondContact NH1-O 2.77Å; R780-W807 PolarHBondContact NH1-O 3.37Å; R780-L808 HydrophobicContact CB-CD1 4.21Å
781	K	86.8	Confident	83.1	Confident	101 Å²	101	68.9 Å²	68.9	44%	0.439	36%	0.362	S	S	.	.	H	α-helix	trans	-67.8	-37.6	172.3	-170.6	179.3	179.8	-175.5	0	112.5	Y777 E778 L784 T785 H816	Y777-K781 WeakPolarHBondContact O-CB 3.49Å; Y777-K781 PolarHBondContact O-N 3.14Å; E778-K781 CarbonylContact O-C 3.55Å; E778-K781 WeakPolarHBondContact O-CB 3.48Å; E778-K781 PolarHBondContact O-N 3.35Å; K781-L784 WeakPolarHBondContact O-CB 3.4Å; K781-L784 PolarHBondContact O-N 3.38Å; K781-T785 PolarHBondContact O-N 3.35Å; K781-T785 VanDerWaalsContact O-N 3.15Å; K781-T785 PolarHBondContact O-OG1 3.13Å; K781-H816 PolarHBondContact O-CE1 2.74Å; K781-H816 PolarHBondContact O-NE2 3.14Å
782	A	86.1	Confident	83.8	Confident	48 Å²	48	68.7 Å²	68.7	40%	0.397	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-40.8	173.2	0	0	0	0	0	111.7	E778 S779 L784 T785 Q786	E778-A782 WeakPolarHBondContact O-CB 3.45Å; E778-A782 PolarHBondContact O-N 3.4Å; S779-A782 PolarHBondContact O-N 3.21Å; A782-L784 VanDerWaalsContact C-N 3.33Å; A782-L784 PolarHBondContact O-N 3.3Å; A782-T785 WeakPolarHBondContact O-CA 3.47Å; A782-T785 WeakPolarHBondContact O-CB 3.34Å; A782-T785 PolarHBondContact O-N 2.97Å; A782-Q786 PolarHBondContact O-N 2.98Å
783	F	90.9	Very high	84.6	Confident	7 Å²	7	76 Å²	76	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-60.8	-38.7	171.6	176.1	-98.3	0	0	0	112.5	L767 P769 Q772 S779 R780 T785 Q786 Y787 L802 L806	L767-F783 HydrophobicContact CB-CE2 3.83Å; L767-F783 HydrophobicContact CB-CZ 3.85Å; L767-F783 HydrophobicContact CD1-CE2 4.22Å; P769-F783 HydrophobicContact CB-CE1 3.83Å; P769-F783 HydrophobicContact CB-CZ 3.96Å; Q772-F783 HydrophobicContact CG-CB 4.28Å; Q772-F783 HydrophobicContact CG-CD1 4.26Å; Q772-F783 HydrophobicContact CG-CD2 3.91Å; Q772-F783 HydrophobicContact CG-CE2 4.28Å; Q772-F783 HydrophobicContact CG-CG 3.87Å; S779-F783 PolarHBondContact O-N 3.05Å; R780-F783 PolarHBondContact O-N 3.31Å; F783-T785 VanDerWaalsContact C-N 3.27Å; F783-T785 PolarHBondContact O-N 2.82Å; F783-Q786 PolarHBondContact O-N 2.81Å; F783-Y787 PolarHBondContact O-N 2.66Å; F783-L802 HydrophobicContact CE1-CD2 4.07Å; F783-L806 HydrophobicContact CD1-CD1 3.84Å; F783-L806 HydrophobicContact CD1-CD2 3.65Å; F783-L806 HydrophobicContact CD1-CG 4.36Å; F783-L806 HydrophobicContact CE1-CD1 4.13Å; F783-L806 HydrophobicContact CE1-CD2 3.93Å; F783-L806 HydrophobicContact CE1-CG 4.5Å
784	L	89.6	Confident	85.1	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-63.2	-31.3	172.6	-70	178.1	0	0	0	112.9	R780 K781 A782 F788 L806 L808 V813 H816 F817	R780-L784 PolarHBondContact O-N 3.49Å; R780-L784 VanDerWaalsContact O-N 3.11Å; K781-L784 WeakPolarHBondContact O-CB 3.4Å; K781-L784 PolarHBondContact O-N 3.38Å; A782-L784 VanDerWaalsContact C-N 3.33Å; A782-L784 PolarHBondContact O-N 3.3Å; L784-F788 WeakPolarHBondContact O-CB 3.39Å; L784-F788 PolarHBondContact O-N 3.17Å; L784-L806 HydrophobicContact CD2-CD1 3.49Å; L784-L806 VanDerWaalsContact CD2-CD1 3.49Å; L784-L806 HydrophobicContact CG-CD1 3.93Å; L784-L808 HydrophobicContact CD1-CD1 3.7Å; L784-L808 HydrophobicContact CG-CD1 4.4Å; L784-V813 HydrophobicContact CD1-CG2 4.24Å; L784-V813 HydrophobicContact CD2-CG1 4.06Å; L784-H816 VanDerWaalsContact CB-CD2 3.41Å; L784-H816 WeakPolarHBondContact CB-CD2 3.26Å; L784-H816 HydrophobicContact CD1-CB 4.13Å; L784-F817 HydrophobicContact CD2-CE2 4.06Å
785	T	89.1	Confident	85.8	Confident	53 Å²	53	72 Å²	72	33%	0.325	36%	0.356	S	S	.	.	H	α-helix	trans	-70.1	-40.9	170.9	-51.5	0	0	0	0	111.8	K781 A782 F783 Y787 F788 N789 H816	K781-T785 PolarHBondContact O-N 3.35Å; K781-T785 VanDerWaalsContact O-N 3.15Å; K781-T785 PolarHBondContact O-OG1 3.13Å; A782-T785 WeakPolarHBondContact O-CA 3.47Å; A782-T785 WeakPolarHBondContact O-CB 3.34Å; A782-T785 PolarHBondContact O-N 2.97Å; F783-T785 VanDerWaalsContact C-N 3.27Å; F783-T785 PolarHBondContact O-N 2.82Å; T785-Y787 VanDerWaalsContact C-N 3.33Å; T785-Y787 PolarHBondContact O-N 3.48Å; T785-F788 WeakPolarHBondContact O-CB 3.45Å; T785-F788 PolarHBondContact O-N 2.74Å; T785-N789 PolarHBondContact O-N 3.15Å; T785-N789 VanDerWaalsContact O-N 3.1Å; T785-N789 PolarHBondContact O-OD1 3.47Å; T785-H816 PolarHBondContact N-NE2 3.49Å; T785-H816 PolarHBondContact OG1-CE1 3.06Å; T785-H816 VanDerWaalsContact OG1-CE1 3.29Å; T785-H816 PolarHBondContact OG1-NE2 3.42Å
786	Q	84.6	Confident	86.1	Confident	111 Å²	111	73.2 Å²	73.2	52%	0.519	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-39.9	174.4	-68.6	172.8	-15.8	0	0	111.6	L767 A782 F783 N789	L767-Q786 HydrophobicContact CD1-CB 4Å; A782-Q786 PolarHBondContact O-N 2.98Å; F783-Q786 PolarHBondContact O-N 2.81Å; Q786-N789 PolarHBondContact O-N 2.91Å
787	Y	88.6	Confident	86	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-43.2	172.2	-161.9	-74	0	0	0	111.3	L765 A766 L767 F783 T785 N789 R790 A791 P794 E798 L802 F817	L765-Y787 HydrophobicContact CB-CE2 4.06Å; L765-Y787 HydrophobicContact CD2-CE2 4.26Å; L765-Y787 WeakPolarHBondContact CD2-OH 3.19Å; A766-Y787 HydrophobicContact CB-CE1 4.14Å; A766-Y787 HydrophobicContact CB-CE2 3.94Å; A766-Y787 PolarHBondContact N-OH 3.17Å; L767-Y787 HydrophobicContact CB-CD2 4.11Å; F783-Y787 PolarHBondContact O-N 2.66Å; T785-Y787 VanDerWaalsContact C-N 3.33Å; T785-Y787 PolarHBondContact O-N 3.48Å; Y787-N789 VanDerWaalsContact C-N 3.26Å; Y787-N789 PolarHBondContact O-N 3.11Å; Y787-R790 PolarHBondContact O-N 3.26Å; Y787-A791 HydrophobicContact CD1-CB 3.97Å; Y787-A791 HydrophobicContact CE1-CB 3.59Å; Y787-A791 PolarHBondContact O-N 3.38Å; Y787-P794 HydrophobicContact CE1-CB 4.36Å; Y787-E798 PolarHBondContact OH-OE1 3.29Å; Y787-L802 HydrophobicContact CD1-CD1 4.17Å; Y787-L802 HydrophobicContact CD2-CD1 4.2Å; Y787-L802 HydrophobicContact CD2-CD2 3.89Å; Y787-L802 HydrophobicContact CE1-CD1 3.99Å; Y787-L802 HydrophobicContact CE2-CD1 4.03Å; Y787-L802 HydrophobicContact CE2-CD2 3.9Å; Y787-L802 HydrophobicContact CE2-CG 4.4Å; Y787-L802 HydrophobicContact CG-CD1 4.28Å; Y787-F817 AromaticContact CD1-CE1 3.99Å; Y787-F817 HydrophobicContact CD1-CE1 3.99Å; Y787-F817 AromaticContact CD1-CZ 3.6Å; Y787-F817 HydrophobicContact CD1-CZ 3.6Å; Y787-F817 HydrophobicContact CE1-CZ 4.31Å; Y787-F817 HydrophobicContact CG-CZ 4.24Å
788	F	89.3	Confident	86.1	Confident	20 Å²	20	69.8 Å²	69.8	9%	0.088	34%	0.34	C	S	.	.	H	α-helix	trans	-54.9	-41.7	176.9	179	-100.3	0	0	0	112.4	L784 T785 R790 A791 P792 F817 T820 R821	L784-F788 WeakPolarHBondContact O-CB 3.39Å; L784-F788 PolarHBondContact O-N 3.17Å; T785-F788 WeakPolarHBondContact O-CB 3.45Å; T785-F788 PolarHBondContact O-N 2.74Å; F788-R790 VanDerWaalsContact C-N 3.33Å; F788-R790 PolarHBondContact O-N 3.44Å; F788-A791 CarbonylContact O-C 3.53Å; F788-A791 PolarHBondContact O-N 2.84Å; F788-P792 HydrophobicContact CD2-CB 3.81Å; F788-P792 HydrophobicContact CE1-CB 4.36Å; F788-P792 HydrophobicContact CE2-CB 3.31Å; F788-P792 HydrophobicContact CG-CB 4.49Å; F788-P792 HydrophobicContact CZ-CB 3.65Å; F788-P792 VanDerWaalsContact O-CA 3.32Å; F788-P792 WeakPolarHBondContact O-CA 3.46Å; F788-P792 WeakPolarHBondContact O-CB 3.49Å; F788-P792 VanDerWaalsContact O-CD 3.31Å; F788-P792 WeakPolarHBondContact O-CD 3.49Å; F788-P792 VanDerWaalsContact O-N 3.1Å; F788-F817 HydrophobicContact CB-CD1 4.5Å; F788-F817 HydrophobicContact CB-CE1 4.17Å; F788-F817 AromaticContact CD2-CD1 3.8Å; F788-F817 HydrophobicContact CD2-CD1 3.8Å; F788-F817 HydrophobicContact CD2-CE1 4.18Å; F788-T820 HydrophobicContact CD1-CG2 3.45Å; F788-T820 VanDerWaalsContact CD1-CG2 3.45Å; F788-T820 HydrophobicContact CD2-CG2 4.46Å; F788-T820 HydrophobicContact CE1-CG2 3.58Å; F788-T820 HydrophobicContact CG-CG2 3.93Å; F788-T820 HydrophobicContact CZ-CG2 4.17Å; F788-R821 HydrophobicContact CE2-CG 3.44Å; F788-R821 VanDerWaalsContact CE2-CG 3.44Å; F788-R821 HydrophobicContact CZ-CG 3.76Å
789	N	85.4	Confident	86.2	Confident	121 Å²	121	63 Å²	63	65%	0.647	31%	0.309	S	S	*	.	H	α-helix	trans	-67.4	-29.1	-178.6	-65.6	-0.8	0	0	0	113.5	T785 Q786 Y787	T785-N789 PolarHBondContact O-N 3.15Å; T785-N789 VanDerWaalsContact O-N 3.1Å; T785-N789 PolarHBondContact O-OD1 3.47Å; Q786-N789 PolarHBondContact O-N 2.91Å; Y787-N789 VanDerWaalsContact C-N 3.26Å; Y787-N789 PolarHBondContact O-N 3.11Å
790	R	81.4	Confident	86.4	Confident	173 Å²	173	62.9 Å²	62.9	65%	0.653	31%	0.305	S	S	*	.	H	α-helix	trans	-93.9	-25.2	174.9	-67.3	-79.9	-179	165.8	-4.5	112.8	Y787 F788 D854	Y787-R790 PolarHBondContact O-N 3.26Å; F788-R790 VanDerWaalsContact C-N 3.33Å; F788-R790 PolarHBondContact O-N 3.44Å; R790-D854 IonicContact CZ-OD2 3.24Å; R790-D854 IonicContact NH1-OD2 3.8Å; R790-D854 PolarHBondContact NH1-OD2 3.17Å; R790-D854 VanDerWaalsContact NH1-OD2 3.13Å; R790-D854 IonicContact NH2-OD2 2.71Å; R790-D854 PolarHBondContact NH2-OD2 3.28Å
791	A	82.6	Confident	86.4	Confident	19 Å²	19	64.6 Å²	64.6	16%	0.157	31%	0.313	C	S	.	.			trans	-148.7	81	-177.9	0	0	0	0	0	112.3	A766 Y787 F788 Y793	A766-A791 HydrophobicContact CB-CB 3.75Å; Y787-A791 HydrophobicContact CD1-CB 3.97Å; Y787-A791 HydrophobicContact CE1-CB 3.59Å; Y787-A791 PolarHBondContact O-N 3.38Å; F788-A791 CarbonylContact O-C 3.53Å; F788-A791 PolarHBondContact O-N 2.84Å; A791-Y793 PolarHBondContact O-N 3.43Å
792	P	84.3	Confident	86.4	Confident	47 Å²	47	59.8 Å²	59.8	31%	0.305	29%	0.292	S	S	.	.	S	Bend	trans	-74.2	-8	-174	26	-33.1	0	0	0	115	F788 R821	F788-P792 HydrophobicContact CD2-CB 3.81Å; F788-P792 HydrophobicContact CE1-CB 4.36Å; F788-P792 HydrophobicContact CE2-CB 3.31Å; F788-P792 HydrophobicContact CG-CB 4.49Å; F788-P792 HydrophobicContact CZ-CB 3.65Å; F788-P792 VanDerWaalsContact O-CA 3.32Å; F788-P792 WeakPolarHBondContact O-CA 3.46Å; F788-P792 WeakPolarHBondContact O-CB 3.49Å; F788-P792 VanDerWaalsContact O-CD 3.31Å; F788-P792 WeakPolarHBondContact O-CD 3.49Å; F788-P792 VanDerWaalsContact O-N 3.1Å; P792-R821 PolarHBondContact O-NH1 3.12Å
793	Y	86.6	Confident	86.6	Confident	181 Å²	181	57.8 Å²	57.8	71%	0.71	28%	0.276	S	S	*	.	S	Bend	trans	-131	67.4	-179.9	-61.4	-83.3	0	0	0	111.6	A791	A791-Y793 PolarHBondContact O-N 3.43Å
794	P	85.3	Confident	86.4	Confident	21 Å²	21	61.8 Å²	61.8	14%	0.136	30%	0.304	C	S	.	.			trans	-65.3	145.2	178.6	30	-37.7	0	0	0	111.6	Y787 E798 V799 F817	Y787-P794 HydrophobicContact CE1-CB 4.36Å; P794-E798 HydrophobicContact CB-CB 4.08Å; P794-V799 HydrophobicContact CB-CG2 4.06Å; P794-V799 HydrophobicContact CG-CG2 3.81Å; P794-F817 HydrophobicContact CG-CD1 3.62Å; P794-F817 HydrophobicContact CG-CD2 3.94Å; P794-F817 HydrophobicContact CG-CE1 3.64Å; P794-F817 HydrophobicContact CG-CE2 3.96Å; P794-F817 HydrophobicContact CG-CG 3.82Å; P794-F817 HydrophobicContact CG-CZ 3.84Å
795	T	85.3	Confident	86.2	Confident	76 Å²	76	63 Å²	63	47%	0.466	31%	0.313	S	S	.	.			trans	-72.5	162.8	172.2	64.2	0	0	0	0	111.7	R797 E798 V799	T795-R797 VanDerWaalsContact C-N 3.25Å; T795-R797 PolarHBondContact O-N 3.44Å; T795-E798 VanDerWaalsContact CB-OE2 3.31Å; T795-E798 WeakPolarHBondContact CB-OE2 3.48Å; T795-E798 WeakPolarHBondContact CG2-OE2 3.44Å; T795-E798 PolarHBondContact N-OE2 2.91Å; T795-E798 WeakPolarHBondContact O-CB 3.42Å; T795-E798 PolarHBondContact O-N 2.92Å; T795-E798 WeakPolarHBondContact OG1-CG 3.32Å; T795-E798 PolarHBondContact OG1-N 2.95Å; T795-E798 PolarHBondContact OG1-OE2 3.24Å; T795-V799 PolarHBondContact O-N 3.23Å
796	Q	84.7	Confident	86.1	Confident	119 Å²	119	60.4 Å²	60.4	56%	0.556	30%	0.298	S	S	*	.	H	α-helix	trans	-56.5	-39.9	177.8	-169.2	64.7	61.8	0	0	112.2	E798 V799 D800	Q796-E798 VanDerWaalsContact C-N 3.31Å; Q796-E798 PolarHBondContact O-N 3.31Å; Q796-V799 PolarHBondContact O-N 2.85Å; Q796-D800 PolarHBondContact NE2-OD1 3.41Å; Q796-D800 WeakPolarHBondContact O-CB 3.28Å; Q796-D800 PolarHBondContact O-N 2.78Å
797	R	84.2	Confident	86.1	Confident	95 Å²	95	64 Å²	64	36%	0.358	31%	0.306	S	S	.	.	H	α-helix	trans	-63	-35.2	177.4	-69.4	-174.6	177.3	-135.1	-2.4	112.3	E757 V763 T795 K801	E757-R797 VanDerWaalsContact CD-CZ 3.41Å; E757-R797 IonicContact OE1-CZ 3Å; E757-R797 IonicContact OE1-NE 2.79Å; E757-R797 PolarHBondContact OE1-NE 2.97Å; E757-R797 IonicContact OE1-NH2 2.78Å; E757-R797 IonicContact OE2-CZ 3.67Å; E757-R797 IonicContact OE2-NE 3.97Å; E757-R797 IonicContact OE2-NH2 3.81Å; E757-R797 PolarHBondContact OE2-NH2 3.34Å; V763-R797 HydrophobicContact CG1-CB 4.37Å; V763-R797 HydrophobicContact CG2-CB 3.87Å; T795-R797 VanDerWaalsContact C-N 3.25Å; T795-R797 PolarHBondContact O-N 3.44Å; R797-K801 WeakPolarHBondContact O-CB 3.48Å; R797-K801 PolarHBondContact O-N 3.32Å; R797-K801 VanDerWaalsContact O-N 3.13Å
798	E	86.1	Confident	86.1	Confident	29 Å²	29	64.9 Å²	64.9	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-73.7	-44.6	174.6	-67.2	165.1	77.9	0	0	112.2	V763 L765 Y787 P794 T795 Q796 D800 K801 L802	V763-E798 HydrophobicContact CG1-CB 4.5Å; V763-E798 HydrophobicContact CG1-CG 3.76Å; L765-E798 HydrophobicContact CD2-CB 3.93Å; L765-E798 HydrophobicContact CD2-CG 4Å; Y787-E798 PolarHBondContact OH-OE1 3.29Å; P794-E798 HydrophobicContact CB-CB 4.08Å; T795-E798 VanDerWaalsContact CB-OE2 3.31Å; T795-E798 WeakPolarHBondContact CB-OE2 3.48Å; T795-E798 WeakPolarHBondContact CG2-OE2 3.44Å; T795-E798 PolarHBondContact N-OE2 2.91Å; T795-E798 WeakPolarHBondContact O-CB 3.42Å; T795-E798 PolarHBondContact O-N 2.92Å; T795-E798 WeakPolarHBondContact OG1-CG 3.32Å; T795-E798 PolarHBondContact OG1-N 2.95Å; T795-E798 PolarHBondContact OG1-OE2 3.24Å; Q796-E798 VanDerWaalsContact C-N 3.31Å; Q796-E798 PolarHBondContact O-N 3.31Å; E798-D800 PolarHBondContact O-N 3.15Å; E798-K801 PolarHBondContact O-N 2.88Å; E798-L802 WeakPolarHBondContact O-CB 3.45Å; E798-L802 VanDerWaalsContact O-CG 3.3Å; E798-L802 WeakPolarHBondContact O-CG 3.46Å; E798-L802 PolarHBondContact O-N 3.47Å
799	V	88.5	Confident	86.1	Confident	11 Å²	11	73.4 Å²	73.4	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-57.4	-41.8	175.5	171.1	0	0	0	0	110.8	P794 T795 Q796 A803 V813 S814	P794-V799 HydrophobicContact CB-CG2 4.06Å; P794-V799 HydrophobicContact CG-CG2 3.81Å; T795-V799 PolarHBondContact O-N 3.23Å; Q796-V799 PolarHBondContact O-N 2.85Å; V799-A803 WeakPolarHBondContact O-CB 3.48Å; V799-A803 PolarHBondContact O-N 3.06Å; V799-V813 HydrophobicContact CG1-CB 4.46Å; V799-V813 HydrophobicContact CG1-CG1 4.07Å; V799-S814 WeakPolarHBondContact CG1-OG 3.22Å
800	D	87.5	Confident	86.3	Confident	43 Å²	43	74.4 Å²	74.4	23%	0.23	34%	0.337	C	S	.	.	H	α-helix	trans	-65.9	-44.7	178.1	-65.3	-9.9	0	0	0	111.5	Q796 E798 A803 S804 R810	Q796-D800 PolarHBondContact NE2-OD1 3.41Å; Q796-D800 WeakPolarHBondContact O-CB 3.28Å; Q796-D800 PolarHBondContact O-N 2.78Å; E798-D800 PolarHBondContact O-N 3.15Å; D800-A803 PolarHBondContact O-N 3.31Å; D800-S804 PolarHBondContact O-N 3.03Å; D800-S804 VanDerWaalsContact O-N 3.12Å; D800-S804 PolarHBondContact O-OG 2.98Å; D800-R810 IonicContact OD1-CZ 3.47Å; D800-R810 IonicContact OD1-NE 3.59Å; D800-R810 PolarHBondContact OD1-NE 3.08Å; D800-R810 IonicContact OD1-NH2 3.56Å; D800-R810 PolarHBondContact OD1-NH2 2.88Å; D800-R810 IonicContact OD2-CZ 3.41Å; D800-R810 IonicContact OD2-NE 3.38Å; D800-R810 IonicContact OD2-NH2 2.68Å; D800-R810 PolarHBondContact OD2-NH2 3.34Å
801	K	87.3	Confident	86.8	Confident	78 Å²	78	69.7 Å²	69.7	34%	0.339	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-38	176.7	-173.1	177.2	165.5	179.2	0	112.5	V763 L765 R797 E798 S804 S805	V763-K801 HydrophobicContact CB-CD 3.97Å; V763-K801 HydrophobicContact CG1-CD 4.33Å; V763-K801 PolarHBondContact O-NZ 3.08Å; L765-K801 HydrophobicContact CD1-CD 3.86Å; L765-K801 HydrophobicContact CD1-CG 4Å; L765-K801 HydrophobicContact CD2-CB 4.46Å; L765-K801 HydrophobicContact CD2-CD 4.31Å; L765-K801 HydrophobicContact CG-CD 3.94Å; L765-K801 HydrophobicContact CG-CG 4.46Å; R797-K801 WeakPolarHBondContact O-CB 3.48Å; R797-K801 PolarHBondContact O-N 3.32Å; R797-K801 VanDerWaalsContact O-N 3.13Å; E798-K801 PolarHBondContact O-N 2.88Å; K801-S804 PolarHBondContact O-N 3.31Å; K801-S805 VanDerWaalsContact O-CB 3.32Å; K801-S805 WeakPolarHBondContact O-CB 3.39Å; K801-S805 PolarHBondContact O-N 3.37Å; K801-S805 PolarHBondContact O-OG 2.96Å
802	L	88.2	Confident	87.1	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-40.9	174.5	-75.9	168.1	0	0	0	111.6	L765 F783 Y787 E798 S805 L806 V813 F817	L765-L802 HydrophobicContact CD1-CD2 4.12Å; L765-L802 HydrophobicContact CD1-CG 4.46Å; L765-L802 HydrophobicContact CD2-CD2 4.39Å; L765-L802 HydrophobicContact CD2-CG 4.07Å; F783-L802 HydrophobicContact CE1-CD2 4.07Å; Y787-L802 HydrophobicContact CD1-CD1 4.17Å; Y787-L802 HydrophobicContact CD2-CD1 4.2Å; Y787-L802 HydrophobicContact CD2-CD2 3.89Å; Y787-L802 HydrophobicContact CE1-CD1 3.99Å; Y787-L802 HydrophobicContact CE2-CD1 4.03Å; Y787-L802 HydrophobicContact CE2-CD2 3.9Å; Y787-L802 HydrophobicContact CE2-CG 4.4Å; Y787-L802 HydrophobicContact CG-CD1 4.28Å; E798-L802 WeakPolarHBondContact O-CB 3.45Å; E798-L802 VanDerWaalsContact O-CG 3.3Å; E798-L802 WeakPolarHBondContact O-CG 3.46Å; E798-L802 PolarHBondContact O-N 3.47Å; L802-S805 PolarHBondContact O-N 3.35Å; L802-L806 HydrophobicContact CB-CD1 4.43Å; L802-L806 HydrophobicContact CD2-CD1 4.27Å; L802-L806 WeakPolarHBondContact O-CB 3.49Å; L802-L806 WeakPolarHBondContact O-CG 3.4Å; L802-L806 PolarHBondContact O-N 2.96Å; L802-V813 HydrophobicContact CB-CG1 4.15Å; L802-F817 HydrophobicContact CD1-CE2 4.13Å; L802-F817 HydrophobicContact CD1-CZ 4.21Å
803	A	89.5	Confident	87.4	Confident	6 Å²	6	68.9 Å²	68.9	5%	0.05	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-48.2	174.3	0	0	0	0	0	111.6	V799 D800 W807 L808 R810 V813	V799-A803 WeakPolarHBondContact O-CB 3.48Å; V799-A803 PolarHBondContact O-N 3.06Å; D800-A803 PolarHBondContact O-N 3.31Å; A803-W807 PolarHBondContact O-N 2.92Å; A803-L808 WeakPolarHBondContact CA-O 3.35Å; A803-L808 WeakPolarHBondContact CB-O 3.37Å; A803-L808 PolarHBondContact O-N 3.29Å; A803-L808 VanDerWaalsContact O-N 3.13Å; A803-R810 HydrophobicContact CB-CB 4.34Å; A803-R810 HydrophobicContact CB-CG 3.44Å; A803-R810 VanDerWaalsContact CB-CG 3.44Å; A803-V813 HydrophobicContact CB-CG2 4.08Å
804	S	86.6	Confident	87.6	Confident	90 Å²	90	62.3 Å²	62.3	63%	0.629	30%	0.302	S	S	*	.	H	α-helix	trans	-63.3	-47.6	175.8	-65.1	0	0	0	0	113.1	D800 K801 L806 W807	D800-S804 PolarHBondContact O-N 3.03Å; D800-S804 VanDerWaalsContact O-N 3.12Å; D800-S804 PolarHBondContact O-OG 2.98Å; K801-S804 PolarHBondContact O-N 3.31Å; S804-L806 VanDerWaalsContact C-N 3.28Å; S804-L806 PolarHBondContact O-N 3.46Å; S804-W807 PolarHBondContact O-N 2.86Å
805	S	85.6	Confident	87.8	Confident	29 Å²	29	63.3 Å²	63.3	20%	0.203	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	7.7	-177.2	-60.4	0	0	0	0	114.8	E773 K801 L802	E773-S805 WeakPolarHBondContact CG-O 3.36Å; K801-S805 VanDerWaalsContact O-CB 3.32Å; K801-S805 WeakPolarHBondContact O-CB 3.39Å; K801-S805 PolarHBondContact O-N 3.37Å; K801-S805 PolarHBondContact O-OG 2.96Å; L802-S805 PolarHBondContact O-N 3.35Å
806	L	85.9	Confident	88.1	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-2.2	169	-61.1	171.5	0	0	0	112.2	P769 Q772 R780 F783 L784 L802 S804 L808	P769-L806 HydrophobicContact CB-CD2 3.87Å; P769-L806 HydrophobicContact CB-CG 4.31Å; Q772-L806 HydrophobicContact CB-CD2 3.48Å; Q772-L806 VanDerWaalsContact CB-CD2 3.48Å; Q772-L806 HydrophobicContact CG-CD2 4.14Å; R780-L806 WeakPolarHBondContact CD-O 3.31Å; R780-L806 PolarHBondContact NH1-O 2.77Å; F783-L806 HydrophobicContact CD1-CD1 3.84Å; F783-L806 HydrophobicContact CD1-CD2 3.65Å; F783-L806 HydrophobicContact CD1-CG 4.36Å; F783-L806 HydrophobicContact CE1-CD1 4.13Å; F783-L806 HydrophobicContact CE1-CD2 3.93Å; F783-L806 HydrophobicContact CE1-CG 4.5Å; L784-L806 HydrophobicContact CD2-CD1 3.49Å; L784-L806 VanDerWaalsContact CD2-CD1 3.49Å; L784-L806 HydrophobicContact CG-CD1 3.93Å; L802-L806 HydrophobicContact CB-CD1 4.43Å; L802-L806 HydrophobicContact CD2-CD1 4.27Å; L802-L806 WeakPolarHBondContact O-CB 3.49Å; L802-L806 WeakPolarHBondContact O-CG 3.4Å; L802-L806 PolarHBondContact O-N 2.96Å; S804-L806 VanDerWaalsContact C-N 3.28Å; S804-L806 PolarHBondContact O-N 3.46Å; L806-L808 HydrophobicContact CB-CB 4.43Å; L806-L808 HydrophobicContact CB-CD1 3.91Å; L806-L808 HydrophobicContact CB-CG 3.92Å; L806-L808 HydrophobicContact CD1-CD1 4.17Å; L806-L808 PolarHBondContact O-N 3.37Å
807	W	85.7	Confident	88.4	Confident	186 Å²	186	55.5 Å²	55.5	71%	0.705	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	45.6	-174.2	-60.4	34.8	0	0	0	111.1	E773 R780 A803 S804	E773-W807 PolarHBondContact OE2-NE1 3.36Å; R780-W807 PolarHBondContact NH1-O 3.37Å; A803-W807 PolarHBondContact O-N 2.92Å; S804-W807 PolarHBondContact O-N 2.86Å
808	L	88.1	Confident	88.8	Confident	18 Å²	18	54.3 Å²	54.3	9%	0.094	28%	0.278	C	S	.	.			trans	-117.4	150.6	177.3	-67.5	178.2	0	0	0	109	Y777 R780 L784 A803 L806 V813	Y777-L808 HydrophobicContact CD2-CD2 3.65Å; Y777-L808 HydrophobicContact CE2-CD2 3.6Å; R780-L808 HydrophobicContact CB-CD1 4.21Å; L784-L808 HydrophobicContact CD1-CD1 3.7Å; L784-L808 HydrophobicContact CG-CD1 4.4Å; A803-L808 WeakPolarHBondContact CA-O 3.35Å; A803-L808 WeakPolarHBondContact CB-O 3.37Å; A803-L808 PolarHBondContact O-N 3.29Å; A803-L808 VanDerWaalsContact O-N 3.13Å; L806-L808 HydrophobicContact CB-CB 4.43Å; L806-L808 HydrophobicContact CB-CD1 3.91Å; L806-L808 HydrophobicContact CB-CG 3.92Å; L806-L808 HydrophobicContact CD1-CD1 4.17Å; L806-L808 PolarHBondContact O-N 3.37Å; L808-V813 HydrophobicContact CB-CG2 3.87Å; L808-V813 HydrophobicContact CD1-CG2 4.27Å
809	W	90.1	Very high	89	Confident	200 Å²	200	54.4 Å²	54.4	76%	0.758	29%	0.286	S	S	*	.			trans	-69.5	147.9	175.6	-59.2	91.8	0	0	0	110.4	S811 D812 V813	W809-S811 WeakPolarHBondContact CB-OG 3.3Å; W809-S811 PolarHBondContact O-N 3.36Å; W809-S811 VanDerWaalsContact O-N 3.15Å; W809-D812 WeakPolarHBondContact CB-OD2 3.32Å; W809-D812 VanDerWaalsContact CD1-OD2 3.29Å; W809-D812 PolarHBondContact N-OD2 3.48Å; W809-D812 PolarHBondContact O-N 2.83Å; W809-V813 PolarHBondContact O-N 2.64Å; W809-V813 VanDerWaalsContact O-N 3.17Å
810	R	89.4	Confident	89	Confident	141 Å²	141	55.3 Å²	55.3	53%	0.532	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-25.3	176.8	-68.6	162	77.6	-170.8	7.2	111.8	D800 A803 S814	D800-R810 IonicContact OD1-CZ 3.47Å; D800-R810 IonicContact OD1-NE 3.59Å; D800-R810 PolarHBondContact OD1-NE 3.08Å; D800-R810 IonicContact OD1-NH2 3.56Å; D800-R810 PolarHBondContact OD1-NH2 2.88Å; D800-R810 IonicContact OD2-CZ 3.41Å; D800-R810 IonicContact OD2-NE 3.38Å; D800-R810 IonicContact OD2-NH2 2.68Å; D800-R810 PolarHBondContact OD2-NH2 3.34Å; A803-R810 HydrophobicContact CB-CB 4.34Å; A803-R810 HydrophobicContact CB-CG 3.44Å; A803-R810 VanDerWaalsContact CB-CG 3.44Å; R810-S814 WeakPolarHBondContact O-CB 3.37Å; R810-S814 PolarHBondContact O-N 2.95Å; R810-S814 PolarHBondContact O-OG 3.32Å
811	S	90.6	Very high	89.1	Confident	74 Å²	74	56.2 Å²	56.2	52%	0.517	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-45.9	168.3	42.7	0	0	0	0	112.6	W809 S814 G815	W809-S811 WeakPolarHBondContact CB-OG 3.3Å; W809-S811 PolarHBondContact O-N 3.36Å; W809-S811 VanDerWaalsContact O-N 3.15Å; S811-S814 PolarHBondContact O-N 2.95Å; S811-G815 WeakPolarHBondContact O-CA 3.07Å; S811-G815 PolarHBondContact O-N 2.76Å
812	D	88.8	Confident	89.2	Confident	50 Å²	50	60.9 Å²	60.9	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-79.7	-42	-167.1	-41.9	-16.9	0	0	0	109.7	W809 G815 H816	W809-D812 WeakPolarHBondContact CB-OD2 3.32Å; W809-D812 VanDerWaalsContact CD1-OD2 3.29Å; W809-D812 PolarHBondContact N-OD2 3.48Å; W809-D812 PolarHBondContact O-N 2.83Å; D812-G815 PolarHBondContact O-N 2.88Å; D812-H816 WeakPolarHBondContact O-CB 3.44Å; D812-H816 PolarHBondContact O-N 3.39Å
813	V	90.8	Very high	89.2	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.2	-55.6	169	-179.3	0	0	0	0	109.4	L784 V799 L802 A803 L808 W809 G815 H816 F817	L784-V813 HydrophobicContact CD1-CG2 4.24Å; L784-V813 HydrophobicContact CD2-CG1 4.06Å; V799-V813 HydrophobicContact CG1-CB 4.46Å; V799-V813 HydrophobicContact CG1-CG1 4.07Å; L802-V813 HydrophobicContact CB-CG1 4.15Å; A803-V813 HydrophobicContact CB-CG2 4.08Å; L808-V813 HydrophobicContact CB-CG2 3.87Å; L808-V813 HydrophobicContact CD1-CG2 4.27Å; W809-V813 PolarHBondContact O-N 2.64Å; W809-V813 VanDerWaalsContact O-N 3.17Å; V813-G815 VanDerWaalsContact C-N 3.3Å; V813-G815 PolarHBondContact O-N 3.49Å; V813-H816 PolarHBondContact O-N 3.37Å; V813-F817 HydrophobicContact CG1-CD2 4Å; V813-F817 HydrophobicContact CG1-CE2 3.83Å; V813-F817 VanDerWaalsContact O-CD2 3.23Å; V813-F817 WeakPolarHBondContact O-CD2 3.36Å; V813-F817 PolarHBondContact O-N 2.84Å; V813-F817 VanDerWaalsContact O-N 3.12Å
814	S	90.7	Very high	88.9	Confident	43 Å²	43	69.8 Å²	69.8	30%	0.301	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-40.6	179	-59.7	0	0	0	0	112.6	V799 R810 S811 F817 V818	V799-S814 WeakPolarHBondContact CG1-OG 3.22Å; R810-S814 WeakPolarHBondContact O-CB 3.37Å; R810-S814 PolarHBondContact O-N 2.95Å; R810-S814 PolarHBondContact O-OG 3.32Å; S811-S814 PolarHBondContact O-N 2.95Å; S814-F817 PolarHBondContact O-N 3.34Å; S814-V818 WeakPolarHBondContact O-CB 3.15Å; S814-V818 VanDerWaalsContact O-CG2 3.3Å; S814-V818 WeakPolarHBondContact O-CG2 3.23Å; S814-V818 PolarHBondContact O-N 3.39Å
815	G	89.9	Confident	88.9	Confident	42 Å²	42	69.2 Å²	69.2	43%	0.433	34%	0.344	S	S	.	.	H	α-helix	trans	-65.2	-39	179.2	0	0	0	0	0	112.4	S811 D812 V813 V818 G819	S811-G815 WeakPolarHBondContact O-CA 3.07Å; S811-G815 PolarHBondContact O-N 2.76Å; D812-G815 PolarHBondContact O-N 2.88Å; V813-G815 VanDerWaalsContact C-N 3.3Å; V813-G815 PolarHBondContact O-N 3.49Å; G815-V818 PolarHBondContact O-N 2.83Å; G815-G819 PolarHBondContact O-N 3.27Å
816	H	91	Very high	88.9	Confident	27 Å²	27	73.7 Å²	73.7	13%	0.125	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-49.5	173.5	-166.3	83.3	0	0	0	111.2	K781 L784 T785 D812 V813 V818 G819 T820	K781-H816 PolarHBondContact O-CE1 2.74Å; K781-H816 PolarHBondContact O-NE2 3.14Å; L784-H816 VanDerWaalsContact CB-CD2 3.41Å; L784-H816 WeakPolarHBondContact CB-CD2 3.26Å; L784-H816 HydrophobicContact CD1-CB 4.13Å; T785-H816 PolarHBondContact N-NE2 3.49Å; T785-H816 PolarHBondContact OG1-CE1 3.06Å; T785-H816 VanDerWaalsContact OG1-CE1 3.29Å; T785-H816 PolarHBondContact OG1-NE2 3.42Å; D812-H816 WeakPolarHBondContact O-CB 3.44Å; D812-H816 PolarHBondContact O-N 3.39Å; V813-H816 PolarHBondContact O-N 3.37Å; H816-V818 VanDerWaalsContact C-N 3.34Å; H816-V818 PolarHBondContact O-N 3.26Å; H816-G819 PolarHBondContact O-N 2.96Å; H816-T820 WeakPolarHBondContact O-CB 3.47Å; H816-T820 PolarHBondContact O-N 2.92Å; H816-T820 PolarHBondContact O-OG1 2.91Å
817	F	92.4	Very high	88.8	Confident	3 Å²	3	78.6 Å²	78.6	1%	0.013	38%	0.384	C	S	.	.	H	α-helix	trans	-60.8	-38.7	175.8	-78.5	-79.9	0	0	0	112.8	L784 Y787 F788 P794 L802 V813 S814 R821	L784-F817 HydrophobicContact CD2-CE2 4.06Å; Y787-F817 AromaticContact CD1-CE1 3.99Å; Y787-F817 HydrophobicContact CD1-CE1 3.99Å; Y787-F817 AromaticContact CD1-CZ 3.6Å; Y787-F817 HydrophobicContact CD1-CZ 3.6Å; Y787-F817 HydrophobicContact CE1-CZ 4.31Å; Y787-F817 HydrophobicContact CG-CZ 4.24Å; F788-F817 HydrophobicContact CB-CD1 4.5Å; F788-F817 HydrophobicContact CB-CE1 4.17Å; F788-F817 AromaticContact CD2-CD1 3.8Å; F788-F817 HydrophobicContact CD2-CD1 3.8Å; F788-F817 HydrophobicContact CD2-CE1 4.18Å; P794-F817 HydrophobicContact CG-CD1 3.62Å; P794-F817 HydrophobicContact CG-CD2 3.94Å; P794-F817 HydrophobicContact CG-CE1 3.64Å; P794-F817 HydrophobicContact CG-CE2 3.96Å; P794-F817 HydrophobicContact CG-CG 3.82Å; P794-F817 HydrophobicContact CG-CZ 3.84Å; L802-F817 HydrophobicContact CD1-CE2 4.13Å; L802-F817 HydrophobicContact CD1-CZ 4.21Å; V813-F817 HydrophobicContact CG1-CD2 4Å; V813-F817 HydrophobicContact CG1-CE2 3.83Å; V813-F817 VanDerWaalsContact O-CD2 3.23Å; V813-F817 WeakPolarHBondContact O-CD2 3.36Å; V813-F817 PolarHBondContact O-N 2.84Å; V813-F817 VanDerWaalsContact O-N 3.12Å; S814-F817 PolarHBondContact O-N 3.34Å; F817-R821 WeakPolarHBondContact O-CB 3.38Å; F817-R821 VanDerWaalsContact O-CG 3.28Å; F817-R821 WeakPolarHBondContact O-CG 3.29Å; F817-R821 PolarHBondContact O-N 2.99Å; F817-R821 PolarHBondContact O-NE 3.47Å
818	V	91.8	Very high	88.4	Confident	71 Å²	71	72.6 Å²	72.6	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-71.9	-41.2	176.6	170.2	0	0	0	0	112	S814 G815 H816 R822	S814-V818 WeakPolarHBondContact O-CB 3.15Å; S814-V818 VanDerWaalsContact O-CG2 3.3Å; S814-V818 WeakPolarHBondContact O-CG2 3.23Å; S814-V818 PolarHBondContact O-N 3.39Å; G815-V818 PolarHBondContact O-N 2.83Å; H816-V818 VanDerWaalsContact C-N 3.34Å; H816-V818 PolarHBondContact O-N 3.26Å; V818-R822 PolarHBondContact O-N 3.27Å; V818-R822 VanDerWaalsContact O-N 3.08Å
819	G	90.3	Very high	88.1	Confident	30 Å²	30	78 Å²	78	31%	0.309	40%	0.395	S	S	.	.	H	α-helix	trans	-66.6	-47.8	179.7	0	0	0	0	0	112.5	G815 H816 R822 K823	G815-G819 PolarHBondContact O-N 3.27Å; H816-G819 PolarHBondContact O-N 2.96Å; G819-R822 WeakPolarHBondContact O-CB 3.46Å; G819-R822 PolarHBondContact O-N 3.19Å; G819-R822 VanDerWaalsContact O-N 3.12Å; G819-K823 PolarHBondContact O-N 3.19Å
820	T	88.3	Confident	87.7	Confident	30 Å²	30	72.8 Å²	72.8	18%	0.184	39%	0.389	C	S	.	.	H	α-helix	trans	-67	-38.1	179.6	-53.2	0	0	0	0	111.6	F788 H816 R822 K823 C824	F788-T820 HydrophobicContact CD1-CG2 3.45Å; F788-T820 VanDerWaalsContact CD1-CG2 3.45Å; F788-T820 HydrophobicContact CD2-CG2 4.46Å; F788-T820 HydrophobicContact CE1-CG2 3.58Å; F788-T820 HydrophobicContact CG-CG2 3.93Å; F788-T820 HydrophobicContact CZ-CG2 4.17Å; H816-T820 WeakPolarHBondContact O-CB 3.47Å; H816-T820 PolarHBondContact O-N 2.92Å; H816-T820 PolarHBondContact O-OG1 2.91Å; T820-R822 VanDerWaalsContact C-N 3.34Å; T820-R822 PolarHBondContact O-N 2.99Å; T820-K823 PolarHBondContact O-N 3.06Å; T820-C824 WeakPolarHBondContact O-CB 3.5Å; T820-C824 PolarHBondContact O-N 3.16Å
821	R	90.1	Very high	87.1	Confident	63 Å²	63	73 Å²	73	24%	0.238	40%	0.396	C	S	.	.	H	α-helix	trans	-59.1	-42.2	168.5	-76	-172.3	-64.4	-110.7	-1	112.5	F788 P792 F817 C824 V825	F788-R821 HydrophobicContact CE2-CG 3.44Å; F788-R821 VanDerWaalsContact CE2-CG 3.44Å; F788-R821 HydrophobicContact CZ-CG 3.76Å; P792-R821 PolarHBondContact O-NH1 3.12Å; F817-R821 WeakPolarHBondContact O-CB 3.38Å; F817-R821 VanDerWaalsContact O-CG 3.28Å; F817-R821 WeakPolarHBondContact O-CG 3.29Å; F817-R821 PolarHBondContact O-N 2.99Å; F817-R821 PolarHBondContact O-NE 3.47Å; R821-C824 PolarHBondContact O-N 3.45Å; R821-V825 WeakPolarHBondContact O-CG2 3.48Å; R821-V825 PolarHBondContact O-N 2.88Å
822	R	90.1	Very high	86.3	Confident	176 Å²	176	76.5 Å²	76.5	66%	0.664	40%	0.404	S	S	*	.	H	α-helix	trans	-64.6	-42.3	178.8	-170.1	-174.9	-62.6	168.2	1.5	111.7	V818 G819 T820 V825 Q826	V818-R822 PolarHBondContact O-N 3.27Å; V818-R822 VanDerWaalsContact O-N 3.08Å; G819-R822 WeakPolarHBondContact O-CB 3.46Å; G819-R822 PolarHBondContact O-N 3.19Å; G819-R822 VanDerWaalsContact O-N 3.12Å; T820-R822 VanDerWaalsContact C-N 3.34Å; T820-R822 PolarHBondContact O-N 2.99Å; R822-V825 PolarHBondContact O-N 3.14Å; R822-Q826 WeakPolarHBondContact O-CB 3.35Å; R822-Q826 PolarHBondContact O-N 2.86Å
823	K	87.4	Confident	85.4	Confident	137 Å²	137	77.7 Å²	77.7	60%	0.596	41%	0.414	S	S	*	.	H	α-helix	trans	-59.5	-52	174.5	-71.6	-173.9	173.4	-165.7	0	111.6	G819 T820 V825 Q826 E827	G819-K823 PolarHBondContact O-N 3.19Å; T820-K823 PolarHBondContact O-N 3.06Å; K823-V825 VanDerWaalsContact C-N 3.35Å; K823-V825 PolarHBondContact O-N 3.23Å; K823-Q826 CarbonylContact O-C 3.23Å; K823-Q826 WeakPolarHBondContact O-CB 3.47Å; K823-Q826 PolarHBondContact O-N 2.91Å; K823-E827 WeakPolarHBondContact O-CG 3.42Å; K823-E827 PolarHBondContact O-N 3.05Å
824	C	84	Confident	83.7	Confident	56 Å²	56	82.4 Å²	82.4	38%	0.378	45%	0.448	S	S	.	.	H	α-helix	trans	-56.6	-45	177.8	175.8	0	0	0	0	112.3	T820 R821 Q826 E827 C828	T820-C824 WeakPolarHBondContact O-CB 3.5Å; T820-C824 PolarHBondContact O-N 3.16Å; R821-C824 PolarHBondContact O-N 3.45Å; C824-Q826 PolarHBondContact O-N 2.86Å; C824-E827 PolarHBondContact O-N 3.37Å; C824-C828 PolarHBondContact O-N 2.76Å; C824-C828 PolarHBondContact O-SG 2.92Å
825	V	85.9	Confident	82.2	Confident	78 Å²	78	86.1 Å²	86.1	47%	0.473	47%	0.468	S	S	.	.	H	α-helix	trans	-62.3	-42.7	174.7	170.5	0	0	0	0	111.7	R821 R822 K823 E827 C828 E829	R821-V825 WeakPolarHBondContact O-CG2 3.48Å; R821-V825 PolarHBondContact O-N 2.88Å; R822-V825 PolarHBondContact O-N 3.14Å; K823-V825 VanDerWaalsContact C-N 3.35Å; K823-V825 PolarHBondContact O-N 3.23Å; V825-E827 VanDerWaalsContact C-N 3.34Å; V825-E827 PolarHBondContact O-N 2.8Å; V825-C828 PolarHBondContact O-N 3.32Å; V825-E829 HydrophobicContact CG1-CG 4.34Å; V825-E829 WeakPolarHBondContact O-CB 3.37Å; V825-E829 WeakPolarHBondContact O-CG 3.17Å; V825-E829 PolarHBondContact O-N 3.27Å
826	Q	86.4	Confident	80.3	Confident	123 Å²	123	89.4 Å²	89.4	58%	0.575	48%	0.475	S	S	*	.	H	α-helix	trans	-67.3	-33.2	178.5	-174.8	175.8	-7.3	0	0	112.7	R822 K823 C824 S830	R822-Q826 WeakPolarHBondContact O-CB 3.35Å; R822-Q826 PolarHBondContact O-N 2.86Å; K823-Q826 CarbonylContact O-C 3.23Å; K823-Q826 WeakPolarHBondContact O-CB 3.47Å; K823-Q826 PolarHBondContact O-N 2.91Å; C824-Q826 PolarHBondContact O-N 2.86Å; Q826-S830 WeakPolarHBondContact O-CB 3.19Å; Q826-S830 PolarHBondContact O-N 3.37Å; Q826-S830 PolarHBondContact O-OG 3.06Å
827	E	83.7	Confident	78.3	Confident	103 Å²	103	96.4 Å²	96.4	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-69.2	-44	172.4	-75.3	160.8	-165.8	0	0	110.9	K823 C824 V825 S830 Q831	K823-E827 WeakPolarHBondContact O-CG 3.42Å; K823-E827 PolarHBondContact O-N 3.05Å; C824-E827 PolarHBondContact O-N 3.37Å; V825-E827 VanDerWaalsContact C-N 3.34Å; V825-E827 PolarHBondContact O-N 2.8Å; E827-S830 WeakPolarHBondContact CA-OG 3.49Å; E827-S830 PolarHBondContact O-N 3.44Å; E827-S830 PolarHBondContact O-OG 2.99Å; E827-S830 VanDerWaalsContact O-OG 3.14Å; E827-Q831 VanDerWaalsContact O-CB 3.3Å; E827-Q831 WeakPolarHBondContact O-CB 3.3Å; E827-Q831 VanDerWaalsContact O-CG 3.3Å; E827-Q831 WeakPolarHBondContact O-CG 3.49Å; E827-Q831 PolarHBondContact O-N 3.34Å
828	C	77.4	Confident	76.4	Confident	59 Å²	59	99.9 Å²	99.9	40%	0.399	55%	0.55	S	S	.	.	H	α-helix	trans	-62.3	-42.8	171.2	-64.5	0	0	0	0	112.6	C824 V825 S830 Q832 P833	C824-C828 PolarHBondContact O-N 2.76Å; C824-C828 PolarHBondContact O-SG 2.92Å; V825-C828 PolarHBondContact O-N 3.32Å; C828-S830 VanDerWaalsContact C-N 3.27Å; C828-S830 PolarHBondContact O-N 3.35Å; C828-Q832 WeakPolarHBondContact O-CA 3.33Å; C828-Q832 PolarHBondContact O-N 3.19Å; C828-P833 HydrophobicContact CB-CG 4.32Å; C828-P833 WeakPolarHBondContact O-CD 3.48Å
829	E	81.6	Confident	74.5	Confident	133 Å²	133	103.6 Å²	103.6	62%	0.621	56%	0.56	S	S	*	*	H	α-helix	trans	-64.6	-29.7	177.7	-77.2	-177.8	168.6	0	0	112.7	V825 Q832	V825-E829 HydrophobicContact CG1-CG 4.34Å; V825-E829 WeakPolarHBondContact O-CB 3.37Å; V825-E829 WeakPolarHBondContact O-CG 3.17Å; V825-E829 PolarHBondContact O-N 3.27Å; E829-Q832 PolarHBondContact O-NE2 2.8Å
830	S	80	Confident	72.8	Confident	90 Å²	90	104.7 Å²	104.7	63%	0.629	56%	0.563	S	S	*	*	H	α-helix	trans	-89.6	-32.9	178.6	52	0	0	0	0	114	Q826 E827 C828	Q826-S830 WeakPolarHBondContact O-CB 3.19Å; Q826-S830 PolarHBondContact O-N 3.37Å; Q826-S830 PolarHBondContact O-OG 3.06Å; E827-S830 WeakPolarHBondContact CA-OG 3.49Å; E827-S830 PolarHBondContact O-N 3.44Å; E827-S830 PolarHBondContact O-OG 2.99Å; E827-S830 VanDerWaalsContact O-OG 3.14Å; C828-S830 VanDerWaalsContact C-N 3.27Å; C828-S830 PolarHBondContact O-N 3.35Å
831	Q	78.4	Confident	71.6	Confident	146 Å²	146	107.9 Å²	107.9	68%	0.682	58%	0.577	S	S	*	*	H	α-helix	trans	-83.4	-19	176.8	-65.9	177.7	10.6	0	0	113.4	E827	E827-Q831 VanDerWaalsContact O-CB 3.3Å; E827-Q831 WeakPolarHBondContact O-CB 3.3Å; E827-Q831 VanDerWaalsContact O-CG 3.3Å; E827-Q831 WeakPolarHBondContact O-CG 3.49Å; E827-Q831 PolarHBondContact O-N 3.34Å
832	Q	73.4	Confident	69.9	Low	146 Å²	146	110.6 Å²	110.6	68%	0.682	59%	0.592	S	S	*	*			trans	48.7	50.8	-177.1	-65.7	-72.6	-52	0	0	113.7	C828 E829 S834	C828-Q832 WeakPolarHBondContact O-CA 3.33Å; C828-Q832 PolarHBondContact O-N 3.19Å; E829-Q832 PolarHBondContact O-NE2 2.8Å; Q832-S834 PolarHBondContact O-N 3.23Å; Q832-S834 VanDerWaalsContact O-N 3.08Å
833	P	69.9	Low	68.4	Low	75 Å²	75	106 Å²	106	49%	0.487	58%	0.581	S	S	.	*			trans	-67.5	111.5	-175.5	29.6	-33.6	0	0	0	110.8	C828 V835	C828-P833 HydrophobicContact CB-CG 4.32Å; C828-P833 WeakPolarHBondContact O-CD 3.48Å; P833-V835 PolarHBondContact O-N 3.45Å
834	S	54.9	Low	67.1	Low	100 Å²	100	101.9 Å²	101.9	70%	0.699	57%	0.565	S	S	*	*			trans	-79.8	97	179	44.7	0	0	0	0	111.3	Q832 L836	Q832-S834 PolarHBondContact O-N 3.23Å; Q832-S834 VanDerWaalsContact O-N 3.08Å; S834-L836 PolarHBondContact O-N 3.4Å
835	V	58.8	Low	66	Low	120 Å²	120	102.6 Å²	102.6	73%	0.727	57%	0.571	S	S	*	*			trans	-70	93.5	168.4	-177.3	0	0	0	0	109	P833 L837	P833-V835 PolarHBondContact O-N 3.45Å; V835-L837 HydrophobicContact CG1-CD2 4.3Å; V835-L837 PolarHBondContact O-N 2.86Å
836	L	50.5	Low	64.7	Low	112 Å²	112	105 Å²	105	59%	0.586	58%	0.575	S	S	*	*			trans	-68.9	100.5	170.7	-60.2	173.7	0	0	0	108.6	S834 G838 F839	S834-L836 PolarHBondContact O-N 3.4Å; L836-G838 PolarHBondContact O-N 3.48Å; L836-F839 HydrophobicContact CB-CD2 4.5Å; L836-F839 HydrophobicContact CB-CE2 3.72Å; L836-F839 HydrophobicContact CB-CZ 4.07Å; L836-F839 HydrophobicContact CD1-CE2 4.28Å; L836-F839 HydrophobicContact CD1-CZ 4.03Å; L836-F839 HydrophobicContact CG-CE2 4.49Å; L836-F839 WeakPolarHBondContact O-CD2 3.37Å
837	L	48	Very low	63.5	Low	173 Å²	173	104.5 Å²	104.5	91%	0.906	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	102.6	179.5	-72.1	169	0	0	0	110.2	V835	V835-L837 HydrophobicContact CG1-CD2 4.3Å; V835-L837 PolarHBondContact O-N 2.86Å
838	G	52.5	Low	61.9	Low	77 Å²	77	112 Å²	112	79%	0.794	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.3	-18	-179.2	0	0	0	0	0	114.9	L836	L836-G838 PolarHBondContact O-N 3.48Å
839	F	52.5	Low	61.3	Low	148 Å²	148	112.2 Å²	112.2	65%	0.649	59%	0.594	S	S	*	*			trans	-72.2	137.4	179.9	-58	-54.2	0	0	0	113.5	L836	L836-F839 HydrophobicContact CB-CD2 4.5Å; L836-F839 HydrophobicContact CB-CE2 3.72Å; L836-F839 HydrophobicContact CB-CZ 4.07Å; L836-F839 HydrophobicContact CD1-CE2 4.28Å; L836-F839 HydrophobicContact CD1-CZ 4.03Å; L836-F839 HydrophobicContact CG-CE2 4.49Å; L836-F839 WeakPolarHBondContact O-CD2 3.37Å
840	S	55.3	Low	59.6	Low	54 Å²	54	114.5 Å²	114.5	38%	0.378	61%	0.611	S	S	.	*			trans	-75.1	130.1	164.7	175.2	0	0	0	0	109.9	H842 D843 L844	S840-H842 PolarHBondContact O-N 3.12Å; S840-H842 PolarHBondContact OG-N 2.71Å; S840-D843 WeakPolarHBondContact CB-OD2 3.15Å; S840-D843 PolarHBondContact O-N 3.04Å; S840-D843 PolarHBondContact OG-OD2 2.87Å; S840-L844 PolarHBondContact O-N 3.13Å
841	M	61.9	Low	58.2	Low	96 Å²	96	115.4 Å²	115.4	47%	0.473	61%	0.608	S	S	.	*	H	α-helix	trans	-59.3	-30.6	174.9	-70.2	-58.4	-58.5	0	0	112.4	D843 L844 S845	M841-D843 PolarHBondContact O-N 3.37Å; M841-L844 HydrophobicContact CE-CD2 3.8Å; M841-L844 WeakPolarHBondContact O-CB 3.46Å; M841-L844 PolarHBondContact O-N 3.35Å; M841-L844 HydrophobicContact SD-CD2 4.17Å; M841-S845 PolarHBondContact O-N 3.28Å; M841-S845 VanDerWaalsContact O-N 3.14Å; M841-S845 PolarHBondContact O-OG 3.08Å
842	H	56	Low	56.8	Low	120 Å²	120	117.6 Å²	117.6	56%	0.556	62%	0.618	S	S	*	*	H	α-helix	trans	-69.3	-19	175.7	174	73.6	0	0	0	113.3	S840 S845 K846	S840-H842 PolarHBondContact O-N 3.12Å; S840-H842 PolarHBondContact OG-N 2.71Å; H842-S845 PolarHBondContact O-OG 2.95Å; H842-K846 PolarHBondContact CD2-NZ 3.01Å; H842-K846 WeakPolarHBondContact NE2-CE 3.47Å; H842-K846 PolarHBondContact NE2-NZ 2.97Å; H842-K846 WeakPolarHBondContact O-CE 3.48Å; H842-K846 WeakPolarHBondContact O-CG 3.36Å
843	D	57.5	Low	55.9	Low	80 Å²	80	115.3 Å²	115.3	43%	0.428	61%	0.607	S	S	.	*	H	α-helix	trans	-96.8	-27.8	172.9	-61.2	-48.6	0	0	0	111.8	S840 M841 S845 K846	S840-D843 WeakPolarHBondContact CB-OD2 3.15Å; S840-D843 PolarHBondContact O-N 3.04Å; S840-D843 PolarHBondContact OG-OD2 2.87Å; M841-D843 PolarHBondContact O-N 3.37Å; D843-S845 VanDerWaalsContact C-N 3.32Å; D843-S845 PolarHBondContact O-N 3.35Å; D843-K846 WeakPolarHBondContact O-CB 3.44Å; D843-K846 PolarHBondContact O-N 3.34Å; D843-K846 VanDerWaalsContact O-N 3.12Å; D843-K846 IonicContact OD1-NZ 2.74Å; D843-K846 PolarHBondContact OD1-NZ 3.46Å
844	L	60.6	Low	54.7	Low	51 Å²	51	116.5 Å²	116.5	27%	0.267	61%	0.609	S	S	.	*	H	α-helix	trans	-57.9	-45.3	169.2	-162.5	82	0	0	0	111	S840 M841 K846 L847 H849 F853	S840-L844 PolarHBondContact O-N 3.13Å; M841-L844 HydrophobicContact CE-CD2 3.8Å; M841-L844 WeakPolarHBondContact O-CB 3.46Å; M841-L844 PolarHBondContact O-N 3.35Å; M841-L844 HydrophobicContact SD-CD2 4.17Å; L844-K846 PolarHBondContact O-N 2.9Å; L844-L847 HydrophobicContact CD1-CD1 4.44Å; L844-L847 WeakPolarHBondContact O-CB 3.33Å; L844-L847 PolarHBondContact O-N 3.2Å; L844-H849 PolarHBondContact O-NE2 3.45Å; L844-F853 HydrophobicContact CD2-CE2 4.03Å; L844-F853 HydrophobicContact CD2-CZ 4.14Å
845	S	60.8	Low	54.2	Low	71 Å²	71	116.5 Å²	116.5	50%	0.497	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	-1.1	177.3	61.8	0	0	0	0	115	M841 H842 D843	M841-S845 PolarHBondContact O-N 3.28Å; M841-S845 VanDerWaalsContact O-N 3.14Å; M841-S845 PolarHBondContact O-OG 3.08Å; H842-S845 PolarHBondContact O-OG 2.95Å; D843-S845 VanDerWaalsContact C-N 3.32Å; D843-S845 PolarHBondContact O-N 3.35Å
846	K	58.9	Low	53.3	Low	128 Å²	128	119.5 Å²	119.5	56%	0.557	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-10.7	172.3	-61.2	170.8	-171.9	158.1	0	112.3	H842 D843 L844	H842-K846 PolarHBondContact CD2-NZ 3.01Å; H842-K846 WeakPolarHBondContact NE2-CE 3.47Å; H842-K846 PolarHBondContact NE2-NZ 2.97Å; H842-K846 WeakPolarHBondContact O-CE 3.48Å; H842-K846 WeakPolarHBondContact O-CG 3.36Å; D843-K846 WeakPolarHBondContact O-CB 3.44Å; D843-K846 PolarHBondContact O-N 3.34Å; D843-K846 VanDerWaalsContact O-N 3.12Å; D843-K846 IonicContact OD1-NZ 2.74Å; D843-K846 PolarHBondContact OD1-NZ 3.46Å; L844-K846 PolarHBondContact O-N 2.9Å
847	L	59.7	Low	52.8	Low	113 Å²	113	120.5 Å²	120.5	59%	0.592	63%	0.627	S	S	*	*	S	Bend	trans	-84.9	143.7	176.2	-60	175.1	0	0	0	109.9	L844 H849	L844-L847 HydrophobicContact CD1-CD1 4.44Å; L844-L847 WeakPolarHBondContact O-CB 3.33Å; L844-L847 PolarHBondContact O-N 3.2Å; L847-H849 PolarHBondContact O-CD2 3.31Å; L847-H849 PolarHBondContact O-N 2.97Å
848	R	50.6	Low	52.3	Low	260 Å²	260	115.8 Å²	115.8	98%	0.981	61%	0.613	S	S	*	*			trans	-75.7	111.4	170.4	-84.3	-174.8	159	-158.8	-7.4	109.7
849	H	64.8	Low	52.1	Low	63 Å²	63	121.5 Å²	121.5	29%	0.292	61%	0.612	S	S	.	*			trans	-136.5	149.3	175.6	51.2	50.4	0	0	0	109.7	L844 L847 L851 F853	L844-H849 PolarHBondContact O-NE2 3.45Å; L847-H849 PolarHBondContact O-CD2 3.31Å; L847-H849 PolarHBondContact O-N 2.97Å; H849-L851 PolarHBondContact CE1-O 3.27Å; H849-L851 PolarHBondContact ND1-O 3Å; H849-L851 PolarHBondContact O-N 3.18Å; H849-L851 VanDerWaalsContact O-N 3.1Å; H849-F853 AromaticContact CE1-CD2 3.38Å; H849-F853 WeakPolarHBondContact CE1-CD2 3.43Å; H849-F853 AromaticContact CE1-CE2 3.53Å; H849-F853 AromaticContact NE2-CD2 3.51Å; H849-F853 AromaticContact NE2-CE2 3.37Å; H849-F853 WeakPolarHBondContact NE2-CE2 3.37Å
850	D	45.9	Very low	51.3	Low	181 Å²	181	121 Å²	121	97%	0.968	61%	0.612	S	S	*	*	S	Bend	trans	-79.8	18.3	175.4	-55.5	-49.3	0	0	0	112.8
851	L	52	Low	50.6	Low	110 Å²	110	121.9 Å²	121.9	58%	0.576	63%	0.629	S	S	*	*			trans	-89.6	122.1	172.5	-59.1	177.5	0	0	0	109.9	H849 F853	H849-L851 PolarHBondContact CE1-O 3.27Å; H849-L851 PolarHBondContact ND1-O 3Å; H849-L851 PolarHBondContact O-N 3.18Å; H849-L851 VanDerWaalsContact O-N 3.1Å; L851-F853 HydrophobicContact CB-CE2 4.17Å; L851-F853 HydrophobicContact CB-CZ 4.11Å; L851-F853 HydrophobicContact CD1-CZ 4.07Å; L851-F853 PolarHBondContact O-N 2.94Å
852	E	47.4	Very low	49.3	Very low	191 Å²	191	125.2 Å²	125.2	89%	0.893	64%	0.641	S	S	*	*			trans	-83	106.7	176.8	-170.7	170.7	-132.2	0	0	110
853	F	54.8	Low	48.6	Very low	99 Å²	99	128.6 Å²	128.6	43%	0.434	66%	0.656	S	S	.	*			trans	-104.3	121.4	170.8	-63.7	-52.7	0	0	0	109.6	L844 H849 L851 A855	L844-F853 HydrophobicContact CD2-CE2 4.03Å; L844-F853 HydrophobicContact CD2-CZ 4.14Å; H849-F853 AromaticContact CE1-CD2 3.38Å; H849-F853 WeakPolarHBondContact CE1-CD2 3.43Å; H849-F853 AromaticContact CE1-CE2 3.53Å; H849-F853 AromaticContact NE2-CD2 3.51Å; H849-F853 AromaticContact NE2-CE2 3.37Å; H849-F853 WeakPolarHBondContact NE2-CE2 3.37Å; L851-F853 HydrophobicContact CB-CE2 4.17Å; L851-F853 HydrophobicContact CB-CZ 4.11Å; L851-F853 HydrophobicContact CD1-CZ 4.07Å; L851-F853 PolarHBondContact O-N 2.94Å; F853-A855 PolarHBondContact O-N 3.18Å; F853-A855 VanDerWaalsContact O-N 3.08Å
854	D	44.7	Very low	47.5	Very low	99 Å²	99	127.8 Å²	127.8	53%	0.529	67%	0.667	S	S	.	*			trans	-57.6	109.9	174.1	-81.6	-52.8	0	0	0	109.9	R790 E856	R790-D854 IonicContact CZ-OD2 3.24Å; R790-D854 IonicContact NH1-OD2 3.8Å; R790-D854 PolarHBondContact NH1-OD2 3.17Å; R790-D854 VanDerWaalsContact NH1-OD2 3.13Å; R790-D854 IonicContact NH2-OD2 2.71Å; R790-D854 PolarHBondContact NH2-OD2 3.28Å; D854-E856 PolarHBondContact O-N 3.08Å; D854-E856 VanDerWaalsContact O-N 3.13Å
855	A	45.1	Very low	46.6	Very low	101 Å²	101	135.4 Å²	135.4	84%	0.835	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-5.6	-170.7	0	0	0	0	0	115.2	F853	F853-A855 PolarHBondContact O-N 3.18Å; F853-A855 VanDerWaalsContact O-N 3.08Å
856	E	39.9	Very low	45.3	Very low	183 Å²	183	140.3 Å²	140.3	86%	0.855	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-18.9	-178.8	-73.7	-73.5	123.3	0	0	113.7	D854 A858	D854-E856 PolarHBondContact O-N 3.08Å; D854-E856 VanDerWaalsContact O-N 3.13Å; E856-A858 PolarHBondContact O-N 3.12Å
857	D	39.9	Very low	44.4	Very low	133 Å²	133	144.2 Å²	144.2	71%	0.711	73%	0.725	S	S	*	*			trans	-77.8	65.3	173.4	-97.1	-28.1	0	0	0	110.7	Y859	D857-Y859 VanDerWaalsContact O-CD2 3.25Å; D857-Y859 WeakPolarHBondContact O-CD2 3.11Å; D857-Y859 PolarHBondContact O-N 2.91Å; D857-Y859 VanDerWaalsContact O-N 3.13Å
858	A	37.4	Very low	43.2	Very low	74 Å²	74	144.7 Å²	144.7	61%	0.612	73%	0.732	S	S	*	*			trans	-60.3	113.9	171	0	0	0	0	0	109.8	E856 E860	E856-A858 PolarHBondContact O-N 3.12Å; A858-E860 PolarHBondContact O-N 3.08Å
859	Y	47.9	Very low	42.3	Very low	197 Å²	197	137.1 Å²	137.1	77%	0.773	72%	0.719	S	S	*	*			trans	-69.7	39.3	-176.9	-82.3	-93	0	0	0	114.8	D857 G861	D857-Y859 VanDerWaalsContact O-CD2 3.25Å; D857-Y859 WeakPolarHBondContact O-CD2 3.11Å; D857-Y859 PolarHBondContact O-N 2.91Å; D857-Y859 VanDerWaalsContact O-N 3.13Å; Y859-G861 PolarHBondContact O-N 3.32Å
860	E	35.9	Very low	40.9	Very low	138 Å²	138	146.1 Å²	146.1	65%	0.645	75%	0.75	S	S	*	*			trans	-64.9	127.6	154.7	-73.1	-164.3	136.6	0	0	109.3	A858 K862	A858-E860 PolarHBondContact O-N 3.08Å; E860-K862 PolarHBondContact O-N 3.41Å; E860-K862 IonicContact OE2-NZ 2.72Å; E860-K862 PolarHBondContact OE2-NZ 3.29Å
861	G	40.8	Very low	40.3	Very low	72 Å²	72	143.8 Å²	143.8	74%	0.742	74%	0.743	S	S	*	*			trans	-70.2	58.6	-173.6	0	0	0	0	0	116	Y859 H863	Y859-G861 PolarHBondContact O-N 3.32Å; G861-H863 PolarHBondContact O-N 3.36Å
862	K	33.9	Very low	39.6	Very low	166 Å²	166	145.6 Å²	145.6	72%	0.722	74%	0.742	S	S	*	*			trans	-64.8	124.6	171	-72.3	166.2	-174	148.6	0	109.1	E860 G864	E860-K862 PolarHBondContact O-N 3.41Å; E860-K862 IonicContact OE2-NZ 2.72Å; E860-K862 PolarHBondContact OE2-NZ 3.29Å; K862-G864 PolarHBondContact O-N 2.99Å
863	H	42.4	Very low	38.8	Very low	190 Å²	190	146.7 Å²	146.7	88%	0.88	74%	0.744	S	S	*	*			trans	-73.4	58.2	-177.5	-69.7	-46.4	0	0	0	114	G861 K865	G861-H863 PolarHBondContact O-N 3.36Å; H863-K865 PolarHBondContact O-N 2.89Å
864	G	33.3	Very low	37.9	Very low	63 Å²	63	145 Å²	145	65%	0.649	75%	0.754	S	S	*	*			trans	-65.5	125.2	166.5	0	0	0	0	0	110.6	K862 Q866	K862-G864 PolarHBondContact O-N 2.99Å; G864-Q866 PolarHBondContact O-N 3.43Å
865	K	41.8	Very low	37.6	Very low	212 Å²	212	147.1 Å²	147.1	92%	0.922	77%	0.765	S	S	*	*			trans	-79.6	63.9	179.7	-66.7	173.6	-176.6	165.6	0	111.3	H863	H863-K865 PolarHBondContact O-N 2.89Å
866	Q	33.1	Very low	37.6	Very low	174 Å²	174	145.8 Å²	145.8	81%	0.813	75%	0.749	S	S	*	*			trans	-60.7	141.4	169.6	-72.3	-171.3	-4.9	0	0	110.4	G864 T868	G864-Q866 PolarHBondContact O-N 3.43Å; Q866-T868 VanDerWaalsContact C-N 3.3Å; Q866-T868 PolarHBondContact O-N 2.2Å
867	R	41.8	Very low	37.7	Very low	210 Å²	210	145.1 Å²	145.1	79%	0.792	75%	0.746	S	S	*	*			trans	-88.5	49.9	-161	-164.7	177	171.7	172.2	-3.7	113.4
868	T	33.9	Very low	37.8	Very low	123 Å²	123	145.4 Å²	145.4	76%	0.755	74%	0.743	S	S	*	*	S	Bend	trans	-71.9	155.1	161.9	54.3	0	0	0	0	110.1	Q866 R870	Q866-T868 VanDerWaalsContact C-N 3.3Å; Q866-T868 PolarHBondContact O-N 2.2Å; T868-R870 PolarHBondContact O-N 3.24Å
869	S	30.8	Very low	38	Very low	100 Å²	100	143.7 Å²	143.7	70%	0.699	73%	0.729	S	S	*	*			trans	-66.7	123.1	-169.5	41.3	0	0	0	0	112.3	T871	S869-T871 PolarHBondContact O-N 3.22Å
870	R	36.3	Very low	38	Very low	253 Å²	253	138.6 Å²	138.6	96%	0.955	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	23.4	-165.8	-138.5	179.8	87.4	178.1	7.6	115.5	T868	T868-R870 PolarHBondContact O-N 3.24Å
871	T	33.8	Very low	38.4	Very low	132 Å²	132	136.3 Å²	136.3	81%	0.81	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.4	12.7	-164.3	44.6	0	0	0	0	115.2	S869	S869-T871 PolarHBondContact O-N 3.22Å
872	R	36.1	Very low	38.7	Very low	148 Å²	148	139.5 Å²	139.5	56%	0.558	69%	0.694	S	S	*	*			trans	-134.8	91.3	167.1	-152.5	173	-173.5	-169	-2.3	112	D55 C57	D55-R872 IonicContact OD2-CZ 3.16Å; D55-R872 IonicContact OD2-NH2 2.79Å; D55-R872 PolarHBondContact OD2-NH2 2.89Å; C57-R872 VanDerWaalsContact CB-NH2 3.26Å; C57-R872 VanDerWaalsContact O-CZ 3.29Å; C57-R872 PolarHBondContact O-NH1 2.82Å; C57-R872 PolarHBondContact O-NH2 2.9Å
873	K	32.3	Very low	39.2	Very low	214 Å²	214	137.5 Å²	137.5	93%	0.93	69%	0.687	S	S	*	*			trans	-93.5	116.6	158.5	-85.1	-164.8	170.7	-166.1	0	108
874	G	35.8	Very low	39.7	Very low	63 Å²	63	137 Å²	137	65%	0.649	68%	0.677	S	S	*	*			trans	-84.5	158.6	170.2	0	0	0	0	0	112
875	L	38.1	Very low	40.3	Very low	143 Å²	143	138.6 Å²	138.6	75%	0.749	67%	0.667	S	S	*	*			trans	48.4	117	161.4	-52.5	-179.5	0	0	0	117.6
876	S	45.3	Very low	40.5	Very low	73 Å²	73	133.9 Å²	133.9	51%	0.51	65%	0.652	S	S	.	*			trans	-72	146.1	164.4	63.8	0	0	0	0	111.1	Q878 A879	S876-Q878 PolarHBondContact O-N 3.37Å; S876-Q878 VanDerWaalsContact O-N 3.15Å; S876-A879 WeakPolarHBondContact O-CB 3.36Å; S876-A879 PolarHBondContact O-N 3.21Å
877	E	42.3	Very low	41.3	Very low	170 Å²	170	130 Å²	130	79%	0.794	64%	0.64	S	S	*	*	H	α-helix	trans	-52	-35.4	176.7	-169.2	167.7	-167.4	0	0	112.6	A879 L880 Q881	E877-A879 PolarHBondContact O-N 2.77Å; E877-A879 VanDerWaalsContact O-N 3.15Å; E877-L880 PolarHBondContact O-N 3.26Å; E877-L880 VanDerWaalsContact O-N 3.1Å; E877-Q881 PolarHBondContact O-N 2.62Å
878	Q	41.2	Very low	41.6	Very low	139 Å²	139	124.1 Å²	124.1	65%	0.65	64%	0.636	S	S	*	*	H	α-helix	trans	-64.9	-11.2	175.2	-155.8	-174.1	38.1	0	0	114.8	S876 R882	S876-Q878 PolarHBondContact O-N 3.37Å; S876-Q878 VanDerWaalsContact O-N 3.15Å; Q878-R882 PolarHBondContact O-NE 3Å
879	A	42.2	Very low	42.3	Very low	37 Å²	37	122 Å²	122	31%	0.306	63%	0.63	S	S	.	*	H	α-helix	trans	-88.7	-40	170	0	0	0	0	0	111.7	S876 E877 H883	S876-A879 WeakPolarHBondContact O-CB 3.36Å; S876-A879 PolarHBondContact O-N 3.21Å; E877-A879 PolarHBondContact O-N 2.77Å; E877-A879 VanDerWaalsContact O-N 3.15Å; A879-H883 PolarHBondContact O-N 2.91Å
880	L	46.7	Very low	42.7	Very low	91 Å²	91	123 Å²	123	48%	0.476	63%	0.628	S	S	.	*	H	α-helix	trans	-65.9	-39.7	174.9	-66.9	170.2	0	0	0	111.3	E877 H883 R884	E877-L880 PolarHBondContact O-N 3.26Å; E877-L880 VanDerWaalsContact O-N 3.1Å; L880-H883 PolarHBondContact O-N 2.8Å; L880-R884 WeakPolarHBondContact O-CG 3.32Å; L880-R884 PolarHBondContact O-N 3.19Å; L880-R884 VanDerWaalsContact O-N 3.07Å
881	Q	45.2	Very low	42.8	Very low	89 Å²	89	114.4 Å²	114.4	42%	0.416	62%	0.618	S	S	.	*	H	α-helix	trans	-59.9	-51.6	175.7	-176.6	58	22.9	0	0	111.7	E877 H883 R884 E885	E877-Q881 PolarHBondContact O-N 2.62Å; Q881-H883 VanDerWaalsContact C-N 3.27Å; Q881-H883 PolarHBondContact O-N 3.2Å; Q881-R884 WeakPolarHBondContact O-CB 3.2Å; Q881-R884 PolarHBondContact O-N 3.06Å; Q881-R884 VanDerWaalsContact O-N 3.11Å; Q881-E885 WeakPolarHBondContact CG-OE1 3.24Å; Q881-E885 PolarHBondContact NE2-OE1 2.89Å; Q881-E885 WeakPolarHBondContact O-CG 3.3Å; Q881-E885 PolarHBondContact O-N 2.72Å
882	R	46.7	Very low	42.6	Very low	140 Å²	140	111.9 Å²	111.9	53%	0.528	62%	0.618	S	S	.	*	H	α-helix	trans	-62.1	-31.2	176	-79.9	-177.7	-71.3	162.3	-6.2	113.6	Q878 E885 L886	Q878-R882 PolarHBondContact O-NE 3Å; R882-E885 WeakPolarHBondContact CA-OE2 3.36Å; R882-L886 WeakPolarHBondContact O-CB 3.43Å; R882-L886 VanDerWaalsContact O-CG 3.29Å; R882-L886 WeakPolarHBondContact O-CG 3.41Å; R882-L886 PolarHBondContact O-N 3.16Å
883	H	44.9	Very low	42.3	Very low	124 Å²	124	111.8 Å²	111.8	57%	0.574	63%	0.634	S	S	*	*	H	α-helix	trans	-67.1	-42.5	174	-173.7	15.4	0	0	0	111.8	A879 L880 Q881 L886 V887	A879-H883 PolarHBondContact O-N 2.91Å; L880-H883 PolarHBondContact O-N 2.8Å; Q881-H883 VanDerWaalsContact C-N 3.27Å; Q881-H883 PolarHBondContact O-N 3.2Å; H883-L886 PolarHBondContact O-N 3.18Å; H883-V887 WeakPolarHBondContact O-CG2 3.23Å; H883-V887 PolarHBondContact O-N 2.81Å; H883-V887 VanDerWaalsContact O-N 3.07Å
884	R	52.1	Low	42.2	Very low	180 Å²	180	109.8 Å²	109.8	68%	0.679	63%	0.628	S	S	*	*	H	α-helix	trans	-62.7	-42.7	174.7	-70.2	172.9	175.1	168.5	-2.8	111.9	L880 Q881 V887 A888	L880-R884 WeakPolarHBondContact O-CG 3.32Å; L880-R884 PolarHBondContact O-N 3.19Å; L880-R884 VanDerWaalsContact O-N 3.07Å; Q881-R884 WeakPolarHBondContact O-CB 3.2Å; Q881-R884 PolarHBondContact O-N 3.06Å; Q881-R884 VanDerWaalsContact O-N 3.11Å; R884-V887 PolarHBondContact O-N 2.88Å; R884-A888 PolarHBondContact O-N 3.22Å
885	E	46.8	Very low	41.7	Very low	96 Å²	96	115.4 Å²	115.4	45%	0.449	64%	0.637	S	S	.	*	H	α-helix	trans	-62.3	-41.7	176.5	-70.4	160.3	177.4	0	0	112	Q881 R882 V887 A888 A889	Q881-E885 WeakPolarHBondContact CG-OE1 3.24Å; Q881-E885 PolarHBondContact NE2-OE1 2.89Å; Q881-E885 WeakPolarHBondContact O-CG 3.3Å; Q881-E885 PolarHBondContact O-N 2.72Å; R882-E885 WeakPolarHBondContact CA-OE2 3.36Å; E885-V887 VanDerWaalsContact C-N 3.33Å; E885-V887 PolarHBondContact O-N 3.05Å; E885-A888 PolarHBondContact O-N 2.92Å; E885-A889 WeakPolarHBondContact O-CB 3.33Å; E885-A889 PolarHBondContact O-N 3.31Å
886	L	45.2	Very low	41.4	Very low	113 Å²	113	114.1 Å²	114.1	59%	0.592	64%	0.637	S	S	*	*	H	α-helix	trans	-67	-29.4	175	-76	167	0	0	0	113.6	R882 H883 N890	R882-L886 WeakPolarHBondContact O-CB 3.43Å; R882-L886 VanDerWaalsContact O-CG 3.29Å; R882-L886 WeakPolarHBondContact O-CG 3.41Å; R882-L886 PolarHBondContact O-N 3.16Å; H883-L886 PolarHBondContact O-N 3.18Å; L886-N890 PolarHBondContact O-ND2 3.47Å
887	V	50.8	Low	40.8	Very low	93 Å²	93	119.9 Å²	119.9	56%	0.564	66%	0.656	S	S	*	*	H	α-helix	trans	-75.7	-41.6	173.4	171.6	0	0	0	0	110.7	H883 R884 E885 A889 N890	H883-V887 WeakPolarHBondContact O-CG2 3.23Å; H883-V887 PolarHBondContact O-N 2.81Å; H883-V887 VanDerWaalsContact O-N 3.07Å; R884-V887 PolarHBondContact O-N 2.88Å; E885-V887 VanDerWaalsContact C-N 3.33Å; E885-V887 PolarHBondContact O-N 3.05Å; V887-A889 VanDerWaalsContact C-N 3.3Å; V887-A889 PolarHBondContact O-N 3.29Å; V887-N890 PolarHBondContact O-N 2.97Å
888	A	48	Very low	40	Very low	85 Å²	85	121.2 Å²	121.2	70%	0.702	66%	0.662	S	S	*	*	H	α-helix	trans	-65	-31	175.8	0	0	0	0	0	113.3	R884 E885 N890	R884-A888 PolarHBondContact O-N 3.22Å; E885-A888 PolarHBondContact O-N 2.92Å; A888-N890 VanDerWaalsContact C-N 3.32Å; A888-N890 PolarHBondContact O-N 3.18Å
889	A	47.3	Very low	39.2	Very low	78 Å²	78	118.1 Å²	118.1	65%	0.645	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-16.6	179.4	0	0	0	0	0	114.6	E885 V887	E885-A889 WeakPolarHBondContact O-CB 3.33Å; E885-A889 PolarHBondContact O-N 3.31Å; V887-A889 VanDerWaalsContact C-N 3.3Å; V887-A889 PolarHBondContact O-N 3.29Å
890	N	40	Very low	38.5	Very low	123 Å²	123	126 Å²	126	66%	0.658	70%	0.698	S	S	*	*	S	Bend	trans	-109	86.1	-179.8	-71.7	-79.5	0	0	0	109.5	L886 V887 A888 G892	L886-N890 PolarHBondContact O-ND2 3.47Å; V887-N890 PolarHBondContact O-N 2.97Å; A888-N890 VanDerWaalsContact C-N 3.32Å; A888-N890 PolarHBondContact O-N 3.18Å; N890-G892 PolarHBondContact O-N 3.44Å
891	G	37.4	Very low	37.5	Very low	72 Å²	72	130 Å²	130	74%	0.742	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-51	123.4	-171.3	0	0	0	0	0	114
892	G	31	Very low	36.6	Very low	79 Å²	79	130.9 Å²	130.9	81%	0.814	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-69.8	140.4	179.4	0	0	0	0	0	112.7	N890	N890-G892 PolarHBondContact O-N 3.44Å
893	V	28.8	Very low	35.5	Very low	145 Å²	145	127.9 Å²	127.9	88%	0.879	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-103.3	123.4	166.8	176.3	0	0	0	0	107.6
894	E	30.5	Very low	34.6	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.804	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-81.3	172.6	177.1	-76.1	-161.9	119.2	0	0	113.6
895	Q	26.2	Very low	33.3	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	78%	0.78	S	S	*	*			trans	93	151.8	160.6	-55.5	-171.1	2.3	0	0	118
896	P	30.6	Very low	32.4	Very low	115 Å²	115	136.5 Å²	136.5	75%	0.747	80%	0.799	S	S	*	*			cis	-119.6	160.9	-8.6	21.2	0.3	0	0	0	114.5
897	Q	33.9	Very low	31.4	Very low	195 Å²	195	137.1 Å²	137.1	91%	0.911	80%	0.803	S	S	*	*			trans	-98	118.9	158.5	-70.9	-178.2	-75.4	0	0	109.9
898	E	24.6	Very low	30.3	Very low	197 Å²	197	140.7 Å²	140.7	92%	0.921	82%	0.818	S	S	*	*			trans	-148.3	136.2	156	-69.1	-166.9	141.8	0	0	107.9
899	G	25.5	Very low	29.2	Very low	74 Å²	74	142.3 Å²	142.3	76%	0.763	81%	0.814	S	S	*	*			cis	-168.7	159.2	-7.6	0	0	0	0	0	111
900	E	25.7	Very low	28.8	Very low	202 Å²	202	143.9 Å²	143.9	94%	0.944	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.8	158.1	175.9	-82.2	179.4	92.7	0	0	112.9
901	L	26.7	Very low	28.2	Very low	176 Å²	176	146.4 Å²	146.4	92%	0.921	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-93.7	152	176.9	-82.5	167.2	0	0	0	112.3
902	A	25.9	Very low	28.5	Very low	108 Å²	108	148.1 Å²	148.1	89%	0.893	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-72.2	155.2	-165.1	0	0	0	0	0	115.6
903	G	23.6	Very low	28.2	Very low	76 Å²	76	149.4 Å²	149.4	78%	0.784	82%	0.818	S	S	*	*			trans	-164.6	89.5	166.6	0	0	0	0	0	112.4
904	K	26.6	Very low	28	Very low	214 Å²	214	148.3 Å²	148.3	93%	0.93	81%	0.811	S	S	*	*			trans	-147.9	142.6	163.7	-82.9	-160.4	173.8	-174.1	0	110.5
905	E	25.3	Very low	27.9	Very low	184 Å²	184	147 Å²	147	86%	0.86	81%	0.814	S	S	*	*			trans	-99.9	150.8	179.4	-78.1	179.6	126.9	0	0	112.6
906	E	27.2	Very low	27.9	Very low	184 Å²	184	141.4 Å²	141.4	86%	0.86	81%	0.806	S	S	*	*			trans	61	145.2	148.6	-63.7	-61.7	94.6	0	0	122.4
907	D	24.5	Very low	27.7	Very low	126 Å²	126	146.5 Å²	146.5	67%	0.674	81%	0.811	S	S	*	*			trans	-87.8	162.2	-166.5	-146.2	-26.2	0	0	0	112.9
908	L	26.2	Very low	27.6	Very low	168 Å²	168	143.5 Å²	143.5	88%	0.88	80%	0.801	S	S	*	*				178	141	117.4	-92.4	169.9	0	0	0	113.4
909	L	25.4	Very low	27.8	Very low	119 Å²	119	141.9 Å²	141.9	62%	0.623	79%	0.793	S	S	*	*			trans	-86	-178.8	-179.7	-109.5	72.7	0	0	0	112.5
910	P	39.6	Very low	28	Very low	111 Å²	111	143.5 Å²	143.5	72%	0.721	79%	0.788	S	S	*	*			cis	-141.3	154.1	18.1	33.7	-10.3	0	0	0	120.5
911	K	28.1	Very low	28.6	Very low	176 Å²	176	142.9 Å²	142.9	77%	0.765	78%	0.782	S	S	*	*				18.3	162.1	127.4	-74.4	179.7	-179.8	174.4	0	122.2
912	P	43.1	Very low	28.7	Very low	108 Å²	108	141 Å²	141	70%	0.701	78%	0.779	S	S	*	*			cis	-146.4	-163.6	-25.8	41.1	-20.9	0	0	0	115.7
913	S	24.3	Very low	29	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	78%	0.775	S	S	*	*			trans	86.7	145.3	156	85.7	0	0	0	0	117.6
914	T	25.4	Very low	29.1	Very low	121 Å²	121	144.5 Å²	144.5	74%	0.742	77%	0.771	S	S	*	*			cis	-156.6	151	-4.8	-12.8	0	0	0	0	111.3
915	V	27.6	Very low	29.2	Very low	144 Å²	144	139.3 Å²	139.3	87%	0.873	76%	0.761	S	S	*	*			trans	53.6	137.1	156.8	170.8	0	0	0	0	118.9
916	G	25.9	Very low	29.2	Very low	66 Å²	66	136.8 Å²	136.8	68%	0.68	76%	0.759	S	S	*	*			cis	147.9	176.2	-2.8	0	0	0	0	0	112.9
917	R	27.2	Very low	29.2	Very low	222 Å²	222	135.8 Å²	135.8	84%	0.838	76%	0.758	S	S	*	*			trans	92.5	127	168.8	-164	174.1	-177.1	155.2	1.1	119.2
918	D	30.8	Very low	30.2	Very low	131 Å²	131	134.4 Å²	134.4	70%	0.701	76%	0.756	S	S	*	*			trans	-78.3	172.8	179	-41.6	-109.9	0	0	0	115.1
919	Q	29.3	Very low	30.2	Very low	163 Å²	163	134.4 Å²	134.4	76%	0.762	75%	0.752	S	S	*	*				-165.3	171.2	111	-99.9	149.1	111.7	0	0	113.2
920	T	29.5	Very low	30.2	Very low	108 Å²	108	137.9 Å²	137.9	66%	0.663	76%	0.762	S	S	*	*			trans	-148.8	158.6	-157.8	59.9	0	0	0	0	115.6
921	K	37.6	Very low	29.5	Very low	189 Å²	189	140.9 Å²	140.9	82%	0.822	77%	0.768	S	S	*	*			trans	66.8	127.3	153.6	-69.1	162.1	-179.8	175.3	0	120.8
922	T	28.9	Very low	30.1	Very low	138 Å²	138	137.2 Å²	137.2	85%	0.847	76%	0.762	S	S	*	*			trans	170.4	156.8	141.8	26.1	0	0	0	0	109.7
923	I	32.2	Very low	29.4	Very low	158 Å²	158	139.1 Å²	139.1	81%	0.81	77%	0.766	S	S	*	*			cis	-152.1	-179.3	-41	-139.3	174	0	0	0	111.8
924	S	26.8	Very low	29.4	Very low	99 Å²	99	139.9 Å²	139.9	69%	0.692	76%	0.762	S	S	*	*			trans	-56.7	146.4	-170.4	-45.2	0	0	0	0	122.6
925	S	27.5	Very low	29.5	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	76%	0.762	S	S	*	*				89.8	141.2	124.8	-166.1	0	0	0	0	124.7
926	T	27	Very low	29.6	Very low	132 Å²	132	139.5 Å²	139.5	81%	0.81	76%	0.759	S	S	*	*			trans	93.5	147.2	143.9	15.3	0	0	0	0	123.9
927	L	26.9	Very low	29.9	Very low	162 Å²	162	144.9 Å²	144.9	85%	0.848	77%	0.766	S	S	*	*			trans	-83.9	-174.2	-179.5	-106.8	83.6	0	0	0	113.1
928	P	45.8	Very low	30.5	Very low	98 Å²	98	139.5 Å²	139.5	64%	0.636	76%	0.76	S	S	*	*			cis	-141.4	-169.7	1.5	41	-21	0	0	0	117.6
929	Q	24.7	Very low	30.2	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	76%	0.763	S	S	*	*			trans	98.8	137.2	139.4	-89.5	-172.3	30.5	0	0	125.1
930	K	26	Very low	29.9	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.835	76%	0.761	S	S	*	*			trans	85.2	154	150.2	-88.5	-176.2	175	-178.4	0	123.1
931	M	26	Very low	29.7	Very low	173 Å²	173	139.2 Å²	139.2	85%	0.852	76%	0.764	S	S	*	*			trans	-130.2	-169.4	178.1	-58.7	-165.7	75.6	0	0	108.1
932	P	40.8	Very low	29	Very low	99 Å²	99	137 Å²	137	64%	0.643	76%	0.762	S	S	*	*			cis	-146.3	-170.4	5	44.5	-23.5	0	0	0	117.9
933	L	28	Very low	29.1	Very low	148 Å²	148	135 Å²	135	78%	0.775	75%	0.753	S	S	*	*			trans	68.9	160.7	162.3	-57.3	175.8	0	0	0	117.4
934	D	23.4	Very low	28.8	Very low	122 Å²	122	135.3 Å²	135.3	65%	0.652	75%	0.751	S	S	*	*			cis	-152.8	163.6	-6.2	-134.5	-10.3	0	0	0	115.4
935	L	28.1	Very low	28.9	Very low	143 Å²	143	134.6 Å²	134.6	75%	0.749	75%	0.746	S	S	*	*			trans	13.3	138.3	153.9	-74.8	166.8	0	0	0	127.2
936	S	29.9	Very low	29.1	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	75%	0.747	S	S	*	*				106	143.8	128	-73.8	0	0	0	0	125.4
937	E	31.6	Very low	29.3	Very low	178 Å²	178	138.1 Å²	138.1	83%	0.832	75%	0.746	S	S	*	*			trans	-71.8	178.2	171.9	-73	-175.6	152.7	0	0	113.7
938	P	40.7	Very low	29.6	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	74%	0.744	S	S	*	*			cis	-153.3	171	28.7	44.6	-22.3	0	0	0	122.4
939	I	24.5	Very low	29	Very low	148 Å²	148	139.6 Å²	139.6	76%	0.759	74%	0.741	S	S	*	*			trans	31.8	121.3	140.7	-53.7	161.8	0	0	0	121.4
940	S	22.7	Very low	29.3	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	73%	0.734	S	S	*	*				168.9	122	123	55.9	0	0	0	0	111.9
941	I	23.8	Very low	29.5	Very low	144 Å²	144	133.4 Å²	133.4	74%	0.738	71%	0.714	S	S	*	*				93.5	117.4	85.5	-69.9	164.7	0	0	0	115.1
942	D	23.6	Very low	29.5	Very low	144 Å²	144	134.3 Å²	134.3	77%	0.77	71%	0.708	S	S	*	*			trans	50.6	154.9	149.6	-56	-11.6	0	0	0	125.7
943	S	31.7	Very low	28.9	Very low	94 Å²	94	135.5 Å²	135.5	66%	0.657	71%	0.709	S	S	*	*			trans	65.6	154.4	159.6	-75.4	0	0	0	0	118.4
944	E	25.4	Very low	28.9	Very low	166 Å²	166	134 Å²	134	78%	0.776	70%	0.702	S	S	*	*			cis	-160.2	167.1	-3	-107.2	147.8	-136.9	0	0	106.5
945	S	29.4	Very low	29.1	Very low	84 Å²	84	136.7 Å²	136.7	59%	0.587	71%	0.708	S	S	*	*			cis	-158.7	179	3	-124.8	0	0	0	0	111.1
946	D	30.4	Very low	29.2	Very low	140 Å²	140	139.3 Å²	139.3	75%	0.749	71%	0.713	S	S	*	*			trans	8.1	163.4	135	-51.4	-65.4	0	0	0	121.3
947	E	32.7	Very low	29.5	Very low	169 Å²	169	140.2 Å²	140.2	79%	0.79	72%	0.716	S	S	*	*			cis	-143.3	149.4	29.3	-72.4	176.3	147.2	0	0	114.5
948	E	32.8	Very low	29.2	Very low	170 Å²	170	135.4 Å²	135.4	79%	0.794	72%	0.715	S	S	*	*			trans	45.2	157.3	133.2	-58.8	-165.1	150.5	0	0	122.2
949	E	32.2	Very low	28.5	Very low	122 Å²	122	135 Å²	135	57%	0.57	72%	0.721	S	S	*	*			cis	-164.8	-170.8	-23.1	-111.2	-117.4	91.8	0	0	105.7	Q951	E949-Q951 VanDerWaalsContact CD-NE2 3.25Å; E949-Q951 PolarHBondContact OE1-N 2.83Å; E949-Q951 PolarHBondContact OE1-NE2 3.36Å; E949-Q951 PolarHBondContact OE2-NE2 2.78Å
950	Q	30.6	Very low	28.7	Very low	138 Å²	138	132.7 Å²	132.7	65%	0.645	72%	0.724	S	S	*	*			cis	-139.1	158.8	9.2	-133.7	-160	24.9	0	0	114.8
951	Q	30.7	Very low	28.9	Very low	91 Å²	91	132.3 Å²	132.3	43%	0.425	73%	0.727	S	S	.	*			trans	-10.8	157.9	140.4	-66.7	156.6	56	0	0	119.2	E949	E949-Q951 VanDerWaalsContact CD-NE2 3.25Å; E949-Q951 PolarHBondContact OE1-N 2.83Å; E949-Q951 PolarHBondContact OE1-NE2 3.36Å; E949-Q951 PolarHBondContact OE2-NE2 2.78Å
952	R	27.4	Very low	29	Very low	192 Å²	192	134.1 Å²	134.1	73%	0.725	73%	0.732	S	S	*	*			cis	-148.3	141.9	27.3	-113.6	118.5	-154.6	-116.9	6.2	113.4
953	N	28.1	Very low	29.2	Very low	124 Å²	124	133.9 Å²	133.9	66%	0.663	73%	0.729	S	S	*	*				35.1	144.5	115.7	-63.3	54.1	0	0	0	120.2
954	D	27.6	Very low	28.9	Very low	116 Å²	116	138.3 Å²	138.3	62%	0.62	74%	0.739	S	S	*	*			cis	-167.5	177.1	11.4	-134.7	-43.8	0	0	0	114.8
955	K	27.3	Very low	28.9	Very low	180 Å²	180	133.9 Å²	133.9	78%	0.783	74%	0.738	S	S	*	*			trans	74.1	115.9	147.5	-77.4	159.5	-170	167.2	0	122.7
956	K	29.6	Very low	28.8	Very low	198 Å²	198	136.6 Å²	136.6	86%	0.861	75%	0.746	S	S	*	*			trans	-63	175.7	141.7	-65.3	176.7	177.2	174.7	0	110.7
957	P	37.2	Very low	28.7	Very low	133 Å²	133	137.6 Å²	137.6	86%	0.864	75%	0.746	S	S	*	*			cis	-139.6	-163.9	11.8	44.4	-25.4	0	0	0	114.5
958	G	25	Very low	28.3	Very low	78 Å²	78	136.2 Å²	136.2	80%	0.804	74%	0.739	S	S	*	*			trans	155.6	146.7	160	0	0	0	0	0	114.2
959	A	26.1	Very low	28	Very low	101 Å²	101	136.6 Å²	136.6	84%	0.835	74%	0.739	S	S	*	*			trans	-133.8	158.4	-175.3	0	0	0	0	0	113.9
960	A	27.7	Very low	27.6	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	75%	0.749	S	S	*	*			trans	82.8	150.3	149.6	0	0	0	0	0	122.3
961	A	27.9	Very low	27.3	Very low	94 Å²	94	133.7 Å²	133.7	78%	0.777	75%	0.753	S	S	*	*			trans	80.4	94.6	147.7	0	0	0	0	0	122.8
962	H	25.2	Very low	27	Very low	182 Å²	182	134.8 Å²	134.8	84%	0.843	77%	0.771	S	S	*	*				56.1	135.3	110.8	-113.3	-35	0	0	0	123.8
963	I	28	Very low	26.9	Very low	140 Å²	140	135.1 Å²	135.1	72%	0.718	78%	0.778	S	S	*	*			trans	105.5	139.3	144	-65.4	169.3	0	0	0	120.1
964	H	26	Very low	26.8	Very low	187 Å²	187	138 Å²	138	87%	0.866	79%	0.787	S	S	*	*			trans	-36.2	160.3	-174.7	-57.4	-53.1	0	0	0	123.9
965	G	25.1	Very low	26.6	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	79%	0.794	S	S	*	*			trans	151	102.7	154.1	0	0	0	0	0	110.9
966	N	26.3	Very low	26.5	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	80%	0.799	S	S	*	*			cis	103.5	138	34.3	-170	33.5	0	0	0	112.8
967	Q	28.6	Very low	26.3	Very low	162 Å²	162	138.4 Å²	138.4	76%	0.757	79%	0.787	S	S	*	*			trans	76.4	157.9	179.1	-60.3	161.3	111.6	0	0	117.9
968	Q	25.9	Very low	25.7	Very low	139 Å²	139	138.3 Å²	138.3	65%	0.65	78%	0.784	S	S	*	*			cis	166.9	160.6	-44.1	-179.5	178.4	9.1	0	0	109.3
969	F	24.5	Very low	25.7	Very low	179 Å²	179	144 Å²	144	79%	0.785	78%	0.781	S	S	*	*			trans	73.8	152.1	174.3	-62	-75.1	0	0	0	116.3
970	T	24.5	Very low	25.8	Very low	128 Å²	128	145.1 Å²	145.1	79%	0.785	78%	0.778	S	S	*	*			cis	-127.2	155.1	-6.6	47.9	0	0	0	0	109.3
971	G	24.3	Very low	25.7	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	76%	0.762	S	S	*	*				77.5	141.6	76.1	0	0	0	0	0	113.7
972	S	25.8	Very low	25.8	Very low	113 Å²	113	146.3 Å²	146.3	79%	0.79	76%	0.756	S	S	*	*			cis	-175.4	150.7	-4.4	56.1	0	0	0	0	114.7
973	K	25.3	Very low	25.8	Very low	200 Å²	200	146.3 Å²	146.3	87%	0.87	75%	0.753	S	S	*	*			trans	80.4	162.2	143.6	-97.6	-174.2	177.2	-176.1	0	123.8
974	E	24.1	Very low	25.7	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	75%	0.752	S	S	*	*			trans	69.7	124.6	174.3	-46.2	-153.3	117.3	0	0	116.6
975	R	24.7	Very low	25.7	Very low	205 Å²	205	143.1 Å²	143.1	77%	0.774	75%	0.745	S	S	*	*			cis	95.2	111.1	22.8	-167.4	-172	-174.6	-176.8	5.1	115.2	E977	R975-E977 IonicContact CZ-OE2 3.81Å; R975-E977 IonicContact NE-OE2 2.68Å; R975-E977 PolarHBondContact NE-OE2 2.66Å; R975-E977 IonicContact NH2-OE2 2.72Å; R975-E977 PolarHBondContact NH2-OE2 3.02Å
976	L	25.4	Very low	25.8	Very low	168 Å²	168	144.7 Å²	144.7	88%	0.88	75%	0.745	S	S	*	*			trans	-152.1	152	147.1	-164.6	61.9	0	0	0	110.3
977	E	24.6	Very low	25.7	Very low	130 Å²	130	144.4 Å²	144.4	61%	0.607	74%	0.743	S	S	*	*			trans	-138.2	136.5	-175.6	-70.5	160.6	82.1	0	0	112.3	R975	R975-E977 IonicContact CZ-OE2 3.81Å; R975-E977 IonicContact NE-OE2 2.68Å; R975-E977 PolarHBondContact NE-OE2 2.66Å; R975-E977 IonicContact NH2-OE2 2.72Å; R975-E977 PolarHBondContact NH2-OE2 3.02Å
978	T	25.3	Very low	25.8	Very low	131 Å²	131	144.1 Å²	144.1	80%	0.804	75%	0.746	S	S	*	*			trans	-167.4	122.7	157.8	31.8	0	0	0	0	105.7
979	R	25.2	Very low	26	Very low	197 Å²	197	144.7 Å²	144.7	74%	0.743	75%	0.754	S	S	*	*			cis	62.5	113.3	40	-163.4	173.9	-174.5	167.9	8.8	111.5	D981	R979-D981 IonicContact CZ-OD2 3.54Å; R979-D981 IonicContact NE-OD2 3.43Å; R979-D981 PolarHBondContact NE-OD2 2.96Å; R979-D981 IonicContact NH2-OD1 2.66Å; R979-D981 IonicContact NH2-OD2 3.84Å; R979-D981 PolarHBondContact NH2-OD2 2.81Å
980	T	27.1	Very low	26.4	Very low	126 Å²	126	142.7 Å²	142.7	77%	0.773	75%	0.751	S	S	*	*				-134.2	142.7	64	35.5	0	0	0	0	114
981	D	25.6	Very low	26.8	Very low	93 Å²	93	144 Å²	144	50%	0.497	75%	0.75	S	S	.	*				58.8	135.5	79.9	-69.4	-58.1	0	0	0	113.3	R979	R979-D981 IonicContact CZ-OD2 3.54Å; R979-D981 IonicContact NE-OD2 3.43Å; R979-D981 PolarHBondContact NE-OD2 2.96Å; R979-D981 IonicContact NH2-OD1 2.66Å; R979-D981 IonicContact NH2-OD2 3.84Å; R979-D981 PolarHBondContact NH2-OD2 2.81Å
982	I	29.9	Very low	27.3	Very low	126 Å²	126	146.1 Å²	146.1	65%	0.646	75%	0.754	S	S	*	*			cis	-155.3	151.3	9.4	-114.9	159.6	0	0	0	106.2
983	K	26.6	Very low	27.8	Very low	181 Å²	181	147.7 Å²	147.7	79%	0.787	75%	0.753	S	S	*	*				-169.9	117.3	60.3	-161.2	158.7	-178.1	178.2	0	108.8
984	M	25.4	Very low	28.4	Very low	142 Å²	142	146.1 Å²	146.1	70%	0.7	76%	0.755	S	S	*	*				74.8	110.9	90.2	-67.6	177.9	165.6	0	0	116.8
985	V	25.3	Very low	29.2	Very low	118 Å²	118	144 Å²	144	72%	0.715	75%	0.749	S	S	*	*				57.6	150.4	90.9	-81.1	0	0	0	0	115.8
986	S	26.9	Very low	29.9	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	76%	0.757	S	S	*	*			cis	-156.8	145.5	20	10.4	0	0	0	0	108.3
987	D	24.9	Very low	30.6	Very low	134 Å²	134	142.4 Å²	142.4	72%	0.717	75%	0.752	S	S	*	*				96.1	136.6	56.6	-83.5	-47.3	0	0	0	114.7
988	L	30.4	Very low	31.3	Very low	156 Å²	156	143.2 Å²	143.2	82%	0.817	76%	0.76	S	S	*	*			trans	78.7	169.7	152.6	-67.9	166	0	0	0	122.3
989	D	30.6	Very low	32	Very low	152 Å²	152	146.1 Å²	146.1	81%	0.813	77%	0.765	S	S	*	*			trans	68.5	113.2	-175.5	-51.6	-17.3	0	0	0	115
990	D	33.2	Very low	32.8	Very low	136 Å²	136	143.8 Å²	143.8	73%	0.727	77%	0.767	S	S	*	*			cis	92.2	147.7	25.3	-154.9	13.7	0	0	0	115
991	M	33	Very low	33.4	Very low	156 Å²	156	146 Å²	146	77%	0.768	77%	0.774	S	S	*	*			trans	67.1	107.7	178.2	-52.7	-65.2	168.6	0	0	119.1
992	S	34.4	Very low	34.1	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	79%	0.787	S	S	*	*				-175.1	119.3	117.7	59.2	0	0	0	0	111.1
993	D	36.8	Very low	34.7	Very low	145 Å²	145	150.6 Å²	150.6	78%	0.775	80%	0.8	S	S	*	*			trans	-69.4	158.6	155.6	-53.1	-68.4	0	0	0	109.7
994	D	37.6	Very low	35.2	Very low	168 Å²	168	148.8 Å²	148.8	90%	0.898	80%	0.799	S	S	*	*			trans	-161.5	118.9	143.3	-98.4	-30.1	0	0	0	106.7
995	D	39.3	Very low	35.9	Very low	139 Å²	139	150.2 Å²	150.2	74%	0.743	81%	0.809	S	S	*	*			trans	-81.4	151.3	172.1	-59.8	-73	0	0	0	110.1
996	D	39.9	Very low	36.6	Very low	174 Å²	174	151.5 Å²	151.5	93%	0.93	81%	0.812	S	S	*	*			trans	-137.3	111.7	156.9	-98.6	-39.2	0	0	0	106.2
997	E	40.5	Very low	37.1	Very low	165 Å²	165	154.6 Å²	154.6	77%	0.771	82%	0.82	S	S	*	*			trans	-90.2	175.8	180	-60.1	-175.7	112.9	0	0	111.2
998	D	39.7	Very low	37.8	Very low	147 Å²	147	156 Å²	156	79%	0.786	83%	0.828	S	S	*	*			trans	66.1	164.5	162.8	-54.3	-23.9	0	0	0	117
999	E	39.5	Very low	38.2	Very low	192 Å²	192	156.5 Å²	156.5	90%	0.897	83%	0.831	S	S	*	*			cis	-118.3	146.1	2.8	-66.6	169.2	131.7	0	0	111.2
1000	D	41.6	Very low	38.8	Very low	147 Å²	147	158.7 Å²	158.7	79%	0.786	84%	0.837	S	S	*	*			trans	-76	151.5	162.7	-70.1	-59.3	0	0	0	110.4
1001	D	41	Very low	38.8	Very low	173 Å²	173	160.4 Å²	160.4	93%	0.925	85%	0.846	S	S	*	*			trans	-137.8	87.2	168.7	-114.1	-17.2	0	0	0	107.5
1002	D	40.5	Very low	38.8	Very low	144 Å²	144	160.6 Å²	160.6	77%	0.77	85%	0.85	S	S	*	*			trans	-82.6	130.8	167	-80.9	-45.4	0	0	0	109.3
1003	D	41.7	Very low	38.9	Very low	171 Å²	171	164.1 Å²	164.1	91%	0.914	85%	0.854	S	S	*	*			trans	-122.2	88.5	170.1	-107.4	-25	0	0	0	107.5
1004	D	37.3	Very low	38.6	Very low	143 Å²	143	161 Å²	161	77%	0.765	86%	0.855	S	S	*	*			trans	-82.6	128.9	165.1	-86.6	-46.2	0	0	0	109.4
1005	D	39.9	Very low	38.2	Very low	173 Å²	173	162 Å²	162	93%	0.925	86%	0.855	S	S	*	*			trans	-92.4	98.6	165.5	-93.5	-43.5	0	0	0	107.5
1006	D	39.3	Very low	37.8	Very low	145 Å²	145	162.7 Å²	162.7	78%	0.775	86%	0.857	S	S	*	*			trans	-71.5	148.5	180	-95.3	-45.8	0	0	0	113.9
1007	D	38.8	Very low	37.3	Very low	171 Å²	171	160.8 Å²	160.8	91%	0.914	85%	0.852	S	S	*	*			trans	-92.5	91.3	170	-83.8	-50.2	0	0	0	109.7	D1009	D1007-D1009 PolarHBondContact O-N 2.72Å
1008	D	39.7	Very low	36.7	Very low	162 Å²	162	161.1 Å²	161.1	87%	0.866	85%	0.853	S	S	*	*			trans	-75.6	107.1	171.4	-87.6	-34.6	0	0	0	111.9
1009	D	38.7	Very low	36.1	Very low	167 Å²	167	161.8 Å²	161.8	89%	0.893	86%	0.857	S	S	*	*			trans	-121.9	123.4	159.2	-103.7	-35.3	0	0	0	107.5	D1007	D1007-D1009 PolarHBondContact O-N 2.72Å
1010	E	41.7	Very low	35.6	Very low	199 Å²	199	155.8 Å²	155.8	93%	0.93	85%	0.846	S	S	*	*			trans	-76.7	128.9	-172.7	-61.2	174	133.6	0	0	113.1
1011	D	34.5	Very low	34.7	Very low	172 Å²	172	158.5 Å²	158.5	92%	0.92	85%	0.852	S	S	*	*			trans	-84.6	142.6	165.3	-92	-36	0	0	0	111.3
1012	D	33.4	Very low	33.9	Very low	159 Å²	159	156.3 Å²	156.3	85%	0.85	85%	0.848	S	S	*	*			trans	-124.8	152.6	171.4	-170	14	0	0	0	110
1013	E	36.6	Very low	33.2	Very low	191 Å²	191	154 Å²	154	89%	0.893	85%	0.85	S	S	*	*			trans	-74.8	155.8	-152.1	-64.1	-168.2	154	0	0	116.9
1014	G	29.8	Very low	32.6	Very low	78 Å²	78	152 Å²	152	80%	0.804	84%	0.843	S	S	*	*			trans	-177.2	61.9	174.1	0	0	0	0	0	117.8
1015	E	29.4	Very low	32	Very low	190 Å²	190	153.3 Å²	153.3	89%	0.888	85%	0.845	S	S	*	*			trans	-65.6	140.1	159.6	-74.1	-161.6	122.5	0	0	111.2
1016	L	29.4	Very low	31.4	Very low	153 Å²	153	151.6 Å²	151.6	80%	0.801	84%	0.836	S	S	*	*				174.8	132	124.2	-97.1	162.7	0	0	0	116.7
1017	V	31.1	Very low	30.9	Very low	134 Å²	134	150.2 Å²	150.2	81%	0.812	84%	0.837	S	S	*	*			trans	58	142.1	157.7	-72.6	0	0	0	0	124.5
1018	E	27.3	Very low	30.3	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.804	82%	0.822	S	S	*	*			trans	-78.9	-176.6	170.5	-60	178.9	90.1	0	0	114.9
1019	N	27.9	Very low	29.7	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	82%	0.824	S	S	*	*			trans	91.4	139.9	168.1	-50.9	-75.8	0	0	0	116.1
1020	G	27.9	Very low	29.1	Very low	65 Å²	65	147.6 Å²	147.6	67%	0.67	82%	0.819	S	S	*	*			cis	171.1	138.1	-9.4	0	0	0	0	0	114.7
1021	F	23.1	Very low	28.4	Very low	205 Å²	205	142.2 Å²	142.2	90%	0.899	80%	0.804	S	S	*	*			trans	49.7	128.3	157.7	-80	-92	0	0	0	123.9
1022	C	24.3	Very low	28	Very low	126 Å²	126	141.7 Å²	141.7	85%	0.851	80%	0.8	S	S	*	*			trans	66.1	158.8	150.8	-71.1	0	0	0	0	118.4
1023	A	26.1	Very low	28.2	Very low	97 Å²	97	138.9 Å²	138.9	80%	0.802	79%	0.79	S	S	*	*			cis	-145.4	-176.4	19.3	0	0	0	0	0	113.8
1024	T	27.4	Very low	27.6	Very low	127 Å²	127	136.4 Å²	136.4	78%	0.779	78%	0.782	S	S	*	*			trans	-120	157.6	174.1	50	0	0	0	0	112.2
1025	E	26.5	Very low	27.4	Very low	171 Å²	171	139.7 Å²	139.7	80%	0.799	78%	0.779	S	S	*	*			trans	70.1	156.7	177.6	-39.6	-163	149.9	0	0	114.2
1026	N	26.2	Very low	27.1	Very low	138 Å²	138	137.9 Å²	137.9	74%	0.738	77%	0.774	S	S	*	*			cis	-158.9	160.3	24	-133	-45.1	0	0	0	113
1027	S	28.5	Very low	27.2	Very low	115 Å²	115	136.2 Å²	136.2	80%	0.804	77%	0.772	S	S	*	*			trans	158.8	139.5	151.8	-169.6	0	0	0	0	109.1
1028	G	26.1	Very low	27.1	Very low	58 Å²	58	138.7 Å²	138.7	60%	0.598	77%	0.772	S	S	*	*			cis	126.4	78.8	13.4	0	0	0	0	0	109.3
1029	R	26.7	Very low	26.9	Very low	240 Å²	240	140.6 Å²	140.6	91%	0.906	78%	0.778	S	S	*	*				96.5	152.5	90	-90	-169.4	-178.2	-163.7	3	113.3
1030	D	26.4	Very low	26.8	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	77%	0.772	S	S	*	*			trans	89.2	145.7	170	-63.6	-44.9	0	0	0	120
1031	S	28.3	Very low	27.4	Very low	87 Å²	87	140.9 Å²	140.9	61%	0.608	78%	0.775	S	S	*	*			cis	-172.5	117.3	-30.3	-99.1	0	0	0	0	106.7
1032	L	24.5	Very low	27.4	Very low	161 Å²	161	136.9 Å²	136.9	84%	0.843	77%	0.772	S	S	*	*				61.6	153.5	98	-68.5	-177.5	0	0	0	116.9
1033	P	39.3	Very low	27.6	Very low	99 Å²	99	136.8 Å²	136.8	64%	0.643	77%	0.773	S	S	*	*			cis	-143.8	-159.3	-18.3	34.5	-10.1	0	0	0	115.1
1034	I	24.1	Very low	27.7	Very low	139 Å²	139	136.8 Å²	136.8	71%	0.713	77%	0.773	S	S	*	*			trans	77.6	117.6	161.5	-59.8	160.3	0	0	0	116.3
1035	I	25.6	Very low	27.7	Very low	147 Å²	147	141.7 Å²	141.7	75%	0.754	78%	0.777	S	S	*	*			cis	99	127.4	27.9	-61	161.1	0	0	0	113.7
1036	I	23.3	Very low	27.7	Very low	153 Å²	153	140 Å²	140	79%	0.785	77%	0.774	S	S	*	*			trans	151.2	137.9	151.5	-86.4	162.2	0	0	0	110.7
1037	P	30.4	Very low	27.8	Very low	117 Å²	117	141.8 Å²	141.8	76%	0.76	78%	0.778	S	S	*	*			cis	-129.9	-177.1	-24.7	37.4	-18.8	0	0	0	114.2
1038	K	29.7	Very low	27.9	Very low	187 Å²	187	146.8 Å²	146.8	81%	0.813	78%	0.779	S	S	*	*			trans	-99	165.9	163.4	-57.1	172.1	-179.4	174.6	0	110
1039	F	23.3	Very low	28.1	Very low	211 Å²	211	151.7 Å²	151.7	93%	0.925	79%	0.791	S	S	*	*			trans	-165	166.5	132.6	-107.2	-68.5	0	0	0	113
1040	V	25.9	Very low	28.1	Very low	120 Å²	120	143.5 Å²	143.5	73%	0.727	78%	0.782	S	S	*	*			trans	-161.2	161.1	-161.9	179.7	0	0	0	0	107.3
1041	P	39.5	Very low	28.2	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	78%	0.784	S	S	*	*			cis	-117.3	-160.9	-33.6	38.7	-23.1	0	0	0	110.9
1042	S	24	Very low	28.3	Very low	122 Å²	122	145 Å²	145	85%	0.853	79%	0.792	S	S	*	*			trans	-161.2	155.8	144.6	-90	0	0	0	0	114.1
1043	S	27.1	Very low	28.6	Very low	124 Å²	124	144.9 Å²	144.9	87%	0.867	79%	0.791	S	S	*	*			trans	-142.4	127	170	-64.9	0	0	0	0	109.5
1044	A	28.3	Very low	28.1	Very low	97 Å²	97	144.1 Å²	144.1	80%	0.802	80%	0.801	S	S	*	*			trans	-167.6	132.7	163.7	0	0	0	0	0	114.3
1045	R	28	Very low	28.5	Very low	230 Å²	230	146 Å²	146	87%	0.868	80%	0.804	S	S	*	*			trans	25.9	120.7	135.5	-87.1	-179.9	164	170.4	-6.8	121.2
1046	N	26.2	Very low	28.9	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	80%	0.797	S	S	*	*				170.3	169.6	101.5	-93	-9.2	0	0	0	109.9
1047	Q	28.3	Very low	29.4	Very low	175 Å²	175	146.4 Å²	146.4	82%	0.818	80%	0.799	S	S	*	*			cis	-157	-174.2	-44.8	-166.9	160.4	6.1	0	0	105.7
1048	R	30.9	Very low	29.6	Very low	219 Å²	219	149.8 Å²	149.8	83%	0.826	83%	0.826	S	S	*	*			trans	-88	174.2	-174.7	-78.7	-173.8	174.6	162.2	-2.3	114.5
1049	D	29.9	Very low	29.6	Very low	161 Å²	161	148 Å²	148	86%	0.861	83%	0.827	S	S	*	*			trans	80.3	138.6	162.6	-46.4	-41.7	0	0	0	116.3
1050	G	27.4	Very low	29.9	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	82%	0.821	S	S	*	*			cis	176.4	166.6	-7.5	0	0	0	0	0	112.7
1051	A	27.7	Very low	30.1	Very low	99 Å²	99	146 Å²	146	82%	0.818	83%	0.827	S	S	*	*			trans	63.6	167.8	175.8	0	0	0	0	0	115.6
1052	Q	31.2	Very low	29.6	Very low	166 Å²	166	147.9 Å²	147.9	78%	0.776	83%	0.832	S	S	*	*			cis	-155.5	164.2	-24.3	-121.9	-176.4	-1.9	0	0	109.4
1053	L	29.7	Very low	29.9	Very low	159 Å²	159	149.6 Å²	149.6	83%	0.832	83%	0.831	S	S	*	*			trans	28.3	126.6	149	-60.7	165.1	0	0	0	120.9
1054	G	29.1	Very low	30.1	Very low	82 Å²	82	151.3 Å²	151.3	85%	0.845	83%	0.828	S	S	*	*			trans	-171.1	83	170.9	0	0	0	0	0	117.9
1055	K	34.1	Very low	30.2	Very low	179 Å²	179	155.1 Å²	155.1	78%	0.778	83%	0.83	S	S	*	*			trans	-50.1	146.6	177.3	-77.8	169.7	157.4	-166.7	0	119.1
1056	Q	33.1	Very low	30.4	Very low	132 Å²	132	149.4 Å²	149.4	62%	0.617	83%	0.827	S	S	*	*			trans	67.8	139.7	131.5	-67.6	175.5	-97.2	0	0	123.1
1057	Q	33.9	Very low	30.8	Very low	176 Å²	176	150.5 Å²	150.5	82%	0.822	84%	0.836	S	S	*	*			trans	69.2	150.7	151.4	-71	162.4	-22.1	0	0	117.5
1058	S	34.1	Very low	31	Very low	189 Å²	189	148.3 Å²	148.3	100%	1.322	84%	0.837	S	S	*	*			cis	-104.3	0	1.2	62.7	0	0	0	0	113.5

Retrieved 1,058 of 1,058 residues in 493.7 ms (Link to these results)

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