A0A087YM63_POEFO Loading...

IQ motif and SEC7 domain-containing protein 3

Acts as a guanine nucleotide exchange factor (GEF) for ARF1.

AlphaFold DB , UniProt , Accession A0A087YM63, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,143 aa.

						>A0A087YM63_POEFO|A0A087YM63
MSSSLLENPVQAILYLRELTTIVQNQQSLIQTQRARIEELDRRVDELIGENRHLRDHHSHHTLPDPSCLHHHHHPQDPQLKSTTGALPEHAATPAQVEVSPGVQPPPAQPMDPGDMHRGQVFRNRPKLHGTALNLPPTPHAEKLTTQGVKQVPQETKPQKCMYVCVFLMQTDGASTNEKGQLKRRNRSETVLHQFCCPAPEHPETDTSGSSRRKCAQCPYHHRDSCLARCINSSGLALKPSNYIVKAEFYHFPFEQNLCCGQILSLEDGTSSGGGQEVKGLKREGPSEYEINLENKNKQIEELEQKYGGHLIARRAARRIQTAFRQYQLSKNFQKIRNSLSESKLPRRISLRHPSPSSRSRNAAQRHSYTLHPGGGQIPLRSKTPPPPPCRSTSLPPTSGPTLTQLEDCFSEQLHSLAQSIDDALRGWSLSEGGEGKGLLMDPGALRAAAESAGLPRSASSLLMAFRDVTVHIDSNSSYTISSATTTTTTSLGNASGGESGSRKPSVSGTGGGGDGQSMEEPEFPAPPPSEELEMVDPGSRRGSAAPAAAGVGMEGENSSDRLGSSTSTSTSTSISTSVPGGPSPDSLQALVVSLPRDRCQDPASCRSPTLSTDTHRKRLYRIGLNLFNVNPERGIHFLITRGFVPDTAIGVAHFLLQRKGLSRQMIGEFLGNSKLQFNRDVLDCVVDEMDFSGMELDEALRKFQAHVRVQGEAQKVERLIEAFSQRYCMCNPDVVQQFHNPDTIFILAFAVVLLNTDMYSPNIKPHRKMGLDDFIRNLRGVDDGADIPREMVAGIYERIQQRELRSNEDHVTYVSRVEQSILGLKTVLAVPHRRLVCCCRLFEVPDANKPHKQKLSALQREVFLFNDLLLILKLCPKKKSSASYTFCKAMGLLGMQFHLFSNEYYAHGITMMSPFTSEKKQLVSFCSPSGEELRKFAEELREAIAEVNEMEQIHIQWELERQQGIQSHGLHTNGGQMDTHTGHGSPSGQQDVYDKTGNNNTVEVSIHNRLQTYQLSQPSIESAPLALAAPPTLLSPVQAGELRPETLIQCQQIVKVIVVDQSGRGRMEAFLSQGPATHQLIQSAMSTPVRVREGDGPQPPLPPPPPPYNHPHQFCPPDSPMPFHHAMPLTRRRNSSGSRSIV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	49.7	Very low	239 Å²	239	124.1 Å²	124.1	100%	1.177	70%	0.695	S	S	*	*				0	156.8	0	-73.6	177.1	167.3	0	0	109.3
2	S	44.3	Very low	50.6	Low	120 Å²	120	117.8 Å²	117.8	84%	0.839	67%	0.67	S	S	*	*			trans	-106.6	92.5	-176.8	51.2	0	0	0	0	111.6	S4	S2-S4 PolarHBondContact O-N 3.39Å
3	S	37.6	Very low	52.2	Low	105 Å²	105	117.3 Å²	117.3	73%	0.734	66%	0.663	S	S	*	*			trans	-80.1	115.4	170.6	-59.2	0	0	0	0	109.6
4	S	47	Very low	53.3	Low	72 Å²	72	116.1 Å²	116.1	50%	0.503	65%	0.653	S	S	.	*			trans	-77.5	152.6	-179.1	-173	0	0	0	0	111.2	S2 L6	S2-S4 PolarHBondContact O-N 3.39Å; S4-L6 PolarHBondContact O-N 2.78Å
5	L	46.3	Very low	54	Low	148 Å²	148	118.9 Å²	118.9	78%	0.775	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	11.8	175.5	-91.7	164.9	0	0	0	114.3
6	L	51.3	Low	55.4	Low	157 Å²	157	118.3 Å²	118.3	82%	0.822	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-14.4	-179.7	-79.9	160	0	0	0	114.2	S4	S4-L6 PolarHBondContact O-N 2.78Å
7	E	50.8	Low	56.7	Low	155 Å²	155	121.8 Å²	121.8	72%	0.724	65%	0.648	S	S	*	*	S	Bend	trans	-92.3	-5.7	-172.3	-66.5	-177.3	123	0	0	115
8	N	54.8	Low	57.9	Low	76 Å²	76	120.7 Å²	120.7	41%	0.406	64%	0.638	S	S	.	*			trans	-128.9	92.5	-179.5	-165	-34.7	0	0	0	112.9	V10 Q11 A12	N8-V10 VanDerWaalsContact C-N 3.27Å; N8-V10 PolarHBondContact O-N 3.16Å; N8-V10 WeakPolarHBondContact OD1-CB 3.46Å; N8-V10 PolarHBondContact OD1-N 2.97Å; N8-V10 VanDerWaalsContact OD1-N 3.16Å; N8-Q11 HydrophobicContact CB-CB 4.06Å; N8-Q11 PolarHBondContact O-N 2.84Å; N8-Q11 PolarHBondContact OD1-N 2.71Å; N8-Q11 VanDerWaalsContact OD1-N 3.11Å; N8-A12 PolarHBondContact O-N 3.27Å
9	P	59.7	Low	59	Low	92 Å²	92	118.9 Å²	118.9	60%	0.597	63%	0.628	S	S	*	*	H	α-helix	trans	-66.7	-26.4	-179	26.2	-34.2	0	0	0	113.2	Q11 A12 I13	P9-Q11 VanDerWaalsContact C-N 3.32Å; P9-Q11 PolarHBondContact O-N 3.21Å; P9-A12 PolarHBondContact O-N 3.37Å; P9-I13 WeakPolarHBondContact O-CD1 3.49Å; P9-I13 WeakPolarHBondContact O-CG1 3.32Å; P9-I13 PolarHBondContact O-N 3.33Å
10	V	62	Low	60.1	Low	94 Å²	94	117 Å²	117	57%	0.57	62%	0.621	S	S	*	*	H	α-helix	trans	-65.1	-40.2	175.7	-174.9	0	0	0	0	110.2	N8 I13 L14	N8-V10 VanDerWaalsContact C-N 3.27Å; N8-V10 PolarHBondContact O-N 3.16Å; N8-V10 WeakPolarHBondContact OD1-CB 3.46Å; N8-V10 PolarHBondContact OD1-N 2.97Å; N8-V10 VanDerWaalsContact OD1-N 3.16Å; V10-I13 PolarHBondContact O-N 3.37Å; V10-L14 HydrophobicContact CG1-CD1 4.5Å; V10-L14 WeakPolarHBondContact O-CG 3.49Å; V10-L14 PolarHBondContact O-N 2.81Å
11	Q	58	Low	61.2	Low	107 Å²	107	114.5 Å²	114.5	50%	0.5	61%	0.611	S	S	.	*	H	α-helix	trans	-68.8	-35.9	177.7	-165.8	165.2	-6.3	0	0	112.1	N8 P9 L14 Y15	N8-Q11 HydrophobicContact CB-CB 4.06Å; N8-Q11 PolarHBondContact O-N 2.84Å; N8-Q11 PolarHBondContact OD1-N 2.71Å; N8-Q11 VanDerWaalsContact OD1-N 3.11Å; P9-Q11 VanDerWaalsContact C-N 3.32Å; P9-Q11 PolarHBondContact O-N 3.21Å; Q11-L14 PolarHBondContact O-N 3.14Å; Q11-Y15 PolarHBondContact O-N 3.33Å
12	A	60.3	Low	63.5	Low	48 Å²	48	106.8 Å²	106.8	40%	0.397	57%	0.574	S	S	.	*	H	α-helix	trans	-64.4	-42.4	171.4	0	0	0	0	0	112.5	N8 P9 L14 Y15 L16	N8-A12 PolarHBondContact O-N 3.27Å; P9-A12 PolarHBondContact O-N 3.37Å; A12-L14 VanDerWaalsContact C-N 3.35Å; A12-L14 PolarHBondContact O-N 3.17Å; A12-Y15 PolarHBondContact O-N 3.25Å; A12-L16 WeakPolarHBondContact O-CG 3.36Å; A12-L16 PolarHBondContact O-N 3.14Å
13	I	72.4	Confident	65.4	Low	112 Å²	112	104.5 Å²	104.5	57%	0.574	55%	0.554	S	S	*	*	H	α-helix	trans	-61.7	-41.3	175.3	-72.8	159.3	0	0	0	111.4	P9 V10 L16 R17	P9-I13 WeakPolarHBondContact O-CD1 3.49Å; P9-I13 WeakPolarHBondContact O-CG1 3.32Å; P9-I13 PolarHBondContact O-N 3.33Å; V10-I13 PolarHBondContact O-N 3.37Å; I13-L16 PolarHBondContact O-N 3.08Å; I13-R17 WeakPolarHBondContact O-CB 3.46Å; I13-R17 PolarHBondContact O-N 3.42Å
14	L	67.6	Low	67.4	Low	101 Å²	101	105.2 Å²	105.2	53%	0.529	55%	0.546	S	S	.	.	H	α-helix	trans	-63.1	-42.7	175.1	-71	170.8	0	0	0	111.8	V10 Q11 A12 R17 E18	V10-L14 HydrophobicContact CG1-CD1 4.5Å; V10-L14 WeakPolarHBondContact O-CG 3.49Å; V10-L14 PolarHBondContact O-N 2.81Å; Q11-L14 PolarHBondContact O-N 3.14Å; A12-L14 VanDerWaalsContact C-N 3.35Å; A12-L14 PolarHBondContact O-N 3.17Å; L14-R17 PolarHBondContact O-N 3.29Å; L14-E18 PolarHBondContact O-N 3.11Å
15	Y	63.9	Low	68.9	Low	158 Å²	158	106.9 Å²	106.9	62%	0.62	55%	0.549	S	S	*	.	H	α-helix	trans	-64.5	-41.8	177.8	-140.6	-95.8	0	0	0	112.4	Q11 A12 R17 E18 L19	Q11-Y15 PolarHBondContact O-N 3.33Å; A12-Y15 PolarHBondContact O-N 3.25Å; Y15-R17 VanDerWaalsContact C-N 3.33Å; Y15-R17 PolarHBondContact O-N 2.68Å; Y15-E18 PolarHBondContact O-N 3.21Å; Y15-L19 HydrophobicContact CD1-CD1 4.03Å; Y15-L19 HydrophobicContact CD1-CG 4.44Å; Y15-L19 HydrophobicContact CE1-CD1 4.5Å; Y15-L19 WeakPolarHBondContact O-CB 3.31Å; Y15-L19 WeakPolarHBondContact O-CG 3.49Å; Y15-L19 PolarHBondContact O-N 3.08Å
16	L	75.2	Confident	70.3	Confident	108 Å²	108	105.4 Å²	105.4	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-64.1	-36.5	174.1	-73.8	167.8	0	0	0	112.2	A12 I13 T20	A12-L16 WeakPolarHBondContact O-CG 3.36Å; A12-L16 PolarHBondContact O-N 3.14Å; I13-L16 PolarHBondContact O-N 3.08Å; L16-T20 WeakPolarHBondContact O-CB 3.46Å; L16-T20 PolarHBondContact O-N 3.08Å; L16-T20 PolarHBondContact O-OG1 3.06Å
17	R	78.4	Confident	71.7	Confident	179 Å²	179	103.1 Å²	103.1	68%	0.675	52%	0.524	S	S	*	.	H	α-helix	trans	-68.3	-40	175.3	-170.3	177.1	-176.9	178.6	1.5	112.1	I13 L14 Y15 T20 T21	I13-R17 WeakPolarHBondContact O-CB 3.46Å; I13-R17 PolarHBondContact O-N 3.42Å; L14-R17 PolarHBondContact O-N 3.29Å; Y15-R17 VanDerWaalsContact C-N 3.33Å; Y15-R17 PolarHBondContact O-N 2.68Å; R17-T20 PolarHBondContact O-N 3.32Å; R17-T21 WeakPolarHBondContact O-CB 3.46Å; R17-T21 PolarHBondContact O-N 2.84Å; R17-T21 PolarHBondContact O-OG1 3Å
18	E	78.3	Confident	73.3	Confident	101 Å²	101	98.8 Å²	98.8	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-47.2	174	-170.6	170.3	-167.3	0	0	111.1	L14 Y15 T20 T21 I22	L14-E18 PolarHBondContact O-N 3.11Å; Y15-E18 PolarHBondContact O-N 3.21Å; E18-T20 PolarHBondContact O-N 3.18Å; E18-T21 WeakPolarHBondContact O-CB 3.38Å; E18-T21 PolarHBondContact O-N 3.09Å; E18-T21 VanDerWaalsContact O-N 3.13Å; E18-I22 HydrophobicContact CG-CD1 4.21Å; E18-I22 WeakPolarHBondContact O-CG1 3.39Å; E18-I22 PolarHBondContact O-N 3.36Å
19	L	78.4	Confident	74.7	Confident	87 Å²	87	100 Å²	100	46%	0.455	52%	0.516	S	S	.	.	H	α-helix	trans	-57.1	-45.4	173.5	-75.7	168.3	0	0	0	112.7	Y15 T21 I22 V23	Y15-L19 HydrophobicContact CD1-CD1 4.03Å; Y15-L19 HydrophobicContact CD1-CG 4.44Å; Y15-L19 HydrophobicContact CE1-CD1 4.5Å; Y15-L19 WeakPolarHBondContact O-CB 3.31Å; Y15-L19 WeakPolarHBondContact O-CG 3.49Å; Y15-L19 PolarHBondContact O-N 3.08Å; L19-T21 VanDerWaalsContact C-N 3.28Å; L19-T21 PolarHBondContact O-N 3.42Å; L19-I22 PolarHBondContact O-N 3.12Å; L19-V23 WeakPolarHBondContact O-CG2 3.29Å; L19-V23 PolarHBondContact O-N 3.2Å
20	T	81.8	Confident	76	Confident	80 Å²	80	99.5 Å²	99.5	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-40.4	176.7	-55.8	0	0	0	0	111.3	L16 R17 E18 V23 Q24	L16-T20 WeakPolarHBondContact O-CB 3.46Å; L16-T20 PolarHBondContact O-N 3.08Å; L16-T20 PolarHBondContact O-OG1 3.06Å; R17-T20 PolarHBondContact O-N 3.32Å; E18-T20 PolarHBondContact O-N 3.18Å; T20-V23 PolarHBondContact O-N 2.93Å; T20-Q24 WeakPolarHBondContact O-CG 3.38Å; T20-Q24 PolarHBondContact O-N 3.46Å
21	T	82.3	Confident	77.1	Confident	66 Å²	66	101.6 Å²	101.6	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-38	177.4	-52.4	0	0	0	0	111.5	R17 E18 L19 N25	R17-T21 WeakPolarHBondContact O-CB 3.46Å; R17-T21 PolarHBondContact O-N 2.84Å; R17-T21 PolarHBondContact O-OG1 3Å; E18-T21 WeakPolarHBondContact O-CB 3.38Å; E18-T21 PolarHBondContact O-N 3.09Å; E18-T21 VanDerWaalsContact O-N 3.13Å; L19-T21 VanDerWaalsContact C-N 3.28Å; L19-T21 PolarHBondContact O-N 3.42Å; T21-N25 WeakPolarHBondContact O-CB 3.28Å; T21-N25 VanDerWaalsContact O-CG 3.29Å; T21-N25 PolarHBondContact O-N 3.34Å; T21-N25 PolarHBondContact O-ND2 2.68Å
22	I	82.7	Confident	78.3	Confident	77 Å²	77	100.7 Å²	100.7	40%	0.395	51%	0.513	S	S	.	.	H	α-helix	trans	-64.4	-45	174.4	-68.3	164	0	0	0	110.8	E18 L19 N25 Q26	E18-I22 HydrophobicContact CG-CD1 4.21Å; E18-I22 WeakPolarHBondContact O-CG1 3.39Å; E18-I22 PolarHBondContact O-N 3.36Å; L19-I22 PolarHBondContact O-N 3.12Å; I22-N25 PolarHBondContact O-N 2.73Å; I22-Q26 PolarHBondContact O-N 3.03Å
23	V	85.6	Confident	79.1	Confident	71 Å²	71	103.6 Å²	103.6	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-44.8	177.7	171.8	0	0	0	0	111.4	L19 T20 N25 Q26 Q27	L19-V23 WeakPolarHBondContact O-CG2 3.29Å; L19-V23 PolarHBondContact O-N 3.2Å; T20-V23 PolarHBondContact O-N 2.93Å; V23-N25 PolarHBondContact O-N 2.89Å; V23-Q26 PolarHBondContact O-N 2.91Å; V23-Q27 HydrophobicContact CG1-CG 4.44Å; V23-Q27 WeakPolarHBondContact O-CG 3.37Å; V23-Q27 PolarHBondContact O-N 3.03Å
24	Q	79.5	Confident	79.7	Confident	120 Å²	120	106.1 Å²	106.1	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-62.1	-41.1	176	-75.3	-176.2	-43.2	0	0	112.4	T20 Q26 Q27 S28	T20-Q24 WeakPolarHBondContact O-CG 3.38Å; T20-Q24 PolarHBondContact O-N 3.46Å; Q24-Q26 VanDerWaalsContact C-N 3.35Å; Q24-Q26 PolarHBondContact O-N 3.25Å; Q24-Q27 PolarHBondContact O-N 2.87Å; Q24-S28 WeakPolarHBondContact O-CB 3.24Å; Q24-S28 PolarHBondContact O-N 3.1Å
25	N	77.1	Confident	80.5	Confident	107 Å²	107	104 Å²	104	57%	0.572	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-37.2	175.2	-76.1	-39.4	0	0	0	112.4	T21 I22 V23 L29	T21-N25 WeakPolarHBondContact O-CB 3.28Å; T21-N25 VanDerWaalsContact O-CG 3.29Å; T21-N25 PolarHBondContact O-N 3.34Å; T21-N25 PolarHBondContact O-ND2 2.68Å; I22-N25 PolarHBondContact O-N 2.73Å; V23-N25 PolarHBondContact O-N 2.89Å; N25-L29 WeakPolarHBondContact O-CB 3.39Å; N25-L29 PolarHBondContact O-N 3.37Å; N25-L29 VanDerWaalsContact O-N 3.07Å
26	Q	76.9	Confident	81.5	Confident	117 Å²	117	101.6 Å²	101.6	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-69.4	-41.2	174.2	-75.2	-177.4	-28.8	0	0	112.3	I22 V23 Q24 L29 I30	I22-Q26 PolarHBondContact O-N 3.03Å; V23-Q26 PolarHBondContact O-N 2.91Å; Q24-Q26 VanDerWaalsContact C-N 3.35Å; Q24-Q26 PolarHBondContact O-N 3.25Å; Q26-L29 PolarHBondContact O-N 2.83Å; Q26-I30 VanDerWaalsContact O-CG1 3.29Å; Q26-I30 WeakPolarHBondContact O-CG1 3.22Å; Q26-I30 PolarHBondContact O-N 3.21Å
27	Q	79.4	Confident	82	Confident	109 Å²	109	101 Å²	101	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-42.9	175	-73.7	175.1	-14.4	0	0	111.9	V23 Q24 L29 I30 Q31	V23-Q27 HydrophobicContact CG1-CG 4.44Å; V23-Q27 WeakPolarHBondContact O-CG 3.37Å; V23-Q27 PolarHBondContact O-N 3.03Å; Q24-Q27 PolarHBondContact O-N 2.87Å; Q27-L29 VanDerWaalsContact C-N 3.35Å; Q27-L29 PolarHBondContact O-N 3.17Å; Q27-I30 PolarHBondContact O-N 3.37Å; Q27-Q31 WeakPolarHBondContact O-CG 3.42Å; Q27-Q31 PolarHBondContact O-N 3.2Å
28	S	84.5	Confident	82.6	Confident	64 Å²	64	98.7 Å²	98.7	45%	0.448	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-39.9	175	-177.5	0	0	0	0	112.3	Q24 Q31 T32	Q24-S28 WeakPolarHBondContact O-CB 3.24Å; Q24-S28 PolarHBondContact O-N 3.1Å; S28-Q31 PolarHBondContact O-N 2.76Å; S28-T32 WeakPolarHBondContact O-CB 3.21Å; S28-T32 PolarHBondContact O-N 2.86Å; S28-T32 PolarHBondContact O-OG1 3.42Å
29	L	84	Confident	83	Confident	101 Å²	101	97.6 Å²	97.6	53%	0.529	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-44.2	174.8	-177.2	62.8	0	0	0	111.8	N25 Q26 Q27 T32 Q33	N25-L29 WeakPolarHBondContact O-CB 3.39Å; N25-L29 PolarHBondContact O-N 3.37Å; N25-L29 VanDerWaalsContact O-N 3.07Å; Q26-L29 PolarHBondContact O-N 2.83Å; Q27-L29 VanDerWaalsContact C-N 3.35Å; Q27-L29 PolarHBondContact O-N 3.17Å; L29-T32 WeakPolarHBondContact O-CB 3.43Å; L29-T32 PolarHBondContact O-N 3.31Å; L29-Q33 WeakPolarHBondContact O-CG 3.32Å; L29-Q33 PolarHBondContact O-N 3.49Å
30	I	88.3	Confident	83.1	Confident	83 Å²	83	97.6 Å²	97.6	43%	0.426	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-41.3	177.9	-69	163.2	0	0	0	111.1	Q26 Q27 Q33 R34	Q26-I30 VanDerWaalsContact O-CG1 3.29Å; Q26-I30 WeakPolarHBondContact O-CG1 3.22Å; Q26-I30 PolarHBondContact O-N 3.21Å; Q27-I30 PolarHBondContact O-N 3.37Å; I30-Q33 PolarHBondContact O-N 3.17Å; I30-R34 WeakPolarHBondContact O-CG 3.43Å; I30-R34 PolarHBondContact O-N 3.25Å
31	Q	83.9	Confident	83.3	Confident	137 Å²	137	98.1 Å²	98.1	64%	0.64	50%	0.496	S	S	*	.	H	α-helix	trans	-62.4	-42.4	173.7	-74.7	174.5	-20.1	0	0	111.8	Q27 S28 Q33 R34 A35	Q27-Q31 WeakPolarHBondContact O-CG 3.42Å; Q27-Q31 PolarHBondContact O-N 3.2Å; S28-Q31 PolarHBondContact O-N 2.76Å; Q31-Q33 VanDerWaalsContact C-N 3.31Å; Q31-Q33 PolarHBondContact O-N 3.28Å; Q31-R34 PolarHBondContact O-N 3.27Å; Q31-A35 PolarHBondContact O-N 3.41Å
32	T	84.8	Confident	83.7	Confident	88 Å²	88	100.3 Å²	100.3	54%	0.54	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-37.5	175.7	-53.5	0	0	0	0	111.7	S28 L29 R36	S28-T32 WeakPolarHBondContact O-CB 3.21Å; S28-T32 PolarHBondContact O-N 2.86Å; S28-T32 PolarHBondContact O-OG1 3.42Å; L29-T32 WeakPolarHBondContact O-CB 3.43Å; L29-T32 PolarHBondContact O-N 3.31Å; T32-R36 WeakPolarHBondContact O-CB 3.44Å; T32-R36 PolarHBondContact O-N 3.29Å
33	Q	76.3	Confident	83.9	Confident	109 Å²	109	101.4 Å²	101.4	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-68.9	-42.6	175.6	-74.3	174.4	-39	0	0	112.2	L29 I30 Q31 R36 I37	L29-Q33 WeakPolarHBondContact O-CG 3.32Å; L29-Q33 PolarHBondContact O-N 3.49Å; I30-Q33 PolarHBondContact O-N 3.17Å; Q31-Q33 VanDerWaalsContact C-N 3.31Å; Q31-Q33 PolarHBondContact O-N 3.28Å; Q33-R36 PolarHBondContact O-N 3.44Å; Q33-I37 WeakPolarHBondContact O-CG1 3.43Å; Q33-I37 PolarHBondContact O-N 3.48Å
34	R	85.3	Confident	84	Confident	165 Å²	165	101.7 Å²	101.7	62%	0.623	50%	0.498	S	S	*	.	H	α-helix	trans	-61.5	-50.2	175.9	-74.1	-179.4	177.3	-158.7	-3.6	112.4	I30 Q31 R36 I37 E38	I30-R34 WeakPolarHBondContact O-CG 3.43Å; I30-R34 PolarHBondContact O-N 3.25Å; Q31-R34 PolarHBondContact O-N 3.27Å; R34-R36 PolarHBondContact O-N 3.48Å; R34-R36 VanDerWaalsContact O-N 3.16Å; R34-I37 WeakPolarHBondContact O-CB 3.42Å; R34-I37 PolarHBondContact O-N 3.08Å; R34-E38 PolarHBondContact O-N 3.23Å
35	A	84.9	Confident	84.3	Confident	56 Å²	56	101.4 Å²	101.4	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-60.2	-27.4	176	0	0	0	0	0	112.9	Q31 E39	Q31-A35 PolarHBondContact O-N 3.41Å; A35-E39 PolarHBondContact O-N 3.22Å
36	R	82.9	Confident	84.8	Confident	108 Å²	108	99.5 Å²	99.5	41%	0.408	49%	0.487	S	S	.	.	H	α-helix	trans	-77.9	-28.7	173.8	-175.5	55	-178.8	-176.8	3.9	113.3	T32 Q33 R34 L40	T32-R36 WeakPolarHBondContact O-CB 3.44Å; T32-R36 PolarHBondContact O-N 3.29Å; Q33-R36 PolarHBondContact O-N 3.44Å; R34-R36 PolarHBondContact O-N 3.48Å; R34-R36 VanDerWaalsContact O-N 3.16Å; R36-L40 HydrophobicContact CG-CD1 4.36Å; R36-L40 WeakPolarHBondContact O-CD1 3.48Å; R36-L40 VanDerWaalsContact O-CG 3.22Å; R36-L40 WeakPolarHBondContact O-CG 3.39Å; R36-L40 PolarHBondContact O-N 3.38Å
37	I	87.6	Confident	85.2	Confident	95 Å²	95	97.3 Å²	97.3	49%	0.487	48%	0.479	S	S	.	.	H	α-helix	trans	-70.1	-50.4	172.3	-67.9	161.4	0	0	0	109	Q33 R34 E39 L40 D41	Q33-I37 WeakPolarHBondContact O-CG1 3.43Å; Q33-I37 PolarHBondContact O-N 3.48Å; R34-I37 WeakPolarHBondContact O-CB 3.42Å; R34-I37 PolarHBondContact O-N 3.08Å; I37-E39 VanDerWaalsContact C-N 3.31Å; I37-E39 PolarHBondContact O-N 3.39Å; I37-L40 WeakPolarHBondContact O-CA 3.42Å; I37-L40 WeakPolarHBondContact O-CB 3.42Å; I37-L40 PolarHBondContact O-N 2.82Å; I37-D41 WeakPolarHBondContact CG2-OD2 3.49Å; I37-D41 PolarHBondContact O-N 3.34Å
38	E	89.9	Confident	85.6	Confident	131 Å²	131	97.1 Å²	97.1	61%	0.612	48%	0.48	S	S	*	.	H	α-helix	trans	-54.3	-42	178.7	-69.2	162.9	-160.8	0	0	112.8	R34 R42	R34-E38 PolarHBondContact O-N 3.23Å; E38-R42 WeakPolarHBondContact O-CB 3.38Å; E38-R42 PolarHBondContact O-N 2.84Å
39	E	87.6	Confident	85.7	Confident	78 Å²	78	96 Å²	96	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-73.8	-25.3	175.6	-179.7	56.3	-158.4	0	0	113.7	A35 I37 R42 R43	A35-E39 PolarHBondContact O-N 3.22Å; I37-E39 VanDerWaalsContact C-N 3.31Å; I37-E39 PolarHBondContact O-N 3.39Å; E39-R42 IonicContact OE1-CZ 3.42Å; E39-R42 IonicContact OE1-NE 2.73Å; E39-R42 IonicContact OE1-NH2 2.87Å; E39-R42 PolarHBondContact OE1-NH2 3.13Å; E39-R42 IonicContact OE2-CZ 3.15Å; E39-R42 IonicContact OE2-NE 3.51Å; E39-R42 PolarHBondContact OE2-NE 3.31Å; E39-R42 IonicContact OE2-NH2 3.61Å; E39-R43 WeakPolarHBondContact O-CB 3.3Å; E39-R43 PolarHBondContact O-N 3.3Å
40	L	79.2	Confident	85.6	Confident	87 Å²	87	95.6 Å²	95.6	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-74.6	-43.8	173.3	-76.7	169	0	0	0	111	R36 I37 R43 V44	R36-L40 HydrophobicContact CG-CD1 4.36Å; R36-L40 WeakPolarHBondContact O-CD1 3.48Å; R36-L40 VanDerWaalsContact O-CG 3.22Å; R36-L40 WeakPolarHBondContact O-CG 3.39Å; R36-L40 PolarHBondContact O-N 3.38Å; I37-L40 WeakPolarHBondContact O-CA 3.42Å; I37-L40 WeakPolarHBondContact O-CB 3.42Å; I37-L40 PolarHBondContact O-N 2.82Å; L40-R43 PolarHBondContact O-N 2.76Å; L40-R43 VanDerWaalsContact O-N 3.13Å; L40-V44 WeakPolarHBondContact O-CG2 3.18Å; L40-V44 PolarHBondContact O-N 2.89Å
41	D	85.9	Confident	84.9	Confident	92 Å²	92	96.2 Å²	96.2	49%	0.492	48%	0.479	S	S	.	.	H	α-helix	trans	-60.8	-47.3	176.2	-62.1	-29.2	0	0	0	110.2	I37 R43 V44 D45	I37-D41 WeakPolarHBondContact CG2-OD2 3.49Å; I37-D41 PolarHBondContact O-N 3.34Å; D41-R43 PolarHBondContact O-N 3.09Å; D41-V44 WeakPolarHBondContact O-CA 3.37Å; D41-V44 WeakPolarHBondContact O-CB 3.43Å; D41-V44 PolarHBondContact O-N 2.9Å; D41-D45 PolarHBondContact O-N 2.61Å
42	R	91.5	Very high	84.9	Confident	112 Å²	112	98.3 Å²	98.3	42%	0.423	48%	0.481	S	S	.	.	H	α-helix	trans	-55.6	-36.5	173.8	-162	-167.9	72.3	65.9	14.3	112.6	E38 E39 E46	E38-R42 WeakPolarHBondContact O-CB 3.38Å; E38-R42 PolarHBondContact O-N 2.84Å; E39-R42 IonicContact OE1-CZ 3.42Å; E39-R42 IonicContact OE1-NE 2.73Å; E39-R42 IonicContact OE1-NH2 2.87Å; E39-R42 PolarHBondContact OE1-NH2 3.13Å; E39-R42 IonicContact OE2-CZ 3.15Å; E39-R42 IonicContact OE2-NE 3.51Å; E39-R42 PolarHBondContact OE2-NE 3.31Å; E39-R42 IonicContact OE2-NH2 3.61Å; R42-E46 IonicContact CZ-OE1 2.84Å; R42-E46 IonicContact CZ-OE2 3.19Å; R42-E46 IonicContact NH1-OE1 2.69Å; R42-E46 PolarHBondContact NH1-OE1 2.8Å; R42-E46 IonicContact NH1-OE2 2.78Å; R42-E46 IonicContact NH2-OE1 3.28Å; R42-E46 IonicContact NH2-OE2 2.62Å; R42-E46 PolarHBondContact NH2-OE2 3.29Å; R42-E46 WeakPolarHBondContact O-CG 3.49Å; R42-E46 PolarHBondContact O-N 2.91Å
43	R	85.9	Confident	84.3	Confident	100 Å²	100	99.7 Å²	99.7	38%	0.377	48%	0.481	S	S	.	.	H	α-helix	trans	-79.1	-25.8	177.7	-170.5	59.8	-169.4	162.2	17.6	113	E39 L40 D41 E46 L47 E50	E39-R43 WeakPolarHBondContact O-CB 3.3Å; E39-R43 PolarHBondContact O-N 3.3Å; L40-R43 PolarHBondContact O-N 2.76Å; L40-R43 VanDerWaalsContact O-N 3.13Å; D41-R43 PolarHBondContact O-N 3.09Å; R43-E46 WeakPolarHBondContact CD-OE2 3.45Å; R43-E46 IonicContact CZ-OE2 3.84Å; R43-E46 IonicContact NE-OE2 3.17Å; R43-E46 IonicContact NH1-OE2 3.19Å; R43-E46 PolarHBondContact NH1-OE2 3.27Å; R43-L47 HydrophobicContact CG-CD1 4.49Å; R43-L47 WeakPolarHBondContact O-CD1 3.46Å; R43-L47 VanDerWaalsContact O-CG 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.24Å; R43-L47 PolarHBondContact O-N 3.45Å; R43-L47 VanDerWaalsContact O-N 3.13Å; R43-E50 IonicContact CZ-OE1 3.8Å; R43-E50 IonicContact NH1-OE1 3.56Å; R43-E50 IonicContact NH2-OE1 2.73Å; R43-E50 PolarHBondContact NH2-OE1 2.93Å; R43-E50 VanDerWaalsContact NH2-OE1 3.08Å; R43-E50 IonicContact NH2-OE2 3.58Å
44	V	87.5	Confident	84	Confident	77 Å²	77	99.5 Å²	99.5	47%	0.467	48%	0.483	S	S	.	.	H	α-helix	trans	-67.1	-44.6	169.5	168.8	0	0	0	0	110.2	L40 D41 E46 L47 I48	L40-V44 WeakPolarHBondContact O-CG2 3.18Å; L40-V44 PolarHBondContact O-N 2.89Å; D41-V44 WeakPolarHBondContact O-CA 3.37Å; D41-V44 WeakPolarHBondContact O-CB 3.43Å; D41-V44 PolarHBondContact O-N 2.9Å; V44-E46 PolarHBondContact O-N 3.21Å; V44-L47 PolarHBondContact O-N 3.21Å; V44-I48 HydrophobicContact CG1-CD1 3.76Å; V44-I48 HydrophobicContact CG1-CG1 4.41Å; V44-I48 WeakPolarHBondContact O-CG1 3.29Å; V44-I48 PolarHBondContact O-N 3.43Å
45	D	87.5	Confident	83.3	Confident	113 Å²	113	101 Å²	101	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-60.8	-43.2	175.8	-75.2	-27.4	0	0	0	112.5	D41 L47 I48 G49	D41-D45 PolarHBondContact O-N 2.61Å; D45-L47 PolarHBondContact O-N 3.21Å; D45-I48 PolarHBondContact O-N 2.99Å; D45-G49 PolarHBondContact O-N 3.47Å
46	E	87.8	Confident	82.5	Confident	67 Å²	67	102.1 Å²	102.1	31%	0.313	49%	0.487	S	S	.	.	H	α-helix	trans	-57.2	-46.4	172.7	-75.4	179	153.6	0	0	111.7	R42 R43 V44 I48 G49 E50	R42-E46 IonicContact CZ-OE1 2.84Å; R42-E46 IonicContact CZ-OE2 3.19Å; R42-E46 IonicContact NH1-OE1 2.69Å; R42-E46 PolarHBondContact NH1-OE1 2.8Å; R42-E46 IonicContact NH1-OE2 2.78Å; R42-E46 IonicContact NH2-OE1 3.28Å; R42-E46 IonicContact NH2-OE2 2.62Å; R42-E46 PolarHBondContact NH2-OE2 3.29Å; R42-E46 WeakPolarHBondContact O-CG 3.49Å; R42-E46 PolarHBondContact O-N 2.91Å; R43-E46 WeakPolarHBondContact CD-OE2 3.45Å; R43-E46 IonicContact CZ-OE2 3.84Å; R43-E46 IonicContact NE-OE2 3.17Å; R43-E46 IonicContact NH1-OE2 3.19Å; R43-E46 PolarHBondContact NH1-OE2 3.27Å; V44-E46 PolarHBondContact O-N 3.21Å; E46-I48 PolarHBondContact O-N 3.2Å; E46-G49 PolarHBondContact O-N 3.15Å; E46-E50 WeakPolarHBondContact O-CG 3.44Å; E46-E50 PolarHBondContact O-N 3.46Å
47	L	84.3	Confident	81.3	Confident	72 Å²	72	101.9 Å²	101.9	38%	0.377	49%	0.49	S	S	.	.	H	α-helix	trans	-67.9	-31.7	179	-73.3	168.2	0	0	0	113	R43 V44 D45 N51	R43-L47 HydrophobicContact CG-CD1 4.49Å; R43-L47 WeakPolarHBondContact O-CD1 3.46Å; R43-L47 VanDerWaalsContact O-CG 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.24Å; R43-L47 PolarHBondContact O-N 3.45Å; R43-L47 VanDerWaalsContact O-N 3.13Å; V44-L47 PolarHBondContact O-N 3.21Å; D45-L47 PolarHBondContact O-N 3.21Å; L47-N51 WeakPolarHBondContact O-CB 3.42Å; L47-N51 PolarHBondContact O-N 2.97Å; L47-N51 PolarHBondContact O-ND2 2.86Å
48	I	87.2	Confident	79.7	Confident	104 Å²	104	104.4 Å²	104.4	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-41.1	172.1	-70.6	166.6	0	0	0	110.1	V44 D45 E46 N51 R52	V44-I48 HydrophobicContact CG1-CD1 3.76Å; V44-I48 HydrophobicContact CG1-CG1 4.41Å; V44-I48 WeakPolarHBondContact O-CG1 3.29Å; V44-I48 PolarHBondContact O-N 3.43Å; D45-I48 PolarHBondContact O-N 2.99Å; E46-I48 PolarHBondContact O-N 3.2Å; I48-N51 PolarHBondContact O-N 3.15Å; I48-R52 PolarHBondContact O-N 3.26Å
49	G	87.6	Confident	77.8	Confident	41 Å²	41	101.6 Å²	101.6	42%	0.423	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-49.5	172.8	0	0	0	0	0	113.1	D45 E46 N51 R52 H53	D45-G49 PolarHBondContact O-N 3.47Å; E46-G49 PolarHBondContact O-N 3.15Å; G49-N51 VanDerWaalsContact C-N 3.35Å; G49-N51 PolarHBondContact O-N 3.46Å; G49-R52 PolarHBondContact O-N 3.22Å; G49-H53 PolarHBondContact O-N 2.95Å; G49-H53 VanDerWaalsContact O-N 3.09Å
50	E	81.5	Confident	75.9	Confident	92 Å²	92	105.8 Å²	105.8	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-57.4	-45.2	175.7	-71.6	174.9	-161.2	0	0	111.2	R43 E46 R52 H53 L54	R43-E50 IonicContact CZ-OE1 3.8Å; R43-E50 IonicContact NH1-OE1 3.56Å; R43-E50 IonicContact NH2-OE1 2.73Å; R43-E50 PolarHBondContact NH2-OE1 2.93Å; R43-E50 VanDerWaalsContact NH2-OE1 3.08Å; R43-E50 IonicContact NH2-OE2 3.58Å; E46-E50 WeakPolarHBondContact O-CG 3.44Å; E46-E50 PolarHBondContact O-N 3.46Å; E50-R52 VanDerWaalsContact C-N 3.34Å; E50-R52 PolarHBondContact O-N 2.92Å; E50-H53 PolarHBondContact O-N 3.11Å; E50-L54 WeakPolarHBondContact O-CG 3.38Å; E50-L54 PolarHBondContact O-N 3.15Å
51	N	73.3	Confident	74.6	Confident	96 Å²	96	109.4 Å²	109.4	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-33.5	177.8	-87.9	-84	0	0	0	113.6	L47 I48 G49 R55	L47-N51 WeakPolarHBondContact O-CB 3.42Å; L47-N51 PolarHBondContact O-N 2.97Å; L47-N51 PolarHBondContact O-ND2 2.86Å; I48-N51 PolarHBondContact O-N 3.15Å; G49-N51 VanDerWaalsContact C-N 3.35Å; G49-N51 PolarHBondContact O-N 3.46Å; N51-R55 WeakPolarHBondContact O-CG 3.5Å; N51-R55 PolarHBondContact O-N 2.91Å
52	R	83.7	Confident	72.8	Confident	182 Å²	182	110.3 Å²	110.3	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-66	-50.4	174.7	-172.2	175.5	-176.4	162.7	2.8	110.7	I48 G49 E50 L54 R55 D56	I48-R52 PolarHBondContact O-N 3.26Å; G49-R52 PolarHBondContact O-N 3.22Å; E50-R52 VanDerWaalsContact C-N 3.34Å; E50-R52 PolarHBondContact O-N 2.92Å; R52-L54 VanDerWaalsContact C-N 3.27Å; R52-L54 PolarHBondContact O-N 3.06Å; R52-R55 WeakPolarHBondContact O-CB 3.5Å; R52-R55 PolarHBondContact O-N 3.44Å; R52-D56 PolarHBondContact O-N 3.04Å
53	H	73.4	Confident	70.2	Confident	117 Å²	117	112.8 Å²	112.8	54%	0.542	56%	0.558	S	S	.	*	H	α-helix	trans	-60	-35.8	178.8	-165	-90.5	0	0	0	112.9	G49 E50 H57	G49-H53 PolarHBondContact O-N 2.95Å; G49-H53 VanDerWaalsContact O-N 3.09Å; E50-H53 PolarHBondContact O-N 3.11Å; H53-H57 AromaticContact CE1-CD2 3.42Å; H53-H57 PolarHBondContact CE1-CD2 2.86Å; H53-H57 VanDerWaalsContact CE1-CD2 3.42Å; H53-H57 AromaticContact CE1-NE2 3.42Å; H53-H57 PolarHBondContact CE1-NE2 3.34Å; H53-H57 AromaticContact ND1-CD2 3.58Å; H53-H57 PolarHBondContact O-N 3.03Å; H53-H57 VanDerWaalsContact O-N 3.13Å
54	L	69.7	Low	68.1	Low	105 Å²	105	113.8 Å²	113.8	55%	0.55	58%	0.577	S	S	.	*	H	α-helix	trans	-68.7	-29.2	174.7	-73.8	169.2	0	0	0	113.7	E50 R52 H58	E50-L54 WeakPolarHBondContact O-CG 3.38Å; E50-L54 PolarHBondContact O-N 3.15Å; R52-L54 VanDerWaalsContact C-N 3.27Å; R52-L54 PolarHBondContact O-N 3.06Å; L54-H58 PolarHBondContact O-ND1 2.85Å
55	R	69.8	Low	65.4	Low	195 Å²	195	117.5 Å²	117.5	74%	0.736	59%	0.594	S	S	*	*	H	α-helix	trans	-75	-46.2	172.5	-72.5	178.6	178.1	-140.4	-0.4	111.3	N51 R52 H57 H58 S59	N51-R55 WeakPolarHBondContact O-CG 3.5Å; N51-R55 PolarHBondContact O-N 2.91Å; R52-R55 WeakPolarHBondContact O-CB 3.5Å; R52-R55 PolarHBondContact O-N 3.44Å; R55-H57 PolarHBondContact O-N 3.29Å; R55-H58 PolarHBondContact O-N 2.94Å; R55-S59 PolarHBondContact O-N 3.48Å; R55-S59 PolarHBondContact O-OG 3.41Å
56	D	68.1	Low	63.3	Low	80 Å²	80	117.7 Å²	117.7	43%	0.428	60%	0.602	S	S	.	*	H	α-helix	trans	-61.2	-32.8	-179.1	-62	-27.1	0	0	0	111.7	R52 H58 S59 H60	R52-D56 PolarHBondContact O-N 3.04Å; D56-H58 PolarHBondContact O-N 3.4Å; D56-S59 PolarHBondContact O-OG 2.87Å; D56-H60 PolarHBondContact O-CD2 3.02Å; D56-H60 VanDerWaalsContact O-CD2 3.29Å
57	H	58.3	Low	60.8	Low	104 Å²	104	119.5 Å²	119.5	48%	0.481	62%	0.622	S	S	.	*	H	α-helix	trans	-66.4	-29.2	171.5	-102.2	-71.2	0	0	0	114.8	H53 R55	H53-H57 AromaticContact CE1-CD2 3.42Å; H53-H57 PolarHBondContact CE1-CD2 2.86Å; H53-H57 VanDerWaalsContact CE1-CD2 3.42Å; H53-H57 AromaticContact CE1-NE2 3.42Å; H53-H57 PolarHBondContact CE1-NE2 3.34Å; H53-H57 AromaticContact ND1-CD2 3.58Å; H53-H57 PolarHBondContact O-N 3.03Å; H53-H57 VanDerWaalsContact O-N 3.13Å; R55-H57 PolarHBondContact O-N 3.29Å
58	H	54	Low	58.2	Low	147 Å²	147	122.7 Å²	122.7	68%	0.681	65%	0.648	S	S	*	*	H	α-helix	trans	-76.5	-36.7	179.3	-82.4	81.1	0	0	0	111.9	L54 R55 D56 H60 H61	L54-H58 PolarHBondContact O-ND1 2.85Å; R55-H58 PolarHBondContact O-N 2.94Å; D56-H58 PolarHBondContact O-N 3.4Å; H58-H60 VanDerWaalsContact C-N 3.27Å; H58-H60 PolarHBondContact O-N 3.04Å; H58-H61 PolarHBondContact O-N 3.03Å
59	S	49.8	Very low	55.7	Low	73 Å²	73	125.5 Å²	125.5	51%	0.51	66%	0.664	S	S	.	*	H	α-helix	trans	-65.6	-26.3	177.5	31.7	0	0	0	0	113.5	R55 D56 H61	R55-S59 PolarHBondContact O-N 3.48Å; R55-S59 PolarHBondContact O-OG 3.41Å; D56-S59 PolarHBondContact O-OG 2.87Å; S59-H61 VanDerWaalsContact C-N 3.33Å; S59-H61 PolarHBondContact O-N 3.39Å
60	H	48.6	Very low	53.2	Low	166 Å²	166	132.3 Å²	132.3	77%	0.769	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-6.2	178.6	-81.4	-63.1	0	0	0	115.5	D56 H58	D56-H60 PolarHBondContact O-CD2 3.02Å; D56-H60 VanDerWaalsContact O-CD2 3.29Å; H58-H60 VanDerWaalsContact C-N 3.27Å; H58-H60 PolarHBondContact O-N 3.04Å
61	H	52.3	Low	50.9	Low	163 Å²	163	135.7 Å²	135.7	76%	0.755	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	4.1	-178.6	-88.2	-63	0	0	0	115.4	H58 S59	H58-H61 PolarHBondContact O-N 3.03Å; S59-H61 VanDerWaalsContact C-N 3.33Å; S59-H61 PolarHBondContact O-N 3.39Å
62	T	46.7	Very low	48.9	Very low	110 Å²	110	139.2 Å²	139.2	68%	0.675	71%	0.713	S	S	*	*			trans	-124.8	70.4	-177.9	51.6	0	0	0	0	113.2
63	L	38.2	Very low	46.5	Very low	165 Å²	165	138.1 Å²	138.1	86%	0.864	72%	0.715	S	S	*	*			trans	-136.1	121.1	165.5	-90.3	166.6	0	0	0	109.4
64	P	41	Very low	44.4	Very low	121 Å²	121	138.8 Å²	138.8	79%	0.786	72%	0.718	S	S	*	*			trans	-88.7	140.3	177.7	33.9	-32.5	0	0	0	112.3
65	D	31.3	Very low	43.2	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	73%	0.729	S	S	*	*			trans	-91.9	126.7	-178.4	-155.4	5.1	0	0	0	111	S67	D65-S67 PolarHBondContact O-N 3.05Å
66	P	42.2	Very low	41.4	Very low	118 Å²	118	137.2 Å²	137.2	77%	0.766	73%	0.727	S	S	*	*			trans	-97.8	86	-162	36.3	-35.5	0	0	0	114.7
67	S	36.1	Very low	39.5	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	75%	0.746	S	S	*	*			trans	-157.7	102.6	163.2	51.3	0	0	0	0	116.5	D65	D65-S67 PolarHBondContact O-N 3.05Å
68	C	30.5	Very low	38.8	Very low	139 Å²	139	141.5 Å²	141.5	94%	0.939	76%	0.76	S	S	*	*			trans	178.9	144.1	134.3	-94.4	0	0	0	0	111.7
69	L	34.5	Very low	37.7	Very low	164 Å²	164	142 Å²	142	86%	0.859	76%	0.762	S	S	*	*			trans	-117.6	138.9	179.6	-80.6	157.5	0	0	0	110.6
70	H	33.8	Very low	36.7	Very low	184 Å²	184	146.3 Å²	146.3	85%	0.852	78%	0.779	S	S	*	*				-174.2	165.7	129.1	-105.7	69.7	0	0	0	114.1
71	H	33.3	Very low	35.9	Very low	162 Å²	162	146.7 Å²	146.7	75%	0.75	78%	0.778	S	S	*	*			trans	-74.7	169.4	178.2	-65.6	-6.6	0	0	0	112.6
72	H	32	Very low	34.8	Very low	170 Å²	170	144.3 Å²	144.3	79%	0.787	78%	0.78	S	S	*	*			cis	-164	-159.2	48.6	-127	-15.4	0	0	0	115.8
73	H	32.9	Very low	33.9	Very low	160 Å²	160	145.1 Å²	145.1	74%	0.741	79%	0.785	S	S	*	*			trans	-101	146.8	-154.5	-88.2	-78.4	0	0	0	119.2
74	H	30.4	Very low	33.6	Very low	130 Å²	130	144 Å²	144	60%	0.602	79%	0.785	S	S	*	*			trans	51.4	179.8	137.2	-117.9	-6.2	0	0	0	119.3	Q76	H74-Q76 PolarHBondContact CD2-NE2 3.46Å; H74-Q76 PolarHBondContact NE2-NE2 2.94Å
75	P	43.7	Very low	32.9	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	79%	0.788	S	S	*	*			cis	-91	-144.6	9.4	-3.8	27.2	0	0	0	114.8
76	Q	31.4	Very low	32.8	Very low	147 Å²	147	139.9 Å²	139.9	69%	0.687	79%	0.791	S	S	*	*				-176.9	153.9	-93	-173.5	171.3	99.3	0	0	109.9	H74	H74-Q76 PolarHBondContact CD2-NE2 3.46Å; H74-Q76 PolarHBondContact NE2-NE2 2.94Å
77	D	28	Very low	32	Very low	155 Å²	155	142.1 Å²	142.1	83%	0.829	80%	0.795	S	S	*	*			trans	-137.9	160.3	175.9	-110.3	-38.6	0	0	0	111.9
78	P	44.9	Very low	32.5	Very low	119 Å²	119	142.2 Å²	142.2	77%	0.773	79%	0.794	S	S	*	*			trans	-93.2	168.1	-161.5	36.1	-36.9	0	0	0	117.5
79	Q	30	Very low	32.3	Very low	156 Å²	156	143.6 Å²	143.6	73%	0.729	79%	0.786	S	S	*	*			trans	-100.7	169.2	-175.7	-69.1	-162.6	-22.7	0	0	115.3
80	L	29.2	Very low	32.1	Very low	165 Å²	165	143.9 Å²	143.9	86%	0.864	78%	0.783	S	S	*	*				-179.7	154.2	124	-90.7	159.8	0	0	0	109.4
81	K	32	Very low	31.7	Very low	173 Å²	173	139.2 Å²	139.2	75%	0.752	78%	0.776	S	S	*	*				-159.1	167.5	-51.9	-122.6	-170.8	-173.2	176.8	0	109
82	S	28.6	Very low	31.4	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	78%	0.782	S	S	*	*			trans	-137.5	170.2	176.2	60.7	0	0	0	0	113.5
83	T	28.8	Very low	31.2	Very low	127 Å²	127	134.9 Å²	134.9	78%	0.779	78%	0.784	S	S	*	*			trans	-144.3	150	-177.4	46.8	0	0	0	0	108
84	T	30.2	Very low	31.5	Very low	141 Å²	141	132.7 Å²	132.7	87%	0.865	78%	0.784	S	S	*	*			cis	-163.5	160.4	5.9	4.8	0	0	0	0	109.2
85	G	27.2	Very low	31.3	Very low	81 Å²	81	130.4 Å²	130.4	84%	0.835	79%	0.788	S	S	*	*			trans	162.9	141.7	168.5	0	0	0	0	0	112.5
86	A	29.4	Very low	30.4	Very low	108 Å²	108	133.3 Å²	133.3	89%	0.893	79%	0.791	S	S	*	*			trans	-141.8	158	-170.4	0	0	0	0	0	114.8
87	L	25.9	Very low	30.2	Very low	164 Å²	164	132.2 Å²	132.2	86%	0.859	79%	0.794	S	S	*	*			trans	-85.3	161.2	174.5	-77.1	164.1	0	0	0	111.4
88	P	46.3	Very low	30	Very low	107 Å²	107	132.9 Å²	132.9	70%	0.695	79%	0.792	S	S	*	*				-134.8	-166.2	72.5	38.5	-18.6	0	0	0	112.6
89	E	25.6	Very low	29.1	Very low	167 Å²	167	132.8 Å²	132.8	78%	0.78	79%	0.789	S	S	*	*			cis	-158.8	-178.4	18.7	-153.4	160.3	163.9	0	0	114.8
90	H	30.3	Very low	28.9	Very low	170 Å²	170	130.5 Å²	130.5	79%	0.787	79%	0.791	S	S	*	*			trans	-55.3	172.4	177.7	-67.6	-75.2	0	0	0	117.8
91	A	26.6	Very low	29.8	Very low	86 Å²	86	128.9 Å²	128.9	71%	0.711	79%	0.79	S	S	*	*			cis	-177.3	174.2	-25.8	0	0	0	0	0	112.1
92	A	26.7	Very low	29.6	Very low	105 Å²	105	124 Å²	124	87%	0.868	79%	0.788	S	S	*	*			trans	87.1	151.2	148.4	0	0	0	0	0	123.4
93	T	27.7	Very low	29.5	Very low	137 Å²	137	124.6 Å²	124.6	84%	0.84	79%	0.787	S	S	*	*			trans	-86.9	175.1	-177.2	8.5	0	0	0	0	113
94	P	39.6	Very low	29.6	Very low	114 Å²	114	127 Å²	127	74%	0.74	79%	0.789	S	S	*	*				-158.9	-178.1	53	45.7	-22.8	0	0	0	120.5
95	A	26.1	Very low	30.3	Very low	82 Å²	82	125.7 Å²	125.7	68%	0.678	78%	0.783	S	S	*	*			trans	32.9	152.3	136.4	0	0	0	0	0	122.8
96	Q	24.6	Very low	31.7	Very low	181 Å²	181	127.5 Å²	127.5	85%	0.846	78%	0.78	S	S	*	*			cis	-171.6	-171.3	-2.8	-114.8	178.1	-18.2	0	0	110.3
97	V	25.9	Very low	32.8	Very low	124 Å²	124	128.3 Å²	128.3	75%	0.752	78%	0.776	S	S	*	*			trans	77.9	120	164.3	-168.6	0	0	0	0	114.8
98	E	24.7	Very low	33.2	Very low	169 Å²	169	125.5 Å²	125.5	79%	0.79	78%	0.777	S	S	*	*			cis	88.7	121	35.6	-153.6	-173.9	177.2	0	0	113.3
99	V	25.8	Very low	32.7	Very low	117 Å²	117	129.2 Å²	129.2	71%	0.709	79%	0.785	S	S	*	*				176.9	126.7	88.9	163.1	0	0	0	0	105
100	S	25.1	Very low	33.8	Very low	109 Å²	109	126.8 Å²	126.8	76%	0.762	78%	0.784	S	S	*	*				65.2	161.8	76	-84.2	0	0	0	0	116.8
101	P	49.8	Very low	33.7	Very low	131 Å²	131	127.3 Å²	127.3	85%	0.851	79%	0.789	S	S	*	*			cis	-133.6	-177.8	9.7	43	-26.1	0	0	0	117.2
102	G	25.8	Very low	34.1	Very low	70 Å²	70	129 Å²	129	72%	0.722	79%	0.786	S	S	*	*			trans	173.5	51.3	171	0	0	0	0	0	124.2
103	V	28.5	Very low	35.2	Very low	127 Å²	127	130 Å²	130	77%	0.77	78%	0.783	S	S	*	*			trans	49.6	103.1	142	-176.3	0	0	0	0	120.1
104	Q	29.8	Very low	35.3	Very low	177 Å²	177	126.2 Å²	126.2	83%	0.827	77%	0.772	S	S	*	*				75.5	164.5	85.2	-76.6	-178.7	-11	0	0	117.5
105	P	44.3	Very low	34.9	Very low	114 Å²	114	128.1 Å²	128.1	74%	0.74	78%	0.776	S	S	*	*			cis	-134.1	-174.6	-24.8	32.9	-10	0	0	0	115.1
106	P	58.1	Low	35.1	Very low	118 Å²	118	130.4 Å²	130.4	77%	0.766	77%	0.774	S	S	*	*			trans	-109.9	174.6	-170.7	41.9	-35.6	0	0	0	117.3
107	P	52.2	Low	35.4	Very low	125 Å²	125	129.2 Å²	129.2	81%	0.812	77%	0.768	S	S	*	*				-159.8	161.4	118.6	41	-22.1	0	0	0	120.8
108	A	34.3	Very low	35.5	Very low	106 Å²	106	134 Å²	134	88%	0.876	77%	0.773	S	S	*	*			trans	52.5	165.6	137.5	0	0	0	0	0	127.2
109	Q	34.8	Very low	35.6	Very low	185 Å²	185	129 Å²	129	86%	0.864	77%	0.766	S	S	*	*			trans	-100.6	178.3	-179.3	-56.7	176.3	-38.4	0	0	113.7
110	P	49	Very low	35.7	Very low	116 Å²	116	132.5 Å²	132.5	75%	0.753	78%	0.775	S	S	*	*				-160.5	155.3	98.5	40.6	-20.6	0	0	0	121.1
111	M	28.1	Very low	35.7	Very low	181 Å²	181	132.9 Å²	132.9	89%	0.892	77%	0.773	S	S	*	*			trans	69.8	159.7	134.6	-66.5	-67.7	-73.8	0	0	125.9
112	D	34.4	Very low	34.3	Very low	122 Å²	122	135 Å²	135	65%	0.652	77%	0.769	S	S	*	*			trans	-138.2	167.2	-171.1	175.9	55.7	0	0	0	111	G114	D112-G114 WeakPolarHBondContact OD2-CA 3.49Å
113	P	51.6	Low	34.2	Very low	124 Å²	124	141.7 Å²	141.7	81%	0.805	77%	0.772	S	S	*	*				-147.4	157.3	113.1	38.5	-23.8	0	0	0	115.8
114	G	29.3	Very low	33.9	Very low	59 Å²	59	142.4 Å²	142.4	61%	0.608	77%	0.772	S	S	*	*			cis	150.4	20	-5.8	0	0	0	0	0	118	D112	D112-G114 WeakPolarHBondContact OD2-CA 3.49Å
115	D	30.7	Very low	33.6	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	77%	0.774	S	S	*	*			trans	-144.4	143.7	-161.5	-171.8	84.9	0	0	0	113.3
116	M	29.4	Very low	33.3	Very low	129 Å²	129	145 Å²	145	64%	0.635	77%	0.773	S	S	*	*			cis	-161.7	167.5	-20.8	-114.4	-61.9	166.8	0	0	111.8
117	H	31.4	Very low	31.8	Very low	157 Å²	157	147.9 Å²	147.9	73%	0.727	77%	0.774	S	S	*	*			trans	61.5	151.5	167.6	-61.9	111.5	0	0	0	118.4
118	R	28.1	Very low	30.6	Very low	225 Å²	225	148 Å²	148	85%	0.849	77%	0.767	S	S	*	*			cis	178.8	139.8	-26	177.1	173.5	-177.7	163.4	0.6	107.4
119	G	26.7	Very low	30.3	Very low	63 Å²	63	151.6 Å²	151.6	65%	0.649	77%	0.765	S	S	*	*			cis	150	144.8	-6.6	0	0	0	0	0	111.8
120	Q	27.9	Very low	30	Very low	191 Å²	191	145.7 Å²	145.7	89%	0.893	75%	0.754	S	S	*	*			trans	67.8	169.3	174.6	-74.4	179.4	-11	0	0	117.5
121	V	24.8	Very low	29.1	Very low	117 Å²	117	147.6 Å²	147.6	71%	0.709	76%	0.764	S	S	*	*			cis	-165.8	149.9	-48	103.5	0	0	0	0	110.5
122	F	21.8	Very low	29.2	Very low	175 Å²	175	143.2 Å²	143.2	77%	0.768	76%	0.756	S	S	*	*			trans	61.9	144.6	162.2	-90.3	-129.4	0	0	0	123.4
123	R	22.2	Very low	28.9	Very low	210 Å²	210	144.4 Å²	144.4	79%	0.792	76%	0.762	S	S	*	*			trans	83	139.4	139.6	-94.7	179.6	175	172.1	-1.6	124.1
124	N	22.8	Very low	27.7	Very low	142 Å²	142	144.7 Å²	144.7	76%	0.759	76%	0.757	S	S	*	*			trans	94.3	115.7	140.2	-70.1	-4.6	0	0	0	123.1
125	R	23.4	Very low	27.6	Very low	234 Å²	234	149.3 Å²	149.3	88%	0.883	77%	0.767	S	S	*	*			trans	-44.2	162.4	142.9	-98.6	179.3	171.1	-178	-1.4	112.7
126	P	38.5	Very low	28.1	Very low	111 Å²	111	147.6 Å²	147.6	72%	0.721	76%	0.764	S	S	*	*			cis	-150	-176.5	43.5	42.5	-21.4	0	0	0	119.1
127	K	25.6	Very low	29.2	Very low	180 Å²	180	146.3 Å²	146.3	78%	0.783	77%	0.765	S	S	*	*			trans	1.1	157.6	144.9	-52.7	174.5	178.4	-179.9	0	118.7
128	L	26.8	Very low	29.2	Very low	127 Å²	127	145.2 Å²	145.2	67%	0.665	77%	0.769	S	S	*	*			cis	-152.4	150.3	34.4	-89	88.9	0	0	0	113.5
129	H	28.4	Very low	30.2	Very low	182 Å²	182	140.4 Å²	140.4	84%	0.843	77%	0.768	S	S	*	*			trans	56	147.2	140.8	-61.3	12.2	0	0	0	120.6
130	G	28.7	Very low	30.2	Very low	61 Å²	61	146.1 Å²	146.1	63%	0.629	78%	0.777	S	S	*	*			cis	159.3	146.3	-9.1	0	0	0	0	0	113.8
131	T	31.4	Very low	30.3	Very low	156 Å²	156	141.4 Å²	141.4	96%	0.957	77%	0.771	S	S	*	*			trans	62.4	143.9	175.3	30.1	0	0	0	0	116.8
132	A	29.2	Very low	30.3	Very low	88 Å²	88	143 Å²	143	73%	0.727	77%	0.77	S	S	*	*			cis	-147.2	178.5	1.8	0	0	0	0	0	109.4
133	L	27.4	Very low	30.5	Very low	148 Å²	148	142 Å²	142	78%	0.775	77%	0.766	S	S	*	*			cis	-141.6	-132	4.3	-146.6	175.8	0	0	0	109.3
134	N	27.2	Very low	30.7	Very low	130 Å²	130	138.7 Å²	138.7	70%	0.695	76%	0.763	S	S	*	*			trans	-144.6	167.7	-174.2	-62.5	-62.9	0	0	0	109.1
135	L	28.1	Very low	30.8	Very low	156 Å²	156	137.3 Å²	137.3	82%	0.817	76%	0.76	S	S	*	*			cis	63.4	159.3	34.2	-76.6	149.1	0	0	0	113.3
136	P	40	Very low	30.9	Very low	117 Å²	117	132.1 Å²	132.1	76%	0.76	75%	0.754	S	S	*	*			cis	-132	-167.9	4.9	40.1	-19.7	0	0	0	114.8
137	P	52.7	Low	30.3	Very low	102 Å²	102	135.4 Å²	135.4	66%	0.662	76%	0.76	S	S	*	*			trans	-118.9	178.2	-179.1	42	-31.5	0	0	0	116.9
138	T	32.3	Very low	30.4	Very low	134 Å²	134	129.9 Å²	129.9	82%	0.822	76%	0.755	S	S	*	*			trans	60.8	174.1	165.2	46.9	0	0	0	0	117.3
139	P	47.2	Very low	30.5	Very low	125 Å²	125	130.2 Å²	130.2	81%	0.812	76%	0.762	S	S	*	*			cis	-133.1	-117.1	8.5	42	-19.4	0	0	0	117
140	H	27.8	Very low	30.4	Very low	183 Å²	183	130.7 Å²	130.7	85%	0.847	76%	0.761	S	S	*	*			trans	-114.7	153	-152.9	-88.2	-113.3	0	0	0	117.5
141	A	28.9	Very low	30.3	Very low	92 Å²	92	137.1 Å²	137.1	76%	0.76	78%	0.775	S	S	*	*			trans	78.5	143.9	137.6	0	0	0	0	0	125.9
142	E	26.3	Very low	30.1	Very low	150 Å²	150	135.9 Å²	135.9	70%	0.701	77%	0.767	S	S	*	*			trans	71.8	118.7	151.8	-66.5	-120.3	99.9	0	0	125.3
143	K	26.1	Very low	30.4	Very low	154 Å²	154	136.8 Å²	136.8	67%	0.67	77%	0.765	S	S	*	*			trans	74.2	122.2	130.8	-77.2	-176.1	-179.2	120.3	0	125.8
144	L	25.1	Very low	30.4	Very low	140 Å²	140	137.6 Å²	137.6	73%	0.733	77%	0.765	S	S	*	*			trans	79.1	121.2	132.4	-107.8	74	0	0	0	123.8
145	T	24.8	Very low	30.3	Very low	113 Å²	113	138.6 Å²	138.6	69%	0.693	77%	0.766	S	S	*	*			trans	52.8	136.6	136.1	46.4	0	0	0	0	121.6
146	T	26.8	Very low	30.1	Very low	126 Å²	126	137.3 Å²	137.3	77%	0.773	76%	0.764	S	S	*	*			cis	-166.9	-165.7	-8.9	7.1	0	0	0	0	107
147	Q	26.4	Very low	29.9	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	77%	0.769	S	S	*	*			cis	-159.1	157.6	8.7	-146.1	-160.5	114.7	0	0	111.4
148	G	27.5	Very low	29	Very low	65 Å²	65	142.5 Å²	142.5	67%	0.67	78%	0.778	S	S	*	*			trans	79.6	150.5	161.6	0	0	0	0	0	116.6
149	V	27.2	Very low	28.8	Very low	134 Å²	134	144.3 Å²	144.3	81%	0.812	78%	0.777	S	S	*	*			cis	-142.3	131.1	2.3	172.7	0	0	0	0	111.7
150	K	26.7	Very low	27.6	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.835	78%	0.776	S	S	*	*			trans	16.3	121.2	156.4	-55.7	175.8	-178.1	178.9	0	120.7
151	Q	27	Very low	27.3	Very low	196 Å²	196	144 Å²	144	92%	0.916	77%	0.773	S	S	*	*				-159	166.6	103.8	-106.4	175	1.5	0	0	111.9
152	V	28.2	Very low	26.9	Very low	130 Å²	130	148 Å²	148	79%	0.788	78%	0.778	S	S	*	*			trans	-159	158.5	-151.8	162.6	0	0	0	0	107.7
153	P	35.4	Very low	26.7	Very low	107 Å²	107	150.6 Å²	150.6	70%	0.695	78%	0.783	S	S	*	*			cis	-118.7	-167.5	2.3	34	-12.3	0	0	0	112.7
154	Q	27	Very low	26.4	Very low	165 Å²	165	148.8 Å²	148.8	77%	0.771	79%	0.785	S	S	*	*			cis	-146.4	162.7	8.9	-150.8	150.1	11	0	0	113
155	E	24.8	Very low	26.3	Very low	151 Å²	151	147.2 Å²	147.2	71%	0.706	79%	0.785	S	S	*	*			trans	-62.5	146.9	-167.4	-59.2	105.5	133.9	0	0	115.2
156	T	24	Very low	26.2	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	79%	0.786	S	S	*	*			cis	84.3	122.6	25.8	73.7	0	0	0	0	117.8
157	K	36.8	Very low	26	Very low	199 Å²	199	149.5 Å²	149.5	87%	0.865	78%	0.784	S	S	*	*			trans	-71.1	166.3	178.3	-49.5	166	-175	172.2	0	112.4
158	P	33.4	Very low	25.8	Very low	129 Å²	129	146.7 Å²	146.7	84%	0.838	78%	0.775	S	S	*	*				-137	-163.7	126.2	37.3	-24.3	0	0	0	114.4
159	Q	26.8	Very low	25.5	Very low	173 Å²	173	149.7 Å²	149.7	81%	0.808	77%	0.773	S	S	*	*			trans	-125.5	172.9	-162.5	-53.2	167.7	-69.3	0	0	113.7
160	K	23.2	Very low	25.3	Very low	184 Å²	184	150.4 Å²	150.4	80%	0.8	77%	0.767	S	S	*	*			trans	81	119.3	156.6	-69.1	-177.9	177	178.6	0	120
161	C	21.7	Very low	25.2	Very low	116 Å²	116	147.2 Å²	147.2	78%	0.784	76%	0.764	S	S	*	*			trans	48.2	107.4	131.3	-53.6	0	0	0	0	120.5
162	M	20.1	Very low	25	Very low	176 Å²	176	146.4 Å²	146.4	87%	0.867	77%	0.766	S	S	*	*				-165.3	155	106.4	-112.2	-160.5	-61	0	0	115.7
163	Y	20.9	Very low	24.8	Very low	205 Å²	205	143.7 Å²	143.7	80%	0.804	76%	0.764	S	S	*	*			trans	17	124.7	143	-92.6	-123	0	0	0	122.7
164	V	21	Very low	24.4	Very low	116 Å²	116	143.8 Å²	143.8	70%	0.703	77%	0.774	S	S	*	*				89.4	121.6	119.9	162.2	0	0	0	0	122.9
165	C	21.8	Very low	24.3	Very low	108 Å²	108	141 Å²	141	73%	0.73	77%	0.772	S	S	*	*			trans	74.6	151	146.3	-88.7	0	0	0	0	124
166	V	23	Very low	24.4	Very low	120 Å²	120	140.8 Å²	140.8	73%	0.727	78%	0.782	S	S	*	*			trans	72.1	136.8	141.9	162.1	0	0	0	0	116.2
167	F	22.4	Very low	24.4	Very low	166 Å²	166	142.2 Å²	142.2	73%	0.728	79%	0.785	S	S	*	*			cis	-162.7	161.4	0.4	-128.5	-160.8	0	0	0	112.6
168	L	22.2	Very low	23.8	Very low	121 Å²	121	139.9 Å²	139.9	63%	0.634	78%	0.777	S	S	*	*			trans	47.9	165.9	139.8	-70.6	-176.5	0	0	0	125.9
169	M	21.4	Very low	23.4	Very low	128 Å²	128	142.7 Å²	142.7	63%	0.631	78%	0.776	S	S	*	*			trans	73.9	129.4	165.9	-58.9	-63.5	87.7	0	0	117.4
170	Q	23	Very low	23.4	Very low	148 Å²	148	138.2 Å²	138.2	69%	0.692	78%	0.776	S	S	*	*				75.2	97.3	52.5	-75.2	-170.9	-6.2	0	0	112.1
171	T	24.6	Very low	23.5	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	78%	0.779	S	S	*	*				87.2	119.8	86.8	51.3	0	0	0	0	113.7
172	D	23.4	Very low	23.7	Very low	180 Å²	180	140.4 Å²	140.4	96%	0.963	78%	0.782	S	S	*	*			trans	-162.2	170	146.7	-118.4	-27.6	0	0	0	110.3
173	G	23.8	Very low	24.1	Very low	72 Å²	72	142.1 Å²	142.1	74%	0.742	78%	0.784	S	S	*	*			trans	-176.7	167	177.4	0	0	0	0	0	115.8
174	A	27.3	Very low	24.3	Very low	109 Å²	109	144.1 Å²	144.1	90%	0.901	79%	0.791	S	S	*	*			trans	-151.5	164.5	176.5	0	0	0	0	0	113
175	S	24.3	Very low	24.5	Very low	106 Å²	106	150.1 Å²	150.1	74%	0.741	80%	0.8	S	S	*	*			trans	-85	161.7	-163	58.5	0	0	0	0	117.4
176	T	26.3	Very low	24.7	Very low	148 Å²	148	152.5 Å²	152.5	91%	0.908	81%	0.806	S	S	*	*				-167.1	165.7	125.2	14.2	0	0	0	0	112.3
177	N	24.5	Very low	24.8	Very low	158 Å²	158	158.7 Å²	158.7	85%	0.845	82%	0.817	S	S	*	*			trans	-85.5	142.2	-174	-92.4	-39.4	0	0	0	113.8
178	E	24.4	Very low	24.9	Very low	150 Å²	150	156 Å²	156	70%	0.701	82%	0.818	S	S	*	*				-176.5	164.6	104	-94	-131.3	88.4	0	0	115.1
179	K	25.7	Very low	25.2	Very low	187 Å²	187	159.2 Å²	159.2	81%	0.813	83%	0.83	S	S	*	*			trans	-42	134.8	-173.8	-57.2	150.3	-172.4	139.9	0	116.7
180	G	25.7	Very low	25.6	Very low	79 Å²	79	159.8 Å²	159.8	81%	0.814	84%	0.841	S	S	*	*			trans	-174.9	128.9	162.3	0	0	0	0	0	114.1
181	Q	25.4	Very low	25.7	Very low	187 Å²	187	159.1 Å²	159.1	87%	0.874	85%	0.847	S	S	*	*			trans	-81.1	126.6	175.8	-61.9	176.7	0.7	0	0	111
182	L	26	Very low	25.8	Very low	160 Å²	160	161.5 Å²	161.5	84%	0.838	85%	0.854	S	S	*	*				-170.5	148.8	121.2	-127.2	67.7	0	0	0	114.7	R184	L182-R184 PolarHBondContact O-N 3.48Å
183	K	28.2	Very low	26	Very low	211 Å²	211	161.1 Å²	161.1	92%	0.917	85%	0.846	S	S	*	*			trans	-65.4	113	178.3	-174.8	174.1	-175.6	171	0	111.9
184	R	25.9	Very low	26.2	Very low	248 Å²	248	165.1 Å²	165.1	94%	0.936	85%	0.845	S	S	*	*			trans	-104.2	158.5	165.5	-85.5	-170.4	171.1	-170.1	-1.5	111.9	L182	L182-R184 PolarHBondContact O-N 3.48Å
185	R	26	Very low	26.1	Very low	241 Å²	241	169 Å²	169	91%	0.909	84%	0.842	S	S	*	*			trans	-114	139.7	-163.3	-179.7	178.1	178.8	168.2	-1	109.7
186	N	25.5	Very low	26.1	Very low	159 Å²	159	169.8 Å²	169.8	85%	0.85	85%	0.846	S	S	*	*			trans	-63.1	156.3	176.8	-94.7	-3	0	0	0	112.4
187	R	24.2	Very low	26	Very low	250 Å²	250	168.4 Å²	168.4	94%	0.943	84%	0.841	S	S	*	*			trans	-58.9	149.8	169.7	-65.4	172.7	174	162.8	-4	110
188	S	25.9	Very low	26.2	Very low	109 Å²	109	167 Å²	167	76%	0.762	84%	0.841	S	S	*	*			trans	-124	116.2	173.3	54.2	0	0	0	0	109.4
189	E	27.5	Very low	26.2	Very low	189 Å²	189	164 Å²	164	88%	0.883	84%	0.841	S	S	*	*			trans	-73.4	153.3	172.3	-65.4	172.2	138.3	0	0	110.4	V191	E189-V191 PolarHBondContact O-N 2.89Å
190	T	29.2	Very low	26.3	Very low	140 Å²	140	161.1 Å²	161.1	86%	0.859	84%	0.842	S	S	*	*			trans	-93.7	84	-168.4	52.8	0	0	0	0	112.7
191	V	26.3	Very low	26.2	Very low	134 Å²	134	166.4 Å²	166.4	81%	0.812	85%	0.845	S	S	*	*			trans	-111.6	104.5	160.3	-178.6	0	0	0	0	108.2	E189	E189-V191 PolarHBondContact O-N 2.89Å
192	L	26.2	Very low	26.1	Very low	174 Å²	174	166.5 Å²	166.5	91%	0.911	85%	0.845	S	S	*	*			trans	-110.3	72.3	-176.2	-152.8	127.6	0	0	0	110.8
193	H	28.9	Very low	26.4	Very low	173 Å²	173	164.1 Å²	164.1	80%	0.801	84%	0.839	S	S	*	*			trans	-133.4	55.9	176	-161.1	-73.2	0	0	0	111.7
194	Q	26.2	Very low	26.1	Very low	156 Å²	156	163.3 Å²	163.3	73%	0.729	84%	0.839	S	S	*	*			trans	-143.5	150.5	174.7	-150.3	84.8	44.2	0	0	110.1
195	F	25.5	Very low	26.1	Very low	190 Å²	190	158 Å²	158	83%	0.833	83%	0.834	S	S	*	*			trans	69.2	80.6	172.8	-50.2	-71	0	0	0	117.9
196	C	24.7	Very low	26.1	Very low	123 Å²	123	153.6 Å²	153.6	83%	0.831	83%	0.829	S	S	*	*				-163.8	51.9	129.1	-126.3	0	0	0	0	115.1
197	C	24.1	Very low	26.1	Very low	118 Å²	118	152.8 Å²	152.8	80%	0.797	83%	0.83	S	S	*	*			trans	-128.5	124.2	167.7	-62	0	0	0	0	109.7
198	P	28.2	Very low	26.2	Very low	129 Å²	129	146.7 Å²	146.7	84%	0.838	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-78.9	133.5	160.2	32.3	-29.7	0	0	0	109.4
199	A	24.8	Very low	26.1	Very low	86 Å²	86	145.2 Å²	145.2	71%	0.711	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-83.2	155.2	167.7	0	0	0	0	0	109.9
200	P	28	Very low	26.1	Very low	128 Å²	128	142 Å²	142	83%	0.831	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.2	142.9	176.4	31.1	-34.5	0	0	0	111.2
201	E	23	Very low	26.1	Very low	189 Å²	189	141.1 Å²	141.1	88%	0.883	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-92	131.1	170.1	-69	-178.1	-179.5	0	0	110.1
202	H	23.8	Very low	26.2	Very low	190 Å²	190	146.2 Å²	146.2	88%	0.88	83%	0.83	S	S	*	*			trans	-122.1	146.6	153.7	-122.2	-108.5	0	0	0	107.2
203	P	31.7	Very low	26.1	Very low	109 Å²	109	148.8 Å²	148.8	71%	0.708	83%	0.828	S	S	*	*			trans	-87.8	150.5	-166.8	34.8	-35.2	0	0	0	112.4
204	E	23.7	Very low	25.9	Very low	194 Å²	194	150.3 Å²	150.3	91%	0.907	83%	0.832	S	S	*	*			trans	-154.9	167.8	141.8	-123.4	162.4	-133.3	0	0	111.8
205	T	23.9	Very low	25.7	Very low	136 Å²	136	148.7 Å²	148.7	83%	0.834	84%	0.837	S	S	*	*			trans	-99.8	157.8	-155.7	42.5	0	0	0	0	116.1
206	D	27	Very low	25.6	Very low	149 Å²	149	143.4 Å²	143.4	80%	0.797	83%	0.828	S	S	*	*			trans	-68.8	177.4	-179.9	-67.7	-75.8	0	0	0	116.9
207	T	24.7	Very low	25.5	Very low	142 Å²	142	146 Å²	146	87%	0.871	83%	0.828	S	S	*	*			trans	92.6	149	157.1	78.5	0	0	0	0	117.2
208	S	26.5	Very low	25.2	Very low	122 Å²	122	146 Å²	146	85%	0.853	83%	0.828	S	S	*	*			cis	-147.5	171.7	3.8	73.5	0	0	0	0	111
209	G	25	Very low	25.4	Very low	79 Å²	79	144.6 Å²	144.6	81%	0.814	82%	0.819	S	S	*	*			cis	140.2	62.1	-7.6	0	0	0	0	0	116
210	S	27.4	Very low	25.3	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	82%	0.824	S	S	*	*			trans	-117.8	109.8	-170.3	-173.4	0	0	0	0	117.4
211	S	27.9	Very low	25.2	Very low	122 Å²	122	150.5 Å²	150.5	85%	0.853	81%	0.813	S	S	*	*			trans	-169.5	150.5	139.3	-94.6	0	0	0	0	114.3
212	R	29.4	Very low	25.2	Very low	241 Å²	241	148.2 Å²	148.2	91%	0.909	80%	0.802	S	S	*	*			trans	-76.9	158.1	179.6	-60.7	167.7	170	168.4	-5.9	110.2
213	R	24.4	Very low	25.2	Very low	229 Å²	229	148.3 Å²	148.3	86%	0.864	80%	0.795	S	S	*	*			cis	-155.9	141.7	37	-59.7	167.8	176.8	178	-1.9	112.9
214	K	23.5	Very low	24.7	Very low	204 Å²	204	148.8 Å²	148.8	89%	0.887	79%	0.791	S	S	*	*			trans	59.9	138.2	147.1	-69.6	-175	178.1	-170.1	0	119.4
215	C	21.7	Very low	24.7	Very low	123 Å²	123	144.9 Å²	144.9	83%	0.831	79%	0.785	S	S	*	*			cis	-168.9	169.6	-14.1	-152.8	0	0	0	0	110.7
216	A	23.5	Very low	24.6	Very low	79 Å²	79	143.3 Å²	143.3	65%	0.653	78%	0.779	S	S	*	*			trans	91.4	121.5	161.8	0	0	0	0	0	119.7
217	Q	23.7	Very low	24.6	Very low	177 Å²	177	144.2 Å²	144.2	83%	0.827	78%	0.783	S	S	*	*			trans	50.1	114.1	149.3	-90.6	63.1	10.5	0	0	122.5
218	C	18.3	Very low	24.5	Very low	118 Å²	118	141.8 Å²	141.8	80%	0.797	78%	0.777	S	S	*	*			trans	-63.4	-174.6	149.6	-49.4	0	0	0	0	111.1
219	P	31.2	Very low	24.4	Very low	99 Å²	99	147 Å²	147	64%	0.643	78%	0.778	S	S	*	*			cis	-154.6	-176.6	20.4	47.3	-26.6	0	0	0	120
220	Y	23.7	Very low	24.4	Very low	207 Å²	207	147.4 Å²	147.4	81%	0.812	77%	0.768	S	S	*	*			trans	60.1	165	148.8	-68.3	-46.9	0	0	0	119.4
221	H	24.8	Very low	24.4	Very low	131 Å²	131	148.4 Å²	148.4	61%	0.606	76%	0.762	S	S	*	*			cis	-154.2	164.9	-9.6	-133.9	-72.5	0	0	0	111.1
222	H	23.9	Very low	24.3	Very low	142 Å²	142	148.9 Å²	148.9	66%	0.657	76%	0.755	S	S	*	*			trans	56.1	127.5	146.5	-88.9	-34.5	0	0	0	125.9
223	R	23.1	Very low	24.2	Very low	192 Å²	192	141.8 Å²	141.8	73%	0.725	74%	0.742	S	S	*	*				46.4	136.3	117	-87.8	-177	175.7	-99.3	6.4	123.1
224	D	22.4	Very low	24.3	Very low	119 Å²	119	137.3 Å²	137.3	64%	0.636	75%	0.746	S	S	*	*			trans	65.3	132.4	135.3	-52.9	-20.7	0	0	0	123.3
225	S	22	Very low	24.3	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	74%	0.737	S	S	*	*			trans	93	127.8	142.8	-147.3	0	0	0	0	122.4
226	C	22.7	Very low	24.4	Very low	104 Å²	104	133.6 Å²	133.6	70%	0.703	74%	0.742	S	S	*	*			trans	35.4	126.6	140.1	-63.5	0	0	0	0	125.2
227	L	26.6	Very low	24.4	Very low	167 Å²	167	133.5 Å²	133.5	87%	0.874	74%	0.742	S	S	*	*			trans	63.9	151.3	137.5	-93.6	92.8	0	0	0	123
228	A	23.4	Very low	24.4	Very low	91 Å²	91	133.2 Å²	133.2	75%	0.752	75%	0.745	S	S	*	*			trans	67.9	138.2	167.3	0	0	0	0	0	116.7
229	R	24.7	Very low	24.7	Very low	231 Å²	231	136.8 Å²	136.8	87%	0.872	75%	0.747	S	S	*	*			cis	80.2	122.4	33.2	-160	173.1	-168.4	179.6	4.6	110.7
230	C	25.2	Very low	24.9	Very low	89 Å²	89	137.1 Å²	137.1	60%	0.601	75%	0.749	S	S	*	*			cis	-166	-178.8	22.3	-138.1	0	0	0	0	112.6
231	I	26.5	Very low	24.9	Very low	140 Å²	140	131.9 Å²	131.9	72%	0.718	74%	0.743	S	S	*	*			trans	71.1	148.8	144.7	-76.9	163.6	0	0	0	117
232	N	26	Very low	25	Very low	132 Å²	132	132 Å²	132	71%	0.706	75%	0.748	S	S	*	*			cis	-169.9	-176.4	-15.4	-102.9	2.1	0	0	0	108.2
233	S	27	Very low	25	Very low	93 Å²	93	135.1 Å²	135.1	65%	0.65	76%	0.755	S	S	*	*			cis	-179	138.2	-44.3	64.4	0	0	0	0	109.8
234	S	26.2	Very low	25	Very low	135 Å²	135	132.4 Å²	132.4	94%	0.944	75%	0.754	S	S	*	*			trans	-162.4	152.1	171.5	-76.2	0	0	0	0	111.5
235	G	23.6	Very low	25	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	76%	0.758	S	S	*	*			cis	164.1	131.7	-11.1	0	0	0	0	0	114.2
236	L	23.8	Very low	25	Very low	181 Å²	181	135.9 Å²	135.9	95%	0.948	76%	0.759	S	S	*	*			trans	75.6	154.9	165.2	-51.7	173.7	0	0	0	119.4
237	A	23	Very low	25.1	Very low	78 Å²	78	135.5 Å²	135.5	65%	0.645	76%	0.764	S	S	*	*			cis	-172.9	149.4	-33.9	0	0	0	0	0	111
238	L	24.8	Very low	24.9	Very low	171 Å²	171	135.8 Å²	135.8	90%	0.895	76%	0.761	S	S	*	*				165.2	160.2	129.7	-88	167	0	0	0	113.8
239	K	23.7	Very low	25.1	Very low	193 Å²	193	141.3 Å²	141.3	84%	0.839	77%	0.768	S	S	*	*			trans	-160.1	-177.6	-171.6	-102.1	-178.4	-177.9	179.9	0	107
240	P	35.7	Very low	25	Very low	106 Å²	106	141.2 Å²	141.2	69%	0.688	77%	0.769	S	S	*	*			cis	-150.5	-179.4	24.1	44.8	-23.9	0	0	0	119.3
241	S	24.1	Very low	24.9	Very low	97 Å²	97	144.2 Å²	144.2	68%	0.678	77%	0.774	S	S	*	*			trans	63.7	156.3	136.7	-77.6	0	0	0	0	122.9
242	N	25.9	Very low	24.9	Very low	132 Å²	132	145.9 Å²	145.9	71%	0.706	78%	0.776	S	S	*	*			cis	-152.2	160	3	-119.8	-5.7	0	0	0	113.5
243	Y	24.6	Very low	25.2	Very low	208 Å²	208	144.4 Å²	144.4	82%	0.816	77%	0.774	S	S	*	*			trans	144.7	89.6	156.7	-88.2	-70.3	0	0	0	108.3
244	I	23.3	Very low	25	Very low	136 Å²	136	146.7 Å²	146.7	70%	0.697	77%	0.773	S	S	*	*				75	119	87.6	-72.1	174.8	0	0	0	111.6
245	V	23	Very low	24.9	Very low	120 Å²	120	146.6 Å²	146.6	73%	0.727	76%	0.757	S	S	*	*			cis	-157.9	162	-0.7	97	0	0	0	0	113.2
246	K	22.3	Very low	24.9	Very low	182 Å²	182	150.4 Å²	150.4	79%	0.791	76%	0.757	S	S	*	*			trans	60.8	122.6	168.8	-79.8	179.8	174.7	-169.3	0	118.7
247	A	23.6	Very low	25.1	Very low	97 Å²	97	147.2 Å²	147.2	80%	0.802	74%	0.741	S	S	*	*			trans	-98.8	163.7	153.2	0	0	0	0	0	108.9
248	E	23.3	Very low	25.1	Very low	173 Å²	173	150.5 Å²	150.5	81%	0.808	75%	0.747	S	S	*	*			trans	-142.5	133.5	160.4	-128.5	157.8	-121.2	0	0	108.9
249	F	26.8	Very low	25.1	Very low	206 Å²	206	147.8 Å²	147.8	90%	0.904	74%	0.741	S	S	*	*			trans	-128.1	87	178.8	-155.9	-64.8	0	0	0	106.3
250	Y	21.8	Very low	25.1	Very low	229 Å²	229	145.2 Å²	145.2	90%	0.898	75%	0.746	S	S	*	*			trans	-139.9	162.4	171.8	-105.6	-76.3	0	0	0	111.9
251	H	24.9	Very low	24.6	Very low	152 Å²	152	143.6 Å²	143.6	70%	0.704	75%	0.748	S	S	*	*			trans	-112.4	145.6	-164.9	-165.9	-119.8	0	0	0	109
252	F	26	Very low	24.6	Very low	175 Å²	175	148.2 Å²	148.2	77%	0.768	76%	0.759	S	S	*	*			trans	70	175.6	165.9	-93.8	-126.1	0	0	0	113.9
253	P	31.7	Very low	24.6	Very low	102 Å²	102	149.2 Å²	149.2	66%	0.662	76%	0.763	S	S	*	*			cis	-142.5	179.3	25.2	45	-26.1	0	0	0	119.4
254	F	22.4	Very low	24.5	Very low	141 Å²	141	146.2 Å²	146.2	62%	0.618	76%	0.76	S	S	*	*			trans	75.3	139.2	149.3	-82.5	-156.8	0	0	0	118.7	Q256	F254-Q256 HydrophobicContact CD1-CG 4.19Å; F254-Q256 HydrophobicContact CE1-CG 4.39Å
255	E	23.7	Very low	24.5	Very low	132 Å²	132	144.4 Å²	144.4	62%	0.617	76%	0.759	S	S	*	*			cis	74.4	150.9	41.5	-64.6	-160.1	-171.6	0	0	112.5	N257	E255-N257 PolarHBondContact OE1-ND2 3.12Å; E255-N257 PolarHBondContact OE2-ND2 3.42Å
256	Q	25.4	Very low	24.4	Very low	147 Å²	147	145.6 Å²	145.6	69%	0.687	76%	0.761	S	S	*	*			cis	-126.6	150.3	28.9	-61	161.4	-25.9	0	0	113.3	F254	F254-Q256 HydrophobicContact CD1-CG 4.19Å; F254-Q256 HydrophobicContact CE1-CG 4.39Å
257	N	26.3	Very low	24.5	Very low	114 Å²	114	144.6 Å²	144.6	61%	0.61	76%	0.759	S	S	*	*			cis	65.4	137.7	46.1	-92.3	-15	0	0	0	114.6	E255	E255-N257 PolarHBondContact OE1-ND2 3.12Å; E255-N257 PolarHBondContact OE2-ND2 3.42Å
258	L	23.3	Very low	24.4	Very low	148 Å²	148	147.3 Å²	147.3	78%	0.775	76%	0.76	S	S	*	*			trans	-176.7	124.8	150.4	-124.2	74.9	0	0	0	108.9
259	C	26.3	Very low	24.4	Very low	113 Å²	113	142.8 Å²	142.8	76%	0.764	76%	0.76	S	S	*	*			cis	-164	141.6	-17.5	-128.2	0	0	0	0	110.4
260	C	23.1	Very low	24.3	Very low	140 Å²	140	139.7 Å²	139.7	95%	0.946	76%	0.758	S	S	*	*				177.9	142.6	127.4	-128.7	0	0	0	0	107
261	G	24.5	Very low	24.4	Very low	71 Å²	71	134.9 Å²	134.9	73%	0.732	76%	0.758	S	S	*	*			cis	168.6	103.8	-1.2	0	0	0	0	0	106.4
262	Q	24.6	Very low	24.4	Very low	194 Å²	194	133.6 Å²	133.6	91%	0.907	77%	0.766	S	S	*	*			trans	-105.3	129.1	-166.8	-170.8	-179.7	19.5	0	0	111
263	I	25	Very low	24.4	Very low	153 Å²	153	128.9 Å²	128.9	79%	0.785	77%	0.767	S	S	*	*			trans	-128.9	114.6	167.2	-64.6	-176.6	0	0	0	108.7
264	L	23	Very low	24.1	Very low	145 Å²	145	128.1 Å²	128.1	76%	0.759	78%	0.778	S	S	*	*			trans	28.4	114.8	142.6	-51.8	175.9	0	0	0	117.5
265	S	22.6	Very low	24.2	Very low	98 Å²	98	124.9 Å²	124.9	69%	0.685	78%	0.784	S	S	*	*				82.2	153.1	66	-66.7	0	0	0	0	113.7
266	L	22.5	Very low	24.4	Very low	145 Å²	145	127.1 Å²	127.1	76%	0.759	80%	0.795	S	S	*	*			trans	72.5	147.4	174.5	-88.1	70.7	0	0	0	115.6
267	E	23	Very low	24.4	Very low	161 Å²	161	128.1 Å²	128.1	75%	0.752	80%	0.799	S	S	*	*			cis	-154.6	-164.2	-13.9	-146.5	155.7	-135.2	0	0	111
268	D	22.8	Very low	24.5	Very low	155 Å²	155	127.1 Å²	127.1	83%	0.829	80%	0.797	S	S	*	*			trans	-61.9	157.9	-176	-70.3	-68	0	0	0	116
269	G	22.7	Very low	24.7	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	80%	0.802	S	S	*	*			trans	-126.8	65.4	-177.3	0	0	0	0	0	115.4
270	T	24.5	Very low	24.7	Very low	140 Å²	140	127.9 Å²	127.9	86%	0.859	80%	0.803	S	S	*	*			trans	-145.3	102.8	164	53.4	0	0	0	0	113.7
271	S	24.6	Very low	24.9	Very low	129 Å²	129	128.8 Å²	128.8	90%	0.902	80%	0.797	S	S	*	*			trans	-161.9	155.1	144.1	-165	0	0	0	0	110.9
272	S	25.1	Very low	24.9	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	80%	0.797	S	S	*	*			trans	-118.9	142.2	176.7	177.5	0	0	0	0	110
273	G	25.5	Very low	24.9	Very low	76 Å²	76	134.6 Å²	134.6	78%	0.784	79%	0.793	S	S	*	*			trans	157.8	112	176.7	0	0	0	0	0	110.8
274	G	25.8	Very low	25.3	Very low	87 Å²	87	137 Å²	137	90%	0.897	80%	0.801	S	S	*	*			trans	-107.1	-174.6	-173.2	0	0	0	0	0	114.5
275	G	24.6	Very low	25.5	Very low	73 Å²	73	133.4 Å²	133.4	75%	0.753	80%	0.799	S	S	*	*			trans	123.9	123.4	161.2	0	0	0	0	0	115.7
276	Q	27.3	Very low	26.1	Very low	179 Å²	179	135.1 Å²	135.1	84%	0.836	81%	0.808	S	S	*	*			trans	68	123.9	162.6	-69.1	173.5	-23.5	0	0	116.8
277	E	25.2	Very low	26.6	Very low	167 Å²	167	133.1 Å²	133.1	78%	0.78	81%	0.806	S	S	*	*				74.6	134	69.4	-92.7	-161.1	113.3	0	0	113
278	V	29.4	Very low	26.9	Very low	94 Å²	94	135 Å²	135	57%	0.57	82%	0.815	S	S	*	*			cis	-150.8	142.3	19.7	-173.8	0	0	0	0	112.9
279	K	27.2	Very low	27.5	Very low	202 Å²	202	137.4 Å²	137.4	88%	0.878	81%	0.814	S	S	*	*			trans	43.4	132.1	155.5	-63.6	160.4	-161.7	160.1	0	122.7
280	G	25.6	Very low	28.4	Very low	75 Å²	75	142 Å²	142	77%	0.773	82%	0.815	S	S	*	*			trans	-175.3	105.3	154.7	0	0	0	0	0	114.3
281	L	27.5	Very low	29.3	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	80%	0.797	S	S	*	*			trans	-60.4	151.4	-179.3	-69.2	72.7	0	0	0	111.6
282	K	24.2	Very low	30.7	Very low	167 Å²	167	138.4 Å²	138.4	73%	0.726	78%	0.779	S	S	*	*				-178.9	146.3	56.1	-140.9	161.2	-171.6	174.7	0	113
283	R	25.1	Very low	32.1	Very low	221 Å²	221	138 Å²	138	83%	0.834	77%	0.767	S	S	*	*			trans	55.7	106	150.5	-76.4	176.1	178.6	176.7	-3	122.3
284	E	33.2	Very low	33.5	Very low	203 Å²	203	141 Å²	141	95%	0.949	76%	0.76	S	S	*	*			trans	20	130.4	134.6	-61.3	178.5	175	0	0	122.6
285	G	26.4	Very low	35.3	Very low	70 Å²	70	141 Å²	141	72%	0.722	74%	0.74	S	S	*	*			trans	-160.6	135.4	152.5	0	0	0	0	0	109
286	P	35.7	Very low	37.2	Very low	133 Å²	133	142.5 Å²	142.5	86%	0.864	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-88.5	161.4	-165.4	34.1	-36.2	0	0	0	115.2
287	S	33	Very low	39.2	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-69.6	141.2	179.9	52.9	0	0	0	0	114.2
288	E	28.8	Very low	41.6	Very low	201 Å²	201	136.3 Å²	136.3	94%	0.939	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-70.6	137.8	175.3	-164.2	164.8	-153	0	0	111.8
289	Y	36.8	Very low	43.4	Very low	204 Å²	204	137.4 Å²	137.4	80%	0.8	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-96.1	150.1	-163.1	-121.8	-103.4	0	0	0	113.5	I291	Y289-I291 PolarHBondContact O-N 3.14Å
290	E	41.7	Very low	45.5	Very low	175 Å²	175	131.8 Å²	131.8	82%	0.818	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-60.2	130.3	165	-69.4	-169.8	113.4	0	0	110.9	N292	E290-N292 VanDerWaalsContact C-N 3.28Å; E290-N292 PolarHBondContact O-N 3.23Å
291	I	43.6	Very low	47.8	Very low	95 Å²	95	133.8 Å²	133.8	49%	0.487	66%	0.664	S	S	.	*			trans	-78.6	83.8	176.7	-53.9	-177.8	0	0	0	109.6	Y289 N295 K296	Y289-I291 PolarHBondContact O-N 3.14Å; I291-N295 HydrophobicContact CG2-CB 3.86Å; I291-K296 HydrophobicContact CG2-CG 3.98Å; I291-K296 PolarHBondContact O-NZ 3.29Å
292	N	53.8	Low	50.2	Low	99 Å²	99	130.9 Å²	130.9	53%	0.529	65%	0.646	S	S	.	*			trans	-45.8	146.7	167.9	-172.9	-1.7	0	0	0	110.9	E290 E294 N295	E290-N292 VanDerWaalsContact C-N 3.28Å; E290-N292 PolarHBondContact O-N 3.23Å; N292-E294 PolarHBondContact O-N 2.92Å; N292-E294 VanDerWaalsContact O-N 3.11Å; N292-N295 PolarHBondContact O-N 2.75Å
293	L	53.2	Low	52.2	Low	116 Å²	116	127.4 Å²	127.4	61%	0.607	64%	0.635	S	S	*	*	H	α-helix	trans	-52.5	-34.4	-178.7	-179	59.9	0	0	0	112.4	N295 K296 N297	L293-N295 PolarHBondContact O-N 3.47Å; L293-K296 WeakPolarHBondContact O-CB 3.43Å; L293-K296 PolarHBondContact O-N 2.88Å; L293-K296 VanDerWaalsContact O-N 3.1Å; L293-N297 PolarHBondContact O-N 3.17Å
294	E	55.9	Low	54.9	Low	139 Å²	139	118.6 Å²	118.6	65%	0.65	60%	0.603	S	S	*	*	H	α-helix	trans	-62.4	-37.8	178.1	-163	156.8	-152.4	0	0	113.2	N292 K296 N297 K298	N292-E294 PolarHBondContact O-N 2.92Å; N292-E294 VanDerWaalsContact O-N 3.11Å; E294-K296 VanDerWaalsContact C-N 3.33Å; E294-K296 PolarHBondContact O-N 3.5Å; E294-N297 PolarHBondContact O-N 3.48Å; E294-K298 WeakPolarHBondContact O-CB 3.3Å; E294-K298 PolarHBondContact O-N 2.9Å
295	N	63.7	Low	57	Low	87 Å²	87	115.8 Å²	115.8	47%	0.465	59%	0.59	S	S	.	*	H	α-helix	trans	-68.6	-30.5	173.1	-84.1	-19.7	0	0	0	112.4	I291 N292 L293 K298 Q299	I291-N295 HydrophobicContact CG2-CB 3.86Å; N292-N295 PolarHBondContact O-N 2.75Å; L293-N295 PolarHBondContact O-N 3.47Å; N295-K298 PolarHBondContact O-N 3.33Å; N295-Q299 WeakPolarHBondContact O-CG 3.18Å; N295-Q299 PolarHBondContact O-N 3.26Å
296	K	63.6	Low	59.3	Low	104 Å²	104	119.6 Å²	119.6	45%	0.452	59%	0.587	S	S	.	*	H	α-helix	trans	-70.9	-40.5	173.6	-71.1	166.5	-178.7	148.9	0	111.2	I291 L293 E294 K298 Q299 I300	I291-K296 HydrophobicContact CG2-CG 3.98Å; I291-K296 PolarHBondContact O-NZ 3.29Å; L293-K296 WeakPolarHBondContact O-CB 3.43Å; L293-K296 PolarHBondContact O-N 2.88Å; L293-K296 VanDerWaalsContact O-N 3.1Å; E294-K296 VanDerWaalsContact C-N 3.33Å; E294-K296 PolarHBondContact O-N 3.5Å; K296-K298 VanDerWaalsContact C-N 3.32Å; K296-K298 PolarHBondContact O-N 2.76Å; K296-Q299 PolarHBondContact O-N 3.03Å; K296-I300 WeakPolarHBondContact O-CG1 3.42Å; K296-I300 PolarHBondContact O-N 3.21Å
297	N	70.4	Confident	60.7	Low	87 Å²	87	120.5 Å²	120.5	47%	0.465	57%	0.574	S	S	.	*	H	α-helix	trans	-62	-41.9	172.7	-66.6	-12.9	0	0	0	111	L293 E294 I300 E301	L293-N297 PolarHBondContact O-N 3.17Å; E294-N297 PolarHBondContact O-N 3.48Å; N297-I300 WeakPolarHBondContact O-CB 3.32Å; N297-I300 PolarHBondContact O-N 3.19Å; N297-I300 VanDerWaalsContact O-N 3.16Å; N297-E301 PolarHBondContact O-N 3.08Å
298	K	74.9	Confident	62.9	Low	129 Å²	129	118.1 Å²	118.1	56%	0.561	57%	0.566	S	S	*	*	H	α-helix	trans	-65.4	-37.6	176.6	-145	168.5	-168.7	170.8	0	113.2	E294 N295 K296 E301 E302	E294-K298 WeakPolarHBondContact O-CB 3.3Å; E294-K298 PolarHBondContact O-N 2.9Å; N295-K298 PolarHBondContact O-N 3.33Å; K296-K298 VanDerWaalsContact C-N 3.32Å; K296-K298 PolarHBondContact O-N 2.76Å; K298-E301 PolarHBondContact O-N 3.01Å; K298-E302 WeakPolarHBondContact O-CB 3.35Å; K298-E302 PolarHBondContact O-N 3.07Å
299	Q	67.1	Low	65.2	Low	116 Å²	116	110 Å²	110	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-65.6	-35.9	170.9	-79.1	-175.8	-18.6	0	0	112.9	N295 K296 L303	N295-Q299 WeakPolarHBondContact O-CG 3.18Å; N295-Q299 PolarHBondContact O-N 3.26Å; K296-Q299 PolarHBondContact O-N 3.03Å; Q299-L303 WeakPolarHBondContact O-CB 3.21Å; Q299-L303 WeakPolarHBondContact O-CG 3.24Å; Q299-L303 PolarHBondContact O-N 2.7Å
300	I	71.6	Confident	66.9	Low	85 Å²	85	104 Å²	104	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-46.7	172.6	-69.4	163	0	0	0	109.7	K296 N297 E302 L303 E304	K296-I300 WeakPolarHBondContact O-CG1 3.42Å; K296-I300 PolarHBondContact O-N 3.21Å; N297-I300 WeakPolarHBondContact O-CB 3.32Å; N297-I300 PolarHBondContact O-N 3.19Å; N297-I300 VanDerWaalsContact O-N 3.16Å; I300-E302 PolarHBondContact O-N 3.17Å; I300-L303 WeakPolarHBondContact O-CB 3.46Å; I300-L303 PolarHBondContact O-N 2.87Å; I300-E304 HydrophobicContact CG2-CG 4.24Å; I300-E304 WeakPolarHBondContact O-CB 3.44Å; I300-E304 VanDerWaalsContact O-CG 3.23Å; I300-E304 WeakPolarHBondContact O-CG 3.5Å; I300-E304 PolarHBondContact O-N 3.15Å
301	E	74.8	Confident	68.3	Low	117 Å²	117	102.7 Å²	102.7	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-41.1	178.9	-169	170.2	-139.7	0	0	112.6	N297 K298 E304 Q305	N297-E301 PolarHBondContact O-N 3.08Å; K298-E301 PolarHBondContact O-N 3.01Å; E301-E304 PolarHBondContact O-N 3.22Å; E301-Q305 WeakPolarHBondContact O-CG 3.4Å; E301-Q305 PolarHBondContact O-N 3.07Å
302	E	76.5	Confident	69.7	Low	96 Å²	96	103.1 Å²	103.1	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-41.5	171.4	-86.6	-165.9	-137.9	0	0	113.1	K298 I300 E304 K306	K298-E302 WeakPolarHBondContact O-CB 3.35Å; K298-E302 PolarHBondContact O-N 3.07Å; I300-E302 PolarHBondContact O-N 3.17Å; E302-E304 VanDerWaalsContact C-N 3.34Å; E302-K306 WeakPolarHBondContact O-CB 3.41Å; E302-K306 WeakPolarHBondContact O-CD 3.32Å; E302-K306 VanDerWaalsContact O-CG 3.23Å; E302-K306 WeakPolarHBondContact O-CG 3.42Å; E302-K306 PolarHBondContact O-N 3.28Å; E302-K306 IonicContact OE2-NZ 2.74Å; E302-K306 PolarHBondContact OE2-NZ 3.11Å
303	L	67.5	Low	70.9	Confident	94 Å²	94	99.1 Å²	99.1	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-42.3	174.5	-82.5	165.3	0	0	0	110.5	Q299 I300 K306 Y307	Q299-L303 WeakPolarHBondContact O-CB 3.21Å; Q299-L303 WeakPolarHBondContact O-CG 3.24Å; Q299-L303 PolarHBondContact O-N 2.7Å; I300-L303 WeakPolarHBondContact O-CB 3.46Å; I300-L303 PolarHBondContact O-N 2.87Å; L303-K306 PolarHBondContact O-N 3.05Å; L303-Y307 HydrophobicContact CD2-CD2 4.32Å; L303-Y307 HydrophobicContact CD2-CE2 4.01Å; L303-Y307 WeakPolarHBondContact O-CB 3.11Å; L303-Y307 WeakPolarHBondContact O-CD2 3.3Å; L303-Y307 PolarHBondContact O-N 3.03Å
304	E	81.1	Confident	71.9	Confident	36 Å²	36	99.9 Å²	99.9	17%	0.168	49%	0.49	C	S	.	.	H	α-helix	trans	-64.3	-41	178.6	-72.9	-179.5	164.1	0	0	111.3	I300 E301 E302 G308 G309 H310 A313	I300-E304 HydrophobicContact CG2-CG 4.24Å; I300-E304 WeakPolarHBondContact O-CB 3.44Å; I300-E304 VanDerWaalsContact O-CG 3.23Å; I300-E304 WeakPolarHBondContact O-CG 3.5Å; I300-E304 PolarHBondContact O-N 3.15Å; E301-E304 PolarHBondContact O-N 3.22Å; E302-E304 VanDerWaalsContact C-N 3.34Å; E304-G308 PolarHBondContact O-N 3.48Å; E304-G309 CarbonylContact O-C 3.58Å; E304-G309 VanDerWaalsContact O-C 3.32Å; E304-G309 WeakPolarHBondContact O-CA 3.17Å; E304-G309 PolarHBondContact O-N 2.89Å; E304-H310 IonicContact OE1-CE1 3.56Å; E304-H310 PolarHBondContact OE1-CE1 3.03Å; E304-H310 IonicContact OE1-ND1 3.68Å; E304-H310 PolarHBondContact OE1-ND1 3.05Å; E304-H310 IonicContact OE2-CE1 3.15Å; E304-H310 IonicContact OE2-CG 2.72Å; E304-H310 IonicContact OE2-ND1 3.48Å; E304-H310 PolarHBondContact OE2-ND1 3.38Å; E304-A313 HydrophobicContact CB-CB 4.2Å; E304-A313 HydrophobicContact CG-CB 3.76Å
305	Q	76.1	Confident	72.5	Confident	144 Å²	144	102.5 Å²	102.5	67%	0.673	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-49.8	169.4	-72.6	-175.4	3.7	0	0	112.2	E301 Y307 G308	E301-Q305 WeakPolarHBondContact O-CG 3.4Å; E301-Q305 PolarHBondContact O-N 3.07Å; Q305-Y307 PolarHBondContact O-N 3.3Å; Q305-G308 PolarHBondContact O-N 3.31Å; Q305-G308 VanDerWaalsContact O-N 3.09Å
306	K	75.5	Confident	72.9	Confident	151 Å²	151	100.2 Å²	100.2	66%	0.657	49%	0.487	S	S	*	.	H	α-helix	trans	-63	-26.2	-178.4	-73.7	163.9	-171.4	160.3	0	113.7	E302 L303	E302-K306 WeakPolarHBondContact O-CB 3.41Å; E302-K306 WeakPolarHBondContact O-CD 3.32Å; E302-K306 VanDerWaalsContact O-CG 3.23Å; E302-K306 WeakPolarHBondContact O-CG 3.42Å; E302-K306 PolarHBondContact O-N 3.28Å; E302-K306 IonicContact OE2-NZ 2.74Å; E302-K306 PolarHBondContact OE2-NZ 3.11Å; L303-K306 PolarHBondContact O-N 3.05Å
307	Y	64.8	Low	73.5	Confident	152 Å²	152	97.2 Å²	97.2	60%	0.596	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	18.5	176.1	-80.3	-80.6	0	0	0	114.2	L303 Q305 I312	L303-Y307 HydrophobicContact CD2-CD2 4.32Å; L303-Y307 HydrophobicContact CD2-CE2 4.01Å; L303-Y307 WeakPolarHBondContact O-CB 3.11Å; L303-Y307 WeakPolarHBondContact O-CD2 3.3Å; L303-Y307 PolarHBondContact O-N 3.03Å; Q305-Y307 PolarHBondContact O-N 3.3Å; Y307-I312 WeakPolarHBondContact O-CB 3.3Å; Y307-I312 VanDerWaalsContact O-CG2 3.25Å; Y307-I312 WeakPolarHBondContact O-CG2 3.22Å
308	G	79.8	Confident	73.2	Confident	53 Å²	53	99.5 Å²	99.5	55%	0.546	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	26.4	171.9	0	0	0	0	0	115	E304 Q305 I312	E304-G308 PolarHBondContact O-N 3.48Å; Q305-G308 PolarHBondContact O-N 3.31Å; Q305-G308 VanDerWaalsContact O-N 3.09Å; G308-I312 WeakPolarHBondContact O-CD1 3.33Å
309	G	77.4	Confident	73	Confident	30 Å²	30	102.8 Å²	102.8	31%	0.309	49%	0.493	S	S	.	.	S	Bend	trans	100.1	156.3	178.9	0	0	0	0	0	113.8	E304 L311 I312 A313	E304-G309 CarbonylContact O-C 3.58Å; E304-G309 VanDerWaalsContact O-C 3.32Å; E304-G309 WeakPolarHBondContact O-CA 3.17Å; E304-G309 PolarHBondContact O-N 2.89Å; G309-L311 VanDerWaalsContact C-N 3.26Å; G309-L311 PolarHBondContact O-N 3.18Å; G309-L311 VanDerWaalsContact O-N 3.09Å; G309-I312 PolarHBondContact O-N 3.31Å; G309-A313 PolarHBondContact O-N 3.29Å; G309-A313 VanDerWaalsContact O-N 3.11Å
310	H	71.6	Confident	73.6	Confident	80 Å²	80	102.9 Å²	102.9	37%	0.37	50%	0.496	S	S	.	.	H	α-helix	trans	-41.5	-48.7	-178.3	-177.4	82.1	0	0	0	113.7	E304 I312 R314	E304-H310 IonicContact OE1-CE1 3.56Å; E304-H310 PolarHBondContact OE1-CE1 3.03Å; E304-H310 IonicContact OE1-ND1 3.68Å; E304-H310 PolarHBondContact OE1-ND1 3.05Å; E304-H310 IonicContact OE2-CE1 3.15Å; E304-H310 IonicContact OE2-CG 2.72Å; E304-H310 IonicContact OE2-ND1 3.48Å; E304-H310 PolarHBondContact OE2-ND1 3.38Å; H310-I312 PolarHBondContact O-N 3.42Å; H310-R314 PolarHBondContact CE1-NH1 3.26Å; H310-R314 WeakPolarHBondContact NE2-CD 3.15Å; H310-R314 PolarHBondContact NE2-NH1 3.22Å; H310-R314 WeakPolarHBondContact O-CB 3.43Å; H310-R314 PolarHBondContact O-N 3.46Å
311	L	70.9	Confident	73.4	Confident	147 Å²	147	105 Å²	105	77%	0.77	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-42.1	-178.5	-78.1	163.5	0	0	0	113.2	G309 R315	G309-L311 VanDerWaalsContact C-N 3.26Å; G309-L311 PolarHBondContact O-N 3.18Å; G309-L311 VanDerWaalsContact O-N 3.09Å; L311-R315 WeakPolarHBondContact O-CB 3.4Å; L311-R315 PolarHBondContact O-N 3.21Å
312	I	73.1	Confident	73	Confident	104 Å²	104	103 Å²	103	53%	0.533	50%	0.5	S	S	.	.	H	α-helix	trans	-72.8	-48.2	-178	-58.1	-172.3	0	0	0	109.9	Y307 G308 G309 H310 R314 R315 A316	Y307-I312 WeakPolarHBondContact O-CB 3.3Å; Y307-I312 VanDerWaalsContact O-CG2 3.25Å; Y307-I312 WeakPolarHBondContact O-CG2 3.22Å; G308-I312 WeakPolarHBondContact O-CD1 3.33Å; G309-I312 PolarHBondContact O-N 3.31Å; H310-I312 PolarHBondContact O-N 3.42Å; I312-R314 PolarHBondContact O-N 2.96Å; I312-R315 PolarHBondContact O-N 3.22Å; I312-A316 WeakPolarHBondContact O-CB 3.44Å; I312-A316 PolarHBondContact O-N 3.44Å
313	A	80.1	Confident	72.7	Confident	14 Å²	14	101 Å²	101	12%	0.116	50%	0.5	C	S	.	.	H	α-helix	trans	-57.4	-46.5	176.6	0	0	0	0	0	112.4	E304 G309 R315 A316 A317	E304-A313 HydrophobicContact CB-CB 4.2Å; E304-A313 HydrophobicContact CG-CB 3.76Å; G309-A313 PolarHBondContact O-N 3.29Å; G309-A313 VanDerWaalsContact O-N 3.11Å; A313-R315 PolarHBondContact O-N 3.4Å; A313-A316 PolarHBondContact O-N 3.25Å; A313-A317 WeakPolarHBondContact O-CB 3.45Å; A313-A317 PolarHBondContact O-N 2.86Å
314	R	74.4	Confident	73.1	Confident	132 Å²	132	102.5 Å²	102.5	50%	0.498	50%	0.502	S	S	.	.	H	α-helix	trans	-69.7	-32.4	179.3	-156.7	172.1	-148.8	-174.7	3.3	112.5	H310 I312 R318	H310-R314 PolarHBondContact CE1-NH1 3.26Å; H310-R314 WeakPolarHBondContact NE2-CD 3.15Å; H310-R314 PolarHBondContact NE2-NH1 3.22Å; H310-R314 WeakPolarHBondContact O-CB 3.43Å; H310-R314 PolarHBondContact O-N 3.46Å; I312-R314 PolarHBondContact O-N 2.96Å; R314-R318 WeakPolarHBondContact O-CG 3.38Å; R314-R318 PolarHBondContact O-N 3.36Å
315	R	68	Low	72.7	Confident	195 Å²	195	109.9 Å²	109.9	74%	0.736	53%	0.529	S	S	*	.	H	α-helix	trans	-69.4	-41.3	172.4	-163.2	176.1	-153.1	164.4	5.7	111.4	L311 I312 A313 R319	L311-R315 WeakPolarHBondContact O-CB 3.4Å; L311-R315 PolarHBondContact O-N 3.21Å; I312-R315 PolarHBondContact O-N 3.22Å; A313-R315 PolarHBondContact O-N 3.4Å; R315-R319 WeakPolarHBondContact O-CB 3.45Å; R315-R319 PolarHBondContact O-N 3.47Å
316	A	72.8	Confident	72.1	Confident	38 Å²	38	108.7 Å²	108.7	31%	0.314	52%	0.523	S	S	.	.	H	α-helix	trans	-62.8	-47.5	172.7	0	0	0	0	0	111.4	I312 A313 R318 R319 I320	I312-A316 WeakPolarHBondContact O-CB 3.44Å; I312-A316 PolarHBondContact O-N 3.44Å; A313-A316 PolarHBondContact O-N 3.25Å; A316-R318 PolarHBondContact O-N 2.91Å; A316-R319 PolarHBondContact O-N 3.13Å; A316-R319 VanDerWaalsContact O-N 3.09Å; A316-I320 WeakPolarHBondContact O-CG1 3.23Å; A316-I320 PolarHBondContact O-N 3.27Å
317	A	74.4	Confident	72.3	Confident	41 Å²	41	107.7 Å²	107.7	34%	0.339	52%	0.516	S	S	.	.	H	α-helix	trans	-57.5	-47.5	176.5	0	0	0	0	0	112.3	A313 R319 I320 Q321	A313-A317 WeakPolarHBondContact O-CB 3.45Å; A313-A317 PolarHBondContact O-N 2.86Å; A317-R319 VanDerWaalsContact C-N 3.33Å; A317-R319 PolarHBondContact O-N 3.49Å; A317-I320 PolarHBondContact O-N 3.33Å; A317-Q321 WeakPolarHBondContact O-CB 3.38Å; A317-Q321 VanDerWaalsContact O-CG 3.22Å; A317-Q321 WeakPolarHBondContact O-CG 3.42Å; A317-Q321 PolarHBondContact O-N 3.3Å
318	R	64.6	Low	72.8	Confident	136 Å²	136	104.3 Å²	104.3	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-59.9	-40.2	173.8	-75.5	-173.5	-176.1	-162.6	4	112.4	R314 A316 Q321 T322	R314-R318 WeakPolarHBondContact O-CG 3.38Å; R314-R318 PolarHBondContact O-N 3.36Å; A316-R318 PolarHBondContact O-N 2.91Å; R318-Q321 PolarHBondContact O-N 2.87Å; R318-T322 WeakPolarHBondContact O-CB 3.29Å; R318-T322 PolarHBondContact O-N 2.95Å; R318-T322 PolarHBondContact O-OG1 3.02Å
319	R	72.1	Confident	72.1	Confident	198 Å²	198	106.3 Å²	106.3	75%	0.747	50%	0.504	S	S	*	.	H	α-helix	trans	-67.5	-41.5	-179.8	-156.6	166.6	-175.2	140.4	-1.6	111.5	R315 A316 A317 T322 A323	R315-R319 WeakPolarHBondContact O-CB 3.45Å; R315-R319 PolarHBondContact O-N 3.47Å; A316-R319 PolarHBondContact O-N 3.13Å; A316-R319 VanDerWaalsContact O-N 3.09Å; A317-R319 VanDerWaalsContact C-N 3.33Å; A317-R319 PolarHBondContact O-N 3.49Å; R319-T322 PolarHBondContact O-N 2.68Å; R319-A323 WeakPolarHBondContact O-CB 3.31Å; R319-A323 PolarHBondContact O-N 2.89Å
320	I	78.3	Confident	71.6	Confident	118 Å²	118	108.6 Å²	108.6	61%	0.605	52%	0.515	S	S	*	.	H	α-helix	trans	-65.4	-46.4	173.6	-66.7	163.8	0	0	0	111.1	A316 A317 T322 A323 F324	A316-I320 WeakPolarHBondContact O-CG1 3.23Å; A316-I320 PolarHBondContact O-N 3.27Å; A317-I320 PolarHBondContact O-N 3.33Å; I320-T322 VanDerWaalsContact C-N 3.32Å; I320-T322 PolarHBondContact O-N 3.24Å; I320-A323 PolarHBondContact O-N 2.78Å; I320-F324 WeakPolarHBondContact O-CB 3.39Å; I320-F324 PolarHBondContact O-N 3.26Å
321	Q	68.1	Low	71.9	Confident	129 Å²	129	109.3 Å²	109.3	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-61.8	-39.3	177.3	-74	170.6	-2.2	0	0	112.2	A317 R318 R325	A317-Q321 WeakPolarHBondContact O-CB 3.38Å; A317-Q321 VanDerWaalsContact O-CG 3.22Å; A317-Q321 WeakPolarHBondContact O-CG 3.42Å; A317-Q321 PolarHBondContact O-N 3.3Å; R318-Q321 PolarHBondContact O-N 2.87Å; Q321-R325 WeakPolarHBondContact O-CB 3.2Å; Q321-R325 PolarHBondContact O-N 3Å
322	T	66.6	Low	71.6	Confident	76 Å²	76	106.4 Å²	106.4	47%	0.466	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-48.4	176	-58.2	0	0	0	0	110.9	R318 R319 I320 F324 R325 Q326	R318-T322 WeakPolarHBondContact O-CB 3.29Å; R318-T322 PolarHBondContact O-N 2.95Å; R318-T322 PolarHBondContact O-OG1 3.02Å; R319-T322 PolarHBondContact O-N 2.68Å; I320-T322 VanDerWaalsContact C-N 3.32Å; I320-T322 PolarHBondContact O-N 3.24Å; T322-F324 VanDerWaalsContact C-N 3.34Å; T322-F324 PolarHBondContact O-N 3.34Å; T322-R325 PolarHBondContact O-N 3.27Å; T322-Q326 WeakPolarHBondContact O-CB 3.19Å; T322-Q326 WeakPolarHBondContact O-CG 3.26Å; T322-Q326 PolarHBondContact O-N 2.86Å
323	A	70.6	Confident	71.3	Confident	53 Å²	53	108.4 Å²	108.4	44%	0.438	51%	0.507	S	S	.	.	H	α-helix	trans	-60.9	-40.3	176.4	0	0	0	0	0	112.3	R319 I320 Q326 Y327	R319-A323 WeakPolarHBondContact O-CB 3.31Å; R319-A323 PolarHBondContact O-N 2.89Å; I320-A323 PolarHBondContact O-N 2.78Å; A323-Q326 PolarHBondContact O-N 3.14Å; A323-Y327 WeakPolarHBondContact O-CB 3.44Å; A323-Y327 PolarHBondContact O-N 3.33Å
324	F	76	Confident	70.7	Confident	126 Å²	126	112 Å²	112	55%	0.553	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-41	176	-174.3	-104.2	0	0	0	112.4	I320 T322 Y327 Q328	I320-F324 WeakPolarHBondContact O-CB 3.39Å; I320-F324 PolarHBondContact O-N 3.26Å; T322-F324 VanDerWaalsContact C-N 3.34Å; T322-F324 PolarHBondContact O-N 3.34Å; F324-Y327 PolarHBondContact O-N 3.43Å; F324-Q328 HydrophobicContact CD1-CG 4.3Å; F324-Q328 HydrophobicContact CE1-CG 3.99Å; F324-Q328 HydrophobicContact CE2-CG 4.42Å; F324-Q328 HydrophobicContact CZ-CG 4.07Å; F324-Q328 VanDerWaalsContact O-CG 3.3Å; F324-Q328 WeakPolarHBondContact O-CG 3.32Å; F324-Q328 PolarHBondContact O-N 3.07Å
325	R	72.5	Confident	70.5	Confident	190 Å²	190	111.8 Å²	111.8	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-42.4	175	-174.6	177.3	-74.8	179	-4	111.2	Q321 T322 Q328 L329	Q321-R325 WeakPolarHBondContact O-CB 3.2Å; Q321-R325 PolarHBondContact O-N 3Å; T322-R325 PolarHBondContact O-N 3.27Å; R325-Q328 PolarHBondContact O-N 3.43Å; R325-L329 HydrophobicContact CG-CD1 4.39Å; R325-L329 WeakPolarHBondContact O-CG 3.44Å; R325-L329 PolarHBondContact O-N 2.91Å
326	Q	61.9	Low	70.6	Confident	120 Å²	120	106.9 Å²	106.9	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-46.9	172.9	-74.8	175	-25.8	0	0	111.7	T322 A323 Q328 L329 S330	T322-Q326 WeakPolarHBondContact O-CB 3.19Å; T322-Q326 WeakPolarHBondContact O-CG 3.26Å; T322-Q326 PolarHBondContact O-N 2.86Å; A323-Q326 PolarHBondContact O-N 3.14Å; Q326-Q328 VanDerWaalsContact C-N 3.34Å; Q326-Q328 PolarHBondContact O-N 3.26Å; Q326-L329 PolarHBondContact O-N 3.3Å; Q326-S330 PolarHBondContact O-N 3.12Å; Q326-S330 PolarHBondContact O-OG 2.95Å
327	Y	79.8	Confident	70.2	Confident	129 Å²	129	113.9 Å²	113.9	51%	0.506	53%	0.53	S	S	.	.	H	α-helix	trans	-56.9	-44.9	175.8	172	-97.4	0	0	0	112.2	A323 F324 S330 K331	A323-Y327 WeakPolarHBondContact O-CB 3.44Å; A323-Y327 PolarHBondContact O-N 3.33Å; F324-Y327 PolarHBondContact O-N 3.43Å; Y327-S330 PolarHBondContact O-N 3.12Å; Y327-K331 HydrophobicContact CE1-CD 3.84Å; Y327-K331 VanDerWaalsContact O-CB 3.26Å; Y327-K331 WeakPolarHBondContact O-CB 3.29Å; Y327-K331 PolarHBondContact O-N 3.34Å; Y327-K331 PolarHBondContact OH-NZ 3.01Å
328	Q	75.6	Confident	69.2	Low	81 Å²	81	115.8 Å²	115.8	38%	0.379	54%	0.535	S	S	.	.	H	α-helix	trans	-69.1	-34.7	178.5	-67.4	-76.6	42.3	0	0	112.8	F324 R325 Q326 K331 N332	F324-Q328 HydrophobicContact CD1-CG 4.3Å; F324-Q328 HydrophobicContact CE1-CG 3.99Å; F324-Q328 HydrophobicContact CE2-CG 4.42Å; F324-Q328 HydrophobicContact CZ-CG 4.07Å; F324-Q328 VanDerWaalsContact O-CG 3.3Å; F324-Q328 WeakPolarHBondContact O-CG 3.32Å; F324-Q328 PolarHBondContact O-N 3.07Å; R325-Q328 PolarHBondContact O-N 3.43Å; Q326-Q328 VanDerWaalsContact C-N 3.34Å; Q326-Q328 PolarHBondContact O-N 3.26Å; Q328-K331 PolarHBondContact O-N 2.89Å; Q328-N332 PolarHBondContact O-N 2.94Å
329	L	64.8	Low	68.7	Low	96 Å²	96	112.5 Å²	112.5	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-51.7	171.4	-74	168.1	0	0	0	110.8	R325 Q326 K331 N332 F333	R325-L329 HydrophobicContact CG-CD1 4.39Å; R325-L329 WeakPolarHBondContact O-CG 3.44Å; R325-L329 PolarHBondContact O-N 2.91Å; Q326-L329 PolarHBondContact O-N 3.3Å; L329-K331 VanDerWaalsContact C-N 3.27Å; L329-K331 PolarHBondContact O-N 3.07Å; L329-N332 PolarHBondContact O-N 2.89Å; L329-F333 WeakPolarHBondContact O-CD2 3.4Å; L329-F333 PolarHBondContact O-N 3.41Å
330	S	68.3	Low	67.4	Low	78 Å²	78	108.3 Å²	108.3	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-57.5	-38.9	175.5	-62.9	0	0	0	0	112.3	Q326 Y327 N332 F333 Q334	Q326-S330 PolarHBondContact O-N 3.12Å; Q326-S330 PolarHBondContact O-OG 2.95Å; Y327-S330 PolarHBondContact O-N 3.12Å; S330-N332 PolarHBondContact O-N 3.38Å; S330-F333 PolarHBondContact O-N 3.1Å; S330-Q334 WeakPolarHBondContact O-CB 3.49Å; S330-Q334 PolarHBondContact O-N 2.92Å
331	K	77.7	Confident	65.9	Low	94 Å²	94	106.4 Å²	106.4	41%	0.409	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-33.8	176	-165.3	169.6	-168	165	0	112.8	Y327 Q328 L329 K335	Y327-K331 HydrophobicContact CE1-CD 3.84Å; Y327-K331 VanDerWaalsContact O-CB 3.26Å; Y327-K331 WeakPolarHBondContact O-CB 3.29Å; Y327-K331 PolarHBondContact O-N 3.34Å; Y327-K331 PolarHBondContact OH-NZ 3.01Å; Q328-K331 PolarHBondContact O-N 2.89Å; L329-K331 VanDerWaalsContact C-N 3.27Å; L329-K331 PolarHBondContact O-N 3.07Å; K331-K335 WeakPolarHBondContact O-CG 3.45Å; K331-K335 PolarHBondContact O-N 3.38Å; K331-K335 VanDerWaalsContact O-N 3.17Å
332	N	64.3	Low	64.7	Low	86 Å²	86	108.1 Å²	108.1	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-74	-40.8	171.4	-87.8	-18.9	0	0	0	112.3	Q328 L329 S330 Q334 K335 I336	Q328-N332 PolarHBondContact O-N 2.94Å; L329-N332 PolarHBondContact O-N 2.89Å; S330-N332 PolarHBondContact O-N 3.38Å; N332-Q334 VanDerWaalsContact C-N 3.29Å; N332-Q334 PolarHBondContact O-N 3.29Å; N332-K335 WeakPolarHBondContact O-CB 3.25Å; N332-K335 PolarHBondContact O-N 2.89Å; N332-I336 WeakPolarHBondContact O-CG1 3.34Å; N332-I336 PolarHBondContact O-N 3.14Å
333	F	66.9	Low	63.7	Low	146 Å²	146	108.4 Å²	108.4	64%	0.64	54%	0.535	S	S	*	.	H	α-helix	trans	-60	-38.7	172.4	-86.2	-73.4	0	0	0	112.1	L329 S330 I336 R337	L329-F333 WeakPolarHBondContact O-CD2 3.4Å; L329-F333 PolarHBondContact O-N 3.41Å; S330-F333 PolarHBondContact O-N 3.1Å; F333-I336 PolarHBondContact O-N 3.48Å; F333-R337 WeakPolarHBondContact O-CB 3.4Å; F333-R337 PolarHBondContact O-N 3.31Å
334	Q	66.7	Low	62.6	Low	89 Å²	89	114.5 Å²	114.5	42%	0.416	55%	0.551	S	S	.	*	H	α-helix	trans	-65.3	-41.2	174.9	-159.3	73	-11.2	0	0	111.9	S330 N332 I336 R337 N338	S330-Q334 WeakPolarHBondContact O-CB 3.49Å; S330-Q334 PolarHBondContact O-N 2.92Å; N332-Q334 VanDerWaalsContact C-N 3.29Å; N332-Q334 PolarHBondContact O-N 3.29Å; Q334-I336 PolarHBondContact O-N 3.34Å; Q334-R337 PolarHBondContact O-N 2.82Å; Q334-N338 WeakPolarHBondContact O-CB 3.19Å; Q334-N338 PolarHBondContact O-N 2.64Å; Q334-N338 PolarHBondContact O-OD1 3.03Å
335	K	71.4	Confident	60.7	Low	129 Å²	129	115.7 Å²	115.7	56%	0.561	56%	0.563	S	S	*	*	H	α-helix	trans	-59.1	-45.3	172.1	-73.6	172.9	-178.4	177.7	0	112.1	K331 N332 N338 S339	K331-K335 WeakPolarHBondContact O-CG 3.45Å; K331-K335 PolarHBondContact O-N 3.38Å; K331-K335 VanDerWaalsContact O-N 3.17Å; N332-K335 WeakPolarHBondContact O-CB 3.25Å; N332-K335 PolarHBondContact O-N 2.89Å; K335-N338 PolarHBondContact O-N 3.26Å; K335-S339 WeakPolarHBondContact O-CB 3.43Å; K335-S339 PolarHBondContact O-N 2.87Å; K335-S339 PolarHBondContact O-OG 3.04Å
336	I	68.5	Low	58.9	Low	92 Å²	92	112.4 Å²	112.4	47%	0.472	57%	0.566	S	S	.	*	H	α-helix	trans	-61.6	-48.4	177.9	-66.8	163.9	0	0	0	109.8	N332 F333 Q334 N338 S339 L340	N332-I336 WeakPolarHBondContact O-CG1 3.34Å; N332-I336 PolarHBondContact O-N 3.14Å; F333-I336 PolarHBondContact O-N 3.48Å; Q334-I336 PolarHBondContact O-N 3.34Å; I336-N338 PolarHBondContact O-N 2.9Å; I336-S339 PolarHBondContact O-N 3.46Å; I336-S339 PolarHBondContact O-OG 3.41Å; I336-L340 HydrophobicContact CG2-CD1 4.09Å; I336-L340 WeakPolarHBondContact O-CG 3.18Å; I336-L340 PolarHBondContact O-N 2.87Å
337	R	65.7	Low	57.6	Low	184 Å²	184	117.7 Å²	117.7	69%	0.694	58%	0.58	S	S	*	*	H	α-helix	trans	-57.9	-45.2	177.7	-162.6	177.1	-168.8	113.1	1.8	112.1	F333 Q334 L340 S341	F333-R337 WeakPolarHBondContact O-CB 3.4Å; F333-R337 PolarHBondContact O-N 3.31Å; Q334-R337 PolarHBondContact O-N 2.82Å; R337-L340 PolarHBondContact O-N 2.95Å; R337-S341 PolarHBondContact O-N 3.41Å; R337-S341 VanDerWaalsContact O-N 3.15Å; R337-S341 PolarHBondContact O-OG 3.22Å
338	N	52	Low	55.5	Low	82 Å²	82	123.4 Å²	123.4	44%	0.439	60%	0.601	S	S	.	*	H	α-helix	trans	-67.1	-42.3	179.3	-69.4	12.3	0	0	0	112	Q334 K335 I336 L340 S341 E342	Q334-N338 WeakPolarHBondContact O-CB 3.19Å; Q334-N338 PolarHBondContact O-N 2.64Å; Q334-N338 PolarHBondContact O-OD1 3.03Å; K335-N338 PolarHBondContact O-N 3.26Å; I336-N338 PolarHBondContact O-N 2.9Å; N338-L340 VanDerWaalsContact C-N 3.26Å; N338-L340 PolarHBondContact O-N 3.39Å; N338-S341 WeakPolarHBondContact CA-OG 3.37Å; N338-S341 PolarHBondContact O-N 3.29Å; N338-S341 VanDerWaalsContact O-N 3.13Å; N338-S341 PolarHBondContact O-OG 3Å; N338-E342 PolarHBondContact O-N 3.48Å; N338-E342 VanDerWaalsContact O-N 3.09Å
339	S	55.5	Low	53.4	Low	67 Å²	67	125.8 Å²	125.8	47%	0.469	62%	0.615	S	S	.	*	H	α-helix	trans	-63.2	-31.4	176.2	71.5	0	0	0	0	113.1	K335 I336	K335-S339 WeakPolarHBondContact O-CB 3.43Å; K335-S339 PolarHBondContact O-N 2.87Å; K335-S339 PolarHBondContact O-OG 3.04Å; I336-S339 PolarHBondContact O-N 3.46Å; I336-S339 PolarHBondContact O-OG 3.41Å
340	L	44.9	Very low	51.7	Low	110 Å²	110	126.6 Å²	126.6	58%	0.576	63%	0.629	S	S	*	*	H	α-helix	trans	-71.8	-37.4	173.6	-72	167.5	0	0	0	111.9	I336 R337 N338 S343	I336-L340 HydrophobicContact CG2-CD1 4.09Å; I336-L340 WeakPolarHBondContact O-CG 3.18Å; I336-L340 PolarHBondContact O-N 2.87Å; R337-L340 PolarHBondContact O-N 2.95Å; N338-L340 VanDerWaalsContact C-N 3.26Å; N338-L340 PolarHBondContact O-N 3.39Å; L340-S343 PolarHBondContact O-N 3.34Å; L340-S343 PolarHBondContact O-OG 3.31Å
341	S	46.7	Very low	49.8	Very low	77 Å²	77	130.1 Å²	130.1	54%	0.538	64%	0.641	S	S	.	*	H	α-helix	trans	-68.1	-37.2	175.6	44.5	0	0	0	0	113.9	R337 N338 S343 K344	R337-S341 PolarHBondContact O-N 3.41Å; R337-S341 VanDerWaalsContact O-N 3.15Å; R337-S341 PolarHBondContact O-OG 3.22Å; N338-S341 WeakPolarHBondContact CA-OG 3.37Å; N338-S341 PolarHBondContact O-N 3.29Å; N338-S341 VanDerWaalsContact O-N 3.13Å; N338-S341 PolarHBondContact O-OG 3Å; S341-S343 PolarHBondContact O-N 3.02Å; S341-K344 PolarHBondContact O-N 3.02Å
342	E	41.7	Very low	47.4	Very low	165 Å²	165	136.9 Å²	136.9	77%	0.771	66%	0.664	S	S	*	*	H	α-helix	trans	-67.1	-22.3	177.2	-69.4	-175.9	153.7	0	0	112.9	N338 K344	N338-E342 PolarHBondContact O-N 3.48Å; N338-E342 VanDerWaalsContact O-N 3.09Å; E342-K344 VanDerWaalsContact C-N 3.26Å; E342-K344 PolarHBondContact O-N 2.95Å
343	S	47.3	Very low	45.8	Very low	83 Å²	83	141.4 Å²	141.4	58%	0.58	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-7.3	-179.1	77.4	0	0	0	0	115.5	L340 S341	L340-S343 PolarHBondContact O-N 3.34Å; L340-S343 PolarHBondContact O-OG 3.31Å; S341-S343 PolarHBondContact O-N 3.02Å
344	K	46.1	Very low	44.2	Very low	180 Å²	180	140 Å²	140	78%	0.783	69%	0.687	S	S	*	*			trans	-124.9	54	-173.5	-72.4	-169.6	174.9	-176.8	0	114.6	S341 E342	S341-K344 PolarHBondContact O-N 3.02Å; E342-K344 VanDerWaalsContact C-N 3.26Å; E342-K344 PolarHBondContact O-N 2.95Å
345	L	36.4	Very low	42.2	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	71%	0.709	S	S	*	*			trans	-124.3	112.8	164.4	-84.8	167.3	0	0	0	111.4	R347	L345-R347 PolarHBondContact O-N 3.27Å
346	P	35.6	Very low	40.7	Very low	121 Å²	121	140.9 Å²	140.9	79%	0.786	72%	0.717	S	S	*	*			trans	-78.1	117.5	-176.5	29.8	-33.3	0	0	0	112.1	R348	P346-R348 PolarHBondContact O-N 2.79Å
347	R	33.8	Very low	38.7	Very low	230 Å²	230	141.5 Å²	141.5	87%	0.868	73%	0.729	S	S	*	*			trans	-67	98.3	167.3	-79	-175.7	174.8	147	-0.4	110.5	L345 I349	L345-R347 PolarHBondContact O-N 3.27Å; R347-I349 VanDerWaalsContact C-N 3.32Å; R347-I349 HydrophobicContact CB-CG1 4.48Å; R347-I349 PolarHBondContact O-N 3.18Å
348	R	35.4	Very low	36.9	Very low	250 Å²	250	138.2 Å²	138.2	94%	0.943	74%	0.735	S	S	*	*			trans	-73	79.5	173.7	-168.3	-177.4	-168.6	176.4	4.7	111.1	P346	P346-R348 PolarHBondContact O-N 2.79Å
349	I	31.3	Very low	35.8	Very low	130 Å²	130	145.8 Å²	145.8	67%	0.667	76%	0.757	S	S	*	*			trans	-89.4	116.5	172.5	-63.3	175.5	0	0	0	108.9	R347 L351	R347-I349 VanDerWaalsContact C-N 3.32Å; R347-I349 HydrophobicContact CB-CG1 4.48Å; R347-I349 PolarHBondContact O-N 3.18Å; I349-L351 HydrophobicContact CG2-CG 4.3Å
350	S	30.1	Very low	34.5	Very low	113 Å²	113	147.4 Å²	147.4	79%	0.79	77%	0.769	S	S	*	*			trans	-80.6	138.9	169.7	-172.9	0	0	0	0	110
351	L	28.1	Very low	33.8	Very low	152 Å²	152	153.3 Å²	153.3	80%	0.796	78%	0.783	S	S	*	*			trans	-133.3	117.4	173.4	-76.8	172.9	0	0	0	110.7	I349	I349-L351 HydrophobicContact CG2-CG 4.3Å
352	R	27.7	Very low	32.9	Very low	236 Å²	236	157 Å²	157	89%	0.891	80%	0.797	S	S	*	*			trans	-137.5	111.4	158.1	-80.8	-169.6	173.8	-179.6	-1.3	109.3
353	H	30.1	Very low	32.3	Very low	182 Å²	182	153.6 Å²	153.6	84%	0.843	80%	0.797	S	S	*	*			trans	30.7	141.5	155.2	-58.6	-78.2	0	0	0	122.7
354	P	34.2	Very low	31.4	Very low	117 Å²	117	154.1 Å²	154.1	76%	0.76	81%	0.806	S	S	*	*			trans	-92.7	158.1	178.5	38	-35.9	0	0	0	114.1
355	S	24.7	Very low	30.5	Very low	123 Å²	123	152.5 Å²	152.5	86%	0.86	80%	0.801	S	S	*	*			trans	-159.2	161.8	152.3	-86.7	0	0	0	0	110.6
356	P	38.3	Very low	30.1	Very low	112 Å²	112	154 Å²	154	73%	0.727	80%	0.796	S	S	*	*			trans	-109.5	175	-153.4	41.2	-36.3	0	0	0	116.3
357	S	27.6	Very low	29.8	Very low	105 Å²	105	155.3 Å²	155.3	73%	0.734	79%	0.792	S	S	*	*			trans	84	105.7	150.9	-58.1	0	0	0	0	121.4
358	S	27.1	Very low	29.5	Very low	116 Å²	116	148.8 Å²	148.8	81%	0.811	78%	0.782	S	S	*	*				91.5	146.3	129.4	83	0	0	0	0	123
359	R	29.7	Very low	29.2	Very low	240 Å²	240	147 Å²	147	91%	0.906	78%	0.776	S	S	*	*			trans	56.9	96.4	151.2	-93.6	-180	171.5	170.6	-2.2	122.1
360	S	27.5	Very low	29	Very low	102 Å²	102	146.9 Å²	146.9	71%	0.713	78%	0.782	S	S	*	*				18.7	118.5	117.9	-170.9	0	0	0	0	119.8
361	R	30.5	Very low	28.9	Very low	233 Å²	233	149.3 Å²	149.3	88%	0.879	79%	0.785	S	S	*	*				165.2	131	118	-89.6	175.5	-173.9	-176	1.3	114.5
362	N	28.1	Very low	29	Very low	155 Å²	155	150.1 Å²	150.1	83%	0.829	78%	0.784	S	S	*	*			trans	22.5	136.8	141	-58.1	9.1	0	0	0	123.7
363	A	27.8	Very low	30	Very low	94 Å²	94	144.9 Å²	144.9	78%	0.777	78%	0.781	S	S	*	*			trans	82.1	106.3	130	0	0	0	0	0	123.1
364	A	28.6	Very low	30	Very low	93 Å²	93	139.3 Å²	139.3	77%	0.769	77%	0.773	S	S	*	*				81.9	140.3	113.9	0	0	0	0	0	124.2
365	Q	28.6	Very low	29.7	Very low	146 Å²	146	138 Å²	138	68%	0.682	78%	0.78	S	S	*	*			trans	90.8	132.9	139.4	-100.9	-177.8	13.7	0	0	123.3
366	R	27	Very low	29.9	Very low	183 Å²	183	135.7 Å²	135.7	69%	0.691	78%	0.776	S	S	*	*			trans	70.8	122.7	150	-76	159	174.7	158.6	-8.4	116.9
367	H	30	Very low	29.4	Very low	150 Å²	150	140 Å²	140	69%	0.694	79%	0.786	S	S	*	*				110.4	153	53.8	-83.7	8.3	0	0	0	109.4	Y369	H367-Y369 WeakPolarHBondContact O-CE2 3.35Å
368	S	27.3	Very low	29.7	Very low	93 Å²	93	142.9 Å²	142.9	65%	0.65	79%	0.792	S	S	*	*			cis	-103.8	-109	1.6	-66	0	0	0	0	113.2
369	Y	28.3	Very low	30.6	Very low	212 Å²	212	142.9 Å²	142.9	83%	0.831	79%	0.789	S	S	*	*			cis	-146.2	-174.5	7.7	-74.3	-80.1	0	0	0	111.8	H367	H367-Y369 WeakPolarHBondContact O-CE2 3.35Å
370	T	28.5	Very low	30.5	Very low	128 Å²	128	139.5 Å²	139.5	79%	0.785	79%	0.788	S	S	*	*			trans	-108.3	158.7	-165.1	1.5	0	0	0	0	112
371	L	27.3	Very low	30.4	Very low	163 Å²	163	145.7 Å²	145.7	85%	0.853	80%	0.796	S	S	*	*			cis	-140.9	168.6	33.3	-95.7	168.2	0	0	0	114.8
372	H	29.5	Very low	30.2	Very low	169 Å²	169	138.8 Å²	138.8	78%	0.782	78%	0.784	S	S	*	*			trans	-128.7	-171.4	175.9	-111.2	-43.1	0	0	0	108.9
373	P	50.1	Low	30	Very low	126 Å²	126	141.3 Å²	141.3	82%	0.818	79%	0.787	S	S	*	*			cis	-125.7	-179.7	10.5	40.3	-23.3	0	0	0	114.7
374	G	28.4	Very low	30.4	Very low	66 Å²	66	143.1 Å²	143.1	68%	0.68	79%	0.789	S	S	*	*			cis	-145.4	-149.1	1.7	0	0	0	0	0	110.9
375	G	29.5	Very low	31.4	Very low	88 Å²	88	144 Å²	144	91%	0.907	79%	0.787	S	S	*	*			cis	117.2	121.2	-2.4	0	0	0	0	0	113.7
376	G	28.4	Very low	32.2	Very low	75 Å²	75	142.5 Å²	142.5	77%	0.773	79%	0.79	S	S	*	*			cis	171.1	-170.6	-5.3	0	0	0	0	0	114.1
377	Q	27.8	Very low	33.2	Very low	203 Å²	203	139.1 Å²	139.1	95%	0.949	79%	0.791	S	S	*	*			trans	89.6	139.4	172.6	-51.6	-157.8	79.5	0	0	120
378	I	33.4	Very low	34.4	Very low	165 Å²	165	137.4 Å²	137.4	85%	0.846	79%	0.793	S	S	*	*			trans	-153.7	133.2	-166.5	-63.1	161.4	0	0	0	111.9
379	P	45.7	Very low	35.4	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	79%	0.794	S	S	*	*			trans	-147.9	121.5	156.8	35	-15.2	0	0	0	118.6
380	L	27.8	Very low	35.3	Very low	169 Å²	169	133.2 Å²	133.2	89%	0.885	79%	0.791	S	S	*	*			trans	48.1	149.9	137.1	-65.9	166.9	0	0	0	125.3
381	R	25.7	Very low	35.2	Very low	231 Å²	231	138.6 Å²	138.6	87%	0.872	80%	0.797	S	S	*	*			trans	103.3	101.3	135.6	-121.1	-163.5	-175.4	-179.5	2.1	123.1
382	S	26.4	Very low	35.1	Very low	89 Å²	89	136 Å²	136	62%	0.622	79%	0.792	S	S	*	*				57.9	140.6	125.5	73.8	0	0	0	0	126.6
383	K	24.9	Very low	35	Very low	207 Å²	207	134.6 Å²	134.6	90%	0.9	80%	0.796	S	S	*	*			trans	87.4	153.5	146.8	-76.4	178.8	175.8	-174	0	121.8
384	T	35	Very low	33.9	Very low	132 Å²	132	133.8 Å²	133.8	81%	0.81	79%	0.794	S	S	*	*			trans	-103.3	-174.1	-179.5	51.1	0	0	0	0	111.7
385	P	48.9	Very low	33.9	Very low	113 Å²	113	138.1 Å²	138.1	73%	0.734	80%	0.8	S	S	*	*			cis	-132	-136.9	6.4	38	-12	0	0	0	112
386	P	45.6	Very low	34.3	Very low	114 Å²	114	139 Å²	139	74%	0.74	79%	0.79	S	S	*	*			cis	-129.7	-105.8	-12.8	28.4	0.9	0	0	0	118.8
387	P	48	Very low	35.2	Very low	111 Å²	111	140.5 Å²	140.5	72%	0.721	79%	0.786	S	S	*	*			trans	-133.3	-140.6	-145.1	38.2	-11	0	0	0	116.6
388	P	55.3	Low	35.2	Very low	114 Å²	114	137 Å²	137	74%	0.74	78%	0.779	S	S	*	*				-112.1	-132.3	-86.1	38.7	-17.4	0	0	0	111.7
389	P	49	Very low	35.1	Very low	102 Å²	102	134.7 Å²	134.7	66%	0.662	78%	0.778	S	S	*	*			cis	-135.7	-178.9	-31.9	41.1	-23.2	0	0	0	117.3
390	C	26.3	Very low	34.6	Very low	115 Å²	115	131.6 Å²	131.6	78%	0.777	77%	0.767	S	S	*	*			trans	70.3	155.1	151.7	-70.8	0	0	0	0	122.8
391	R	25.4	Very low	35	Very low	242 Å²	242	129.1 Å²	129.1	91%	0.913	76%	0.761	S	S	*	*			cis	-167.8	169.4	-35.3	-130.5	-179.1	-176.2	-161.6	1.1	112.3
392	S	26.6	Very low	35.6	Very low	107 Å²	107	123 Å²	123	75%	0.748	75%	0.749	S	S	*	*			trans	-86	179	-171.8	-38.4	0	0	0	0	115.9
393	T	27.3	Very low	36.2	Very low	140 Å²	140	124.7 Å²	124.7	86%	0.859	75%	0.751	S	S	*	*			cis	-138.2	-129.8	16	-36.2	0	0	0	0	113.3
394	S	25.8	Very low	37.2	Very low	110 Å²	110	118.4 Å²	118.4	77%	0.769	73%	0.73	S	S	*	*			cis	-151	-151.1	15.3	62.6	0	0	0	0	114.3
395	L	29.6	Very low	37.3	Very low	156 Å²	156	117.9 Å²	117.9	82%	0.817	72%	0.718	S	S	*	*			trans	-161.4	-175.8	-170.6	-102.5	175.8	0	0	0	109.7
396	P	37.9	Very low	37.1	Very low	107 Å²	107	118.6 Å²	118.6	70%	0.695	72%	0.715	S	S	*	*			cis	-121.4	-92.5	12.7	19.3	7.7	0	0	0	120.7
397	P	47.5	Very low	37.1	Very low	106 Å²	106	118.5 Å²	118.5	69%	0.688	71%	0.705	S	S	*	*			trans	-112.3	-163.5	-145.2	43.9	-28.2	0	0	0	112.9
398	T	27.8	Very low	36.6	Very low	129 Å²	129	118 Å²	118	79%	0.791	70%	0.696	S	S	*	*			cis	-160.3	167.8	19	-0.3	0	0	0	0	107.7
399	S	30.5	Very low	36.1	Very low	118 Å²	118	115.3 Å²	115.3	83%	0.825	68%	0.68	S	S	*	*			cis	-158.6	174.2	-0.5	45.4	0	0	0	0	110.1
400	G	34.5	Very low	35.7	Very low	52 Å²	52	116.8 Å²	116.8	54%	0.536	68%	0.676	S	S	.	*	S	Bend	trans	127.4	151	-176.6	0	0	0	0	0	110.6	T402	G400-T402 PolarHBondContact O-N 3.48Å
401	P	36.9	Very low	36.7	Very low	117 Å²	117	113.8 Å²	113.8	76%	0.76	66%	0.656	S	S	*	*			trans	-71.4	115.7	-170.8	28	-33.9	0	0	0	111.9
402	T	38.1	Very low	37.8	Very low	102 Å²	102	109.3 Å²	109.3	63%	0.626	65%	0.645	S	S	*	*			trans	-98.5	158.2	178.4	16.7	0	0	0	0	112.8	G400 T404 Q405	G400-T402 PolarHBondContact O-N 3.48Å; T402-T404 PolarHBondContact O-N 3.19Å; T402-Q405 PolarHBondContact O-N 3.35Å
403	L	39	Very low	38.7	Very low	124 Å²	124	110.1 Å²	110.1	65%	0.649	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.7	-37	-169.7	-176	62	0	0	0	115.8	Q405 L406 E407	L403-Q405 PolarHBondContact O-N 3.02Å; L403-L406 WeakPolarHBondContact O-CB 3.29Å; L403-L406 PolarHBondContact O-N 2.96Å; L403-E407 PolarHBondContact O-N 2.81Å
404	T	47.4	Very low	40	Very low	76 Å²	76	107.9 Å²	107.9	47%	0.466	62%	0.62	S	S	.	*	H	α-helix	trans	-60.5	-28.4	179.3	48.4	0	0	0	0	113.1	T402 L406 E407 D408	T402-T404 PolarHBondContact O-N 3.19Å; T404-L406 PolarHBondContact O-N 3.47Å; T404-E407 PolarHBondContact O-N 2.98Å; T404-E407 VanDerWaalsContact O-N 3.11Å; T404-D408 WeakPolarHBondContact O-CB 3.29Å; T404-D408 VanDerWaalsContact O-CG 3.26Å; T404-D408 PolarHBondContact O-N 2.83Å
405	Q	36.2	Very low	40.9	Very low	120 Å²	120	109.2 Å²	109.2	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-66.8	-24.4	174.9	-70.9	-171.6	-39.9	0	0	113.2	T402 L403 C409	T402-Q405 PolarHBondContact O-N 3.35Å; L403-Q405 PolarHBondContact O-N 3.02Å; Q405-C409 WeakPolarHBondContact O-CB 3.29Å; Q405-C409 PolarHBondContact O-N 2.75Å; Q405-C409 VanDerWaalsContact O-N 3.16Å
406	L	44	Very low	41.9	Very low	129 Å²	129	105.5 Å²	105.5	68%	0.675	60%	0.601	S	S	*	*	H	α-helix	trans	-77.5	-39	169.2	-94.1	73.1	0	0	0	111.4	L403 T404 C409 F410	L403-L406 WeakPolarHBondContact O-CB 3.29Å; L403-L406 PolarHBondContact O-N 2.96Å; T404-L406 PolarHBondContact O-N 3.47Å; L406-C409 PolarHBondContact O-N 3.27Å; L406-F410 VanDerWaalsContact O-CB 3.24Å; L406-F410 WeakPolarHBondContact O-CB 3.37Å; L406-F410 PolarHBondContact O-N 3.01Å
407	E	45.3	Very low	42.3	Very low	112 Å²	112	105.2 Å²	105.2	52%	0.523	59%	0.593	S	S	.	*	H	α-helix	trans	-68.2	-38.4	178.1	-62.2	-174.5	136.1	0	0	111.9	L403 T404 S411	L403-E407 PolarHBondContact O-N 2.81Å; T404-E407 PolarHBondContact O-N 2.98Å; T404-E407 VanDerWaalsContact O-N 3.11Å; E407-S411 VanDerWaalsContact O-CB 3.23Å; E407-S411 WeakPolarHBondContact O-CB 3.37Å; E407-S411 PolarHBondContact O-N 3.37Å; E407-S411 PolarHBondContact O-OG 3.16Å
408	D	38.5	Very low	42.5	Very low	99 Å²	99	102.8 Å²	102.8	53%	0.529	58%	0.581	S	S	.	*	H	α-helix	trans	-66.5	-46.7	172.8	-69.6	-35.5	0	0	0	110.7	T404 F410 S411 E412	T404-D408 WeakPolarHBondContact O-CB 3.29Å; T404-D408 VanDerWaalsContact O-CG 3.26Å; T404-D408 PolarHBondContact O-N 2.83Å; D408-F410 PolarHBondContact O-N 3.26Å; D408-S411 CarbonylContact O-C 3.55Å; D408-S411 WeakPolarHBondContact O-CA 3.49Å; D408-S411 WeakPolarHBondContact O-CB 3.49Å; D408-S411 PolarHBondContact O-N 3.31Å; D408-S411 VanDerWaalsContact O-N 3.13Å; D408-E412 PolarHBondContact O-N 2.92Å
409	C	43.6	Very low	43.1	Very low	59 Å²	59	102.5 Å²	102.5	40%	0.399	57%	0.571	S	S	.	*	H	α-helix	trans	-62.9	-41	176.9	-174.8	0	0	0	0	112.3	Q405 L406 S411 E412 Q413	Q405-C409 WeakPolarHBondContact O-CB 3.29Å; Q405-C409 PolarHBondContact O-N 2.75Å; Q405-C409 VanDerWaalsContact O-N 3.16Å; L406-C409 PolarHBondContact O-N 3.27Å; C409-S411 VanDerWaalsContact C-N 3.31Å; C409-S411 PolarHBondContact O-N 3.42Å; C409-E412 PolarHBondContact O-N 3.09Å; C409-Q413 WeakPolarHBondContact O-CB 3.28Å; C409-Q413 WeakPolarHBondContact O-CG 3.43Å; C409-Q413 PolarHBondContact O-N 3.42Å
410	F	41.3	Very low	43.8	Very low	132 Å²	132	100.6 Å²	100.6	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-67	-33.6	174.2	-167.8	-104.5	0	0	0	111.9	L406 D408 L414	L406-F410 VanDerWaalsContact O-CB 3.24Å; L406-F410 WeakPolarHBondContact O-CB 3.37Å; L406-F410 PolarHBondContact O-N 3.01Å; D408-F410 PolarHBondContact O-N 3.26Å; F410-L414 HydrophobicContact CD1-CD1 3.86Å; F410-L414 HydrophobicContact CE1-CD1 3.63Å; F410-L414 HydrophobicContact CE1-CG 4.48Å; F410-L414 HydrophobicContact CZ-CD1 4.4Å; F410-L414 WeakPolarHBondContact O-CB 3.14Å; F410-L414 PolarHBondContact O-N 3.02Å
411	S	47.4	Very low	44.6	Very low	53 Å²	53	102.4 Å²	102.4	37%	0.371	55%	0.554	S	S	.	*	H	α-helix	trans	-70.7	-39.8	174.2	-62.9	0	0	0	0	112.4	E407 D408 C409 L414 H415	E407-S411 VanDerWaalsContact O-CB 3.23Å; E407-S411 WeakPolarHBondContact O-CB 3.37Å; E407-S411 PolarHBondContact O-N 3.37Å; E407-S411 PolarHBondContact O-OG 3.16Å; D408-S411 CarbonylContact O-C 3.55Å; D408-S411 WeakPolarHBondContact O-CA 3.49Å; D408-S411 WeakPolarHBondContact O-CB 3.49Å; D408-S411 PolarHBondContact O-N 3.31Å; D408-S411 VanDerWaalsContact O-N 3.13Å; C409-S411 VanDerWaalsContact C-N 3.31Å; C409-S411 PolarHBondContact O-N 3.42Å; S411-L414 PolarHBondContact O-N 3.06Å; S411-H415 PolarHBondContact O-N 3.45Å; S411-H415 PolarHBondContact O-ND1 2.88Å
412	E	47.9	Very low	45	Very low	147 Å²	147	100.4 Å²	100.4	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-64.9	-41.6	171.7	-76.5	-163.4	140.7	0	0	111.5	D408 C409 L414 H415 S416	D408-E412 PolarHBondContact O-N 2.92Å; C409-E412 PolarHBondContact O-N 3.09Å; E412-L414 VanDerWaalsContact C-N 3.34Å; E412-L414 PolarHBondContact O-N 3.09Å; E412-H415 PolarHBondContact O-N 3.15Å; E412-S416 VanDerWaalsContact O-CB 3.23Å; E412-S416 WeakPolarHBondContact O-CB 3.42Å; E412-S416 PolarHBondContact O-N 3.49Å
413	Q	45.8	Very low	45.2	Very low	125 Å²	125	99.8 Å²	99.8	58%	0.584	53%	0.53	S	S	*	.	H	α-helix	trans	-61.9	-41.2	174	-75.2	180	-6.4	0	0	111.9	C409 L417	C409-Q413 WeakPolarHBondContact O-CB 3.28Å; C409-Q413 WeakPolarHBondContact O-CG 3.43Å; C409-Q413 PolarHBondContact O-N 3.42Å; Q413-L417 VanDerWaalsContact O-CB 3.26Å; Q413-L417 WeakPolarHBondContact O-CB 3.28Å; Q413-L417 PolarHBondContact O-N 3.43Å
414	L	54.6	Low	45.2	Very low	93 Å²	93	96.9 Å²	96.9	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-39.5	174	-87.6	166.2	0	0	0	113	F410 S411 E412 A418	F410-L414 HydrophobicContact CD1-CD1 3.86Å; F410-L414 HydrophobicContact CE1-CD1 3.63Å; F410-L414 HydrophobicContact CE1-CG 4.48Å; F410-L414 HydrophobicContact CZ-CD1 4.4Å; F410-L414 WeakPolarHBondContact O-CB 3.14Å; F410-L414 PolarHBondContact O-N 3.02Å; S411-L414 PolarHBondContact O-N 3.06Å; E412-L414 VanDerWaalsContact C-N 3.34Å; E412-L414 PolarHBondContact O-N 3.09Å; L414-A418 VanDerWaalsContact O-CB 3.29Å; L414-A418 WeakPolarHBondContact O-CB 3.42Å; L414-A418 PolarHBondContact O-N 3.49Å
415	H	44.5	Very low	44.8	Very low	137 Å²	137	97.8 Å²	97.8	63%	0.634	53%	0.525	S	S	*	.	H	α-helix	trans	-71.8	-39.4	176.6	-77.8	79.6	0	0	0	112.1	S411 E412 A418 Q419	S411-H415 PolarHBondContact O-N 3.45Å; S411-H415 PolarHBondContact O-ND1 2.88Å; E412-H415 PolarHBondContact O-N 3.15Å; H415-A418 PolarHBondContact O-N 2.83Å; H415-Q419 WeakPolarHBondContact O-CB 3.33Å; H415-Q419 PolarHBondContact O-N 3.43Å
416	S	52.1	Low	44.8	Very low	78 Å²	78	99.7 Å²	99.7	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-63.6	-41.7	174.4	-176.5	0	0	0	0	111.4	E412 Q419 S420	E412-S416 VanDerWaalsContact O-CB 3.23Å; E412-S416 WeakPolarHBondContact O-CB 3.42Å; E412-S416 PolarHBondContact O-N 3.49Å; S416-Q419 PolarHBondContact O-N 3.4Å; S416-S420 WeakPolarHBondContact O-CB 3.42Å; S416-S420 PolarHBondContact O-N 2.92Å
417	L	45	Very low	44.5	Very low	102 Å²	102	96.8 Å²	96.8	53%	0.534	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-45.3	173.1	-179.6	61.3	0	0	0	111.8	Q413 Q419 S420 I421	Q413-L417 VanDerWaalsContact O-CB 3.26Å; Q413-L417 WeakPolarHBondContact O-CB 3.28Å; Q413-L417 PolarHBondContact O-N 3.43Å; L417-Q419 VanDerWaalsContact C-N 3.34Å; L417-Q419 PolarHBondContact O-N 2.93Å; L417-S420 PolarHBondContact O-N 3.02Å; L417-I421 HydrophobicContact CD1-CD1 4.22Å; L417-I421 HydrophobicContact CG-CD1 4.15Å; L417-I421 WeakPolarHBondContact O-CD1 3.37Å; L417-I421 VanDerWaalsContact O-CG1 3.29Å; L417-I421 WeakPolarHBondContact O-CG1 3.29Å; L417-I421 PolarHBondContact O-N 3.4Å
418	A	52.5	Low	44.3	Very low	54 Å²	54	102.3 Å²	102.3	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-62.1	-41.8	176.2	0	0	0	0	0	111.8	L414 H415 I421 D422	L414-A418 VanDerWaalsContact O-CB 3.29Å; L414-A418 WeakPolarHBondContact O-CB 3.42Å; L414-A418 PolarHBondContact O-N 3.49Å; H415-A418 PolarHBondContact O-N 2.83Å; A418-I421 PolarHBondContact O-N 2.87Å; A418-D422 WeakPolarHBondContact O-CB 3.36Å; A418-D422 PolarHBondContact O-N 3.31Å
419	Q	40.4	Very low	43.9	Very low	124 Å²	124	101.7 Å²	101.7	58%	0.579	55%	0.548	S	S	*	.	H	α-helix	trans	-68.7	-39.3	178	-172.2	169.2	0.5	0	0	111.9	H415 S416 L417 I421 D422 D423	H415-Q419 WeakPolarHBondContact O-CB 3.33Å; H415-Q419 PolarHBondContact O-N 3.43Å; S416-Q419 PolarHBondContact O-N 3.4Å; L417-Q419 VanDerWaalsContact C-N 3.34Å; L417-Q419 PolarHBondContact O-N 2.93Å; Q419-I421 VanDerWaalsContact C-N 3.3Å; Q419-I421 PolarHBondContact O-N 3.43Å; Q419-D422 PolarHBondContact O-N 3.09Å; Q419-D423 WeakPolarHBondContact O-CB 3.23Å; Q419-D423 PolarHBondContact O-N 2.77Å
420	S	44.8	Very low	43.2	Very low	78 Å²	78	106.9 Å²	106.9	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-62.2	-36.7	172.1	178.7	0	0	0	0	112.5	S416 L417 A424	S416-S420 WeakPolarHBondContact O-CB 3.42Å; S416-S420 PolarHBondContact O-N 2.92Å; L417-S420 PolarHBondContact O-N 3.02Å; S420-A424 WeakPolarHBondContact O-CB 3.31Å; S420-A424 PolarHBondContact O-N 3.22Å; S420-A424 VanDerWaalsContact O-N 3.09Å
421	I	50.5	Low	42.4	Very low	90 Å²	90	106.6 Å²	106.6	46%	0.462	59%	0.586	S	S	.	*	H	α-helix	trans	-69.7	-43.4	173.7	-69.1	164.1	0	0	0	110.2	L417 A418 Q419 A424 L425	L417-I421 HydrophobicContact CD1-CD1 4.22Å; L417-I421 HydrophobicContact CG-CD1 4.15Å; L417-I421 WeakPolarHBondContact O-CD1 3.37Å; L417-I421 VanDerWaalsContact O-CG1 3.29Å; L417-I421 WeakPolarHBondContact O-CG1 3.29Å; L417-I421 PolarHBondContact O-N 3.4Å; A418-I421 PolarHBondContact O-N 2.87Å; Q419-I421 VanDerWaalsContact C-N 3.3Å; Q419-I421 PolarHBondContact O-N 3.43Å; I421-A424 PolarHBondContact O-N 3.4Å; I421-L425 HydrophobicContact CG2-CD1 3.94Å; I421-L425 WeakPolarHBondContact O-CB 3.4Å; I421-L425 VanDerWaalsContact O-CG 3.25Å; I421-L425 WeakPolarHBondContact O-CG 3.15Å; I421-L425 PolarHBondContact O-N 2.82Å
422	D	45	Very low	41.4	Very low	75 Å²	75	113.5 Å²	113.5	40%	0.401	61%	0.612	S	S	.	*	H	α-helix	trans	-64.5	-38.6	178.2	-121.5	41.4	0	0	0	112.1	A418 Q419 L425 R426	A418-D422 WeakPolarHBondContact O-CB 3.36Å; A418-D422 PolarHBondContact O-N 3.31Å; Q419-D422 PolarHBondContact O-N 3.09Å; D422-L425 PolarHBondContact O-N 3.1Å; D422-R426 WeakPolarHBondContact O-CB 3.49Å; D422-R426 VanDerWaalsContact O-CD 3.31Å; D422-R426 WeakPolarHBondContact O-CD 3.32Å; D422-R426 WeakPolarHBondContact O-CG 3.26Å; D422-R426 PolarHBondContact O-N 2.8Å; D422-R426 IonicContact OD2-CZ 3.13Å; D422-R426 IonicContact OD2-NE 2.76Å; D422-R426 IonicContact OD2-NH2 3.3Å; D422-R426 PolarHBondContact OD2-NH2 2.96Å
423	D	42.7	Very low	40.5	Very low	89 Å²	89	110.7 Å²	110.7	48%	0.476	62%	0.623	S	S	.	*	H	α-helix	trans	-71.7	-37.7	176.5	-74.8	-27.1	0	0	0	112.1	Q419 L425 R426 G427	Q419-D423 WeakPolarHBondContact O-CB 3.23Å; Q419-D423 PolarHBondContact O-N 2.77Å; D423-L425 VanDerWaalsContact C-N 3.28Å; D423-L425 PolarHBondContact O-N 2.79Å; D423-R426 PolarHBondContact O-N 3.31Å; D423-R426 WeakPolarHBondContact OD1-CD 3.45Å; D423-G427 PolarHBondContact O-N 2.97Å
424	A	40.2	Very low	39.6	Very low	62 Å²	62	108.4 Å²	108.4	51%	0.512	63%	0.632	S	S	.	*	H	α-helix	trans	-61.8	-35.9	169.5	0	0	0	0	0	112.2	S420 I421	S420-A424 WeakPolarHBondContact O-CB 3.31Å; S420-A424 PolarHBondContact O-N 3.22Å; S420-A424 VanDerWaalsContact O-N 3.09Å; I421-A424 PolarHBondContact O-N 3.4Å
425	L	38.3	Very low	38.6	Very low	96 Å²	96	114 Å²	114	50%	0.503	66%	0.656	S	S	.	*	H	α-helix	trans	-76.1	-33.1	175.4	-69.4	169.3	0	0	0	112.9	I421 D422 D423 G427 W428	I421-L425 HydrophobicContact CG2-CD1 3.94Å; I421-L425 WeakPolarHBondContact O-CB 3.4Å; I421-L425 VanDerWaalsContact O-CG 3.25Å; I421-L425 WeakPolarHBondContact O-CG 3.15Å; I421-L425 PolarHBondContact O-N 2.82Å; D422-L425 PolarHBondContact O-N 3.1Å; D423-L425 VanDerWaalsContact C-N 3.28Å; D423-L425 PolarHBondContact O-N 2.79Å; L425-G427 VanDerWaalsContact C-N 3.33Å; L425-W428 PolarHBondContact O-N 3.31Å
426	R	36.5	Very low	37.8	Very low	159 Å²	159	110.8 Å²	110.8	60%	0.6	66%	0.66	S	S	*	*	H	α-helix	trans	-65.9	-35.5	172.2	-72.5	157	-163.7	-105.2	1	111.7	D422 D423 W428 S429	D422-R426 WeakPolarHBondContact O-CB 3.49Å; D422-R426 VanDerWaalsContact O-CD 3.31Å; D422-R426 WeakPolarHBondContact O-CD 3.32Å; D422-R426 WeakPolarHBondContact O-CG 3.26Å; D422-R426 PolarHBondContact O-N 2.8Å; D422-R426 IonicContact OD2-CZ 3.13Å; D422-R426 IonicContact OD2-NE 2.76Å; D422-R426 IonicContact OD2-NH2 3.3Å; D422-R426 PolarHBondContact OD2-NH2 2.96Å; D423-R426 PolarHBondContact O-N 3.31Å; D423-R426 WeakPolarHBondContact OD1-CD 3.45Å; R426-W428 PolarHBondContact O-N 2.99Å; R426-W428 VanDerWaalsContact O-N 3.1Å; R426-S429 PolarHBondContact O-N 3.3Å
427	G	38.5	Very low	36.9	Very low	68 Å²	68	117.3 Å²	117.3	70%	0.701	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-20.5	173.6	0	0	0	0	0	114.8	D423 L425	D423-G427 PolarHBondContact O-N 2.97Å; L425-G427 VanDerWaalsContact C-N 3.33Å
428	W	39.3	Very low	36.4	Very low	228 Å²	228	116.1 Å²	116.1	86%	0.864	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	8.5	174.9	-76.7	-40	0	0	0	114.4	L425 R426	L425-W428 PolarHBondContact O-N 3.31Å; R426-W428 PolarHBondContact O-N 2.99Å; R426-W428 VanDerWaalsContact O-N 3.1Å
429	S	31.2	Very low	35.3	Very low	87 Å²	87	121.8 Å²	121.8	61%	0.608	71%	0.713	S	S	*	*	S	Bend	trans	-145.7	37.4	-166.8	-169	0	0	0	0	117.6	R426	R426-S429 PolarHBondContact O-N 3.3Å
430	L	28.3	Very low	35.2	Very low	168 Å²	168	123.3 Å²	123.3	88%	0.88	72%	0.724	S	S	*	*			trans	-161.2	108.6	145.6	-144.8	72.5	0	0	0	115.2
431	S	24.3	Very low	34.6	Very low	126 Å²	126	127.9 Å²	127.9	88%	0.881	74%	0.739	S	S	*	*			trans	-162	79.5	146.7	-146.7	0	0	0	0	111.8
432	E	28	Very low	33.7	Very low	197 Å²	197	129.5 Å²	129.5	92%	0.921	75%	0.749	S	S	*	*			trans	-128.5	146.4	158	-77.3	-165.2	123	0	0	107.8
433	G	27.6	Very low	33.2	Very low	89 Å²	89	131.1 Å²	131.1	92%	0.918	76%	0.763	S	S	*	*			trans	117.8	43.8	172.5	0	0	0	0	0	117.1
434	G	26.6	Very low	32.7	Very low	76 Å²	76	128.4 Å²	128.4	78%	0.784	76%	0.757	S	S	*	*			trans	-139.7	115.5	162.5	0	0	0	0	0	109.4
435	E	33.4	Very low	32.5	Very low	211 Å²	211	129.5 Å²	129.5	99%	0.986	77%	0.765	S	S	*	*			trans	-78.2	125.6	-163.7	-60.6	-179.6	107.3	0	0	113.7
436	G	28.9	Very low	32.3	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	78%	0.779	S	S	*	*			trans	162.1	101.1	165.5	0	0	0	0	0	117.1
437	K	32.3	Very low	32.3	Very low	215 Å²	215	132.1 Å²	132.1	94%	0.935	78%	0.779	S	S	*	*			trans	35	95	154	-61.3	179.4	-179.5	177.1	0	117
438	G	35.2	Very low	32.1	Very low	77 Å²	77	131.9 Å²	131.9	79%	0.794	77%	0.77	S	S	*	*			trans	-78.3	-173.9	-179.9	0	0	0	0	0	116
439	L	28.5	Very low	32.1	Very low	172 Å²	172	124.2 Å²	124.2	90%	0.901	76%	0.755	S	S	*	*			trans	-158.7	170.6	164.4	-107.7	176.3	0	0	0	111.3
440	L	39.1	Very low	32.4	Very low	156 Å²	156	121.6 Å²	121.6	82%	0.817	74%	0.739	S	S	*	*			trans	-47.7	148	178.1	-172.8	69.9	0	0	0	114.8
441	M	31.3	Very low	32.6	Very low	174 Å²	174	118.8 Å²	118.8	86%	0.857	72%	0.721	S	S	*	*			trans	-118.4	155.5	170.3	-83.7	-70.7	116.3	0	0	112.5
442	D	33.3	Very low	33.2	Very low	125 Å²	125	117.7 Å²	117.7	67%	0.668	71%	0.714	S	S	*	*			trans	-101.8	143.2	-153.5	179.9	74.2	0	0	0	115.4	G444	D442-G444 VanDerWaalsContact C-N 3.26Å; D442-G444 PolarHBondContact O-N 2.79Å; D442-G444 WeakPolarHBondContact OD2-CA 3.45Å; D442-G444 PolarHBondContact OD2-N 3.16Å
443	P	33.5	Very low	33.8	Very low	109 Å²	109	111.2 Å²	111.2	71%	0.708	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-11.3	178.5	-23.9	35.7	0	0	0	116.9	A445	P443-A445 VanDerWaalsContact C-N 3.29Å; P443-A445 PolarHBondContact O-N 3.13Å
444	G	32.3	Very low	34.1	Very low	32 Å²	32	110.4 Å²	110.4	33%	0.33	69%	0.685	S	S	.	*	H	α-helix	trans	-61.2	-29.9	-171.3	0	0	0	0	0	115.1	D442 L446 R447	D442-G444 VanDerWaalsContact C-N 3.26Å; D442-G444 PolarHBondContact O-N 2.79Å; D442-G444 WeakPolarHBondContact OD2-CA 3.45Å; D442-G444 PolarHBondContact OD2-N 3.16Å; G444-L446 PolarHBondContact O-N 3.28Å; G444-R447 VanDerWaalsContact O-CB 3.24Å; G444-R447 WeakPolarHBondContact O-CB 3.48Å; G444-R447 PolarHBondContact O-N 2.8Å; G444-R447 VanDerWaalsContact O-N 3.08Å
445	A	35.8	Very low	34.8	Very low	84 Å²	84	110.5 Å²	110.5	69%	0.694	67%	0.668	S	S	*	*	H	α-helix	trans	-65	-35.4	-174.9	0	0	0	0	0	114	P443 R447	P443-A445 VanDerWaalsContact C-N 3.29Å; P443-A445 PolarHBondContact O-N 3.13Å; A445-R447 VanDerWaalsContact C-N 3.28Å; A445-R447 PolarHBondContact O-N 3.22Å
446	L	34.1	Very low	35.4	Very low	151 Å²	151	102 Å²	102	79%	0.791	63%	0.631	S	S	*	*	H	α-helix	trans	-72.8	-21.8	174.9	-96.2	114.7	0	0	0	112.9	G444	G444-L446 PolarHBondContact O-N 3.28Å
447	R	36.3	Very low	35.7	Very low	160 Å²	160	104.8 Å²	104.8	60%	0.604	62%	0.619	S	S	*	*	H	α-helix	trans	-66.9	-50.2	-175.7	-167.7	178.8	178	142.6	1	111.3	G444 A445 A449 A450 E451 R457	G444-R447 VanDerWaalsContact O-CB 3.24Å; G444-R447 WeakPolarHBondContact O-CB 3.48Å; G444-R447 PolarHBondContact O-N 2.8Å; G444-R447 VanDerWaalsContact O-N 3.08Å; A445-R447 VanDerWaalsContact C-N 3.28Å; A445-R447 PolarHBondContact O-N 3.22Å; R447-A449 PolarHBondContact O-N 3.1Å; R447-A450 PolarHBondContact O-N 3.17Å; R447-E451 WeakPolarHBondContact CG-OE1 3.18Å; R447-E451 IonicContact NE-OE1 2.7Å; R447-E451 PolarHBondContact NE-OE1 3.21Å; R447-E451 PolarHBondContact O-N 3.44Å; R447-R457 VanDerWaalsContact CG-NH2 3.32Å; R447-R457 PolarHBondContact O-NH2 3.5Å
448	A	34.7	Very low	36.3	Very low	63 Å²	63	95.8 Å²	95.8	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-64.3	-36.4	-177.5	0	0	0	0	0	113.3	A450 E451 S452	A448-A450 VanDerWaalsContact C-N 3.29Å; A448-A450 PolarHBondContact O-N 2.67Å; A448-E451 PolarHBondContact O-N 3.25Å; A448-S452 PolarHBondContact O-N 2.94Å; A448-S452 PolarHBondContact O-OG 3.47Å
449	A	38.5	Very low	36.6	Very low	66 Å²	66	92.7 Å²	92.7	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-70	-23.5	179.6	0	0	0	0	0	113.7	R447 S452	R447-A449 PolarHBondContact O-N 3.1Å; A449-S452 PolarHBondContact O-OG 2.93Å
450	A	38.8	Very low	37.5	Very low	32 Å²	32	87 Å²	87	26%	0.264	53%	0.525	S	S	.	.	H	α-helix	trans	-80.9	-37.7	171.5	0	0	0	0	0	111.7	R447 A448 S452 A453 R457	R447-A450 PolarHBondContact O-N 3.17Å; A448-A450 VanDerWaalsContact C-N 3.29Å; A448-A450 PolarHBondContact O-N 2.67Å; A450-S452 VanDerWaalsContact C-N 3.28Å; A450-S452 PolarHBondContact O-N 3.29Å; A450-A453 PolarHBondContact O-N 2.73Å; A450-R457 HydrophobicContact CB-CG 4.33Å
451	E	32.4	Very low	37.9	Very low	109 Å²	109	83.3 Å²	83.3	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-22.8	-179.5	-81.9	151.3	-161.7	0	0	113	R447 A448 R457	R447-E451 WeakPolarHBondContact CG-OE1 3.18Å; R447-E451 IonicContact NE-OE1 2.7Å; R447-E451 PolarHBondContact NE-OE1 3.21Å; R447-E451 PolarHBondContact O-N 3.44Å; A448-E451 PolarHBondContact O-N 3.25Å; E451-R457 IonicContact OE1-CZ 3.58Å; E451-R457 IonicContact OE1-NH1 2.73Å; E451-R457 PolarHBondContact OE1-NH1 3.05Å; E451-R457 IonicContact OE1-NH2 2.71Å; E451-R457 PolarHBondContact OE1-NH2 3.07Å
452	S	35.6	Very low	38.9	Very low	103 Å²	103	75.4 Å²	75.4	72%	0.72	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.6	173.1	58.8	0	0	0	0	115.3	A448 A449 A450	A448-S452 PolarHBondContact O-N 2.94Å; A448-S452 PolarHBondContact O-OG 3.47Å; A449-S452 PolarHBondContact O-OG 2.93Å; A450-S452 VanDerWaalsContact C-N 3.28Å; A450-S452 PolarHBondContact O-N 3.29Å
453	A	41.2	Very low	40	Very low	62 Å²	62	73.6 Å²	73.6	51%	0.512	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-12.9	-175.1	0	0	0	0	0	114.2	A450 L455	A450-A453 PolarHBondContact O-N 2.73Å; A453-L455 HydrophobicContact CB-CD1 4.2Å; A453-L455 PolarHBondContact O-N 2.95Å
454	G	34.6	Very low	40.8	Very low	71 Å²	71	73.8 Å²	73.8	73%	0.732	46%	0.456	S	S	*	.			trans	73.2	-5.2	179.5	0	0	0	0	0	116.1
455	L	41.7	Very low	41.5	Very low	79 Å²	79	74.6 Å²	74.6	41%	0.414	46%	0.46	S	S	.	.			trans	-72	133.7	178.4	-84.9	89.5	0	0	0	112.4	A453 R457	A453-L455 HydrophobicContact CB-CD1 4.2Å; A453-L455 PolarHBondContact O-N 2.95Å; L455-R457 PolarHBondContact O-N 2.99Å
456	P	44.3	Very low	42	Very low	33 Å²	33	70.6 Å²	70.6	21%	0.214	43%	0.427	C	S	.	.			trans	-57.9	124.6	162.7	-23.1	34.2	0	0	0	110.4	S458 A459 D743	P456-S458 PolarHBondContact O-N 2.81Å; P456-S458 VanDerWaalsContact O-N 3.11Å; P456-A459 HydrophobicContact CB-CB 4.37Å; P456-A459 WeakPolarHBondContact O-CB 3.44Å; P456-A459 PolarHBondContact O-N 3.45Å; P456-D743 HydrophobicContact CB-CB 4.35Å; P456-D743 HydrophobicContact CG-CB 4.31Å; P456-D743 WeakPolarHBondContact CG-OD2 3.37Å
457	R	36.6	Very low	42.6	Very low	127 Å²	127	70.5 Å²	70.5	48%	0.479	42%	0.416	S	S	.	.	H	α-helix	trans	-57.4	-30.8	-176.8	-69	178.2	171.4	118.9	-0.5	112.7	R447 A450 E451 L455 S461	R447-R457 VanDerWaalsContact CG-NH2 3.32Å; R447-R457 PolarHBondContact O-NH2 3.5Å; A450-R457 HydrophobicContact CB-CG 4.33Å; E451-R457 IonicContact OE1-CZ 3.58Å; E451-R457 IonicContact OE1-NH1 2.73Å; E451-R457 PolarHBondContact OE1-NH1 3.05Å; E451-R457 IonicContact OE1-NH2 2.71Å; E451-R457 PolarHBondContact OE1-NH2 3.07Å; L455-R457 PolarHBondContact O-N 2.99Å; R457-S461 PolarHBondContact O-N 3.03Å
458	S	43.9	Very low	42.6	Very low	26 Å²	26	70.2 Å²	70.2	18%	0.182	43%	0.426	C	S	.	.	H	α-helix	trans	-67.8	-40.4	177.2	-171.9	0	0	0	0	112.6	P456 S460 S461 L462 V782	P456-S458 PolarHBondContact O-N 2.81Å; P456-S458 VanDerWaalsContact O-N 3.11Å; S458-S460 PolarHBondContact O-N 3.3Å; S458-S461 WeakPolarHBondContact O-CB 3.5Å; S458-S461 PolarHBondContact O-N 2.94Å; S458-S461 VanDerWaalsContact O-N 3.09Å; S458-L462 PolarHBondContact O-N 2.97Å; S458-V782 PolarHBondContact OG-O 3.03Å
459	A	41.4	Very low	42.8	Very low	12 Å²	12	68.5 Å²	68.5	10%	0.099	41%	0.41	C	S	.	.	H	α-helix	trans	-62	-42.7	177.8	0	0	0	0	0	112.7	P456 S461 L462 L463 F746 I747	P456-A459 HydrophobicContact CB-CB 4.37Å; P456-A459 WeakPolarHBondContact O-CB 3.44Å; P456-A459 PolarHBondContact O-N 3.45Å; A459-S461 VanDerWaalsContact C-N 3.29Å; A459-S461 PolarHBondContact O-N 3.41Å; A459-L462 PolarHBondContact O-N 3.11Å; A459-L463 WeakPolarHBondContact O-CG 3.19Å; A459-L463 PolarHBondContact O-N 3.05Å; A459-F746 HydrophobicContact CB-CE1 4.32Å; A459-I747 HydrophobicContact CB-CG1 3.99Å
460	S	47.1	Very low	42.8	Very low	53 Å²	53	68.5 Å²	68.5	37%	0.371	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-30	175.2	-174.9	0	0	0	0	112.7	S458 M464	S458-S460 PolarHBondContact O-N 3.3Å; S460-M464 WeakPolarHBondContact O-CG 3.22Å; S460-M464 PolarHBondContact O-N 3.37Å
461	S	47.5	Very low	42.6	Very low	79 Å²	79	72 Å²	72	55%	0.552	42%	0.42	S	S	*	.	H	α-helix	trans	-69.2	-45.4	173.6	-166.1	0	0	0	0	110.8	R457 S458 A459 L463 M464 A465	R457-S461 PolarHBondContact O-N 3.03Å; S458-S461 WeakPolarHBondContact O-CB 3.5Å; S458-S461 PolarHBondContact O-N 2.94Å; S458-S461 VanDerWaalsContact O-N 3.09Å; A459-S461 VanDerWaalsContact C-N 3.29Å; A459-S461 PolarHBondContact O-N 3.41Å; S461-L463 PolarHBondContact O-N 3.02Å; S461-M464 WeakPolarHBondContact O-CB 3.5Å; S461-M464 PolarHBondContact O-N 3.28Å; S461-A465 PolarHBondContact O-N 2.93Å
462	L	52.6	Low	42.6	Very low	7 Å²	7	70.9 Å²	70.9	4%	0.037	42%	0.415	C	S	.	.	H	α-helix	trans	-57.8	-45.7	176	-164.4	100.1	0	0	0	111.7	S458 A459 M464 A465 F466 I747 F750 A751 L754 L779 V782	S458-L462 PolarHBondContact O-N 2.97Å; A459-L462 PolarHBondContact O-N 3.11Å; L462-M464 PolarHBondContact O-N 2.93Å; L462-A465 WeakPolarHBondContact O-CB 3.43Å; L462-A465 PolarHBondContact O-N 2.94Å; L462-F466 HydrophobicContact CD1-CD2 4.47Å; L462-F466 HydrophobicContact CD1-CE2 3.95Å; L462-F466 HydrophobicContact CD2-CD2 4.08Å; L462-F466 HydrophobicContact CD2-CE2 3.99Å; L462-F466 HydrophobicContact CG-CD2 3.82Å; L462-F466 HydrophobicContact CG-CE2 3.76Å; L462-F466 WeakPolarHBondContact O-CD2 3.13Å; L462-F466 PolarHBondContact O-N 2.93Å; L462-I747 HydrophobicContact CB-CG2 4.07Å; L462-I747 HydrophobicContact CD1-CG2 3.82Å; L462-I747 HydrophobicContact CD2-CG2 3.93Å; L462-I747 HydrophobicContact CG-CG2 4.12Å; L462-F750 HydrophobicContact CD2-CB 4.41Å; L462-A751 HydrophobicContact CD1-CB 4.38Å; L462-A751 HydrophobicContact CD2-CB 4.06Å; L462-L754 HydrophobicContact CD2-CD1 4.42Å; L462-L779 HydrophobicContact CD1-CD2 3.79Å; L462-V782 HydrophobicContact CD1-CG2 4.15Å
463	L	56.4	Low	42.6	Very low	88 Å²	88	68.6 Å²	68.6	46%	0.461	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-26.2	176.4	-72.3	170.3	0	0	0	113.4	A459 S461	A459-L463 WeakPolarHBondContact O-CG 3.19Å; A459-L463 PolarHBondContact O-N 3.05Å; S461-L463 PolarHBondContact O-N 3.02Å
464	M	52	Low	42.1	Very low	112 Å²	112	73 Å²	73	55%	0.552	41%	0.409	S	S	*	.	H	α-helix	trans	-78.1	-36.3	170.5	-67	-67.7	177.6	0	0	112.1	S460 S461 L462 R467	S460-M464 WeakPolarHBondContact O-CG 3.22Å; S460-M464 PolarHBondContact O-N 3.37Å; S461-M464 WeakPolarHBondContact O-CB 3.5Å; S461-M464 PolarHBondContact O-N 3.28Å; L462-M464 PolarHBondContact O-N 2.93Å; M464-R467 WeakPolarHBondContact O-CB 3.31Å; M464-R467 PolarHBondContact O-N 2.93Å; M464-R467 PolarHBondContact SD-NH1 2.94Å
465	A	45.9	Very low	41.9	Very low	49 Å²	49	73.5 Å²	73.5	41%	0.405	40%	0.402	S	S	.	.	H	α-helix	trans	-65.3	-39	176.3	0	0	0	0	0	112.9	S461 L462 R467	S461-A465 PolarHBondContact O-N 2.93Å; L462-A465 WeakPolarHBondContact O-CB 3.43Å; L462-A465 PolarHBondContact O-N 2.94Å; A465-R467 VanDerWaalsContact C-N 3.29Å; A465-R467 PolarHBondContact O-N 2.85Å
466	F	46.6	Very low	41.4	Very low	1 Å²	1	78.1 Å²	78.1	0%	0.004	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	3.4	175.8	-75.7	-81.1	0	0	0	114.6	L462 D468 V469 T470 A751 L754 M770 F775 N778	L462-F466 HydrophobicContact CD1-CD2 4.47Å; L462-F466 HydrophobicContact CD1-CE2 3.95Å; L462-F466 HydrophobicContact CD2-CD2 4.08Å; L462-F466 HydrophobicContact CD2-CE2 3.99Å; L462-F466 HydrophobicContact CG-CD2 3.82Å; L462-F466 HydrophobicContact CG-CE2 3.76Å; L462-F466 WeakPolarHBondContact O-CD2 3.13Å; L462-F466 PolarHBondContact O-N 2.93Å; F466-D468 VanDerWaalsContact C-N 3.33Å; F466-D468 PolarHBondContact O-N 3.24Å; F466-V469 PolarHBondContact O-N 2.72Å; F466-V469 VanDerWaalsContact O-N 3.12Å; F466-T470 PolarHBondContact O-N 2.69Å; F466-T470 VanDerWaalsContact O-N 3.15Å; F466-T470 PolarHBondContact O-OG1 3.41Å; F466-A751 HydrophobicContact CE2-CB 4.15Å; F466-A751 HydrophobicContact CZ-CB 4.24Å; F466-L754 HydrophobicContact CB-CD1 3.9Å; F466-L754 HydrophobicContact CD1-CB 3.91Å; F466-L754 HydrophobicContact CD1-CD1 4.3Å; F466-L754 HydrophobicContact CD2-CD1 3.69Å; F466-L754 HydrophobicContact CE1-CB 4.05Å; F466-L754 HydrophobicContact CE2-CD1 4.29Å; F466-L754 HydrophobicContact CG-CB 4.19Å; F466-L754 HydrophobicContact CG-CD1 3.71Å; F466-L754 HydrophobicContact CG-CG 4.48Å; F466-L754 HydrophobicContact CZ-CB 4.49Å; F466-M770 HydrophobicContact CD1-SD 4.46Å; F466-M770 HydrophobicContact CE1-CE 3.68Å; F466-M770 HydrophobicContact CE1-SD 3.56Å; F466-M770 VanDerWaalsContact CE1-SD 3.56Å; F466-M770 HydrophobicContact CZ-CE 4.31Å; F466-M770 HydrophobicContact CZ-SD 4.15Å; F466-F775 HydrophobicContact CZ-CD2 4.34Å; F466-F775 HydrophobicContact CZ-CE2 4.46Å; F466-N778 HydrophobicContact CE2-CB 4.43Å; F466-N778 HydrophobicContact CZ-CB 4.29Å
467	R	45.8	Very low	40.8	Very low	149 Å²	149	81.9 Å²	81.9	56%	0.562	45%	0.454	S	S	*	.	H	α-helix	trans	-63.8	-33.9	-172.1	-169.9	170.3	178.8	159.4	1	113.6	M464 A465 V469 V471	M464-R467 WeakPolarHBondContact O-CB 3.31Å; M464-R467 PolarHBondContact O-N 2.93Å; M464-R467 PolarHBondContact SD-NH1 2.94Å; A465-R467 VanDerWaalsContact C-N 3.29Å; A465-R467 PolarHBondContact O-N 2.85Å; R467-V469 VanDerWaalsContact C-N 3.29Å; R467-V469 PolarHBondContact O-N 2.99Å; R467-V471 WeakPolarHBondContact O-CG2 3.46Å
468	D	36.5	Very low	40.5	Very low	153 Å²	153	79.8 Å²	79.8	82%	0.818	46%	0.458	S	S	*	.	H	α-helix	trans	-74.8	-17.7	178	-78	-23.8	0	0	0	113.8	F466	F466-D468 VanDerWaalsContact C-N 3.33Å; F466-D468 PolarHBondContact O-N 3.24Å
469	V	40.5	Very low	39.8	Very low	28 Å²	28	89 Å²	89	17%	0.17	49%	0.491	C	S	.	.	H	α-helix	trans	-86.3	-49.6	177.1	173.7	0	0	0	0	110.8	F466 R467 V471 D758 I764	F466-V469 PolarHBondContact O-N 2.72Å; F466-V469 VanDerWaalsContact O-N 3.12Å; R467-V469 VanDerWaalsContact C-N 3.29Å; R467-V469 PolarHBondContact O-N 2.99Å; V469-V471 PolarHBondContact O-N 3.4Å; V469-D758 HydrophobicContact CG1-CB 3.75Å; V469-D758 WeakPolarHBondContact CG1-OD1 3.39Å; V469-I764 HydrophobicContact CG1-CD1 4.17Å
470	T	37.7	Very low	39.1	Very low	66 Å²	66	94 Å²	94	41%	0.405	52%	0.52	S	S	.	.	H	α-helix	trans	-67.8	-22.2	-168.2	-44.2	0	0	0	0	113.6	F466 H472 I473	F466-T470 PolarHBondContact O-N 2.69Å; F466-T470 VanDerWaalsContact O-N 3.15Å; F466-T470 PolarHBondContact O-OG1 3.41Å; T470-H472 PolarHBondContact O-N 3.46Å; T470-I473 WeakPolarHBondContact O-CD1 3.31Å; T470-I473 PolarHBondContact O-N 2.97Å
471	V	35.3	Very low	37.9	Very low	104 Å²	104	99.8 Å²	99.8	63%	0.63	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-4.1	-175.5	165.5	0	0	0	0	115	R467 V469	R467-V471 WeakPolarHBondContact O-CG2 3.46Å; V469-V471 PolarHBondContact O-N 3.4Å
472	H	32	Very low	36.8	Very low	86 Å²	86	100.7 Å²	100.7	40%	0.398	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.9	8.6	-177.6	-75.8	78.3	0	0	0	116.1	T470 N763 I764	T470-H472 PolarHBondContact O-N 3.46Å; H472-N763 VanDerWaalsContact O-CB 3.23Å; H472-N763 WeakPolarHBondContact O-CB 3.46Å; H472-N763 PolarHBondContact O-ND2 2.71Å; H472-I764 HydrophobicContact CB-CG1 4.36Å
473	I	36	Very low	35.5	Very low	56 Å²	56	106.5 Å²	106.5	29%	0.287	59%	0.593	S	S	.	*	S	Bend	trans	-85.5	-43	-179.8	-70.5	86	0	0	0	112.3	T470 S475 T757 N763 I764	T470-I473 WeakPolarHBondContact O-CD1 3.31Å; T470-I473 PolarHBondContact O-N 2.97Å; I473-S475 PolarHBondContact O-N 2.91Å; I473-T757 HydrophobicContact CD1-CG2 3.84Å; I473-T757 HydrophobicContact CG1-CG2 3.63Å; I473-N763 PolarHBondContact O-ND2 3.43Å; I473-I764 HydrophobicContact CD1-CD1 4.27Å
474	D	30.1	Very low	34.1	Very low	153 Å²	153	106.3 Å²	106.3	82%	0.818	60%	0.604	S	S	*	*			trans	-81.2	79.5	-178.4	-68.6	-40.7	0	0	0	112.7
475	S	30.9	Very low	32.9	Very low	82 Å²	82	107.6 Å²	107.6	57%	0.573	62%	0.618	S	S	*	*			trans	-138.8	6.1	178.4	-72	0	0	0	0	116	I473	I473-S475 PolarHBondContact O-N 2.91Å
476	N	30.2	Very low	31.9	Very low	177 Å²	177	109.8 Å²	109.8	95%	0.947	63%	0.627	S	S	*	*	S	Bend	trans	-106.8	17.6	168.1	-101.3	4.7	0	0	0	113.7
477	S	31.7	Very low	30.8	Very low	111 Å²	111	116 Å²	116	78%	0.776	67%	0.665	S	S	*	*	S	Bend	trans	-116.8	108.1	160.9	-173.4	0	0	0	0	108.4
478	S	29.8	Very low	29.9	Very low	83 Å²	83	114.4 Å²	114.4	58%	0.58	67%	0.672	S	S	*	*			trans	-102.3	138.9	174.4	58.7	0	0	0	0	109.6
479	Y	28.9	Very low	29.3	Very low	219 Å²	219	113.9 Å²	113.9	86%	0.859	68%	0.675	S	S	*	*			cis	-137.6	171	30.4	-78.3	-88.1	0	0	0	115
480	T	26.9	Very low	28.5	Very low	117 Å²	117	119.4 Å²	119.4	72%	0.718	71%	0.709	S	S	*	*			trans	-105.4	151.3	-168	52.7	0	0	0	0	114.6
481	I	22.3	Very low	27.9	Very low	175 Å²	175	121.4 Å²	121.4	90%	0.897	73%	0.725	S	S	*	*			trans	-136.9	145.9	130.5	-65	-169.6	0	0	0	107.5
482	S	25.3	Very low	27.7	Very low	99 Å²	99	124.8 Å²	124.8	69%	0.692	74%	0.739	S	S	*	*			trans	-137.9	156.1	-177	-43.2	0	0	0	0	111.6
483	S	25.3	Very low	27.3	Very low	129 Å²	129	124.3 Å²	124.3	90%	0.902	76%	0.757	S	S	*	*			trans	-154.9	145.7	159.7	-80.6	0	0	0	0	110.3
484	A	27.1	Very low	27	Very low	84 Å²	84	129.5 Å²	129.5	69%	0.694	79%	0.786	S	S	*	*			trans	-148.1	161.8	-169.9	0	0	0	0	0	112.4
485	T	26.7	Very low	26.8	Very low	138 Å²	138	126.5 Å²	126.5	85%	0.847	78%	0.782	S	S	*	*			trans	-129.6	161.8	176	-45.2	0	0	0	0	110
486	T	24.3	Very low	26.5	Very low	95 Å²	95	128.7 Å²	128.7	58%	0.583	80%	0.797	S	S	*	*			trans	-146.4	144.8	-148.5	52.5	0	0	0	0	114.2
487	T	24.7	Very low	26.3	Very low	132 Å²	132	124.2 Å²	124.2	81%	0.81	79%	0.793	S	S	*	*			trans	-137.1	122.4	152.5	41.1	0	0	0	0	107.1
488	T	26.1	Very low	26	Very low	115 Å²	115	122.5 Å²	122.5	71%	0.706	79%	0.793	S	S	*	*				70.9	97.8	60.9	63.6	0	0	0	0	114.6
489	T	23.7	Very low	25.8	Very low	143 Å²	143	127.9 Å²	127.9	88%	0.877	81%	0.809	S	S	*	*			trans	-83.5	156.1	165.8	48.6	0	0	0	0	111.7
490	T	24	Very low	25.7	Very low	144 Å²	144	123.7 Å²	123.7	88%	0.883	81%	0.811	S	S	*	*			trans	-123.5	149.8	168.9	48.6	0	0	0	0	110.4
491	S	24.1	Very low	25.6	Very low	108 Å²	108	121.7 Å²	121.7	76%	0.755	82%	0.815	S	S	*	*			trans	-145.9	111.7	179.4	59.5	0	0	0	0	112.5
492	L	31.2	Very low	25.9	Very low	174 Å²	174	118.9 Å²	118.9	91%	0.911	81%	0.81	S	S	*	*			trans	46.5	131.7	148	-64.7	167.6	0	0	0	121.1
493	G	24.7	Very low	25.9	Very low	76 Å²	76	125.8 Å²	125.8	78%	0.784	82%	0.821	S	S	*	*			trans	-152.8	124.8	159.4	0	0	0	0	0	110.7
494	N	30.1	Very low	25.8	Very low	166 Å²	166	129 Å²	129	89%	0.888	82%	0.819	S	S	*	*			trans	-95.3	156.9	-178.5	-92.3	10.2	0	0	0	112.4
495	A	24.4	Very low	26.4	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	82%	0.822	S	S	*	*			trans	-149.1	127.6	162.4	0	0	0	0	0	114.3
496	S	25.8	Very low	26.3	Very low	127 Å²	127	128.4 Å²	128.4	89%	0.888	81%	0.813	S	S	*	*			trans	62.3	135.4	150.9	58.6	0	0	0	0	122.8
497	G	25.5	Very low	26.5	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	83%	0.825	S	S	*	*			trans	101.7	136	168.7	0	0	0	0	0	114.5
498	G	24.9	Very low	26.6	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	82%	0.823	S	S	*	*			cis	173.3	121.5	-10.4	0	0	0	0	0	113.4
499	E	25.5	Very low	26.6	Very low	196 Å²	196	126.8 Å²	126.8	92%	0.916	82%	0.818	S	S	*	*			trans	62.1	142.5	162.8	-68.6	-163.1	83	0	0	124.2
500	S	27.1	Very low	26.9	Very low	131 Å²	131	127.4 Å²	127.4	92%	0.916	82%	0.822	S	S	*	*			trans	68.8	148.8	148.3	-151.9	0	0	0	0	121.5
501	G	25.8	Very low	27	Very low	76 Å²	76	124.2 Å²	124.2	78%	0.784	82%	0.818	S	S	*	*			trans	144.4	39.8	174.7	0	0	0	0	0	118.3
502	S	27.2	Very low	27.2	Very low	115 Å²	115	123.2 Å²	123.2	80%	0.804	82%	0.824	S	S	*	*			trans	-81	128.3	-178.5	-178.5	0	0	0	0	114.1
503	R	25.5	Very low	27.1	Very low	245 Å²	245	119 Å²	119	93%	0.925	82%	0.823	S	S	*	*			trans	-168.8	119	140.6	-105.2	157.3	-165.8	-160.3	2.6	114.8
504	K	24	Very low	27.2	Very low	196 Å²	196	119.2 Å²	119.2	85%	0.852	83%	0.825	S	S	*	*			trans	-78.8	-180	149.6	-76.5	-175.5	177.2	-179.4	0	108.9
505	P	38.2	Very low	27.1	Very low	117 Å²	117	119.9 Å²	119.9	76%	0.76	83%	0.829	S	S	*	*			cis	-129.6	-155.5	9.7	29.3	-1.7	0	0	0	111.6
506	S	25.6	Very low	27.2	Very low	93 Å²	93	119.3 Å²	119.3	65%	0.65	83%	0.831	S	S	*	*			cis	-168.2	157	16.8	-14.8	0	0	0	0	112.7
507	V	27.9	Very low	27.2	Very low	138 Å²	138	122.5 Å²	122.5	84%	0.836	83%	0.832	S	S	*	*			trans	63	138.3	141.2	170.9	0	0	0	0	117.5
508	S	27	Very low	27.2	Very low	111 Å²	111	122.9 Å²	122.9	78%	0.776	82%	0.821	S	S	*	*			cis	-162	169.1	-7.4	41.1	0	0	0	0	107.3
509	G	26.7	Very low	27.2	Very low	58 Å²	58	127.4 Å²	127.4	60%	0.598	83%	0.825	S	S	*	*			cis	137.9	134	1.6	0	0	0	0	0	110.8
510	T	29.7	Very low	27.1	Very low	157 Å²	157	126.7 Å²	126.7	96%	0.963	82%	0.822	S	S	*	*			trans	58.8	153.9	-179.1	47.6	0	0	0	0	117.1
511	G	25.9	Very low	27.1	Very low	77 Å²	77	128.2 Å²	128.2	79%	0.794	81%	0.814	S	S	*	*			cis	144.4	132.4	-8.8	0	0	0	0	0	113.3
512	G	27.8	Very low	27.3	Very low	87 Å²	87	130.3 Å²	130.3	90%	0.897	81%	0.814	S	S	*	*			trans	99.3	158.3	176.4	0	0	0	0	0	114.6
513	G	28.9	Very low	27.2	Very low	86 Å²	86	133 Å²	133	89%	0.887	81%	0.814	S	S	*	*			trans	-149.9	172	175.4	0	0	0	0	0	110.8
514	G	27.6	Very low	27.2	Very low	80 Å²	80	131 Å²	131	83%	0.825	81%	0.812	S	S	*	*			trans	-179.5	140.3	177	0	0	0	0	0	112.1
515	D	27.5	Very low	27.5	Very low	180 Å²	180	127.1 Å²	127.1	96%	0.963	81%	0.807	S	S	*	*			trans	-82.7	145.6	174.2	-75.9	-62.7	0	0	0	111.7
516	G	27.3	Very low	27.1	Very low	77 Å²	77	125.8 Å²	125.8	79%	0.794	81%	0.806	S	S	*	*			trans	-170.3	112.4	177.2	0	0	0	0	0	113.4
517	Q	26.3	Very low	27.2	Very low	194 Å²	194	127 Å²	127	91%	0.907	81%	0.812	S	S	*	*			trans	-68.2	156.6	165.8	-70.4	168.2	1.3	0	0	109.8
518	S	23.9	Very low	27.5	Very low	92 Å²	92	126.3 Å²	126.3	64%	0.643	81%	0.81	S	S	*	*			cis	-170.9	155.8	0.4	42.9	0	0	0	0	108.4
519	M	25.6	Very low	27.7	Very low	170 Å²	170	126.7 Å²	126.7	84%	0.837	81%	0.81	S	S	*	*			trans	-159.8	173.6	149.9	-133.6	81.1	-87.2	0	0	111.4
520	E	24.5	Very low	27.7	Very low	181 Å²	181	129.8 Å²	129.8	85%	0.846	82%	0.822	S	S	*	*			trans	-72.9	159.1	-151.8	-66.9	168.8	112.7	0	0	118.3
521	E	26	Very low	27.6	Very low	163 Å²	163	131.3 Å²	131.3	76%	0.762	82%	0.818	S	S	*	*			trans	-86.8	142.6	176.8	174.4	-178	172.1	0	0	111.9
522	P	29.1	Very low	27.4	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	82%	0.822	S	S	*	*			trans	-128.5	137.9	136.8	5	16.6	0	0	0	113
523	E	25.7	Very low	27.4	Very low	171 Å²	171	140.7 Å²	140.7	80%	0.799	82%	0.823	S	S	*	*			trans	-57.9	148.7	174.8	-68.1	172.3	92.2	0	0	113.4
524	F	26.7	Very low	27	Very low	202 Å²	202	145.4 Å²	145.4	89%	0.886	82%	0.822	S	S	*	*			trans	-106.3	149.6	157.3	-113.4	-112.6	0	0	0	109.5
525	P	29.8	Very low	27	Very low	116 Å²	116	150.7 Å²	150.7	75%	0.753	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-81.3	152.6	-150.2	30.8	-37	0	0	0	115.4
526	A	28.8	Very low	26.9	Very low	89 Å²	89	148.6 Å²	148.6	74%	0.736	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-70.6	156.4	173.8	0	0	0	0	0	113.5
527	P	29.3	Very low	26.7	Very low	119 Å²	119	151.3 Å²	151.3	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.9	146.4	168.7	30.6	-35.2	0	0	0	111.6
528	P	33.8	Very low	26.9	Very low	122 Å²	122	148.1 Å²	148.1	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-74.1	151.3	174.2	31.2	-34.5	0	0	0	112.2
529	P	30	Very low	26.9	Very low	120 Å²	120	146.3 Å²	146.3	78%	0.779	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-85.8	170	-173.4	35.9	-37.6	0	0	0	114
530	S	26.5	Very low	26.9	Very low	122 Å²	122	143.7 Å²	143.7	85%	0.853	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-94.8	137.5	156.4	-57.4	0	0	0	0	109.3
531	E	27.9	Very low	26.9	Very low	189 Å²	189	146 Å²	146	88%	0.883	81%	0.809	S	S	*	*			trans	-154.7	165.6	164.2	-139.3	165.7	-143	0	0	111.7
532	E	23.2	Very low	26.9	Very low	185 Å²	185	150.1 Å²	150.1	86%	0.864	82%	0.817	S	S	*	*			trans	-83.7	165.8	-169.2	-61.6	171.5	97.9	0	0	113.6
533	L	26.5	Very low	26.6	Very low	177 Å²	177	147.6 Å²	147.6	93%	0.927	81%	0.813	S	S	*	*			trans	-135.6	117.1	160.7	-85.3	175.8	0	0	0	111.4
534	E	21.7	Very low	26.6	Very low	184 Å²	184	145.3 Å²	145.3	86%	0.86	82%	0.816	S	S	*	*			trans	-68.1	162.5	156.3	-65	-170.3	127.2	0	0	110.6
535	M	26.6	Very low	26.5	Very low	192 Å²	192	140.5 Å²	140.5	95%	0.946	81%	0.813	S	S	*	*			trans	-107.1	141.1	164	-67.6	-159.4	-58.3	0	0	110.9
536	V	25.2	Very low	26.3	Very low	136 Å²	136	139.3 Å²	139.3	82%	0.824	81%	0.814	S	S	*	*			trans	-98	140.5	-167.8	174	0	0	0	0	112.6
537	D	23.3	Very low	26.7	Very low	133 Å²	133	141.3 Å²	141.3	71%	0.711	82%	0.819	S	S	*	*			trans	-78.6	142.7	171.5	170.2	68.8	0	0	0	113.4	G539	D537-G539 PolarHBondContact OD2-N 3.12Å
538	P	31.3	Very low	26.5	Very low	127 Å²	127	140.3 Å²	140.3	83%	0.825	82%	0.821	S	S	*	*			trans	-119.5	67.1	166.5	40.6	-29.1	0	0	0	114.8
539	G	23	Very low	26.1	Very low	55 Å²	55	139.4 Å²	139.4	57%	0.567	82%	0.824	S	S	*	*				116.6	128	115.4	0	0	0	0	0	121.9	D537	D537-G539 PolarHBondContact OD2-N 3.12Å
540	S	25.3	Very low	25.9	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	83%	0.825	S	S	*	*			trans	91.1	136.5	137.7	-136.2	0	0	0	0	120.8
541	R	25.4	Very low	25.8	Very low	230 Å²	230	135.8 Å²	135.8	87%	0.868	82%	0.818	S	S	*	*			trans	78.6	88.8	159.7	-58.6	-175.7	179	-165.6	-1	120.6
542	R	25.2	Very low	25.7	Very low	249 Å²	249	134 Å²	134	94%	0.94	82%	0.82	S	S	*	*				59.4	107.1	108	-171.2	-162.2	-141.7	-137.8	7.5	118.6
543	G	23.5	Very low	25.8	Very low	67 Å²	67	128.3 Å²	128.3	69%	0.691	81%	0.81	S	S	*	*			trans	150.4	102.8	139.6	0	0	0	0	0	119
544	S	26.2	Very low	25.8	Very low	124 Å²	124	128.4 Å²	128.4	87%	0.867	81%	0.808	S	S	*	*			trans	47	133	135.8	-54.5	0	0	0	0	123.9
545	A	24.1	Very low	25.9	Very low	100 Å²	100	128.6 Å²	128.6	83%	0.826	81%	0.809	S	S	*	*			trans	80.1	131.8	136.5	0	0	0	0	0	120.9
546	A	24.7	Very low	25.7	Very low	92 Å²	92	122.5 Å²	122.5	76%	0.76	80%	0.795	S	S	*	*			trans	-81.1	162.7	149.7	0	0	0	0	0	109.1
547	P	38.3	Very low	25.8	Very low	130 Å²	130	124.7 Å²	124.7	84%	0.844	80%	0.797	S	S	*	*				-147.3	-172.6	76.3	40.4	-21.7	0	0	0	115.3
548	A	24.9	Very low	26	Very low	99 Å²	99	124.4 Å²	124.4	82%	0.818	80%	0.795	S	S	*	*			trans	-79.5	168.2	-179	0	0	0	0	0	115.2
549	A	25.2	Very low	25.8	Very low	102 Å²	102	123.2 Å²	123.2	84%	0.843	79%	0.789	S	S	*	*			trans	-150.4	169.6	155.6	0	0	0	0	0	111.5
550	A	25.4	Very low	26.1	Very low	99 Å²	99	125 Å²	125	82%	0.818	79%	0.794	S	S	*	*			trans	-63.5	172.4	-177.1	0	0	0	0	0	114.9
551	G	25.1	Very low	26.3	Very low	67 Å²	67	126.1 Å²	126.1	69%	0.691	79%	0.79	S	S	*	*			cis	121.2	158.5	-1.1	0	0	0	0	0	114.3
552	V	26.2	Very low	26.6	Very low	153 Å²	153	127.1 Å²	127.1	93%	0.927	79%	0.794	S	S	*	*			trans	72.5	126.4	168.6	-172	0	0	0	0	118.5
553	G	24	Very low	26.8	Very low	64 Å²	64	124 Å²	124	66%	0.66	80%	0.795	S	S	*	*				108.6	100.2	126.3	0	0	0	0	0	120.9
554	M	27.1	Very low	27	Very low	180 Å²	180	124.7 Å²	124.7	89%	0.887	80%	0.803	S	S	*	*				56.6	154.9	121.9	-136	67.3	166.6	0	0	122.7
555	E	23.6	Very low	27.1	Very low	188 Å²	188	124.4 Å²	124.4	88%	0.879	80%	0.801	S	S	*	*			trans	70	150.1	167.1	-53.8	-176.7	175.7	0	0	116.3
556	G	23.3	Very low	27.3	Very low	64 Å²	64	124.4 Å²	124.4	66%	0.66	80%	0.795	S	S	*	*			cis	146.7	136.1	-8.7	0	0	0	0	0	112.5
557	E	26.9	Very low	27.3	Very low	182 Å²	182	126 Å²	126	85%	0.85	80%	0.795	S	S	*	*			trans	67.1	151.8	161.6	-66.7	-154.3	91.5	0	0	118
558	N	27.6	Very low	26.7	Very low	127 Å²	127	124.9 Å²	124.9	68%	0.679	79%	0.79	S	S	*	*			cis	-157.2	-175.5	-23.2	-138.9	-36.1	0	0	0	111.8
559	S	26.7	Very low	26.7	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	79%	0.788	S	S	*	*			trans	82.9	135.6	162.1	-54.4	0	0	0	0	118.1
560	S	30	Very low	26.9	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	78%	0.783	S	S	*	*			cis	-157.2	142.2	-5.3	-117.3	0	0	0	0	114.3
561	D	29.6	Very low	26.9	Very low	136 Å²	136	128.4 Å²	128.4	73%	0.727	79%	0.786	S	S	*	*			trans	44.2	121.3	144.2	-50.5	-63.6	0	0	0	121.9
562	R	30.1	Very low	27	Very low	251 Å²	251	129.7 Å²	129.7	95%	0.947	78%	0.784	S	S	*	*				-173.3	168.1	85.8	-93.7	-166.9	175.7	-152.2	-5.3	114.2
563	L	30.7	Very low	27.1	Very low	184 Å²	184	129 Å²	129	96%	0.963	78%	0.781	S	S	*	*			trans	-88.9	153.6	-171.5	-63.4	156	0	0	0	113.8
564	G	27.7	Very low	27.2	Very low	82 Å²	82	131.7 Å²	131.7	85%	0.845	79%	0.789	S	S	*	*			trans	173.2	137	164.6	0	0	0	0	0	112.7
565	S	28.5	Very low	27.3	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	79%	0.785	S	S	*	*			trans	-140	175.8	-174.8	-167.4	0	0	0	0	113
566	S	28	Very low	27.4	Very low	100 Å²	100	127.6 Å²	127.6	70%	0.699	79%	0.785	S	S	*	*			trans	75.4	101.6	162.1	53	0	0	0	0	121.9
567	T	24.5	Very low	27.5	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	79%	0.792	S	S	*	*				65.9	121.9	108	-49	0	0	0	0	122.6
568	S	25.8	Very low	27.5	Very low	107 Å²	107	128 Å²	128	75%	0.748	79%	0.793	S	S	*	*			trans	69.6	151.7	155	74.9	0	0	0	0	117.4
569	T	24.4	Very low	27.5	Very low	126 Å²	126	128.4 Å²	128.4	77%	0.773	80%	0.799	S	S	*	*			cis	-150.1	166.4	25.8	-58.9	0	0	0	0	112.3
570	S	29.3	Very low	28	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	81%	0.807	S	S	*	*			trans	-56.1	149	-178.3	-37	0	0	0	0	118.3
571	T	26.7	Very low	27.9	Very low	141 Å²	141	128.9 Å²	128.9	87%	0.865	81%	0.811	S	S	*	*			trans	-159.4	147.8	140.1	-8.2	0	0	0	0	115.6
572	S	27.1	Very low	28	Very low	94 Å²	94	126 Å²	126	66%	0.657	81%	0.814	S	S	*	*			trans	-9.1	129.2	165.3	54.2	0	0	0	0	124.3
573	T	28	Very low	28.2	Very low	140 Å²	140	118.7 Å²	118.7	86%	0.859	80%	0.799	S	S	*	*				55.2	112.6	117.3	-37.4	0	0	0	0	122.3
574	S	26.3	Very low	28.4	Very low	119 Å²	119	112.9 Å²	112.9	83%	0.832	77%	0.774	S	S	*	*				-167.4	162.3	128.6	67	0	0	0	0	111.4
575	I	29.5	Very low	29.2	Very low	156 Å²	156	113.6 Å²	113.6	80%	0.8	76%	0.763	S	S	*	*			trans	-108.8	138.9	-177.3	-60.4	162.4	0	0	0	110.3
576	S	24.2	Very low	29.5	Very low	126 Å²	126	113.4 Å²	113.4	88%	0.881	75%	0.753	S	S	*	*			trans	-163.2	154.5	148.2	-84.6	0	0	0	0	111.5
577	T	27	Very low	29.7	Very low	133 Å²	133	110.7 Å²	110.7	82%	0.816	73%	0.734	S	S	*	*			trans	-107.8	148	-167.9	39.8	0	0	0	0	114
578	S	25.3	Very low	30.3	Very low	123 Å²	123	110 Å²	110	86%	0.86	73%	0.725	S	S	*	*			trans	-153	137.2	151.7	60.4	0	0	0	0	110.9
579	V	27.9	Very low	30.7	Very low	135 Å²	135	111.5 Å²	111.5	82%	0.818	72%	0.72	S	S	*	*			trans	-128.4	130.8	-177.3	166	0	0	0	0	105.5
580	P	37.8	Very low	31.1	Very low	132 Å²	132	108.7 Å²	108.7	86%	0.857	71%	0.709	S	S	*	*				-147.4	153.7	90.8	37.4	-19.3	0	0	0	116.5
581	G	27.7	Very low	31.4	Very low	72 Å²	72	109.8 Å²	109.8	74%	0.742	71%	0.706	S	S	*	*			trans	151.8	76	173.4	0	0	0	0	0	112.9
582	G	30.7	Very low	32	Very low	77 Å²	77	105.7 Å²	105.7	79%	0.794	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-69.3	133.1	177	0	0	0	0	0	111.9
583	P	34.5	Very low	32.3	Very low	97 Å²	97	107 Å²	107	63%	0.63	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-77.5	150.7	-177.7	32	-35.7	0	0	0	112.7
584	S	35.7	Very low	32.5	Very low	62 Å²	62	104.8 Å²	104.8	43%	0.434	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-66.8	157.3	177.9	59.9	0	0	0	0	112.9	D586 S587	S584-D586 PolarHBondContact O-N 3.16Å; S584-D586 VanDerWaalsContact O-N 3.13Å; S584-S587 WeakPolarHBondContact O-CB 3.44Å; S584-S587 PolarHBondContact O-N 3.42Å; S584-S587 PolarHBondContact O-OG 3.32Å; S584-S587 PolarHBondContact OG-OG 3.39Å
585	P	43.7	Very low	32.9	Very low	97 Å²	97	103.2 Å²	103.2	63%	0.63	66%	0.657	S	S	*	*	H	α-helix	trans	-57.8	-28.2	-179.3	21.1	-33.8	0	0	0	114.5	S587 L588 Q589	P585-S587 PolarHBondContact O-N 2.99Å; P585-L588 PolarHBondContact O-N 3.43Å; P585-Q589 PolarHBondContact O-N 3.14Å
586	D	34.9	Very low	33.2	Very low	114 Å²	114	101.4 Å²	101.4	61%	0.61	66%	0.655	S	S	*	*	H	α-helix	trans	-64.4	-29.9	174.5	-57.6	-58.2	0	0	0	112.7	S584 L588 Q589 A590	S584-D586 PolarHBondContact O-N 3.16Å; S584-D586 VanDerWaalsContact O-N 3.13Å; D586-L588 VanDerWaalsContact C-N 3.3Å; D586-L588 PolarHBondContact O-N 3.16Å; D586-Q589 PolarHBondContact O-N 2.9Å; D586-A590 PolarHBondContact O-N 3.08Å
587	S	33.1	Very low	33.9	Very low	42 Å²	42	104.4 Å²	104.4	29%	0.294	65%	0.647	S	S	.	*	H	α-helix	trans	-65.9	-34.2	177.2	-52.6	0	0	0	0	111.8	S584 P585 A590 L591	S584-S587 WeakPolarHBondContact O-CB 3.44Å; S584-S587 PolarHBondContact O-N 3.42Å; S584-S587 PolarHBondContact O-OG 3.32Å; S584-S587 PolarHBondContact OG-OG 3.39Å; P585-S587 PolarHBondContact O-N 2.99Å; S587-A590 PolarHBondContact O-N 3.28Å; S587-L591 WeakPolarHBondContact O-CD1 3.4Å; S587-L591 PolarHBondContact O-N 3.29Å
588	L	35.8	Very low	34.2	Very low	110 Å²	110	105.6 Å²	105.6	58%	0.576	65%	0.648	S	S	*	*	H	α-helix	trans	-69.9	-36	175.9	-66.2	173.8	0	0	0	111.4	P585 D586 A590 V592	P585-L588 PolarHBondContact O-N 3.43Å; D586-L588 VanDerWaalsContact C-N 3.3Å; D586-L588 PolarHBondContact O-N 3.16Å; L588-A590 VanDerWaalsContact C-N 3.3Å; L588-A590 PolarHBondContact O-N 3.13Å; L588-V592 VanDerWaalsContact O-CB 3.3Å; L588-V592 WeakPolarHBondContact O-CB 3.39Å; L588-V592 WeakPolarHBondContact O-CG2 3.4Å; L588-V592 PolarHBondContact O-N 2.88Å
589	Q	36.1	Very low	34.7	Very low	140 Å²	140	110.8 Å²	110.8	65%	0.654	65%	0.649	S	S	*	*	H	α-helix	trans	-65.5	-34	173.5	-63.2	-168.5	34.6	0	0	112.1	P585 D586	P585-Q589 PolarHBondContact O-N 3.14Å; D586-Q589 PolarHBondContact O-N 2.9Å
590	A	31.7	Very low	34.9	Very low	66 Å²	66	108.8 Å²	108.8	55%	0.545	64%	0.64	S	S	.	*	H	α-helix	trans	-67.4	-45	177.3	0	0	0	0	0	113.3	D586 S587 L588 V592	D586-A590 PolarHBondContact O-N 3.08Å; S587-A590 PolarHBondContact O-N 3.28Å; L588-A590 VanDerWaalsContact C-N 3.3Å; L588-A590 PolarHBondContact O-N 3.13Å; A590-V592 VanDerWaalsContact C-N 3.29Å; A590-V592 PolarHBondContact O-N 2.8Å
591	L	35.2	Very low	34.8	Very low	130 Å²	130	111.8 Å²	111.8	68%	0.681	64%	0.643	S	S	*	*	H	α-helix	trans	-64.2	-34	176.8	-91	81	0	0	0	112.3	S587 V593 S594	S587-L591 WeakPolarHBondContact O-CD1 3.4Å; S587-L591 PolarHBondContact O-N 3.29Å; L591-V593 VanDerWaalsContact C-N 3.28Å; L591-V593 PolarHBondContact O-N 3.24Å; L591-S594 PolarHBondContact O-N 3.05Å
592	V	39.7	Very low	35.1	Very low	54 Å²	54	111.6 Å²	111.6	33%	0.327	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.4	1	-168.6	170.6	0	0	0	0	114	L588 A590 R659	L588-V592 VanDerWaalsContact O-CB 3.3Å; L588-V592 WeakPolarHBondContact O-CB 3.39Å; L588-V592 WeakPolarHBondContact O-CG2 3.4Å; L588-V592 PolarHBondContact O-N 2.88Å; A590-V592 VanDerWaalsContact C-N 3.29Å; A590-V592 PolarHBondContact O-N 2.8Å; V592-R659 VanDerWaalsContact CG1-CZ 3.44Å; V592-R659 PolarHBondContact O-NH1 3.36Å; V592-R659 PolarHBondContact O-NH2 3.07Å
593	V	33.4	Very low	35.3	Very low	122 Å²	122	114 Å²	114	74%	0.739	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-14.6	170.1	178.2	0	0	0	0	112.6	L591 L595	L591-V593 VanDerWaalsContact C-N 3.28Å; L591-V593 PolarHBondContact O-N 3.24Å; V593-L595 PolarHBondContact O-N 2.95Å
594	S	31.7	Very low	35.6	Very low	94 Å²	94	112.8 Å²	112.8	66%	0.657	62%	0.624	S	S	*	*	S	Bend	trans	-100.8	73	175.7	-62.6	0	0	0	0	111.3	L591	L591-S594 PolarHBondContact O-N 3.05Å
595	L	35.8	Very low	35.6	Very low	85 Å²	85	114.2 Å²	114.2	45%	0.445	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-54.4	128.9	172.6	-82.8	166.4	0	0	0	110.2	V593 R597 F644	V593-L595 PolarHBondContact O-N 2.95Å; L595-R597 PolarHBondContact O-N 3.38Å; L595-F644 HydrophobicContact CD1-CD1 4.39Å
596	P	34.8	Very low	35.2	Very low	118 Å²	118	113.6 Å²	113.6	77%	0.766	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-53.2	131	175.4	-27.6	35.5	0	0	0	111.2
597	R	39.1	Very low	35.3	Very low	190 Å²	190	119.3 Å²	119.3	72%	0.717	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-87.9	117.2	171.6	-165.1	179.2	-155.1	133.1	7	107.1	L595 R599	L595-R597 PolarHBondContact O-N 3.38Å; R597-R599 PolarHBondContact O-N 3.47Å
598	D	33.2	Very low	35.4	Very low	157 Å²	157	121.8 Å²	121.8	84%	0.84	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-51.5	133.7	176.8	-87.5	-56.1	0	0	0	111.1	C600	D598-C600 PolarHBondContact O-N 3.15Å
599	R	36.5	Very low	35.6	Very low	233 Å²	233	121 Å²	121	88%	0.879	66%	0.663	S	S	*	*			trans	-81.2	71.9	-165.3	-166.1	179.5	-174.2	179	2	110.5	R597 Q601	R597-R599 PolarHBondContact O-N 3.47Å; R599-Q601 WeakPolarHBondContact O-CG 3.47Å; R599-Q601 PolarHBondContact O-N 3.01Å; R599-Q601 VanDerWaalsContact O-N 3.17Å
600	C	32.1	Very low	36.2	Very low	92 Å²	92	118.6 Å²	118.6	62%	0.622	66%	0.658	S	S	*	*			trans	-49.5	118.1	179.4	-168.4	0	0	0	0	110.9	D598 D602	D598-C600 PolarHBondContact O-N 3.15Å; C600-D602 PolarHBondContact O-N 3.37Å; C600-D602 VanDerWaalsContact O-N 3.14Å
601	Q	35.6	Very low	36.8	Very low	196 Å²	196	122.1 Å²	122.1	92%	0.916	67%	0.667	S	S	*	*	S	Bend	trans	-86.2	37.3	-173.9	-62.5	-170.3	5	0	0	113.4	R599	R599-Q601 WeakPolarHBondContact O-CG 3.47Å; R599-Q601 PolarHBondContact O-N 3.01Å; R599-Q601 VanDerWaalsContact O-N 3.17Å
602	D	33.4	Very low	37.5	Very low	68 Å²	68	118.9 Å²	118.9	36%	0.364	66%	0.655	S	S	.	*			trans	-147.2	111.4	167.3	-178.3	17.4	0	0	0	112.4	C600 A604 S605	C600-D602 PolarHBondContact O-N 3.37Å; C600-D602 VanDerWaalsContact O-N 3.14Å; D602-A604 VanDerWaalsContact C-N 3.26Å; D602-A604 PolarHBondContact O-N 3.31Å; D602-A604 VanDerWaalsContact OD1-CB 3.32Å; D602-A604 WeakPolarHBondContact OD1-CB 3.16Å; D602-A604 PolarHBondContact OD1-N 3.47Å; D602-S605 VanDerWaalsContact OD2-CB 3.22Å; D602-S605 WeakPolarHBondContact OD2-CB 3.22Å; D602-S605 PolarHBondContact OD2-N 2.92Å; D602-S605 VanDerWaalsContact OD2-N 3.09Å
603	P	35.5	Very low	38.6	Very low	128 Å²	128	119.7 Å²	119.7	83%	0.831	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-17.3	172.1	-20.7	33.9	0	0	0	115.1
604	A	40.7	Very low	40.9	Very low	70 Å²	70	117.2 Å²	117.2	58%	0.579	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-41.8	-172.3	0	0	0	0	0	113.6	D602 C606	D602-A604 VanDerWaalsContact C-N 3.26Å; D602-A604 PolarHBondContact O-N 3.31Å; D602-A604 VanDerWaalsContact OD1-CB 3.32Å; D602-A604 WeakPolarHBondContact OD1-CB 3.16Å; D602-A604 PolarHBondContact OD1-N 3.47Å; A604-C606 VanDerWaalsContact C-N 3.31Å; A604-C606 PolarHBondContact O-N 3.48Å
605	S	36.7	Very low	43.7	Very low	93 Å²	93	116 Å²	116	65%	0.65	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-25.7	-177	-174.6	0	0	0	0	114.4	D602 R607	D602-S605 VanDerWaalsContact OD2-CB 3.22Å; D602-S605 WeakPolarHBondContact OD2-CB 3.22Å; D602-S605 PolarHBondContact OD2-N 2.92Å; D602-S605 VanDerWaalsContact OD2-N 3.09Å; S605-R607 VanDerWaalsContact C-N 3.27Å; S605-R607 PolarHBondContact O-N 2.94Å
606	C	35.3	Very low	46.4	Very low	84 Å²	84	116 Å²	116	57%	0.568	63%	0.629	S	S	*	*			trans	-79	50.3	-173.5	-65.1	0	0	0	0	115.7	A604	A604-C606 VanDerWaalsContact C-N 3.31Å; A604-C606 PolarHBondContact O-N 3.48Å
607	R	37	Very low	49.2	Very low	233 Å²	233	114.8 Å²	114.8	88%	0.879	61%	0.61	S	S	*	*			trans	-100.1	45.5	173.8	-69.3	-165.9	175.2	-158.4	-0.1	114.4	S605	S605-R607 VanDerWaalsContact C-N 3.27Å; S605-R607 PolarHBondContact O-N 2.94Å
608	S	34.4	Very low	51.9	Low	94 Å²	94	111 Å²	111	66%	0.657	60%	0.599	S	S	*	*	S	Bend	trans	-123.5	146.1	171	-71.2	0	0	0	0	110.2	T610	S608-T610 PolarHBondContact O-N 3.28Å
609	P	39.6	Very low	55	Low	93 Å²	93	105.5 Å²	105.5	60%	0.604	57%	0.566	S	S	*	*			trans	-67.8	117.9	-166.5	25.7	-34.4	0	0	0	112.7	L611 S612	P609-L611 PolarHBondContact O-N 3.41Å; P609-S612 PolarHBondContact O-N 2.94Å; P609-S612 VanDerWaalsContact O-N 3.07Å; P609-S612 PolarHBondContact O-OG 3.33Å; P609-S612 VanDerWaalsContact O-OG 3.05Å
610	T	49.4	Very low	57.8	Low	91 Å²	91	95.2 Å²	95.2	56%	0.558	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-11	-175.1	45.7	0	0	0	0	115.5	S608 T613	S608-T610 PolarHBondContact O-N 3.28Å; T610-T613 PolarHBondContact O-OG1 3.03Å
611	L	43.5	Very low	61	Low	139 Å²	139	93.4 Å²	93.4	73%	0.728	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-31.9	175.3	-60.3	176.9	0	0	0	113.5	P609 D614 T615	P609-L611 PolarHBondContact O-N 3.41Å; L611-D614 PolarHBondContact O-N 3.2Å; L611-T615 PolarHBondContact O-N 2.94Å
612	S	49.4	Very low	63.9	Low	62 Å²	62	86.8 Å²	86.8	43%	0.434	48%	0.475	S	S	.	.	H	α-helix	trans	-73.9	-29.6	-179.9	62.8	0	0	0	0	112.3	P609 D614 T615 H616	P609-S612 PolarHBondContact O-N 2.94Å; P609-S612 VanDerWaalsContact O-N 3.07Å; P609-S612 PolarHBondContact O-OG 3.33Å; P609-S612 VanDerWaalsContact O-OG 3.05Å; S612-D614 VanDerWaalsContact C-N 3.28Å; S612-D614 PolarHBondContact O-N 3.4Å; S612-T615 PolarHBondContact O-OG1 3.13Å; S612-H616 WeakPolarHBondContact O-CB 3.36Å; S612-H616 PolarHBondContact O-N 3.48Å
613	T	62.8	Low	67	Low	71 Å²	71	83.6 Å²	83.6	44%	0.436	46%	0.458	S	S	.	.	H	α-helix	trans	-66.5	-30.1	172	51.4	0	0	0	0	112.6	T610 R617	T610-T613 PolarHBondContact O-OG1 3.03Å; T613-R617 WeakPolarHBondContact O-CB 3.25Å; T613-R617 PolarHBondContact O-N 3.11Å
614	D	82.9	Confident	70	Confident	71 Å²	71	77.5 Å²	77.5	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-73.6	-46.2	179.1	173.8	73	0	0	0	111.6	L611 S612 R617 K618	L611-D614 PolarHBondContact O-N 3.2Å; S612-D614 VanDerWaalsContact C-N 3.28Å; S612-D614 PolarHBondContact O-N 3.4Å; D614-R617 PolarHBondContact O-N 3.02Å; D614-K618 VanDerWaalsContact O-CB 3.31Å; D614-K618 WeakPolarHBondContact O-CB 3.5Å; D614-K618 VanDerWaalsContact O-CG 3.28Å; D614-K618 WeakPolarHBondContact O-CG 3.43Å; D614-K618 PolarHBondContact O-N 3.48Å; D614-K618 WeakPolarHBondContact OD1-CE 3.43Å; D614-K618 IonicContact OD1-NZ 2.8Å; D614-K618 PolarHBondContact OD1-NZ 3.22Å; D614-K618 WeakPolarHBondContact OD2-CE 3.25Å; D614-K618 IonicContact OD2-NZ 3.6Å; D614-K618 PolarHBondContact OD2-NZ 3.07Å
615	T	90.2	Very high	72.7	Confident	69 Å²	69	74.5 Å²	74.5	42%	0.423	39%	0.393	S	S	.	.	H	α-helix	trans	-64.2	-44.2	176.8	54.7	0	0	0	0	112	L611 S612 K618 R619	L611-T615 PolarHBondContact O-N 2.94Å; S612-T615 PolarHBondContact O-OG1 3.13Å; T615-K618 PolarHBondContact O-N 3.38Å; T615-R619 WeakPolarHBondContact O-CB 3.38Å; T615-R619 PolarHBondContact O-N 3.37Å
616	H	91.6	Very high	75.6	Confident	84 Å²	84	70.4 Å²	70.4	39%	0.389	36%	0.363	S	S	.	.	H	α-helix	trans	-66	-42.9	175.9	177.3	53.4	0	0	0	112.5	S612 K618 R619 L620 E950	S612-H616 WeakPolarHBondContact O-CB 3.36Å; S612-H616 PolarHBondContact O-N 3.48Å; H616-K618 VanDerWaalsContact C-N 3.34Å; H616-K618 PolarHBondContact O-N 2.95Å; H616-R619 WeakPolarHBondContact O-CB 3.43Å; H616-R619 PolarHBondContact O-N 3.42Å; H616-R619 VanDerWaalsContact O-N 3.13Å; H616-L620 WeakPolarHBondContact O-CG 3.4Å; H616-L620 PolarHBondContact O-N 3.25Å; H616-E950 IonicContact CE1-OE1 3.15Å; H616-E950 PolarHBondContact CE1-OE1 3.49Å; H616-E950 IonicContact ND1-OE1 3.22Å; H616-E950 PolarHBondContact ND1-OE1 3.29Å; H616-E950 IonicContact ND1-OE2 2.8Å
617	R	94.8	Very high	78.6	Confident	93 Å²	93	67 Å²	67	35%	0.351	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-37.9	175.1	-175.6	162.9	173.5	78.3	-6.6	111.9	T613 D614 R619 Y621 R642 G643 F644	T613-R617 WeakPolarHBondContact O-CB 3.25Å; T613-R617 PolarHBondContact O-N 3.11Å; D614-R617 PolarHBondContact O-N 3.02Å; R617-R619 VanDerWaalsContact C-N 3.35Å; R617-Y621 PolarHBondContact O-N 3.2Å; R617-R642 PolarHBondContact NH1-O 3.09Å; R617-G643 PolarHBondContact NH2-O 3.4Å; R617-F644 HydrophobicContact CG-CE1 3.58Å; R617-F644 HydrophobicContact CG-CZ 3.82Å; R617-F644 VanDerWaalsContact O-CZ 3.31Å; R617-F644 WeakPolarHBondContact O-CZ 3.5Å
618	K	95.8	Very high	81.5	Confident	111 Å²	111	56 Å²	56	48%	0.483	30%	0.298	S	S	.	.	H	α-helix	trans	-64.8	-36.2	171.7	-76.2	167.9	177.3	162.4	0	112.3	D614 T615 H616 R622	D614-K618 VanDerWaalsContact O-CB 3.31Å; D614-K618 WeakPolarHBondContact O-CB 3.5Å; D614-K618 VanDerWaalsContact O-CG 3.28Å; D614-K618 WeakPolarHBondContact O-CG 3.43Å; D614-K618 PolarHBondContact O-N 3.48Å; D614-K618 WeakPolarHBondContact OD1-CE 3.43Å; D614-K618 IonicContact OD1-NZ 2.8Å; D614-K618 PolarHBondContact OD1-NZ 3.22Å; D614-K618 WeakPolarHBondContact OD2-CE 3.25Å; D614-K618 IonicContact OD2-NZ 3.6Å; D614-K618 PolarHBondContact OD2-NZ 3.07Å; T615-K618 PolarHBondContact O-N 3.38Å; H616-K618 VanDerWaalsContact C-N 3.34Å; H616-K618 PolarHBondContact O-N 2.95Å; K618-R622 WeakPolarHBondContact O-CG 3.37Å; K618-R622 PolarHBondContact O-N 2.97Å; K618-R622 VanDerWaalsContact O-N 3.09Å; K618-R622 PolarHBondContact O-NH1 2.81Å
619	R	96.9	Very high	84.5	Confident	40 Å²	40	51.6 Å²	51.6	15%	0.151	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-51.1	173.8	-168.5	-170.7	-61.9	150.4	3	111.6	T615 H616 R617 Y621 R622 I623 E943 E947 E950	T615-R619 WeakPolarHBondContact O-CB 3.38Å; T615-R619 PolarHBondContact O-N 3.37Å; H616-R619 WeakPolarHBondContact O-CB 3.43Å; H616-R619 PolarHBondContact O-N 3.42Å; H616-R619 VanDerWaalsContact O-N 3.13Å; R617-R619 VanDerWaalsContact C-N 3.35Å; R619-Y621 VanDerWaalsContact C-N 3.25Å; R619-Y621 PolarHBondContact O-N 3.48Å; R619-R622 CarbonylContact O-C 3.55Å; R619-R622 WeakPolarHBondContact O-CA 3.42Å; R619-R622 PolarHBondContact O-N 3.05Å; R619-I623 HydrophobicContact CG-CD1 3.97Å; R619-I623 HydrophobicContact CG-CG1 4.42Å; R619-I623 WeakPolarHBondContact O-CG1 3.28Å; R619-I623 PolarHBondContact O-N 3.04Å; R619-E943 WeakPolarHBondContact CB-OE1 3Å; R619-E943 WeakPolarHBondContact CG-OE1 3.23Å; R619-E943 IonicContact CZ-OE1 3.21Å; R619-E943 IonicContact CZ-OE2 2.68Å; R619-E943 IonicContact NE-OE1 3.85Å; R619-E943 PolarHBondContact NE-OE1 2.97Å; R619-E943 IonicContact NE-OE2 3.13Å; R619-E943 PolarHBondContact NE-OE2 2.96Å; R619-E943 IonicContact NH2-OE1 3.16Å; R619-E943 IonicContact NH2-OE2 3.32Å; R619-E943 PolarHBondContact NH2-OE2 3.01Å; R619-E947 HydrophobicContact CG-CB 4.13Å; R619-E947 HydrophobicContact CG-CG 4.46Å; R619-E950 WeakPolarHBondContact CD-OE2 3.41Å; R619-E950 IonicContact CZ-OE2 3.88Å; R619-E950 IonicContact NE-OE2 3.77Å; R619-E950 IonicContact NH1-OE2 3.11Å; R619-E950 PolarHBondContact NH1-OE2 3.25Å
620	L	97	Very high	87.2	Confident	17 Å²	17	51.1 Å²	51.1	9%	0.089	26%	0.263	C	S	.	.	H	α-helix	trans	-55.5	-40.9	175.8	-71.8	172.5	0	0	0	111.7	H616 I623 G624 F638 F644 E950 I954	H616-L620 WeakPolarHBondContact O-CG 3.4Å; H616-L620 PolarHBondContact O-N 3.25Å; L620-I623 PolarHBondContact O-N 3.01Å; L620-G624 PolarHBondContact O-N 3.04Å; L620-F638 HydrophobicContact CD2-CZ 4.03Å; L620-F638 WeakPolarHBondContact O-CE1 3.39Å; L620-F644 HydrophobicContact CB-CE2 4.06Å; L620-F644 HydrophobicContact CB-CZ 4Å; L620-E950 WeakPolarHBondContact CD2-OE1 3.3Å; L620-I954 HydrophobicContact CD2-CD1 4.44Å
621	Y	97.8	Very high	89.5	Confident	55 Å²	55	49.5 Å²	49.5	22%	0.216	25%	0.25	C	S	.	.	H	α-helix	trans	-60.3	-48	173.4	-178.4	-107.1	0	0	0	112.2	R617 R619 I623 G624 L625 L639 F644 F655	R617-Y621 PolarHBondContact O-N 3.2Å; R619-Y621 VanDerWaalsContact C-N 3.25Å; R619-Y621 PolarHBondContact O-N 3.48Å; Y621-I623 VanDerWaalsContact C-N 3.32Å; Y621-I623 PolarHBondContact O-N 3.43Å; Y621-G624 PolarHBondContact O-N 3.34Å; Y621-G624 VanDerWaalsContact O-N 3.14Å; Y621-L625 HydrophobicContact CD1-CD1 4.16Å; Y621-L625 HydrophobicContact CE1-CD1 3.66Å; Y621-L625 HydrophobicContact CE1-CD2 4.48Å; Y621-L625 HydrophobicContact CE1-CG 4.15Å; Y621-L625 WeakPolarHBondContact O-CG 3.34Å; Y621-L625 PolarHBondContact O-N 3.01Å; Y621-L639 HydrophobicContact CD2-CD2 3.99Å; Y621-L639 HydrophobicContact CE2-CD2 4.22Å; Y621-F644 HydrophobicContact CD2-CB 4.03Å; Y621-F644 AromaticContact CD2-CD1 3.72Å; Y621-F644 HydrophobicContact CD2-CD1 3.72Å; Y621-F644 HydrophobicContact CD2-CD2 4.32Å; Y621-F644 HydrophobicContact CD2-CE1 4.19Å; Y621-F644 AromaticContact CD2-CG 3.79Å; Y621-F644 HydrophobicContact CD2-CG 3.79Å; Y621-F644 HydrophobicContact CE2-CB 4.39Å; Y621-F644 HydrophobicContact CG-CD1 4.37Å; Y621-F644 HydrophobicContact CG-CE1 4.4Å; Y621-F655 HydrophobicContact CE2-CE2 4.15Å
622	R	97.9	Very high	92	Very high	57 Å²	57	43.4 Å²	43.4	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-33.7	176.8	-67.3	-177.6	-27.6	-96.9	-4.1	112.6	K618 R619 L625 N626 E943 E947	K618-R622 WeakPolarHBondContact O-CG 3.37Å; K618-R622 PolarHBondContact O-N 2.97Å; K618-R622 VanDerWaalsContact O-N 3.09Å; K618-R622 PolarHBondContact O-NH1 2.81Å; R619-R622 CarbonylContact O-C 3.55Å; R619-R622 WeakPolarHBondContact O-CA 3.42Å; R619-R622 PolarHBondContact O-N 3.05Å; R622-L625 PolarHBondContact O-N 2.99Å; R622-N626 WeakPolarHBondContact O-CB 3.39Å; R622-N626 PolarHBondContact O-N 2.72Å; R622-N626 PolarHBondContact O-OD1 3.24Å; R622-N626 VanDerWaalsContact O-OD1 3.07Å; R622-E943 IonicContact CZ-OE1 3.62Å; R622-E943 IonicContact NH1-OE1 2.73Å; R622-E943 PolarHBondContact NH1-OE1 3.46Å; R622-E943 IonicContact NH2-OE1 3.08Å; R622-E943 PolarHBondContact NH2-OE1 3.17Å; R622-E947 IonicContact CZ-OE2 3.31Å; R622-E947 IonicContact NE-OE2 3.59Å; R622-E947 PolarHBondContact NE-OE2 3.23Å; R622-E947 IonicContact NH2-OE2 3.8Å; R622-E947 PolarHBondContact NH2-OE2 2.78Å
623	I	98	Very high	94.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-43.9	171.3	-68.6	170.7	0	0	0	110.2	R619 L620 Y621 L625 N626 L627 F638 E947 E950 M951 I954	R619-I623 HydrophobicContact CG-CD1 3.97Å; R619-I623 HydrophobicContact CG-CG1 4.42Å; R619-I623 WeakPolarHBondContact O-CG1 3.28Å; R619-I623 PolarHBondContact O-N 3.04Å; L620-I623 PolarHBondContact O-N 3.01Å; Y621-I623 VanDerWaalsContact C-N 3.32Å; Y621-I623 PolarHBondContact O-N 3.43Å; I623-L625 VanDerWaalsContact C-N 3.34Å; I623-L625 PolarHBondContact O-N 2.69Å; I623-N626 PolarHBondContact O-N 2.97Å; I623-L627 HydrophobicContact CG2-CD1 3.86Å; I623-L627 HydrophobicContact CG2-CG 4.29Å; I623-L627 WeakPolarHBondContact O-CB 3.38Å; I623-L627 VanDerWaalsContact O-CG 3.3Å; I623-L627 WeakPolarHBondContact O-CG 3.45Å; I623-L627 PolarHBondContact O-N 3.26Å; I623-F638 HydrophobicContact CG2-CE1 4.35Å; I623-F638 HydrophobicContact CG2-CZ 4.18Å; I623-E947 HydrophobicContact CG1-CG 4.01Å; I623-E950 HydrophobicContact CD1-CB 3.81Å; I623-E950 HydrophobicContact CD1-CG 3.84Å; I623-M951 HydrophobicContact CD1-CB 4.47Å; I623-M951 HydrophobicContact CG1-CB 4.25Å; I623-M951 HydrophobicContact CG2-CB 4.08Å; I623-M951 HydrophobicContact CG2-CG 4.12Å; I623-M951 HydrophobicContact CG2-SD 4.24Å; I623-I954 HydrophobicContact CD1-CD1 4.38Å; I623-I954 HydrophobicContact CG2-CD1 3.87Å
624	G	97.8	Very high	95.8	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-41.1	173.5	0	0	0	0	0	113.4	L620 Y621 L627 F628	L620-G624 PolarHBondContact O-N 3.04Å; Y621-G624 PolarHBondContact O-N 3.34Å; Y621-G624 VanDerWaalsContact O-N 3.14Å; G624-L627 PolarHBondContact O-N 3.41Å; G624-F628 PolarHBondContact O-N 3.44Å
625	L	98.3	Very high	96.5	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-43.8	172.1	-61.8	-179.4	0	0	0	112.2	Y621 R622 I623 L627 F628 N629 F655 L662	Y621-L625 HydrophobicContact CD1-CD1 4.16Å; Y621-L625 HydrophobicContact CE1-CD1 3.66Å; Y621-L625 HydrophobicContact CE1-CD2 4.48Å; Y621-L625 HydrophobicContact CE1-CG 4.15Å; Y621-L625 WeakPolarHBondContact O-CG 3.34Å; Y621-L625 PolarHBondContact O-N 3.01Å; R622-L625 PolarHBondContact O-N 2.99Å; I623-L625 VanDerWaalsContact C-N 3.34Å; I623-L625 PolarHBondContact O-N 2.69Å; L625-L627 VanDerWaalsContact C-N 3.32Å; L625-L627 PolarHBondContact O-N 3.01Å; L625-F628 PolarHBondContact O-N 3.35Å; L625-N629 WeakPolarHBondContact O-CB 3.42Å; L625-N629 PolarHBondContact O-N 3.32Å; L625-N629 PolarHBondContact O-ND2 3.45Å; L625-F655 HydrophobicContact CD2-CZ 3.85Å; L625-L662 HydrophobicContact CD2-CD2 3.53Å; L625-L662 HydrophobicContact CD2-CG 4.05Å
626	N	97.8	Very high	96.8	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.037	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-39.9	177.4	-64.7	-5.8	0	0	0	111.3	R622 I623 N629 V630 R835 N867 E947 M951	R622-N626 WeakPolarHBondContact O-CB 3.39Å; R622-N626 PolarHBondContact O-N 2.72Å; R622-N626 PolarHBondContact O-OD1 3.24Å; R622-N626 VanDerWaalsContact O-OD1 3.07Å; I623-N626 PolarHBondContact O-N 2.97Å; N626-N629 CarbonylContact O-C 3.48Å; N626-N629 PolarHBondContact O-N 3.34Å; N626-V630 WeakPolarHBondContact O-CG2 3.35Å; N626-V630 PolarHBondContact O-N 3.35Å; N626-R835 PolarHBondContact OD1-NH1 3.19Å; N626-R835 PolarHBondContact OD1-NH2 3.02Å; N626-N867 PolarHBondContact ND2-ND2 2.86Å; N626-N867 PolarHBondContact OD1-ND2 3.01Å; N626-E947 PolarHBondContact ND2-OE1 3.01Å; N626-M951 HydrophobicContact CB-CE 3.91Å; N626-M951 HydrophobicContact CB-SD 3.52Å; N626-M951 VanDerWaalsContact CB-SD 3.52Å
627	L	97.8	Very high	97.1	Very high	14 Å²	14	40.2 Å²	40.2	7%	0.073	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-49.4	174.4	-79.7	167.4	0	0	0	111.2	I623 G624 L625 N629 V630 N631 F638 M951 W958	I623-L627 HydrophobicContact CG2-CD1 3.86Å; I623-L627 HydrophobicContact CG2-CG 4.29Å; I623-L627 WeakPolarHBondContact O-CB 3.38Å; I623-L627 VanDerWaalsContact O-CG 3.3Å; I623-L627 WeakPolarHBondContact O-CG 3.45Å; I623-L627 PolarHBondContact O-N 3.26Å; G624-L627 PolarHBondContact O-N 3.41Å; L625-L627 VanDerWaalsContact C-N 3.32Å; L625-L627 PolarHBondContact O-N 3.01Å; L627-N629 PolarHBondContact O-N 2.94Å; L627-V630 PolarHBondContact O-N 3.29Å; L627-N631 CarbonylContact O-C 3.58Å; L627-N631 PolarHBondContact O-N 2.96Å; L627-N631 VanDerWaalsContact O-O 3.05Å; L627-F638 HydrophobicContact CD1-CB 4.02Å; L627-F638 HydrophobicContact CD1-CD1 3.97Å; L627-F638 HydrophobicContact CD1-CD2 3.87Å; L627-F638 HydrophobicContact CD1-CE1 4.38Å; L627-F638 HydrophobicContact CD1-CE2 4.28Å; L627-F638 HydrophobicContact CD1-CG 3.68Å; L627-M951 HydrophobicContact CD2-CE 3.83Å; L627-M951 HydrophobicContact CG-CE 3.91Å; L627-W958 HydrophobicContact CD1-CH2 3.82Å; L627-W958 HydrophobicContact CD1-CZ3 4.19Å; L627-W958 HydrophobicContact CD2-CH2 4.09Å; L627-W958 HydrophobicContact CD2-CZ3 3.65Å
628	F	98.4	Very high	97.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-55	-42.5	174.2	179.2	-88.3	0	0	0	111.7	G624 L625 V630 N631 P632 I636 L656 L662 M666 I667 F670	G624-F628 PolarHBondContact O-N 3.44Å; L625-F628 PolarHBondContact O-N 3.35Å; F628-V630 PolarHBondContact O-N 3.48Å; F628-V630 VanDerWaalsContact O-N 3.15Å; F628-N631 CarbonylContact O-C 3.52Å; F628-P632 HydrophobicContact CD2-CB 3.93Å; F628-P632 HydrophobicContact CE2-CB 3.69Å; F628-P632 HydrophobicContact CZ-CB 4.14Å; F628-P632 WeakPolarHBondContact O-CA 3.42Å; F628-I636 HydrophobicContact CD2-CD1 3.65Å; F628-I636 HydrophobicContact CD2-CG1 3.81Å; F628-I636 HydrophobicContact CE2-CD1 3.78Å; F628-I636 HydrophobicContact CE2-CG1 3.88Å; F628-L656 HydrophobicContact CE1-CD2 4.4Å; F628-L656 HydrophobicContact CE2-CD2 3.61Å; F628-L656 HydrophobicContact CZ-CD2 3.49Å; F628-L656 VanDerWaalsContact CZ-CD2 3.49Å; F628-L662 HydrophobicContact CB-CD2 4.24Å; F628-L662 HydrophobicContact CD1-CB 4.47Å; F628-L662 HydrophobicContact CD1-CD2 3.46Å; F628-L662 VanDerWaalsContact CD1-CD2 3.46Å; F628-L662 HydrophobicContact CD2-CD2 4.48Å; F628-L662 HydrophobicContact CE1-CB 4.32Å; F628-L662 HydrophobicContact CE1-CD2 3.89Å; F628-L662 HydrophobicContact CG-CD2 3.8Å; F628-M666 HydrophobicContact CD1-CB 4.23Å; F628-M666 HydrophobicContact CE1-CB 3.8Å; F628-I667 HydrophobicContact CE1-CG1 4.05Å; F628-I667 HydrophobicContact CZ-CG1 4.11Å; F628-F670 HydrophobicContact CE2-CB 4.29Å; F628-F670 HydrophobicContact CE2-CD2 4.47Å; F628-F670 HydrophobicContact CE2-CG 4.26Å; F628-F670 HydrophobicContact CZ-CB 4.26Å
629	N	97.8	Very high	97.3	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.011	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	6.3	178.6	-64.8	-40.8	0	0	0	114.7	L625 N626 L627 G661 S663 H833	L625-N629 WeakPolarHBondContact O-CB 3.42Å; L625-N629 PolarHBondContact O-N 3.32Å; L625-N629 PolarHBondContact O-ND2 3.45Å; N626-N629 CarbonylContact O-C 3.48Å; N626-N629 PolarHBondContact O-N 3.34Å; L627-N629 PolarHBondContact O-N 2.94Å; N629-G661 PolarHBondContact ND2-O 2.89Å; N629-S663 PolarHBondContact OD1-N 2.86Å; N629-H833 VanDerWaalsContact CB-CA 3.47Å; N629-H833 HydrophobicContact CB-CB 3.71Å
630	V	96.5	Very high	97.3	Very high	84 Å²	84	30.4 Å²	30.4	51%	0.509	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-44.5	171.9	171.3	0	0	0	0	110.9	N626 L627 F628 H833	N626-V630 WeakPolarHBondContact O-CG2 3.35Å; N626-V630 PolarHBondContact O-N 3.35Å; L627-V630 PolarHBondContact O-N 3.29Å; F628-V630 PolarHBondContact O-N 3.48Å; F628-V630 VanDerWaalsContact O-N 3.15Å; V630-H833 HydrophobicContact CG2-CB 3.82Å; V630-H833 WeakPolarHBondContact CG2-ND1 3.39Å
631	N	96.1	Very high	97.2	Very high	56 Å²	56	34.1 Å²	34.1	30%	0.299	17%	0.166	S	C	.	.			trans	-146.4	104.7	175	-179.6	-78.7	0	0	0	107.7	L627 F628 E633 R634 G635	L627-N631 CarbonylContact O-C 3.58Å; L627-N631 PolarHBondContact O-N 2.96Å; L627-N631 VanDerWaalsContact O-O 3.05Å; F628-N631 CarbonylContact O-C 3.52Å; N631-E633 VanDerWaalsContact C-N 3.34Å; N631-E633 PolarHBondContact O-N 3Å; N631-R634 HydrophobicContact CB-CB 4.34Å; N631-R634 PolarHBondContact O-N 2.97Å; N631-R634 WeakPolarHBondContact OD1-CB 3.03Å; N631-R634 VanDerWaalsContact OD1-CG 3.29Å; N631-R634 WeakPolarHBondContact OD1-CG 3.47Å; N631-R634 PolarHBondContact OD1-N 3.39Å; N631-G635 PolarHBondContact O-N 3.47Å
632	P	97.1	Very high	97.1	Very high	12 Å²	12	37 Å²	37	8%	0.078	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-42.9	-172.6	-31.5	38	0	0	0	114.5	F628 R634 G635 I636 M666 F670	F628-P632 HydrophobicContact CD2-CB 3.93Å; F628-P632 HydrophobicContact CE2-CB 3.69Å; F628-P632 HydrophobicContact CZ-CB 4.14Å; F628-P632 WeakPolarHBondContact O-CA 3.42Å; P632-R634 PolarHBondContact O-N 3.27Å; P632-G635 WeakPolarHBondContact O-CA 3.34Å; P632-G635 PolarHBondContact O-N 3.13Å; P632-G635 VanDerWaalsContact O-N 3.1Å; P632-I636 PolarHBondContact O-N 3.33Å; P632-M666 HydrophobicContact CG-CB 4.28Å; P632-M666 HydrophobicContact CG-CE 3.78Å; P632-F670 HydrophobicContact CB-CB 3.65Å; P632-F670 HydrophobicContact CB-CD2 3.66Å; P632-F670 HydrophobicContact CB-CG 4.05Å; P632-F670 HydrophobicContact CG-CB 4.27Å
633	E	95.9	Very high	97	Very high	53 Å²	53	36.4 Å²	36.4	25%	0.248	19%	0.188	C	C	.	.	H	α-helix	trans	-58.1	-51.4	-179.5	-42.8	-56.1	163.7	0	0	111.6	N631 G635 I636 H637 F670 N673 L676 N679	N631-E633 VanDerWaalsContact C-N 3.34Å; N631-E633 PolarHBondContact O-N 3Å; E633-G635 VanDerWaalsContact C-N 3.26Å; E633-G635 PolarHBondContact O-N 2.93Å; E633-I636 PolarHBondContact O-N 2.98Å; E633-H637 WeakPolarHBondContact O-CB 3.46Å; E633-H637 PolarHBondContact O-N 3.31Å; E633-F670 WeakPolarHBondContact OE2-CE2 3.48Å; E633-N673 PolarHBondContact OE1-ND2 2.73Å; E633-L676 HydrophobicContact CG-CD1 4.37Å; E633-N679 PolarHBondContact OE1-ND2 3.22Å; E633-N679 PolarHBondContact OE2-ND2 3.48Å
634	R	95	Very high	96.9	Very high	114 Å²	114	37.2 Å²	37.2	43%	0.43	19%	0.192	S	C	.	.	H	α-helix	trans	-64.8	-31.5	177.1	-68.1	179.5	-166.1	-165.9	6.5	112.1	N631 P632 F638 W958	N631-R634 HydrophobicContact CB-CB 4.34Å; N631-R634 PolarHBondContact O-N 2.97Å; N631-R634 WeakPolarHBondContact OD1-CB 3.03Å; N631-R634 VanDerWaalsContact OD1-CG 3.29Å; N631-R634 WeakPolarHBondContact OD1-CG 3.47Å; N631-R634 PolarHBondContact OD1-N 3.39Å; P632-R634 PolarHBondContact O-N 3.27Å; R634-F638 WeakPolarHBondContact O-CB 3.31Å; R634-F638 PolarHBondContact O-N 3.22Å; R634-W958 HydrophobicContact CB-CH2 4.25Å; R634-W958 HydrophobicContact CB-CZ3 4.3Å
635	G	97.4	Very high	96.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-53.2	173.7	0	0	0	0	0	113	N631 P632 E633 F638 L639	N631-G635 PolarHBondContact O-N 3.47Å; P632-G635 WeakPolarHBondContact O-CA 3.34Å; P632-G635 PolarHBondContact O-N 3.13Å; P632-G635 VanDerWaalsContact O-N 3.1Å; E633-G635 VanDerWaalsContact C-N 3.26Å; E633-G635 PolarHBondContact O-N 2.93Å; G635-F638 PolarHBondContact O-N 2.94Å; G635-L639 WeakPolarHBondContact O-CB 3.47Å; G635-L639 WeakPolarHBondContact O-CD1 3.49Å; G635-L639 VanDerWaalsContact O-CG 3.25Å; G635-L639 WeakPolarHBondContact O-CG 3.45Å; G635-L639 PolarHBondContact O-N 2.77Å
636	I	98	Very high	96.6	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-48.4	177.5	-65	-50.5	0	0	0	110.6	F628 P632 E633 F638 L639 I640 V652 F655 L656 F670 F678	F628-I636 HydrophobicContact CD2-CD1 3.65Å; F628-I636 HydrophobicContact CD2-CG1 3.81Å; F628-I636 HydrophobicContact CE2-CD1 3.78Å; F628-I636 HydrophobicContact CE2-CG1 3.88Å; P632-I636 PolarHBondContact O-N 3.33Å; E633-I636 PolarHBondContact O-N 2.98Å; I636-F638 VanDerWaalsContact C-N 3.34Å; I636-F638 PolarHBondContact O-N 3.11Å; I636-L639 PolarHBondContact O-N 2.69Å; I636-L639 VanDerWaalsContact O-N 3.12Å; I636-I640 HydrophobicContact CG2-CD1 3.58Å; I636-I640 HydrophobicContact CG2-CG1 4.31Å; I636-I640 WeakPolarHBondContact O-CG1 3.25Å; I636-I640 PolarHBondContact O-N 2.9Å; I636-V652 HydrophobicContact CD1-CG1 4.01Å; I636-V652 HydrophobicContact CG1-CG1 4.3Å; I636-V652 HydrophobicContact CG2-CG1 4.23Å; I636-V652 HydrophobicContact CG2-CG2 3.94Å; I636-F655 HydrophobicContact CD1-CD1 4.16Å; I636-F655 HydrophobicContact CD1-CE1 3.95Å; I636-L656 HydrophobicContact CD1-CD2 4.3Å; I636-F670 HydrophobicContact CB-CE2 4.38Å; I636-F670 HydrophobicContact CG1-CD2 4.36Å; I636-F670 HydrophobicContact CG1-CE2 3.81Å; I636-F670 HydrophobicContact CG1-CZ 3.97Å; I636-F678 HydrophobicContact CG2-CE1 4.28Å
637	H	96.5	Very high	96.5	Very high	119 Å²	119	46.3 Å²	46.3	55%	0.551	25%	0.245	S	C	*	.	H	α-helix	trans	-55.6	-46.3	176.6	-179.7	-86.3	0	0	0	112.4	E633 I640 T641	E633-H637 WeakPolarHBondContact O-CB 3.46Å; E633-H637 PolarHBondContact O-N 3.31Å; H637-I640 PolarHBondContact O-N 2.8Å; H637-T641 PolarHBondContact CE1-OG1 3.17Å; H637-T641 WeakPolarHBondContact O-CB 3.24Å; H637-T641 PolarHBondContact O-N 3.36Å; H637-T641 PolarHBondContact O-OG1 2.88Å
638	F	97.5	Very high	96.5	Very high	7 Å²	7	48.9 Å²	48.9	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-40.9	176.8	-179.5	-86.1	0	0	0	112.4	L620 I623 L627 R634 G635 I636 T641 R642 I954 W958	L620-F638 HydrophobicContact CD2-CZ 4.03Å; L620-F638 WeakPolarHBondContact O-CE1 3.39Å; I623-F638 HydrophobicContact CG2-CE1 4.35Å; I623-F638 HydrophobicContact CG2-CZ 4.18Å; L627-F638 HydrophobicContact CD1-CB 4.02Å; L627-F638 HydrophobicContact CD1-CD1 3.97Å; L627-F638 HydrophobicContact CD1-CD2 3.87Å; L627-F638 HydrophobicContact CD1-CE1 4.38Å; L627-F638 HydrophobicContact CD1-CE2 4.28Å; L627-F638 HydrophobicContact CD1-CG 3.68Å; R634-F638 WeakPolarHBondContact O-CB 3.31Å; R634-F638 PolarHBondContact O-N 3.22Å; G635-F638 PolarHBondContact O-N 2.94Å; I636-F638 VanDerWaalsContact C-N 3.34Å; I636-F638 PolarHBondContact O-N 3.11Å; F638-T641 PolarHBondContact O-N 2.7Å; F638-R642 HydrophobicContact CD1-CG 4.18Å; F638-R642 HydrophobicContact CE1-CG 3.9Å; F638-R642 HydrophobicContact CE2-CG 4.29Å; F638-R642 HydrophobicContact CG-CG 4.5Å; F638-R642 HydrophobicContact CZ-CG 3.97Å; F638-R642 WeakPolarHBondContact O-CB 3.49Å; F638-R642 VanDerWaalsContact O-CG 3.23Å; F638-R642 WeakPolarHBondContact O-CG 3.45Å; F638-R642 PolarHBondContact O-N 3.17Å; F638-I954 HydrophobicContact CD2-CG2 4.32Å; F638-I954 HydrophobicContact CE2-CD1 3.73Å; F638-I954 HydrophobicContact CE2-CG1 4.33Å; F638-I954 HydrophobicContact CE2-CG2 4Å; F638-I954 HydrophobicContact CZ-CD1 3.82Å; F638-W958 HydrophobicContact CB-CH2 4.14Å; F638-W958 HydrophobicContact CB-CZ2 4.22Å; F638-W958 HydrophobicContact CD2-CH2 4.06Å; F638-W958 AromaticContact CD2-CZ2 3.79Å; F638-W958 HydrophobicContact CD2-CZ2 3.79Å; F638-W958 HydrophobicContact CG-CH2 4.48Å; F638-W958 HydrophobicContact CG-CZ2 4.47Å
639	L	97.9	Very high	96.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-36.4	178.4	-74.3	164.1	0	0	0	112.4	Y621 G635 I636 G643 F644 V645 F655	Y621-L639 HydrophobicContact CD2-CD2 3.99Å; Y621-L639 HydrophobicContact CE2-CD2 4.22Å; G635-L639 WeakPolarHBondContact O-CB 3.47Å; G635-L639 WeakPolarHBondContact O-CD1 3.49Å; G635-L639 VanDerWaalsContact O-CG 3.25Å; G635-L639 WeakPolarHBondContact O-CG 3.45Å; G635-L639 PolarHBondContact O-N 2.77Å; I636-L639 PolarHBondContact O-N 2.69Å; I636-L639 VanDerWaalsContact O-N 3.12Å; L639-G643 PolarHBondContact O-N 2.88Å; L639-F644 HydrophobicContact CB-CB 4.45Å; L639-F644 HydrophobicContact CD2-CB 3.93Å; L639-F644 HydrophobicContact CD2-CD2 3.91Å; L639-F644 HydrophobicContact CD2-CG 4.22Å; L639-F644 WeakPolarHBondContact O-CB 3.29Å; L639-F644 PolarHBondContact O-N 2.89Å; L639-V645 HydrophobicContact CB-CG2 4Å; L639-V645 PolarHBondContact O-N 3.44Å; L639-F655 HydrophobicContact CD1-CE1 3.84Å; L639-F655 HydrophobicContact CD1-CE2 4.38Å; L639-F655 HydrophobicContact CD1-CZ 3.5Å; L639-F655 VanDerWaalsContact CD1-CZ 3.5Å
640	I	96.6	Very high	96.5	Very high	31 Å²	31	54.5 Å²	54.5	16%	0.159	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-53.7	173	-68.4	167.7	0	0	0	110.2	I636 H637 R642 G643 V645 D647 V652	I636-I640 HydrophobicContact CG2-CD1 3.58Å; I636-I640 HydrophobicContact CG2-CG1 4.31Å; I636-I640 WeakPolarHBondContact O-CG1 3.25Å; I636-I640 PolarHBondContact O-N 2.9Å; H637-I640 PolarHBondContact O-N 2.8Å; I640-R642 PolarHBondContact O-N 2.9Å; I640-G643 PolarHBondContact O-N 3.13Å; I640-V645 WeakPolarHBondContact CA-O 3.36Å; I640-V645 HydrophobicContact CG1-CB 4.28Å; I640-D647 HydrophobicContact CG2-CB 3.66Å; I640-V652 HydrophobicContact CD1-CG2 4.3Å
641	T	96.1	Very high	96.5	Very high	94 Å²	94	51.1 Å²	51.1	58%	0.577	28%	0.275	S	S	*	.	H	α-helix	trans	-56.7	-27.9	-179.8	-52.5	0	0	0	0	113.1	H637 F638	H637-T641 PolarHBondContact CE1-OG1 3.17Å; H637-T641 WeakPolarHBondContact O-CB 3.24Å; H637-T641 PolarHBondContact O-N 3.36Å; H637-T641 PolarHBondContact O-OG1 2.88Å; F638-T641 PolarHBondContact O-N 2.7Å
642	R	94.5	Very high	96.6	Very high	116 Å²	116	48.5 Å²	48.5	44%	0.438	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	6.5	178.8	-62.4	-63.8	-172.5	170.5	0.1	114.3	R617 F638 I640 F644	R617-R642 PolarHBondContact NH1-O 3.09Å; F638-R642 HydrophobicContact CD1-CG 4.18Å; F638-R642 HydrophobicContact CE1-CG 3.9Å; F638-R642 HydrophobicContact CE2-CG 4.29Å; F638-R642 HydrophobicContact CG-CG 4.5Å; F638-R642 HydrophobicContact CZ-CG 3.97Å; F638-R642 WeakPolarHBondContact O-CB 3.49Å; F638-R642 VanDerWaalsContact O-CG 3.23Å; F638-R642 WeakPolarHBondContact O-CG 3.45Å; F638-R642 PolarHBondContact O-N 3.17Å; I640-R642 PolarHBondContact O-N 2.9Å; R642-F644 HydrophobicContact CB-CD2 3.57Å; R642-F644 HydrophobicContact CB-CE2 3.49Å; R642-F644 VanDerWaalsContact CB-CE2 3.49Å; R642-F644 HydrophobicContact CG-CE2 4.38Å
643	G	95.4	Very high	96.6	Very high	44 Å²	44	47.9 Å²	47.9	45%	0.454	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	45.1	178.5	0	0	0	0	0	112.9	R617 L639 I640	R617-G643 PolarHBondContact NH2-O 3.4Å; L639-G643 PolarHBondContact O-N 2.88Å; I640-G643 PolarHBondContact O-N 3.13Å
644	F	96.2	Very high	96.7	Very high	17 Å²	17	48.1 Å²	48.1	8%	0.075	26%	0.258	C	S	.	.	S	Bend	trans	-105.2	-24.9	171.5	-64.9	-64.3	0	0	0	113.1	L595 R617 L620 Y621 L639 R642	L595-F644 HydrophobicContact CD1-CD1 4.39Å; R617-F644 HydrophobicContact CG-CE1 3.58Å; R617-F644 HydrophobicContact CG-CZ 3.82Å; R617-F644 VanDerWaalsContact O-CZ 3.31Å; R617-F644 WeakPolarHBondContact O-CZ 3.5Å; L620-F644 HydrophobicContact CB-CE2 4.06Å; L620-F644 HydrophobicContact CB-CZ 4Å; Y621-F644 HydrophobicContact CD2-CB 4.03Å; Y621-F644 AromaticContact CD2-CD1 3.72Å; Y621-F644 HydrophobicContact CD2-CD1 3.72Å; Y621-F644 HydrophobicContact CD2-CD2 4.32Å; Y621-F644 HydrophobicContact CD2-CE1 4.19Å; Y621-F644 AromaticContact CD2-CG 3.79Å; Y621-F644 HydrophobicContact CD2-CG 3.79Å; Y621-F644 HydrophobicContact CE2-CB 4.39Å; Y621-F644 HydrophobicContact CG-CD1 4.37Å; Y621-F644 HydrophobicContact CG-CE1 4.4Å; L639-F644 HydrophobicContact CB-CB 4.45Å; L639-F644 HydrophobicContact CD2-CB 3.93Å; L639-F644 HydrophobicContact CD2-CD2 3.91Å; L639-F644 HydrophobicContact CD2-CG 4.22Å; L639-F644 WeakPolarHBondContact O-CB 3.29Å; L639-F644 PolarHBondContact O-N 2.89Å; R642-F644 HydrophobicContact CB-CD2 3.57Å; R642-F644 HydrophobicContact CB-CE2 3.49Å; R642-F644 VanDerWaalsContact CB-CE2 3.49Å; R642-F644 HydrophobicContact CG-CE2 4.38Å
645	V	96.2	Very high	96.8	Very high	7 Å²	7	43.2 Å²	43.2	4%	0.042	24%	0.24	C	C	.	.	S	Bend	trans	-137.5	136.7	179.5	-176.5	0	0	0	0	106.8	L639 I640 V652 F655	L639-V645 HydrophobicContact CB-CG2 4Å; L639-V645 PolarHBondContact O-N 3.44Å; I640-V645 WeakPolarHBondContact CA-O 3.36Å; I640-V645 HydrophobicContact CG1-CB 4.28Å; V645-V652 HydrophobicContact CG1-CG2 3.82Å; V645-F655 HydrophobicContact CG1-CB 4.16Å; V645-F655 HydrophobicContact CG1-CG 4.32Å; V645-F655 HydrophobicContact CG2-CB 4.26Å; V645-F655 HydrophobicContact CG2-CD1 4.12Å; V645-F655 HydrophobicContact CG2-CD2 3.37Å; V645-F655 HydrophobicContact CG2-CE1 4.34Å; V645-F655 HydrophobicContact CG2-CE2 3.65Å; V645-F655 HydrophobicContact CG2-CG 3.65Å; V645-F655 HydrophobicContact CG2-CZ 4.14Å
646	P	94.6	Very high	96.8	Very high	78 Å²	78	43.2 Å²	43.2	51%	0.506	24%	0.24	S	C	.	.			trans	-74.4	150.1	176.4	31.9	-35.3	0	0	0	111	T648	P646-T648 PolarHBondContact O-N 3.46Å
647	D	95.8	Very high	96.6	Very high	120 Å²	120	44.3 Å²	44.3	64%	0.642	25%	0.246	S	C	*	.	S	Bend	trans	-76.5	68.8	-178.3	-159.8	7.7	0	0	0	111.9	I640	I640-D647 HydrophobicContact CG2-CB 3.66Å
648	T	97.9	Very high	96.5	Very high	69 Å²	69	43.8 Å²	43.8	42%	0.423	24%	0.244	S	C	.	.	S	Bend	trans	-151.7	142.4	-174.4	54.5	0	0	0	0	110.4	P646 I650 G651 V652	P646-T648 PolarHBondContact O-N 3.46Å; T648-I650 PolarHBondContact O-N 3.14Å; T648-G651 PolarHBondContact O-N 3.42Å; T648-G651 WeakPolarHBondContact OG1-CA 3.23Å; T648-G651 PolarHBondContact OG1-N 3.09Å; T648-V652 PolarHBondContact O-N 3.28Å
649	A	97.5	Very high	96.3	Very high	19 Å²	19	46.6 Å²	46.6	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-47.4	-179.8	0	0	0	0	0	112.4	G651 V652 A653 D681 V682	A649-G651 PolarHBondContact O-N 3.18Å; A649-V652 PolarHBondContact O-N 3.33Å; A649-A653 WeakPolarHBondContact O-CB 3.05Å; A649-A653 PolarHBondContact O-N 3.48Å; A649-D681 HydrophobicContact CB-CB 3.8Å; A649-V682 HydrophobicContact CB-CG2 3.91Å
650	I	97.2	Very high	96.1	Very high	101 Å²	101	55.9 Å²	55.9	52%	0.518	29%	0.294	S	S	.	.	H	α-helix	trans	-59.2	-43.9	176.5	-59.3	168.5	0	0	0	111.5	T648 V652 A653 H654 C685	T648-I650 PolarHBondContact O-N 3.14Å; I650-V652 PolarHBondContact O-N 2.93Å; I650-A653 WeakPolarHBondContact O-CB 3.28Å; I650-A653 PolarHBondContact O-N 3.19Å; I650-H654 WeakPolarHBondContact CG2-NE2 3.31Å; I650-H654 PolarHBondContact O-CD2 3.04Å; I650-H654 VanDerWaalsContact O-CD2 3.27Å; I650-H654 PolarHBondContact O-N 3.46Å; I650-C685 HydrophobicContact CG1-CB 4.4Å; I650-C685 VanDerWaalsContact CG1-SG 3.54Å
651	G	97.3	Very high	96	Very high	13 Å²	13	55.2 Å²	55.2	13%	0.134	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-35.5	179.8	0	0	0	0	0	113.7	T648 A649 F655	T648-G651 PolarHBondContact O-N 3.42Å; T648-G651 WeakPolarHBondContact OG1-CA 3.23Å; T648-G651 PolarHBondContact OG1-N 3.09Å; A649-G651 PolarHBondContact O-N 3.18Å; G651-F655 WeakPolarHBondContact O-CB 3.43Å; G651-F655 PolarHBondContact O-N 2.71Å
652	V	98.2	Very high	96	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71	-39.9	170.5	178.8	0	0	0	0	110.7	I636 I640 V645 T648 A649 I650 F655 L656 F670 F678 V682	I636-V652 HydrophobicContact CD1-CG1 4.01Å; I636-V652 HydrophobicContact CG1-CG1 4.3Å; I636-V652 HydrophobicContact CG2-CG1 4.23Å; I636-V652 HydrophobicContact CG2-CG2 3.94Å; I640-V652 HydrophobicContact CD1-CG2 4.3Å; V645-V652 HydrophobicContact CG1-CG2 3.82Å; T648-V652 PolarHBondContact O-N 3.28Å; A649-V652 PolarHBondContact O-N 3.33Å; I650-V652 PolarHBondContact O-N 2.93Å; V652-F655 WeakPolarHBondContact O-CB 3.5Å; V652-F655 PolarHBondContact O-N 3.48Å; V652-F655 VanDerWaalsContact O-N 3.14Å; V652-L656 HydrophobicContact CG1-CD1 3.95Å; V652-L656 HydrophobicContact CG1-CG 4.1Å; V652-L656 VanDerWaalsContact O-CG 3.29Å; V652-L656 WeakPolarHBondContact O-CG 3.45Å; V652-L656 PolarHBondContact O-N 3.08Å; V652-F670 HydrophobicContact CG1-CE1 4.11Å; V652-F670 HydrophobicContact CG1-CZ 4.3Å; V652-F678 HydrophobicContact CG2-CE1 4.19Å; V652-F678 HydrophobicContact CG2-CZ 3.84Å; V652-V682 HydrophobicContact CB-CG1 4.22Å; V652-V682 HydrophobicContact CB-CG2 4.01Å; V652-V682 HydrophobicContact CG1-CG1 3.93Å; V652-V682 HydrophobicContact CG1-CG2 4.15Å
653	A	97.9	Very high	96.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.6	-53.7	177.4	0	0	0	0	0	112.3	A649 I650 F655 L656 L657 V682 C685 V686	A649-A653 WeakPolarHBondContact O-CB 3.05Å; A649-A653 PolarHBondContact O-N 3.48Å; I650-A653 WeakPolarHBondContact O-CB 3.28Å; I650-A653 PolarHBondContact O-N 3.19Å; A653-F655 VanDerWaalsContact C-N 3.27Å; A653-F655 PolarHBondContact O-N 3.37Å; A653-L656 PolarHBondContact O-N 2.72Å; A653-L657 WeakPolarHBondContact O-CG 3.44Å; A653-L657 PolarHBondContact O-N 3.19Å; A653-L657 VanDerWaalsContact O-N 3.07Å; A653-V682 HydrophobicContact CB-CG1 4.17Å; A653-C685 HydrophobicContact CB-CB 3.64Å; A653-V686 HydrophobicContact CB-CG2 3.57Å
654	H	97	Very high	96.2	Very high	58 Å²	58	45.2 Å²	45.2	27%	0.269	23%	0.234	S	C	.	.	H	α-helix	trans	-59.1	-38.9	174.4	-60.6	-58.1	0	0	0	111.7	I650 L657 Q658 E689	I650-H654 WeakPolarHBondContact CG2-NE2 3.31Å; I650-H654 PolarHBondContact O-CD2 3.04Å; I650-H654 VanDerWaalsContact O-CD2 3.27Å; I650-H654 PolarHBondContact O-N 3.46Å; H654-L657 PolarHBondContact O-N 2.87Å; H654-Q658 VanDerWaalsContact O-CB 3.22Å; H654-Q658 WeakPolarHBondContact O-CB 3.25Å; H654-Q658 VanDerWaalsContact O-CG 3.22Å; H654-Q658 WeakPolarHBondContact O-CG 3.37Å; H654-Q658 PolarHBondContact O-N 3.4Å; H654-E689 IonicContact CE1-OE1 3.47Å; H654-E689 PolarHBondContact CE1-OE1 3.39Å; H654-E689 VanDerWaalsContact CE1-OE1 3.3Å; H654-E689 IonicContact CE1-OE2 2.68Å; H654-E689 PolarHBondContact CE1-OE2 2.88Å; H654-E689 VanDerWaalsContact ND1-CD 3.3Å; H654-E689 IonicContact ND1-OE1 3.46Å; H654-E689 IonicContact ND1-OE2 3.77Å; H654-E689 PolarHBondContact ND1-OE2 2.93Å
655	F	97.4	Very high	96.1	Very high	10 Å²	10	47.4 Å²	47.4	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-47.1	177.3	169.3	-94.6	0	0	0	112.2	Y621 L625 I636 L639 V645 G651 V652 A653 R659 L662	Y621-F655 HydrophobicContact CE2-CE2 4.15Å; L625-F655 HydrophobicContact CD2-CZ 3.85Å; I636-F655 HydrophobicContact CD1-CD1 4.16Å; I636-F655 HydrophobicContact CD1-CE1 3.95Å; L639-F655 HydrophobicContact CD1-CE1 3.84Å; L639-F655 HydrophobicContact CD1-CE2 4.38Å; L639-F655 HydrophobicContact CD1-CZ 3.5Å; L639-F655 VanDerWaalsContact CD1-CZ 3.5Å; V645-F655 HydrophobicContact CG1-CB 4.16Å; V645-F655 HydrophobicContact CG1-CG 4.32Å; V645-F655 HydrophobicContact CG2-CB 4.26Å; V645-F655 HydrophobicContact CG2-CD1 4.12Å; V645-F655 HydrophobicContact CG2-CD2 3.37Å; V645-F655 HydrophobicContact CG2-CE1 4.34Å; V645-F655 HydrophobicContact CG2-CE2 3.65Å; V645-F655 HydrophobicContact CG2-CG 3.65Å; V645-F655 HydrophobicContact CG2-CZ 4.14Å; G651-F655 WeakPolarHBondContact O-CB 3.43Å; G651-F655 PolarHBondContact O-N 2.71Å; V652-F655 WeakPolarHBondContact O-CB 3.5Å; V652-F655 PolarHBondContact O-N 3.48Å; V652-F655 VanDerWaalsContact O-N 3.14Å; A653-F655 VanDerWaalsContact C-N 3.27Å; A653-F655 PolarHBondContact O-N 3.37Å; F655-R659 HydrophobicContact CD2-CB 4.13Å; F655-R659 HydrophobicContact CD2-CG 3.44Å; F655-R659 VanDerWaalsContact CD2-CG 3.44Å; F655-R659 HydrophobicContact CE2-CB 4.06Å; F655-R659 HydrophobicContact CE2-CG 3.72Å; F655-R659 HydrophobicContact CG-CG 4.22Å; F655-R659 VanDerWaalsContact O-CB 3.31Å; F655-R659 WeakPolarHBondContact O-CB 3.4Å; F655-R659 WeakPolarHBondContact O-CG 3.44Å; F655-R659 PolarHBondContact O-N 3.02Å; F655-L662 HydrophobicContact CD1-CD1 4.09Å; F655-L662 HydrophobicContact CE1-CD1 3.67Å; F655-L662 HydrophobicContact CE1-CD2 3.83Å; F655-L662 HydrophobicContact CE1-CG 4.32Å; F655-L662 HydrophobicContact CZ-CD1 4.07Å; F655-L662 HydrophobicContact CZ-CD2 3.98Å; F655-L662 HydrophobicContact CZ-CG 4.42Å
656	L	97.4	Very high	96.2	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-36.5	179.1	-65.6	173.6	0	0	0	112.7	F628 I636 V652 A653 L662 I667 F670 L671 V682	F628-L656 HydrophobicContact CE1-CD2 4.4Å; F628-L656 HydrophobicContact CE2-CD2 3.61Å; F628-L656 HydrophobicContact CZ-CD2 3.49Å; F628-L656 VanDerWaalsContact CZ-CD2 3.49Å; I636-L656 HydrophobicContact CD1-CD2 4.3Å; V652-L656 HydrophobicContact CG1-CD1 3.95Å; V652-L656 HydrophobicContact CG1-CG 4.1Å; V652-L656 VanDerWaalsContact O-CG 3.29Å; V652-L656 WeakPolarHBondContact O-CG 3.45Å; V652-L656 PolarHBondContact O-N 3.08Å; A653-L656 PolarHBondContact O-N 2.72Å; L656-L662 HydrophobicContact CD2-CD1 4.15Å; L656-I667 HydrophobicContact CB-CG2 4.45Å; L656-I667 HydrophobicContact CD2-CG1 4.23Å; L656-I667 WeakPolarHBondContact O-CD1 3.32Å; L656-F670 HydrophobicContact CD1-CD1 3.69Å; L656-F670 HydrophobicContact CD1-CE1 3.86Å; L656-L671 HydrophobicContact CD1-CD2 3.82Å; L656-L671 HydrophobicContact CD1-CG 4.3Å; L656-V682 HydrophobicContact CD1-CG1 3.9Å
657	L	94.4	Very high	96.3	Very high	26 Å²	26	43.9 Å²	43.9	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-73.3	-48.8	178.2	-69.7	174.6	0	0	0	112	A653 H654 R664 V686 E689 M690 H707	A653-L657 WeakPolarHBondContact O-CG 3.44Å; A653-L657 PolarHBondContact O-N 3.19Å; A653-L657 VanDerWaalsContact O-N 3.07Å; H654-L657 PolarHBondContact O-N 2.87Å; L657-R664 PolarHBondContact O-NH2 2.81Å; L657-V686 HydrophobicContact CD2-CG1 4.2Å; L657-V686 HydrophobicContact CG-CG2 4.47Å; L657-E689 HydrophobicContact CD1-CB 3.84Å; L657-E689 HydrophobicContact CD1-CG 4.28Å; L657-M690 HydrophobicContact CD2-CE 3.88Å; L657-H707 HydrophobicContact CD2-CB 3.79Å
658	Q	93.6	Very high	96.4	Very high	109 Å²	109	38.4 Å²	38.4	51%	0.509	19%	0.193	S	C	.	.	H	α-helix	trans	-91	-30.4	-166	-59.8	173.7	8.6	0	0	114.8	H654	H654-Q658 VanDerWaalsContact O-CB 3.22Å; H654-Q658 WeakPolarHBondContact O-CB 3.25Å; H654-Q658 VanDerWaalsContact O-CG 3.22Å; H654-Q658 WeakPolarHBondContact O-CG 3.37Å; H654-Q658 PolarHBondContact O-N 3.4Å
659	R	94.1	Very high	96.3	Very high	66 Å²	66	37.7 Å²	37.7	25%	0.249	19%	0.185	C	C	.	.			trans	-86.1	131.9	-170.9	-61.4	-56.7	-165.1	167	3.7	112.9	V592 F655 L662	V592-R659 VanDerWaalsContact CG1-CZ 3.44Å; V592-R659 PolarHBondContact O-NH1 3.36Å; V592-R659 PolarHBondContact O-NH2 3.07Å; F655-R659 HydrophobicContact CD2-CB 4.13Å; F655-R659 HydrophobicContact CD2-CG 3.44Å; F655-R659 VanDerWaalsContact CD2-CG 3.44Å; F655-R659 HydrophobicContact CE2-CB 4.06Å; F655-R659 HydrophobicContact CE2-CG 3.72Å; F655-R659 HydrophobicContact CG-CG 4.22Å; F655-R659 VanDerWaalsContact O-CB 3.31Å; F655-R659 WeakPolarHBondContact O-CB 3.4Å; F655-R659 WeakPolarHBondContact O-CG 3.44Å; F655-R659 PolarHBondContact O-N 3.02Å; R659-L662 HydrophobicContact CB-CD1 4.32Å
660	K	93.7	Very high	96.3	Very high	195 Å²	195	36.9 Å²	36.9	85%	0.848	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	149.5	174.1	-60.3	-179.2	-177.4	178.5	0	110.9
661	G	93.4	Very high	96.3	Very high	16 Å²	16	32 Å²	32	17%	0.165	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	1.3	-179.1	0	0	0	0	0	114.7	N629 H811	N629-G661 PolarHBondContact ND2-O 2.89Å; G661-H811 VanDerWaalsContact C-CE1 3.46Å; G661-H811 WeakPolarHBondContact CA-ND1 3.43Å; G661-H811 PolarHBondContact O-CE1 3.46Å; G661-H811 PolarHBondContact O-ND1 3.15Å
662	L	97.1	Very high	96.3	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.031	15%	0.147	C	C	.	.	S	Bend	trans	-91.2	136.9	164.3	-58.1	169.6	0	0	0	108.6	L625 F628 F655 L656 R659 I667	L625-L662 HydrophobicContact CD2-CD2 3.53Å; L625-L662 HydrophobicContact CD2-CG 4.05Å; F628-L662 HydrophobicContact CB-CD2 4.24Å; F628-L662 HydrophobicContact CD1-CB 4.47Å; F628-L662 HydrophobicContact CD1-CD2 3.46Å; F628-L662 VanDerWaalsContact CD1-CD2 3.46Å; F628-L662 HydrophobicContact CD2-CD2 4.48Å; F628-L662 HydrophobicContact CE1-CB 4.32Å; F628-L662 HydrophobicContact CE1-CD2 3.89Å; F628-L662 HydrophobicContact CG-CD2 3.8Å; F655-L662 HydrophobicContact CD1-CD1 4.09Å; F655-L662 HydrophobicContact CE1-CD1 3.67Å; F655-L662 HydrophobicContact CE1-CD2 3.83Å; F655-L662 HydrophobicContact CE1-CG 4.32Å; F655-L662 HydrophobicContact CZ-CD1 4.07Å; F655-L662 HydrophobicContact CZ-CD2 3.98Å; F655-L662 HydrophobicContact CZ-CG 4.42Å; L656-L662 HydrophobicContact CD2-CD1 4.15Å; R659-L662 HydrophobicContact CB-CD1 4.32Å; L662-I667 HydrophobicContact CB-CD1 3.93Å; L662-I667 HydrophobicContact CB-CG1 4.25Å
663	S	97.2	Very high	96.1	Very high	3 Å²	3	33 Å²	33	2%	0.021	16%	0.155	C	C	.	.			trans	-81.7	135.2	176.3	179	0	0	0	0	110.6	N629 Q665 M666 I667 D810 V812	N629-S663 PolarHBondContact OD1-N 2.86Å; S663-Q665 PolarHBondContact O-N 3.06Å; S663-M666 PolarHBondContact O-N 3.03Å; S663-I667 WeakPolarHBondContact O-CG1 3.45Å; S663-I667 PolarHBondContact O-N 3.05Å; S663-D810 VanDerWaalsContact CA-OD2 3.28Å; S663-D810 WeakPolarHBondContact CA-OD2 3.49Å; S663-D810 PolarHBondContact OG-OD2 3.46Å; S663-V812 WeakPolarHBondContact OG-CG2 3.38Å
664	R	95.8	Very high	95.8	Very high	36 Å²	36	36.1 Å²	36.1	14%	0.136	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-25	-178.2	-68	-77.1	172.2	-148.1	-5.1	112.6	L657 G668 H707 R709 D810	L657-R664 PolarHBondContact O-NH2 2.81Å; R664-G668 PolarHBondContact O-N 3.08Å; R664-H707 WeakPolarHBondContact CD-O 3.22Å; R664-H707 PolarHBondContact NH1-O 2.82Å; R664-R709 HydrophobicContact CB-CB 4.4Å; R664-R709 WeakPolarHBondContact O-CB 3.35Å; R664-R709 PolarHBondContact O-N 2.87Å; R664-R709 VanDerWaalsContact O-N 3.16Å; R664-D810 HydrophobicContact CG-CB 4.04Å; R664-D810 PolarHBondContact N-OD2 3.2Å
665	Q	95.5	Very high	95.6	Very high	63 Å²	63	41.1 Å²	41.1	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-66.4	-52.6	168.8	177.4	175.2	-28.3	0	0	111.8	S663 I667 G668 E669	S663-Q665 PolarHBondContact O-N 3.06Å; Q665-I667 VanDerWaalsContact C-N 3.25Å; Q665-I667 PolarHBondContact O-N 2.95Å; Q665-G668 CarbonylContact O-C 3.52Å; Q665-G668 WeakPolarHBondContact O-CA 3.42Å; Q665-G668 PolarHBondContact O-N 3.17Å; Q665-E669 HydrophobicContact CG-CG 4.49Å; Q665-E669 VanDerWaalsContact CG-OE1 3.28Å; Q665-E669 WeakPolarHBondContact CG-OE1 3.19Å; Q665-E669 PolarHBondContact NE2-OE1 2.79Å; Q665-E669 PolarHBondContact O-N 3.03Å
666	M	97.3	Very high	95.4	Very high	9 Å²	9	44.3 Å²	44.3	4%	0.044	22%	0.215	C	C	.	.	H	α-helix	trans	-69.1	-25.9	-174.3	-54.4	-53.3	-55.1	0	0	112.4	F628 P632 S663 E669 F670 P832	F628-M666 HydrophobicContact CD1-CB 4.23Å; F628-M666 HydrophobicContact CE1-CB 3.8Å; P632-M666 HydrophobicContact CG-CB 4.28Å; P632-M666 HydrophobicContact CG-CE 3.78Å; S663-M666 PolarHBondContact O-N 3.03Å; M666-E669 WeakPolarHBondContact CE-OE2 3.4Å; M666-E669 PolarHBondContact O-N 2.72Å; M666-F670 WeakPolarHBondContact O-CB 3.49Å; M666-F670 PolarHBondContact O-N 3.17Å; M666-P832 HydrophobicContact CG-CB 3.57Å; M666-P832 HydrophobicContact CG-CG 4.29Å; M666-P832 HydrophobicContact SD-CB 3.78Å; M666-P832 HydrophobicContact SD-CG 3.85Å
667	I	97.8	Very high	95.4	Very high	2 Å²	2	49 Å²	49	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-47.6	165.8	-64.8	168.7	0	0	0	110.7	F628 L656 L662 S663 Q665 E669 F670 L671 V708	F628-I667 HydrophobicContact CE1-CG1 4.05Å; F628-I667 HydrophobicContact CZ-CG1 4.11Å; L656-I667 HydrophobicContact CB-CG2 4.45Å; L656-I667 HydrophobicContact CD2-CG1 4.23Å; L656-I667 WeakPolarHBondContact O-CD1 3.32Å; L662-I667 HydrophobicContact CB-CD1 3.93Å; L662-I667 HydrophobicContact CB-CG1 4.25Å; S663-I667 WeakPolarHBondContact O-CG1 3.45Å; S663-I667 PolarHBondContact O-N 3.05Å; Q665-I667 VanDerWaalsContact C-N 3.25Å; Q665-I667 PolarHBondContact O-N 2.95Å; I667-E669 VanDerWaalsContact C-N 3.34Å; I667-E669 PolarHBondContact O-N 3.41Å; I667-F670 PolarHBondContact O-N 3.47Å; I667-L671 HydrophobicContact CG2-CD1 3.73Å; I667-L671 HydrophobicContact CG2-CG 4.37Å; I667-L671 WeakPolarHBondContact O-CB 3.5Å; I667-L671 VanDerWaalsContact O-CG 3.29Å; I667-L671 WeakPolarHBondContact O-CG 3.27Å; I667-L671 PolarHBondContact O-N 3.29Å; I667-V708 HydrophobicContact CG2-CG1 4.45Å; I667-V708 HydrophobicContact CG2-CG2 4.21Å
668	G	96.4	Very high	95.5	Very high	5 Å²	5	50.9 Å²	50.9	5%	0.052	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-37.9	175.4	0	0	0	0	0	113.2	R664 Q665 G672	R664-G668 PolarHBondContact O-N 3.08Å; Q665-G668 CarbonylContact O-C 3.52Å; Q665-G668 WeakPolarHBondContact O-CA 3.42Å; Q665-G668 PolarHBondContact O-N 3.17Å; G668-G672 PolarHBondContact O-N 2.99Å
669	E	96.3	Very high	95.7	Very high	54 Å²	54	45.8 Å²	45.8	25%	0.252	22%	0.22	S	C	.	.	H	α-helix	trans	-68.2	-34.7	176.7	-69.8	-179	-147.2	0	0	113.6	Q665 M666 I667	Q665-E669 HydrophobicContact CG-CG 4.49Å; Q665-E669 VanDerWaalsContact CG-OE1 3.28Å; Q665-E669 WeakPolarHBondContact CG-OE1 3.19Å; Q665-E669 PolarHBondContact NE2-OE1 2.79Å; Q665-E669 PolarHBondContact O-N 3.03Å; M666-E669 WeakPolarHBondContact CE-OE2 3.4Å; M666-E669 PolarHBondContact O-N 2.72Å; I667-E669 VanDerWaalsContact C-N 3.34Å; I667-E669 PolarHBondContact O-N 3.41Å
670	F	97.7	Very high	95.9	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-70.3	-50.3	174.5	179.9	-102	0	0	0	112.3	F628 P632 E633 I636 V652 L656 M666 I667 N673 F678 N679 V682	F628-F670 HydrophobicContact CE2-CB 4.29Å; F628-F670 HydrophobicContact CE2-CD2 4.47Å; F628-F670 HydrophobicContact CE2-CG 4.26Å; F628-F670 HydrophobicContact CZ-CB 4.26Å; P632-F670 HydrophobicContact CB-CB 3.65Å; P632-F670 HydrophobicContact CB-CD2 3.66Å; P632-F670 HydrophobicContact CB-CG 4.05Å; P632-F670 HydrophobicContact CG-CB 4.27Å; E633-F670 WeakPolarHBondContact OE2-CE2 3.48Å; I636-F670 HydrophobicContact CB-CE2 4.38Å; I636-F670 HydrophobicContact CG1-CD2 4.36Å; I636-F670 HydrophobicContact CG1-CE2 3.81Å; I636-F670 HydrophobicContact CG1-CZ 3.97Å; V652-F670 HydrophobicContact CG1-CE1 4.11Å; V652-F670 HydrophobicContact CG1-CZ 4.3Å; L656-F670 HydrophobicContact CD1-CD1 3.69Å; L656-F670 HydrophobicContact CD1-CE1 3.86Å; M666-F670 WeakPolarHBondContact O-CB 3.49Å; M666-F670 PolarHBondContact O-N 3.17Å; I667-F670 PolarHBondContact O-N 3.47Å; F670-N673 VanDerWaalsContact O-CB 3.29Å; F670-N673 WeakPolarHBondContact O-CB 3.21Å; F670-N673 PolarHBondContact O-N 3.28Å; F670-F678 HydrophobicContact CZ-CD1 4.41Å; F670-F678 HydrophobicContact CZ-CE1 4.35Å; F670-N679 VanDerWaalsContact CD2-ND2 3.32Å; F670-N679 WeakPolarHBondContact CD2-ND2 3.36Å; F670-N679 VanDerWaalsContact CE2-ND2 3.26Å; F670-N679 WeakPolarHBondContact CE2-ND2 3.28Å; F670-N679 PolarHBondContact O-ND2 3.46Å; F670-V682 HydrophobicContact CE1-CB 4.21Å; F670-V682 HydrophobicContact CE1-CG1 3.98Å; F670-V682 HydrophobicContact CE1-CG2 4.37Å
671	L	97.8	Very high	96.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.5	-32.9	-175.8	-64.8	177.1	0	0	0	112.3	L656 I667 N673 V682 L683 V686 V708 L720	L656-L671 HydrophobicContact CD1-CD2 3.82Å; L656-L671 HydrophobicContact CD1-CG 4.3Å; I667-L671 HydrophobicContact CG2-CD1 3.73Å; I667-L671 HydrophobicContact CG2-CG 4.37Å; I667-L671 WeakPolarHBondContact O-CB 3.5Å; I667-L671 VanDerWaalsContact O-CG 3.29Å; I667-L671 WeakPolarHBondContact O-CG 3.27Å; I667-L671 PolarHBondContact O-N 3.29Å; L671-N673 PolarHBondContact O-N 2.94Å; L671-V682 HydrophobicContact CD2-CB 4.31Å; L671-V682 HydrophobicContact CD2-CG1 3.73Å; L671-L683 HydrophobicContact CB-CB 4.29Å; L671-L683 HydrophobicContact CB-CD1 4.2Å; L671-L683 HydrophobicContact CD1-CD1 4.46Å; L671-L683 HydrophobicContact CD2-CB 4.16Å; L671-L683 WeakPolarHBondContact O-CD2 3.28Å; L671-V686 HydrophobicContact CD1-CB 4.41Å; L671-V686 HydrophobicContact CD1-CG1 4.01Å; L671-V686 HydrophobicContact CD1-CG2 4.2Å; L671-V686 HydrophobicContact CD2-CG2 4.15Å; L671-V708 HydrophobicContact CD1-CG1 4.2Å; L671-V708 HydrophobicContact CD1-CG2 3.84Å; L671-L720 HydrophobicContact CB-CD2 3.77Å
672	G	96.2	Very high	96.3	Very high	2 Å²	2	39.6 Å²	39.6	2%	0.021	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-1.8	173.2	0	0	0	0	0	114.6	G668 S674	G668-G672 PolarHBondContact O-N 2.99Å; G672-S674 PolarHBondContact O-N 2.95Å
673	N	94.4	Very high	96.4	Very high	31 Å²	31	39.3 Å²	39.3	17%	0.166	19%	0.19	C	C	.	.			trans	-78.2	85.2	179.6	-175	8.7	0	0	0	111.7	E633 F670 L671 K675 N679	E633-N673 PolarHBondContact OE1-ND2 2.73Å; F670-N673 VanDerWaalsContact O-CB 3.29Å; F670-N673 WeakPolarHBondContact O-CB 3.21Å; F670-N673 PolarHBondContact O-N 3.28Å; L671-N673 PolarHBondContact O-N 2.94Å; N673-K675 PolarHBondContact O-N 3.29Å; N673-K675 VanDerWaalsContact O-N 3.15Å; N673-K675 WeakPolarHBondContact OD1-CB 3.49Å; N673-K675 PolarHBondContact OD1-N 3.44Å; N673-N679 HydrophobicContact CB-CB 4.3Å; N673-N679 WeakPolarHBondContact O-CB 3.45Å
674	S	91.8	Very high	96.4	Very high	65 Å²	65	41.7 Å²	41.7	46%	0.455	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-8.7	178.6	56.5	0	0	0	0	115.4	G672	G672-S674 PolarHBondContact O-N 2.95Å
675	K	92.9	Very high	96.5	Very high	163 Å²	163	41.2 Å²	41.2	71%	0.709	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.2	-176.4	-60.3	-176.1	179.1	-177.6	0	114.2	N673	N673-K675 PolarHBondContact O-N 3.29Å; N673-K675 VanDerWaalsContact O-N 3.15Å; N673-K675 WeakPolarHBondContact OD1-CB 3.49Å; N673-K675 PolarHBondContact OD1-N 3.44Å
676	L	93.6	Very high	96.6	Very high	77 Å²	77	38.2 Å²	38.2	40%	0.403	19%	0.19	S	C	.	.	S	Bend	trans	-116	125.3	-175.3	-63.8	-179.3	0	0	0	109.1	E633 F678 N679 R680	E633-L676 HydrophobicContact CG-CD1 4.37Å; L676-F678 VanDerWaalsContact C-N 3.32Å; L676-F678 PolarHBondContact O-N 3.05Å; L676-N679 HydrophobicContact CB-CB 4.26Å; L676-N679 WeakPolarHBondContact CB-OD1 3.2Å; L676-N679 PolarHBondContact O-N 3.27Å; L676-R680 PolarHBondContact O-N 2.92Å
677	Q	96.4	Very high	96.6	Very high	99 Å²	99	38.1 Å²	38.1	46%	0.463	19%	0.19	S	C	.	.	H	α-helix	trans	-60.7	-42.8	-176.7	-174.3	55.9	39.6	0	0	111.7	N679 R680 D681	Q677-N679 VanDerWaalsContact C-N 3.26Å; Q677-N679 PolarHBondContact O-N 2.84Å; Q677-R680 WeakPolarHBondContact O-CA 3.2Å; Q677-R680 VanDerWaalsContact O-CB 3.29Å; Q677-R680 WeakPolarHBondContact O-CB 3.41Å; Q677-R680 PolarHBondContact O-N 3.45Å; Q677-D681 PolarHBondContact NE2-OD1 3.38Å; Q677-D681 PolarHBondContact O-N 3.43Å
678	F	97.4	Very high	96.6	Very high	66 Å²	66	42.2 Å²	42.2	29%	0.289	21%	0.212	S	C	.	.	H	α-helix	trans	-53.1	-40.7	176.3	-175	-104.8	0	0	0	113.2	I636 V652 F670 L676 R680 D681 V682	I636-F678 HydrophobicContact CG2-CE1 4.28Å; V652-F678 HydrophobicContact CG2-CE1 4.19Å; V652-F678 HydrophobicContact CG2-CZ 3.84Å; F670-F678 HydrophobicContact CZ-CD1 4.41Å; F670-F678 HydrophobicContact CZ-CE1 4.35Å; L676-F678 VanDerWaalsContact C-N 3.32Å; L676-F678 PolarHBondContact O-N 3.05Å; F678-R680 VanDerWaalsContact C-N 3.33Å; F678-R680 PolarHBondContact O-N 2.95Å; F678-D681 WeakPolarHBondContact CA-OD2 3.43Å; F678-D681 PolarHBondContact O-N 3.22Å; F678-V682 HydrophobicContact CD1-CG2 4.16Å; F678-V682 HydrophobicContact CE1-CG2 3.93Å; F678-V682 HydrophobicContact CE2-CG2 4.5Å; F678-V682 HydrophobicContact CZ-CG2 4.12Å; F678-V682 WeakPolarHBondContact O-CG2 3.18Å; F678-V682 PolarHBondContact O-N 3.42Å
679	N	97.4	Very high	96.5	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-33	178.4	-62	55.2	0	0	0	111.9	E633 F670 N673 L676 Q677 L683	E633-N679 PolarHBondContact OE1-ND2 3.22Å; E633-N679 PolarHBondContact OE2-ND2 3.48Å; F670-N679 VanDerWaalsContact CD2-ND2 3.32Å; F670-N679 WeakPolarHBondContact CD2-ND2 3.36Å; F670-N679 VanDerWaalsContact CE2-ND2 3.26Å; F670-N679 WeakPolarHBondContact CE2-ND2 3.28Å; F670-N679 PolarHBondContact O-ND2 3.46Å; N673-N679 HydrophobicContact CB-CB 4.3Å; N673-N679 WeakPolarHBondContact O-CB 3.45Å; L676-N679 HydrophobicContact CB-CB 4.26Å; L676-N679 WeakPolarHBondContact CB-OD1 3.2Å; L676-N679 PolarHBondContact O-N 3.27Å; Q677-N679 VanDerWaalsContact C-N 3.26Å; Q677-N679 PolarHBondContact O-N 2.84Å; N679-L683 WeakPolarHBondContact O-CB 3.28Å; N679-L683 PolarHBondContact O-N 3.48Å
680	R	97.1	Very high	96.5	Very high	87 Å²	87	44.6 Å²	44.6	33%	0.328	22%	0.222	S	C	.	.	H	α-helix	trans	-66.7	-50.4	171.5	-57.5	176.2	67.3	-139.9	1.3	110	L676 Q677 F678 V682 L683 D684	L676-R680 PolarHBondContact O-N 2.92Å; Q677-R680 WeakPolarHBondContact O-CA 3.2Å; Q677-R680 VanDerWaalsContact O-CB 3.29Å; Q677-R680 WeakPolarHBondContact O-CB 3.41Å; Q677-R680 PolarHBondContact O-N 3.45Å; F678-R680 VanDerWaalsContact C-N 3.33Å; F678-R680 PolarHBondContact O-N 2.95Å; R680-V682 VanDerWaalsContact C-N 3.27Å; R680-V682 PolarHBondContact O-N 3.04Å; R680-L683 WeakPolarHBondContact O-CB 3.43Å; R680-L683 PolarHBondContact O-N 3.39Å; R680-D684 PolarHBondContact O-N 3.01Å
681	D	98	Very high	96.4	Very high	60 Å²	60	48.6 Å²	48.6	32%	0.321	24%	0.243	S	C	.	.	H	α-helix	trans	-56.7	-40.6	178.1	-51.3	-34.7	0	0	0	111.5	A649 Q677 F678 C685	A649-D681 HydrophobicContact CB-CB 3.8Å; Q677-D681 PolarHBondContact NE2-OD1 3.38Å; Q677-D681 PolarHBondContact O-N 3.43Å; F678-D681 WeakPolarHBondContact CA-OD2 3.43Å; F678-D681 PolarHBondContact O-N 3.22Å; D681-C685 WeakPolarHBondContact O-CB 3.23Å; D681-C685 PolarHBondContact O-N 3Å; D681-C685 PolarHBondContact O-SG 3.35Å
682	V	98.4	Very high	96.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.5	-40.5	175.4	178.8	0	0	0	0	111.7	A649 V652 A653 L656 F670 L671 F678 R680 D684 C685 V686	A649-V682 HydrophobicContact CB-CG2 3.91Å; V652-V682 HydrophobicContact CB-CG1 4.22Å; V652-V682 HydrophobicContact CB-CG2 4.01Å; V652-V682 HydrophobicContact CG1-CG1 3.93Å; V652-V682 HydrophobicContact CG1-CG2 4.15Å; A653-V682 HydrophobicContact CB-CG1 4.17Å; L656-V682 HydrophobicContact CD1-CG1 3.9Å; F670-V682 HydrophobicContact CE1-CB 4.21Å; F670-V682 HydrophobicContact CE1-CG1 3.98Å; F670-V682 HydrophobicContact CE1-CG2 4.37Å; L671-V682 HydrophobicContact CD2-CB 4.31Å; L671-V682 HydrophobicContact CD2-CG1 3.73Å; F678-V682 HydrophobicContact CD1-CG2 4.16Å; F678-V682 HydrophobicContact CE1-CG2 3.93Å; F678-V682 HydrophobicContact CE2-CG2 4.5Å; F678-V682 HydrophobicContact CZ-CG2 4.12Å; F678-V682 WeakPolarHBondContact O-CG2 3.18Å; F678-V682 PolarHBondContact O-N 3.42Å; R680-V682 VanDerWaalsContact C-N 3.27Å; R680-V682 PolarHBondContact O-N 3.04Å; V682-D684 VanDerWaalsContact C-N 3.35Å; V682-C685 PolarHBondContact O-N 2.76Å; V682-V686 HydrophobicContact CG1-CG2 4.35Å; V682-V686 WeakPolarHBondContact O-CB 3.44Å; V682-V686 VanDerWaalsContact O-CG2 3.29Å; V682-V686 WeakPolarHBondContact O-CG2 3.45Å; V682-V686 PolarHBondContact O-N 2.89Å
683	L	98.3	Very high	96.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.3	-42.6	174.9	171.6	58.8	0	0	0	111.4	L671 N679 R680 C685 V686 V687 F704 R719 L720 A723	L671-L683 HydrophobicContact CB-CB 4.29Å; L671-L683 HydrophobicContact CB-CD1 4.2Å; L671-L683 HydrophobicContact CD1-CD1 4.46Å; L671-L683 HydrophobicContact CD2-CB 4.16Å; L671-L683 WeakPolarHBondContact O-CD2 3.28Å; N679-L683 WeakPolarHBondContact O-CB 3.28Å; N679-L683 PolarHBondContact O-N 3.48Å; R680-L683 WeakPolarHBondContact O-CB 3.43Å; R680-L683 PolarHBondContact O-N 3.39Å; L683-C685 VanDerWaalsContact C-N 3.33Å; L683-C685 PolarHBondContact O-N 2.88Å; L683-V686 WeakPolarHBondContact O-CA 3.19Å; L683-V686 WeakPolarHBondContact O-CB 3.38Å; L683-V686 PolarHBondContact O-N 3.26Å; L683-V687 HydrophobicContact CD1-CG1 4.12Å; L683-V687 PolarHBondContact O-N 2.98Å; L683-F704 HydrophobicContact CD1-CZ 4.43Å; L683-R719 HydrophobicContact CD2-CG 3.9Å; L683-L720 HydrophobicContact CD1-CD2 3.91Å; L683-L720 HydrophobicContact CD2-CD2 4.18Å; L683-A723 HydrophobicContact CD1-CB 4.21Å; L683-A723 HydrophobicContact CD2-CB 3.69Å; L683-A723 HydrophobicContact CG-CB 3.75Å
684	D	97.8	Very high	96.6	Very high	52 Å²	52	54 Å²	54	28%	0.278	30%	0.295	S	S	.	.	H	α-helix	trans	-62.5	-43.7	178.4	-59.6	-24.6	0	0	0	109.6	R680 V682 V686 V687 D688 R719	R680-D684 PolarHBondContact O-N 3.01Å; V682-D684 VanDerWaalsContact C-N 3.35Å; D684-V686 PolarHBondContact O-N 2.9Å; D684-V687 VanDerWaalsContact O-CG2 3.24Å; D684-V687 WeakPolarHBondContact O-CG2 3.35Å; D684-V687 PolarHBondContact O-N 3.44Å; D684-D688 WeakPolarHBondContact O-CB 3.35Å; D684-D688 PolarHBondContact O-N 3.28Å; D684-R719 IonicContact OD1-CZ 3.82Å; D684-R719 IonicContact OD1-NH2 2.78Å; D684-R719 PolarHBondContact OD1-NH2 3.45Å; D684-R719 IonicContact OD2-NH2 2.72Å; D684-R719 PolarHBondContact OD2-NH2 2.96Å
685	C	98.1	Very high	96.8	Very high	26 Å²	26	53 Å²	53	18%	0.176	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-36.2	169.7	-64.7	0	0	0	0	113.8	I650 A653 D681 V682 L683 D688 E689	I650-C685 HydrophobicContact CG1-CB 4.4Å; I650-C685 VanDerWaalsContact CG1-SG 3.54Å; A653-C685 HydrophobicContact CB-CB 3.64Å; D681-C685 WeakPolarHBondContact O-CB 3.23Å; D681-C685 PolarHBondContact O-N 3Å; D681-C685 PolarHBondContact O-SG 3.35Å; V682-C685 PolarHBondContact O-N 2.76Å; L683-C685 VanDerWaalsContact C-N 3.33Å; L683-C685 PolarHBondContact O-N 2.88Å; C685-D688 PolarHBondContact O-N 3.23Å; C685-E689 WeakPolarHBondContact O-CG 3.4Å; C685-E689 PolarHBondContact O-N 3.31Å; C685-E689 VanDerWaalsContact O-N 3.15Å
686	V	98.1	Very high	97	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-35.2	178.8	160.5	0	0	0	0	112	A653 L657 L671 V682 L683 D684 M690 V708	A653-V686 HydrophobicContact CB-CG2 3.57Å; L657-V686 HydrophobicContact CD2-CG1 4.2Å; L657-V686 HydrophobicContact CG-CG2 4.47Å; L671-V686 HydrophobicContact CD1-CB 4.41Å; L671-V686 HydrophobicContact CD1-CG1 4.01Å; L671-V686 HydrophobicContact CD1-CG2 4.2Å; L671-V686 HydrophobicContact CD2-CG2 4.15Å; V682-V686 HydrophobicContact CG1-CG2 4.35Å; V682-V686 WeakPolarHBondContact O-CB 3.44Å; V682-V686 VanDerWaalsContact O-CG2 3.29Å; V682-V686 WeakPolarHBondContact O-CG2 3.45Å; V682-V686 PolarHBondContact O-N 2.89Å; L683-V686 WeakPolarHBondContact O-CA 3.19Å; L683-V686 WeakPolarHBondContact O-CB 3.38Å; L683-V686 PolarHBondContact O-N 3.26Å; D684-V686 PolarHBondContact O-N 2.9Å; V686-M690 HydrophobicContact CG1-CE 4.07Å; V686-V708 HydrophobicContact CG1-CG2 4.33Å
687	V	97.6	Very high	97.2	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.036	25%	0.251	C	S	.	.	H	α-helix	trans	-79.7	-30.1	174.2	-61.4	0	0	0	0	111.8	L683 D684 E689 M690 F704 A723 R727	L683-V687 HydrophobicContact CD1-CG1 4.12Å; L683-V687 PolarHBondContact O-N 2.98Å; D684-V687 VanDerWaalsContact O-CG2 3.24Å; D684-V687 WeakPolarHBondContact O-CG2 3.35Å; D684-V687 PolarHBondContact O-N 3.44Å; V687-E689 VanDerWaalsContact C-N 3.32Å; V687-E689 PolarHBondContact O-N 3.15Å; V687-M690 WeakPolarHBondContact O-CA 3.32Å; V687-M690 WeakPolarHBondContact O-CB 3.3Å; V687-M690 PolarHBondContact O-N 3.1Å; V687-M690 VanDerWaalsContact O-O 3.1Å; V687-F704 HydrophobicContact CG1-CD2 4.28Å; V687-F704 HydrophobicContact CG1-CE2 3.72Å; V687-F704 HydrophobicContact CG1-CZ 4.48Å; V687-A723 HydrophobicContact CG1-CB 4.3Å; V687-A723 HydrophobicContact CG2-CB 4.49Å; V687-R727 HydrophobicContact CB-CB 3.92Å; V687-R727 HydrophobicContact CB-CG 3.99Å; V687-R727 HydrophobicContact CG2-CB 3.96Å; V687-R727 HydrophobicContact CG2-CG 4.3Å; V687-R727 WeakPolarHBondContact O-CD 3.44Å; V687-R727 WeakPolarHBondContact O-CG 3.48Å; V687-R727 PolarHBondContact O-NE 3.5Å; V687-R727 VanDerWaalsContact O-NE 3.11Å
688	D	96.4	Very high	97.3	Very high	88 Å²	88	41.1 Å²	41.1	47%	0.471	23%	0.229	S	C	.	.	H	α-helix	trans	-67.1	-30.9	175.2	-84.1	-15.1	0	0	0	113.8	D684 C685 M690 R727	D684-D688 WeakPolarHBondContact O-CB 3.35Å; D684-D688 PolarHBondContact O-N 3.28Å; C685-D688 PolarHBondContact O-N 3.23Å; D688-M690 PolarHBondContact O-N 3.12Å; D688-R727 PolarHBondContact O-NH2 3.21Å; D688-R727 IonicContact OD1-CZ 3.3Å; D688-R727 IonicContact OD1-NE 2.96Å; D688-R727 IonicContact OD1-NH1 3.44Å; D688-R727 PolarHBondContact OD1-NH1 3.35Å
689	E	95.8	Very high	97.3	Very high	100 Å²	100	41.9 Å²	41.9	47%	0.467	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-6	167.2	-76.2	-81.9	106.4	0	0	113.5	H654 L657 C685 V687	H654-E689 IonicContact CE1-OE1 3.47Å; H654-E689 PolarHBondContact CE1-OE1 3.39Å; H654-E689 VanDerWaalsContact CE1-OE1 3.3Å; H654-E689 IonicContact CE1-OE2 2.68Å; H654-E689 PolarHBondContact CE1-OE2 2.88Å; H654-E689 VanDerWaalsContact ND1-CD 3.3Å; H654-E689 IonicContact ND1-OE1 3.46Å; H654-E689 IonicContact ND1-OE2 3.77Å; H654-E689 PolarHBondContact ND1-OE2 2.93Å; L657-E689 HydrophobicContact CD1-CB 3.84Å; L657-E689 HydrophobicContact CD1-CG 4.28Å; C685-E689 WeakPolarHBondContact O-CG 3.4Å; C685-E689 PolarHBondContact O-N 3.31Å; C685-E689 VanDerWaalsContact O-N 3.15Å; V687-E689 VanDerWaalsContact C-N 3.32Å; V687-E689 PolarHBondContact O-N 3.15Å
690	M	95.3	Very high	97.4	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.049	23%	0.233	C	C	.	.			trans	-109.3	123.8	176.3	-55.8	-163	-159.5	0	0	111.8	L657 V686 V687 D688 F692 F704 H707 R727	L657-M690 HydrophobicContact CD2-CE 3.88Å; V686-M690 HydrophobicContact CG1-CE 4.07Å; V687-M690 WeakPolarHBondContact O-CA 3.32Å; V687-M690 WeakPolarHBondContact O-CB 3.3Å; V687-M690 PolarHBondContact O-N 3.1Å; V687-M690 VanDerWaalsContact O-O 3.1Å; D688-M690 PolarHBondContact O-N 3.12Å; M690-F692 HydrophobicContact CB-CD1 4.5Å; M690-F692 HydrophobicContact CB-CE1 3.75Å; M690-F692 HydrophobicContact CB-CE2 4.14Å; M690-F692 HydrophobicContact CB-CZ 3.52Å; M690-F692 HydrophobicContact CG-CZ 4.29Å; M690-F692 HydrophobicContact SD-CE1 4.16Å; M690-F692 HydrophobicContact SD-CZ 3.92Å; M690-F704 HydrophobicContact CE-CD2 3.89Å; M690-F704 HydrophobicContact SD-CB 4.23Å; M690-F704 HydrophobicContact SD-CD2 3.87Å; M690-H707 HydrophobicContact CE-CB 4.02Å; M690-R727 PolarHBondContact O-NE 2.89Å; M690-R727 PolarHBondContact O-NH2 3.04Å
691	D	96.1	Very high	97.4	Very high	85 Å²	85	37.6 Å²	37.6	46%	0.455	22%	0.217	S	C	.	.			trans	-84.9	130.3	165.4	174.4	26	0	0	0	109.8	S693 K703	D691-S693 WeakPolarHBondContact OD1-CB 3.4Å; D691-S693 PolarHBondContact OD1-N 3.42Å; D691-S693 PolarHBondContact OD1-OG 3.42Å; D691-K703 WeakPolarHBondContact O-CE 3.37Å; D691-K703 PolarHBondContact O-NZ 3.28Å
692	F	97.9	Very high	97.4	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.			trans	-121.3	12.5	173.5	-56.9	-49.7	0	0	0	112.5	M690 G694 M695 A700 K703 F704 F724 R727 Y728 C731 N732	M690-F692 HydrophobicContact CB-CD1 4.5Å; M690-F692 HydrophobicContact CB-CE1 3.75Å; M690-F692 HydrophobicContact CB-CE2 4.14Å; M690-F692 HydrophobicContact CB-CZ 3.52Å; M690-F692 HydrophobicContact CG-CZ 4.29Å; M690-F692 HydrophobicContact SD-CE1 4.16Å; M690-F692 HydrophobicContact SD-CZ 3.92Å; F692-G694 PolarHBondContact O-N 3.27Å; F692-M695 WeakPolarHBondContact O-CB 3.2Å; F692-M695 PolarHBondContact O-N 3.01Å; F692-A700 HydrophobicContact CB-CB 3.94Å; F692-A700 HydrophobicContact CD1-CB 3.69Å; F692-A700 HydrophobicContact CE1-CB 4.39Å; F692-A700 HydrophobicContact CG-CB 3.89Å; F692-K703 HydrophobicContact CD1-CD 4.24Å; F692-K703 HydrophobicContact CE1-CB 4.32Å; F692-K703 HydrophobicContact CE1-CD 4.31Å; F692-K703 HydrophobicContact CE1-CG 4.4Å; F692-F704 HydrophobicContact CE1-CB 4.41Å; F692-F704 HydrophobicContact CZ-CB 4.11Å; F692-F724 HydrophobicContact CD1-CE2 4.48Å; F692-F724 HydrophobicContact CD2-CD2 4.45Å; F692-F724 HydrophobicContact CD2-CE2 4.18Å; F692-F724 HydrophobicContact CE1-CD2 4.49Å; F692-F724 HydrophobicContact CE1-CE2 4.12Å; F692-F724 AromaticContact CE2-CD2 3.69Å; F692-F724 HydrophobicContact CE2-CD2 3.69Å; F692-F724 AromaticContact CE2-CE2 3.79Å; F692-F724 HydrophobicContact CE2-CE2 3.79Å; F692-F724 AromaticContact CZ-CD2 3.72Å; F692-F724 HydrophobicContact CZ-CD2 3.72Å; F692-F724 AromaticContact CZ-CE2 3.77Å; F692-F724 HydrophobicContact CZ-CE2 3.77Å; F692-R727 HydrophobicContact CD2-CB 4.3Å; F692-R727 HydrophobicContact CD2-CG 3.72Å; F692-R727 HydrophobicContact CE2-CB 4.08Å; F692-R727 HydrophobicContact CE2-CG 3.63Å; F692-Y728 HydrophobicContact CB-CD2 4.21Å; F692-C731 HydrophobicContact CB-CB 4.02Å; F692-N732 PolarHBondContact O-ND2 3Å; F692-N732 PolarHBondContact O-OD1 2.97Å
693	S	97.8	Very high	97.3	Very high	67 Å²	67	39.9 Å²	39.9	47%	0.469	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	127.9	-171.4	-45.2	0	0	0	0	111.6	D691 M695	D691-S693 WeakPolarHBondContact OD1-CB 3.4Å; D691-S693 PolarHBondContact OD1-N 3.42Å; D691-S693 PolarHBondContact OD1-OG 3.42Å; S693-M695 PolarHBondContact O-N 3.04Å
694	G	95.9	Very high	97.2	Very high	79 Å²	79	39.9 Å²	39.9	81%	0.814	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.5	14.6	-178.7	0	0	0	0	0	114.8	F692 N732	F692-G694 PolarHBondContact O-N 3.27Å; G694-N732 PolarHBondContact N-OD1 3.18Å
695	M	97.6	Very high	97.1	Very high	44 Å²	44	37.6 Å²	37.6	22%	0.217	21%	0.211	C	C	.	.			trans	-97.5	144.8	174.8	-59.3	-170.9	69.5	0	0	110.8	F692 S693 E699 A700 K703 Y728	F692-M695 WeakPolarHBondContact O-CB 3.2Å; F692-M695 PolarHBondContact O-N 3.01Å; S693-M695 PolarHBondContact O-N 3.04Å; M695-E699 HydrophobicContact CE-CB 3.82Å; M695-E699 WeakPolarHBondContact CE-O 3.34Å; M695-A700 HydrophobicContact CB-CB 4.19Å; M695-K703 HydrophobicContact CE-CB 4.31Å; M695-K703 HydrophobicContact CE-CD 4.07Å; M695-K703 HydrophobicContact SD-CD 3.66Å; M695-Y728 WeakPolarHBondContact O-CE2 3.17Å; M695-Y728 PolarHBondContact O-OH 3.28Å
696	E	97.1	Very high	96.9	Very high	84 Å²	84	37 Å²	37	39%	0.393	21%	0.208	S	C	.	.			trans	-72.4	154.9	167.7	-70.1	-171.7	72.8	0	0	111.4	D698 E699 A700 R799	E696-D698 VanDerWaalsContact C-N 3.35Å; E696-D698 PolarHBondContact O-N 3.42Å; E696-E699 HydrophobicContact CB-CG 4.4Å; E696-E699 WeakPolarHBondContact O-CA 3.26Å; E696-E699 WeakPolarHBondContact O-CB 3.21Å; E696-E699 PolarHBondContact O-N 3.21Å; E696-A700 PolarHBondContact O-N 3.04Å; E696-R799 IonicContact OE1-CZ 3.66Å; E696-R799 IonicContact OE1-NH1 3.78Å; E696-R799 PolarHBondContact OE1-NH1 2.97Å; E696-R799 IonicContact OE1-NH2 3.71Å; E696-R799 PolarHBondContact OE1-NH2 3.27Å; E696-R799 IonicContact OE2-CZ 3.42Å; E696-R799 VanDerWaalsContact OE2-CZ 3.31Å; E696-R799 IonicContact OE2-NH1 3.23Å; E696-R799 PolarHBondContact OE2-NH1 3.37Å; E696-R799 IonicContact OE2-NH2 3.31Å
697	L	97.6	Very high	96.7	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-57.4	-41	-168.5	-175.3	63.1	0	0	0	113.9	E699 L701 F724 Y728 I745 L748 A749	L697-E699 VanDerWaalsContact C-N 3.34Å; L697-L701 VanDerWaalsContact O-CB 3.22Å; L697-L701 WeakPolarHBondContact O-CB 3.38Å; L697-L701 PolarHBondContact O-N 3.43Å; L697-F724 HydrophobicContact CD1-CE1 3.82Å; L697-F724 HydrophobicContact CD1-CZ 4.04Å; L697-Y728 HydrophobicContact CB-CE2 4.22Å; L697-Y728 HydrophobicContact CD1-CD1 3.79Å; L697-Y728 HydrophobicContact CD1-CD2 3.87Å; L697-Y728 HydrophobicContact CD1-CE1 3.87Å; L697-Y728 HydrophobicContact CD1-CE2 3.94Å; L697-Y728 HydrophobicContact CD1-CG 3.78Å; L697-Y728 PolarHBondContact N-OH 3.4Å; L697-I745 HydrophobicContact CD1-CG2 3.87Å; L697-I745 HydrophobicContact CD2-CG2 4.37Å; L697-L748 HydrophobicContact CD2-CB 3.95Å; L697-L748 HydrophobicContact CD2-CD2 3.77Å; L697-L748 HydrophobicContact CD2-CG 3.78Å; L697-A749 HydrophobicContact CD1-CB 4.45Å; L697-A749 HydrophobicContact CD2-CB 4.3Å
698	D	97.6	Very high	96.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-73.1	-25.8	177.3	73	-75.3	0	0	0	112.8	E696 R702 V752 I796 R799 I800	E696-D698 VanDerWaalsContact C-N 3.35Å; E696-D698 PolarHBondContact O-N 3.42Å; D698-R702 WeakPolarHBondContact O-CB 3.33Å; D698-R702 PolarHBondContact O-N 3.47Å; D698-R702 IonicContact OD2-NH2 3.5Å; D698-R702 PolarHBondContact OD2-NH2 2.89Å; D698-V752 HydrophobicContact CB-CG1 4.08Å; D698-I796 HydrophobicContact CB-CG2 4.47Å; D698-R799 IonicContact OD1-CZ 3.77Å; D698-R799 IonicContact OD1-NE 2.7Å; D698-R799 PolarHBondContact OD1-NE 2.81Å; D698-R799 IonicContact OD1-NH2 2.76Å; D698-R799 PolarHBondContact OD1-NH2 3.07Å; D698-R799 WeakPolarHBondContact OD2-CB 3.23Å; D698-R799 IonicContact OD2-NE 3.96Å; D698-R799 PolarHBondContact OD2-NE 3.09Å; D698-I800 HydrophobicContact CB-CD1 4.21Å; D698-I800 HydrophobicContact CB-CG1 4.35Å
699	E	97.9	Very high	96.3	Very high	82 Å²	82	39.5 Å²	39.5	38%	0.383	21%	0.213	S	C	.	.	H	α-helix	trans	-76.5	-42.1	175.2	-57.6	-160.3	128.9	0	0	111.7	M695 E696 L697 R702 K703	M695-E699 HydrophobicContact CE-CB 3.82Å; M695-E699 WeakPolarHBondContact CE-O 3.34Å; E696-E699 HydrophobicContact CB-CG 4.4Å; E696-E699 WeakPolarHBondContact O-CA 3.26Å; E696-E699 WeakPolarHBondContact O-CB 3.21Å; E696-E699 PolarHBondContact O-N 3.21Å; L697-E699 VanDerWaalsContact C-N 3.34Å; E699-R702 WeakPolarHBondContact O-CB 3.47Å; E699-R702 PolarHBondContact O-N 2.99Å; E699-K703 PolarHBondContact O-N 3.48Å
700	A	98.2	Very high	96.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-45.7	171	0	0	0	0	0	110.9	F692 M695 E696 R702 K703 F704 F724 Y728	F692-A700 HydrophobicContact CB-CB 3.94Å; F692-A700 HydrophobicContact CD1-CB 3.69Å; F692-A700 HydrophobicContact CE1-CB 4.39Å; F692-A700 HydrophobicContact CG-CB 3.89Å; M695-A700 HydrophobicContact CB-CB 4.19Å; E696-A700 PolarHBondContact O-N 3.04Å; A700-R702 VanDerWaalsContact C-N 3.29Å; A700-R702 PolarHBondContact O-N 3.21Å; A700-K703 WeakPolarHBondContact O-CB 3.48Å; A700-K703 PolarHBondContact O-N 3.14Å; A700-K703 VanDerWaalsContact O-N 3.11Å; A700-F704 PolarHBondContact O-N 3.22Å; A700-F724 VanDerWaalsContact C-CE2 3.46Å; A700-F724 HydrophobicContact CB-CE2 3.88Å; A700-F724 HydrophobicContact CB-CZ 3.83Å; A700-Y728 HydrophobicContact CB-CD2 3.56Å; A700-Y728 HydrophobicContact CB-CE2 3.79Å
701	L	97.9	Very high	95.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.3	-36.9	175.9	-179.6	59.4	0	0	0	111.5	L697 F704 Q705 I721 F724 V752 V753 L805	L697-L701 VanDerWaalsContact O-CB 3.22Å; L697-L701 WeakPolarHBondContact O-CB 3.38Å; L697-L701 PolarHBondContact O-N 3.43Å; L701-F704 HydrophobicContact CD1-CD1 4.39Å; L701-F704 PolarHBondContact O-N 3.42Å; L701-Q705 VanDerWaalsContact O-CB 3.23Å; L701-Q705 WeakPolarHBondContact O-CB 3.41Å; L701-Q705 PolarHBondContact O-N 3.14Å; L701-I721 HydrophobicContact CD1-CD1 3.59Å; L701-F724 VanDerWaalsContact CA-CZ 3.47Å; L701-F724 HydrophobicContact CB-CE1 3.91Å; L701-F724 HydrophobicContact CB-CE2 4.36Å; L701-F724 HydrophobicContact CB-CZ 3.7Å; L701-F724 HydrophobicContact CD1-CD1 4.03Å; L701-F724 HydrophobicContact CD1-CE1 4Å; L701-F724 HydrophobicContact CD1-CG 4.43Å; L701-F724 HydrophobicContact CD1-CZ 4.37Å; L701-F724 HydrophobicContact CG-CE1 4.47Å; L701-F724 VanDerWaalsContact N-CZ 3.26Å; L701-V752 HydrophobicContact CD2-CB 4.07Å; L701-V752 HydrophobicContact CD2-CG1 3.74Å; L701-V753 HydrophobicContact CD2-CG2 3.99Å; L701-L805 HydrophobicContact CD2-CD1 4.19Å; L701-L805 HydrophobicContact CG-CD1 4.48Å
702	R	97.4	Very high	95.2	Very high	27 Å²	27	37.2 Å²	37.2	10%	0.102	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-38.7	173.2	-169.3	-175.7	-53.6	-88.3	7.7	112.4	D698 E699 A700 A706 R799 R803 E804 L805	D698-R702 WeakPolarHBondContact O-CB 3.33Å; D698-R702 PolarHBondContact O-N 3.47Å; D698-R702 IonicContact OD2-NH2 3.5Å; D698-R702 PolarHBondContact OD2-NH2 2.89Å; E699-R702 WeakPolarHBondContact O-CB 3.47Å; E699-R702 PolarHBondContact O-N 2.99Å; A700-R702 VanDerWaalsContact C-N 3.29Å; A700-R702 PolarHBondContact O-N 3.21Å; R702-A706 WeakPolarHBondContact O-CB 3.36Å; R702-A706 PolarHBondContact O-N 2.98Å; R702-R799 PolarHBondContact NH2-O 3.42Å; R702-R803 PolarHBondContact NH1-O 3.47Å; R702-R803 PolarHBondContact NH2-O 2.73Å; R702-E804 PolarHBondContact NH1-O 3.28Å; R702-L805 HydrophobicContact CB-CD2 3.61Å; R702-L805 HydrophobicContact CG-CD2 3.87Å
703	K	96.8	Very high	94.7	Very high	80 Å²	80	42.5 Å²	42.5	35%	0.348	24%	0.242	S	C	.	.	H	α-helix	trans	-65.8	-39.6	175	-174	176	-177.9	177.1	0	112	D691 F692 M695 E699 A700 H707	D691-K703 WeakPolarHBondContact O-CE 3.37Å; D691-K703 PolarHBondContact O-NZ 3.28Å; F692-K703 HydrophobicContact CD1-CD 4.24Å; F692-K703 HydrophobicContact CE1-CB 4.32Å; F692-K703 HydrophobicContact CE1-CD 4.31Å; F692-K703 HydrophobicContact CE1-CG 4.4Å; M695-K703 HydrophobicContact CE-CB 4.31Å; M695-K703 HydrophobicContact CE-CD 4.07Å; M695-K703 HydrophobicContact SD-CD 3.66Å; E699-K703 PolarHBondContact O-N 3.48Å; A700-K703 WeakPolarHBondContact O-CB 3.48Å; A700-K703 PolarHBondContact O-N 3.14Å; A700-K703 VanDerWaalsContact O-N 3.11Å; K703-H707 PolarHBondContact O-ND1 3.17Å
704	F	97.3	Very high	94.4	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.5	-52.9	172.7	179.7	-112.9	0	0	0	112	L683 V687 M690 F692 A700 L701 A706 H707 V708 V710 L720 F724	L683-F704 HydrophobicContact CD1-CZ 4.43Å; V687-F704 HydrophobicContact CG1-CD2 4.28Å; V687-F704 HydrophobicContact CG1-CE2 3.72Å; V687-F704 HydrophobicContact CG1-CZ 4.48Å; M690-F704 HydrophobicContact CE-CD2 3.89Å; M690-F704 HydrophobicContact SD-CB 4.23Å; M690-F704 HydrophobicContact SD-CD2 3.87Å; F692-F704 HydrophobicContact CE1-CB 4.41Å; F692-F704 HydrophobicContact CZ-CB 4.11Å; A700-F704 PolarHBondContact O-N 3.22Å; L701-F704 HydrophobicContact CD1-CD1 4.39Å; L701-F704 PolarHBondContact O-N 3.42Å; F704-A706 PolarHBondContact O-N 3.22Å; F704-H707 PolarHBondContact O-N 3.27Å; F704-V708 HydrophobicContact CE2-CG2 4.2Å; F704-V708 HydrophobicContact CZ-CB 4.37Å; F704-V708 HydrophobicContact CZ-CG2 4.47Å; F704-V708 PolarHBondContact O-N 2.87Å; F704-V708 VanDerWaalsContact O-N 3.08Å; F704-V710 HydrophobicContact CD1-CG2 3.86Å; F704-V710 HydrophobicContact CE1-CG2 3.64Å; F704-L720 HydrophobicContact CE1-CB 4.27Å; F704-L720 HydrophobicContact CZ-CB 4.34Å; F704-L720 HydrophobicContact CZ-CD2 4.2Å; F704-F724 HydrophobicContact CB-CD2 3.79Å; F704-F724 HydrophobicContact CB-CE2 4.17Å; F704-F724 HydrophobicContact CD1-CB 4.08Å; F704-F724 HydrophobicContact CD1-CD2 4.15Å; F704-F724 HydrophobicContact CD1-CG 4.2Å; F704-F724 HydrophobicContact CD2-CD2 4.49Å; F704-F724 HydrophobicContact CE1-CB 4.03Å; F704-F724 HydrophobicContact CG-CB 4.41Å; F704-F724 AromaticContact CG-CD2 3.92Å; F704-F724 HydrophobicContact CG-CD2 3.92Å; F704-F724 HydrophobicContact CG-CG 4.41Å; F704-F724 HydrophobicContact CZ-CB 4.33Å
705	Q	95.2	Very high	94.2	Very high	4 Å²	4	46 Å²	46	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-24	-177	-174.3	171	-24.4	0	0	113.3	L701 H707 V708 V710 L805 S807	L701-Q705 VanDerWaalsContact O-CB 3.23Å; L701-Q705 WeakPolarHBondContact O-CB 3.41Å; L701-Q705 PolarHBondContact O-N 3.14Å; Q705-H707 PolarHBondContact O-N 2.85Å; Q705-V708 CarbonylContact C-O 3.5Å; Q705-V708 VanDerWaalsContact CA-O 3.28Å; Q705-V708 WeakPolarHBondContact CA-O 3.29Å; Q705-V710 HydrophobicContact CB-CG2 4.33Å; Q705-V710 HydrophobicContact CG-CG2 4.35Å; Q705-L805 PolarHBondContact NE2-O 3.38Å; Q705-S807 WeakPolarHBondContact O-CA 3.27Å; Q705-S807 VanDerWaalsContact O-CB 3.27Å; Q705-S807 WeakPolarHBondContact O-CB 3.26Å; Q705-S807 PolarHBondContact O-OG 2.83Å
706	A	94.8	Very high	94	Very high	14 Å²	14	46 Å²	46	12%	0.116	24%	0.242	C	C	.	.	H	α-helix	trans	-56	-35.2	169.8	0	0	0	0	0	112.3	R702 F704 N808	R702-A706 WeakPolarHBondContact O-CB 3.36Å; R702-A706 PolarHBondContact O-N 2.98Å; F704-A706 PolarHBondContact O-N 3.22Å; A706-N808 VanDerWaalsContact O-CB 3.25Å; A706-N808 WeakPolarHBondContact O-CB 3.19Å; A706-N808 VanDerWaalsContact O-CG 3.24Å; A706-N808 PolarHBondContact O-N 2.79Å; A706-N808 PolarHBondContact O-ND2 2.84Å; A706-N808 VanDerWaalsContact O-ND2 3.14Å
707	H	93.3	Very high	93.8	Very high	60 Å²	60	42.7 Å²	42.7	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-100.4	-30.7	-176	-63.5	94.7	0	0	0	114	L657 R664 M690 K703 F704 Q705	L657-H707 HydrophobicContact CD2-CB 3.79Å; R664-H707 WeakPolarHBondContact CD-O 3.22Å; R664-H707 PolarHBondContact NH1-O 2.82Å; M690-H707 HydrophobicContact CE-CB 4.02Å; K703-H707 PolarHBondContact O-ND1 3.17Å; F704-H707 PolarHBondContact O-N 3.27Å; Q705-H707 PolarHBondContact O-N 2.85Å
708	V	92.9	Very high	93.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-125.5	128.8	-178.2	-174.1	0	0	0	0	109.5	I667 L671 V686 F704 Q705 V710 L720	I667-V708 HydrophobicContact CG2-CG1 4.45Å; I667-V708 HydrophobicContact CG2-CG2 4.21Å; L671-V708 HydrophobicContact CD1-CG1 4.2Å; L671-V708 HydrophobicContact CD1-CG2 3.84Å; V686-V708 HydrophobicContact CG1-CG2 4.33Å; F704-V708 HydrophobicContact CE2-CG2 4.2Å; F704-V708 HydrophobicContact CZ-CB 4.37Å; F704-V708 HydrophobicContact CZ-CG2 4.47Å; F704-V708 PolarHBondContact O-N 2.87Å; F704-V708 VanDerWaalsContact O-N 3.08Å; Q705-V708 CarbonylContact C-O 3.5Å; Q705-V708 VanDerWaalsContact CA-O 3.28Å; Q705-V708 WeakPolarHBondContact CA-O 3.29Å; V708-V710 PolarHBondContact O-N 2.74Å; V708-V710 VanDerWaalsContact O-N 3.13Å; V708-L720 HydrophobicContact CG1-CD1 4.08Å; V708-L720 HydrophobicContact CG1-CD2 3.97Å
709	R	92.4	Very high	93.6	Very high	87 Å²	87	46.5 Å²	46.5	33%	0.328	24%	0.244	S	C	.	.			trans	-80	100.1	179	-171.4	-176	177.6	-159.1	-6.9	110.8	R664 Q711 S807	R664-R709 HydrophobicContact CB-CB 4.4Å; R664-R709 WeakPolarHBondContact O-CB 3.35Å; R664-R709 PolarHBondContact O-N 2.87Å; R664-R709 VanDerWaalsContact O-N 3.16Å; R709-Q711 HydrophobicContact CG-CB 4.18Å; R709-Q711 HydrophobicContact CG-CG 4.4Å; R709-Q711 VanDerWaalsContact CZ-OE1 3.29Å; R709-Q711 PolarHBondContact O-N 3.37Å; R709-S807 WeakPolarHBondContact CA-OG 3.24Å
710	V	90.9	Very high	93.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	23%	0.227	C	C	.	.			trans	-80.4	60.3	179.2	-162.9	0	0	0	0	111.4	F704 Q705 V708 V717 L720 I721	F704-V710 HydrophobicContact CD1-CG2 3.86Å; F704-V710 HydrophobicContact CE1-CG2 3.64Å; Q705-V710 HydrophobicContact CB-CG2 4.33Å; Q705-V710 HydrophobicContact CG-CG2 4.35Å; V708-V710 PolarHBondContact O-N 2.74Å; V708-V710 VanDerWaalsContact O-N 3.13Å; V710-V717 HydrophobicContact CG1-CG1 4.05Å; V710-L720 HydrophobicContact CG1-CB 4.29Å; V710-L720 HydrophobicContact CG1-CD1 4.46Å; V710-I721 HydrophobicContact CG1-CD1 3.92Å; V710-I721 HydrophobicContact CG1-CG1 3.96Å
711	Q	85.6	Confident	93.6	Very high	79 Å²	79	42.7 Å²	42.7	37%	0.369	23%	0.227	S	C	.	.			trans	-147.2	134.8	180	-64.9	180	-20.9	0	0	110.5	R709	R709-Q711 HydrophobicContact CG-CB 4.18Å; R709-Q711 HydrophobicContact CG-CG 4.4Å; R709-Q711 VanDerWaalsContact CZ-OE1 3.29Å; R709-Q711 PolarHBondContact O-N 3.37Å
712	G	86.4	Confident	93.5	Very high	68 Å²	68	45.7 Å²	45.7	70%	0.701	24%	0.241	S	C	*	.	S	Bend	trans	143.7	-140.6	177.3	0	0	0	0	0	112.1	A714	G712-A714 PolarHBondContact O-N 2.73Å
713	E	89.1	Confident	93.6	Very high	111 Å²	111	44.5 Å²	44.5	52%	0.519	24%	0.236	S	C	.	.	S	Bend	trans	-54.9	131.9	175.8	-66.7	155.3	-129.7	0	0	111.9	Q715 K716 V717	E713-Q715 VanDerWaalsContact C-N 3.32Å; E713-Q715 PolarHBondContact O-N 2.7Å; E713-K716 HydrophobicContact CB-CB 4.39Å; E713-K716 HydrophobicContact CB-CD 4.15Å; E713-K716 HydrophobicContact CB-CG 4.23Å; E713-K716 PolarHBondContact O-N 2.75Å; E713-K716 IonicContact OE1-NZ 3.85Å; E713-K716 PolarHBondContact OE1-NZ 2.98Å; E713-K716 WeakPolarHBondContact OE2-CD 3.47Å; E713-K716 WeakPolarHBondContact OE2-CE 3.37Å; E713-K716 IonicContact OE2-NZ 2.86Å; E713-K716 PolarHBondContact OE2-NZ 3.28Å; E713-V717 PolarHBondContact O-N 2.81Å; E713-V717 VanDerWaalsContact O-N 3.07Å
714	A	89.9	Confident	93.6	Very high	76 Å²	76	40.7 Å²	40.7	63%	0.628	22%	0.22	S	C	*	.	H	α-helix	trans	-54.1	-44.3	-175.4	0	0	0	0	0	113.2	G712 K716 V717 E718	G712-A714 PolarHBondContact O-N 2.73Å; A714-K716 VanDerWaalsContact C-N 3.31Å; A714-K716 PolarHBondContact O-N 2.68Å; A714-V717 PolarHBondContact O-N 3.43Å; A714-E718 VanDerWaalsContact O-CB 3.29Å; A714-E718 WeakPolarHBondContact O-CB 3.42Å; A714-E718 PolarHBondContact O-N 3.17Å
715	Q	91.8	Very high	93.7	Very high	142 Å²	142	40.9 Å²	40.9	66%	0.664	22%	0.222	S	C	*	.	H	α-helix	trans	-63.7	-31.6	179.3	-67.9	179.2	-24.3	0	0	113.5	E713 R719	E713-Q715 VanDerWaalsContact C-N 3.32Å; E713-Q715 PolarHBondContact O-N 2.7Å; Q715-R719 PolarHBondContact O-N 2.87Å
716	K	93.3	Very high	93.8	Very high	45 Å²	45	45.1 Å²	45.1	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-74.8	-41.9	175.5	-68.4	178.1	175.8	162.1	0	110.6	E713 A714 E718 L720	E713-K716 HydrophobicContact CB-CB 4.39Å; E713-K716 HydrophobicContact CB-CD 4.15Å; E713-K716 HydrophobicContact CB-CG 4.23Å; E713-K716 PolarHBondContact O-N 2.75Å; E713-K716 IonicContact OE1-NZ 3.85Å; E713-K716 PolarHBondContact OE1-NZ 2.98Å; E713-K716 WeakPolarHBondContact OE2-CD 3.47Å; E713-K716 WeakPolarHBondContact OE2-CE 3.37Å; E713-K716 IonicContact OE2-NZ 2.86Å; E713-K716 PolarHBondContact OE2-NZ 3.28Å; A714-K716 VanDerWaalsContact C-N 3.31Å; A714-K716 PolarHBondContact O-N 2.68Å; K716-E718 VanDerWaalsContact C-N 3.29Å; K716-E718 PolarHBondContact O-N 2.78Å; K716-L720 VanDerWaalsContact O-CG 3.25Å; K716-L720 WeakPolarHBondContact O-CG 3.38Å; K716-L720 PolarHBondContact O-N 2.82Å; K716-L720 VanDerWaalsContact O-N 3.14Å
717	V	94.7	Very high	93.9	Very high	15 Å²	15	46.7 Å²	46.7	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-41.7	172.5	170.4	0	0	0	0	110.8	V710 E713 A714 L720 I721 F750	V710-V717 HydrophobicContact CG1-CG1 4.05Å; E713-V717 PolarHBondContact O-N 2.81Å; E713-V717 VanDerWaalsContact O-N 3.07Å; A714-V717 PolarHBondContact O-N 3.43Å; V717-L720 PolarHBondContact O-N 2.71Å; V717-I721 HydrophobicContact CG1-CG1 4.3Å; V717-I721 WeakPolarHBondContact O-CB 3.03Å; V717-I721 WeakPolarHBondContact O-CG1 3.38Å; V717-I721 PolarHBondContact O-N 2.88Å; V717-F750 HydrophobicContact CG1-CE1 3.8Å; V717-F750 HydrophobicContact CG1-CZ 4.05Å
718	E	94.9	Very high	94.2	Very high	73 Å²	73	44.1 Å²	44.1	34%	0.341	23%	0.232	S	C	.	.	H	α-helix	trans	-59.1	-53.5	177.9	-170.2	173.5	-167.3	0	0	112.1	A714 K716 L720 I721 E722 F746 F750	A714-E718 VanDerWaalsContact O-CB 3.29Å; A714-E718 WeakPolarHBondContact O-CB 3.42Å; A714-E718 PolarHBondContact O-N 3.17Å; K716-E718 VanDerWaalsContact C-N 3.29Å; K716-E718 PolarHBondContact O-N 2.78Å; E718-L720 VanDerWaalsContact C-N 3.3Å; E718-L720 PolarHBondContact O-N 2.86Å; E718-I721 PolarHBondContact O-N 3.31Å; E718-E722 VanDerWaalsContact O-CB 3.3Å; E718-E722 WeakPolarHBondContact O-CB 3.45Å; E718-E722 PolarHBondContact O-N 3.43Å; E718-F746 HydrophobicContact CG-CZ 4.18Å; E718-F750 HydrophobicContact CB-CE2 4.25Å; E718-F750 HydrophobicContact CB-CZ 3.92Å; E718-F750 HydrophobicContact CG-CE2 4.22Å; E718-F750 HydrophobicContact CG-CZ 4.3Å
719	R	95.9	Very high	94.4	Very high	12 Å²	12	45.5 Å²	45.5	5%	0.045	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-35.1	176.6	177.6	54.9	-172.9	150.6	12.9	113.1	L683 D684 Q715 E722 A723	L683-R719 HydrophobicContact CD2-CG 3.9Å; D684-R719 IonicContact OD1-CZ 3.82Å; D684-R719 IonicContact OD1-NH2 2.78Å; D684-R719 PolarHBondContact OD1-NH2 3.45Å; D684-R719 IonicContact OD2-NH2 2.72Å; D684-R719 PolarHBondContact OD2-NH2 2.96Å; Q715-R719 PolarHBondContact O-N 2.87Å; R719-E722 WeakPolarHBondContact CD-OE2 3.29Å; R719-E722 IonicContact CZ-OE2 3.76Å; R719-E722 IonicContact NE-OE2 2.76Å; R719-E722 IonicContact NH1-OE1 3.85Å; R719-E722 IonicContact NH1-OE2 2.68Å; R719-E722 PolarHBondContact NH1-OE2 2.75Å; R719-A723 PolarHBondContact O-N 2.86Å
720	L	97.6	Very high	94.5	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-68.6	-43	176.2	-70.4	174	0	0	0	112.4	L671 L683 F704 V708 V710 K716 V717 E718 F724	L671-L720 HydrophobicContact CB-CD2 3.77Å; L683-L720 HydrophobicContact CD1-CD2 3.91Å; L683-L720 HydrophobicContact CD2-CD2 4.18Å; F704-L720 HydrophobicContact CE1-CB 4.27Å; F704-L720 HydrophobicContact CZ-CB 4.34Å; F704-L720 HydrophobicContact CZ-CD2 4.2Å; V708-L720 HydrophobicContact CG1-CD1 4.08Å; V708-L720 HydrophobicContact CG1-CD2 3.97Å; V710-L720 HydrophobicContact CG1-CB 4.29Å; V710-L720 HydrophobicContact CG1-CD1 4.46Å; K716-L720 VanDerWaalsContact O-CG 3.25Å; K716-L720 WeakPolarHBondContact O-CG 3.38Å; K716-L720 PolarHBondContact O-N 2.82Å; K716-L720 VanDerWaalsContact O-N 3.14Å; V717-L720 PolarHBondContact O-N 2.71Å; E718-L720 VanDerWaalsContact C-N 3.3Å; E718-L720 PolarHBondContact O-N 2.86Å; L720-F724 VanDerWaalsContact O-CB 3.31Å; L720-F724 WeakPolarHBondContact O-CB 3.39Å; L720-F724 PolarHBondContact O-N 3Å; L720-F724 VanDerWaalsContact O-N 3.14Å
721	I	97.5	Very high	94.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-73.3	-32.7	178.1	-67.6	-64.2	0	0	0	111.5	L701 V710 V717 E718 S725 F746 A749 F750 V753	L701-I721 HydrophobicContact CD1-CD1 3.59Å; V710-I721 HydrophobicContact CG1-CD1 3.92Å; V710-I721 HydrophobicContact CG1-CG1 3.96Å; V717-I721 HydrophobicContact CG1-CG1 4.3Å; V717-I721 WeakPolarHBondContact O-CB 3.03Å; V717-I721 WeakPolarHBondContact O-CG1 3.38Å; V717-I721 PolarHBondContact O-N 2.88Å; E718-I721 PolarHBondContact O-N 3.31Å; I721-S725 VanDerWaalsContact O-CB 3.24Å; I721-S725 WeakPolarHBondContact O-CB 3.42Å; I721-S725 PolarHBondContact O-N 3.48Å; I721-S725 PolarHBondContact O-OG 2.94Å; I721-F746 HydrophobicContact CB-CE2 4.48Å; I721-F746 HydrophobicContact CG2-CD2 3.82Å; I721-F746 HydrophobicContact CG2-CE2 4.07Å; I721-A749 HydrophobicContact CG2-CB 3.89Å; I721-F750 HydrophobicContact CB-CD2 4.18Å; I721-F750 HydrophobicContact CB-CE2 4.06Å; I721-F750 HydrophobicContact CG2-CD2 3.66Å; I721-F750 HydrophobicContact CG2-CE2 4.04Å; I721-F750 HydrophobicContact CG2-CG 4.32Å; I721-V753 HydrophobicContact CD1-CG2 3.83Å; I721-V753 HydrophobicContact CG1-CG2 4.38Å
722	E	96.9	Very high	95.4	Very high	64 Å²	64	45.2 Å²	45.2	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-56.3	-60	172.3	-173.6	-151.6	178.7	0	0	111	E718 R719 F724 S725 Q726 F746	E718-E722 VanDerWaalsContact O-CB 3.3Å; E718-E722 WeakPolarHBondContact O-CB 3.45Å; E718-E722 PolarHBondContact O-N 3.43Å; R719-E722 WeakPolarHBondContact CD-OE2 3.29Å; R719-E722 IonicContact CZ-OE2 3.76Å; R719-E722 IonicContact NE-OE2 2.76Å; R719-E722 IonicContact NH1-OE1 3.85Å; R719-E722 IonicContact NH1-OE2 2.68Å; R719-E722 PolarHBondContact NH1-OE2 2.75Å; E722-F724 VanDerWaalsContact C-N 3.35Å; E722-F724 PolarHBondContact O-N 3.46Å; E722-S725 PolarHBondContact O-N 3.05Å; E722-S725 VanDerWaalsContact O-N 3.12Å; E722-Q726 WeakPolarHBondContact O-CG 2.99Å; E722-Q726 PolarHBondContact O-N 3.44Å; E722-Q726 PolarHBondContact OE1-NE2 3.42Å; E722-F746 HydrophobicContact CB-CD2 4.43Å; E722-F746 HydrophobicContact CB-CE2 4.03Å
723	A	97.8	Very high	95.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-39.2	-178.4	0	0	0	0	0	112.3	L683 V687 R719 S725 R727	L683-A723 HydrophobicContact CD1-CB 4.21Å; L683-A723 HydrophobicContact CD2-CB 3.69Å; L683-A723 HydrophobicContact CG-CB 3.75Å; V687-A723 HydrophobicContact CG1-CB 4.3Å; V687-A723 HydrophobicContact CG2-CB 4.49Å; R719-A723 PolarHBondContact O-N 2.86Å; A723-S725 PolarHBondContact O-N 3.33Å; A723-R727 WeakPolarHBondContact O-CB 3.19Å; A723-R727 PolarHBondContact O-N 2.9Å
724	F	98.3	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-45.5	172.3	164.8	-101.1	0	0	0	112	F692 L697 A700 L701 F704 L720 E722 R727 Y728 A749	F692-F724 HydrophobicContact CD1-CE2 4.48Å; F692-F724 HydrophobicContact CD2-CD2 4.45Å; F692-F724 HydrophobicContact CD2-CE2 4.18Å; F692-F724 HydrophobicContact CE1-CD2 4.49Å; F692-F724 HydrophobicContact CE1-CE2 4.12Å; F692-F724 AromaticContact CE2-CD2 3.69Å; F692-F724 HydrophobicContact CE2-CD2 3.69Å; F692-F724 AromaticContact CE2-CE2 3.79Å; F692-F724 HydrophobicContact CE2-CE2 3.79Å; F692-F724 AromaticContact CZ-CD2 3.72Å; F692-F724 HydrophobicContact CZ-CD2 3.72Å; F692-F724 AromaticContact CZ-CE2 3.77Å; F692-F724 HydrophobicContact CZ-CE2 3.77Å; L697-F724 HydrophobicContact CD1-CE1 3.82Å; L697-F724 HydrophobicContact CD1-CZ 4.04Å; A700-F724 VanDerWaalsContact C-CE2 3.46Å; A700-F724 HydrophobicContact CB-CE2 3.88Å; A700-F724 HydrophobicContact CB-CZ 3.83Å; L701-F724 VanDerWaalsContact CA-CZ 3.47Å; L701-F724 HydrophobicContact CB-CE1 3.91Å; L701-F724 HydrophobicContact CB-CE2 4.36Å; L701-F724 HydrophobicContact CB-CZ 3.7Å; L701-F724 HydrophobicContact CD1-CD1 4.03Å; L701-F724 HydrophobicContact CD1-CE1 4Å; L701-F724 HydrophobicContact CD1-CG 4.43Å; L701-F724 HydrophobicContact CD1-CZ 4.37Å; L701-F724 HydrophobicContact CG-CE1 4.47Å; L701-F724 VanDerWaalsContact N-CZ 3.26Å; F704-F724 HydrophobicContact CB-CD2 3.79Å; F704-F724 HydrophobicContact CB-CE2 4.17Å; F704-F724 HydrophobicContact CD1-CB 4.08Å; F704-F724 HydrophobicContact CD1-CD2 4.15Å; F704-F724 HydrophobicContact CD1-CG 4.2Å; F704-F724 HydrophobicContact CD2-CD2 4.49Å; F704-F724 HydrophobicContact CE1-CB 4.03Å; F704-F724 HydrophobicContact CG-CB 4.41Å; F704-F724 AromaticContact CG-CD2 3.92Å; F704-F724 HydrophobicContact CG-CD2 3.92Å; F704-F724 HydrophobicContact CG-CG 4.41Å; F704-F724 HydrophobicContact CZ-CB 4.33Å; L720-F724 VanDerWaalsContact O-CB 3.31Å; L720-F724 WeakPolarHBondContact O-CB 3.39Å; L720-F724 PolarHBondContact O-N 3Å; L720-F724 VanDerWaalsContact O-N 3.14Å; E722-F724 VanDerWaalsContact C-N 3.35Å; E722-F724 PolarHBondContact O-N 3.46Å; F724-R727 PolarHBondContact O-N 2.97Å; F724-Y728 HydrophobicContact CZ-CD2 4.38Å; F724-Y728 WeakPolarHBondContact O-CB 3.49Å; F724-Y728 PolarHBondContact O-N 3.31Å; F724-A749 HydrophobicContact CD1-CB 4.37Å; F724-A749 HydrophobicContact CE1-CB 4.14Å
725	S	97.9	Very high	96.3	Very high	5 Å²	5	42.2 Å²	42.2	4%	0.035	21%	0.213	C	C	.	.	H	α-helix	trans	-70.2	-41.5	-176.8	-56.1	0	0	0	0	111.5	I721 E722 A723 R727 Y728 C729 F746	I721-S725 VanDerWaalsContact O-CB 3.24Å; I721-S725 WeakPolarHBondContact O-CB 3.42Å; I721-S725 PolarHBondContact O-N 3.48Å; I721-S725 PolarHBondContact O-OG 2.94Å; E722-S725 PolarHBondContact O-N 3.05Å; E722-S725 VanDerWaalsContact O-N 3.12Å; A723-S725 PolarHBondContact O-N 3.33Å; S725-R727 VanDerWaalsContact C-N 3.34Å; S725-R727 PolarHBondContact O-N 3.07Å; S725-Y728 PolarHBondContact O-N 3.07Å; S725-C729 WeakPolarHBondContact O-CB 3.36Å; S725-C729 PolarHBondContact O-N 3.38Å; S725-C729 PolarHBondContact O-SG 2.94Å; S725-F746 WeakPolarHBondContact OG-CA 3.48Å
726	Q	97.3	Very high	96.4	Very high	92 Å²	92	37 Å²	37	43%	0.43	19%	0.191	S	C	.	.	H	α-helix	trans	-55.4	-49.5	172.3	-72.3	166.3	-2.2	0	0	110.7	E722 C729 M730	E722-Q726 WeakPolarHBondContact O-CG 2.99Å; E722-Q726 PolarHBondContact O-N 3.44Å; E722-Q726 PolarHBondContact OE1-NE2 3.42Å; Q726-C729 PolarHBondContact O-N 3.24Å; Q726-M730 WeakPolarHBondContact O-CG 3.45Å; Q726-M730 PolarHBondContact O-N 2.9Å; Q726-M730 VanDerWaalsContact O-N 3.11Å
727	R	97.9	Very high	96.4	Very high	48 Å²	48	42.4 Å²	42.4	18%	0.181	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-41	176.7	-176.9	68.7	-177.7	179.2	1.8	113	V687 D688 M690 F692 A723 F724 S725 M730 C731	V687-R727 HydrophobicContact CB-CB 3.92Å; V687-R727 HydrophobicContact CB-CG 3.99Å; V687-R727 HydrophobicContact CG2-CB 3.96Å; V687-R727 HydrophobicContact CG2-CG 4.3Å; V687-R727 WeakPolarHBondContact O-CD 3.44Å; V687-R727 WeakPolarHBondContact O-CG 3.48Å; V687-R727 PolarHBondContact O-NE 3.5Å; V687-R727 VanDerWaalsContact O-NE 3.11Å; D688-R727 PolarHBondContact O-NH2 3.21Å; D688-R727 IonicContact OD1-CZ 3.3Å; D688-R727 IonicContact OD1-NE 2.96Å; D688-R727 IonicContact OD1-NH1 3.44Å; D688-R727 PolarHBondContact OD1-NH1 3.35Å; M690-R727 PolarHBondContact O-NE 2.89Å; M690-R727 PolarHBondContact O-NH2 3.04Å; F692-R727 HydrophobicContact CD2-CB 4.3Å; F692-R727 HydrophobicContact CD2-CG 3.72Å; F692-R727 HydrophobicContact CE2-CB 4.08Å; F692-R727 HydrophobicContact CE2-CG 3.63Å; A723-R727 WeakPolarHBondContact O-CB 3.19Å; A723-R727 PolarHBondContact O-N 2.9Å; F724-R727 PolarHBondContact O-N 2.97Å; S725-R727 VanDerWaalsContact C-N 3.34Å; S725-R727 PolarHBondContact O-N 3.07Å; R727-M730 PolarHBondContact O-N 2.79Å; R727-C731 PolarHBondContact O-N 2.7Å; R727-C731 VanDerWaalsContact O-N 3.08Å; R727-C731 PolarHBondContact O-SG 2.72Å
728	Y	98.3	Very high	96.2	Very high	6 Å²	6	46.8 Å²	46.8	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-44.4	176.2	179.2	-87.1	0	0	0	111.7	F692 M695 L697 A700 F724 S725 M730 C731 N732 V735 I745	F692-Y728 HydrophobicContact CB-CD2 4.21Å; M695-Y728 WeakPolarHBondContact O-CE2 3.17Å; M695-Y728 PolarHBondContact O-OH 3.28Å; L697-Y728 HydrophobicContact CB-CE2 4.22Å; L697-Y728 HydrophobicContact CD1-CD1 3.79Å; L697-Y728 HydrophobicContact CD1-CD2 3.87Å; L697-Y728 HydrophobicContact CD1-CE1 3.87Å; L697-Y728 HydrophobicContact CD1-CE2 3.94Å; L697-Y728 HydrophobicContact CD1-CG 3.78Å; L697-Y728 PolarHBondContact N-OH 3.4Å; A700-Y728 HydrophobicContact CB-CD2 3.56Å; A700-Y728 HydrophobicContact CB-CE2 3.79Å; F724-Y728 HydrophobicContact CZ-CD2 4.38Å; F724-Y728 WeakPolarHBondContact O-CB 3.49Å; F724-Y728 PolarHBondContact O-N 3.31Å; S725-Y728 PolarHBondContact O-N 3.07Å; Y728-M730 VanDerWaalsContact C-N 3.3Å; Y728-M730 PolarHBondContact O-N 2.73Å; Y728-C731 PolarHBondContact O-N 2.96Å; Y728-C731 VanDerWaalsContact O-N 3.14Å; Y728-N732 WeakPolarHBondContact CD2-ND2 3.49Å; Y728-N732 HydrophobicContact CE1-CB 4.19Å; Y728-N732 WeakPolarHBondContact CE2-ND2 3.28Å; Y728-N732 PolarHBondContact O-N 2.78Å; Y728-N732 PolarHBondContact O-ND2 3.45Å; Y728-V735 HydrophobicContact CE1-CG1 4.27Å; Y728-I745 HydrophobicContact CD1-CG2 3.77Å; Y728-I745 HydrophobicContact CE1-CD1 4.3Å; Y728-I745 HydrophobicContact CE1-CG2 4.31Å
729	C	97.2	Very high	96.2	Very high	28 Å²	28	44.2 Å²	44.2	19%	0.189	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-36.6	176.5	-70	0	0	0	0	112.5	S725 Q726 V736	S725-C729 WeakPolarHBondContact O-CB 3.36Å; S725-C729 PolarHBondContact O-N 3.38Å; S725-C729 PolarHBondContact O-SG 2.94Å; Q726-C729 PolarHBondContact O-N 3.24Å; C729-V736 HydrophobicContact CB-CG2 3.68Å
730	M	96.1	Very high	96	Very high	137 Å²	137	50.5 Å²	50.5	68%	0.675	25%	0.253	S	S	*	.	H	α-helix	trans	-68.1	-33	174.1	-69.4	170.5	65.2	0	0	113	Q726 R727 Y728	Q726-M730 WeakPolarHBondContact O-CG 3.45Å; Q726-M730 PolarHBondContact O-N 2.9Å; Q726-M730 VanDerWaalsContact O-N 3.11Å; R727-M730 PolarHBondContact O-N 2.79Å; Y728-M730 VanDerWaalsContact C-N 3.3Å; Y728-M730 PolarHBondContact O-N 2.73Å
731	C	97.7	Very high	95.7	Very high	21 Å²	21	51.7 Å²	51.7	14%	0.142	26%	0.26	C	S	.	.	H	α-helix	trans	-81.7	-27.7	179	-59.9	0	0	0	0	113.4	F692 R727 Y728 P733	F692-C731 HydrophobicContact CB-CB 4.02Å; R727-C731 PolarHBondContact O-N 2.7Å; R727-C731 VanDerWaalsContact O-N 3.08Å; R727-C731 PolarHBondContact O-SG 2.72Å; Y728-C731 PolarHBondContact O-N 2.96Å; Y728-C731 VanDerWaalsContact O-N 3.14Å; C731-P733 VanDerWaalsContact C-CD 3.45Å
732	N	96.9	Very high	95.4	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.016	28%	0.283	C	S	.	.			trans	-128.8	59.2	-171.7	-56.4	-72	0	0	0	112.5	F692 G694 Y728 D734 V735 V736	F692-N732 PolarHBondContact O-ND2 3Å; F692-N732 PolarHBondContact O-OD1 2.97Å; G694-N732 PolarHBondContact N-OD1 3.18Å; Y728-N732 WeakPolarHBondContact CD2-ND2 3.49Å; Y728-N732 HydrophobicContact CE1-CB 4.19Å; Y728-N732 WeakPolarHBondContact CE2-ND2 3.28Å; Y728-N732 PolarHBondContact O-N 2.78Å; Y728-N732 PolarHBondContact O-ND2 3.45Å; N732-D734 VanDerWaalsContact C-OD1 3.31Å; N732-D734 PolarHBondContact O-N 3.01Å; N732-V735 HydrophobicContact CB-CB 4.05Å; N732-V735 HydrophobicContact CB-CG2 3.98Å; N732-V735 WeakPolarHBondContact O-CB 3.46Å; N732-V735 PolarHBondContact O-N 2.83Å; N732-V736 PolarHBondContact O-N 2.9Å; N732-V736 VanDerWaalsContact O-N 3.15Å
733	P	95.8	Very high	95.2	Very high	71 Å²	71	55.2 Å²	55.2	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-66.1	-20.5	-175.3	29.1	-36.8	0	0	0	113.5	C731 Q737	C731-P733 VanDerWaalsContact C-CD 3.45Å; P733-Q737 VanDerWaalsContact O-CG 3.31Å; P733-Q737 WeakPolarHBondContact O-CG 3.5Å; P733-Q737 PolarHBondContact O-N 3.46Å; P733-Q737 PolarHBondContact O-NE2 3.13Å
734	D	94.5	Very high	95.1	Very high	97 Å²	97	55.2 Å²	55.2	52%	0.519	29%	0.285	S	S	.	.	H	α-helix	trans	-74.5	-29.4	173.1	65.2	-49.5	0	0	0	113	N732 Q738	N732-D734 VanDerWaalsContact C-OD1 3.31Å; N732-D734 PolarHBondContact O-N 3.01Å; D734-Q738 PolarHBondContact O-NE2 3.45Å
735	V	93.9	Very high	95	Very high	24 Å²	24	55.3 Å²	55.3	15%	0.145	29%	0.285	C	S	.	.	H	α-helix	trans	-74.8	-43.4	169.8	178.8	0	0	0	0	110.1	Y728 N732 Q737 Q738 F739	Y728-V735 HydrophobicContact CE1-CG1 4.27Å; N732-V735 HydrophobicContact CB-CB 4.05Å; N732-V735 HydrophobicContact CB-CG2 3.98Å; N732-V735 WeakPolarHBondContact O-CB 3.46Å; N732-V735 PolarHBondContact O-N 2.83Å; V735-Q737 VanDerWaalsContact C-N 3.28Å; V735-Q737 PolarHBondContact O-N 3.18Å; V735-Q738 WeakPolarHBondContact O-CB 3.35Å; V735-Q738 PolarHBondContact O-N 3.47Å; V735-Q738 VanDerWaalsContact O-N 3.08Å; V735-F739 HydrophobicContact CG1-CE2 4.11Å; V735-F739 VanDerWaalsContact O-CD2 3.3Å; V735-F739 WeakPolarHBondContact O-CD2 3.42Å
736	V	93.4	Very high	94.9	Very high	32 Å²	32	56.4 Å²	56.4	19%	0.194	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-38.1	177.9	-179.9	0	0	0	0	111.9	C729 N732 Q738 F739 P742	C729-V736 HydrophobicContact CB-CG2 3.68Å; N732-V736 PolarHBondContact O-N 2.9Å; N732-V736 VanDerWaalsContact O-N 3.15Å; V736-Q738 PolarHBondContact O-N 2.83Å; V736-Q738 VanDerWaalsContact O-N 3.08Å; V736-F739 PolarHBondContact O-N 3.45Å; V736-F739 VanDerWaalsContact O-N 3.12Å; V736-P742 HydrophobicContact CG1-CB 4.16Å
737	Q	93	Very high	94.9	Very high	159 Å²	159	52.1 Å²	52.1	74%	0.743	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.3	176.7	-81.1	167.5	76.7	0	0	115.2	P733 V735	P733-Q737 VanDerWaalsContact O-CG 3.31Å; P733-Q737 WeakPolarHBondContact O-CG 3.5Å; P733-Q737 PolarHBondContact O-N 3.46Å; P733-Q737 PolarHBondContact O-NE2 3.13Å; V735-Q737 VanDerWaalsContact C-N 3.28Å; V735-Q737 PolarHBondContact O-N 3.18Å
738	Q	92	Very high	94.8	Very high	108 Å²	108	49.9 Å²	49.9	51%	0.505	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.5	176.1	-60.8	169.7	44.6	0	0	112.8	D734 V735 V736	D734-Q738 PolarHBondContact O-NE2 3.45Å; V735-Q738 WeakPolarHBondContact O-CB 3.35Å; V735-Q738 PolarHBondContact O-N 3.47Å; V735-Q738 VanDerWaalsContact O-N 3.08Å; V736-Q738 PolarHBondContact O-N 2.83Å; V736-Q738 VanDerWaalsContact O-N 3.08Å
739	F	93.5	Very high	94.8	Very high	18 Å²	18	49.6 Å²	49.6	8%	0.079	26%	0.26	C	S	.	.	S	Bend	trans	-106.7	150.8	-179.4	-64.8	-82.5	0	0	0	111.2	V735 V736 T744 I745 I788 M792	V735-F739 HydrophobicContact CG1-CE2 4.11Å; V735-F739 VanDerWaalsContact O-CD2 3.3Å; V735-F739 WeakPolarHBondContact O-CD2 3.42Å; V736-F739 PolarHBondContact O-N 3.45Å; V736-F739 VanDerWaalsContact O-N 3.12Å; F739-T744 HydrophobicContact CD1-CG2 3.37Å; F739-T744 HydrophobicContact CE1-CG2 3.54Å; F739-T744 HydrophobicContact CG-CG2 4.29Å; F739-I745 HydrophobicContact CD2-CD1 3.83Å; F739-I745 HydrophobicContact CE2-CD1 3.45Å; F739-I745 VanDerWaalsContact CE2-CD1 3.45Å; F739-I745 HydrophobicContact CZ-CD1 4.01Å; F739-I788 HydrophobicContact CE1-CG1 4.24Å; F739-I788 HydrophobicContact CE1-CG2 4.02Å; F739-M792 HydrophobicContact CE2-CE 4.39Å; F739-M792 HydrophobicContact CZ-CE 4.13Å; F739-M792 HydrophobicContact CZ-SD 3.82Å
740	H	92.8	Very high	94.7	Very high	144 Å²	144	49.6 Å²	49.6	67%	0.667	26%	0.257	S	S	*	.	S	Bend	trans	-75.6	-32.2	173	-59	80.8	0	0	0	111.2	D783	H740-D783 IonicContact CE1-OD2 2.71Å; H740-D783 IonicContact CG-OD2 3.27Å; H740-D783 PolarHBondContact N-OD1 3.39Å; H740-D783 VanDerWaalsContact N-OD1 3.1Å; H740-D783 PolarHBondContact N-OD2 3.2Å; H740-D783 IonicContact ND1-OD2 3.21Å; H740-D783 PolarHBondContact ND1-OD2 3Å
741	N	91.6	Very high	94.7	Very high	28 Å²	28	43 Å²	43	15%	0.15	22%	0.224	C	C	.	.			trans	-128.9	126	-178.9	-174.6	-15.5	0	0	0	111.1	D743 T744 D783 D784	N741-D743 PolarHBondContact O-N 3.48Å; N741-D743 VanDerWaalsContact OD1-CB 3.28Å; N741-D743 WeakPolarHBondContact OD1-CB 3.4Å; N741-D743 PolarHBondContact OD1-N 2.98Å; N741-T744 WeakPolarHBondContact O-CB 3.41Å; N741-T744 PolarHBondContact O-N 3.09Å; N741-T744 VanDerWaalsContact O-N 3.08Å; N741-T744 PolarHBondContact O-OG1 2.93Å; N741-T744 VanDerWaalsContact O-OG1 3.07Å; N741-D783 PolarHBondContact N-OD1 3.01Å; N741-D784 HydrophobicContact CB-CB 4.48Å; N741-D784 PolarHBondContact ND2-OD1 3.21Å
742	P	90	Very high	94.7	Very high	74 Å²	74	42 Å²	42	48%	0.481	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.8	176.1	26.4	-35.7	0	0	0	113.7	V736 T744 I745	V736-P742 HydrophobicContact CG1-CB 4.16Å; P742-T744 PolarHBondContact O-N 3.35Å; P742-I745 PolarHBondContact O-N 2.75Å
743	D	92.4	Very high	94.6	Very high	64 Å²	64	42.5 Å²	42.5	34%	0.342	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-23.4	174.5	-65.9	-16.4	0	0	0	112.1	P456 N741 I745 F746 I747	P456-D743 HydrophobicContact CB-CB 4.35Å; P456-D743 HydrophobicContact CG-CB 4.31Å; P456-D743 WeakPolarHBondContact CG-OD2 3.37Å; N741-D743 PolarHBondContact O-N 3.48Å; N741-D743 VanDerWaalsContact OD1-CB 3.28Å; N741-D743 WeakPolarHBondContact OD1-CB 3.4Å; N741-D743 PolarHBondContact OD1-N 2.98Å; D743-I745 PolarHBondContact O-N 3.46Å; D743-F746 WeakPolarHBondContact O-CB 3.44Å; D743-F746 PolarHBondContact O-N 3.45Å; D743-I747 HydrophobicContact CB-CD1 4.27Å; D743-I747 WeakPolarHBondContact O-CD1 3.15Å; D743-I747 WeakPolarHBondContact O-CG1 3.15Å; D743-I747 PolarHBondContact O-N 3.03Å
744	T	95.8	Very high	94.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.8	-33.3	176.8	-60.9	0	0	0	0	112.1	F739 N741 P742 I747 L748 V782 D783 I788	F739-T744 HydrophobicContact CD1-CG2 3.37Å; F739-T744 HydrophobicContact CE1-CG2 3.54Å; F739-T744 HydrophobicContact CG-CG2 4.29Å; N741-T744 WeakPolarHBondContact O-CB 3.41Å; N741-T744 PolarHBondContact O-N 3.09Å; N741-T744 VanDerWaalsContact O-N 3.08Å; N741-T744 PolarHBondContact O-OG1 2.93Å; N741-T744 VanDerWaalsContact O-OG1 3.07Å; P742-T744 PolarHBondContact O-N 3.35Å; T744-I747 PolarHBondContact O-N 3.26Å; T744-L748 WeakPolarHBondContact O-CB 3.43Å; T744-L748 PolarHBondContact O-N 3.23Å; T744-V782 HydrophobicContact CG2-CG1 4.24Å; T744-D783 HydrophobicContact CG2-CB 4Å; T744-D783 WeakPolarHBondContact OG1-CA 3.38Å; T744-D783 PolarHBondContact OG1-OD1 3.09Å; T744-I788 HydrophobicContact CG2-CD1 3.74Å; T744-I788 HydrophobicContact CG2-CG1 4.01Å
745	I	96.8	Very high	94.6	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-45.6	174.8	-62.3	-61.1	0	0	0	111.2	L697 Y728 F739 P742 D743 L748 A749	L697-I745 HydrophobicContact CD1-CG2 3.87Å; L697-I745 HydrophobicContact CD2-CG2 4.37Å; Y728-I745 HydrophobicContact CD1-CG2 3.77Å; Y728-I745 HydrophobicContact CE1-CD1 4.3Å; Y728-I745 HydrophobicContact CE1-CG2 4.31Å; F739-I745 HydrophobicContact CD2-CD1 3.83Å; F739-I745 HydrophobicContact CE2-CD1 3.45Å; F739-I745 VanDerWaalsContact CE2-CD1 3.45Å; F739-I745 HydrophobicContact CZ-CD1 4.01Å; P742-I745 PolarHBondContact O-N 2.75Å; D743-I745 PolarHBondContact O-N 3.46Å; I745-L748 PolarHBondContact O-N 3.02Å; I745-A749 WeakPolarHBondContact O-CB 3.22Å; I745-A749 PolarHBondContact O-N 2.7Å
746	F	96.8	Very high	94.6	Very high	29 Å²	29	34.6 Å²	34.6	13%	0.127	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-42.7	178.2	165	-100.8	0	0	0	111.7	A459 E718 I721 E722 S725 D743 A749 F750	A459-F746 HydrophobicContact CB-CE1 4.32Å; E718-F746 HydrophobicContact CG-CZ 4.18Å; I721-F746 HydrophobicContact CB-CE2 4.48Å; I721-F746 HydrophobicContact CG2-CD2 3.82Å; I721-F746 HydrophobicContact CG2-CE2 4.07Å; E722-F746 HydrophobicContact CB-CD2 4.43Å; E722-F746 HydrophobicContact CB-CE2 4.03Å; S725-F746 WeakPolarHBondContact OG-CA 3.48Å; D743-F746 WeakPolarHBondContact O-CB 3.44Å; D743-F746 PolarHBondContact O-N 3.45Å; F746-A749 PolarHBondContact O-N 2.9Å; F746-F750 HydrophobicContact CD2-CD2 4.36Å; F746-F750 HydrophobicContact CE1-CD2 4.26Å; F746-F750 HydrophobicContact CE1-CE2 4.39Å; F746-F750 AromaticContact CE2-CD2 3.89Å; F746-F750 HydrophobicContact CE2-CD2 3.89Å; F746-F750 AromaticContact CE2-CE2 3.7Å; F746-F750 HydrophobicContact CE2-CE2 3.7Å; F746-F750 AromaticContact CZ-CD2 3.84Å; F746-F750 HydrophobicContact CZ-CD2 3.84Å; F746-F750 AromaticContact CZ-CE2 3.6Å; F746-F750 HydrophobicContact CZ-CE2 3.6Å; F746-F750 PolarHBondContact O-N 3.04Å
747	I	95.8	Very high	94.6	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-66.7	-41.6	178.3	-60.3	156.7	0	0	0	110.9	A459 L462 D743 T744 F750 A751 V782	A459-I747 HydrophobicContact CB-CG1 3.99Å; L462-I747 HydrophobicContact CB-CG2 4.07Å; L462-I747 HydrophobicContact CD1-CG2 3.82Å; L462-I747 HydrophobicContact CD2-CG2 3.93Å; L462-I747 HydrophobicContact CG-CG2 4.12Å; D743-I747 HydrophobicContact CB-CD1 4.27Å; D743-I747 WeakPolarHBondContact O-CD1 3.15Å; D743-I747 WeakPolarHBondContact O-CG1 3.15Å; D743-I747 PolarHBondContact O-N 3.03Å; T744-I747 PolarHBondContact O-N 3.26Å; I747-F750 WeakPolarHBondContact O-CB 3.48Å; I747-F750 PolarHBondContact O-N 2.7Å; I747-A751 PolarHBondContact O-N 3.34Å; I747-V782 HydrophobicContact CB-CG1 4.13Å; I747-V782 HydrophobicContact CD1-CG1 4.35Å; I747-V782 HydrophobicContact CG2-CG1 3.61Å
748	L	96.9	Very high	94.7	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-68.1	-41.8	177.1	-175.4	61.1	0	0	0	111.8	L697 T744 I745 F750 A751 V752 L779 I788 M792 I796	L697-L748 HydrophobicContact CD2-CB 3.95Å; L697-L748 HydrophobicContact CD2-CD2 3.77Å; L697-L748 HydrophobicContact CD2-CG 3.78Å; T744-L748 WeakPolarHBondContact O-CB 3.43Å; T744-L748 PolarHBondContact O-N 3.23Å; I745-L748 PolarHBondContact O-N 3.02Å; L748-F750 VanDerWaalsContact C-N 3.29Å; L748-F750 PolarHBondContact O-N 3.34Å; L748-A751 WeakPolarHBondContact O-CB 3.38Å; L748-A751 PolarHBondContact O-N 2.99Å; L748-A751 VanDerWaalsContact O-N 3.11Å; L748-V752 WeakPolarHBondContact O-CG2 3.5Å; L748-V752 PolarHBondContact O-N 3.28Å; L748-L779 HydrophobicContact CD1-CD1 3.68Å; L748-L779 HydrophobicContact CD1-CD2 4.04Å; L748-I788 HydrophobicContact CB-CD1 4.47Å; L748-I788 HydrophobicContact CD1-CD1 4.09Å; L748-I788 HydrophobicContact CD2-CD1 4.37Å; L748-M792 HydrophobicContact CD2-SD 4.34Å; L748-I796 HydrophobicContact CD1-CD1 4.41Å; L748-I796 HydrophobicContact CD2-CD1 3.9Å; L748-I796 HydrophobicContact CG-CD1 4.29Å
749	A	97.4	Very high	94.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-41.6	173.8	0	0	0	0	0	111.5	L697 I721 F724 I745 F746 V752 V753	L697-A749 HydrophobicContact CD1-CB 4.45Å; L697-A749 HydrophobicContact CD2-CB 4.3Å; I721-A749 HydrophobicContact CG2-CB 3.89Å; F724-A749 HydrophobicContact CD1-CB 4.37Å; F724-A749 HydrophobicContact CE1-CB 4.14Å; I745-A749 WeakPolarHBondContact O-CB 3.22Å; I745-A749 PolarHBondContact O-N 2.7Å; F746-A749 PolarHBondContact O-N 2.9Å; A749-V752 PolarHBondContact O-N 2.95Å; A749-V753 PolarHBondContact O-N 2.9Å; A749-V753 VanDerWaalsContact O-N 3.13Å
750	F	95.3	Very high	94.9	Very high	27 Å²	27	26 Å²	26	12%	0.118	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-45	171.3	-111.3	-69.5	0	0	0	112.9	L462 V717 E718 I721 F746 I747 L748 V752 V753 L754	L462-F750 HydrophobicContact CD2-CB 4.41Å; V717-F750 HydrophobicContact CG1-CE1 3.8Å; V717-F750 HydrophobicContact CG1-CZ 4.05Å; E718-F750 HydrophobicContact CB-CE2 4.25Å; E718-F750 HydrophobicContact CB-CZ 3.92Å; E718-F750 HydrophobicContact CG-CE2 4.22Å; E718-F750 HydrophobicContact CG-CZ 4.3Å; I721-F750 HydrophobicContact CB-CD2 4.18Å; I721-F750 HydrophobicContact CB-CE2 4.06Å; I721-F750 HydrophobicContact CG2-CD2 3.66Å; I721-F750 HydrophobicContact CG2-CE2 4.04Å; I721-F750 HydrophobicContact CG2-CG 4.32Å; F746-F750 HydrophobicContact CD2-CD2 4.36Å; F746-F750 HydrophobicContact CE1-CD2 4.26Å; F746-F750 HydrophobicContact CE1-CE2 4.39Å; F746-F750 AromaticContact CE2-CD2 3.89Å; F746-F750 HydrophobicContact CE2-CD2 3.89Å; F746-F750 AromaticContact CE2-CE2 3.7Å; F746-F750 HydrophobicContact CE2-CE2 3.7Å; F746-F750 AromaticContact CZ-CD2 3.84Å; F746-F750 HydrophobicContact CZ-CD2 3.84Å; F746-F750 AromaticContact CZ-CE2 3.6Å; F746-F750 HydrophobicContact CZ-CE2 3.6Å; F746-F750 PolarHBondContact O-N 3.04Å; I747-F750 WeakPolarHBondContact O-CB 3.48Å; I747-F750 PolarHBondContact O-N 2.7Å; L748-F750 VanDerWaalsContact C-N 3.29Å; L748-F750 PolarHBondContact O-N 3.34Å; F750-V752 PolarHBondContact O-N 3.49Å; F750-V753 PolarHBondContact O-N 2.99Å; F750-L754 WeakPolarHBondContact O-CG 3.43Å; F750-L754 PolarHBondContact O-N 3.48Å
751	A	96.8	Very high	94.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.7	-33.9	176.6	0	0	0	0	0	112.2	L462 F466 I747 L748 L754 L755 F775 L779	L462-A751 HydrophobicContact CD1-CB 4.38Å; L462-A751 HydrophobicContact CD2-CB 4.06Å; F466-A751 HydrophobicContact CE2-CB 4.15Å; F466-A751 HydrophobicContact CZ-CB 4.24Å; I747-A751 PolarHBondContact O-N 3.34Å; L748-A751 WeakPolarHBondContact O-CB 3.38Å; L748-A751 PolarHBondContact O-N 2.99Å; L748-A751 VanDerWaalsContact O-N 3.11Å; A751-L754 PolarHBondContact O-N 3.32Å; A751-L755 VanDerWaalsContact O-CB 3.28Å; A751-L755 WeakPolarHBondContact O-CB 3.16Å; A751-L755 PolarHBondContact O-N 2.92Å; A751-F775 HydrophobicContact CB-CE2 4.02Å; A751-L779 HydrophobicContact CB-CD1 4.47Å; A751-L779 HydrophobicContact CB-CD2 3.79Å; A751-L779 HydrophobicContact CB-CG 4.44Å
752	V	97.4	Very high	94.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.6	-41.2	174.5	173.8	0	0	0	0	112.4	D698 L701 L748 A749 F750 L754 L755 N756 I796 I800 L805	D698-V752 HydrophobicContact CB-CG1 4.08Å; L701-V752 HydrophobicContact CD2-CB 4.07Å; L701-V752 HydrophobicContact CD2-CG1 3.74Å; L748-V752 WeakPolarHBondContact O-CG2 3.5Å; L748-V752 PolarHBondContact O-N 3.28Å; A749-V752 PolarHBondContact O-N 2.95Å; F750-V752 PolarHBondContact O-N 3.49Å; V752-L754 VanDerWaalsContact C-N 3.3Å; V752-L754 PolarHBondContact O-N 2.81Å; V752-L755 PolarHBondContact O-N 3.41Å; V752-N756 WeakPolarHBondContact O-CB 3.35Å; V752-N756 PolarHBondContact O-N 3.29Å; V752-I796 HydrophobicContact CG2-CG2 3.4Å; V752-I796 VanDerWaalsContact CG2-CG2 3.4Å; V752-I800 HydrophobicContact CG1-CD1 3.65Å; V752-I800 HydrophobicContact CG1-CG1 4.02Å; V752-L805 HydrophobicContact CG1-CD1 3.98Å
753	V	94.8	Very high	94.7	Very high	13 Å²	13	24.2 Å²	24.2	8%	0.079	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-41.5	173.1	176.6	0	0	0	0	110.9	L701 I721 A749 F750 T757	L701-V753 HydrophobicContact CD2-CG2 3.99Å; I721-V753 HydrophobicContact CD1-CG2 3.83Å; I721-V753 HydrophobicContact CG1-CG2 4.38Å; A749-V753 PolarHBondContact O-N 2.9Å; A749-V753 VanDerWaalsContact O-N 3.13Å; F750-V753 PolarHBondContact O-N 2.99Å; V753-T757 WeakPolarHBondContact O-CB 3.44Å; V753-T757 PolarHBondContact O-N 2.81Å; V753-T757 PolarHBondContact O-OG1 3.11Å
754	L	93.8	Very high	94.6	Very high	21 Å²	21	22 Å²	22	11%	0.11	12%	0.119	C	C	.	.	H	α-helix	trans	-68.8	-43.7	178.5	-67.7	167.7	0	0	0	112	L462 F466 F750 A751 V752 T757 D758	L462-L754 HydrophobicContact CD2-CD1 4.42Å; F466-L754 HydrophobicContact CB-CD1 3.9Å; F466-L754 HydrophobicContact CD1-CB 3.91Å; F466-L754 HydrophobicContact CD1-CD1 4.3Å; F466-L754 HydrophobicContact CD2-CD1 3.69Å; F466-L754 HydrophobicContact CE1-CB 4.05Å; F466-L754 HydrophobicContact CE2-CD1 4.29Å; F466-L754 HydrophobicContact CG-CB 4.19Å; F466-L754 HydrophobicContact CG-CD1 3.71Å; F466-L754 HydrophobicContact CG-CG 4.48Å; F466-L754 HydrophobicContact CZ-CB 4.49Å; F750-L754 WeakPolarHBondContact O-CG 3.43Å; F750-L754 PolarHBondContact O-N 3.48Å; A751-L754 PolarHBondContact O-N 3.32Å; V752-L754 VanDerWaalsContact C-N 3.3Å; V752-L754 PolarHBondContact O-N 2.81Å; L754-T757 PolarHBondContact O-N 3.49Å; L754-D758 PolarHBondContact O-N 2.86Å
755	L	96.1	Very high	94.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.1	-50.5	172.3	171.2	70.7	0	0	0	111.8	A751 V752 T757 D758 M759 M770 F775 Y797 I800	A751-L755 VanDerWaalsContact O-CB 3.28Å; A751-L755 WeakPolarHBondContact O-CB 3.16Å; A751-L755 PolarHBondContact O-N 2.92Å; V752-L755 PolarHBondContact O-N 3.41Å; L755-T757 VanDerWaalsContact C-N 3.25Å; L755-T757 PolarHBondContact O-N 3.2Å; L755-D758 PolarHBondContact O-N 3.24Å; L755-M759 HydrophobicContact CD1-CE 3.65Å; L755-M759 HydrophobicContact CG-CE 4.15Å; L755-M759 VanDerWaalsContact O-CB 3.29Å; L755-M759 WeakPolarHBondContact O-CB 3.44Å; L755-M759 PolarHBondContact O-N 2.8Å; L755-M770 HydrophobicContact CB-CE 3.98Å; L755-M770 HydrophobicContact CD1-CE 3.38Å; L755-M770 HydrophobicContact CG-CE 4.29Å; L755-F775 HydrophobicContact CB-CD2 4.31Å; L755-F775 HydrophobicContact CB-CE2 3.93Å; L755-F775 HydrophobicContact CB-CZ 4.4Å; L755-F775 HydrophobicContact CD1-CD2 4.26Å; L755-F775 HydrophobicContact CD1-CG 4.35Å; L755-F775 HydrophobicContact CD2-CD1 4.33Å; L755-F775 HydrophobicContact CD2-CD2 4.46Å; L755-F775 HydrophobicContact CD2-CE1 3.96Å; L755-F775 HydrophobicContact CD2-CE2 4.1Å; L755-F775 HydrophobicContact CD2-CZ 3.83Å; L755-F775 HydrophobicContact CG-CE2 4.42Å; L755-Y797 HydrophobicContact CD1-CD2 3.58Å; L755-Y797 HydrophobicContact CD1-CE2 3.72Å; L755-Y797 HydrophobicContact CD2-CD2 4.15Å; L755-I800 HydrophobicContact CD2-CB 3.89Å; L755-I800 HydrophobicContact CD2-CG1 4.1Å; L755-I800 HydrophobicContact CD2-CG2 3.82Å; L755-I800 HydrophobicContact CG-CG2 3.93Å
756	N	95.1	Very high	94.1	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-60.8	-38.6	178.1	177.3	82.6	0	0	0	111.6	V752 M759 Y760 I800 L805	V752-N756 WeakPolarHBondContact O-CB 3.35Å; V752-N756 PolarHBondContact O-N 3.29Å; N756-M759 PolarHBondContact O-N 3.13Å; N756-Y760 PolarHBondContact O-N 3.27Å; N756-Y760 WeakPolarHBondContact OD1-CD2 3.47Å; N756-I800 HydrophobicContact CB-CG2 4.22Å; N756-L805 HydrophobicContact CB-CB 4.45Å; N756-L805 HydrophobicContact CB-CD1 3.91Å; N756-L805 HydrophobicContact CB-CG 4.24Å; N756-L805 WeakPolarHBondContact OD1-CB 3.25Å; N756-L805 PolarHBondContact OD1-N 2.97Å
757	T	93.3	Very high	93.8	Very high	37 Å²	37	38.9 Å²	38.9	23%	0.227	21%	0.206	C	C	.	.	H	α-helix	trans	-68.6	-41.2	179.1	-57.3	0	0	0	0	111.8	I473 V753 L754 L755 S761	I473-T757 HydrophobicContact CD1-CG2 3.84Å; I473-T757 HydrophobicContact CG1-CG2 3.63Å; V753-T757 WeakPolarHBondContact O-CB 3.44Å; V753-T757 PolarHBondContact O-N 2.81Å; V753-T757 PolarHBondContact O-OG1 3.11Å; L754-T757 PolarHBondContact O-N 3.49Å; L755-T757 VanDerWaalsContact C-N 3.25Å; L755-T757 PolarHBondContact O-N 3.2Å; T757-S761 WeakPolarHBondContact O-CB 3.4Å; T757-S761 PolarHBondContact O-N 2.9Å
758	D	94.6	Very high	93.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.011	23%	0.234	C	C	.	.	H	α-helix	trans	-59.6	-54	170.7	179.2	72.3	0	0	0	111.6	V469 L754 L755 Y760 K769 M770	V469-D758 HydrophobicContact CG1-CB 3.75Å; V469-D758 WeakPolarHBondContact CG1-OD1 3.39Å; L754-D758 PolarHBondContact O-N 2.86Å; L755-D758 PolarHBondContact O-N 3.24Å; D758-Y760 PolarHBondContact O-N 2.8Å; D758-K769 WeakPolarHBondContact O-CE 3.43Å; D758-K769 PolarHBondContact O-NZ 3.15Å; D758-K769 WeakPolarHBondContact OD2-CA 3.45Å; D758-K769 WeakPolarHBondContact OD2-CB 3.41Å; D758-M770 PolarHBondContact OD2-N 2.97Å
759	M	94.9	Very high	93.4	Very high	25 Å²	25	49.2 Å²	49.2	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-68.6	-33.5	-167.9	-160.5	-178.4	-59.8	0	0	112.7	L755 N756 K769 Y797 I800 Q801	L755-M759 HydrophobicContact CD1-CE 3.65Å; L755-M759 HydrophobicContact CG-CE 4.15Å; L755-M759 VanDerWaalsContact O-CB 3.29Å; L755-M759 WeakPolarHBondContact O-CB 3.44Å; L755-M759 PolarHBondContact O-N 2.8Å; N756-M759 PolarHBondContact O-N 3.13Å; M759-K769 PolarHBondContact O-NZ 2.92Å; M759-Y797 HydrophobicContact CE-CD2 4.25Å; M759-Y797 HydrophobicContact CE-CE1 4.37Å; M759-Y797 HydrophobicContact CE-CE2 3.77Å; M759-I800 HydrophobicContact CE-CG2 4.31Å; M759-Q801 HydrophobicContact CE-CB 4.03Å; M759-Q801 HydrophobicContact CE-CG 4.5Å; M759-Q801 WeakPolarHBondContact SD-CA 3.37Å; M759-Q801 HydrophobicContact SD-CB 3.65Å; M759-Q801 HydrophobicContact SD-CG 3.8Å
760	Y	94.5	Very high	93.2	Very high	73 Å²	73	49.7 Å²	49.7	29%	0.286	25%	0.249	S	C	.	.	H	α-helix	trans	-108.8	-8.5	-176.8	-65.5	-76.1	0	0	0	115.5	N756 D758 I800 Q801 E804	N756-Y760 PolarHBondContact O-N 3.27Å; N756-Y760 WeakPolarHBondContact OD1-CD2 3.47Å; D758-Y760 PolarHBondContact O-N 2.8Å; Y760-I800 HydrophobicContact CE2-CG2 4.45Å; Y760-I800 WeakPolarHBondContact CE2-O 3.46Å; Y760-I800 PolarHBondContact OH-O 3.43Å; Y760-Q801 PolarHBondContact OH-O 3.21Å; Y760-E804 HydrophobicContact CD1-CB 3.92Å; Y760-E804 HydrophobicContact CD1-CG 4.04Å; Y760-E804 HydrophobicContact CD2-CB 3.79Å; Y760-E804 HydrophobicContact CD2-CG 3.62Å; Y760-E804 HydrophobicContact CE1-CB 3.9Å; Y760-E804 VanDerWaalsContact CE2-CA 3.48Å; Y760-E804 HydrophobicContact CE2-CB 3.75Å; Y760-E804 HydrophobicContact CE2-CG 4.12Å; Y760-E804 HydrophobicContact CG-CB 3.87Å; Y760-E804 HydrophobicContact CG-CG 3.56Å; Y760-E804 PolarHBondContact OH-N 3.11Å
761	S	91.3	Very high	93.2	Very high	14 Å²	14	49.5 Å²	49.5	10%	0.098	25%	0.254	C	S	.	.			trans	-61.8	132.6	172.7	176.1	0	0	0	0	111.6	T757 N763 K769	T757-S761 WeakPolarHBondContact O-CB 3.4Å; T757-S761 PolarHBondContact O-N 2.9Å; S761-N763 VanDerWaalsContact C-N 3.28Å; S761-N763 PolarHBondContact OG-N 2.83Å; S761-K769 PolarHBondContact O-NZ 3.19Å
762	P	88.7	Confident	93.2	Very high	122 Å²	122	51.4 Å²	51.4	79%	0.792	26%	0.264	S	S	*	.	S	Bend	trans	-77.1	-14.6	173.8	32.4	-35.6	0	0	0	112.7	I764	P762-I764 VanDerWaalsContact C-N 3.35Å
763	N	90	Very high	93.1	Very high	73 Å²	73	56.3 Å²	56.3	39%	0.39	29%	0.291	S	S	.	.	S	Bend	trans	-77.4	-25.4	179.5	-60.8	-7.5	0	0	0	111.7	H472 I473 S761	H472-N763 VanDerWaalsContact O-CB 3.23Å; H472-N763 WeakPolarHBondContact O-CB 3.46Å; H472-N763 PolarHBondContact O-ND2 2.71Å; I473-N763 PolarHBondContact O-ND2 3.43Å; S761-N763 VanDerWaalsContact C-N 3.28Å; S761-N763 PolarHBondContact OG-N 2.83Å
764	I	91.1	Very high	93.2	Very high	16 Å²	16	58.4 Å²	58.4	8%	0.082	30%	0.301	C	S	.	.	S	Bend	trans	-90	121	-177.6	-62.2	171.3	0	0	0	108.8	V469 H472 I473 P762 R768 K769	V469-I764 HydrophobicContact CG1-CD1 4.17Å; H472-I764 HydrophobicContact CB-CG1 4.36Å; I473-I764 HydrophobicContact CD1-CD1 4.27Å; P762-I764 VanDerWaalsContact C-N 3.35Å; I764-R768 HydrophobicContact CG2-CB 4.28Å; I764-K769 HydrophobicContact CG2-CG 3.69Å; I764-K769 WeakPolarHBondContact O-CE 3.43Å
765	K	90.8	Very high	93.3	Very high	125 Å²	125	57.4 Å²	57.4	54%	0.543	30%	0.296	S	S	.	.			trans	-69.2	141.3	-177.8	-61	-177	-177.7	179.8	0	109.8	H767 R768	K765-H767 VanDerWaalsContact C-N 3.26Å; K765-H767 PolarHBondContact O-N 2.92Å; K765-R768 WeakPolarHBondContact O-CB 3.43Å; K765-R768 PolarHBondContact O-N 3.07Å
766	P	91	Very high	93.3	Very high	115 Å²	115	58.5 Å²	58.5	75%	0.747	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-52	-36.7	-176.1	-31	36.1	0	0	0	115.4	R768 K769	P766-R768 PolarHBondContact O-N 3.35Å; P766-K769 PolarHBondContact O-N 3.48Å
767	H	89.7	Confident	93.3	Very high	147 Å²	147	64.7 Å²	64.7	68%	0.681	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-74.3	2	177.2	69	-103.2	0	0	0	115.1	K765	K765-H767 VanDerWaalsContact C-N 3.26Å; K765-H767 PolarHBondContact O-N 2.92Å
768	R	91.4	Very high	93.4	Very high	158 Å²	158	64.6 Å²	64.6	60%	0.596	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-116.6	-4.4	175.6	-62.7	-169	171.9	-160.1	-10.7	112.9	I764 K765 P766	I764-R768 HydrophobicContact CG2-CB 4.28Å; K765-R768 WeakPolarHBondContact O-CB 3.43Å; K765-R768 PolarHBondContact O-N 3.07Å; P766-R768 PolarHBondContact O-N 3.35Å
769	K	93.6	Very high	93.5	Very high	61 Å²	61	64.7 Å²	64.7	27%	0.265	32%	0.323	S	S	.	.	S	Bend	trans	-70.3	139	177.4	-67	-172.3	171.6	-165.6	0	108.8	D758 M759 S761 I764 P766 G771	D758-K769 WeakPolarHBondContact O-CE 3.43Å; D758-K769 PolarHBondContact O-NZ 3.15Å; D758-K769 WeakPolarHBondContact OD2-CA 3.45Å; D758-K769 WeakPolarHBondContact OD2-CB 3.41Å; M759-K769 PolarHBondContact O-NZ 2.92Å; S761-K769 PolarHBondContact O-NZ 3.19Å; I764-K769 HydrophobicContact CG2-CG 3.69Å; I764-K769 WeakPolarHBondContact O-CE 3.43Å; P766-K769 PolarHBondContact O-N 3.48Å; K769-G771 PolarHBondContact O-N 2.68Å
770	M	93	Very high	93.5	Very high	10 Å²	10	71.2 Å²	71.2	5%	0.049	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-66.6	120.9	-174.8	-175.8	176.4	53.7	0	0	109.5	F466 L755 D758 D774 F775 N778 Y797	F466-M770 HydrophobicContact CD1-SD 4.46Å; F466-M770 HydrophobicContact CE1-CE 3.68Å; F466-M770 HydrophobicContact CE1-SD 3.56Å; F466-M770 VanDerWaalsContact CE1-SD 3.56Å; F466-M770 HydrophobicContact CZ-CE 4.31Å; F466-M770 HydrophobicContact CZ-SD 4.15Å; L755-M770 HydrophobicContact CB-CE 3.98Å; L755-M770 HydrophobicContact CD1-CE 3.38Å; L755-M770 HydrophobicContact CG-CE 4.29Å; D758-M770 PolarHBondContact OD2-N 2.97Å; M770-D774 HydrophobicContact CB-CB 4.48Å; M770-D774 HydrophobicContact CG-CB 3.5Å; M770-F775 HydrophobicContact CE-CB 3.98Å; M770-F775 HydrophobicContact CE-CD2 3.53Å; M770-F775 HydrophobicContact CE-CE2 4.39Å; M770-F775 HydrophobicContact CE-CG 4.12Å; M770-F775 HydrophobicContact CG-CB 4.25Å; M770-F775 HydrophobicContact SD-CB 4Å; M770-F775 HydrophobicContact SD-CD2 4.08Å; M770-N778 PolarHBondContact SD-ND2 3.05Å; M770-Y797 PolarHBondContact O-OH 2.91Å
771	G	95.6	Very high	93.4	Very high	23 Å²	23	69.2 Å²	69.2	24%	0.237	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-74.7	170.7	173.9	0	0	0	0	0	112.6	K769 D773 D774 F775	K769-G771 PolarHBondContact O-N 2.68Å; G771-D773 PolarHBondContact O-N 3.22Å; G771-D774 PolarHBondContact N-OD2 3.5Å; G771-D774 WeakPolarHBondContact O-CB 3.39Å; G771-D774 PolarHBondContact O-N 3.33Å; G771-D774 VanDerWaalsContact O-N 3.07Å; G771-F775 PolarHBondContact O-N 3.38Å
772	L	96.7	Very high	93.6	Very high	40 Å²	40	69 Å²	69	21%	0.209	35%	0.346	C	S	.	.	H	α-helix	trans	-53.2	-50.9	176.4	171.5	58.8	0	0	0	112.1	D774 F775 I776 A794 Y797	L772-D774 VanDerWaalsContact C-N 3.27Å; L772-D774 PolarHBondContact O-N 3.2Å; L772-F775 PolarHBondContact O-N 2.87Å; L772-I776 HydrophobicContact CD1-CD1 3.72Å; L772-I776 HydrophobicContact CD1-CG1 4.21Å; L772-I776 HydrophobicContact CG-CD1 3.88Å; L772-I776 WeakPolarHBondContact O-CG1 3.25Å; L772-I776 PolarHBondContact O-N 2.71Å; L772-A794 HydrophobicContact CD1-CB 4.01Å; L772-Y797 HydrophobicContact CB-CD1 3.96Å; L772-Y797 HydrophobicContact CB-CE1 3.92Å; L772-Y797 HydrophobicContact CB-CE2 4.45Å; L772-Y797 HydrophobicContact CB-CG 4.29Å; L772-Y797 HydrophobicContact CD1-CD1 3.91Å; L772-Y797 HydrophobicContact CD1-CD2 4.41Å; L772-Y797 HydrophobicContact CD1-CG 3.77Å; L772-Y797 HydrophobicContact CG-CD1 4.45Å
773	D	96.1	Very high	93.9	Very high	104 Å²	104	63.4 Å²	63.4	56%	0.556	31%	0.31	S	S	*	.	H	α-helix	trans	-72	-20.3	179.6	-62	-63.9	0	0	0	113.1	G771 R777 R790	G771-D773 PolarHBondContact O-N 3.22Å; D773-R777 WeakPolarHBondContact O-CB 3.48Å; D773-R777 PolarHBondContact O-N 2.84Å; D773-R790 IonicContact OD1-NH2 2.67Å; D773-R790 PolarHBondContact OD1-NH2 3.16Å; D773-R790 VanDerWaalsContact OD1-NH2 3.17Å
774	D	95.8	Very high	94	Very high	57 Å²	57	65.6 Å²	65.6	31%	0.305	32%	0.321	S	S	.	.	H	α-helix	trans	-72.1	-43.1	169	-62.3	-57	0	0	0	111	M770 G771 L772 R777 N778	M770-D774 HydrophobicContact CB-CB 4.48Å; M770-D774 HydrophobicContact CG-CB 3.5Å; G771-D774 PolarHBondContact N-OD2 3.5Å; G771-D774 WeakPolarHBondContact O-CB 3.39Å; G771-D774 PolarHBondContact O-N 3.33Å; G771-D774 VanDerWaalsContact O-N 3.07Å; L772-D774 VanDerWaalsContact C-N 3.27Å; L772-D774 PolarHBondContact O-N 3.2Å; D774-R777 PolarHBondContact O-N 2.99Å; D774-R777 IonicContact OD1-CZ 3.1Å; D774-R777 IonicContact OD1-NH1 2.93Å; D774-R777 PolarHBondContact OD1-NH1 3.13Å; D774-R777 IonicContact OD1-NH2 2.69Å; D774-R777 PolarHBondContact OD1-NH2 3.21Å; D774-N778 WeakPolarHBondContact O-CB 3.31Å; D774-N778 PolarHBondContact O-N 2.78Å; D774-N778 PolarHBondContact O-OD1 2.9Å
775	F	96.9	Very high	94	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-45.5	176.2	-177.6	-123	0	0	0	111.4	F466 A751 L755 M770 G771 L772 R777 N778 L779 V793 I796 Y797	F466-F775 HydrophobicContact CZ-CD2 4.34Å; F466-F775 HydrophobicContact CZ-CE2 4.46Å; A751-F775 HydrophobicContact CB-CE2 4.02Å; L755-F775 HydrophobicContact CB-CD2 4.31Å; L755-F775 HydrophobicContact CB-CE2 3.93Å; L755-F775 HydrophobicContact CB-CZ 4.4Å; L755-F775 HydrophobicContact CD1-CD2 4.26Å; L755-F775 HydrophobicContact CD1-CG 4.35Å; L755-F775 HydrophobicContact CD2-CD1 4.33Å; L755-F775 HydrophobicContact CD2-CD2 4.46Å; L755-F775 HydrophobicContact CD2-CE1 3.96Å; L755-F775 HydrophobicContact CD2-CE2 4.1Å; L755-F775 HydrophobicContact CD2-CZ 3.83Å; L755-F775 HydrophobicContact CG-CE2 4.42Å; M770-F775 HydrophobicContact CE-CB 3.98Å; M770-F775 HydrophobicContact CE-CD2 3.53Å; M770-F775 HydrophobicContact CE-CE2 4.39Å; M770-F775 HydrophobicContact CE-CG 4.12Å; M770-F775 HydrophobicContact CG-CB 4.25Å; M770-F775 HydrophobicContact SD-CB 4Å; M770-F775 HydrophobicContact SD-CD2 4.08Å; G771-F775 PolarHBondContact O-N 3.38Å; L772-F775 PolarHBondContact O-N 2.87Å; F775-R777 VanDerWaalsContact C-N 3.35Å; F775-R777 PolarHBondContact O-N 2.86Å; F775-N778 PolarHBondContact O-N 3Å; F775-L779 HydrophobicContact CD1-CD1 4.28Å; F775-L779 HydrophobicContact CD2-CD1 4.14Å; F775-L779 HydrophobicContact CE1-CD1 3.9Å; F775-L779 HydrophobicContact CE2-CD1 3.75Å; F775-L779 HydrophobicContact CG-CD1 4.41Å; F775-L779 HydrophobicContact CZ-CD1 3.62Å; F775-L779 PolarHBondContact O-N 3.08Å; F775-V793 HydrophobicContact CD1-CG1 3.54Å; F775-V793 HydrophobicContact CE1-CG1 3.61Å; F775-V793 HydrophobicContact CG-CG1 4.48Å; F775-I796 HydrophobicContact CE1-CG2 4.04Å; F775-I796 HydrophobicContact CZ-CG2 4.2Å; F775-Y797 HydrophobicContact CB-CD2 3.97Å; F775-Y797 HydrophobicContact CB-CE2 4.47Å; F775-Y797 AromaticContact CD1-CD2 3.98Å; F775-Y797 HydrophobicContact CD1-CD2 3.98Å; F775-Y797 HydrophobicContact CD1-CG 4.44Å; F775-Y797 HydrophobicContact CG-CD2 4.18Å
776	I	95.8	Very high	94.2	Very high	22 Å²	22	63.2 Å²	63.2	11%	0.113	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-43.5	172.8	-65.7	162.3	0	0	0	110.9	L772 N778 L779 R790 V793	L772-I776 HydrophobicContact CD1-CD1 3.72Å; L772-I776 HydrophobicContact CD1-CG1 4.21Å; L772-I776 HydrophobicContact CG-CD1 3.88Å; L772-I776 WeakPolarHBondContact O-CG1 3.25Å; L772-I776 PolarHBondContact O-N 2.71Å; I776-N778 VanDerWaalsContact C-N 3.35Å; I776-N778 PolarHBondContact O-N 3.48Å; I776-L779 PolarHBondContact O-N 2.69Å; I776-R790 HydrophobicContact CD1-CG 3.96Å; I776-V793 HydrophobicContact CB-CG1 4.46Å; I776-V793 HydrophobicContact CG1-CB 4.22Å; I776-V793 HydrophobicContact CG1-CG1 3.67Å
777	R	95.4	Very high	94.3	Very high	135 Å²	135	62.2 Å²	62.2	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-38.5	177.9	-175.8	-174.9	64.9	-118	-8.2	112.3	D773 D774 F775 L779 R780	D773-R777 WeakPolarHBondContact O-CB 3.48Å; D773-R777 PolarHBondContact O-N 2.84Å; D774-R777 PolarHBondContact O-N 2.99Å; D774-R777 IonicContact OD1-CZ 3.1Å; D774-R777 IonicContact OD1-NH1 2.93Å; D774-R777 PolarHBondContact OD1-NH1 3.13Å; D774-R777 IonicContact OD1-NH2 2.69Å; D774-R777 PolarHBondContact OD1-NH2 3.21Å; F775-R777 VanDerWaalsContact C-N 3.35Å; F775-R777 PolarHBondContact O-N 2.86Å; R777-L779 PolarHBondContact O-N 2.9Å; R777-R780 PolarHBondContact O-N 3.28Å
778	N	95.1	Very high	94.6	Very high	35 Å²	35	55.7 Å²	55.7	19%	0.187	29%	0.292	C	S	.	.	H	α-helix	trans	-71.7	-15.6	179.8	-68.3	-3	0	0	0	113.3	F466 M770 D774 F775 I776	F466-N778 HydrophobicContact CE2-CB 4.43Å; F466-N778 HydrophobicContact CZ-CB 4.29Å; M770-N778 PolarHBondContact SD-ND2 3.05Å; D774-N778 WeakPolarHBondContact O-CB 3.31Å; D774-N778 PolarHBondContact O-N 2.78Å; D774-N778 PolarHBondContact O-OD1 2.9Å; F775-N778 PolarHBondContact O-N 3Å; I776-N778 VanDerWaalsContact C-N 3.35Å; I776-N778 PolarHBondContact O-N 3.48Å
779	L	95.4	Very high	94.8	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.021	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	8.3	177.7	-76.8	167.9	0	0	0	114.1	L462 L748 A751 F775 I776 R777 V782 I788 V793	L462-L779 HydrophobicContact CD1-CD2 3.79Å; L748-L779 HydrophobicContact CD1-CD1 3.68Å; L748-L779 HydrophobicContact CD1-CD2 4.04Å; A751-L779 HydrophobicContact CB-CD1 4.47Å; A751-L779 HydrophobicContact CB-CD2 3.79Å; A751-L779 HydrophobicContact CB-CG 4.44Å; F775-L779 HydrophobicContact CD1-CD1 4.28Å; F775-L779 HydrophobicContact CD2-CD1 4.14Å; F775-L779 HydrophobicContact CE1-CD1 3.9Å; F775-L779 HydrophobicContact CE2-CD1 3.75Å; F775-L779 HydrophobicContact CG-CD1 4.41Å; F775-L779 HydrophobicContact CZ-CD1 3.62Å; F775-L779 PolarHBondContact O-N 3.08Å; I776-L779 PolarHBondContact O-N 2.69Å; R777-L779 PolarHBondContact O-N 2.9Å; L779-V782 HydrophobicContact CD2-CG2 4.27Å; L779-V782 WeakPolarHBondContact O-CB 3.15Å; L779-V782 WeakPolarHBondContact O-CG2 3.13Å; L779-I788 HydrophobicContact CD2-CD1 4.23Å; L779-V793 HydrophobicContact CD1-CG1 3.7Å; L779-V793 HydrophobicContact CD1-CG2 4.36Å
780	R	95.3	Very high	94.8	Very high	161 Å²	161	53.8 Å²	53.8	61%	0.608	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	140.8	179	-72.5	-169.5	179.7	-146.3	0.1	113.1	R777 V782 D787	R777-R780 PolarHBondContact O-N 3.28Å; R780-V782 PolarHBondContact O-N 3.23Å; R780-D787 WeakPolarHBondContact CA-OD1 3.23Å; R780-D787 VanDerWaalsContact CB-OD1 3.28Å; R780-D787 WeakPolarHBondContact CB-OD1 3.23Å; R780-D787 WeakPolarHBondContact CG-OD1 3.04Å
781	G	93.6	Very high	94.9	Very high	31 Å²	31	59.9 Å²	59.9	32%	0.32	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	12.5	179.7	0	0	0	0	0	115.2	D783 G785 A786 D787	G781-D783 VanDerWaalsContact C-N 3.33Å; G781-D783 PolarHBondContact O-N 2.96Å; G781-G785 VanDerWaalsContact O-CA 3.3Å; G781-G785 WeakPolarHBondContact O-CA 3.4Å; G781-G785 PolarHBondContact O-N 3.02Å; G781-G785 VanDerWaalsContact O-N 3.07Å; G781-A786 CarbonylContact C-O 3.26Å; G781-A786 VanDerWaalsContact C-O 3.26Å; G781-A786 WeakPolarHBondContact CA-O 3.49Å; G781-A786 PolarHBondContact N-O 3.44Å; G781-D787 PolarHBondContact N-OD1 3.05Å
782	V	94.6	Very high	95	Very high	9 Å²	9	60.7 Å²	60.7	6%	0.055	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-32.4	-174.8	163.3	0	0	0	0	112.4	S458 L462 T744 I747 L779 R780 D784 A786 I788	S458-V782 PolarHBondContact OG-O 3.03Å; L462-V782 HydrophobicContact CD1-CG2 4.15Å; T744-V782 HydrophobicContact CG2-CG1 4.24Å; I747-V782 HydrophobicContact CB-CG1 4.13Å; I747-V782 HydrophobicContact CD1-CG1 4.35Å; I747-V782 HydrophobicContact CG2-CG1 3.61Å; L779-V782 HydrophobicContact CD2-CG2 4.27Å; L779-V782 WeakPolarHBondContact O-CB 3.15Å; L779-V782 WeakPolarHBondContact O-CG2 3.13Å; R780-V782 PolarHBondContact O-N 3.23Å; V782-D784 PolarHBondContact O-N 3.03Å; V782-A786 PolarHBondContact N-O 3.49Å; V782-I788 HydrophobicContact CB-CD1 4.39Å; V782-I788 HydrophobicContact CG1-CD1 4.2Å
783	D	94.6	Very high	95	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.027	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-90	74.9	-177.1	-170.1	41.8	0	0	0	110.7	H740 N741 T744 G781 G785 A786	H740-D783 IonicContact CE1-OD2 2.71Å; H740-D783 IonicContact CG-OD2 3.27Å; H740-D783 PolarHBondContact N-OD1 3.39Å; H740-D783 VanDerWaalsContact N-OD1 3.1Å; H740-D783 PolarHBondContact N-OD2 3.2Å; H740-D783 IonicContact ND1-OD2 3.21Å; H740-D783 PolarHBondContact ND1-OD2 3Å; N741-D783 PolarHBondContact N-OD1 3.01Å; T744-D783 HydrophobicContact CG2-CB 4Å; T744-D783 WeakPolarHBondContact OG1-CA 3.38Å; T744-D783 PolarHBondContact OG1-OD1 3.09Å; G781-D783 VanDerWaalsContact C-N 3.33Å; G781-D783 PolarHBondContact O-N 2.96Å; D783-G785 PolarHBondContact O-N 2.77Å; D783-A786 HydrophobicContact CB-CB 4.35Å; D783-A786 PolarHBondContact N-O 2.72Å; D783-A786 WeakPolarHBondContact O-CB 3.35Å; D783-A786 PolarHBondContact O-N 3.42Å
784	D	92.3	Very high	95.1	Very high	119 Å²	119	54.3 Å²	54.3	64%	0.636	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	32.1	-174.9	-81.8	13.2	0	0	0	114.7	N741 V782	N741-D784 HydrophobicContact CB-CB 4.48Å; N741-D784 PolarHBondContact ND2-OD1 3.21Å; V782-D784 PolarHBondContact O-N 3.03Å
785	G	91.8	Very high	95.2	Very high	61 Å²	61	52.4 Å²	52.4	63%	0.629	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.8	-6.7	-178.1	0	0	0	0	0	114.8	G781 D783	G781-G785 VanDerWaalsContact O-CA 3.3Å; G781-G785 WeakPolarHBondContact O-CA 3.4Å; G781-G785 PolarHBondContact O-N 3.02Å; G781-G785 VanDerWaalsContact O-N 3.07Å; D783-G785 PolarHBondContact O-N 2.77Å
786	A	93.8	Very high	95.2	Very high	31 Å²	31	52.5 Å²	52.5	26%	0.256	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-87.6	156.7	169.5	0	0	0	0	0	112.5	G781 V782 D783	G781-A786 CarbonylContact C-O 3.26Å; G781-A786 VanDerWaalsContact C-O 3.26Å; G781-A786 WeakPolarHBondContact CA-O 3.49Å; G781-A786 PolarHBondContact N-O 3.44Å; V782-A786 PolarHBondContact N-O 3.49Å; D783-A786 HydrophobicContact CB-CB 4.35Å; D783-A786 PolarHBondContact N-O 2.72Å; D783-A786 WeakPolarHBondContact O-CB 3.35Å; D783-A786 PolarHBondContact O-N 3.42Å
787	D	94.4	Very high	95.3	Very high	93 Å²	93	52.5 Å²	52.5	50%	0.497	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-86.9	133.6	173	-76.7	-8.9	0	0	0	110.2	R780 G781	R780-D787 WeakPolarHBondContact CA-OD1 3.23Å; R780-D787 VanDerWaalsContact CB-OD1 3.28Å; R780-D787 WeakPolarHBondContact CB-OD1 3.23Å; R780-D787 WeakPolarHBondContact CG-OD1 3.04Å; G781-D787 PolarHBondContact N-OD1 3.05Å
788	I	95.1	Very high	95.5	Very high	10 Å²	10	50.5 Å²	50.5	5%	0.051	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-61.5	140.5	173	-59.7	177.5	0	0	0	109.5	F739 T744 L748 L779 V782 R790 M792 V793	F739-I788 HydrophobicContact CE1-CG1 4.24Å; F739-I788 HydrophobicContact CE1-CG2 4.02Å; T744-I788 HydrophobicContact CG2-CD1 3.74Å; T744-I788 HydrophobicContact CG2-CG1 4.01Å; L748-I788 HydrophobicContact CB-CD1 4.47Å; L748-I788 HydrophobicContact CD1-CD1 4.09Å; L748-I788 HydrophobicContact CD2-CD1 4.37Å; L779-I788 HydrophobicContact CD2-CD1 4.23Å; V782-I788 HydrophobicContact CB-CD1 4.39Å; V782-I788 HydrophobicContact CG1-CD1 4.2Å; I788-R790 PolarHBondContact O-N 3.28Å; I788-R790 VanDerWaalsContact O-N 3.12Å; I788-M792 HydrophobicContact CG2-SD 4.41Å; I788-V793 HydrophobicContact CB-CG2 3.88Å; I788-V793 HydrophobicContact CG2-CG2 3.54Å
789	P	95.3	Very high	95.6	Very high	63 Å²	63	50.9 Å²	50.9	41%	0.409	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-49.9	118.6	-179.7	-30.6	36.5	0	0	0	113.4	E791 M792 V793	P789-E791 PolarHBondContact O-N 2.84Å; P789-E791 VanDerWaalsContact O-N 3.12Å; P789-M792 HydrophobicContact CB-CB 4.45Å; P789-M792 WeakPolarHBondContact O-CB 3.44Å; P789-M792 PolarHBondContact O-N 3.24Å; P789-V793 PolarHBondContact O-N 3.11Å
790	R	94.9	Very high	95.7	Very high	116 Å²	116	50.7 Å²	50.7	44%	0.438	27%	0.272	S	S	.	.	H	α-helix	trans	-53.7	-39.6	-170.5	-172.5	179.4	-177.1	-80.1	-4.6	113.3	D773 I776 I788 M792 V793 A794	D773-R790 IonicContact OD1-NH2 2.67Å; D773-R790 PolarHBondContact OD1-NH2 3.16Å; D773-R790 VanDerWaalsContact OD1-NH2 3.17Å; I776-R790 HydrophobicContact CD1-CG 3.96Å; I788-R790 PolarHBondContact O-N 3.28Å; I788-R790 VanDerWaalsContact O-N 3.12Å; R790-M792 VanDerWaalsContact C-N 3.33Å; R790-M792 PolarHBondContact O-N 3.5Å; R790-V793 PolarHBondContact O-N 2.87Å; R790-A794 WeakPolarHBondContact O-CB 3.32Å; R790-A794 PolarHBondContact O-N 2.98Å
791	E	95.5	Very high	95.8	Very high	139 Å²	139	48 Å²	48	65%	0.65	27%	0.267	S	S	*	.	H	α-helix	trans	-66.5	-34.1	-178.6	-49.8	-49.3	111.2	0	0	112.2	P789 G795	P789-E791 PolarHBondContact O-N 2.84Å; P789-E791 VanDerWaalsContact O-N 3.12Å; E791-G795 PolarHBondContact O-N 3.32Å
792	M	95.8	Very high	96	Very high	40 Å²	40	53.7 Å²	53.7	20%	0.197	29%	0.285	C	S	.	.	H	α-helix	trans	-68	-45.9	173.5	-174.6	-169.7	-70.6	0	0	110.8	F739 L748 I788 P789 R790 A794 G795 I796	F739-M792 HydrophobicContact CE2-CE 4.39Å; F739-M792 HydrophobicContact CZ-CE 4.13Å; F739-M792 HydrophobicContact CZ-SD 3.82Å; L748-M792 HydrophobicContact CD2-SD 4.34Å; I788-M792 HydrophobicContact CG2-SD 4.41Å; P789-M792 HydrophobicContact CB-CB 4.45Å; P789-M792 WeakPolarHBondContact O-CB 3.44Å; P789-M792 PolarHBondContact O-N 3.24Å; R790-M792 VanDerWaalsContact C-N 3.33Å; R790-M792 PolarHBondContact O-N 3.5Å; M792-A794 VanDerWaalsContact C-N 3.28Å; M792-A794 PolarHBondContact O-N 3.43Å; M792-G795 PolarHBondContact O-N 2.91Å; M792-I796 HydrophobicContact CG-CD1 4.03Å; M792-I796 WeakPolarHBondContact O-CB 3.41Å; M792-I796 VanDerWaalsContact O-CG1 3.25Å; M792-I796 WeakPolarHBondContact O-CG1 3.48Å; M792-I796 PolarHBondContact O-N 2.85Å
793	V	97.1	Very high	96	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-36.8	177.7	-175.8	0	0	0	0	111.3	F775 I776 L779 I788 P789 R790 Y797	F775-V793 HydrophobicContact CD1-CG1 3.54Å; F775-V793 HydrophobicContact CE1-CG1 3.61Å; F775-V793 HydrophobicContact CG-CG1 4.48Å; I776-V793 HydrophobicContact CB-CG1 4.46Å; I776-V793 HydrophobicContact CG1-CB 4.22Å; I776-V793 HydrophobicContact CG1-CG1 3.67Å; L779-V793 HydrophobicContact CD1-CG1 3.7Å; L779-V793 HydrophobicContact CD1-CG2 4.36Å; I788-V793 HydrophobicContact CB-CG2 3.88Å; I788-V793 HydrophobicContact CG2-CG2 3.54Å; P789-V793 PolarHBondContact O-N 3.11Å; R790-V793 PolarHBondContact O-N 2.87Å; V793-Y797 WeakPolarHBondContact O-CB 3.43Å; V793-Y797 PolarHBondContact O-N 3.23Å; V793-Y797 VanDerWaalsContact O-N 3.08Å
794	A	97.8	Very high	96.1	Very high	8 Å²	8	63.4 Å²	63.4	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-69.4	-48.5	175.5	0	0	0	0	0	112.7	L772 R790 M792 I796 Y797 E798	L772-A794 HydrophobicContact CD1-CB 4.01Å; R790-A794 WeakPolarHBondContact O-CB 3.32Å; R790-A794 PolarHBondContact O-N 2.98Å; M792-A794 VanDerWaalsContact C-N 3.28Å; M792-A794 PolarHBondContact O-N 3.43Å; A794-I796 VanDerWaalsContact C-N 3.32Å; A794-I796 PolarHBondContact O-N 3.09Å; A794-Y797 WeakPolarHBondContact O-CB 3.22Å; A794-Y797 PolarHBondContact O-N 2.75Å; A794-Y797 VanDerWaalsContact O-N 3.08Å; A794-E798 WeakPolarHBondContact O-CG 3.43Å; A794-E798 PolarHBondContact O-N 3.27Å
795	G	97.9	Very high	96.2	Very high	17 Å²	17	57.8 Å²	57.8	18%	0.175	29%	0.292	C	S	.	.	H	α-helix	trans	-58.1	-43	176.5	0	0	0	0	0	112.6	E791 M792 E798 R799	E791-G795 PolarHBondContact O-N 3.32Å; M792-G795 PolarHBondContact O-N 2.91Å; G795-E798 PolarHBondContact O-N 3.47Å; G795-R799 WeakPolarHBondContact O-CB 3.4Å; G795-R799 WeakPolarHBondContact O-CG 3.44Å; G795-R799 PolarHBondContact O-N 3.12Å
796	I	98.3	Very high	96.2	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-57.4	-49.5	172.2	-74.7	170.5	0	0	0	111	D698 L748 V752 F775 M792 A794 E798 I800	D698-I796 HydrophobicContact CB-CG2 4.47Å; L748-I796 HydrophobicContact CD1-CD1 4.41Å; L748-I796 HydrophobicContact CD2-CD1 3.9Å; L748-I796 HydrophobicContact CG-CD1 4.29Å; V752-I796 HydrophobicContact CG2-CG2 3.4Å; V752-I796 VanDerWaalsContact CG2-CG2 3.4Å; F775-I796 HydrophobicContact CE1-CG2 4.04Å; F775-I796 HydrophobicContact CZ-CG2 4.2Å; M792-I796 HydrophobicContact CG-CD1 4.03Å; M792-I796 WeakPolarHBondContact O-CB 3.41Å; M792-I796 VanDerWaalsContact O-CG1 3.25Å; M792-I796 WeakPolarHBondContact O-CG1 3.48Å; M792-I796 PolarHBondContact O-N 2.85Å; A794-I796 VanDerWaalsContact C-N 3.32Å; A794-I796 PolarHBondContact O-N 3.09Å; I796-E798 PolarHBondContact O-N 2.73Å; I796-I800 WeakPolarHBondContact O-CB 3.08Å; I796-I800 WeakPolarHBondContact O-CG1 3.46Å; I796-I800 PolarHBondContact O-N 3.32Å
797	Y	98.3	Very high	96.2	Very high	21 Å²	21	62.3 Å²	62.3	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-45.6	179.8	178.5	-81.4	0	0	0	111.9	L755 M759 M770 L772 F775 V793 A794 I800 Q801	L755-Y797 HydrophobicContact CD1-CD2 3.58Å; L755-Y797 HydrophobicContact CD1-CE2 3.72Å; L755-Y797 HydrophobicContact CD2-CD2 4.15Å; M759-Y797 HydrophobicContact CE-CD2 4.25Å; M759-Y797 HydrophobicContact CE-CE1 4.37Å; M759-Y797 HydrophobicContact CE-CE2 3.77Å; M770-Y797 PolarHBondContact O-OH 2.91Å; L772-Y797 HydrophobicContact CB-CD1 3.96Å; L772-Y797 HydrophobicContact CB-CE1 3.92Å; L772-Y797 HydrophobicContact CB-CE2 4.45Å; L772-Y797 HydrophobicContact CB-CG 4.29Å; L772-Y797 HydrophobicContact CD1-CD1 3.91Å; L772-Y797 HydrophobicContact CD1-CD2 4.41Å; L772-Y797 HydrophobicContact CD1-CG 3.77Å; L772-Y797 HydrophobicContact CG-CD1 4.45Å; F775-Y797 HydrophobicContact CB-CD2 3.97Å; F775-Y797 HydrophobicContact CB-CE2 4.47Å; F775-Y797 AromaticContact CD1-CD2 3.98Å; F775-Y797 HydrophobicContact CD1-CD2 3.98Å; F775-Y797 HydrophobicContact CD1-CG 4.44Å; F775-Y797 HydrophobicContact CG-CD2 4.18Å; V793-Y797 WeakPolarHBondContact O-CB 3.43Å; V793-Y797 PolarHBondContact O-N 3.23Å; V793-Y797 VanDerWaalsContact O-N 3.08Å; A794-Y797 WeakPolarHBondContact O-CB 3.22Å; A794-Y797 PolarHBondContact O-N 2.75Å; A794-Y797 VanDerWaalsContact O-N 3.08Å; Y797-I800 PolarHBondContact O-N 2.87Å; Y797-Q801 HydrophobicContact CE1-CB 4.49Å; Y797-Q801 WeakPolarHBondContact O-CB 3.43Å; Y797-Q801 PolarHBondContact O-N 2.85Å
798	E	98	Very high	96.1	Very high	93 Å²	93	61.7 Å²	61.7	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-67.6	-42.6	-178.1	-71	178.5	-165.5	0	0	112.3	A794 G795 I796 I800 Q801 Q802	A794-E798 WeakPolarHBondContact O-CG 3.43Å; A794-E798 PolarHBondContact O-N 3.27Å; G795-E798 PolarHBondContact O-N 3.47Å; I796-E798 PolarHBondContact O-N 2.73Å; E798-I800 VanDerWaalsContact C-N 3.34Å; E798-I800 PolarHBondContact O-N 2.92Å; E798-Q801 PolarHBondContact O-N 2.95Å; E798-Q802 WeakPolarHBondContact O-CB 3.23Å; E798-Q802 WeakPolarHBondContact O-CG 3.37Å; E798-Q802 PolarHBondContact O-N 2.84Å
799	R	98.3	Very high	96.1	Very high	43 Å²	43	66.3 Å²	66.3	16%	0.162	31%	0.306	C	S	.	.	H	α-helix	trans	-66.5	-34	174.9	-72.9	-175	-60.4	-98.2	2.8	113	E696 D698 R702 G795 R803	E696-R799 IonicContact OE1-CZ 3.66Å; E696-R799 IonicContact OE1-NH1 3.78Å; E696-R799 PolarHBondContact OE1-NH1 2.97Å; E696-R799 IonicContact OE1-NH2 3.71Å; E696-R799 PolarHBondContact OE1-NH2 3.27Å; E696-R799 IonicContact OE2-CZ 3.42Å; E696-R799 VanDerWaalsContact OE2-CZ 3.31Å; E696-R799 IonicContact OE2-NH1 3.23Å; E696-R799 PolarHBondContact OE2-NH1 3.37Å; E696-R799 IonicContact OE2-NH2 3.31Å; D698-R799 IonicContact OD1-CZ 3.77Å; D698-R799 IonicContact OD1-NE 2.7Å; D698-R799 PolarHBondContact OD1-NE 2.81Å; D698-R799 IonicContact OD1-NH2 2.76Å; D698-R799 PolarHBondContact OD1-NH2 3.07Å; D698-R799 WeakPolarHBondContact OD2-CB 3.23Å; D698-R799 IonicContact OD2-NE 3.96Å; D698-R799 PolarHBondContact OD2-NE 3.09Å; R702-R799 PolarHBondContact NH2-O 3.42Å; G795-R799 WeakPolarHBondContact O-CB 3.4Å; G795-R799 WeakPolarHBondContact O-CG 3.44Å; G795-R799 PolarHBondContact O-N 3.12Å; R799-R803 PolarHBondContact O-N 2.84Å
800	I	97.8	Very high	96	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.1	-40.1	171.2	-67.4	-72	0	0	0	110.3	D698 V752 L755 N756 M759 Y760 I796 Y797 E798 R803 L805	D698-I800 HydrophobicContact CB-CD1 4.21Å; D698-I800 HydrophobicContact CB-CG1 4.35Å; V752-I800 HydrophobicContact CG1-CD1 3.65Å; V752-I800 HydrophobicContact CG1-CG1 4.02Å; L755-I800 HydrophobicContact CD2-CB 3.89Å; L755-I800 HydrophobicContact CD2-CG1 4.1Å; L755-I800 HydrophobicContact CD2-CG2 3.82Å; L755-I800 HydrophobicContact CG-CG2 3.93Å; N756-I800 HydrophobicContact CB-CG2 4.22Å; M759-I800 HydrophobicContact CE-CG2 4.31Å; Y760-I800 HydrophobicContact CE2-CG2 4.45Å; Y760-I800 WeakPolarHBondContact CE2-O 3.46Å; Y760-I800 PolarHBondContact OH-O 3.43Å; I796-I800 WeakPolarHBondContact O-CB 3.08Å; I796-I800 WeakPolarHBondContact O-CG1 3.46Å; I796-I800 PolarHBondContact O-N 3.32Å; Y797-I800 PolarHBondContact O-N 2.87Å; E798-I800 VanDerWaalsContact C-N 3.34Å; E798-I800 PolarHBondContact O-N 2.92Å; I800-R803 CarbonylContact O-C 3.56Å; I800-R803 VanDerWaalsContact O-C 3.24Å; I800-R803 PolarHBondContact O-N 3.13Å; I800-R803 VanDerWaalsContact O-O 3.06Å; I800-L805 HydrophobicContact CD1-CD1 3.7Å; I800-L805 HydrophobicContact CD1-CD2 3.8Å; I800-L805 HydrophobicContact CD1-CG 3.56Å
801	Q	97	Very high	96	Very high	105 Å²	105	60 Å²	60	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-67.7	-35.7	177.5	-172	178.6	33.8	0	0	114.1	M759 Y760 Y797 E798 R803	M759-Q801 HydrophobicContact CE-CB 4.03Å; M759-Q801 HydrophobicContact CE-CG 4.5Å; M759-Q801 WeakPolarHBondContact SD-CA 3.37Å; M759-Q801 HydrophobicContact SD-CB 3.65Å; M759-Q801 HydrophobicContact SD-CG 3.8Å; Y760-Q801 PolarHBondContact OH-O 3.21Å; Y797-Q801 HydrophobicContact CE1-CB 4.49Å; Y797-Q801 WeakPolarHBondContact O-CB 3.43Å; Y797-Q801 PolarHBondContact O-N 2.85Å; E798-Q801 PolarHBondContact O-N 2.95Å; Q801-R803 VanDerWaalsContact C-N 3.32Å
802	Q	96.8	Very high	96.1	Very high	150 Å²	150	54 Å²	54	70%	0.701	25%	0.25	S	S	*	.	H	α-helix	trans	-70.4	-28.6	174.6	-69.8	165.5	28.3	0	0	112.1	E798	E798-Q802 WeakPolarHBondContact O-CB 3.23Å; E798-Q802 WeakPolarHBondContact O-CG 3.37Å; E798-Q802 PolarHBondContact O-N 2.84Å
803	R	96.1	Very high	96	Very high	165 Å²	165	54.2 Å²	54.2	62%	0.623	25%	0.254	S	S	*	.	S	Bend	trans	-153.4	116.2	-172.7	-169.4	-178.1	176.2	-169.4	0.2	112.4	R702 R799 I800 Q801	R702-R803 PolarHBondContact NH1-O 3.47Å; R702-R803 PolarHBondContact NH2-O 2.73Å; R799-R803 PolarHBondContact O-N 2.84Å; I800-R803 CarbonylContact O-C 3.56Å; I800-R803 VanDerWaalsContact O-C 3.24Å; I800-R803 PolarHBondContact O-N 3.13Å; I800-R803 VanDerWaalsContact O-O 3.06Å; Q801-R803 VanDerWaalsContact C-N 3.32Å
804	E	95.5	Very high	95.8	Very high	54 Å²	54	60.1 Å²	60.1	25%	0.252	28%	0.277	S	S	.	.			trans	-54.9	140.9	170.5	-171.9	-175.3	162.3	0	0	111.9	R702 Y760 R806	R702-E804 PolarHBondContact NH1-O 3.28Å; Y760-E804 HydrophobicContact CD1-CB 3.92Å; Y760-E804 HydrophobicContact CD1-CG 4.04Å; Y760-E804 HydrophobicContact CD2-CB 3.79Å; Y760-E804 HydrophobicContact CD2-CG 3.62Å; Y760-E804 HydrophobicContact CE1-CB 3.9Å; Y760-E804 VanDerWaalsContact CE2-CA 3.48Å; Y760-E804 HydrophobicContact CE2-CB 3.75Å; Y760-E804 HydrophobicContact CE2-CG 4.12Å; Y760-E804 HydrophobicContact CG-CB 3.87Å; Y760-E804 HydrophobicContact CG-CG 3.56Å; Y760-E804 PolarHBondContact OH-N 3.11Å; E804-R806 HydrophobicContact CB-CG 4.27Å; E804-R806 VanDerWaalsContact CD-NH1 3.27Å; E804-R806 HydrophobicContact CG-CG 4.3Å; E804-R806 PolarHBondContact O-N 3.39Å; E804-R806 VanDerWaalsContact O-N 3.14Å; E804-R806 VanDerWaalsContact OE1-CD 3.22Å; E804-R806 WeakPolarHBondContact OE1-CD 3.4Å; E804-R806 IonicContact OE1-CZ 3.48Å; E804-R806 IonicContact OE1-NE 2.72Å; E804-R806 IonicContact OE1-NH1 3.92Å; E804-R806 PolarHBondContact OE1-NH1 3.32Å; E804-R806 VanDerWaalsContact OE2-CD 3.29Å; E804-R806 WeakPolarHBondContact OE2-CD 3.29Å; E804-R806 IonicContact OE2-CZ 2.72Å; E804-R806 IonicContact OE2-NH1 3.79Å; E804-R806 PolarHBondContact OE2-NH1 3.38Å; E804-R806 VanDerWaalsContact OE2-NH1 3.11Å
805	L	94.6	Very high	95.7	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	27%	0.274	C	S	.	.			trans	-71.8	101.5	166.1	-61.9	175.5	0	0	0	109.4	L701 R702 Q705 V752 N756 I800	L701-L805 HydrophobicContact CD2-CD1 4.19Å; L701-L805 HydrophobicContact CG-CD1 4.48Å; R702-L805 HydrophobicContact CB-CD2 3.61Å; R702-L805 HydrophobicContact CG-CD2 3.87Å; Q705-L805 PolarHBondContact NE2-O 3.38Å; V752-L805 HydrophobicContact CG1-CD1 3.98Å; N756-L805 HydrophobicContact CB-CB 4.45Å; N756-L805 HydrophobicContact CB-CD1 3.91Å; N756-L805 HydrophobicContact CB-CG 4.24Å; N756-L805 WeakPolarHBondContact OD1-CB 3.25Å; N756-L805 PolarHBondContact OD1-N 2.97Å; I800-L805 HydrophobicContact CD1-CD1 3.7Å; I800-L805 HydrophobicContact CD1-CD2 3.8Å; I800-L805 HydrophobicContact CD1-CG 3.56Å
806	R	92	Very high	95.6	Very high	157 Å²	157	60.6 Å²	60.6	59%	0.592	28%	0.277	S	S	*	.			trans	-106.9	138.1	177.9	-59.5	-57.7	-58.1	-162.7	-2.7	111	E804	E804-R806 HydrophobicContact CB-CG 4.27Å; E804-R806 VanDerWaalsContact CD-NH1 3.27Å; E804-R806 HydrophobicContact CG-CG 4.3Å; E804-R806 PolarHBondContact O-N 3.39Å; E804-R806 VanDerWaalsContact O-N 3.14Å; E804-R806 VanDerWaalsContact OE1-CD 3.22Å; E804-R806 WeakPolarHBondContact OE1-CD 3.4Å; E804-R806 IonicContact OE1-CZ 3.48Å; E804-R806 IonicContact OE1-NE 2.72Å; E804-R806 IonicContact OE1-NH1 3.92Å; E804-R806 PolarHBondContact OE1-NH1 3.32Å; E804-R806 VanDerWaalsContact OE2-CD 3.29Å; E804-R806 WeakPolarHBondContact OE2-CD 3.29Å; E804-R806 IonicContact OE2-CZ 2.72Å; E804-R806 IonicContact OE2-NH1 3.79Å; E804-R806 PolarHBondContact OE2-NH1 3.38Å; E804-R806 VanDerWaalsContact OE2-NH1 3.11Å
807	S	93.4	Very high	95.3	Very high	30 Å²	30	64.7 Å²	64.7	21%	0.21	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-74.6	151.3	157.4	-57.3	0	0	0	0	110.7	Q705 R709	Q705-S807 WeakPolarHBondContact O-CA 3.27Å; Q705-S807 VanDerWaalsContact O-CB 3.27Å; Q705-S807 WeakPolarHBondContact O-CB 3.26Å; Q705-S807 PolarHBondContact O-OG 2.83Å; R709-S807 WeakPolarHBondContact CA-OG 3.24Å
808	N	93.2	Very high	95	Very high	80 Å²	80	64.4 Å²	64.4	43%	0.428	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-61.7	151.2	176.7	-72.3	-30.8	0	0	0	111.6	A706 D810	A706-N808 VanDerWaalsContact O-CB 3.25Å; A706-N808 WeakPolarHBondContact O-CB 3.19Å; A706-N808 VanDerWaalsContact O-CG 3.24Å; A706-N808 PolarHBondContact O-N 2.79Å; A706-N808 PolarHBondContact O-ND2 2.84Å; A706-N808 VanDerWaalsContact O-ND2 3.14Å; N808-D810 PolarHBondContact O-N 3.17Å
809	E	93.6	Very high	94.8	Very high	106 Å²	106	62.2 Å²	62.2	50%	0.495	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-60.4	133.3	178	-57.7	-159.6	149.3	0	0	112.1	T813 Y814 R817	E809-T813 HydrophobicContact CB-CG2 4.07Å; E809-T813 HydrophobicContact CG-CG2 3.95Å; E809-Y814 PolarHBondContact OE2-OH 3.25Å; E809-R817 VanDerWaalsContact CD-NH2 3.28Å; E809-R817 IonicContact OE1-CZ 2.88Å; E809-R817 VanDerWaalsContact OE1-CZ 3.31Å; E809-R817 IonicContact OE1-NH1 3.33Å; E809-R817 PolarHBondContact OE1-NH1 3.39Å; E809-R817 IonicContact OE1-NH2 2.69Å; E809-R817 PolarHBondContact OE1-NH2 3.16Å; E809-R817 IonicContact OE2-CZ 2.7Å; E809-R817 IonicContact OE2-NH1 3.46Å; E809-R817 PolarHBondContact OE2-NH1 2.99Å; E809-R817 IonicContact OE2-NH2 3.3Å; E809-R817 PolarHBondContact OE2-NH2 2.86Å
810	D	94.6	Very high	94.5	Very high	21 Å²	21	67.8 Å²	67.8	11%	0.112	31%	0.31	C	S	.	.			trans	-116	-179.7	172.8	71.8	-5.3	0	0	0	111.4	S663 R664 N808 V812 T813 Y814	S663-D810 VanDerWaalsContact CA-OD2 3.28Å; S663-D810 WeakPolarHBondContact CA-OD2 3.49Å; S663-D810 PolarHBondContact OG-OD2 3.46Å; R664-D810 HydrophobicContact CG-CB 4.04Å; R664-D810 PolarHBondContact N-OD2 3.2Å; N808-D810 PolarHBondContact O-N 3.17Å; D810-V812 PolarHBondContact O-N 3.24Å; D810-V812 WeakPolarHBondContact OD1-CB 3.44Å; D810-V812 PolarHBondContact OD1-N 3.46Å; D810-T813 PolarHBondContact N-OG1 3Å; D810-T813 VanDerWaalsContact O-CB 3.26Å; D810-T813 WeakPolarHBondContact O-CB 3.47Å; D810-T813 PolarHBondContact O-N 2.85Å; D810-T813 VanDerWaalsContact O-N 3.14Å; D810-T813 PolarHBondContact OD1-N 3.07Å; D810-T813 PolarHBondContact OD1-OG1 3.27Å; D810-Y814 VanDerWaalsContact O-CD2 3.23Å; D810-Y814 WeakPolarHBondContact O-CD2 3.21Å
811	H	95.1	Very high	94.2	Very high	25 Å²	25	69 Å²	69	12%	0.116	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-30.7	179	59.1	-90	0	0	0	112.9	G661 T813 Y814 V815 P832 R834	G661-H811 VanDerWaalsContact C-CE1 3.46Å; G661-H811 WeakPolarHBondContact CA-ND1 3.43Å; G661-H811 PolarHBondContact O-CE1 3.46Å; G661-H811 PolarHBondContact O-ND1 3.15Å; H811-T813 VanDerWaalsContact C-N 3.3Å; H811-T813 PolarHBondContact O-N 2.78Å; H811-Y814 PolarHBondContact O-N 3.34Å; H811-V815 PolarHBondContact O-N 3.42Å; H811-P832 PolarHBondContact NE2-O 3.33Å; H811-R834 PolarHBondContact CD2-O 2.96Å
812	V	96.3	Very high	94	Very high	15 Å²	15	64.7 Å²	64.7	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-37.9	176.9	-165.7	0	0	0	0	110.2	S663 D810 Y814 V815 S816 A830 P832	S663-V812 WeakPolarHBondContact OG-CG2 3.38Å; D810-V812 PolarHBondContact O-N 3.24Å; D810-V812 WeakPolarHBondContact OD1-CB 3.44Å; D810-V812 PolarHBondContact OD1-N 3.46Å; V812-Y814 PolarHBondContact O-N 2.88Å; V812-V815 CarbonylContact O-C 3.55Å; V812-V815 WeakPolarHBondContact O-CA 3.19Å; V812-V815 WeakPolarHBondContact O-CB 3.42Å; V812-V815 PolarHBondContact O-N 3.42Å; V812-S816 PolarHBondContact O-N 3.49Å; V812-S816 PolarHBondContact O-OG 2.91Å; V812-A830 HydrophobicContact CG1-CB 4.05Å; V812-P832 WeakPolarHBondContact CG2-O 3.37Å
813	T	94.7	Very high	93.6	Very high	44 Å²	44	61.7 Å²	61.7	27%	0.27	29%	0.287	S	S	.	.	H	α-helix	trans	-57.9	-33.8	176.8	-53	0	0	0	0	112.6	E809 D810 H811 R817	E809-T813 HydrophobicContact CB-CG2 4.07Å; E809-T813 HydrophobicContact CG-CG2 3.95Å; D810-T813 PolarHBondContact N-OG1 3Å; D810-T813 VanDerWaalsContact O-CB 3.26Å; D810-T813 WeakPolarHBondContact O-CB 3.47Å; D810-T813 PolarHBondContact O-N 2.85Å; D810-T813 VanDerWaalsContact O-N 3.14Å; D810-T813 PolarHBondContact OD1-N 3.07Å; D810-T813 PolarHBondContact OD1-OG1 3.27Å; H811-T813 VanDerWaalsContact C-N 3.3Å; H811-T813 PolarHBondContact O-N 2.78Å; T813-R817 PolarHBondContact O-N 3Å
814	Y	92.8	Very high	93	Very high	126 Å²	126	56.8 Å²	56.8	49%	0.494	29%	0.288	S	S	.	.	H	α-helix	trans	-71.3	-38	171.6	-66.3	-95.4	0	0	0	112.2	E809 D810 H811 V812 R817 V818	E809-Y814 PolarHBondContact OE2-OH 3.25Å; D810-Y814 VanDerWaalsContact O-CD2 3.23Å; D810-Y814 WeakPolarHBondContact O-CD2 3.21Å; H811-Y814 PolarHBondContact O-N 3.34Å; V812-Y814 PolarHBondContact O-N 2.88Å; Y814-R817 VanDerWaalsContact CD1-NH2 3.28Å; Y814-R817 VanDerWaalsContact CZ-NH2 3.31Å; Y814-R817 PolarHBondContact O-N 2.88Å; Y814-V818 PolarHBondContact O-N 3.36Å; Y814-V818 VanDerWaalsContact O-N 3.11Å
815	V	96.2	Very high	92.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-41	175.3	-174.3	0	0	0	0	111.1	H811 V812 R817 V818 E819 L829 A830 R834 F866	H811-V815 PolarHBondContact O-N 3.42Å; V812-V815 CarbonylContact O-C 3.55Å; V812-V815 WeakPolarHBondContact O-CA 3.19Å; V812-V815 WeakPolarHBondContact O-CB 3.42Å; V812-V815 PolarHBondContact O-N 3.42Å; V815-R817 VanDerWaalsContact C-N 3.32Å; V815-R817 PolarHBondContact O-N 2.86Å; V815-V818 PolarHBondContact O-N 3.5Å; V815-V818 VanDerWaalsContact O-N 3.13Å; V815-E819 WeakPolarHBondContact O-CB 3.5Å; V815-E819 PolarHBondContact O-N 2.91Å; V815-L829 HydrophobicContact CG1-CB 4.2Å; V815-L829 HydrophobicContact CG1-CD2 4.07Å; V815-L829 HydrophobicContact CG1-CG 3.68Å; V815-L829 WeakPolarHBondContact CG1-O 3.48Å; V815-A830 HydrophobicContact CB-CB 4.41Å; V815-A830 HydrophobicContact CG1-CB 4.25Å; V815-R834 WeakPolarHBondContact CG2-O 3.47Å; V815-F866 HydrophobicContact CB-CE1 4.44Å; V815-F866 HydrophobicContact CG1-CD1 4.48Å; V815-F866 HydrophobicContact CG1-CE1 3.89Å; V815-F866 HydrophobicContact CG2-CD1 4.19Å; V815-F866 HydrophobicContact CG2-CE1 3.96Å
816	S	94.5	Very high	92.1	Very high	35 Å²	35	65.4 Å²	65.4	25%	0.245	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-40.5	174	-56.9	0	0	0	0	112.7	V812 E819 Q820 A830	V812-S816 PolarHBondContact O-N 3.49Å; V812-S816 PolarHBondContact O-OG 2.91Å; S816-E819 PolarHBondContact O-N 2.92Å; S816-Q820 WeakPolarHBondContact O-CB 3.48Å; S816-Q820 WeakPolarHBondContact O-CG 3.48Å; S816-Q820 PolarHBondContact O-N 3.48Å; S816-A830 VanDerWaalsContact OG-CB 3.25Å; S816-A830 WeakPolarHBondContact OG-CB 3.36Å
817	R	92.3	Very high	91.8	Very high	87 Å²	87	62.2 Å²	62.2	33%	0.328	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-39	174.7	-76.1	-176.6	-75.7	-145	-7.5	112.3	E809 T813 Y814 V815 S821	E809-R817 VanDerWaalsContact CD-NH2 3.28Å; E809-R817 IonicContact OE1-CZ 2.88Å; E809-R817 VanDerWaalsContact OE1-CZ 3.31Å; E809-R817 IonicContact OE1-NH1 3.33Å; E809-R817 PolarHBondContact OE1-NH1 3.39Å; E809-R817 IonicContact OE1-NH2 2.69Å; E809-R817 PolarHBondContact OE1-NH2 3.16Å; E809-R817 IonicContact OE2-CZ 2.7Å; E809-R817 IonicContact OE2-NH1 3.46Å; E809-R817 PolarHBondContact OE2-NH1 2.99Å; E809-R817 IonicContact OE2-NH2 3.3Å; E809-R817 PolarHBondContact OE2-NH2 2.86Å; T813-R817 PolarHBondContact O-N 3Å; Y814-R817 VanDerWaalsContact CD1-NH2 3.28Å; Y814-R817 VanDerWaalsContact CZ-NH2 3.31Å; Y814-R817 PolarHBondContact O-N 2.88Å; V815-R817 VanDerWaalsContact C-N 3.32Å; V815-R817 PolarHBondContact O-N 2.86Å; R817-S821 PolarHBondContact O-N 3.18Å
818	V	92.4	Very high	91.7	Very high	16 Å²	16	65.8 Å²	65.8	10%	0.097	34%	0.344	C	S	.	.	H	α-helix	trans	-65	-46.4	173.2	174.6	0	0	0	0	110.4	Y814 V815 Q820 S821 I822 L829 L836 F864 F866	Y814-V818 PolarHBondContact O-N 3.36Å; Y814-V818 VanDerWaalsContact O-N 3.11Å; V815-V818 PolarHBondContact O-N 3.5Å; V815-V818 VanDerWaalsContact O-N 3.13Å; V818-Q820 PolarHBondContact O-N 3.48Å; V818-S821 WeakPolarHBondContact O-CB 3.49Å; V818-S821 PolarHBondContact O-N 3.02Å; V818-S821 VanDerWaalsContact O-N 3.07Å; V818-S821 PolarHBondContact O-OG 3.44Å; V818-I822 HydrophobicContact CG1-CD1 4.04Å; V818-I822 WeakPolarHBondContact O-CG1 3.33Å; V818-L829 HydrophobicContact CG1-CD2 4.28Å; V818-L836 HydrophobicContact CG2-CD2 4.31Å; V818-F864 HydrophobicContact CG1-CD1 3.86Å; V818-F864 HydrophobicContact CG1-CE1 3.85Å; V818-F864 HydrophobicContact CG1-CG 4.44Å; V818-F864 HydrophobicContact CG1-CZ 4.42Å; V818-F864 HydrophobicContact CG2-CD1 4.19Å; V818-F864 HydrophobicContact CG2-CE1 3.86Å; V818-F866 HydrophobicContact CG1-CZ 4.2Å
819	E	93.9	Very high	91.7	Very high	46 Å²	46	62 Å²	62	22%	0.215	32%	0.324	C	S	.	.	H	α-helix	trans	-56.3	-48.9	178.3	-177.5	157.1	-154.3	0	0	112.7	V815 S816 S821 I822 L825 V828 L829 A830	V815-E819 WeakPolarHBondContact O-CB 3.5Å; V815-E819 PolarHBondContact O-N 2.91Å; S816-E819 PolarHBondContact O-N 2.92Å; E819-S821 PolarHBondContact O-N 3.33Å; E819-S821 VanDerWaalsContact O-N 3.14Å; E819-I822 PolarHBondContact O-N 2.93Å; E819-L825 HydrophobicContact CG-CD2 4.2Å; E819-V828 WeakPolarHBondContact OE1-CA 3.38Å; E819-L829 HydrophobicContact CB-CB 4.09Å; E819-L829 HydrophobicContact CB-CD2 4.29Å; E819-L829 VanDerWaalsContact CD-N 3.27Å; E819-L829 HydrophobicContact CG-CB 4.1Å; E819-L829 PolarHBondContact OE1-N 2.9Å; E819-L829 WeakPolarHBondContact OE2-CB 3.4Å; E819-L829 PolarHBondContact OE2-N 3.21Å; E819-L829 VanDerWaalsContact OE2-N 3.17Å; E819-A830 VanDerWaalsContact OE2-CB 3.31Å; E819-A830 WeakPolarHBondContact OE2-CB 3.36Å; E819-A830 PolarHBondContact OE2-N 2.94Å
820	Q	91.9	Very high	91.8	Very high	161 Å²	161	58 Å²	58	75%	0.752	31%	0.309	S	S	*	.	H	α-helix	trans	-60.9	-21.8	177.1	-70.9	166.8	6.6	0	0	113.9	S816 V818	S816-Q820 WeakPolarHBondContact O-CB 3.48Å; S816-Q820 WeakPolarHBondContact O-CG 3.48Å; S816-Q820 PolarHBondContact O-N 3.48Å; V818-Q820 PolarHBondContact O-N 3.48Å
821	S	91.3	Very high	91.8	Very high	25 Å²	25	58.7 Å²	58.7	18%	0.175	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-10	176.6	79.5	0	0	0	0	114.1	R817 V818 E819 S884 Y885	R817-S821 PolarHBondContact O-N 3.18Å; V818-S821 WeakPolarHBondContact O-CB 3.49Å; V818-S821 PolarHBondContact O-N 3.02Å; V818-S821 VanDerWaalsContact O-N 3.07Å; V818-S821 PolarHBondContact O-OG 3.44Å; E819-S821 PolarHBondContact O-N 3.33Å; E819-S821 VanDerWaalsContact O-N 3.14Å; S821-S884 WeakPolarHBondContact O-CA 3.45Å; S821-Y885 PolarHBondContact O-N 3.22Å; S821-Y885 WeakPolarHBondContact OG-CD2 3.33Å
822	I	92.4	Very high	91.9	Very high	15 Å²	15	58.8 Å²	58.8	8%	0.077	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.5	-171.4	-57.9	161.3	0	0	0	111.6	V818 E819 L825 L829 L871 L873 F887	V818-I822 HydrophobicContact CG1-CD1 4.04Å; V818-I822 WeakPolarHBondContact O-CG1 3.33Å; E819-I822 PolarHBondContact O-N 2.93Å; I822-L825 HydrophobicContact CB-CB 4.44Å; I822-L825 HydrophobicContact CD1-CD2 4.4Å; I822-L825 HydrophobicContact CG2-CB 3.88Å; I822-L829 HydrophobicContact CD1-CD2 4.27Å; I822-L871 HydrophobicContact CD1-CD2 3.75Å; I822-L873 HydrophobicContact CD1-CD1 3.82Å; I822-L873 HydrophobicContact CD1-CD2 4.14Å; I822-L873 HydrophobicContact CG1-CD1 3.8Å; I822-L873 HydrophobicContact CG1-CD2 4.21Å; I822-L873 HydrophobicContact CG2-CD2 3.98Å; I822-F887 HydrophobicContact CG2-CB 3.97Å
823	L	89.6	Confident	91.9	Very high	86 Å²	86	60.8 Å²	60.8	45%	0.45	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	132.2	172.4	-52.8	179.3	0	0	0	110.5	Y885 F887	L823-Y885 WeakPolarHBondContact CB-O 3.44Å; L823-Y885 PolarHBondContact N-O 2.96Å; L823-F887 PolarHBondContact O-N 2.97Å; L823-F887 VanDerWaalsContact O-N 3.07Å
824	G	83.3	Confident	92.1	Very high	62 Å²	62	60 Å²	60	64%	0.639	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	4.3	173.4	0	0	0	0	0	115.8
825	L	86.1	Confident	92.2	Very high	32 Å²	32	55.8 Å²	55.8	17%	0.168	30%	0.3	C	S	.	.			trans	-65.8	140.2	167.9	-169.5	66.2	0	0	0	109.7	E819 I822 T827 L829 F887	E819-L825 HydrophobicContact CG-CD2 4.2Å; I822-L825 HydrophobicContact CB-CB 4.44Å; I822-L825 HydrophobicContact CD1-CD2 4.4Å; I822-L825 HydrophobicContact CG2-CB 3.88Å; L825-T827 WeakPolarHBondContact CD1-OG1 3.45Å; L825-T827 WeakPolarHBondContact CD2-O 3.45Å; L825-L829 HydrophobicContact CD2-CB 4.17Å; L825-F887 HydrophobicContact CD1-CD2 3.5Å; L825-F887 HydrophobicContact CD1-CE2 3.7Å; L825-F887 HydrophobicContact CD1-CG 4.23Å
826	K	84.1	Confident	92.3	Very high	205 Å²	205	58.5 Å²	58.5	89%	0.891	32%	0.315	S	S	*	.			trans	-119.5	-2.6	-179.6	-66.7	-174.3	177.2	-176.5	0	114
827	T	86.4	Confident	92.4	Very high	89 Å²	89	59.1 Å²	59.1	55%	0.546	32%	0.317	S	S	.	.	S	Bend	trans	-122	130.6	-170.9	50.4	0	0	0	0	108.7	L825 L829	L825-T827 WeakPolarHBondContact CD1-OG1 3.45Å; L825-T827 WeakPolarHBondContact CD2-O 3.45Å; T827-L829 PolarHBondContact O-N 3.29Å
828	V	90.4	Very high	92.5	Very high	105 Å²	105	56 Å²	56	64%	0.636	31%	0.308	S	S	*	.			trans	-59.8	122.7	178	-178.2	0	0	0	0	110.1	E819 V831 R834	E819-V828 WeakPolarHBondContact OE1-CA 3.38Å; V828-V831 HydrophobicContact CG1-CG1 4.39Å; V828-R834 PolarHBondContact O-NH1 3.3Å
829	L	93.7	Very high	92.6	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	32%	0.323	C	S	.	.			trans	-93.6	-41.3	-179.6	-165.9	67.3	0	0	0	111.1	V815 V818 E819 I822 L825 T827 V831 R834 F866 L869 L871	V815-L829 HydrophobicContact CG1-CB 4.2Å; V815-L829 HydrophobicContact CG1-CD2 4.07Å; V815-L829 HydrophobicContact CG1-CG 3.68Å; V815-L829 WeakPolarHBondContact CG1-O 3.48Å; V818-L829 HydrophobicContact CG1-CD2 4.28Å; E819-L829 HydrophobicContact CB-CB 4.09Å; E819-L829 HydrophobicContact CB-CD2 4.29Å; E819-L829 VanDerWaalsContact CD-N 3.27Å; E819-L829 HydrophobicContact CG-CB 4.1Å; E819-L829 PolarHBondContact OE1-N 2.9Å; E819-L829 WeakPolarHBondContact OE2-CB 3.4Å; E819-L829 PolarHBondContact OE2-N 3.21Å; E819-L829 VanDerWaalsContact OE2-N 3.17Å; I822-L829 HydrophobicContact CD1-CD2 4.27Å; L825-L829 HydrophobicContact CD2-CB 4.17Å; T827-L829 PolarHBondContact O-N 3.29Å; L829-V831 VanDerWaalsContact C-N 3.25Å; L829-V831 PolarHBondContact O-N 3.24Å; L829-R834 WeakPolarHBondContact O-CD 3.39Å; L829-R834 PolarHBondContact O-NH1 2.96Å; L829-F866 HydrophobicContact CD1-CE2 4.14Å; L829-F866 HydrophobicContact CD1-CZ 4.34Å; L829-F866 HydrophobicContact CD2-CE1 4.44Å; L829-F866 HydrophobicContact CD2-CE2 4.19Å; L829-F866 HydrophobicContact CD2-CZ 3.74Å; L829-F866 HydrophobicContact CG-CZ 4.23Å; L829-L869 HydrophobicContact CD1-CD2 3.78Å; L829-L871 HydrophobicContact CD1-CD2 4.21Å; L829-L871 HydrophobicContact CD2-CD2 3.86Å
830	A	94.9	Very high	92.6	Very high	22 Å²	22	57.3 Å²	57.3	18%	0.182	32%	0.322	C	S	.	.			trans	-76.4	64.3	-179.3	0	0	0	0	0	113.6	V812 V815 S816 E819	V812-A830 HydrophobicContact CG1-CB 4.05Å; V815-A830 HydrophobicContact CB-CB 4.41Å; V815-A830 HydrophobicContact CG1-CB 4.25Å; S816-A830 VanDerWaalsContact OG-CB 3.25Å; S816-A830 WeakPolarHBondContact OG-CB 3.36Å; E819-A830 VanDerWaalsContact OE2-CB 3.31Å; E819-A830 WeakPolarHBondContact OE2-CB 3.36Å; E819-A830 PolarHBondContact OE2-N 2.94Å
831	V	96.2	Very high	92.7	Very high	34 Å²	34	56 Å²	56	21%	0.206	31%	0.31	C	S	.	.			trans	-88.9	149.3	169.5	-59.6	0	0	0	0	110.6	V828 L829 H833 R834	V828-V831 HydrophobicContact CG1-CG1 4.39Å; L829-V831 VanDerWaalsContact C-N 3.25Å; L829-V831 PolarHBondContact O-N 3.24Å; V831-H833 VanDerWaalsContact C-N 3.28Å; V831-H833 WeakPolarHBondContact CG2-NE2 3.22Å; V831-H833 PolarHBondContact O-N 3.3Å; V831-H833 VanDerWaalsContact O-N 3.07Å; V831-R834 HydrophobicContact CG2-CB 3.6Å; V831-R834 PolarHBondContact O-N 2.87Å
832	P	96.8	Very high	92.8	Very high	28 Å²	28	55 Å²	55	18%	0.182	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.7	-166	-27.5	35.7	0	0	0	116.2	M666 H811 V812	M666-P832 HydrophobicContact CG-CB 3.57Å; M666-P832 HydrophobicContact CG-CG 4.29Å; M666-P832 HydrophobicContact SD-CB 3.78Å; M666-P832 HydrophobicContact SD-CG 3.85Å; H811-P832 PolarHBondContact NE2-O 3.33Å; V812-P832 WeakPolarHBondContact CG2-O 3.37Å
833	H	96.2	Very high	92.8	Very high	56 Å²	56	55.7 Å²	55.7	26%	0.259	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-8.6	178.4	56.7	-95.1	0	0	0	114.8	N629 V630 V831 N867	N629-H833 VanDerWaalsContact CB-CA 3.47Å; N629-H833 HydrophobicContact CB-CB 3.71Å; V630-H833 HydrophobicContact CG2-CB 3.82Å; V630-H833 WeakPolarHBondContact CG2-ND1 3.39Å; V831-H833 VanDerWaalsContact C-N 3.28Å; V831-H833 WeakPolarHBondContact CG2-NE2 3.22Å; V831-H833 PolarHBondContact O-N 3.3Å; V831-H833 VanDerWaalsContact O-N 3.07Å; H833-N867 PolarHBondContact O-ND2 2.89Å
834	R	97.6	Very high	93	Very high	28 Å²	28	54.3 Å²	54.3	11%	0.106	30%	0.297	C	S	.	.			trans	-83.4	122.4	-177	-171.4	166.2	-64	124.5	-0.4	110.6	H811 V815 V828 L829 V831 F866 N867 D868	H811-R834 PolarHBondContact CD2-O 2.96Å; V815-R834 WeakPolarHBondContact CG2-O 3.47Å; V828-R834 PolarHBondContact O-NH1 3.3Å; L829-R834 WeakPolarHBondContact O-CD 3.39Å; L829-R834 PolarHBondContact O-NH1 2.96Å; V831-R834 HydrophobicContact CG2-CB 3.6Å; V831-R834 PolarHBondContact O-N 2.87Å; R834-F866 HydrophobicContact CG-CB 3.77Å; R834-F866 HydrophobicContact CG-CD1 3.69Å; R834-F866 HydrophobicContact CG-CG 3.87Å; R834-N867 WeakPolarHBondContact CA-OD1 3.38Å; R834-D868 WeakPolarHBondContact CD-OD1 3.42Å; R834-D868 WeakPolarHBondContact CG-OD1 3.39Å; R834-D868 IonicContact CZ-OD1 3.49Å; R834-D868 IonicContact CZ-OD2 3.05Å; R834-D868 VanDerWaalsContact CZ-OD2 3.32Å; R834-D868 IonicContact NE-OD1 3.54Å; R834-D868 PolarHBondContact NE-OD1 3.43Å; R834-D868 IonicContact NE-OD2 3.67Å; R834-D868 PolarHBondContact NE-OD2 2.79Å; R834-D868 VanDerWaalsContact NE-OD2 3.13Å; R834-D868 IonicContact NH2-OD1 3.72Å; R834-D868 IonicContact NH2-OD2 2.72Å; R834-D868 PolarHBondContact NH2-OD2 3.39Å
835	R	96.8	Very high	93.3	Very high	38 Å²	38	51.6 Å²	51.6	14%	0.143	27%	0.268	C	S	.	.			trans	-118.1	129.3	-179.7	160.5	173.4	59	-101.5	3	108.6	N626 V837 F866 N867 E947	N626-R835 PolarHBondContact OD1-NH1 3.19Å; N626-R835 PolarHBondContact OD1-NH2 3.02Å; R835-V837 PolarHBondContact O-N 3.48Å; R835-F866 CarbonylContact O-C 3.58Å; R835-F866 WeakPolarHBondContact O-CA 3.45Å; R835-F866 WeakPolarHBondContact O-CB 3.32Å; R835-N867 HydrophobicContact CB-CB 4.44Å; R835-N867 PolarHBondContact N-OD1 2.92Å; R835-N867 PolarHBondContact O-N 3.22Å; R835-N867 PolarHBondContact O-OD1 3.26Å; R835-E947 IonicContact CZ-OE1 3.76Å; R835-E947 IonicContact NH2-OE1 3.65Å; R835-E947 PolarHBondContact NH2-OE1 3.23Å; R835-E947 IonicContact NH2-OE2 2.71Å
836	L	96.8	Very high	93.3	Very high	57 Å²	57	55 Å²	55	30%	0.298	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	128.6	167.1	-178.5	65.5	0	0	0	109	V818 F864 F866	V818-L836 HydrophobicContact CG2-CD2 4.31Å; L836-F864 HydrophobicContact CD1-CB 4.27Å; L836-F864 HydrophobicContact CD1-CD1 3.81Å; L836-F866 HydrophobicContact CB-CD1 4.12Å; L836-F866 HydrophobicContact CB-CE1 4.01Å; L836-F866 HydrophobicContact CD1-CD1 4.13Å; L836-F866 HydrophobicContact CD1-CE1 3.78Å; L836-F866 HydrophobicContact CD1-CZ 4.05Å; L836-F866 HydrophobicContact CG-CE1 4.49Å
837	V	96.7	Very high	93.4	Very high	48 Å²	48	47.9 Å²	47.9	29%	0.291	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-55.6	177.9	178.3	0	0	0	0	109.6	R835 L865 N867 E940	R835-V837 PolarHBondContact O-N 3.48Å; V837-L865 WeakPolarHBondContact CA-O 3.42Å; V837-L865 HydrophobicContact CB-CD2 4.19Å; V837-L865 HydrophobicContact CB-CG 4.1Å; V837-L865 WeakPolarHBondContact CB-O 3.46Å; V837-L865 HydrophobicContact CG1-CD2 4.02Å; V837-L865 HydrophobicContact CG1-CG 4.48Å; V837-L865 PolarHBondContact N-O 2.88Å; V837-N867 HydrophobicContact CG2-CB 4.3Å; V837-E940 HydrophobicContact CG1-CB 4.1Å
838	C	95.3	Very high	93.3	Very high	22 Å²	22	44.6 Å²	44.6	15%	0.149	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.2	175.1	69.4	0	0	0	0	113.1	L865	C838-L865 PolarHBondContact N-O 2.93Å; C838-L865 PolarHBondContact O-N 2.95Å
839	C	94.3	Very high	93	Very high	59 Å²	59	45.8 Å²	45.8	40%	0.399	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.4	165.5	-176	0	0	0	0	108.7	V863 F864	C839-V863 CarbonylContact C-O 3.52Å; C839-V863 WeakPolarHBondContact CA-O 3.29Å; C839-F864 HydrophobicContact CB-CD1 4.03Å; C839-F864 HydrophobicContact CB-CE1 4.01Å; C839-F864 HydrophobicContact CB-CG 4.41Å; C839-F864 HydrophobicContact CB-CZ 4.37Å; C839-F864 VanDerWaalsContact SG-CE2 3.51Å; C839-F864 WeakPolarHBondContact SG-CZ 3.43Å
840	C	93.6	Very high	92.6	Very high	30 Å²	30	51.6 Å²	51.6	20%	0.203	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142.4	-178.8	-67.8	0	0	0	0	110.8	V863 F937	C840-V863 PolarHBondContact N-O 2.89Å; C840-V863 PolarHBondContact O-N 3.33Å; C840-F937 HydrophobicContact CB-CD2 3.95Å; C840-F937 HydrophobicContact CB-CG 4.37Å
841	R	93.4	Very high	91.8	Very high	134 Å²	134	53.5 Å²	53.5	51%	0.506	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.4	176.1	-177	175.3	-65	152.9	10.4	109.5	Q860 E862	R841-Q860 HydrophobicContact CG-CG 3.77Å; R841-Q860 VanDerWaalsContact NE-NE2 3.15Å; R841-E862 IonicContact CZ-OE1 2.73Å; R841-E862 IonicContact NE-OE1 2.58Å; R841-E862 PolarHBondContact NE-OE1 3.22Å; R841-E862 IonicContact NE-OE2 2.78Å; R841-E862 PolarHBondContact NE-OE2 2.99Å; R841-E862 IonicContact NH2-OE1 2.7Å; R841-E862 PolarHBondContact NH2-OE1 3.46Å
842	L	93.7	Very high	90.7	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.2	-176.1	-65.7	177.4	0	0	0	110.5	R861 V863 F926 L934 F937	L842-R861 PolarHBondContact N-O 3.46Å; L842-R861 PolarHBondContact O-N 3.14Å; L842-R861 VanDerWaalsContact O-O 3.11Å; L842-V863 HydrophobicContact CB-CG2 4.25Å; L842-V863 HydrophobicContact CD1-CB 4.41Å; L842-V863 HydrophobicContact CD1-CG2 4.19Å; L842-F926 HydrophobicContact CB-CB 4.08Å; L842-F926 HydrophobicContact CB-CD1 3.7Å; L842-F926 HydrophobicContact CB-CE1 4.4Å; L842-F926 HydrophobicContact CB-CG 4.05Å; L842-F926 HydrophobicContact CD1-CB 4.11Å; L842-F926 HydrophobicContact CD1-CD1 4.44Å; L842-F926 HydrophobicContact CD1-CD2 4.36Å; L842-F926 HydrophobicContact CD1-CG 4.07Å; L842-L934 HydrophobicContact CD2-CD1 4.38Å; L842-F937 HydrophobicContact CD1-CD1 4.12Å; L842-F937 HydrophobicContact CD1-CE1 3.81Å; L842-F937 HydrophobicContact CD1-CZ 4.17Å
843	F	93	Very high	89.4	Confident	28 Å²	28	62.5 Å²	62.5	12%	0.123	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.5	176.2	-63.1	-85.6	0	0	0	109.2	V845 L856 L859 Q860 F926 C927 P929	F843-V845 PolarHBondContact O-N 2.95Å; F843-L856 HydrophobicContact CD1-CB 4.21Å; F843-L856 HydrophobicContact CD1-CD2 4.27Å; F843-L856 HydrophobicContact CD1-CG 4.01Å; F843-L856 WeakPolarHBondContact CD1-O 3.33Å; F843-L856 HydrophobicContact CE1-CB 4.04Å; F843-L856 HydrophobicContact CE1-CD2 4.08Å; F843-L856 HydrophobicContact CE1-CG 4.12Å; F843-L856 HydrophobicContact CZ-CD2 4.21Å; F843-L859 HydrophobicContact CB-CB 4.26Å; F843-L859 HydrophobicContact CD1-CB 4.35Å; F843-Q860 HydrophobicContact CD1-CB 4.07Å; F843-Q860 HydrophobicContact CE1-CB 3.83Å; F843-Q860 HydrophobicContact CE1-CG 4.17Å; F843-F926 CarbonylContact O-C 3.42Å; F843-F926 VanDerWaalsContact O-CA 3.23Å; F843-F926 WeakPolarHBondContact O-CA 3.41Å; F843-C927 PolarHBondContact N-O 3.1Å; F843-C927 PolarHBondContact O-N 2.75Å; F843-P929 HydrophobicContact CE2-CG 4.32Å
844	E	92.7	Very high	88.2	Confident	58 Å²	58	66 Å²	66	27%	0.271	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	126.3	-179.3	-175.9	175.9	-168.6	0	0	110.8	P846 L859 R861 V924 F926	E844-P846 WeakPolarHBondContact O-CD 3.34Å; E844-L859 PolarHBondContact N-O 2.66Å; E844-L859 WeakPolarHBondContact O-CD1 3.47Å; E844-L859 WeakPolarHBondContact O-CD2 3.4Å; E844-L859 WeakPolarHBondContact O-CG 3.45Å; E844-R861 HydrophobicContact CB-CG 4.06Å; E844-R861 IonicContact OE2-CZ 3.8Å; E844-R861 IonicContact OE2-NE 2.68Å; E844-R861 PolarHBondContact OE2-NE 2.88Å; E844-R861 IonicContact OE2-NH2 3.87Å; E844-R861 PolarHBondContact OE2-NH2 3.06Å; E844-V924 HydrophobicContact CG-CG2 4.38Å; E844-F926 HydrophobicContact CB-CD1 4.21Å; E844-F926 HydrophobicContact CB-CE1 4Å; E844-F926 HydrophobicContact CG-CE1 4.42Å
845	V	91.3	Very high	87.1	Confident	5 Å²	5	72.6 Å²	72.6	3%	0.03	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	106.8	-178	174	0	0	0	0	108.7	F843 D847 A848 Y906 S925 C927	F843-V845 PolarHBondContact O-N 2.95Å; V845-D847 VanDerWaalsContact C-N 3.29Å; V845-D847 WeakPolarHBondContact CG1-O 3.36Å; V845-D847 PolarHBondContact O-N 2.83Å; V845-A848 HydrophobicContact CG1-CB 4.4Å; V845-Y906 HydrophobicContact CG1-CD2 4.28Å; V845-Y906 HydrophobicContact CG1-CE1 4.33Å; V845-Y906 HydrophobicContact CG1-CE2 3.68Å; V845-Y906 HydrophobicContact CG2-CD1 4.12Å; V845-Y906 HydrophobicContact CG2-CE1 3.85Å; V845-S925 PolarHBondContact N-O 2.87Å; V845-C927 HydrophobicContact CG2-CB 3.92Å
846	P	86.5	Confident	86	Confident	102 Å²	102	75.7 Å²	75.7	66%	0.662	38%	0.383	S	S	*	.	S	Bend	trans	-70.7	-24.6	-176.2	-20.1	34.1	0	0	0	113.8	E844 L859	E844-P846 WeakPolarHBondContact O-CD 3.34Å; P846-L859 HydrophobicContact CG-CD2 4.18Å
847	D	84.5	Confident	84.9	Confident	56 Å²	56	77.3 Å²	77.3	30%	0.299	40%	0.398	S	S	.	.			trans	-151.2	112.6	178.2	-174.3	-24.6	0	0	0	107.9	V845 N849 K850	V845-D847 VanDerWaalsContact C-N 3.29Å; V845-D847 WeakPolarHBondContact CG1-O 3.36Å; V845-D847 PolarHBondContact O-N 2.83Å; D847-N849 PolarHBondContact O-N 2.85Å; D847-N849 PolarHBondContact OD1-N 2.64Å; D847-K850 HydrophobicContact CB-CB 4.4Å; D847-K850 PolarHBondContact O-N 3.07Å; D847-K850 WeakPolarHBondContact OD2-CD 3.48Å; D847-K850 IonicContact OD2-NZ 3.78Å; D847-K850 PolarHBondContact OD2-NZ 3.42Å
848	A	84.5	Confident	84.2	Confident	20 Å²	20	76.5 Å²	76.5	17%	0.165	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.2	-177.1	0	0	0	0	0	112.9	V845 F901 N903	V845-A848 HydrophobicContact CG1-CB 4.4Å; A848-F901 HydrophobicContact CB-CE1 4.49Å; A848-F901 HydrophobicContact CB-CE2 3.96Å; A848-F901 HydrophobicContact CB-CZ 3.87Å; A848-N903 PolarHBondContact O-ND2 3.1Å
849	N	85.5	Confident	83.7	Confident	130 Å²	130	75.8 Å²	75.8	70%	0.695	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	8	-173.8	-60.9	-35.1	0	0	0	113	D847	D847-N849 PolarHBondContact O-N 2.85Å; D847-N849 PolarHBondContact OD1-N 2.64Å
850	K	84.3	Confident	83.6	Confident	124 Å²	124	75 Å²	75	54%	0.539	38%	0.382	S	S	.	.	S	Bend	trans	-133.2	142.3	-179.7	-64.3	-171.5	-177.3	69.1	0	111.6	D847 Y906	D847-K850 HydrophobicContact CB-CB 4.4Å; D847-K850 PolarHBondContact O-N 3.07Å; D847-K850 WeakPolarHBondContact OD2-CD 3.48Å; D847-K850 IonicContact OD2-NZ 3.78Å; D847-K850 PolarHBondContact OD2-NZ 3.42Å; K850-Y906 WeakPolarHBondContact O-CE2 3.23Å; K850-Y906 PolarHBondContact O-OH 2.95Å; K850-Y906 VanDerWaalsContact O-OH 3.13Å
851	P	78.6	Confident	83.6	Confident	62 Å²	62	74.8 Å²	74.8	40%	0.403	38%	0.377	S	S	.	.			trans	-65.3	143.9	174.4	27	-33.1	0	0	0	110.8	K853 Y905	P851-K853 PolarHBondContact O-N 3.14Å; P851-Y905 HydrophobicContact CB-CD1 3.65Å; P851-Y905 HydrophobicContact CB-CE1 3.98Å; P851-Y905 HydrophobicContact CB-CG 3.99Å; P851-Y905 HydrophobicContact CG-CD1 4.22Å; P851-Y905 HydrophobicContact CG-CE1 4.04Å
852	H	72.8	Confident	83.7	Confident	51 Å²	51	69 Å²	69	24%	0.236	36%	0.356	C	S	.	.			trans	-71.7	125.6	-177	-173	58.3	0	0	0	112.7	Q854 L859	H852-Q854 PolarHBondContact CD2-O 3.45Å; H852-Q854 WeakPolarHBondContact CE1-CB 3.46Å; H852-Q854 PolarHBondContact CE1-N 2.84Å; H852-Q854 VanDerWaalsContact NE2-CA 3.28Å; H852-Q854 WeakPolarHBondContact NE2-CA 3.4Å; H852-Q854 WeakPolarHBondContact NE2-CB 3.23Å; H852-Q854 PolarHBondContact NE2-N 2.87Å; H852-Q854 PolarHBondContact NE2-O 2.86Å; H852-L859 WeakPolarHBondContact CE1-CD1 3.42Å; H852-L859 WeakPolarHBondContact CE1-CG 3.4Å; H852-L859 VanDerWaalsContact ND1-CD1 3.33Å; H852-L859 WeakPolarHBondContact ND1-CD1 3.48Å; H852-L859 VanDerWaalsContact NE2-CD1 3.34Å; H852-L859 WeakPolarHBondContact NE2-CD1 3.38Å; H852-L859 WeakPolarHBondContact NE2-CG 3.36Å
853	K	69.1	Low	83.8	Confident	201 Å²	201	68.8 Å²	68.8	87%	0.874	36%	0.355	S	S	*	.			trans	-103	-0.7	-177.7	-61.3	-170.6	178.7	-174.3	0	115.4	P851	P851-K853 PolarHBondContact O-N 3.14Å
854	Q	71.2	Confident	83.9	Confident	130 Å²	130	68.1 Å²	68.1	61%	0.607	35%	0.352	S	S	*	.	S	Bend	trans	-101.5	-175.9	177.7	-127.3	177.9	8.1	0	0	109.9	H852	H852-Q854 PolarHBondContact CD2-O 3.45Å; H852-Q854 WeakPolarHBondContact CE1-CB 3.46Å; H852-Q854 PolarHBondContact CE1-N 2.84Å; H852-Q854 VanDerWaalsContact NE2-CA 3.28Å; H852-Q854 WeakPolarHBondContact NE2-CA 3.4Å; H852-Q854 WeakPolarHBondContact NE2-CB 3.23Å; H852-Q854 PolarHBondContact NE2-N 2.87Å; H852-Q854 PolarHBondContact NE2-O 2.86Å
855	K	74.8	Confident	84.1	Confident	165 Å²	165	65.4 Å²	65.4	72%	0.717	34%	0.339	S	S	*	.			trans	-84.2	133.2	172.1	-63.1	-174.4	179	-175.5	0	109.4	S857 A858	K855-S857 PolarHBondContact O-N 3.28Å; K855-S857 VanDerWaalsContact O-N 3.08Å; K855-A858 VanDerWaalsContact O-CB 3.31Å; K855-A858 WeakPolarHBondContact O-CB 3.34Å; K855-A858 PolarHBondContact O-N 3.21Å
856	L	73.7	Confident	84.5	Confident	104 Å²	104	65.1 Å²	65.1	55%	0.545	34%	0.338	S	S	.	.	H	α-helix	trans	-48.7	-39.8	179.3	-110.6	73	0	0	0	113.3	F843 A858 L859 Q860	F843-L856 HydrophobicContact CD1-CB 4.21Å; F843-L856 HydrophobicContact CD1-CD2 4.27Å; F843-L856 HydrophobicContact CD1-CG 4.01Å; F843-L856 WeakPolarHBondContact CD1-O 3.33Å; F843-L856 HydrophobicContact CE1-CB 4.04Å; F843-L856 HydrophobicContact CE1-CD2 4.08Å; F843-L856 HydrophobicContact CE1-CG 4.12Å; F843-L856 HydrophobicContact CZ-CD2 4.21Å; L856-A858 PolarHBondContact O-N 2.81Å; L856-A858 VanDerWaalsContact O-N 3.14Å; L856-L859 WeakPolarHBondContact O-CB 3.28Å; L856-L859 PolarHBondContact O-N 3.02Å; L856-Q860 PolarHBondContact O-N 3.06Å; L856-Q860 VanDerWaalsContact O-N 3.08Å
857	S	74.4	Confident	85	Confident	90 Å²	90	60.4 Å²	60.4	63%	0.629	31%	0.307	S	S	*	.	H	α-helix	trans	-63.3	-16.1	178.1	53.8	0	0	0	0	114.8	K855	K855-S857 PolarHBondContact O-N 3.28Å; K855-S857 VanDerWaalsContact O-N 3.08Å
858	A	80.8	Confident	85.5	Confident	32 Å²	32	59.6 Å²	59.6	26%	0.264	30%	0.302	S	S	.	.	H	α-helix	trans	-81.6	-28.8	170.6	0	0	0	0	0	112.6	K855 L856 R861	K855-A858 VanDerWaalsContact O-CB 3.31Å; K855-A858 WeakPolarHBondContact O-CB 3.34Å; K855-A858 PolarHBondContact O-N 3.21Å; L856-A858 PolarHBondContact O-N 2.81Å; L856-A858 VanDerWaalsContact O-N 3.14Å; A858-R861 PolarHBondContact O-NH1 3.21Å; A858-R861 PolarHBondContact O-NH2 3.19Å
859	L	86.1	Confident	86	Confident	7 Å²	7	60 Å²	60	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-84.2	-21.5	176.5	-67.3	-172.2	0	0	0	114.2	F843 E844 P846 H852 L856 R861	F843-L859 HydrophobicContact CB-CB 4.26Å; F843-L859 HydrophobicContact CD1-CB 4.35Å; E844-L859 PolarHBondContact N-O 2.66Å; E844-L859 WeakPolarHBondContact O-CD1 3.47Å; E844-L859 WeakPolarHBondContact O-CD2 3.4Å; E844-L859 WeakPolarHBondContact O-CG 3.45Å; P846-L859 HydrophobicContact CG-CD2 4.18Å; H852-L859 WeakPolarHBondContact CE1-CD1 3.42Å; H852-L859 WeakPolarHBondContact CE1-CG 3.4Å; H852-L859 VanDerWaalsContact ND1-CD1 3.33Å; H852-L859 WeakPolarHBondContact ND1-CD1 3.48Å; H852-L859 VanDerWaalsContact NE2-CD1 3.34Å; H852-L859 WeakPolarHBondContact NE2-CD1 3.38Å; H852-L859 WeakPolarHBondContact NE2-CG 3.36Å; L856-L859 WeakPolarHBondContact O-CB 3.28Å; L856-L859 PolarHBondContact O-N 3.02Å; L859-R861 VanDerWaalsContact C-NH1 3.31Å; L859-R861 PolarHBondContact O-N 3.07Å; L859-R861 PolarHBondContact O-NH1 3.39Å
860	Q	91.3	Very high	86.5	Confident	43 Å²	43	53.8 Å²	53.8	20%	0.201	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	127.6	-178.1	-170.8	-171.2	-42.3	0	0	111	R841 F843 L856 E862	R841-Q860 HydrophobicContact CG-CG 3.77Å; R841-Q860 VanDerWaalsContact NE-NE2 3.15Å; F843-Q860 HydrophobicContact CD1-CB 4.07Å; F843-Q860 HydrophobicContact CE1-CB 3.83Å; F843-Q860 HydrophobicContact CE1-CG 4.17Å; L856-Q860 PolarHBondContact O-N 3.06Å; L856-Q860 VanDerWaalsContact O-N 3.08Å; Q860-E862 PolarHBondContact NE2-OE2 3.43Å; Q860-E862 VanDerWaalsContact NE2-OE2 3.07Å
861	R	93.9	Very high	87	Confident	24 Å²	24	47.9 Å²	47.9	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.2	168.9	-56	-59.8	169.3	-101.8	-8.1	108.9	L842 E844 A858 L859 V863 I872 L873 F926	L842-R861 PolarHBondContact N-O 3.46Å; L842-R861 PolarHBondContact O-N 3.14Å; L842-R861 VanDerWaalsContact O-O 3.11Å; E844-R861 HydrophobicContact CB-CG 4.06Å; E844-R861 IonicContact OE2-CZ 3.8Å; E844-R861 IonicContact OE2-NE 2.68Å; E844-R861 PolarHBondContact OE2-NE 2.88Å; E844-R861 IonicContact OE2-NH2 3.87Å; E844-R861 PolarHBondContact OE2-NH2 3.06Å; A858-R861 PolarHBondContact O-NH1 3.21Å; A858-R861 PolarHBondContact O-NH2 3.19Å; L859-R861 VanDerWaalsContact C-NH1 3.31Å; L859-R861 PolarHBondContact O-N 3.07Å; L859-R861 PolarHBondContact O-NH1 3.39Å; R861-V863 HydrophobicContact CB-CG2 4.03Å; R861-I872 HydrophobicContact CB-CG2 4Å; R861-I872 HydrophobicContact CG-CG2 3.82Å; R861-L873 CarbonylContact C-O 3.59Å; R861-L873 WeakPolarHBondContact CA-O 3.32Å; R861-L873 WeakPolarHBondContact CB-O 3.45Å; R861-L873 WeakPolarHBondContact CD-O 3.43Å; R861-F926 HydrophobicContact CB-CE1 4.19Å; R861-F926 HydrophobicContact CG-CE1 3.99Å
862	E	94.4	Very high	87.8	Confident	13 Å²	13	45 Å²	45	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121	161.7	-122.5	76.2	175.1	0	0	106.2	R841 Q860 F864 L873 Y885	R841-E862 IonicContact CZ-OE1 2.73Å; R841-E862 IonicContact NE-OE1 2.58Å; R841-E862 PolarHBondContact NE-OE1 3.22Å; R841-E862 IonicContact NE-OE2 2.78Å; R841-E862 PolarHBondContact NE-OE2 2.99Å; R841-E862 IonicContact NH2-OE1 2.7Å; R841-E862 PolarHBondContact NH2-OE1 3.46Å; Q860-E862 PolarHBondContact NE2-OE2 3.43Å; Q860-E862 VanDerWaalsContact NE2-OE2 3.07Å; E862-F864 HydrophobicContact CB-CE2 4.11Å; E862-F864 HydrophobicContact CG-CE2 4.38Å; E862-L873 PolarHBondContact N-O 2.96Å; E862-L873 WeakPolarHBondContact O-CB 3.42Å; E862-L873 PolarHBondContact O-N 3.31Å; E862-Y885 HydrophobicContact CB-CD1 4.14Å; E862-Y885 HydrophobicContact CB-CE1 3.69Å; E862-Y885 HydrophobicContact CG-CE1 3.87Å
863	V	95.4	Very high	88.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	114.5	-172.5	-179.5	0	0	0	0	108.2	C839 C840 L842 R861 L870 L871 I872 F926 F937	C839-V863 CarbonylContact C-O 3.52Å; C839-V863 WeakPolarHBondContact CA-O 3.29Å; C840-V863 PolarHBondContact N-O 2.89Å; C840-V863 PolarHBondContact O-N 3.33Å; L842-V863 HydrophobicContact CB-CG2 4.25Å; L842-V863 HydrophobicContact CD1-CB 4.41Å; L842-V863 HydrophobicContact CD1-CG2 4.19Å; R861-V863 HydrophobicContact CB-CG2 4.03Å; V863-L870 HydrophobicContact CG1-CD1 3.7Å; V863-L870 HydrophobicContact CG1-CD2 4.13Å; V863-L870 HydrophobicContact CG1-CG 3.93Å; V863-L871 CarbonylContact C-O 3.5Å; V863-L871 WeakPolarHBondContact CA-O 3.39Å; V863-I872 HydrophobicContact CG1-CG1 4.41Å; V863-I872 HydrophobicContact CG2-CG1 4.38Å; V863-F926 HydrophobicContact CG2-CE1 4.1Å; V863-F926 HydrophobicContact CG2-CZ 4.06Å; V863-F937 HydrophobicContact CG1-CE2 4.27Å; V863-F937 HydrophobicContact CG1-CZ 4.13Å
864	F	96.5	Very high	89.9	Confident	14 Å²	14	37.3 Å²	37.3	6%	0.061	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.6	178.4	-71.7	-108.4	0	0	0	108.4	V818 L836 C839 E862 F866 L871 L873 Y885	V818-F864 HydrophobicContact CG1-CD1 3.86Å; V818-F864 HydrophobicContact CG1-CE1 3.85Å; V818-F864 HydrophobicContact CG1-CG 4.44Å; V818-F864 HydrophobicContact CG1-CZ 4.42Å; V818-F864 HydrophobicContact CG2-CD1 4.19Å; V818-F864 HydrophobicContact CG2-CE1 3.86Å; L836-F864 HydrophobicContact CD1-CB 4.27Å; L836-F864 HydrophobicContact CD1-CD1 3.81Å; C839-F864 HydrophobicContact CB-CD1 4.03Å; C839-F864 HydrophobicContact CB-CE1 4.01Å; C839-F864 HydrophobicContact CB-CG 4.41Å; C839-F864 HydrophobicContact CB-CZ 4.37Å; C839-F864 VanDerWaalsContact SG-CE2 3.51Å; C839-F864 WeakPolarHBondContact SG-CZ 3.43Å; E862-F864 HydrophobicContact CB-CE2 4.11Å; E862-F864 HydrophobicContact CG-CE2 4.38Å; F864-F866 HydrophobicContact CB-CE2 3.84Å; F864-F866 HydrophobicContact CB-CZ 4.19Å; F864-L871 HydrophobicContact CB-CB 4.3Å; F864-L871 PolarHBondContact N-O 3.1Å; F864-L871 PolarHBondContact O-N 3.45Å; F864-L873 HydrophobicContact CD2-CD1 3.64Å; F864-L873 HydrophobicContact CD2-CG 4.42Å; F864-L873 HydrophobicContact CE2-CD1 3.69Å; F864-Y885 HydrophobicContact CE2-CE1 4.43Å; F864-Y885 HydrophobicContact CZ-CE2 4.35Å
865	L	97.5	Very high	90.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119	171.8	177.5	66.5	0	0	0	108.6	V837 C838 L870 L893 F937 E940 L941 A944	V837-L865 WeakPolarHBondContact CA-O 3.42Å; V837-L865 HydrophobicContact CB-CD2 4.19Å; V837-L865 HydrophobicContact CB-CG 4.1Å; V837-L865 WeakPolarHBondContact CB-O 3.46Å; V837-L865 HydrophobicContact CG1-CD2 4.02Å; V837-L865 HydrophobicContact CG1-CG 4.48Å; V837-L865 PolarHBondContact N-O 2.88Å; C838-L865 PolarHBondContact N-O 2.93Å; C838-L865 PolarHBondContact O-N 2.95Å; L865-L870 HydrophobicContact CB-CD1 4.01Å; L865-L870 HydrophobicContact CD1-CD1 3.73Å; L865-L870 HydrophobicContact CG-CD1 4.48Å; L865-L893 HydrophobicContact CD1-CD1 3.81Å; L865-L893 HydrophobicContact CD1-CD2 4.24Å; L865-F937 HydrophobicContact CB-CE2 4.43Å; L865-E940 HydrophobicContact CD2-CB 3.83Å; L865-L941 HydrophobicContact CD1-CD1 3.82Å; L865-L941 HydrophobicContact CD2-CB 4.33Å; L865-A944 HydrophobicContact CD1-CB 4.31Å; L865-A944 HydrophobicContact CD2-CB 4.37Å
866	F	98.1	Very high	91.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	169.3	164.1	-57	-88.2	0	0	0	109.5	V815 V818 L829 R834 R835 L836 F864 D868 L869 L871 L893	V815-F866 HydrophobicContact CB-CE1 4.44Å; V815-F866 HydrophobicContact CG1-CD1 4.48Å; V815-F866 HydrophobicContact CG1-CE1 3.89Å; V815-F866 HydrophobicContact CG2-CD1 4.19Å; V815-F866 HydrophobicContact CG2-CE1 3.96Å; V818-F866 HydrophobicContact CG1-CZ 4.2Å; L829-F866 HydrophobicContact CD1-CE2 4.14Å; L829-F866 HydrophobicContact CD1-CZ 4.34Å; L829-F866 HydrophobicContact CD2-CE1 4.44Å; L829-F866 HydrophobicContact CD2-CE2 4.19Å; L829-F866 HydrophobicContact CD2-CZ 3.74Å; L829-F866 HydrophobicContact CG-CZ 4.23Å; R834-F866 HydrophobicContact CG-CB 3.77Å; R834-F866 HydrophobicContact CG-CD1 3.69Å; R834-F866 HydrophobicContact CG-CG 3.87Å; R835-F866 CarbonylContact O-C 3.58Å; R835-F866 WeakPolarHBondContact O-CA 3.45Å; R835-F866 WeakPolarHBondContact O-CB 3.32Å; L836-F866 HydrophobicContact CB-CD1 4.12Å; L836-F866 HydrophobicContact CB-CE1 4.01Å; L836-F866 HydrophobicContact CD1-CD1 4.13Å; L836-F866 HydrophobicContact CD1-CE1 3.78Å; L836-F866 HydrophobicContact CD1-CZ 4.05Å; L836-F866 HydrophobicContact CG-CE1 4.49Å; F864-F866 HydrophobicContact CB-CE2 3.84Å; F864-F866 HydrophobicContact CB-CZ 4.19Å; F866-D868 PolarHBondContact O-N 3.11Å; F866-L869 HydrophobicContact CB-CB 4.31Å; F866-L869 WeakPolarHBondContact CB-O 3.38Å; F866-L869 HydrophobicContact CD2-CB 4.46Å; F866-L869 PolarHBondContact N-O 3Å; F866-L871 HydrophobicContact CD2-CB 4.37Å; F866-L871 HydrophobicContact CE2-CB 3.9Å; F866-L871 HydrophobicContact CE2-CD2 3.84Å; F866-L871 HydrophobicContact CZ-CD2 4.41Å; F866-L893 WeakPolarHBondContact O-CD1 3.37Å
867	N	96.9	Very high	91	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	17%	0.166	C	C	.	.	S	Bend	trans	-60.9	-28	177.3	59	-36.2	0	0	0	113.6	N626 H833 R834 R835 V837 E947 V948	N626-N867 PolarHBondContact ND2-ND2 2.86Å; N626-N867 PolarHBondContact OD1-ND2 3.01Å; H833-N867 PolarHBondContact O-ND2 2.89Å; R834-N867 WeakPolarHBondContact CA-OD1 3.38Å; R835-N867 HydrophobicContact CB-CB 4.44Å; R835-N867 PolarHBondContact N-OD1 2.92Å; R835-N867 PolarHBondContact O-N 3.22Å; R835-N867 PolarHBondContact O-OD1 3.26Å; V837-N867 HydrophobicContact CG2-CB 4.3Å; N867-E947 WeakPolarHBondContact CB-OE1 3.19Å; N867-V948 WeakPolarHBondContact O-CG2 3.43Å
868	D	96.1	Very high	90.3	Very high	38 Å²	38	34 Å²	34	20%	0.203	18%	0.177	C	C	.	.	S	Bend	trans	-113.1	-18.1	-178.5	73.2	-46.6	0	0	0	114.9	R834 F866 L893 V948	R834-D868 WeakPolarHBondContact CD-OD1 3.42Å; R834-D868 WeakPolarHBondContact CG-OD1 3.39Å; R834-D868 IonicContact CZ-OD1 3.49Å; R834-D868 IonicContact CZ-OD2 3.05Å; R834-D868 VanDerWaalsContact CZ-OD2 3.32Å; R834-D868 IonicContact NE-OD1 3.54Å; R834-D868 PolarHBondContact NE-OD1 3.43Å; R834-D868 IonicContact NE-OD2 3.67Å; R834-D868 PolarHBondContact NE-OD2 2.79Å; R834-D868 VanDerWaalsContact NE-OD2 3.13Å; R834-D868 IonicContact NH2-OD1 3.72Å; R834-D868 IonicContact NH2-OD2 2.72Å; R834-D868 PolarHBondContact NH2-OD2 3.39Å; F866-D868 PolarHBondContact O-N 3.11Å; D868-L893 WeakPolarHBondContact O-CG 3.43Å; D868-L893 PolarHBondContact O-N 3.38Å; D868-V948 HydrophobicContact CB-CG2 4.49Å
869	L	95.4	Very high	89.2	Confident	28 Å²	28	38.8 Å²	38.8	15%	0.147	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	133.4	-162	-171.4	74.5	0	0	0	112	L829 F866 A890	L829-L869 HydrophobicContact CD1-CD2 3.78Å; F866-L869 HydrophobicContact CB-CB 4.31Å; F866-L869 WeakPolarHBondContact CB-O 3.38Å; F866-L869 HydrophobicContact CD2-CB 4.46Å; F866-L869 PolarHBondContact N-O 3Å; L869-A890 HydrophobicContact CD1-CB 4.32Å
870	L	95.5	Very high	87.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.1	164.2	-164.7	80.1	0	0	0	110.4	V863 L865 I872 A890 M891 L893 M912 F937	V863-L870 HydrophobicContact CG1-CD1 3.7Å; V863-L870 HydrophobicContact CG1-CD2 4.13Å; V863-L870 HydrophobicContact CG1-CG 3.93Å; L865-L870 HydrophobicContact CB-CD1 4.01Å; L865-L870 HydrophobicContact CD1-CD1 3.73Å; L865-L870 HydrophobicContact CG-CD1 4.48Å; L870-I872 HydrophobicContact CD2-CD1 4.48Å; L870-I872 HydrophobicContact CD2-CG1 4.46Å; L870-A890 CarbonylContact O-C 3.49Å; L870-A890 WeakPolarHBondContact O-CA 3.39Å; L870-M891 HydrophobicContact CD2-CE 3.73Å; L870-M891 PolarHBondContact N-O 2.95Å; L870-M891 PolarHBondContact O-N 3.38Å; L870-L893 HydrophobicContact CB-CD2 4.12Å; L870-M912 HydrophobicContact CD2-CE 3.86Å; L870-M912 HydrophobicContact CD2-SD 3.37Å; L870-M912 WeakPolarHBondContact CD2-SD 3.49Å; L870-F937 HydrophobicContact CD1-CE2 4.18Å; L870-F937 HydrophobicContact CD1-CZ 3.98Å
871	L	95.1	Very high	86.4	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.2	-177.6	-175.9	64.5	0	0	0	110.5	I822 L829 V863 F864 F866 L873 F887 A890	I822-L871 HydrophobicContact CD1-CD2 3.75Å; L829-L871 HydrophobicContact CD1-CD2 4.21Å; L829-L871 HydrophobicContact CD2-CD2 3.86Å; V863-L871 CarbonylContact C-O 3.5Å; V863-L871 WeakPolarHBondContact CA-O 3.39Å; F864-L871 HydrophobicContact CB-CB 4.3Å; F864-L871 PolarHBondContact N-O 3.1Å; F864-L871 PolarHBondContact O-N 3.45Å; F866-L871 HydrophobicContact CD2-CB 4.37Å; F866-L871 HydrophobicContact CE2-CB 3.9Å; F866-L871 HydrophobicContact CE2-CD2 3.84Å; F866-L871 HydrophobicContact CZ-CD2 4.41Å; L871-L873 HydrophobicContact CD1-CD2 4.17Å; L871-L873 HydrophobicContact CD2-CD1 4.36Å; L871-L873 HydrophobicContact CD2-CD2 4.23Å; L871-L873 HydrophobicContact CD2-CG 4.46Å; L871-L873 HydrophobicContact CG-CD2 3.9Å; L871-L873 HydrophobicContact CG-CG 4.12Å; L871-F887 HydrophobicContact CD1-CD2 3.85Å; L871-F887 HydrophobicContact CD1-CE2 3.59Å; L871-A890 HydrophobicContact CD1-CB 4.06Å
872	I	94.1	Very high	85.2	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.7	-174.9	-60.1	158.3	0	0	0	108.3	R861 V863 L870 C888 K889 M891 V924 F926	R861-I872 HydrophobicContact CB-CG2 4Å; R861-I872 HydrophobicContact CG-CG2 3.82Å; V863-I872 HydrophobicContact CG1-CG1 4.41Å; V863-I872 HydrophobicContact CG2-CG1 4.38Å; L870-I872 HydrophobicContact CD2-CD1 4.48Å; L870-I872 HydrophobicContact CD2-CG1 4.46Å; I872-C888 HydrophobicContact CG2-CB 4.48Å; I872-C888 WeakPolarHBondContact O-CB 3.39Å; I872-C888 PolarHBondContact O-N 3.45Å; I872-C888 VanDerWaalsContact O-N 3.11Å; I872-K889 HydrophobicContact CB-CB 4.19Å; I872-K889 HydrophobicContact CD1-CB 4.13Å; I872-K889 HydrophobicContact CD1-CD 4.07Å; I872-K889 HydrophobicContact CD1-CG 4.39Å; I872-K889 PolarHBondContact N-O 2.84Å; I872-K889 PolarHBondContact O-N 3.36Å; I872-K889 VanDerWaalsContact O-N 3.09Å; I872-M891 HydrophobicContact CD1-CE 4.21Å; I872-V924 HydrophobicContact CD1-CG1 4.2Å; I872-F926 HydrophobicContact CD1-CE2 4.09Å; I872-F926 HydrophobicContact CD1-CZ 3.77Å; I872-F926 HydrophobicContact CG1-CE2 4.48Å; I872-F926 HydrophobicContact CG1-CZ 3.92Å; I872-F926 HydrophobicContact CG2-CE1 4.44Å; I872-F926 HydrophobicContact CG2-CZ 4.02Å
873	L	93.9	Very high	84.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	163.6	-172.6	-55.4	177.5	0	0	0	111.8	I822 R861 E862 F864 L871 Y885 F887	I822-L873 HydrophobicContact CD1-CD1 3.82Å; I822-L873 HydrophobicContact CD1-CD2 4.14Å; I822-L873 HydrophobicContact CG1-CD1 3.8Å; I822-L873 HydrophobicContact CG1-CD2 4.21Å; I822-L873 HydrophobicContact CG2-CD2 3.98Å; R861-L873 CarbonylContact C-O 3.59Å; R861-L873 WeakPolarHBondContact CA-O 3.32Å; R861-L873 WeakPolarHBondContact CB-O 3.45Å; R861-L873 WeakPolarHBondContact CD-O 3.43Å; E862-L873 PolarHBondContact N-O 2.96Å; E862-L873 WeakPolarHBondContact O-CB 3.42Å; E862-L873 PolarHBondContact O-N 3.31Å; F864-L873 HydrophobicContact CD2-CD1 3.64Å; F864-L873 HydrophobicContact CD2-CG 4.42Å; F864-L873 HydrophobicContact CE2-CD1 3.69Å; L871-L873 HydrophobicContact CD1-CD2 4.17Å; L871-L873 HydrophobicContact CD2-CD1 4.36Å; L871-L873 HydrophobicContact CD2-CD2 4.23Å; L871-L873 HydrophobicContact CD2-CG 4.46Å; L871-L873 HydrophobicContact CG-CD2 3.9Å; L871-L873 HydrophobicContact CG-CG 4.12Å; L873-Y885 HydrophobicContact CB-CD1 4.24Å; L873-Y885 HydrophobicContact CB-CG 4.42Å; L873-Y885 HydrophobicContact CD1-CD1 4.4Å; L873-Y885 HydrophobicContact CD1-CG 4.05Å; L873-F887 HydrophobicContact CD2-CD2 4.32Å
874	K	92.2	Very high	83.9	Confident	90 Å²	90	57.6 Å²	57.6	39%	0.391	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128	173.5	-179.9	173.7	179.8	172.4	0	110.7	Y885 T886 C888	K874-Y885 CarbonylContact O-C 3.6Å; K874-Y885 WeakPolarHBondContact O-CA 3.46Å; K874-T886 PolarHBondContact N-O 2.76Å; K874-T886 PolarHBondContact O-N 3.47Å; K874-C888 VanDerWaalsContact CB-SG 3.58Å
875	L	88.8	Confident	83.7	Confident	68 Å²	68	58.4 Å²	58.4	36%	0.356	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	134.6	-179.1	-176.2	65.4	0	0	0	112.3	A883 Y885	L875-A883 HydrophobicContact CD1-CB 4.14Å; L875-Y885 HydrophobicContact CB-CD1 4.45Å; L875-Y885 HydrophobicContact CB-CE1 4.48Å; L875-Y885 HydrophobicContact CD1-CD1 4.13Å; L875-Y885 HydrophobicContact CD1-CE1 3.79Å
876	C	84.1	Confident	83.4	Confident	26 Å²	26	61.5 Å²	61.5	18%	0.176	33%	0.33	C	S	.	.			trans	-87.3	118.3	177.4	-65.4	0	0	0	0	111.3	K878 S884 T886	C876-K878 PolarHBondContact O-N 3.07Å; C876-S884 WeakPolarHBondContact CB-O 3.46Å; C876-S884 PolarHBondContact N-O 3.28Å; C876-S884 PolarHBondContact SG-O 3.48Å; C876-T886 PolarHBondContact SG-OG1 2.88Å
877	P	70.5	Confident	83.2	Confident	128 Å²	128	64.6 Å²	64.6	83%	0.831	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	27.2	-170.1	34.4	-38.4	0	0	0	114.8
878	K	59	Low	82.9	Confident	197 Å²	197	67.1 Å²	67.1	86%	0.857	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.4	22.2	-162.4	-79.7	-160.8	173.8	-171.1	0	117.9	C876	C876-K878 PolarHBondContact O-N 3.07Å
879	K	58	Low	82.6	Confident	132 Å²	132	67.5 Å²	67.5	57%	0.574	36%	0.36	S	S	*	.			trans	-126	135.7	168.9	-70.9	-168.9	179.5	-175.7	0	111.2	S882	K879-S882 WeakPolarHBondContact CB-O 3.35Å
880	K	58.3	Low	82.5	Confident	229 Å²	229	67.9 Å²	67.9	100%	0.996	37%	0.368	S	S	*	.	S	Bend	trans	-86.7	-1.2	-175	-78.3	-170.2	174	-174.1	0	115.1
881	S	61.3	Low	82.3	Confident	123 Å²	123	68.2 Å²	68.2	86%	0.86	37%	0.369	S	S	*	.	S	Bend	trans	-136.5	-36.1	-169.5	157	0	0	0	0	113.6
882	S	67.6	Low	82.2	Confident	66 Å²	66	69.9 Å²	69.9	46%	0.462	39%	0.387	S	S	.	.	S	Bend	trans	-131.3	137	177.1	53.7	0	0	0	0	112.3	K879 S884	K879-S882 WeakPolarHBondContact CB-O 3.35Å; S882-S884 PolarHBondContact O-N 3.48Å
883	A	75.9	Confident	82.3	Confident	58 Å²	58	69.9 Å²	69.9	48%	0.479	39%	0.387	S	S	.	.			trans	-64.1	128.3	167.7	0	0	0	0	0	108.7	L875 Y885	L875-A883 HydrophobicContact CD1-CB 4.14Å; A883-Y885 HydrophobicContact CB-CE2 4.28Å
884	S	87.1	Confident	82.3	Confident	7 Å²	7	72 Å²	72	5%	0.049	40%	0.399	C	S	.	.			trans	-126.8	148	172.5	46.7	0	0	0	0	108.8	S821 C876 S882	S821-S884 WeakPolarHBondContact O-CA 3.45Å; C876-S884 WeakPolarHBondContact CB-O 3.46Å; C876-S884 PolarHBondContact N-O 3.28Å; C876-S884 PolarHBondContact SG-O 3.48Å; S882-S884 PolarHBondContact O-N 3.48Å
885	Y	92	Very high	82.2	Confident	31 Å²	31	69 Å²	69	12%	0.122	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151	-172	-59.6	-85.9	0	0	0	110.6	S821 L823 E862 F864 L873 K874 L875 A883	S821-Y885 PolarHBondContact O-N 3.22Å; S821-Y885 WeakPolarHBondContact OG-CD2 3.33Å; L823-Y885 WeakPolarHBondContact CB-O 3.44Å; L823-Y885 PolarHBondContact N-O 2.96Å; E862-Y885 HydrophobicContact CB-CD1 4.14Å; E862-Y885 HydrophobicContact CB-CE1 3.69Å; E862-Y885 HydrophobicContact CG-CE1 3.87Å; F864-Y885 HydrophobicContact CE2-CE1 4.43Å; F864-Y885 HydrophobicContact CZ-CE2 4.35Å; L873-Y885 HydrophobicContact CB-CD1 4.24Å; L873-Y885 HydrophobicContact CB-CG 4.42Å; L873-Y885 HydrophobicContact CD1-CD1 4.4Å; L873-Y885 HydrophobicContact CD1-CG 4.05Å; K874-Y885 CarbonylContact O-C 3.6Å; K874-Y885 WeakPolarHBondContact O-CA 3.46Å; L875-Y885 HydrophobicContact CB-CD1 4.45Å; L875-Y885 HydrophobicContact CB-CE1 4.48Å; L875-Y885 HydrophobicContact CD1-CD1 4.13Å; L875-Y885 HydrophobicContact CD1-CE1 3.79Å; A883-Y885 HydrophobicContact CB-CE2 4.28Å
886	T	91.8	Very high	82.4	Confident	64 Å²	64	66 Å²	66	39%	0.393	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.6	166.2	-55.5	0	0	0	0	108.9	K874 C876 C888	K874-T886 PolarHBondContact N-O 2.76Å; K874-T886 PolarHBondContact O-N 3.47Å; C876-T886 PolarHBondContact SG-OG1 2.88Å; T886-C888 PolarHBondContact O-N 2.92Å; T886-C888 PolarHBondContact O-SG 3.36Å
887	F	93.4	Very high	82.8	Confident	66 Å²	66	70.4 Å²	70.4	29%	0.289	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	132.7	171.6	178	-99	0	0	0	111.5	I822 L823 L825 L871 L873 A890	I822-F887 HydrophobicContact CG2-CB 3.97Å; L823-F887 PolarHBondContact O-N 2.97Å; L823-F887 VanDerWaalsContact O-N 3.07Å; L825-F887 HydrophobicContact CD1-CD2 3.5Å; L825-F887 HydrophobicContact CD1-CE2 3.7Å; L825-F887 HydrophobicContact CD1-CG 4.23Å; L871-F887 HydrophobicContact CD1-CD2 3.85Å; L871-F887 HydrophobicContact CD1-CE2 3.59Å; L873-F887 HydrophobicContact CD2-CD2 4.32Å; F887-A890 HydrophobicContact CE2-CB 4.03Å; F887-A890 HydrophobicContact CZ-CB 4.13Å
888	C	91.1	Very high	84	Confident	56 Å²	56	66 Å²	66	38%	0.378	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	-52	176.6	-63.1	0	0	0	0	112.6	I872 K874 T886	I872-C888 HydrophobicContact CG2-CB 4.48Å; I872-C888 WeakPolarHBondContact O-CB 3.39Å; I872-C888 PolarHBondContact O-N 3.45Å; I872-C888 VanDerWaalsContact O-N 3.11Å; K874-C888 VanDerWaalsContact CB-SG 3.58Å; T886-C888 PolarHBondContact O-N 2.92Å; T886-C888 PolarHBondContact O-SG 3.36Å
889	K	90.4	Very high	85.6	Confident	45 Å²	45	61.6 Å²	61.6	20%	0.196	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	149.6	-178.2	-170.2	-177.5	-176.4	-165.6	0	110.5	I872 M891 L923	I872-K889 HydrophobicContact CB-CB 4.19Å; I872-K889 HydrophobicContact CD1-CB 4.13Å; I872-K889 HydrophobicContact CD1-CD 4.07Å; I872-K889 HydrophobicContact CD1-CG 4.39Å; I872-K889 PolarHBondContact N-O 2.84Å; I872-K889 PolarHBondContact O-N 3.36Å; I872-K889 VanDerWaalsContact O-N 3.09Å; K889-M891 HydrophobicContact CD-CG 4.22Å; K889-M891 HydrophobicContact CD-SD 4.22Å; K889-M891 VanDerWaalsContact CE-SD 3.54Å; K889-M891 HydrophobicContact CG-CG 4.28Å; K889-M891 PolarHBondContact NZ-SD 3.46Å; K889-L923 PolarHBondContact NZ-O 3.07Å; K889-L923 VanDerWaalsContact NZ-O 3.1Å
890	A	92.1	Very high	87.4	Confident	37 Å²	37	59.8 Å²	59.8	31%	0.306	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.7	165.8	0	0	0	0	0	109.5	L869 L870 L871 F887	L869-A890 HydrophobicContact CD1-CB 4.32Å; L870-A890 CarbonylContact O-C 3.49Å; L870-A890 WeakPolarHBondContact O-CA 3.39Å; L871-A890 HydrophobicContact CD1-CB 4.06Å; F887-A890 HydrophobicContact CE2-CB 4.03Å; F887-A890 HydrophobicContact CZ-CB 4.13Å
891	M	92.2	Very high	89.1	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	123	178.6	-56.7	-168.5	-57.7	0	0	109.9	L870 I872 K889 M896 M912 V924	L870-M891 HydrophobicContact CD2-CE 3.73Å; L870-M891 PolarHBondContact N-O 2.95Å; L870-M891 PolarHBondContact O-N 3.38Å; I872-M891 HydrophobicContact CD1-CE 4.21Å; K889-M891 HydrophobicContact CD-CG 4.22Å; K889-M891 HydrophobicContact CD-SD 4.22Å; K889-M891 VanDerWaalsContact CE-SD 3.54Å; K889-M891 HydrophobicContact CG-CG 4.28Å; K889-M891 PolarHBondContact NZ-SD 3.46Å; M891-M896 HydrophobicContact CB-CE 3.64Å; M891-M896 HydrophobicContact CE-CE 3.86Å; M891-M912 HydrophobicContact CE-CB 4.02Å; M891-M912 HydrophobicContact CE-SD 3.82Å; M891-V924 HydrophobicContact CE-CG1 3.43Å; M891-V924 VanDerWaalsContact CE-CG1 3.43Å; M891-V924 HydrophobicContact SD-CG1 3.85Å
892	G	93	Very high	90.6	Very high	37 Å²	37	49.5 Å²	49.5	38%	0.381	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	144.1	172.7	0	0	0	0	0	111.6	M896	G892-M896 WeakPolarHBondContact O-CE 3.33Å
893	L	95.2	Very high	91.7	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	28%	0.283	C	S	.	.			trans	-82.6	-17.3	-174.6	-62.9	-178.9	0	0	0	114.4	L865 F866 D868 L870 G895 M896 L941 A944 I945 V948	L865-L893 HydrophobicContact CD1-CD1 3.81Å; L865-L893 HydrophobicContact CD1-CD2 4.24Å; F866-L893 WeakPolarHBondContact O-CD1 3.37Å; D868-L893 WeakPolarHBondContact O-CG 3.43Å; D868-L893 PolarHBondContact O-N 3.38Å; L870-L893 HydrophobicContact CB-CD2 4.12Å; L893-G895 PolarHBondContact O-N 2.94Å; L893-M896 HydrophobicContact CD2-CE 3.8Å; L893-M896 HydrophobicContact CD2-SD 3.82Å; L893-M896 VanDerWaalsContact O-CB 3.23Å; L893-M896 WeakPolarHBondContact O-CB 3.42Å; L893-M896 PolarHBondContact O-N 2.62Å; L893-L941 HydrophobicContact CD2-CD1 3.74Å; L893-A944 HydrophobicContact CD1-CB 3.7Å; L893-I945 HydrophobicContact CB-CG1 4.09Å; L893-I945 HydrophobicContact CD2-CG1 4.13Å; L893-V948 HydrophobicContact CB-CG2 4.26Å
894	L	93.4	Very high	92.4	Very high	46 Å²	46	54.4 Å²	54.4	24%	0.241	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	120.6	-179.7	-177.1	64.8	0	0	0	111.1	M896 F916 V948 E952	L894-M896 PolarHBondContact O-N 3.31Å; L894-M896 VanDerWaalsContact O-N 3.15Å; L894-F916 HydrophobicContact CD2-CE2 4.45Å; L894-F916 HydrophobicContact CG-CE2 4.22Å; L894-F916 WeakPolarHBondContact O-CE2 3.48Å; L894-V948 HydrophobicContact CB-CG1 3.75Å; L894-V948 HydrophobicContact CD1-CG1 3.93Å; L894-V948 HydrophobicContact CG-CG1 4.44Å; L894-E952 HydrophobicContact CD1-CB 3.66Å; L894-E952 HydrophobicContact CD1-CG 3.85Å; L894-E952 HydrophobicContact CD2-CG 4.28Å; L894-E952 WeakPolarHBondContact CD2-OE1 3.48Å
895	G	90.3	Very high	92.4	Very high	25 Å²	25	59.3 Å²	59.3	26%	0.258	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	5.8	-175.8	0	0	0	0	0	115.4	L893 Q897 P915 N949	L893-G895 PolarHBondContact O-N 2.94Å; G895-Q897 PolarHBondContact O-N 3.32Å; G895-P915 WeakPolarHBondContact O-CD 3.45Å; G895-P915 WeakPolarHBondContact O-CG 3.36Å; G895-N949 PolarHBondContact N-OD1 2.68Å
896	M	94	Very high	92.3	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.03	32%	0.315	C	S	.	.			trans	-61.1	138.2	178.5	-177.7	-179.6	-66.6	0	0	110.4	M891 G892 L893 L894 M912 M913 L941 I945	M891-M896 HydrophobicContact CB-CE 3.64Å; M891-M896 HydrophobicContact CE-CE 3.86Å; G892-M896 WeakPolarHBondContact O-CE 3.33Å; L893-M896 HydrophobicContact CD2-CE 3.8Å; L893-M896 HydrophobicContact CD2-SD 3.82Å; L893-M896 VanDerWaalsContact O-CB 3.23Å; L893-M896 WeakPolarHBondContact O-CB 3.42Å; L893-M896 PolarHBondContact O-N 2.62Å; L894-M896 PolarHBondContact O-N 3.31Å; L894-M896 VanDerWaalsContact O-N 3.15Å; M896-M912 HydrophobicContact SD-CB 4.38Å; M896-M913 WeakPolarHBondContact CG-O 3.34Å; M896-L941 HydrophobicContact SD-CD1 4.36Å; M896-I945 HydrophobicContact CB-CD1 3.94Å; M896-I945 HydrophobicContact CB-CG1 4.19Å; M896-I945 HydrophobicContact CG-CD1 4.01Å; M896-I945 WeakPolarHBondContact O-CG2 3.18Å; M896-I945 HydrophobicContact SD-CD1 4.15Å
897	Q	92.5	Very high	92.2	Very high	118 Å²	118	58.5 Å²	58.5	55%	0.551	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	146.1	171.6	-64.5	179.2	-3.7	0	0	109.3	G895 M913	G895-Q897 PolarHBondContact O-N 3.32Å; Q897-M913 HydrophobicContact CB-CE 4.11Å; Q897-M913 PolarHBondContact N-O 2.88Å; Q897-M913 PolarHBondContact O-N 3.31Å
898	F	94.8	Very high	92.2	Very high	35 Å²	35	58.9 Å²	58.9	15%	0.154	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.7	170.8	75.4	-93.6	0	0	0	111.3	L900 I910 T911 M912 A938 L941 R942 I945	F898-L900 HydrophobicContact CE2-CD2 4.41Å; F898-L900 HydrophobicContact CE2-CG 4.39Å; F898-I910 HydrophobicContact CB-CD1 4.3Å; F898-I910 HydrophobicContact CB-CG1 4.31Å; F898-I910 HydrophobicContact CD2-CD1 3.57Å; F898-I910 HydrophobicContact CD2-CG1 3.97Å; F898-I910 HydrophobicContact CE2-CD1 4.13Å; F898-I910 HydrophobicContact CG-CD1 4.07Å; F898-I910 HydrophobicContact CG-CG1 4.49Å; F898-T911 CarbonylContact C-O 3.24Å; F898-T911 WeakPolarHBondContact CA-O 3.33Å; F898-M912 HydrophobicContact CB-CG 4.19Å; F898-A938 HydrophobicContact CE2-CB 3.9Å; F898-A938 HydrophobicContact CZ-CB 4.17Å; F898-A938 VanDerWaalsContact CZ-O 3.27Å; F898-A938 WeakPolarHBondContact CZ-O 3.43Å; F898-L941 HydrophobicContact CB-CD2 4.37Å; F898-L941 HydrophobicContact CD1-CD2 3.72Å; F898-L941 HydrophobicContact CD1-CG 3.98Å; F898-L941 HydrophobicContact CE1-CB 4.47Å; F898-L941 HydrophobicContact CE1-CD2 4.13Å; F898-L941 HydrophobicContact CE1-CG 4.06Å; F898-L941 HydrophobicContact CG-CD2 4Å; F898-R942 HydrophobicContact CE1-CB 3.95Å; F898-R942 HydrophobicContact CZ-CB 4.02Å; F898-I945 HydrophobicContact CD1-CD1 3.94Å; F898-I945 HydrophobicContact CE1-CD1 4.33Å
899	H	94.2	Very high	92.4	Very high	106 Å²	106	56.2 Å²	56.2	49%	0.491	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.3	178	-64.9	75	0	0	0	108.8	I910 T911	H899-I910 CarbonylContact O-C 3.53Å; H899-I910 WeakPolarHBondContact O-CA 3.39Å; H899-T911 PolarHBondContact N-O 2.84Å; H899-T911 PolarHBondContact O-N 3.09Å
900	L	95.3	Very high	92.6	Very high	93 Å²	93	54.1 Å²	54.1	49%	0.487	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	143.7	168.9	-61.1	178.9	0	0	0	108.9	F898 G909 I910 L934 A938	F898-L900 HydrophobicContact CE2-CD2 4.41Å; F898-L900 HydrophobicContact CE2-CG 4.39Å; L900-G909 WeakPolarHBondContact CA-O 3.19Å; L900-I910 HydrophobicContact CD2-CB 3.85Å; L900-I910 HydrophobicContact CD2-CD1 3.96Å; L900-I910 HydrophobicContact CD2-CG1 3.89Å; L900-L934 HydrophobicContact CD2-CD2 4.36Å; L900-L934 HydrophobicContact CD2-CG 4.37Å; L900-A938 HydrophobicContact CD1-CB 4.38Å; L900-A938 HydrophobicContact CD2-CB 4.06Å
901	F	93.6	Very high	92.7	Very high	47 Å²	47	53.4 Å²	53.4	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.7	177.1	72.1	-90	0	0	0	111.5	A848 Y906 G909 T911	A848-F901 HydrophobicContact CB-CE1 4.49Å; A848-F901 HydrophobicContact CB-CE2 3.96Å; A848-F901 HydrophobicContact CB-CZ 3.87Å; F901-Y906 HydrophobicContact CE2-CD2 4.14Å; F901-Y906 HydrophobicContact CE2-CG 4.36Å; F901-G909 VanDerWaalsContact CD1-C 3.49Å; F901-G909 PolarHBondContact N-O 3.38Å; F901-G909 WeakPolarHBondContact O-CA 3.39Å; F901-G909 PolarHBondContact O-N 3.11Å; F901-T911 WeakPolarHBondContact CD1-OG1 3.31Å; F901-T911 VanDerWaalsContact CE1-OG1 3.24Å; F901-T911 WeakPolarHBondContact CE1-OG1 3.24Å
902	S	93.4	Very high	92.8	Very high	90 Å²	90	53.1 Å²	53.1	63%	0.629	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142	136.2	171.4	-179.9	0	0	0	0	108.4	Y906 A907	S902-Y906 WeakPolarHBondContact CA-O 3.47Å; S902-A907 WeakPolarHBondContact CB-O 3.33Å; S902-A907 PolarHBondContact OG-O 2.97Å; S902-A907 VanDerWaalsContact OG-O 3.09Å
903	N	90.6	Very high	92.6	Very high	50 Å²	50	53.2 Å²	53.2	27%	0.267	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	-179.6	174.9	68	26.9	0	0	0	111.3	A848 Y905 Y906	A848-N903 PolarHBondContact O-ND2 3.1Å; N903-Y905 PolarHBondContact O-N 2.71Å; N903-Y905 PolarHBondContact OD1-N 2.69Å; N903-Y906 PolarHBondContact N-O 3.37Å; N903-Y906 CarbonylContact O-C 3.53Å; N903-Y906 PolarHBondContact O-N 2.85Å; N903-Y906 PolarHBondContact OD1-N 2.96Å
904	E	89.7	Confident	92.1	Very high	177 Å²	177	53.8 Å²	53.8	83%	0.827	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-23.1	-178	-59.2	179.5	165.3	0	0	114.6
905	Y	87.1	Confident	91	Very high	110 Å²	110	54.7 Å²	54.7	43%	0.431	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-24.6	-177	-46.4	-49.4	0	0	0	113.1	P851 N903	P851-Y905 HydrophobicContact CB-CD1 3.65Å; P851-Y905 HydrophobicContact CB-CE1 3.98Å; P851-Y905 HydrophobicContact CB-CG 3.99Å; P851-Y905 HydrophobicContact CG-CD1 4.22Å; P851-Y905 HydrophobicContact CG-CE1 4.04Å; N903-Y905 PolarHBondContact O-N 2.71Å; N903-Y905 PolarHBondContact OD1-N 2.69Å
906	Y	89.9	Confident	89.6	Confident	17 Å²	17	60 Å²	60	7%	0.067	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	97.5	-172.2	-54.1	-67.2	0	0	0	110.1	V845 K850 F901 S902 N903 H908 C927	V845-Y906 HydrophobicContact CG1-CD2 4.28Å; V845-Y906 HydrophobicContact CG1-CE1 4.33Å; V845-Y906 HydrophobicContact CG1-CE2 3.68Å; V845-Y906 HydrophobicContact CG2-CD1 4.12Å; V845-Y906 HydrophobicContact CG2-CE1 3.85Å; K850-Y906 WeakPolarHBondContact O-CE2 3.23Å; K850-Y906 PolarHBondContact O-OH 2.95Å; K850-Y906 VanDerWaalsContact O-OH 3.13Å; F901-Y906 HydrophobicContact CE2-CD2 4.14Å; F901-Y906 HydrophobicContact CE2-CG 4.36Å; S902-Y906 WeakPolarHBondContact CA-O 3.47Å; N903-Y906 PolarHBondContact N-O 3.37Å; N903-Y906 CarbonylContact O-C 3.53Å; N903-Y906 PolarHBondContact O-N 2.85Å; N903-Y906 PolarHBondContact OD1-N 2.96Å; Y906-H908 VanDerWaalsContact C-N 3.28Å; Y906-H908 PolarHBondContact O-N 2.81Å; Y906-C927 HydrophobicContact CD1-CB 3.94Å; Y906-C927 HydrophobicContact CG-CB 4.46Å
907	A	89.7	Confident	87.8	Confident	60 Å²	60	61.6 Å²	61.6	50%	0.496	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	-27.3	179.8	0	0	0	0	0	113.8	S902	S902-A907 WeakPolarHBondContact CB-O 3.33Å; S902-A907 PolarHBondContact OG-O 2.97Å; S902-A907 VanDerWaalsContact OG-O 3.09Å
908	H	94.3	Very high	86	Confident	74 Å²	74	59.7 Å²	59.7	34%	0.343	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	86	-175.8	-53.4	-40.4	0	0	0	109.4	Y906 C927 S928 G931 L934	Y906-H908 VanDerWaalsContact C-N 3.28Å; Y906-H908 PolarHBondContact O-N 2.81Å; H908-C927 CarbonylContact O-C 3.56Å; H908-C927 WeakPolarHBondContact O-CA 3.15Å; H908-C927 WeakPolarHBondContact O-CB 3.4Å; H908-S928 PolarHBondContact O-N 3.28Å; H908-G931 VanDerWaalsContact CD2-CA 3.48Å; H908-G931 WeakPolarHBondContact CD2-CA 3.47Å; H908-G931 PolarHBondContact CD2-N 2.97Å; H908-G931 PolarHBondContact NE2-N 3.48Å; H908-L934 VanDerWaalsContact C-CD2 3.4Å; H908-L934 HydrophobicContact CB-CD2 3.75Å
909	G	93.9	Very high	84	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	149.5	-179.5	0	0	0	0	0	113.7	L900 F901 F926	L900-G909 WeakPolarHBondContact CA-O 3.19Å; F901-G909 VanDerWaalsContact CD1-C 3.49Å; F901-G909 PolarHBondContact N-O 3.38Å; F901-G909 WeakPolarHBondContact O-CA 3.39Å; F901-G909 PolarHBondContact O-N 3.11Å; G909-F926 CarbonylContact C-O 3.32Å; G909-F926 WeakPolarHBondContact CA-O 3.41Å
910	I	95.8	Very high	82.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.9	167.6	-175.1	168.1	0	0	0	110	F898 H899 L900 M912 S925 F926 L934 F937 A938 L941	F898-I910 HydrophobicContact CB-CD1 4.3Å; F898-I910 HydrophobicContact CB-CG1 4.31Å; F898-I910 HydrophobicContact CD2-CD1 3.57Å; F898-I910 HydrophobicContact CD2-CG1 3.97Å; F898-I910 HydrophobicContact CE2-CD1 4.13Å; F898-I910 HydrophobicContact CG-CD1 4.07Å; F898-I910 HydrophobicContact CG-CG1 4.49Å; H899-I910 CarbonylContact O-C 3.53Å; H899-I910 WeakPolarHBondContact O-CA 3.39Å; L900-I910 HydrophobicContact CD2-CB 3.85Å; L900-I910 HydrophobicContact CD2-CD1 3.96Å; L900-I910 HydrophobicContact CD2-CG1 3.89Å; I910-M912 HydrophobicContact CD1-CE 4.1Å; I910-M912 HydrophobicContact CG1-CE 4.43Å; I910-M912 HydrophobicContact CG2-CE 4.24Å; I910-S925 CarbonylContact O-C 3.6Å; I910-S925 VanDerWaalsContact O-CA 3.31Å; I910-S925 WeakPolarHBondContact O-CA 3.4Å; I910-F926 HydrophobicContact CG2-CB 3.81Å; I910-F926 PolarHBondContact N-O 3.47Å; I910-F926 PolarHBondContact O-N 3.07Å; I910-L934 HydrophobicContact CB-CD1 3.99Å; I910-L934 HydrophobicContact CG2-CD1 3.67Å; I910-F937 HydrophobicContact CD1-CD1 4.43Å; I910-F937 HydrophobicContact CD1-CE1 4.2Å; I910-A938 HydrophobicContact CD1-CB 4.44Å; I910-L941 HydrophobicContact CD1-CD2 4.02Å
911	T	94.2	Very high	80.5	Confident	23 Å²	23	72.2 Å²	72.2	14%	0.141	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.1	175.6	-64.9	0	0	0	0	109.4	F898 H899 F901 L923 V924 S925	F898-T911 CarbonylContact C-O 3.24Å; F898-T911 WeakPolarHBondContact CA-O 3.33Å; H899-T911 PolarHBondContact N-O 2.84Å; H899-T911 PolarHBondContact O-N 3.09Å; F901-T911 WeakPolarHBondContact CD1-OG1 3.31Å; F901-T911 VanDerWaalsContact CE1-OG1 3.24Å; F901-T911 WeakPolarHBondContact CE1-OG1 3.24Å; T911-L923 HydrophobicContact CG2-CD1 3.37Å; T911-L923 HydrophobicContact CG2-CG 3.97Å; T911-V924 WeakPolarHBondContact CA-O 3.39Å; T911-S925 WeakPolarHBondContact CG2-OG 3.4Å; T911-S925 PolarHBondContact OG1-OG 3.5Å
912	M	93.4	Very high	79.3	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143.3	-178.7	-58.6	155.5	-174.2	0	0	110.3	L870 M891 M896 F898 I910 L923 V924 F926 F937 L941	L870-M912 HydrophobicContact CD2-CE 3.86Å; L870-M912 HydrophobicContact CD2-SD 3.37Å; L870-M912 WeakPolarHBondContact CD2-SD 3.49Å; M891-M912 HydrophobicContact CE-CB 4.02Å; M891-M912 HydrophobicContact CE-SD 3.82Å; M896-M912 HydrophobicContact SD-CB 4.38Å; F898-M912 HydrophobicContact CB-CG 4.19Å; I910-M912 HydrophobicContact CD1-CE 4.1Å; I910-M912 HydrophobicContact CG1-CE 4.43Å; I910-M912 HydrophobicContact CG2-CE 4.24Å; M912-L923 WeakPolarHBondContact O-CA 3.46Å; M912-V924 HydrophobicContact CB-CG1 4.01Å; M912-V924 PolarHBondContact N-O 3.41Å; M912-V924 PolarHBondContact O-N 2.9Å; M912-V924 HydrophobicContact SD-CG1 3.91Å; M912-F926 HydrophobicContact CE-CD2 3.87Å; M912-F926 HydrophobicContact CE-CE2 4.1Å; M912-F926 HydrophobicContact SD-CD2 4.08Å; M912-F926 HydrophobicContact SD-CE2 3.91Å; M912-F937 HydrophobicContact CE-CE1 3.45Å; M912-F937 VanDerWaalsContact CE-CE1 3.45Å; M912-F937 HydrophobicContact CE-CZ 3.67Å; M912-L941 HydrophobicContact CE-CD2 4.02Å; M912-L941 HydrophobicContact CG-CD2 4.48Å
913	M	89.5	Confident	78.9	Confident	38 Å²	38	74 Å²	74	19%	0.187	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	117.6	179	-65.5	-175.6	-64.1	0	0	109.8	M896 Q897 L923	M896-M913 WeakPolarHBondContact CG-O 3.34Å; Q897-M913 HydrophobicContact CB-CE 4.11Å; Q897-M913 PolarHBondContact N-O 2.88Å; Q897-M913 PolarHBondContact O-N 3.31Å; M913-L923 HydrophobicContact CG-CD1 3.56Å; M913-L923 HydrophobicContact SD-CD1 4.29Å
914	S	83.9	Confident	78.9	Confident	13 Å²	13	72.1 Å²	72.1	9%	0.091	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	134.3	162.5	-172.8	0	0	0	0	109.9	Q922	S914-Q922 PolarHBondContact N-O 3.09Å
915	P	71	Confident	79.1	Confident	66 Å²	66	64.2 Å²	64.2	43%	0.429	32%	0.324	S	S	.	.	S	Bend	trans	-83	-22.8	-178.8	33.7	-37.1	0	0	0	113.7	G895 T917	G895-P915 WeakPolarHBondContact O-CD 3.45Å; G895-P915 WeakPolarHBondContact O-CG 3.36Å; P915-T917 PolarHBondContact O-N 2.8Å
916	F	61.5	Low	79.4	Confident	136 Å²	136	59 Å²	59	60%	0.596	30%	0.303	S	S	*	.			trans	-94.8	40.7	-164.6	-66	-62.6	0	0	0	115	L894	L894-F916 HydrophobicContact CD2-CE2 4.45Å; L894-F916 HydrophobicContact CG-CE2 4.22Å; L894-F916 WeakPolarHBondContact O-CE2 3.48Å
917	T	55	Low	79.6	Confident	40 Å²	40	59 Å²	59	25%	0.245	31%	0.306	C	S	.	.			trans	-125	107.7	176.7	50.7	0	0	0	0	111.9	P915 E919 K920 Q922	P915-T917 PolarHBondContact O-N 2.8Å; T917-E919 VanDerWaalsContact C-N 3.31Å; T917-E919 PolarHBondContact O-N 2.93Å; T917-E919 VanDerWaalsContact O-N 3.07Å; T917-K920 WeakPolarHBondContact CB-O 3.32Å; T917-K920 CarbonylContact O-C 3.56Å; T917-K920 PolarHBondContact O-N 2.98Å; T917-K920 PolarHBondContact OG1-O 2.92Å; T917-Q922 HydrophobicContact CG2-CB 4.47Å; T917-Q922 HydrophobicContact CG2-CG 3.94Å; T917-Q922 PolarHBondContact OG1-N 2.81Å
918	S	54.2	Low	79.8	Confident	78 Å²	78	56.7 Å²	56.7	55%	0.545	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.8	-155.4	46.5	0	0	0	0	117.6
919	E	53.9	Low	79.5	Confident	169 Å²	169	57.7 Å²	57.7	79%	0.79	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-22.2	-178.3	-66.6	-179	-173.1	0	0	114.2	T917	T917-E919 VanDerWaalsContact C-N 3.31Å; T917-E919 PolarHBondContact O-N 2.93Å; T917-E919 VanDerWaalsContact O-N 3.07Å
920	K	54.9	Low	79.4	Confident	175 Å²	175	59.3 Å²	59.3	76%	0.761	31%	0.31	S	S	*	.	S	Bend	trans	-151	127.4	179.6	-63.4	-176.5	-176.4	173.2	0	109.1	T917 Q922	T917-K920 WeakPolarHBondContact CB-O 3.32Å; T917-K920 CarbonylContact O-C 3.56Å; T917-K920 PolarHBondContact O-N 2.98Å; T917-K920 PolarHBondContact OG1-O 2.92Å; K920-Q922 PolarHBondContact O-N 2.97Å
921	K	61.1	Low	79.3	Confident	153 Å²	153	60.4 Å²	60.4	67%	0.665	32%	0.322	S	S	*	.			trans	-55.1	123.1	169.2	-70.4	-175.2	177	-176.6	0	109	L923	K921-L923 VanDerWaalsContact C-N 3.28Å; K921-L923 PolarHBondContact O-N 3.11Å
922	Q	69.3	Low	79.3	Confident	75 Å²	75	66.4 Å²	66.4	35%	0.35	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	87.6	173.7	-87.2	-162.7	38.5	0	0	110.3	S914 T917 K920	S914-Q922 PolarHBondContact N-O 3.09Å; T917-Q922 HydrophobicContact CG2-CB 4.47Å; T917-Q922 HydrophobicContact CG2-CG 3.94Å; T917-Q922 PolarHBondContact OG1-N 2.81Å; K920-Q922 PolarHBondContact O-N 2.97Å
923	L	84.8	Confident	79.2	Confident	99 Å²	99	71.7 Å²	71.7	52%	0.518	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	147.1	167.8	-156.2	68.1	0	0	0	109.9	K889 T911 M912 M913 K921	K889-L923 PolarHBondContact NZ-O 3.07Å; K889-L923 VanDerWaalsContact NZ-O 3.1Å; T911-L923 HydrophobicContact CG2-CD1 3.37Å; T911-L923 HydrophobicContact CG2-CG 3.97Å; M912-L923 WeakPolarHBondContact O-CA 3.46Å; M913-L923 HydrophobicContact CG-CD1 3.56Å; M913-L923 HydrophobicContact SD-CD1 4.29Å; K921-L923 VanDerWaalsContact C-N 3.28Å; K921-L923 PolarHBondContact O-N 3.11Å
924	V	90.8	Very high	79.5	Confident	10 Å²	10	70.3 Å²	70.3	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	136.1	153.2	60.2	0	0	0	0	107.9	E844 I872 M891 T911 M912 F926	E844-V924 HydrophobicContact CG-CG2 4.38Å; I872-V924 HydrophobicContact CD1-CG1 4.2Å; M891-V924 HydrophobicContact CE-CG1 3.43Å; M891-V924 VanDerWaalsContact CE-CG1 3.43Å; M891-V924 HydrophobicContact SD-CG1 3.85Å; T911-V924 WeakPolarHBondContact CA-O 3.39Å; M912-V924 HydrophobicContact CB-CG1 4.01Å; M912-V924 PolarHBondContact N-O 3.41Å; M912-V924 PolarHBondContact O-N 2.9Å; M912-V924 HydrophobicContact SD-CG1 3.91Å; V924-F926 HydrophobicContact CB-CE2 4.33Å; V924-F926 HydrophobicContact CG1-CD2 4.49Å; V924-F926 HydrophobicContact CG1-CE2 3.79Å; V924-F926 HydrophobicContact CG2-CD2 4.22Å; V924-F926 HydrophobicContact CG2-CE1 4.39Å; V924-F926 HydrophobicContact CG2-CE2 3.58Å; V924-F926 HydrophobicContact CG2-CZ 3.67Å
925	S	92.9	Very high	80	Confident	11 Å²	11	76 Å²	76	8%	0.077	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.5	174.5	-57.4	0	0	0	0	109.7	V845 I910 T911	V845-S925 PolarHBondContact N-O 2.87Å; I910-S925 CarbonylContact O-C 3.6Å; I910-S925 VanDerWaalsContact O-CA 3.31Å; I910-S925 WeakPolarHBondContact O-CA 3.4Å; T911-S925 WeakPolarHBondContact CG2-OG 3.4Å; T911-S925 PolarHBondContact OG1-OG 3.5Å
926	F	94.6	Very high	81.1	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	157	176.9	-68.4	-77.4	0	0	0	109.9	L842 F843 E844 R861 V863 I872 G909 I910 M912 V924	L842-F926 HydrophobicContact CB-CB 4.08Å; L842-F926 HydrophobicContact CB-CD1 3.7Å; L842-F926 HydrophobicContact CB-CE1 4.4Å; L842-F926 HydrophobicContact CB-CG 4.05Å; L842-F926 HydrophobicContact CD1-CB 4.11Å; L842-F926 HydrophobicContact CD1-CD1 4.44Å; L842-F926 HydrophobicContact CD1-CD2 4.36Å; L842-F926 HydrophobicContact CD1-CG 4.07Å; F843-F926 CarbonylContact O-C 3.42Å; F843-F926 VanDerWaalsContact O-CA 3.23Å; F843-F926 WeakPolarHBondContact O-CA 3.41Å; E844-F926 HydrophobicContact CB-CD1 4.21Å; E844-F926 HydrophobicContact CB-CE1 4Å; E844-F926 HydrophobicContact CG-CE1 4.42Å; R861-F926 HydrophobicContact CB-CE1 4.19Å; R861-F926 HydrophobicContact CG-CE1 3.99Å; V863-F926 HydrophobicContact CG2-CE1 4.1Å; V863-F926 HydrophobicContact CG2-CZ 4.06Å; I872-F926 HydrophobicContact CD1-CE2 4.09Å; I872-F926 HydrophobicContact CD1-CZ 3.77Å; I872-F926 HydrophobicContact CG1-CE2 4.48Å; I872-F926 HydrophobicContact CG1-CZ 3.92Å; I872-F926 HydrophobicContact CG2-CE1 4.44Å; I872-F926 HydrophobicContact CG2-CZ 4.02Å; G909-F926 CarbonylContact C-O 3.32Å; G909-F926 WeakPolarHBondContact CA-O 3.41Å; I910-F926 HydrophobicContact CG2-CB 3.81Å; I910-F926 PolarHBondContact N-O 3.47Å; I910-F926 PolarHBondContact O-N 3.07Å; M912-F926 HydrophobicContact CE-CD2 3.87Å; M912-F926 HydrophobicContact CE-CE2 4.1Å; M912-F926 HydrophobicContact SD-CD2 4.08Å; M912-F926 HydrophobicContact SD-CE2 3.91Å; V924-F926 HydrophobicContact CB-CE2 4.33Å; V924-F926 HydrophobicContact CG1-CD2 4.49Å; V924-F926 HydrophobicContact CG1-CE2 3.79Å; V924-F926 HydrophobicContact CG2-CD2 4.22Å; V924-F926 HydrophobicContact CG2-CE1 4.39Å; V924-F926 HydrophobicContact CG2-CE2 3.58Å; V924-F926 HydrophobicContact CG2-CZ 3.67Å
927	C	93.4	Very high	82.8	Confident	19 Å²	19	72.5 Å²	72.5	13%	0.128	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	155.9	160.9	63.5	0	0	0	0	111.6	F843 V845 Y906 H908	F843-C927 PolarHBondContact N-O 3.1Å; F843-C927 PolarHBondContact O-N 2.75Å; V845-C927 HydrophobicContact CG2-CB 3.92Å; Y906-C927 HydrophobicContact CD1-CB 3.94Å; Y906-C927 HydrophobicContact CG-CB 4.46Å; H908-C927 CarbonylContact O-C 3.56Å; H908-C927 WeakPolarHBondContact O-CA 3.15Å; H908-C927 WeakPolarHBondContact O-CB 3.4Å
928	S	93.1	Very high	84.8	Confident	11 Å²	11	70.7 Å²	70.7	8%	0.077	35%	0.353	C	S	.	.			trans	-115.4	145.2	176.2	-179.2	0	0	0	0	110.1	H908 S930	H908-S928 PolarHBondContact O-N 3.28Å; S928-S930 WeakPolarHBondContact CB-O 3.37Å; S928-S930 PolarHBondContact OG-N 2.86Å; S928-S930 VanDerWaalsContact OG-N 3.1Å; S928-S930 PolarHBondContact OG-O 2.87Å
929	P	87.6	Confident	86.8	Confident	95 Å²	95	70.7 Å²	70.7	62%	0.617	34%	0.344	S	S	*	.	S	Bend	trans	-72.3	-19.7	168	32.4	-35	0	0	0	112.4	F843	F843-P929 HydrophobicContact CE2-CG 4.32Å
930	S	93.1	Very high	88.8	Confident	34 Å²	34	65.9 Å²	65.9	24%	0.238	32%	0.321	C	S	.	.			trans	-120.2	124.9	178.4	173.9	0	0	0	0	111.6	S928 E932 E933 L934	S928-S930 WeakPolarHBondContact CB-O 3.37Å; S928-S930 PolarHBondContact OG-N 2.86Å; S928-S930 VanDerWaalsContact OG-N 3.1Å; S928-S930 PolarHBondContact OG-O 2.87Å; S930-E932 VanDerWaalsContact C-N 3.27Å; S930-E932 PolarHBondContact O-N 3.4Å; S930-E932 PolarHBondContact OG-N 3.35Å; S930-E933 WeakPolarHBondContact CB-OE2 3.36Å; S930-E933 PolarHBondContact OG-N 3.32Å; S930-L934 PolarHBondContact O-N 3.32Å; S930-L934 VanDerWaalsContact O-N 3.14Å
931	G	92.7	Very high	90.9	Very high	24 Å²	24	57.5 Å²	57.5	25%	0.247	29%	0.285	C	S	.	.	H	α-helix	trans	-66.4	-28.6	173.6	0	0	0	0	0	112.9	H908 R935	H908-G931 VanDerWaalsContact CD2-CA 3.48Å; H908-G931 WeakPolarHBondContact CD2-CA 3.47Å; H908-G931 PolarHBondContact CD2-N 2.97Å; H908-G931 PolarHBondContact NE2-N 3.48Å; G931-R935 VanDerWaalsContact O-CB 3.28Å; G931-R935 WeakPolarHBondContact O-CB 3.3Å; G931-R935 PolarHBondContact O-N 3.17Å
932	E	94.1	Very high	92.6	Very high	149 Å²	149	56.3 Å²	56.3	70%	0.696	28%	0.277	S	S	*	.	H	α-helix	trans	-72.9	-43.6	177.6	-61.8	-173	154.2	0	0	111.9	S930 L934 R935 K936	S930-E932 VanDerWaalsContact C-N 3.27Å; S930-E932 PolarHBondContact O-N 3.4Å; S930-E932 PolarHBondContact OG-N 3.35Å; E932-L934 VanDerWaalsContact C-N 3.3Å; E932-L934 PolarHBondContact O-N 3.21Å; E932-R935 PolarHBondContact O-N 3.02Å; E932-K936 PolarHBondContact O-N 3.19Å
933	E	92.3	Very high	93.9	Very high	111 Å²	111	54.8 Å²	54.8	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-42.7	173.5	-67.5	178	158.5	0	0	110.6	S930 F937	S930-E933 WeakPolarHBondContact CB-OE2 3.36Å; S930-E933 PolarHBondContact OG-N 3.32Å; E933-F937 WeakPolarHBondContact O-CB 3.39Å; E933-F937 PolarHBondContact O-N 2.85Å
934	L	94.8	Very high	94.5	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-42.7	177.6	-171.5	64.1	0	0	0	112.3	L842 L900 H908 I910 S930 E932 F937 A938	L842-L934 HydrophobicContact CD2-CD1 4.38Å; L900-L934 HydrophobicContact CD2-CD2 4.36Å; L900-L934 HydrophobicContact CD2-CG 4.37Å; H908-L934 VanDerWaalsContact C-CD2 3.4Å; H908-L934 HydrophobicContact CB-CD2 3.75Å; I910-L934 HydrophobicContact CB-CD1 3.99Å; I910-L934 HydrophobicContact CG2-CD1 3.67Å; S930-L934 PolarHBondContact O-N 3.32Å; S930-L934 VanDerWaalsContact O-N 3.14Å; E932-L934 VanDerWaalsContact C-N 3.3Å; E932-L934 PolarHBondContact O-N 3.21Å; L934-F937 HydrophobicContact CD1-CD1 4.47Å; L934-F937 PolarHBondContact O-N 2.88Å; L934-A938 VanDerWaalsContact O-CB 3.24Å; L934-A938 WeakPolarHBondContact O-CB 3.26Å; L934-A938 PolarHBondContact O-N 2.86Å
935	R	94.9	Very high	94.8	Very high	133 Å²	133	50.4 Å²	50.4	50%	0.502	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-47.9	177.2	-176.2	-172.2	60.7	70.1	4.8	110.6	G931 E932 A938 E939	G931-R935 VanDerWaalsContact O-CB 3.28Å; G931-R935 WeakPolarHBondContact O-CB 3.3Å; G931-R935 PolarHBondContact O-N 3.17Å; E932-R935 PolarHBondContact O-N 3.02Å; R935-A938 PolarHBondContact O-N 3.48Å; R935-E939 VanDerWaalsContact CG-OE1 3.29Å; R935-E939 WeakPolarHBondContact CG-OE1 3.47Å; R935-E939 IonicContact CZ-OE1 3.12Å; R935-E939 IonicContact CZ-OE2 3.57Å; R935-E939 IonicContact NH1-OE1 2.68Å; R935-E939 PolarHBondContact NH1-OE1 3.13Å; R935-E939 IonicContact NH1-OE2 2.78Å; R935-E939 PolarHBondContact NH1-OE2 2.94Å; R935-E939 WeakPolarHBondContact O-CG 3.42Å; R935-E939 PolarHBondContact O-N 3.47Å
936	K	95	Very high	95	Very high	127 Å²	127	51 Å²	51	55%	0.552	25%	0.252	S	S	*	.	H	α-helix	trans	-59.6	-50.6	176.5	-176.8	176.4	179.3	178	0	111.2	E932 A938 E939 E940	E932-K936 PolarHBondContact O-N 3.19Å; K936-A938 VanDerWaalsContact C-N 3.28Å; K936-A938 PolarHBondContact O-N 3Å; K936-E939 WeakPolarHBondContact O-CB 3.39Å; K936-E939 PolarHBondContact O-N 3.18Å; K936-E940 WeakPolarHBondContact O-CG 3.49Å; K936-E940 PolarHBondContact O-N 3.42Å
937	F	96.5	Very high	95.2	Very high	1 Å²	1	51.3 Å²	51.3	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-38.9	177.3	172.7	-104.6	0	0	0	112.7	C840 L842 V863 L865 L870 I910 M912 E933 L934 E939 L941	C840-F937 HydrophobicContact CB-CD2 3.95Å; C840-F937 HydrophobicContact CB-CG 4.37Å; L842-F937 HydrophobicContact CD1-CD1 4.12Å; L842-F937 HydrophobicContact CD1-CE1 3.81Å; L842-F937 HydrophobicContact CD1-CZ 4.17Å; V863-F937 HydrophobicContact CG1-CE2 4.27Å; V863-F937 HydrophobicContact CG1-CZ 4.13Å; L865-F937 HydrophobicContact CB-CE2 4.43Å; L870-F937 HydrophobicContact CD1-CE2 4.18Å; L870-F937 HydrophobicContact CD1-CZ 3.98Å; I910-F937 HydrophobicContact CD1-CD1 4.43Å; I910-F937 HydrophobicContact CD1-CE1 4.2Å; M912-F937 HydrophobicContact CE-CE1 3.45Å; M912-F937 VanDerWaalsContact CE-CE1 3.45Å; M912-F937 HydrophobicContact CE-CZ 3.67Å; E933-F937 WeakPolarHBondContact O-CB 3.39Å; E933-F937 PolarHBondContact O-N 2.85Å; L934-F937 HydrophobicContact CD1-CD1 4.47Å; L934-F937 PolarHBondContact O-N 2.88Å; F937-E939 VanDerWaalsContact C-N 3.34Å; F937-L941 HydrophobicContact CE1-CD2 4.22Å; F937-L941 HydrophobicContact CZ-CD2 4.38Å; F937-L941 WeakPolarHBondContact O-CB 3.43Å; F937-L941 PolarHBondContact O-N 3.38Å
938	A	96.8	Very high	95.3	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-70.7	-26.4	176.3	0	0	0	0	0	113.5	F898 L900 I910 L934 R935 K936 R942	F898-A938 HydrophobicContact CE2-CB 3.9Å; F898-A938 HydrophobicContact CZ-CB 4.17Å; F898-A938 VanDerWaalsContact CZ-O 3.27Å; F898-A938 WeakPolarHBondContact CZ-O 3.43Å; L900-A938 HydrophobicContact CD1-CB 4.38Å; L900-A938 HydrophobicContact CD2-CB 4.06Å; I910-A938 HydrophobicContact CD1-CB 4.44Å; L934-A938 VanDerWaalsContact O-CB 3.24Å; L934-A938 WeakPolarHBondContact O-CB 3.26Å; L934-A938 PolarHBondContact O-N 2.86Å; R935-A938 PolarHBondContact O-N 3.48Å; K936-A938 VanDerWaalsContact C-N 3.28Å; K936-A938 PolarHBondContact O-N 3Å; A938-R942 VanDerWaalsContact O-CB 3.26Å; A938-R942 WeakPolarHBondContact O-CB 3.38Å; A938-R942 PolarHBondContact O-N 3.04Å; A938-R942 VanDerWaalsContact O-N 3.12Å
939	E	96.1	Very high	95.5	Very high	78 Å²	78	53.3 Å²	53.3	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-73.3	-49.2	172.4	-76	159.4	-170.4	0	0	111.2	R935 K936 F937 L941 R942 E943	R935-E939 VanDerWaalsContact CG-OE1 3.29Å; R935-E939 WeakPolarHBondContact CG-OE1 3.47Å; R935-E939 IonicContact CZ-OE1 3.12Å; R935-E939 IonicContact CZ-OE2 3.57Å; R935-E939 IonicContact NH1-OE1 2.68Å; R935-E939 PolarHBondContact NH1-OE1 3.13Å; R935-E939 IonicContact NH1-OE2 2.78Å; R935-E939 PolarHBondContact NH1-OE2 2.94Å; R935-E939 WeakPolarHBondContact O-CG 3.42Å; R935-E939 PolarHBondContact O-N 3.47Å; K936-E939 WeakPolarHBondContact O-CB 3.39Å; K936-E939 PolarHBondContact O-N 3.18Å; F937-E939 VanDerWaalsContact C-N 3.34Å; E939-L941 PolarHBondContact O-N 2.92Å; E939-R942 PolarHBondContact O-N 3.04Å; E939-E943 PolarHBondContact O-N 3.37Å
940	E	96.8	Very high	95.9	Very high	68 Å²	68	50 Å²	50	32%	0.318	24%	0.239	S	C	.	.	H	α-helix	trans	-59	-44.9	174.5	-58.4	-66.9	173.8	0	0	111.4	V837 L865 K936 R942 E943 A944	V837-E940 HydrophobicContact CG1-CB 4.1Å; L865-E940 HydrophobicContact CD2-CB 3.83Å; K936-E940 WeakPolarHBondContact O-CG 3.49Å; K936-E940 PolarHBondContact O-N 3.42Å; E940-R942 PolarHBondContact O-N 2.91Å; E940-E943 PolarHBondContact O-N 3.47Å; E940-A944 WeakPolarHBondContact O-CB 3.4Å; E940-A944 PolarHBondContact O-N 2.82Å
941	L	97.4	Very high	96	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-40.7	177.6	178.6	63.4	0	0	0	112.2	L865 L893 M896 F898 I910 M912 F937 E939 I945	L865-L941 HydrophobicContact CD1-CD1 3.82Å; L865-L941 HydrophobicContact CD2-CB 4.33Å; L893-L941 HydrophobicContact CD2-CD1 3.74Å; M896-L941 HydrophobicContact SD-CD1 4.36Å; F898-L941 HydrophobicContact CB-CD2 4.37Å; F898-L941 HydrophobicContact CD1-CD2 3.72Å; F898-L941 HydrophobicContact CD1-CG 3.98Å; F898-L941 HydrophobicContact CE1-CB 4.47Å; F898-L941 HydrophobicContact CE1-CD2 4.13Å; F898-L941 HydrophobicContact CE1-CG 4.06Å; F898-L941 HydrophobicContact CG-CD2 4Å; I910-L941 HydrophobicContact CD1-CD2 4.02Å; M912-L941 HydrophobicContact CE-CD2 4.02Å; M912-L941 HydrophobicContact CG-CD2 4.48Å; F937-L941 HydrophobicContact CE1-CD2 4.22Å; F937-L941 HydrophobicContact CZ-CD2 4.38Å; F937-L941 WeakPolarHBondContact O-CB 3.43Å; F937-L941 PolarHBondContact O-N 3.38Å; E939-L941 PolarHBondContact O-N 2.92Å; L941-I945 HydrophobicContact CD1-CD1 3.87Å; L941-I945 HydrophobicContact CD1-CG1 4.26Å; L941-I945 HydrophobicContact CG-CD1 3.86Å; L941-I945 WeakPolarHBondContact O-CB 3.34Å; L941-I945 WeakPolarHBondContact O-CD1 3.03Å; L941-I945 WeakPolarHBondContact O-CG1 3.48Å; L941-I945 PolarHBondContact O-N 2.72Å
942	R	97.2	Very high	96.1	Very high	128 Å²	128	51 Å²	51	48%	0.483	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-43.3	177	-171.8	-174.1	-59.6	112.2	0.8	111.4	F898 A938 E939 E940 A946	F898-R942 HydrophobicContact CE1-CB 3.95Å; F898-R942 HydrophobicContact CZ-CB 4.02Å; A938-R942 VanDerWaalsContact O-CB 3.26Å; A938-R942 WeakPolarHBondContact O-CB 3.38Å; A938-R942 PolarHBondContact O-N 3.04Å; A938-R942 VanDerWaalsContact O-N 3.12Å; E939-R942 PolarHBondContact O-N 3.04Å; E940-R942 PolarHBondContact O-N 2.91Å; R942-A946 WeakPolarHBondContact O-CB 3.4Å; R942-A946 PolarHBondContact O-N 3.48Å
943	E	97.3	Very high	96.2	Very high	43 Å²	43	50 Å²	50	20%	0.201	23%	0.23	C	C	.	.	H	α-helix	trans	-73	-35.1	-178.6	-176.3	54.6	-154.7	0	0	112.2	R619 R622 E939 E940 A946 E947	R619-E943 WeakPolarHBondContact CB-OE1 3Å; R619-E943 WeakPolarHBondContact CG-OE1 3.23Å; R619-E943 IonicContact CZ-OE1 3.21Å; R619-E943 IonicContact CZ-OE2 2.68Å; R619-E943 IonicContact NE-OE1 3.85Å; R619-E943 PolarHBondContact NE-OE1 2.97Å; R619-E943 IonicContact NE-OE2 3.13Å; R619-E943 PolarHBondContact NE-OE2 2.96Å; R619-E943 IonicContact NH2-OE1 3.16Å; R619-E943 IonicContact NH2-OE2 3.32Å; R619-E943 PolarHBondContact NH2-OE2 3.01Å; R622-E943 IonicContact CZ-OE1 3.62Å; R622-E943 IonicContact NH1-OE1 2.73Å; R622-E943 PolarHBondContact NH1-OE1 3.46Å; R622-E943 IonicContact NH2-OE1 3.08Å; R622-E943 PolarHBondContact NH2-OE1 3.17Å; E939-E943 PolarHBondContact O-N 3.37Å; E940-E943 PolarHBondContact O-N 3.47Å; E943-A946 PolarHBondContact O-N 2.94Å; E943-E947 WeakPolarHBondContact O-CB 3.4Å; E943-E947 PolarHBondContact O-N 3.48Å
944	A	97.9	Very high	96.2	Very high	3 Å²	3	45.7 Å²	45.7	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-42.8	171.9	0	0	0	0	0	112.3	L865 L893 E940 A946 E947 V948	L865-A944 HydrophobicContact CD1-CB 4.31Å; L865-A944 HydrophobicContact CD2-CB 4.37Å; L893-A944 HydrophobicContact CD1-CB 3.7Å; E940-A944 WeakPolarHBondContact O-CB 3.4Å; E940-A944 PolarHBondContact O-N 2.82Å; A944-A946 VanDerWaalsContact C-N 3.31Å; A944-A946 PolarHBondContact O-N 3.41Å; A944-E947 PolarHBondContact O-N 2.8Å; A944-V948 WeakPolarHBondContact O-CG2 3.34Å; A944-V948 PolarHBondContact O-N 2.85Å
945	I	97.1	Very high	96.1	Very high	14 Å²	14	49.1 Å²	49.1	7%	0.072	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-41.3	173	-70.3	166.1	0	0	0	110.8	L893 M896 F898 L941 V948 N949	L893-I945 HydrophobicContact CB-CG1 4.09Å; L893-I945 HydrophobicContact CD2-CG1 4.13Å; M896-I945 HydrophobicContact CB-CD1 3.94Å; M896-I945 HydrophobicContact CB-CG1 4.19Å; M896-I945 HydrophobicContact CG-CD1 4.01Å; M896-I945 WeakPolarHBondContact O-CG2 3.18Å; M896-I945 HydrophobicContact SD-CD1 4.15Å; F898-I945 HydrophobicContact CD1-CD1 3.94Å; F898-I945 HydrophobicContact CE1-CD1 4.33Å; L941-I945 HydrophobicContact CD1-CD1 3.87Å; L941-I945 HydrophobicContact CD1-CG1 4.26Å; L941-I945 HydrophobicContact CG-CD1 3.86Å; L941-I945 WeakPolarHBondContact O-CB 3.34Å; L941-I945 WeakPolarHBondContact O-CD1 3.03Å; L941-I945 WeakPolarHBondContact O-CG1 3.48Å; L941-I945 PolarHBondContact O-N 2.72Å; I945-V948 PolarHBondContact O-N 2.78Å; I945-N949 WeakPolarHBondContact CG2-ND2 3.49Å; I945-N949 WeakPolarHBondContact O-CB 3.37Å; I945-N949 PolarHBondContact O-N 2.98Å; I945-N949 PolarHBondContact O-ND2 2.88Å
946	A	97.3	Very high	96	Very high	24 Å²	24	47 Å²	47	20%	0.198	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-42.5	176.8	0	0	0	0	0	112.3	R942 E943 A944 V948 N949 E950	R942-A946 WeakPolarHBondContact O-CB 3.4Å; R942-A946 PolarHBondContact O-N 3.48Å; E943-A946 PolarHBondContact O-N 2.94Å; A944-A946 VanDerWaalsContact C-N 3.31Å; A944-A946 PolarHBondContact O-N 3.41Å; A946-V948 PolarHBondContact O-N 3.49Å; A946-N949 PolarHBondContact O-N 3.39Å; A946-E950 WeakPolarHBondContact O-CB 3.41Å; A946-E950 PolarHBondContact O-N 2.78Å
947	E	97.3	Very high	95.8	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.023	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-45.1	174.6	-177	176.7	133.8	0	0	112.3	R619 R622 I623 N626 R835 N867 E943 A944 M951	R619-E947 HydrophobicContact CG-CB 4.13Å; R619-E947 HydrophobicContact CG-CG 4.46Å; R622-E947 IonicContact CZ-OE2 3.31Å; R622-E947 IonicContact NE-OE2 3.59Å; R622-E947 PolarHBondContact NE-OE2 3.23Å; R622-E947 IonicContact NH2-OE2 3.8Å; R622-E947 PolarHBondContact NH2-OE2 2.78Å; I623-E947 HydrophobicContact CG1-CG 4.01Å; N626-E947 PolarHBondContact ND2-OE1 3.01Å; R835-E947 IonicContact CZ-OE1 3.76Å; R835-E947 IonicContact NH2-OE1 3.65Å; R835-E947 PolarHBondContact NH2-OE1 3.23Å; R835-E947 IonicContact NH2-OE2 2.71Å; N867-E947 WeakPolarHBondContact CB-OE1 3.19Å; E943-E947 WeakPolarHBondContact O-CB 3.4Å; E943-E947 PolarHBondContact O-N 3.48Å; A944-E947 PolarHBondContact O-N 2.8Å; E947-M951 VanDerWaalsContact O-CB 3.23Å; E947-M951 WeakPolarHBondContact O-CB 3.46Å; E947-M951 PolarHBondContact O-N 2.69Å
948	V	96.9	Very high	95.4	Very high	27 Å²	27	48.7 Å²	48.7	16%	0.164	23%	0.231	C	C	.	.	H	α-helix	trans	-70.3	-44.3	179.1	174.7	0	0	0	0	112.1	N867 D868 L893 L894 A944 I945 A946 M951 E952	N867-V948 WeakPolarHBondContact O-CG2 3.43Å; D868-V948 HydrophobicContact CB-CG2 4.49Å; L893-V948 HydrophobicContact CB-CG2 4.26Å; L894-V948 HydrophobicContact CB-CG1 3.75Å; L894-V948 HydrophobicContact CD1-CG1 3.93Å; L894-V948 HydrophobicContact CG-CG1 4.44Å; A944-V948 WeakPolarHBondContact O-CG2 3.34Å; A944-V948 PolarHBondContact O-N 2.85Å; I945-V948 PolarHBondContact O-N 2.78Å; A946-V948 PolarHBondContact O-N 3.49Å; V948-M951 PolarHBondContact O-N 2.77Å; V948-E952 PolarHBondContact O-N 3.35Å
949	N	95.9	Very high	95.1	Very high	46 Å²	46	51.5 Å²	51.5	25%	0.246	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-41	179.7	-68.6	-19.5	0	0	0	111.7	G895 I945 A946 E952 Q953	G895-N949 PolarHBondContact N-OD1 2.68Å; I945-N949 WeakPolarHBondContact CG2-ND2 3.49Å; I945-N949 WeakPolarHBondContact O-CB 3.37Å; I945-N949 PolarHBondContact O-N 2.98Å; I945-N949 PolarHBondContact O-ND2 2.88Å; A946-N949 PolarHBondContact O-N 3.39Å; N949-E952 PolarHBondContact O-N 3.37Å; N949-Q953 VanDerWaalsContact O-CG 3.3Å; N949-Q953 WeakPolarHBondContact O-CG 3.34Å; N949-Q953 PolarHBondContact O-N 3.13Å
950	E	96.8	Very high	94.8	Very high	25 Å²	25	51.5 Å²	51.5	12%	0.117	25%	0.246	C	C	.	.	H	α-helix	trans	-71.5	-34	178.8	-168	172.4	132.5	0	0	111.3	H616 R619 L620 I623 A946 Q953 I954	H616-E950 IonicContact CE1-OE1 3.15Å; H616-E950 PolarHBondContact CE1-OE1 3.49Å; H616-E950 IonicContact ND1-OE1 3.22Å; H616-E950 PolarHBondContact ND1-OE1 3.29Å; H616-E950 IonicContact ND1-OE2 2.8Å; R619-E950 WeakPolarHBondContact CD-OE2 3.41Å; R619-E950 IonicContact CZ-OE2 3.88Å; R619-E950 IonicContact NE-OE2 3.77Å; R619-E950 IonicContact NH1-OE2 3.11Å; R619-E950 PolarHBondContact NH1-OE2 3.25Å; L620-E950 WeakPolarHBondContact CD2-OE1 3.3Å; I623-E950 HydrophobicContact CD1-CB 3.81Å; I623-E950 HydrophobicContact CD1-CG 3.84Å; A946-E950 WeakPolarHBondContact O-CB 3.41Å; A946-E950 PolarHBondContact O-N 2.78Å; E950-Q953 PolarHBondContact O-N 3.34Å; E950-I954 WeakPolarHBondContact O-CD1 3.33Å; E950-I954 WeakPolarHBondContact O-CG1 3.13Å; E950-I954 PolarHBondContact O-N 3.3Å
951	M	95.3	Very high	94.4	Very high	40 Å²	40	52.6 Å²	52.6	20%	0.197	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-39.4	171.7	-175.9	156.7	171.4	0	0	113.1	I623 N626 L627 E947 V948 I954 H955	I623-M951 HydrophobicContact CD1-CB 4.47Å; I623-M951 HydrophobicContact CG1-CB 4.25Å; I623-M951 HydrophobicContact CG2-CB 4.08Å; I623-M951 HydrophobicContact CG2-CG 4.12Å; I623-M951 HydrophobicContact CG2-SD 4.24Å; N626-M951 HydrophobicContact CB-CE 3.91Å; N626-M951 HydrophobicContact CB-SD 3.52Å; N626-M951 VanDerWaalsContact CB-SD 3.52Å; L627-M951 HydrophobicContact CD2-CE 3.83Å; L627-M951 HydrophobicContact CG-CE 3.91Å; E947-M951 VanDerWaalsContact O-CB 3.23Å; E947-M951 WeakPolarHBondContact O-CB 3.46Å; E947-M951 PolarHBondContact O-N 2.69Å; V948-M951 PolarHBondContact O-N 2.77Å; M951-I954 PolarHBondContact O-N 2.94Å; M951-H955 PolarHBondContact O-N 2.89Å
952	E	94.9	Very high	93.9	Very high	39 Å²	39	59.5 Å²	59.5	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-38.3	172.8	-173.8	84	150.4	0	0	111.3	L894 V948 N949 I954 H955 I956 R1010	L894-E952 HydrophobicContact CD1-CB 3.66Å; L894-E952 HydrophobicContact CD1-CG 3.85Å; L894-E952 HydrophobicContact CD2-CG 4.28Å; L894-E952 WeakPolarHBondContact CD2-OE1 3.48Å; V948-E952 PolarHBondContact O-N 3.35Å; N949-E952 PolarHBondContact O-N 3.37Å; E952-I954 PolarHBondContact O-N 3.09Å; E952-H955 WeakPolarHBondContact O-CB 3.34Å; E952-H955 PolarHBondContact O-N 3.16Å; E952-I956 HydrophobicContact CG-CD1 3.99Å; E952-I956 VanDerWaalsContact O-CG1 3.32Å; E952-I956 WeakPolarHBondContact O-CG1 3.28Å; E952-I956 PolarHBondContact O-N 2.74Å; E952-R1010 VanDerWaalsContact CD-NH2 3.27Å; E952-R1010 IonicContact OE1-CZ 2.69Å; E952-R1010 VanDerWaalsContact OE1-CZ 3.3Å; E952-R1010 IonicContact OE1-NH1 3.61Å; E952-R1010 PolarHBondContact OE1-NH1 2.74Å; E952-R1010 IonicContact OE1-NH2 3.66Å; E952-R1010 PolarHBondContact OE1-NH2 3.15Å; E952-R1010 IonicContact OE2-CZ 2.85Å; E952-R1010 IonicContact OE2-NH1 3.05Å; E952-R1010 IonicContact OE2-NH2 3.16Å; E952-R1010 PolarHBondContact OE2-NH2 3.34Å
953	Q	94.9	Very high	93.3	Very high	128 Å²	128	58.3 Å²	58.3	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-60.9	-43.4	174.1	-75.3	169.5	-0.3	0	0	112.1	N949 E950 H955 I956 Q957	N949-Q953 VanDerWaalsContact O-CG 3.3Å; N949-Q953 WeakPolarHBondContact O-CG 3.34Å; N949-Q953 PolarHBondContact O-N 3.13Å; E950-Q953 PolarHBondContact O-N 3.34Å; Q953-H955 VanDerWaalsContact C-N 3.33Å; Q953-H955 PolarHBondContact O-N 3.01Å; Q953-I956 PolarHBondContact O-N 3.33Å; Q953-Q957 WeakPolarHBondContact O-CB 3.49Å; Q953-Q957 PolarHBondContact O-N 3.05Å
954	I	93.9	Very high	92.4	Very high	20 Å²	20	62.4 Å²	62.4	10%	0.103	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-39.6	174.6	-69.7	157.7	0	0	0	111	L620 I623 F638 E950 M951 E952 Q957 W958	L620-I954 HydrophobicContact CD2-CD1 4.44Å; I623-I954 HydrophobicContact CD1-CD1 4.38Å; I623-I954 HydrophobicContact CG2-CD1 3.87Å; F638-I954 HydrophobicContact CD2-CG2 4.32Å; F638-I954 HydrophobicContact CE2-CD1 3.73Å; F638-I954 HydrophobicContact CE2-CG1 4.33Å; F638-I954 HydrophobicContact CE2-CG2 4Å; F638-I954 HydrophobicContact CZ-CD1 3.82Å; E950-I954 WeakPolarHBondContact O-CD1 3.33Å; E950-I954 WeakPolarHBondContact O-CG1 3.13Å; E950-I954 PolarHBondContact O-N 3.3Å; M951-I954 PolarHBondContact O-N 2.94Å; E952-I954 PolarHBondContact O-N 3.09Å; I954-Q957 PolarHBondContact O-N 3.41Å; I954-W958 HydrophobicContact CG2-CD2 3.99Å; I954-W958 HydrophobicContact CG2-CE3 4.01Å; I954-W958 HydrophobicContact CG2-CH2 4.12Å; I954-W958 HydrophobicContact CG2-CZ2 4.07Å; I954-W958 HydrophobicContact CG2-CZ3 4.07Å; I954-W958 PolarHBondContact O-N 3.41Å; I954-W958 VanDerWaalsContact O-N 3.09Å
955	H	92	Very high	90.5	Very high	81 Å²	81	64.8 Å²	64.8	38%	0.375	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-47.1	175.4	-166.8	115.2	0	0	0	112.2	M951 E952 Q953 W958 E959	M951-H955 PolarHBondContact O-N 2.89Å; E952-H955 WeakPolarHBondContact O-CB 3.34Å; E952-H955 PolarHBondContact O-N 3.16Å; Q953-H955 VanDerWaalsContact C-N 3.33Å; Q953-H955 PolarHBondContact O-N 3.01Å; H955-W958 PolarHBondContact O-N 3.05Å; H955-E959 PolarHBondContact O-N 3Å
956	I	93.4	Very high	88.5	Confident	88 Å²	88	70.3 Å²	70.3	45%	0.451	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-43.8	178.2	-68.4	164.1	0	0	0	110.7	E952 Q953 W958 E959 L960	E952-I956 HydrophobicContact CG-CD1 3.99Å; E952-I956 VanDerWaalsContact O-CG1 3.32Å; E952-I956 WeakPolarHBondContact O-CG1 3.28Å; E952-I956 PolarHBondContact O-N 2.74Å; Q953-I956 PolarHBondContact O-N 3.33Å; I956-W958 PolarHBondContact O-N 3.47Å; I956-E959 PolarHBondContact O-N 3.35Å; I956-L960 HydrophobicContact CG2-CD1 4.01Å; I956-L960 HydrophobicContact CG2-CG 4.48Å; I956-L960 WeakPolarHBondContact O-CG 3.08Å; I956-L960 PolarHBondContact O-N 2.95Å
957	Q	91.2	Very high	86.1	Confident	102 Å²	102	77 Å²	77	48%	0.477	38%	0.376	S	S	.	.	H	α-helix	trans	-58.6	-48.1	178	-179.1	60.4	30	0	0	111.6	Q953 I954 E959 L960 E961	Q953-Q957 WeakPolarHBondContact O-CB 3.49Å; Q953-Q957 PolarHBondContact O-N 3.05Å; I954-Q957 PolarHBondContact O-N 3.41Å; Q957-E959 PolarHBondContact O-N 3.35Å; Q957-L960 PolarHBondContact O-N 3.25Å; Q957-E961 WeakPolarHBondContact CG-OE1 3.47Å; Q957-E961 PolarHBondContact NE2-OE1 3.25Å; Q957-E961 WeakPolarHBondContact O-CG 3.31Å; Q957-E961 PolarHBondContact O-N 2.99Å
958	W	86.5	Confident	83.5	Confident	63 Å²	63	81.1 Å²	81.1	24%	0.239	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-35.3	176.3	-73.1	-24.4	0	0	0	113.8	L627 R634 F638 I954 H955 I956 L960 R962	L627-W958 HydrophobicContact CD1-CH2 3.82Å; L627-W958 HydrophobicContact CD1-CZ3 4.19Å; L627-W958 HydrophobicContact CD2-CH2 4.09Å; L627-W958 HydrophobicContact CD2-CZ3 3.65Å; R634-W958 HydrophobicContact CB-CH2 4.25Å; R634-W958 HydrophobicContact CB-CZ3 4.3Å; F638-W958 HydrophobicContact CB-CH2 4.14Å; F638-W958 HydrophobicContact CB-CZ2 4.22Å; F638-W958 HydrophobicContact CD2-CH2 4.06Å; F638-W958 AromaticContact CD2-CZ2 3.79Å; F638-W958 HydrophobicContact CD2-CZ2 3.79Å; F638-W958 HydrophobicContact CG-CH2 4.48Å; F638-W958 HydrophobicContact CG-CZ2 4.47Å; I954-W958 HydrophobicContact CG2-CD2 3.99Å; I954-W958 HydrophobicContact CG2-CE3 4.01Å; I954-W958 HydrophobicContact CG2-CH2 4.12Å; I954-W958 HydrophobicContact CG2-CZ2 4.07Å; I954-W958 HydrophobicContact CG2-CZ3 4.07Å; I954-W958 PolarHBondContact O-N 3.41Å; I954-W958 VanDerWaalsContact O-N 3.09Å; H955-W958 PolarHBondContact O-N 3.05Å; I956-W958 PolarHBondContact O-N 3.47Å; W958-L960 VanDerWaalsContact C-N 3.34Å; W958-R962 VanDerWaalsContact O-CB 3.28Å; W958-R962 WeakPolarHBondContact O-CB 3.22Å; W958-R962 PolarHBondContact O-N 3.43Å
959	E	90.4	Very high	80.8	Confident	60 Å²	60	88.7 Å²	88.7	28%	0.28	44%	0.439	S	S	.	.	H	α-helix	trans	-65.7	-38.4	175.3	-170.7	90.5	-90.5	0	0	111.2	H955 I956 Q957 R962 Q963	H955-E959 PolarHBondContact O-N 3Å; I956-E959 PolarHBondContact O-N 3.35Å; Q957-E959 PolarHBondContact O-N 3.35Å; E959-R962 IonicContact OE1-CZ 3.46Å; E959-R962 VanDerWaalsContact OE1-CZ 3.3Å; E959-R962 IonicContact OE1-NE 3.54Å; E959-R962 PolarHBondContact OE1-NE 2.9Å; E959-R962 IonicContact OE1-NH2 3.06Å; E959-R962 PolarHBondContact OE1-NH2 3.48Å; E959-Q963 VanDerWaalsContact O-CG 3.31Å; E959-Q963 WeakPolarHBondContact O-CG 3.32Å; E959-Q963 PolarHBondContact O-N 2.97Å; E959-Q963 VanDerWaalsContact O-N 3.15Å
960	L	91	Very high	77.9	Confident	78 Å²	78	89.3 Å²	89.3	41%	0.408	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-45.7	175.1	-69.1	168.3	0	0	0	111.9	I956 Q957 W958 R962 Q963 Q964	I956-L960 HydrophobicContact CG2-CD1 4.01Å; I956-L960 HydrophobicContact CG2-CG 4.48Å; I956-L960 WeakPolarHBondContact O-CG 3.08Å; I956-L960 PolarHBondContact O-N 2.95Å; Q957-L960 PolarHBondContact O-N 3.25Å; W958-L960 VanDerWaalsContact C-N 3.34Å; L960-R962 VanDerWaalsContact C-N 3.31Å; L960-R962 PolarHBondContact O-N 3.27Å; L960-Q963 PolarHBondContact O-N 3.32Å; L960-Q963 VanDerWaalsContact O-N 3.16Å; L960-Q964 WeakPolarHBondContact O-CG 3.35Å; L960-Q964 PolarHBondContact O-N 3.03Å
961	E	88.4	Confident	74.9	Confident	91 Å²	91	95.7 Å²	95.7	43%	0.425	49%	0.49	S	S	.	.	H	α-helix	trans	-58.7	-43.3	175.1	-72.7	165.3	-174.8	0	0	111.3	Q957 Q963 Q964 G965	Q957-E961 WeakPolarHBondContact CG-OE1 3.47Å; Q957-E961 PolarHBondContact NE2-OE1 3.25Å; Q957-E961 WeakPolarHBondContact O-CG 3.31Å; Q957-E961 PolarHBondContact O-N 2.99Å; E961-Q963 VanDerWaalsContact C-N 3.3Å; E961-Q963 PolarHBondContact O-N 3.38Å; E961-Q964 PolarHBondContact O-N 3.08Å; E961-G965 PolarHBondContact O-N 2.95Å
962	R	86.4	Confident	72	Confident	145 Å²	145	102 Å²	102	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-60.6	-36.1	175.6	-171.1	176.6	77.5	97.2	-4.2	112.8	W958 E959 L960 I966	W958-R962 VanDerWaalsContact O-CB 3.28Å; W958-R962 WeakPolarHBondContact O-CB 3.22Å; W958-R962 PolarHBondContact O-N 3.43Å; E959-R962 IonicContact OE1-CZ 3.46Å; E959-R962 VanDerWaalsContact OE1-CZ 3.3Å; E959-R962 IonicContact OE1-NE 3.54Å; E959-R962 PolarHBondContact OE1-NE 2.9Å; E959-R962 IonicContact OE1-NH2 3.06Å; E959-R962 PolarHBondContact OE1-NH2 3.48Å; L960-R962 VanDerWaalsContact C-N 3.31Å; L960-R962 PolarHBondContact O-N 3.27Å; R962-I966 WeakPolarHBondContact O-CD1 3.43Å; R962-I966 WeakPolarHBondContact O-CG1 3.37Å
963	Q	85.3	Confident	68.9	Low	103 Å²	103	106.5 Å²	106.5	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-73.4	-39.5	176.7	-71.1	170.4	35.4	0	0	112.2	E959 L960 E961 I966	E959-Q963 VanDerWaalsContact O-CG 3.31Å; E959-Q963 WeakPolarHBondContact O-CG 3.32Å; E959-Q963 PolarHBondContact O-N 2.97Å; E959-Q963 VanDerWaalsContact O-N 3.15Å; L960-Q963 PolarHBondContact O-N 3.32Å; L960-Q963 VanDerWaalsContact O-N 3.16Å; E961-Q963 VanDerWaalsContact C-N 3.3Å; E961-Q963 PolarHBondContact O-N 3.38Å; Q963-I966 PolarHBondContact O-N 3.08Å
964	Q	78.8	Confident	65.9	Low	128 Å²	128	108.8 Å²	108.8	60%	0.598	57%	0.565	S	S	*	*	H	α-helix	trans	-66.8	-38.6	178.6	-69.4	173.9	17.4	0	0	112.4	L960 E961 I966 Q967 S968	L960-Q964 WeakPolarHBondContact O-CG 3.35Å; L960-Q964 PolarHBondContact O-N 3.03Å; E961-Q964 PolarHBondContact O-N 3.08Å; Q964-I966 PolarHBondContact O-N 3.14Å; Q964-Q967 PolarHBondContact O-N 3.13Å; Q964-S968 PolarHBondContact O-OG 3.23Å
965	G	56.9	Low	62.7	Low	54 Å²	54	111.5 Å²	111.5	56%	0.557	60%	0.599	S	S	*	*	H	α-helix	trans	-60.1	-26.3	175.6	0	0	0	0	0	114.2	E961	E961-G965 PolarHBondContact O-N 2.95Å
966	I	55.8	Low	59.7	Low	129 Å²	129	111.3 Å²	111.3	66%	0.662	62%	0.619	S	S	*	*	H	α-helix	trans	-81.1	-27.9	179.3	-65.1	167.4	0	0	0	112	R962 Q963 Q964 S968	R962-I966 WeakPolarHBondContact O-CD1 3.43Å; R962-I966 WeakPolarHBondContact O-CG1 3.37Å; Q963-I966 PolarHBondContact O-N 3.08Å; Q964-I966 PolarHBondContact O-N 3.14Å; I966-S968 PolarHBondContact O-N 3.21Å
967	Q	46.6	Very low	56.6	Low	164 Å²	164	115 Å²	115	77%	0.766	63%	0.634	S	S	*	*	H	α-helix	trans	-79.2	-13.8	-177.7	-71	-171.5	-11.9	0	0	114.4	Q964 H969	Q964-Q967 PolarHBondContact O-N 3.13Å; Q967-H969 VanDerWaalsContact C-N 3.34Å; Q967-H969 PolarHBondContact O-N 3.5Å
968	S	42.9	Very low	53.5	Low	93 Å²	93	117 Å²	117	65%	0.65	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	6.5	-169.1	-60.7	0	0	0	0	115.9	Q964 I966	Q964-S968 PolarHBondContact O-OG 3.23Å; I966-S968 PolarHBondContact O-N 3.21Å
969	H	39.4	Very low	50.6	Low	185 Å²	185	119.9 Å²	119.9	86%	0.856	67%	0.665	S	S	*	*	S	Bend	trans	-122.6	48.3	179.4	-82.5	-29.7	0	0	0	113.2	Q967 K996	Q967-H969 VanDerWaalsContact C-N 3.34Å; Q967-H969 PolarHBondContact O-N 3.5Å; H969-K996 PolarHBondContact CE1-NZ 3.17Å; H969-K996 PolarHBondContact NE2-NZ 3.48Å
970	G	34.8	Very low	47.6	Very low	59 Å²	59	121.8 Å²	121.8	61%	0.608	68%	0.681	S	S	*	*			trans	-154.4	50.7	-174.4	0	0	0	0	0	117.3
971	L	35.3	Very low	44.5	Very low	160 Å²	160	125.5 Å²	125.5	84%	0.838	70%	0.696	S	S	*	*			trans	-166.2	158.8	147.6	-130.7	68.8	0	0	0	113.1
972	H	32.8	Very low	41.5	Very low	173 Å²	173	127.5 Å²	127.5	80%	0.801	71%	0.714	S	S	*	*			trans	75.6	98.7	176.6	-68.4	-80.2	0	0	0	119.7
973	T	30.5	Very low	38.6	Very low	132 Å²	132	123.9 Å²	123.9	81%	0.81	72%	0.722	S	S	*	*			trans	-133.9	137.4	151.2	48.7	0	0	0	0	109.6
974	N	31.6	Very low	35.9	Very low	176 Å²	176	128.8 Å²	128.8	94%	0.941	75%	0.745	S	S	*	*			trans	139.6	132.1	168.7	-78.9	-19	0	0	0	110
975	G	27.9	Very low	33.4	Very low	78 Å²	78	126.1 Å²	126.1	80%	0.804	75%	0.752	S	S	*	*			cis	164.6	123.8	-10.6	0	0	0	0	0	113.3
976	G	27.6	Very low	32	Very low	77 Å²	77	129.1 Å²	129.1	79%	0.794	77%	0.765	S	S	*	*			trans	88	159.1	170.3	0	0	0	0	0	117
977	Q	28.3	Very low	31.5	Very low	166 Å²	166	128.6 Å²	128.6	78%	0.776	77%	0.77	S	S	*	*			cis	-169	130.1	-9.1	-177.3	171.9	-5.5	0	0	111.9
978	M	26.2	Very low	30.6	Very low	144 Å²	144	126.9 Å²	126.9	71%	0.709	78%	0.776	S	S	*	*			trans	61.2	158.7	155.1	-69.1	173	144.9	0	0	119
979	D	25.2	Very low	29.8	Very low	122 Å²	122	126.4 Å²	126.4	65%	0.652	79%	0.785	S	S	*	*			cis	-173.4	170.9	-13.2	-100.5	0.1	0	0	0	107.8
980	T	27.7	Very low	29.2	Very low	100 Å²	100	126 Å²	126	61%	0.613	78%	0.784	S	S	*	*			cis	-164.5	-175.5	-9.3	25.2	0	0	0	0	110.2
981	H	26	Very low	28.8	Very low	156 Å²	156	131.9 Å²	131.9	72%	0.722	80%	0.796	S	S	*	*			trans	87	96.5	148.8	-72.4	-59.3	0	0	0	123.3
982	T	25.3	Very low	28.4	Very low	133 Å²	133	129.4 Å²	129.4	82%	0.816	78%	0.783	S	S	*	*				59	136.4	125.3	55.6	0	0	0	0	122.8
983	G	25.3	Very low	28.2	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	78%	0.782	S	S	*	*			cis	167.5	173.3	-7	0	0	0	0	0	117
984	H	29.8	Very low	28.1	Very low	206 Å²	206	132 Å²	132	95%	0.954	79%	0.787	S	S	*	*			trans	64	121.1	166.8	-78	-77.2	0	0	0	122.4
985	G	24.9	Very low	27.8	Very low	73 Å²	73	130.1 Å²	130.1	75%	0.753	78%	0.777	S	S	*	*			trans	164.9	104.5	162.1	0	0	0	0	0	112.9
986	S	28.2	Very low	27.9	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	77%	0.765	S	S	*	*			trans	-157	171.5	-173.9	-51.5	0	0	0	0	110.2
987	P	45.6	Very low	27.8	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	77%	0.77	S	S	*	*			cis	-136.1	170.5	5.1	42.5	-26.8	0	0	0	116.1
988	S	27.7	Very low	27.7	Very low	128 Å²	128	131.1 Å²	131.1	90%	0.895	77%	0.765	S	S	*	*			trans	176.4	141.5	135.5	-81	0	0	0	0	112.1
989	G	26.7	Very low	27.7	Very low	83 Å²	83	131.9 Å²	131.9	86%	0.856	77%	0.773	S	S	*	*			trans	98.3	86.4	167.1	0	0	0	0	0	116.1
990	Q	26.2	Very low	27.9	Very low	176 Å²	176	134.1 Å²	134.1	82%	0.822	78%	0.784	S	S	*	*			trans	-87.3	146.3	166.5	-97.4	179.6	-93	0	0	111.6	D992	Q990-D992 PolarHBondContact NE2-OD2 2.83Å
991	Q	26.6	Very low	27.9	Very low	183 Å²	183	136.7 Å²	136.7	86%	0.855	80%	0.795	S	S	*	*			trans	-151.4	79.9	173.1	-169.3	174.4	26.1	0	0	109.6	V993	Q991-V993 WeakPolarHBondContact O-CG2 3.36Å
992	D	26.1	Very low	28	Very low	107 Å²	107	134.3 Å²	134.3	57%	0.572	79%	0.791	S	S	*	*			trans	-95.6	124.7	175.3	-51.9	-67.1	0	0	0	107.9	Q990 Y994	Q990-D992 PolarHBondContact NE2-OD2 2.83Å; D992-Y994 HydrophobicContact CB-CE2 4.5Å
993	V	29.8	Very low	28	Very low	130 Å²	130	134.1 Å²	134.1	79%	0.788	79%	0.789	S	S	*	*			cis	64.9	88.9	38.2	-170.2	0	0	0	0	112.3	Q991	Q991-V993 WeakPolarHBondContact O-CG2 3.36Å
994	Y	26.6	Very low	28	Very low	229 Å²	229	138.4 Å²	138.4	90%	0.898	79%	0.791	S	S	*	*			trans	-132.4	125.8	163.9	-90.8	-84.3	0	0	0	110.2	D992	D992-Y994 HydrophobicContact CB-CE2 4.5Å
995	D	26.7	Very low	27.9	Very low	137 Å²	137	134.4 Å²	134.4	73%	0.733	78%	0.781	S	S	*	*			trans	-140.2	154.9	165.2	-176.4	21.6	0	0	0	108.2
996	K	29.7	Very low	28	Very low	130 Å²	130	135.1 Å²	135.1	57%	0.565	77%	0.774	S	S	*	*			trans	57.7	99	177.2	-59.5	-177	-176.5	177.8	0	117.6	H969	H969-K996 PolarHBondContact CE1-NZ 3.17Å; H969-K996 PolarHBondContact NE2-NZ 3.48Å
997	T	25.7	Very low	28.1	Very low	147 Å²	147	137.1 Å²	137.1	90%	0.902	77%	0.774	S	S	*	*				-152.3	131.9	113.7	-72.4	0	0	0	0	107.9
998	G	26	Very low	27.4	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	77%	0.766	S	S	*	*			trans	-112.3	171.7	-172.9	0	0	0	0	0	113.7
999	N	26.1	Very low	27.5	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	76%	0.762	S	S	*	*			trans	-154.4	79.8	163.3	-118.2	-16.1	0	0	0	111.1	N1001	N999-N1001 PolarHBondContact O-N 2.85Å
1000	N	29.3	Very low	27.8	Very low	168 Å²	168	141 Å²	141	90%	0.898	75%	0.745	S	S	*	*			trans	-81.8	91.3	178.7	-80.5	-10.5	0	0	0	111.1
1001	N	27.9	Very low	28.1	Very low	155 Å²	155	140.6 Å²	140.6	83%	0.829	75%	0.747	S	S	*	*			trans	-119.2	85.2	160.8	-100.8	-29.2	0	0	0	110	N999	N999-N1001 PolarHBondContact O-N 2.85Å
1002	T	27.4	Very low	28.2	Very low	106 Å²	106	140.3 Å²	140.3	65%	0.65	75%	0.746	S	S	*	*			trans	-140.6	113.8	164.4	-71.9	0	0	0	0	107.6	E1004	T1002-E1004 PolarHBondContact O-N 3.49Å; T1002-E1004 VanDerWaalsContact O-N 3.09Å
1003	V	26.6	Very low	28.3	Very low	129 Å²	129	139.4 Å²	139.4	78%	0.782	74%	0.744	S	S	*	*			trans	-78	92.5	176.5	-179.7	0	0	0	0	108.2	V1005	V1003-V1005 HydrophobicContact CG1-CG2 4.37Å; V1003-V1005 PolarHBondContact O-N 3.28Å
1004	E	25.6	Very low	28.2	Very low	158 Å²	158	142.9 Å²	142.9	74%	0.738	75%	0.745	S	S	*	*			trans	-65.7	99.9	167.5	-79.4	-160.1	129.9	0	0	109.7	T1002 S1006	T1002-E1004 PolarHBondContact O-N 3.49Å; T1002-E1004 VanDerWaalsContact O-N 3.09Å; E1004-S1006 PolarHBondContact O-N 2.96Å
1005	V	27.4	Very low	28.2	Very low	122 Å²	122	140.9 Å²	140.9	74%	0.739	74%	0.744	S	S	*	*			trans	-69.7	98.7	168.7	-179.9	0	0	0	0	108	V1003 I1007	V1003-V1005 HydrophobicContact CG1-CG2 4.37Å; V1003-V1005 PolarHBondContact O-N 3.28Å; V1005-I1007 PolarHBondContact O-N 2.58Å
1006	S	26.2	Very low	28.1	Very low	88 Å²	88	139.9 Å²	139.9	62%	0.615	74%	0.737	S	S	*	*			trans	-60.8	107	-179.2	-168.2	0	0	0	0	111	E1004 H1008	E1004-S1006 PolarHBondContact O-N 2.96Å; S1006-H1008 PolarHBondContact O-N 3.28Å; S1006-H1008 PolarHBondContact OG-ND1 3.27Å; S1006-H1008 VanDerWaalsContact OG-ND1 3.1Å
1007	I	30.4	Very low	27.9	Very low	160 Å²	160	138.4 Å²	138.4	82%	0.821	74%	0.744	S	S	*	*			trans	-77.6	67.5	176	-50.3	-175.7	0	0	0	109.5	V1005 N1009	V1005-I1007 PolarHBondContact O-N 2.58Å; I1007-N1009 VanDerWaalsContact C-N 3.32Å; I1007-N1009 PolarHBondContact O-N 3.45Å
1008	H	30.1	Very low	27.7	Very low	127 Å²	127	139.5 Å²	139.5	59%	0.588	74%	0.739	S	S	*	*			trans	-78.2	78.6	174.9	-111.8	90	0	0	0	110.9	S1006 R1010	S1006-H1008 PolarHBondContact O-N 3.28Å; S1006-H1008 PolarHBondContact OG-ND1 3.27Å; S1006-H1008 VanDerWaalsContact OG-ND1 3.1Å; H1008-R1010 VanDerWaalsContact C-N 3.33Å; H1008-R1010 PolarHBondContact O-N 3.4Å
1009	N	30.1	Very low	27.7	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	75%	0.746	S	S	*	*			trans	-96.4	55.9	166.7	-159.9	-3.6	0	0	0	111.2	I1007	I1007-N1009 VanDerWaalsContact C-N 3.32Å; I1007-N1009 PolarHBondContact O-N 3.45Å
1010	R	33.7	Very low	27.6	Very low	128 Å²	128	140.2 Å²	140.2	48%	0.483	74%	0.743	S	S	.	*			trans	-85.1	143.8	162.8	-79.5	-165.8	-179.8	-135.9	-4.6	109.3	E952 H1008 Q1012	E952-R1010 VanDerWaalsContact CD-NH2 3.27Å; E952-R1010 IonicContact OE1-CZ 2.69Å; E952-R1010 VanDerWaalsContact OE1-CZ 3.3Å; E952-R1010 IonicContact OE1-NH1 3.61Å; E952-R1010 PolarHBondContact OE1-NH1 2.74Å; E952-R1010 IonicContact OE1-NH2 3.66Å; E952-R1010 PolarHBondContact OE1-NH2 3.15Å; E952-R1010 IonicContact OE2-CZ 2.85Å; E952-R1010 IonicContact OE2-NH1 3.05Å; E952-R1010 IonicContact OE2-NH2 3.16Å; E952-R1010 PolarHBondContact OE2-NH2 3.34Å; H1008-R1010 VanDerWaalsContact C-N 3.33Å; H1008-R1010 PolarHBondContact O-N 3.4Å; R1010-Q1012 VanDerWaalsContact C-N 3.33Å; R1010-Q1012 PolarHBondContact O-N 3.49Å
1011	L	33.2	Very low	27.5	Very low	168 Å²	168	139.6 Å²	139.6	88%	0.88	74%	0.738	S	S	*	*			trans	-64.2	86.6	170.4	-75.5	157.9	0	0	0	110.9	T1013	L1011-T1013 VanDerWaalsContact C-N 3.35Å; L1011-T1013 PolarHBondContact O-N 3.11Å
1012	Q	28.3	Very low	27.3	Very low	177 Å²	177	140.3 Å²	140.3	83%	0.827	74%	0.736	S	S	*	*			trans	-74.4	88.7	169.6	-74.3	-169.1	-11.4	0	0	110.2	R1010	R1010-Q1012 VanDerWaalsContact C-N 3.33Å; R1010-Q1012 PolarHBondContact O-N 3.49Å
1013	T	28.4	Very low	27.2	Very low	87 Å²	87	141.3 Å²	141.3	53%	0.534	75%	0.747	S	S	.	*	P	Polyproline II helix	trans	-76	127.2	165.8	-37	0	0	0	0	108.7	L1011 Q1015	L1011-T1013 VanDerWaalsContact C-N 3.35Å; L1011-T1013 PolarHBondContact O-N 3.11Å; T1013-Q1015 PolarHBondContact O-N 3.19Å
1014	Y	26.6	Very low	27	Very low	204 Å²	204	139.6 Å²	139.6	80%	0.8	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-56.6	134	-179.1	-76.4	-103.4	0	0	0	112.4
1015	Q	26.7	Very low	27.5	Very low	187 Å²	187	137.4 Å²	137.4	87%	0.874	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-84.1	118.7	159.4	-75.5	-174.7	-14.7	0	0	109.6	T1013	T1013-Q1015 PolarHBondContact O-N 3.19Å
1016	L	25.2	Very low	27.3	Very low	115 Å²	115	139.7 Å²	139.7	60%	0.602	75%	0.754	S	S	*	*			trans	-149.2	109.6	156.9	-124.1	112.2	0	0	0	110.5
1017	S	24.2	Very low	27.3	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	77%	0.765	S	S	*	*			trans	23.4	118	150.3	55.2	0	0	0	0	119.7
1018	Q	23.3	Very low	27	Very low	171 Å²	171	141.5 Å²	141.5	80%	0.799	77%	0.771	S	S	*	*			trans	-74	153.4	156.1	-73	-171.1	-9.9	0	0	111.5
1019	P	25.8	Very low	26.8	Very low	126 Å²	126	140.5 Å²	140.5	82%	0.818	79%	0.785	S	S	*	*			trans	-88.2	159.2	-178.8	35.7	-36.3	0	0	0	113.9
1020	S	23.6	Very low	26.7	Very low	115 Å²	115	137.9 Å²	137.9	80%	0.804	79%	0.785	S	S	*	*			trans	-132	115.3	179.8	55.7	0	0	0	0	112.5
1021	I	27.5	Very low	27	Very low	154 Å²	154	137.6 Å²	137.6	79%	0.79	80%	0.8	S	S	*	*			trans	-153.2	137.1	176.2	-67.7	-176.4	0	0	0	106.4
1022	E	23.6	Very low	27.3	Very low	171 Å²	171	135.1 Å²	135.1	80%	0.799	79%	0.794	S	S	*	*			cis	-164.2	150.8	-14.3	-108.5	179.9	159.6	0	0	107.4
1023	S	23.8	Very low	27.2	Very low	126 Å²	126	132.7 Å²	132.7	88%	0.881	79%	0.791	S	S	*	*			trans	-174.5	120.4	137	16.2	0	0	0	0	112.2
1024	A	24.3	Very low	27	Very low	93 Å²	93	135.6 Å²	135.6	77%	0.769	80%	0.802	S	S	*	*			trans	-97.5	-174.7	165.6	0	0	0	0	0	108.8
1025	P	35.9	Very low	26.8	Very low	112 Å²	112	133.7 Å²	133.7	73%	0.727	81%	0.805	S	S	*	*			cis	-138.5	177.9	3.6	43.4	-26.6	0	0	0	116
1026	L	23.1	Very low	26.7	Very low	171 Å²	171	129.7 Å²	129.7	90%	0.895	80%	0.798	S	S	*	*				174.7	119.5	126.5	-98.2	167.3	0	0	0	112.5
1027	A	26.2	Very low	27.2	Very low	102 Å²	102	129.3 Å²	129.3	84%	0.843	80%	0.802	S	S	*	*			trans	167.7	143	139.9	0	0	0	0	0	111.4
1028	L	24.4	Very low	27.1	Very low	184 Å²	184	130.4 Å²	130.4	96%	0.963	80%	0.804	S	S	*	*			trans	-135.4	128.7	175.3	-89.1	160.4	0	0	0	109.6
1029	A	25.6	Very low	27.1	Very low	105 Å²	105	130.8 Å²	130.8	87%	0.868	81%	0.806	S	S	*	*			trans	-162.7	143.3	158.8	0	0	0	0	0	110.2
1030	A	26.6	Very low	27	Very low	100 Å²	100	129 Å²	129	83%	0.826	80%	0.802	S	S	*	*			trans	-107.2	150.6	-168	0	0	0	0	0	114.4
1031	P	41.4	Very low	27	Very low	123 Å²	123	126.8 Å²	126.8	80%	0.799	80%	0.797	S	S	*	*			trans	-124.8	142.3	177.3	39.5	-27.5	0	0	0	117.2
1032	P	39.5	Very low	26.8	Very low	116 Å²	116	128.3 Å²	128.3	75%	0.753	80%	0.801	S	S	*	*			trans	-94.1	-179.4	152.8	39.6	-32.9	0	0	0	110.4
1033	T	25	Very low	26.8	Very low	125 Å²	125	127.8 Å²	127.8	77%	0.767	80%	0.803	S	S	*	*			cis	-149.4	157.9	-2.6	-3.6	0	0	0	0	105.5
1034	L	23.9	Very low	26.8	Very low	149 Å²	149	132.4 Å²	132.4	78%	0.78	80%	0.801	S	S	*	*			cis	71.8	91.8	34.1	-90.1	-179.1	0	0	0	117
1035	L	23.7	Very low	27.7	Very low	164 Å²	164	133 Å²	133	86%	0.859	80%	0.797	S	S	*	*				168.3	159.6	109.4	-90.1	163.3	0	0	0	115
1036	S	24.7	Very low	27.2	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	80%	0.795	S	S	*	*			trans	-98.4	-164.6	176.9	58.4	0	0	0	0	110.3
1037	P	36.2	Very low	27.5	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	78%	0.781	S	S	*	*			cis	-150.4	-167.7	20	41.8	-16.7	0	0	0	118
1038	V	21.4	Very low	27.6	Very low	123 Å²	123	133.3 Å²	133.3	75%	0.745	78%	0.777	S	S	*	*			trans	46.5	133.4	136.1	159.6	0	0	0	0	119.4
1039	Q	23.7	Very low	27.7	Very low	178 Å²	178	131 Å²	131	83%	0.832	77%	0.765	S	S	*	*			cis	-165.7	-159.9	9.7	-131.2	179.6	-27.9	0	0	109.2
1040	A	23.8	Very low	27.7	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	76%	0.757	S	S	*	*			cis	-166.5	174.5	-4.3	0	0	0	0	0	110.5
1041	G	23.3	Very low	27.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	75%	0.751	S	S	*	*			trans	112.5	110.3	162.2	0	0	0	0	0	114.9
1042	E	23.3	Very low	26.9	Very low	186 Å²	186	136 Å²	136	87%	0.869	75%	0.752	S	S	*	*				74.1	132.1	79.2	-93.9	-175.7	163.9	0	0	114.1
1043	L	23.8	Very low	26.4	Very low	161 Å²	161	138.7 Å²	138.7	84%	0.843	76%	0.755	S	S	*	*			cis	-136.6	-174.2	33	-83.9	166.6	0	0	0	115.6
1044	R	22.8	Very low	26.5	Very low	222 Å²	222	141 Å²	141	84%	0.838	76%	0.761	S	S	*	*			trans	-117.9	-174	-174.6	-122.9	-171.3	179.9	153.7	-0.5	111.9
1045	P	42.9	Very low	26.5	Very low	105 Å²	105	139.3 Å²	139.3	68%	0.682	76%	0.757	S	S	*	*			cis	-120.7	-158	24.4	42.4	-24.2	0	0	0	113.2
1046	E	26.8	Very low	26.5	Very low	149 Å²	149	140.3 Å²	140.3	70%	0.696	75%	0.754	S	S	*	*			cis	-149.5	-153.3	2.3	-158.5	27.2	-86.1	0	0	112.8
1047	T	28.4	Very low	26.5	Very low	98 Å²	98	141.4 Å²	141.4	60%	0.601	76%	0.756	S	S	*	*			trans	-149.7	-175.2	-159.8	-37.7	0	0	0	0	113.3
1048	L	27.9	Very low	25.9	Very low	145 Å²	145	143.7 Å²	143.7	76%	0.759	76%	0.761	S	S	*	*			trans	92.4	137.7	164.9	-47.6	-178.6	0	0	0	117.2
1049	I	27.9	Very low	26	Very low	136 Å²	136	143.5 Å²	143.5	70%	0.697	76%	0.759	S	S	*	*			cis	-152.2	155.3	-4.2	-127.8	165.2	0	0	0	115.6
1050	Q	25.5	Very low	26.3	Very low	153 Å²	153	142 Å²	142	72%	0.715	76%	0.762	S	S	*	*			trans	-7.3	144.9	166.5	-69.2	-178.1	-65.2	0	0	127.4
1051	C	24.9	Very low	26.4	Very low	101 Å²	101	144.2 Å²	144.2	68%	0.682	76%	0.762	S	S	*	*				64.7	160.9	129.1	-62.4	0	0	0	0	121.5
1052	Q	25.8	Very low	27	Very low	178 Å²	178	149.8 Å²	149.8	83%	0.832	77%	0.77	S	S	*	*			cis	-148.7	171	2.4	-147.4	154.8	80.1	0	0	112.8
1053	Q	28.2	Very low	27.3	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.813	77%	0.767	S	S	*	*			trans	-94.1	159.9	174.2	-56	169.6	-75.5	0	0	112.8
1054	I	28.5	Very low	28	Very low	172 Å²	172	142.1 Å²	142.1	88%	0.882	76%	0.761	S	S	*	*			trans	-159.1	166.9	149	-110.6	157.1	0	0	0	111.6
1055	V	23.6	Very low	28.2	Very low	115 Å²	115	143.7 Å²	143.7	70%	0.697	77%	0.767	S	S	*	*			trans	-137.3	138.2	-157.6	-176.7	0	0	0	0	113.8
1056	K	23.8	Very low	27.3	Very low	185 Å²	185	142.2 Å²	142.2	80%	0.804	77%	0.771	S	S	*	*			trans	158.9	137.1	144.5	-87.7	161.3	-176.8	-179.9	0	108.8
1057	V	23.9	Very low	27.2	Very low	125 Å²	125	144.8 Å²	144.8	76%	0.758	77%	0.774	S	S	*	*			cis	74.8	139	43.9	-176.2	0	0	0	0	112.6
1058	I	24.8	Very low	26.9	Very low	155 Å²	155	149.1 Å²	149.1	80%	0.795	79%	0.789	S	S	*	*			trans	98.9	137.6	-178.7	-61	175.5	0	0	0	113.6
1059	V	23.3	Very low	26.7	Very low	118 Å²	118	148.6 Å²	148.6	72%	0.715	78%	0.783	S	S	*	*			cis	-159	161.6	-22.8	135.6	0	0	0	0	106.6
1060	V	29.3	Very low	27	Very low	146 Å²	146	146.4 Å²	146.4	89%	0.885	79%	0.785	S	S	*	*			trans	-96.3	130.9	163.9	178.2	0	0	0	0	109.9
1061	D	25.8	Very low	26.9	Very low	136 Å²	136	147.8 Å²	147.8	73%	0.727	79%	0.789	S	S	*	*			trans	-133.3	167.4	174.1	-164.2	22.3	0	0	0	113.1	S1063	D1061-S1063 PolarHBondContact O-N 3.16Å
1062	Q	36.1	Very low	26.9	Very low	186 Å²	186	150 Å²	150	87%	0.869	79%	0.794	S	S	*	*	S	Bend	trans	-97.3	76	-155.1	-57.1	177.3	21.4	0	0	114
1063	S	30	Very low	26.9	Very low	117 Å²	117	146 Å²	146	82%	0.818	79%	0.785	S	S	*	*			trans	-156.3	145.9	154.7	48.1	0	0	0	0	111.4	D1061	D1061-S1063 PolarHBondContact O-N 3.16Å
1064	G	37.4	Very low	26.8	Very low	69 Å²	69	146.9 Å²	146.9	71%	0.711	79%	0.79	S	S	*	*			trans	-89.5	147.2	-176.7	0	0	0	0	0	113.6
1065	R	27.4	Very low	26.6	Very low	255 Å²	255	141.9 Å²	141.9	96%	0.962	78%	0.78	S	S	*	*			trans	97.1	150.9	173.6	-55.6	171.1	-179.4	-88.7	2.2	115.9
1066	G	24.1	Very low	27.4	Very low	74 Å²	74	142.5 Å²	142.5	76%	0.763	79%	0.787	S	S	*	*			trans	101.4	99.2	-175.8	0	0	0	0	0	110.7
1067	R	24.8	Very low	27.6	Very low	202 Å²	202	137.9 Å²	137.9	76%	0.762	78%	0.783	S	S	*	*			cis	66.4	118.8	45	-161.6	-162.7	-168.3	-167.1	12.4	112.9	E1069	R1067-E1069 VanDerWaalsContact CZ-CD 3.41Å; R1067-E1069 IonicContact CZ-OE1 2.75Å; R1067-E1069 IonicContact CZ-OE2 3.94Å; R1067-E1069 VanDerWaalsContact NE-CD 3.33Å; R1067-E1069 IonicContact NE-OE1 3.34Å; R1067-E1069 PolarHBondContact NE-OE1 3.41Å; R1067-E1069 VanDerWaalsContact NE-OE1 3.1Å; R1067-E1069 IonicContact NE-OE2 3.92Å; R1067-E1069 PolarHBondContact NE-OE2 2.99Å; R1067-E1069 IonicContact NH1-OE2 3.59Å; R1067-E1069 IonicContact NH2-OE1 2.7Å; R1067-E1069 PolarHBondContact NH2-OE1 3.39Å; R1067-E1069 IonicContact NH2-OE2 3.95Å; R1067-E1069 PolarHBondContact NH2-OE2 3.2Å
1068	M	23	Very low	27.7	Very low	189 Å²	189	137.9 Å²	137.9	93%	0.931	78%	0.783	S	S	*	*			trans	-141.7	139.4	149.3	-142	169.1	-168.8	0	0	108.7
1069	E	22	Very low	27.9	Very low	134 Å²	134	138.2 Å²	138.2	63%	0.626	78%	0.781	S	S	*	*			trans	-105.5	174.8	177.2	-79.9	167.1	170.6	0	0	110.4	R1067	R1067-E1069 VanDerWaalsContact CZ-CD 3.41Å; R1067-E1069 IonicContact CZ-OE1 2.75Å; R1067-E1069 IonicContact CZ-OE2 3.94Å; R1067-E1069 VanDerWaalsContact NE-CD 3.33Å; R1067-E1069 IonicContact NE-OE1 3.34Å; R1067-E1069 PolarHBondContact NE-OE1 3.41Å; R1067-E1069 VanDerWaalsContact NE-OE1 3.1Å; R1067-E1069 IonicContact NE-OE2 3.92Å; R1067-E1069 PolarHBondContact NE-OE2 2.99Å; R1067-E1069 IonicContact NH1-OE2 3.59Å; R1067-E1069 IonicContact NH2-OE1 2.7Å; R1067-E1069 PolarHBondContact NH2-OE1 3.39Å; R1067-E1069 IonicContact NH2-OE2 3.95Å; R1067-E1069 PolarHBondContact NH2-OE2 3.2Å
1070	A	35.7	Very low	27.9	Very low	90 Å²	90	140.4 Å²	140.4	74%	0.744	78%	0.784	S	S	*	*			trans	-71.6	-173.1	-176.2	0	0	0	0	0	113.5
1071	F	22.7	Very low	27.8	Very low	182 Å²	182	139.3 Å²	139.3	80%	0.798	77%	0.772	S	S	*	*				-178.7	132.5	125.5	-109.4	-134.9	0	0	0	113.6
1072	L	25.4	Very low	27.7	Very low	148 Å²	148	140.4 Å²	140.4	78%	0.775	78%	0.777	S	S	*	*			trans	63.6	156.6	147	-59.7	-176.9	0	0	0	120
1073	S	25.6	Very low	27.2	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	77%	0.769	S	S	*	*			cis	-169.5	-176.7	-14	51.6	0	0	0	0	108.5
1074	Q	26.2	Very low	27.1	Very low	194 Å²	194	137.6 Å²	137.6	91%	0.907	76%	0.761	S	S	*	*			cis	-139.2	-131.6	16.1	-59.5	-176.7	6.2	0	0	112.6
1075	G	23.8	Very low	26.5	Very low	67 Å²	67	138.7 Å²	138.7	69%	0.691	76%	0.763	S	S	*	*			trans	-141.7	-142.3	-178.5	0	0	0	0	0	112.8
1076	P	39.5	Very low	26.6	Very low	127 Å²	127	135.1 Å²	135.1	83%	0.825	76%	0.759	S	S	*	*			cis	-144.1	169.2	5	43.4	-24.9	0	0	0	119.1
1077	A	29.1	Very low	26.7	Very low	88 Å²	88	137.5 Å²	137.5	73%	0.727	77%	0.765	S	S	*	*			trans	53.7	140.8	146.6	0	0	0	0	0	122.6
1078	T	26.6	Very low	26.7	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	77%	0.768	S	S	*	*				-171.4	148.2	61	31.9	0	0	0	0	114.4
1079	H	27.4	Very low	28.1	Very low	162 Å²	162	131 Å²	131	75%	0.75	76%	0.76	S	S	*	*			trans	58.2	146.7	153.4	-84.3	-130.3	0	0	0	121
1080	Q	24.8	Very low	28.3	Very low	164 Å²	164	131.8 Å²	131.8	77%	0.766	77%	0.774	S	S	*	*			cis	-146.6	165.6	3.1	-152	159.8	14	0	0	112.3
1081	L	26.3	Very low	28	Very low	123 Å²	123	138.4 Å²	138.4	64%	0.644	78%	0.779	S	S	*	*			trans	-83	165.7	-176.8	-84.8	77.2	0	0	0	112.7	Q1083	L1081-Q1083 HydrophobicContact CD2-CG 4.42Å
1082	I	24.1	Very low	28.2	Very low	160 Å²	160	136.2 Å²	136.2	82%	0.821	78%	0.781	S	S	*	*				-162.3	128.1	67.2	-76.2	155.9	0	0	0	107.9
1083	Q	26	Very low	28.4	Very low	151 Å²	151	138.6 Å²	138.6	71%	0.706	78%	0.779	S	S	*	*			cis	72.4	138.6	48.5	-91.4	-169	8.3	0	0	115.1	L1081	L1081-Q1083 HydrophobicContact CD2-CG 4.42Å
1084	S	26.5	Very low	28.5	Very low	93 Å²	93	141.9 Å²	141.9	65%	0.65	78%	0.784	S	S	*	*			cis	-159.9	165.7	12.1	-87.9	0	0	0	0	112.6
1085	A	26.2	Very low	28.6	Very low	92 Å²	92	136.2 Å²	136.2	76%	0.76	78%	0.778	S	S	*	*			trans	59.4	137.1	151.6	0	0	0	0	0	120.4
1086	M	29.5	Very low	28.8	Very low	179 Å²	179	141.5 Å²	141.5	88%	0.882	79%	0.791	S	S	*	*			cis	77.9	99.9	36.4	-67.8	-79.6	155.6	0	0	115.8
1087	S	25.1	Very low	28.4	Very low	125 Å²	125	138.8 Å²	138.8	87%	0.874	79%	0.785	S	S	*	*			trans	-169	151.6	143.6	-83.1	0	0	0	0	112
1088	T	25.3	Very low	28.9	Very low	137 Å²	137	141 Å²	141	84%	0.84	79%	0.792	S	S	*	*			trans	-110.1	-160.3	176.6	50.1	0	0	0	0	110.5
1089	P	53.4	Low	29.3	Very low	116 Å²	116	142.5 Å²	142.5	75%	0.753	79%	0.791	S	S	*	*				-115.3	176.1	-92.8	39.8	-26	0	0	0	113.1
1090	V	25.5	Very low	30	Very low	151 Å²	151	139.8 Å²	139.8	92%	0.915	79%	0.787	S	S	*	*			trans	-160.8	158.8	160.3	119.4	0	0	0	0	113
1091	R	29	Very low	30.7	Very low	229 Å²	229	138 Å²	138	86%	0.864	79%	0.79	S	S	*	*			trans	-91.7	161.4	174	-71.8	173.9	163.7	172.5	-6	111.3
1092	V	27	Very low	31.3	Very low	136 Å²	136	138.8 Å²	138.8	82%	0.824	79%	0.794	S	S	*	*				161.2	117	123	158.9	0	0	0	0	113.1
1093	R	29.3	Very low	32.5	Very low	199 Å²	199	136.3 Å²	136.3	75%	0.751	79%	0.789	S	S	*	*			trans	37.1	128	131.9	-160.2	177.2	173.1	130.9	21.5	122.9
1094	E	28.3	Very low	33.6	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.752	79%	0.79	S	S	*	*			trans	58.2	137.6	150	-69.4	161.9	-176.1	0	0	121.4
1095	G	27.2	Very low	34.6	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	80%	0.796	S	S	*	*			trans	159.1	122.8	167.9	0	0	0	0	0	114.4
1096	D	28.9	Very low	35.4	Very low	179 Å²	179	137 Å²	137	96%	0.957	80%	0.796	S	S	*	*			trans	-50.7	148.2	-169.5	-59.2	-63.9	0	0	0	119.2
1097	G	32.1	Very low	36	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	79%	0.787	S	S	*	*			trans	-167.7	146.2	168.3	0	0	0	0	0	112
1098	P	38.7	Very low	36.7	Very low	135 Å²	135	133.1 Å²	133.1	88%	0.877	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.2	141.4	-160.6	28.5	-35.6	0	0	0	115.6
1099	Q	34.3	Very low	37.1	Very low	157 Å²	157	137.2 Å²	137.2	73%	0.734	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-87	129.4	-177.5	-177.9	-179.6	7.1	0	0	112.1
1100	P	41.9	Very low	36.2	Very low	104 Å²	104	138.9 Å²	138.9	68%	0.675	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-72.5	151.5	167.4	31.2	-33.9	0	0	0	111
1101	P	39.5	Very low	36.6	Very low	126 Å²	126	140.2 Å²	140.2	82%	0.818	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.9	139.8	-170.4	27	-35.2	0	0	0	113.1
1102	L	40.6	Very low	36.8	Very low	140 Å²	140	134.9 Å²	134.9	73%	0.733	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-68.2	146.1	169.3	-68.4	169.3	0	0	0	110.6
1103	P	47.8	Very low	37	Very low	109 Å²	109	137.1 Å²	137.1	71%	0.708	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-65.5	151.2	168.5	29.7	-34.7	0	0	0	110.8
1104	P	50.6	Low	37.1	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.8	151.8	177.3	29.1	-35.2	0	0	0	111.6
1105	P	46.8	Very low	37.1	Very low	117 Å²	117	138.9 Å²	138.9	76%	0.76	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.4	150.9	174.6	29	-35.2	0	0	0	111.4
1106	P	43.3	Very low	37.2	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-65.9	149.7	176.9	28.6	-35.1	0	0	0	111.6
1107	P	42.3	Very low	37.7	Very low	108 Å²	108	138 Å²	138	70%	0.701	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-68.1	152	175.2	30.2	-35.3	0	0	0	111.4
1108	P	39.9	Very low	38.2	Very low	116 Å²	116	140.9 Å²	140.9	75%	0.753	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.6	133.6	177.3	28.1	-34.3	0	0	0	111.5	N1110	P1108-N1110 PolarHBondContact O-N 2.76Å
1109	Y	33.6	Very low	37.9	Very low	223 Å²	223	141.9 Å²	141.9	88%	0.875	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.3	122.8	167.8	-88.1	-98.4	0	0	0	109.9
1110	N	33.6	Very low	37.8	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	79%	0.791	S	S	*	*			trans	-106.8	122.2	171.8	-98.3	-30.2	0	0	0	110.4	P1108	P1108-N1110 PolarHBondContact O-N 2.76Å
1111	H	34.7	Very low	38	Very low	179 Å²	179	140.9 Å²	140.9	83%	0.829	80%	0.797	S	S	*	*			trans	-75.9	130.4	172.3	-66.7	-94.6	0	0	0	110.6	H1113	H1111-H1113 PolarHBondContact O-N 2.94Å; H1111-H1113 VanDerWaalsContact O-N 3.16Å
1112	P	32.7	Very low	37.7	Very low	117 Å²	117	142.6 Å²	142.6	76%	0.76	80%	0.796	S	S	*	*	S	Bend	trans	-90.7	64.4	-174.5	36.4	-36.9	0	0	0	113.5
1113	H	32	Very low	38	Very low	182 Å²	182	140.3 Å²	140.3	84%	0.843	79%	0.79	S	S	*	*			trans	-152.9	75.9	168.3	-86.3	-49.8	0	0	0	114.6	H1111	H1111-H1113 PolarHBondContact O-N 2.94Å; H1111-H1113 VanDerWaalsContact O-N 3.16Å
1114	Q	31	Very low	37.1	Very low	192 Å²	192	142.9 Å²	142.9	90%	0.897	79%	0.79	S	S	*	*			trans	-170.5	131.1	142.3	-107.9	165.2	41.4	0	0	109.8
1115	F	28.1	Very low	36.1	Very low	205 Å²	205	144.2 Å²	144.2	90%	0.899	79%	0.786	S	S	*	*			trans	-147.7	116	176.6	-143.2	-81.7	0	0	0	109.2
1116	C	29.8	Very low	35.4	Very low	116 Å²	116	146.6 Å²	146.6	78%	0.784	79%	0.787	S	S	*	*			trans	-123.3	143	173.5	-70.9	0	0	0	0	109.1
1117	P	38.3	Very low	34.7	Very low	119 Å²	119	145.3 Å²	145.3	77%	0.773	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-78.4	163.8	-177.5	32.6	-35.5	0	0	0	113.3
1118	P	43.5	Very low	34	Very low	131 Å²	131	148.5 Å²	148.5	85%	0.851	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-91.7	162.5	-162.9	35.8	-37.8	0	0	0	116.8
1119	D	32.2	Very low	34.5	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-83.8	154.2	-174	-65	-69.1	0	0	0	117.1
1120	S	32.3	Very low	34.3	Very low	116 Å²	116	144 Å²	144	81%	0.811	78%	0.783	S	S	*	*			trans	175.9	153.5	133.3	-83.1	0	0	0	0	112.3
1121	P	46.4	Very low	34.1	Very low	124 Å²	124	142 Å²	142	81%	0.805	78%	0.777	S	S	*	*			cis	-131.9	179.9	-16.5	37.4	-18.7	0	0	0	115.1
1122	M	32.9	Very low	33.8	Very low	163 Å²	163	143.5 Å²	143.5	80%	0.803	78%	0.775	S	S	*	*			trans	-51.7	168.7	172.2	-79.7	-77.8	-78.7	0	0	115.8
1123	P	47	Very low	33.6	Very low	91 Å²	91	146.4 Å²	146.4	59%	0.591	77%	0.771	S	S	*	*			cis	-147.3	176.5	27.5	28	-1	0	0	0	120.4
1124	F	28.7	Very low	33.4	Very low	164 Å²	164	147.1 Å²	147.1	72%	0.719	77%	0.766	S	S	*	*			trans	117.4	129.1	138.8	-80	-59.4	0	0	0	123.7
1125	H	30.3	Very low	33.2	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.657	76%	0.758	S	S	*	*			trans	76.7	114.7	144	-78.2	-64.9	0	0	0	125.3
1126	H	30.5	Very low	33.2	Very low	168 Å²	168	138.8 Å²	138.8	78%	0.778	74%	0.744	S	S	*	*			trans	89.3	130.2	133.5	-78.8	-55.5	0	0	0	125.2
1127	A	29.3	Very low	33.1	Very low	90 Å²	90	138.9 Å²	138.9	74%	0.744	75%	0.746	S	S	*	*			trans	81.2	81	134.7	0	0	0	0	0	122.1
1128	M	26.7	Very low	32.6	Very low	175 Å²	175	136.4 Å²	136.4	86%	0.862	74%	0.742	S	S	*	*				-27.8	165.3	121.2	-79	-72.9	-176.4	0	0	116.1
1129	P	51	Low	31.9	Very low	98 Å²	98	135.4 Å²	135.4	64%	0.636	74%	0.738	S	S	*	*			cis	-146.9	-162.8	-11.8	31.6	-5.6	0	0	0	115.9
1130	L	29.7	Very low	31.8	Very low	145 Å²	145	139.6 Å²	139.6	76%	0.759	74%	0.742	S	S	*	*			trans	96.8	118.1	143.1	-74.2	168.8	0	0	0	123.3
1131	T	29.5	Very low	31.5	Very low	111 Å²	111	138.6 Å²	138.6	68%	0.681	74%	0.735	S	S	*	*			trans	74.4	105.9	133.8	49.8	0	0	0	0	124.9
1132	R	28.1	Very low	30.8	Very low	209 Å²	209	140 Å²	140	79%	0.789	73%	0.734	S	S	*	*				69.4	129.6	97.4	-157.9	-165.2	-162.3	-165.2	9.4	120.1
1133	R	27.6	Very low	31.1	Very low	179 Å²	179	142.2 Å²	142.2	68%	0.675	76%	0.757	S	S	*	*			trans	95.7	108.9	143.7	-109.8	-176.8	-175.8	-160.3	2.4	120.1
1134	R	27.9	Very low	30.3	Very low	196 Å²	196	144.8 Å²	144.8	74%	0.74	77%	0.765	S	S	*	*				68.5	141.2	121.6	-99.4	-168.3	176.8	-178.3	-2	121.1
1135	N	27.7	Very low	30.4	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	77%	0.767	S	S	*	*			trans	67.9	152.8	155.7	-63.3	20.8	0	0	0	115
1136	S	27.7	Very low	30.4	Very low	87 Å²	87	143.9 Å²	143.9	61%	0.608	77%	0.773	S	S	*	*			cis	-179.7	168.7	-27.9	54.9	0	0	0	0	105.7
1137	S	27.4	Very low	30.4	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	77%	0.773	S	S	*	*			trans	60.1	146.2	157.4	48.9	0	0	0	0	118.7
1138	G	28.1	Very low	30.5	Very low	67 Å²	67	145.8 Å²	145.8	69%	0.691	78%	0.775	S	S	*	*			trans	121.9	60.6	158.8	0	0	0	0	0	117
1139	S	28.8	Very low	30.7	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	77%	0.769	S	S	*	*			trans	15.8	147.6	130.3	51.5	0	0	0	0	121.4
1140	R	30.5	Very low	29.3	Very low	244 Å²	244	147.1 Å²	147.1	92%	0.921	78%	0.779	S	S	*	*			trans	75.7	145.6	166.6	-69.3	177.6	165.6	-172.9	-6	115.6
1141	S	26.5	Very low	29.3	Very low	94 Å²	94	147.2 Å²	147.2	66%	0.657	78%	0.78	S	S	*	*			cis	-170.9	158.5	-14.8	-178.1	0	0	0	0	108.3
1142	I	31.5	Very low	29.2	Very low	155 Å²	155	150.3 Å²	150.3	80%	0.795	79%	0.788	S	S	*	*			trans	70.9	123.9	174.3	-53.3	133	0	0	0	112.3
1143	V	39	Very low	29.3	Very low	209 Å²	209	144.9 Å²	144.9	100%	1.267	79%	0.788	S	S	*	*			cis	-103.8	0	1.3	179.9	0	0	0	0	110.2

Retrieved 1,143 of 1,143 residues in 170.6 ms (Link to these results)

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