A0A5K4FBR2_SCHMA Loading...

Helicase ATP-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBR2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,306 aa.

						>A0A5K4FBR2_SCHMA|A0A5K4FBR2
MTDDYPDAVSSENRITKADDERDVKGSTVVSERMVSVIEAPDYLASFNIDTGGEAEGSSMPHYIVNLNMYNTNTDMDALTTLPIHGQDPDIGESSVSLPTSDMNSPVIMNDNVGLMCGVSSTGRGQQFFTPTMRSKARGRGRFSSVPLDDVMEKKIRTYEGKDCVQELGKLLKLFPRFKRAYINRVFTRNMLSYEKSYEQLKEEDDRERERCSKVRLIQAPKAESKRPTDSKTHNRPELPLQSQAFLCMGLPLGRCPPHVANSLYRRVIVTPEGTVESADEHEQKFLDSTGLSSSALETPSSHCEPPRPKPSLFTGLKISPVSTVLPPIHQLAEFKQSPPRPSEEQMLTSDNNAETLNSEETTIQQSGNKFFRTDHVSEAQKKKRGYINREMRTATVSTPVSRPIITASAVRSDLDSDDSSRKPGDAVKYLAKVGVVSNLVSRKRPTRRGKSTRQKLTTEIQEVNNETSTSPAVEVITEDDGLDLTNAERCHLLSFFNDAVLEELTLMPGCSRKTAQAIINMRPFKNTKDLVSQLSGVRHLSSNLYECCKDILEVRSSVIRLLNKCERLTEQVASHATRLLENTIDLPANAITDQNQSDGVDHEHDDFSINKTNGNPVQLVTQQPAILNPLRELKPYQLVGLNWLRLLHHEQVNGILADEMGLGKTVQAIAFLASLWESGNRGPHLIICPSSTQDNWQRELSLWCPHLKVLVYQGSAEQRKAIRLKIYESESQPDFNILLTSYAVGTSAIEDRALMKRINFHYGIFDEAHMLKNMTSQRYRNLMNFRVQRRLLLTGTPLQNNLLELVSLLSFVMPEMFLKSTDLLKRIFQIYSKPMNSREEDQSANNSPIRSSFEEERLVQAKSLLQPFCLRRLKSQVLGQLPPKTSEVVLVAMTKTQATHYHDLVKRLRSQRSLKDTNSNGQDPSLLLNNECEDGDENADPDASDPKGEYAPRKKARLDNYTTVNGTKSFPVTSKSISESLQSPCNMVTALRKAANHQALFSGLAYTDSNLRDIAESLHLDPSHSNADPNLIYEDLLAMSDHQIHKLCQFYETLSSYTLSPESIISGSGKIQWLNDNLPKLVSEGHRILIFSQFVIMLDILEEFLRITNRRYIRMDGSTPVSERQTLIDRFNSSSIEVFLLSTRAGGLGINLTGADTVIIHDIDFNPYNDRQAEDRCHRLGQKNPVHVIRLISEGTLEEGMLRIASEKLQMEQNVTGCVSEYNTEQTEESEDTTRVSSRSRRSKSTNILPPSSLDGMTENGNVFKVLGNWNSAASDLSLSIVNPISSNRISERDVRSLLSDALKL
					

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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	38	Very low	36.7	Very low	229 Å²	229	139 Å²	139	100%	1.128	79%	0.793	S	S	*	*				0	67	0	-70.2	177.3	177.2	0	0	106.1
2	T	35.6	Very low	36.4	Very low	114 Å²	114	142.3 Å²	142.3	70%	0.699	80%	0.796	S	S	*	*				89.8	128.5	53.6	65.2	0	0	0	0	112.9
3	D	35.4	Very low	36.4	Very low	131 Å²	131	142.3 Å²	142.3	70%	0.701	79%	0.793	S	S	*	*			cis	-161.2	162.6	-21.5	-87.3	-37.3	0	0	0	107.2
4	D	38	Very low	36.2	Very low	127 Å²	127	147.1 Å²	147.1	68%	0.679	79%	0.793	S	S	*	*			trans	17.4	132	152.6	-44.1	-30	0	0	0	122.6
5	Y	39.8	Very low	36.3	Very low	218 Å²	218	146.9 Å²	146.9	86%	0.855	79%	0.789	S	S	*	*				169.1	147.3	100.9	-109.5	-83.7	0	0	0	113.7
6	P	43.4	Very low	36.3	Very low	97 Å²	97	145.1 Å²	145.1	63%	0.63	79%	0.786	S	S	*	*			trans	-116.6	-173.1	177.1	42.8	-35	0	0	0	115.9
7	D	33.6	Very low	36.2	Very low	144 Å²	144	146.4 Å²	146.4	77%	0.77	78%	0.782	S	S	*	*			trans	86.1	131.4	156.2	-70.1	-33.8	0	0	0	123.8
8	A	34	Very low	36.4	Very low	89 Å²	89	143.3 Å²	143.3	74%	0.736	78%	0.78	S	S	*	*			trans	35.8	133.8	147.2	0	0	0	0	0	123.3
9	V	37	Very low	36.4	Very low	146 Å²	146	142 Å²	142	89%	0.885	77%	0.772	S	S	*	*				-173.7	152.1	110.5	143.9	0	0	0	0	110.6
10	S	31.8	Very low	36.6	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	78%	0.775	S	S	*	*			trans	-104.2	158.6	-177.5	51	0	0	0	0	113.8
11	S	36.8	Very low	36.5	Very low	123 Å²	123	143.6 Å²	143.6	86%	0.86	78%	0.775	S	S	*	*			trans	-154.4	126.7	163	60.8	0	0	0	0	112.1
12	E	33.8	Very low	36.4	Very low	179 Å²	179	143.2 Å²	143.2	84%	0.836	76%	0.761	S	S	*	*			trans	-89.2	169.7	177.1	-51.7	175.1	111.1	0	0	112.7
13	N	36.3	Very low	36.3	Very low	142 Å²	142	144.4 Å²	144.4	76%	0.759	76%	0.763	S	S	*	*			trans	165	145.1	137.7	-91.3	-58.3	0	0	0	110.7
14	R	33.3	Very low	36.5	Very low	210 Å²	210	144.8 Å²	144.8	79%	0.792	77%	0.769	S	S	*	*			cis	-174.7	178.5	-18.5	-139.5	-172.4	-166.7	175.7	1.5	110.4
15	I	37.5	Very low	36.2	Very low	143 Å²	143	148.1 Å²	148.1	73%	0.733	78%	0.778	S	S	*	*			trans	74.6	137.4	153.8	-68.5	153.3	0	0	0	116.8
16	T	36.5	Very low	36	Very low	119 Å²	119	141.4 Å²	141.4	73%	0.73	77%	0.774	S	S	*	*			cis	-161.7	143.8	-23.2	32.8	0	0	0	0	106.2
17	K	34.6	Very low	35.5	Very low	167 Å²	167	142.2 Å²	142.2	73%	0.726	78%	0.782	S	S	*	*			cis	99.3	143.3	44.1	-154.6	-171.6	-174.5	-71.1	0	113.1	D19	K17-D19 IonicContact NZ-OD1 3.87Å; K17-D19 IonicContact NZ-OD2 2.75Å; K17-D19 PolarHBondContact NZ-OD2 3.16Å
18	A	40	Very low	35.3	Very low	90 Å²	90	141.5 Å²	141.5	74%	0.744	78%	0.784	S	S	*	*			trans	109	141.2	164.2	0	0	0	0	0	118.5
19	D	37	Very low	35.2	Very low	119 Å²	119	143.8 Å²	143.8	64%	0.636	79%	0.788	S	S	*	*			cis	-173	179.3	-39.5	-95	-26.7	0	0	0	108.5	K17	K17-D19 IonicContact NZ-OD1 3.87Å; K17-D19 IonicContact NZ-OD2 2.75Å; K17-D19 PolarHBondContact NZ-OD2 3.16Å
20	D	39.7	Very low	34.7	Very low	154 Å²	154	142.6 Å²	142.6	82%	0.824	78%	0.781	S	S	*	*			trans	87.4	151.7	163.3	-76.7	8.9	0	0	0	123.8
21	E	34	Very low	34.6	Very low	164 Å²	164	142.9 Å²	142.9	77%	0.766	78%	0.783	S	S	*	*			trans	-124.7	159.9	-155.5	-42.5	165.6	120.6	0	0	115.3
22	R	36.2	Very low	34.1	Very low	221 Å²	221	144.9 Å²	144.9	83%	0.834	78%	0.779	S	S	*	*				-178.4	158.2	117.4	-103.8	160.3	-74	-166	-7.3	116.9
23	D	34.2	Very low	33.8	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	79%	0.785	S	S	*	*			trans	-62	158.7	-176.9	-51.6	-102.1	0	0	0	117.1
24	V	38.3	Very low	33.3	Very low	138 Å²	138	149.2 Å²	149.2	84%	0.836	79%	0.785	S	S	*	*				-151.6	116.2	104	176.2	0	0	0	0	112.1
25	K	32.7	Very low	33	Very low	198 Å²	198	145.4 Å²	145.4	86%	0.861	79%	0.785	S	S	*	*			trans	8.1	125.9	150.4	-59.6	171.9	-178.5	174.8	0	119.8
26	G	34.9	Very low	32.4	Very low	76 Å²	76	143.9 Å²	143.9	78%	0.784	79%	0.787	S	S	*	*			trans	-163.7	48.2	177.3	0	0	0	0	0	119.7
27	S	33.4	Very low	31.9	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	79%	0.785	S	S	*	*			trans	52.6	79.2	159	-170.6	0	0	0	0	120.2
28	T	29.4	Very low	31.7	Very low	130 Å²	130	143.4 Å²	143.4	80%	0.798	79%	0.79	S	S	*	*			trans	27.2	112.8	132.6	-37.6	0	0	0	0	120.4
29	V	31.1	Very low	31	Very low	136 Å²	136	147 Å²	147	82%	0.824	79%	0.792	S	S	*	*				-169.1	143.7	106.8	149.1	0	0	0	0	109.2
30	V	28.2	Very low	30.5	Very low	121 Å²	121	145.7 Å²	145.7	73%	0.733	80%	0.797	S	S	*	*			trans	-88.3	140.7	-176	177.7	0	0	0	0	112
31	S	28.9	Very low	30	Very low	118 Å²	118	143.2 Å²	143.2	83%	0.825	79%	0.789	S	S	*	*			trans	-161	129	146	-89.2	0	0	0	0	111.2
32	E	27.2	Very low	29.7	Very low	164 Å²	164	142.4 Å²	142.4	77%	0.766	79%	0.79	S	S	*	*			trans	-72.9	162.6	172.3	-65.1	151.2	113.8	0	0	111.2
33	R	27.2	Very low	29.3	Very low	257 Å²	257	137.5 Å²	137.5	97%	0.97	77%	0.773	S	S	*	*			trans	-129.5	54.2	165.2	-80.2	-169.6	168.2	178.9	-3	111.6
34	M	25	Very low	29	Very low	155 Å²	155	138.4 Å²	138.4	76%	0.764	78%	0.777	S	S	*	*	S	Bend	trans	-98.1	143	155.7	-74.9	-174.8	76.5	0	0	109.7	S36	M34-S36 PolarHBondContact O-N 3.46Å
35	V	28.3	Very low	28.5	Very low	131 Å²	131	136.5 Å²	136.5	79%	0.794	78%	0.776	S	S	*	*			trans	34.6	70.6	148.6	-163.9	0	0	0	0	116.2	V37	V35-V37 PolarHBondContact O-N 3.3Å
36	S	24.6	Very low	28.2	Very low	111 Å²	111	131 Å²	131	78%	0.776	76%	0.762	S	S	*	*			trans	-80	107.9	168.1	60.4	0	0	0	0	110.7	M34	M34-S36 PolarHBondContact O-N 3.46Å
37	V	25.4	Very low	27.9	Very low	112 Å²	112	136.4 Å²	136.4	68%	0.679	76%	0.764	S	S	*	*			trans	-59.5	142.4	170.1	-175	0	0	0	0	109.6	V35 E39	V35-V37 PolarHBondContact O-N 3.3Å; V37-E39 HydrophobicContact CG1-CG 3.85Å
38	I	30	Very low	27.6	Very low	163 Å²	163	138.6 Å²	138.6	84%	0.836	77%	0.767	S	S	*	*			trans	-107.3	99.6	161.3	-62.2	-179.7	0	0	0	106.2
39	E	25	Very low	27.8	Very low	167 Å²	167	139.1 Å²	139.1	78%	0.78	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-68	140.3	178	-64.9	166.8	137.7	0	0	109.8	V37	V37-E39 HydrophobicContact CG1-CG 3.85Å
40	A	27.6	Very low	27.5	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-90.2	122.3	167.7	0	0	0	0	0	107.8	D42	A40-D42 PolarHBondContact O-N 3.27Å
41	P	29.2	Very low	27.5	Very low	103 Å²	103	141.2 Å²	141.2	67%	0.669	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-71.7	125.4	172.9	28.6	-32.3	0	0	0	109.5
42	D	27.2	Very low	27.4	Very low	147 Å²	147	139.6 Å²	139.6	79%	0.786	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.9	143.7	168.7	-81.8	-58.1	0	0	0	110.9	A40	A40-D42 PolarHBondContact O-N 3.27Å
43	Y	27.4	Very low	27.4	Very low	117 Å²	117	135.4 Å²	135.4	46%	0.459	77%	0.774	S	S	.	*			trans	-140.7	77.7	172.4	-104.7	-79.5	0	0	0	109.4	D280 E283	Y43-D280 PolarHBondContact OH-OD1 3.28Å; Y43-E283 WeakPolarHBondContact CE1-OE2 3.39Å; Y43-E283 PolarHBondContact OH-OE2 2.94Å
44	L	28.5	Very low	27.4	Very low	158 Å²	158	132.9 Å²	132.9	83%	0.827	77%	0.773	S	S	*	*			trans	-116.4	152.5	169.9	-82.5	172.5	0	0	0	110.1
45	A	27.7	Very low	27.7	Very low	99 Å²	99	130.6 Å²	130.6	82%	0.818	78%	0.779	S	S	*	*			trans	64.5	85.9	167	0	0	0	0	0	119
46	S	26.3	Very low	27.8	Very low	81 Å²	81	134 Å²	134	57%	0.566	79%	0.786	S	S	*	*			trans	-162	63.4	153.3	51.1	0	0	0	0	114.8
47	F	27.5	Very low	27.9	Very low	191 Å²	191	131.9 Å²	131.9	84%	0.838	78%	0.782	S	S	*	*			trans	-150	56.7	164.7	-92.7	-62.7	0	0	0	113.8
48	N	27.3	Very low	28.1	Very low	160 Å²	160	133 Å²	133	86%	0.856	80%	0.795	S	S	*	*			trans	-81.7	139.8	151.2	-78.2	-3.5	0	0	0	108.3
49	I	33.6	Very low	28	Very low	141 Å²	141	130.7 Å²	130.7	72%	0.723	79%	0.793	S	S	*	*			trans	-128.4	122.5	165.6	-65.7	179.1	0	0	0	106.1	T51	I49-T51 PolarHBondContact O-N 3.07Å
50	D	26.5	Very low	28.1	Very low	159 Å²	159	130.5 Å²	130.5	85%	0.85	79%	0.794	S	S	*	*			trans	-67.5	123.7	-178.1	-72.1	-56.9	0	0	0	112.6
51	T	27.8	Very low	28.2	Very low	142 Å²	142	129.9 Å²	129.9	87%	0.871	78%	0.783	S	S	*	*			trans	-149.6	106.1	153	50.6	0	0	0	0	109.4	I49	I49-T51 PolarHBondContact O-N 3.07Å
52	G	26.9	Very low	28	Very low	84 Å²	84	133.9 Å²	133.9	87%	0.866	79%	0.792	S	S	*	*			trans	142.8	115.7	170.1	0	0	0	0	0	112.3
53	G	27	Very low	28.2	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	78%	0.777	S	S	*	*			trans	-97.2	155.1	173.2	0	0	0	0	0	112.1
54	E	27	Very low	28.2	Very low	204 Å²	204	134.5 Å²	134.5	95%	0.953	79%	0.793	S	S	*	*			trans	38.2	91.4	152.7	-60.7	-176.9	176.3	0	0	119.1
55	A	32	Very low	28.2	Very low	106 Å²	106	131.6 Å²	131.6	88%	0.876	78%	0.782	S	S	*	*			trans	-164.2	153.1	136.3	0	0	0	0	0	111
56	E	28.6	Very low	28.2	Very low	203 Å²	203	131.9 Å²	131.9	95%	0.949	77%	0.77	S	S	*	*			trans	-92.5	146	-175.9	-56.3	178.2	125.5	0	0	113.2
57	G	27.1	Very low	28.2	Very low	67 Å²	67	135.3 Å²	135.3	69%	0.691	78%	0.78	S	S	*	*			trans	126.7	131.4	147.3	0	0	0	0	0	118.5
58	S	29.8	Very low	28.2	Very low	135 Å²	135	131.8 Å²	131.8	94%	0.944	77%	0.771	S	S	*	*			trans	71.4	154.2	171.1	78.7	0	0	0	0	117.5
59	S	27.2	Very low	28.1	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	77%	0.767	S	S	*	*			trans	-114.3	138.6	-163.8	52.5	0	0	0	0	113.8
60	M	28.5	Very low	27.8	Very low	163 Å²	163	134 Å²	134	80%	0.803	77%	0.768	S	S	*	*			trans	-131.6	140.1	166.2	-70.7	-168.9	71.8	0	0	110.9
61	P	28.9	Very low	27.8	Very low	77 Å²	77	132.3 Å²	132.3	50%	0.5	76%	0.759	S	S	.	*			trans	-78.9	144.4	170.9	32.7	-33.4	0	0	0	111.4
62	H	25	Very low	27.7	Very low	187 Å²	187	131.4 Å²	131.4	87%	0.866	75%	0.753	S	S	*	*			trans	-74.5	132.4	-178.9	-65.9	-90.8	0	0	0	113.1
63	Y	31.1	Very low	27.7	Very low	123 Å²	123	134.3 Å²	134.3	48%	0.482	75%	0.749	S	S	.	*			trans	-105.4	126.6	167.2	-59.1	-81.9	0	0	0	110.8	V65 N1110	Y63-V65 PolarHBondContact O-N 3.45Å; Y63-V65 VanDerWaalsContact O-N 3.15Å; Y63-N1110 PolarHBondContact OH-OD1 2.8Å
64	I	28.6	Very low	27.8	Very low	154 Å²	154	134.8 Å²	134.8	79%	0.79	74%	0.737	S	S	*	*			trans	-84.6	88.6	174.5	-56.9	177.3	0	0	0	109.2
65	V	27.4	Very low	27.9	Very low	97 Å²	97	132.8 Å²	132.8	59%	0.588	73%	0.733	S	S	*	*			trans	-78.6	120.1	169.3	-176.6	0	0	0	0	109	Y63 L67	Y63-V65 PolarHBondContact O-N 3.45Å; Y63-V65 VanDerWaalsContact O-N 3.15Å; V65-L67 VanDerWaalsContact C-N 3.31Å; V65-L67 HydrophobicContact CB-CG 4.49Å; V65-L67 HydrophobicContact CG1-CD2 4.19Å; V65-L67 HydrophobicContact CG1-CG 4.05Å; V65-L67 PolarHBondContact O-N 2.8Å
66	N	27.7	Very low	27.5	Very low	105 Å²	105	133 Å²	133	56%	0.561	72%	0.717	S	S	*	*			trans	-76.8	80.6	176.9	-169.4	-2.6	0	0	0	110.5	N68	N66-N68 PolarHBondContact O-N 2.8Å; N66-N68 PolarHBondContact OD1-ND2 3.44Å
67	L	26.1	Very low	27.5	Very low	152 Å²	152	131.2 Å²	131.2	80%	0.796	71%	0.714	S	S	*	*			trans	-70.4	65.6	-179.1	-76.8	170	0	0	0	112.9	V65	V65-L67 VanDerWaalsContact C-N 3.31Å; V65-L67 HydrophobicContact CB-CG 4.49Å; V65-L67 HydrophobicContact CG1-CD2 4.19Å; V65-L67 HydrophobicContact CG1-CG 4.05Å; V65-L67 PolarHBondContact O-N 2.8Å
68	N	29	Very low	27.5	Very low	118 Å²	118	132.7 Å²	132.7	63%	0.631	72%	0.72	S	S	*	*			trans	-117.3	29.4	175.3	-86.7	-71.6	0	0	0	112.7	N66 Y70	N66-N68 PolarHBondContact O-N 2.8Å; N66-N68 PolarHBondContact OD1-ND2 3.44Å; N68-Y70 VanDerWaalsContact C-N 3.32Å; N68-Y70 PolarHBondContact O-N 3.45Å
69	M	25.2	Very low	27.3	Very low	157 Å²	157	132.6 Å²	132.6	77%	0.773	71%	0.708	S	S	*	*			trans	-87.7	21.1	-172.9	-141.5	-179.3	78.2	0	0	115.8
70	Y	25.8	Very low	27.3	Very low	190 Å²	190	132.4 Å²	132.4	75%	0.745	70%	0.702	S	S	*	*			trans	-132.8	76.4	171.6	-71.9	-68.6	0	0	0	112.5	N68 F1051	N68-Y70 VanDerWaalsContact C-N 3.32Å; N68-Y70 PolarHBondContact O-N 3.45Å; Y70-F1051 WeakPolarHBondContact OH-CZ 3.33Å
71	N	27.3	Very low	27.3	Very low	124 Å²	124	131.4 Å²	131.4	66%	0.663	71%	0.705	S	S	*	*			trans	-141	100	165.2	-107	-56.8	0	0	0	111.4	N73	N71-N73 VanDerWaalsContact C-N 3.31Å; N71-N73 PolarHBondContact O-N 2.72Å
72	T	26	Very low	27.2	Very low	122 Å²	122	134.7 Å²	134.7	75%	0.748	72%	0.718	S	S	*	*			trans	-76.1	77	176.6	51.6	0	0	0	0	111.3
73	N	27.5	Very low	27.3	Very low	145 Å²	145	131.5 Å²	131.5	78%	0.775	71%	0.713	S	S	*	*			trans	-102.8	72.2	170.7	-73.4	-38.8	0	0	0	110.6	N71	N71-N73 VanDerWaalsContact C-N 3.31Å; N71-N73 PolarHBondContact O-N 2.72Å
74	T	28.9	Very low	27.3	Very low	86 Å²	86	133.4 Å²	133.4	53%	0.528	73%	0.73	S	S	.	*			trans	-86.6	140.3	158.8	45.8	0	0	0	0	109.5	M76	T74-M76 PolarHBondContact O-N 2.79Å
75	D	27.4	Very low	27.1	Very low	163 Å²	163	135.3 Å²	135.3	87%	0.872	74%	0.736	S	S	*	*			trans	-53.5	129.5	-176.8	-52.4	-72	0	0	0	112.8
76	M	25.1	Very low	27.2	Very low	111 Å²	111	134 Å²	134	55%	0.547	74%	0.742	S	S	.	*			trans	-133.1	36.9	174.9	-90.3	-70.2	-79.6	0	0	112.4	T74 L79 P147	T74-M76 PolarHBondContact O-N 2.79Å; M76-L79 HydrophobicContact CE-CD1 3.76Å; M76-L79 HydrophobicContact CE-CG 4.2Å; M76-P147 HydrophobicContact CE-CG 4.19Å; M76-P147 HydrophobicContact SD-CG 4.2Å
77	D	27.3	Very low	27.2	Very low	164 Å²	164	138.2 Å²	138.2	88%	0.877	76%	0.758	S	S	*	*			trans	-90.1	131	160.7	-85.5	-42.2	0	0	0	110
78	A	27.6	Very low	27.2	Very low	99 Å²	99	138.5 Å²	138.5	82%	0.818	76%	0.76	S	S	*	*			trans	83.5	49.6	179.9	0	0	0	0	0	118.5
79	L	26.6	Very low	27.4	Very low	133 Å²	133	138.3 Å²	138.3	70%	0.696	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-70.6	124.6	146.3	-96.9	-177	0	0	0	110.1	M76	M76-L79 HydrophobicContact CE-CD1 3.76Å; M76-L79 HydrophobicContact CE-CG 4.2Å
80	T	26.9	Very low	27.7	Very low	110 Å²	110	137.2 Å²	137.2	68%	0.675	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-68.5	130.1	176.5	45.5	0	0	0	0	111.9	L82	T80-L82 PolarHBondContact O-N 2.79Å
81	T	27.8	Very low	28	Very low	143 Å²	143	135.8 Å²	135.8	88%	0.877	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.5	127.3	157.3	29.2	0	0	0	0	110.2
82	L	27.9	Very low	28.2	Very low	146 Å²	146	133.1 Å²	133.1	76%	0.764	77%	0.768	S	S	*	*			trans	-125	146.9	164.1	-76.3	176.3	0	0	0	108.7	T80	T80-L82 PolarHBondContact O-N 2.79Å
83	P	26.1	Very low	28.5	Very low	119 Å²	119	136.1 Å²	136.1	77%	0.773	77%	0.774	S	S	*	*			trans	-82.2	151.7	-165.5	33.1	-36.3	0	0	0	113
84	I	30.2	Very low	28.8	Very low	163 Å²	163	134.5 Å²	134.5	84%	0.836	77%	0.774	S	S	*	*			trans	-112.4	134.9	164.1	-65.6	176.6	0	0	0	107.1
85	H	25.9	Very low	28.9	Very low	195 Å²	195	135.2 Å²	135.2	90%	0.903	78%	0.783	S	S	*	*			trans	-68.5	133.6	170.9	-88.1	6	0	0	0	110.6
86	G	28.5	Very low	29.2	Very low	70 Å²	70	133.3 Å²	133.3	72%	0.722	78%	0.777	S	S	*	*			trans	-152.2	133.3	169.8	0	0	0	0	0	108.3
87	Q	28.9	Very low	29.6	Very low	193 Å²	193	132.5 Å²	132.5	90%	0.902	78%	0.782	S	S	*	*			trans	-77.7	134.1	-168.1	-64	150.6	-63.8	0	0	112.3
88	D	26.4	Very low	29.8	Very low	158 Å²	158	132.4 Å²	132.4	85%	0.845	78%	0.78	S	S	*	*			trans	-78.1	144.7	150.8	-59.8	-55.9	0	0	0	108.2
89	P	33.2	Very low	30.2	Very low	114 Å²	114	133.1 Å²	133.1	74%	0.74	78%	0.777	S	S	*	*				-133.6	-177	76.5	45.4	-33.8	0	0	0	111.7
90	D	30.8	Very low	30.6	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	79%	0.786	S	S	*	*			cis	-160.5	171.4	10.9	-145.7	-28.7	0	0	0	110.8
91	I	32.6	Very low	30.8	Very low	160 Å²	160	133.2 Å²	133.2	82%	0.821	79%	0.787	S	S	*	*			trans	65.8	144.6	160.4	-58.3	154.4	0	0	0	117.4
92	G	31.1	Very low	31.1	Very low	68 Å²	68	132.4 Å²	132.4	70%	0.701	78%	0.777	S	S	*	*			trans	171.4	-11	168.6	0	0	0	0	0	123.1
93	E	32.1	Very low	31.5	Very low	185 Å²	185	132.3 Å²	132.3	86%	0.864	78%	0.775	S	S	*	*			trans	57.6	134.5	167.9	-60.2	-160.4	134.8	0	0	123.5
94	S	32.8	Very low	31.7	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	77%	0.774	S	S	*	*			trans	78.8	138.4	144.8	80.9	0	0	0	0	120.9
95	S	32.3	Very low	31.7	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	77%	0.774	S	S	*	*			cis	-170.9	174.7	-15	51.5	0	0	0	0	111.4
96	V	33.2	Very low	32	Very low	123 Å²	123	127.7 Å²	127.7	75%	0.745	77%	0.768	S	S	*	*			trans	68.7	96.1	165.6	-170.2	0	0	0	0	116.2
97	S	33.3	Very low	32.2	Very low	94 Å²	94	131.3 Å²	131.3	66%	0.657	78%	0.775	S	S	*	*				85.8	147.8	51.1	84.1	0	0	0	0	114.3
98	L	32.3	Very low	32.2	Very low	161 Å²	161	128.8 Å²	128.8	84%	0.843	77%	0.767	S	S	*	*			cis	-135.6	169.2	9.1	-99.7	111.3	0	0	0	113
99	P	34.9	Very low	32.5	Very low	115 Å²	115	129.7 Å²	129.7	75%	0.747	77%	0.768	S	S	*	*			trans	-116	-175.3	-176.8	43.1	-32	0	0	0	115
100	T	34.5	Very low	32.3	Very low	146 Å²	146	130 Å²	130	90%	0.896	76%	0.763	S	S	*	*			trans	-136.7	147.4	155.8	37.7	0	0	0	0	111.4
101	S	32.9	Very low	32.3	Very low	98 Å²	98	129.6 Å²	129.6	69%	0.685	76%	0.761	S	S	*	*			trans	-103.1	-177.1	174.3	54.7	0	0	0	0	109.5
102	D	33.3	Very low	32.3	Very low	126 Å²	126	128.6 Å²	128.6	67%	0.674	76%	0.758	S	S	*	*			cis	-166.5	170.6	33.2	-126	-42.9	0	0	0	116.1
103	M	35.5	Very low	32.3	Very low	145 Å²	145	132 Å²	132	71%	0.714	77%	0.765	S	S	*	*			trans	51.5	101.6	154.1	-63.7	-59.7	156.5	0	0	124.2
104	N	31.3	Very low	32.3	Very low	141 Å²	141	127 Å²	127	75%	0.754	76%	0.763	S	S	*	*				35.9	127.2	113.9	-66.5	-36.4	0	0	0	122.8
105	S	30.3	Very low	32.1	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	77%	0.766	S	S	*	*				-174.8	135.6	116.6	40.2	0	0	0	0	113.5
106	P	32.7	Very low	32.1	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	78%	0.776	S	S	*	*			trans	-118.9	150.5	170.1	38.5	-28.5	0	0	0	113.6
107	V	32.6	Very low	31.8	Very low	145 Å²	145	133.4 Å²	133.4	88%	0.879	78%	0.779	S	S	*	*			trans	-137.9	150.9	171.7	-178.3	0	0	0	0	110.6
108	I	28	Very low	31.8	Very low	141 Å²	141	132.3 Å²	132.3	72%	0.723	78%	0.783	S	S	*	*			trans	-125	145.4	-172.9	-60.3	162.3	0	0	0	108.4
109	M	32	Very low	31.7	Very low	176 Å²	176	130.5 Å²	130.5	87%	0.867	78%	0.778	S	S	*	*			trans	169.9	121.2	133	-92.1	171.4	-164.3	0	0	115
110	N	30.8	Very low	31.4	Very low	120 Å²	120	130.1 Å²	130.1	64%	0.642	78%	0.779	S	S	*	*				44.6	123.3	126.8	-70	56.5	0	0	0	124.3
111	D	30.4	Very low	31.3	Very low	126 Å²	126	128.2 Å²	128.2	67%	0.674	77%	0.771	S	S	*	*				86.1	133.7	119.1	-59.7	-12.9	0	0	0	125.3
112	N	32.5	Very low	31.2	Very low	139 Å²	139	130.1 Å²	130.1	74%	0.743	78%	0.779	S	S	*	*			trans	94.1	112.2	138.4	-75.3	-24.1	0	0	0	124.1
113	V	29.9	Very low	31.1	Very low	140 Å²	140	127.2 Å²	127.2	85%	0.848	78%	0.778	S	S	*	*			trans	74.4	131	130.5	179.7	0	0	0	0	119.8
114	G	32.3	Very low	30.8	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	79%	0.791	S	S	*	*			trans	172.5	84.7	169.4	0	0	0	0	0	112.3
115	L	29.8	Very low	30.7	Very low	161 Å²	161	129.8 Å²	129.8	84%	0.843	79%	0.794	S	S	*	*			trans	-121.8	140.4	-176.2	-154.4	109.1	0	0	0	110.9
116	M	32.1	Very low	30.6	Very low	189 Å²	189	133.1 Å²	133.1	93%	0.931	80%	0.797	S	S	*	*			trans	-150.5	163.1	156.2	-82	-127.5	84.6	0	0	109.8
117	C	26.7	Very low	30.4	Very low	119 Å²	119	136.1 Å²	136.1	80%	0.804	80%	0.8	S	S	*	*			trans	-139.5	166.8	-161	-157.5	0	0	0	0	113.5
118	G	32.2	Very low	30	Very low	72 Å²	72	138.2 Å²	138.2	74%	0.742	80%	0.798	S	S	*	*			trans	-152.6	38.1	-168.5	0	0	0	0	0	117
119	V	32.1	Very low	30	Very low	122 Å²	122	141.1 Å²	141.1	74%	0.739	81%	0.806	S	S	*	*			trans	28.6	133.6	152	-140.2	0	0	0	0	122.3
120	S	27.9	Very low	29.7	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	80%	0.795	S	S	*	*			trans	63.7	154.4	149.1	44.8	0	0	0	0	120
121	S	31.3	Very low	29.4	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	80%	0.804	S	S	*	*			cis	-173.8	178.5	-21.9	61.2	0	0	0	0	107.2
122	T	32.4	Very low	29.2	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	80%	0.804	S	S	*	*			cis	-159.5	173	0.8	-17.2	0	0	0	0	108.7
123	G	30.5	Very low	28.8	Very low	65 Å²	65	140 Å²	140	67%	0.67	82%	0.815	S	S	*	*			trans	121.7	88.5	140.6	0	0	0	0	0	121.1
124	R	28.3	Very low	28.6	Very low	261 Å²	261	143.4 Å²	143.4	99%	0.985	81%	0.812	S	S	*	*			trans	52.4	133.7	148.1	-62.6	-176.4	175.1	-170.2	-1.9	120.8
125	G	30.9	Very low	28.2	Very low	79 Å²	79	145.2 Å²	145.2	81%	0.814	81%	0.812	S	S	*	*			trans	160.1	25	166.8	0	0	0	0	0	117.2	Q127	G125-Q127 PolarHBondContact O-N 2.92Å
126	Q	26.7	Very low	28	Very low	190 Å²	190	147 Å²	147	89%	0.888	81%	0.813	S	S	*	*			trans	-71.8	121.7	-175.4	-76.1	178	-33.6	0	0	112.8
127	Q	29	Very low	27.7	Very low	183 Å²	183	142.6 Å²	142.6	86%	0.855	81%	0.806	S	S	*	*			trans	-122.5	142.2	149.4	-74.7	-168.1	-12.5	0	0	109.1	G125 F129	G125-Q127 PolarHBondContact O-N 2.92Å; Q127-F129 PolarHBondContact O-N 3.36Å
128	F	24.9	Very low	27.7	Very low	188 Å²	188	147.6 Å²	147.6	83%	0.825	81%	0.808	S	S	*	*			trans	-76.5	118.3	-172.5	-70.4	-104.8	0	0	0	111.7
129	F	26.7	Very low	27.3	Very low	202 Å²	202	147.8 Å²	147.8	89%	0.886	81%	0.81	S	S	*	*			trans	-135.2	110.9	155	-94.7	-78.1	0	0	0	110.5	Q127	Q127-F129 PolarHBondContact O-N 3.36Å
130	T	26.8	Very low	27.1	Very low	104 Å²	104	152.7 Å²	152.7	64%	0.638	82%	0.816	S	S	*	*			trans	-70.8	132	-177.1	48	0	0	0	0	111.4	T132	T130-T132 PolarHBondContact O-N 3.14Å
131	P	23.7	Very low	26.9	Very low	129 Å²	129	151.2 Å²	151.2	84%	0.838	82%	0.817	S	S	*	*			trans	-79.6	60.2	176.6	33.6	-35.9	0	0	0	111.4	M133	P131-M133 PolarHBondContact O-N 2.94Å
132	T	27	Very low	26.7	Very low	109 Å²	109	156.9 Å²	156.9	67%	0.669	82%	0.822	S	S	*	*			trans	-73.6	96.4	176.4	38.1	0	0	0	0	111.9	T130 R134	T130-T132 PolarHBondContact O-N 3.14Å; T132-R134 VanDerWaalsContact C-N 3.26Å; T132-R134 PolarHBondContact O-N 3.49Å
133	M	24.2	Very low	26.6	Very low	197 Å²	197	158.6 Å²	158.6	97%	0.97	82%	0.819	S	S	*	*			trans	-57.5	89.8	152.8	-84.4	-74	-177.3	0	0	109.3	P131	P131-M133 PolarHBondContact O-N 2.94Å
134	R	24.8	Very low	26.5	Very low	211 Å²	211	160.3 Å²	160.3	80%	0.796	82%	0.82	S	S	*	*			trans	-135.9	119.9	172.7	-152.4	173	-170.6	-175.1	2.2	109.4	T132 K136	T132-R134 VanDerWaalsContact C-N 3.26Å; T132-R134 PolarHBondContact O-N 3.49Å; R134-K136 PolarHBondContact O-N 2.9Å
135	S	24.3	Very low	26.9	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	80%	0.798	S	S	*	*			trans	-62.6	95.9	176.2	37.3	0	0	0	0	110.1	A137	S135-A137 PolarHBondContact O-N 2.76Å
136	K	26.1	Very low	27.6	Very low	200 Å²	200	151.7 Å²	151.7	87%	0.87	78%	0.784	S	S	*	*			trans	-73.6	72	169.3	-77	-169.9	174.5	-179.2	0	110.2	R134 R138	R134-K136 PolarHBondContact O-N 2.9Å; K136-R138 VanDerWaalsContact C-N 3.32Å; K136-R138 PolarHBondContact O-N 3.37Å
137	A	25	Very low	28.7	Very low	95 Å²	95	144.4 Å²	144.4	79%	0.785	75%	0.753	S	S	*	*			trans	-56	100	155.1	0	0	0	0	0	107.4	S135 G139	S135-A137 PolarHBondContact O-N 2.76Å; A137-G139 PolarHBondContact O-N 2.89Å; A137-G139 VanDerWaalsContact O-N 3.12Å
138	R	26.7	Very low	29.6	Very low	224 Å²	224	140 Å²	140	85%	0.845	74%	0.735	S	S	*	*			trans	-72.1	104	167.2	-94.4	-172.4	163.2	-171.6	-5.5	106.9	K136 R140	K136-R138 VanDerWaalsContact C-N 3.32Å; K136-R138 PolarHBondContact O-N 3.37Å; R138-R140 PolarHBondContact O-N 2.76Å
139	G	25.2	Very low	31	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	71%	0.71	S	S	*	*			trans	-54.4	111.3	172.3	0	0	0	0	0	110.2	A137	A137-G139 PolarHBondContact O-N 2.89Å; A137-G139 VanDerWaalsContact O-N 3.12Å
140	R	26.3	Very low	32.5	Very low	226 Å²	226	128 Å²	128	85%	0.853	69%	0.688	S	S	*	*				-81.9	137.3	129.3	-74.8	-175.5	169.7	-166.7	-5.8	105.5	R138 R142	R138-R140 PolarHBondContact O-N 2.76Å; R140-R142 PolarHBondContact O-N 2.93Å
141	G	25	Very low	34.1	Very low	77 Å²	77	125.8 Å²	125.8	79%	0.794	68%	0.675	S	S	*	*			trans	-62.3	85.3	158.4	0	0	0	0	0	108.5	F143	G141-F143 PolarHBondContact O-N 2.81Å
142	R	26.8	Very low	35.8	Very low	224 Å²	224	120.8 Å²	120.8	85%	0.845	64%	0.641	S	S	*	*			trans	-77.7	102.4	152.9	-74.2	-172.4	177.3	-158.6	-2.2	104.3	R140 S144	R140-R142 PolarHBondContact O-N 2.93Å; R142-S144 VanDerWaalsContact C-N 3.28Å; R142-S144 PolarHBondContact O-N 2.9Å
143	F	30.3	Very low	37.6	Very low	174 Å²	174	118 Å²	118	76%	0.763	62%	0.62	S	S	*	*			trans	-52	106.6	151	-75.3	-86.7	0	0	0	105.8	G141 S145	G141-F143 PolarHBondContact O-N 2.81Å; F143-S145 VanDerWaalsContact C-N 3.34Å; F143-S145 PolarHBondContact O-N 3.39Å
144	S	28.7	Very low	39.5	Very low	101 Å²	101	115.9 Å²	115.9	71%	0.706	61%	0.605	S	S	*	*			trans	-70.4	101.9	170.6	51.5	0	0	0	0	105.4	R142 V146	R142-S144 VanDerWaalsContact C-N 3.28Å; R142-S144 PolarHBondContact O-N 2.9Å; S144-V146 PolarHBondContact O-N 3.38Å
145	S	36.3	Very low	41.3	Very low	75 Å²	75	112.2 Å²	112.2	52%	0.524	60%	0.595	S	S	.	*			trans	-56.9	95.8	166.2	51.7	0	0	0	0	107.4	F143 P147	F143-S145 VanDerWaalsContact C-N 3.34Å; F143-S145 PolarHBondContact O-N 3.39Å; S145-P147 WeakPolarHBondContact O-CD 3.32Å
146	V	45.3	Very low	43.2	Very low	83 Å²	83	107 Å²	107	50%	0.503	56%	0.558	S	S	.	*			trans	-52.4	123.8	165.9	178.6	0	0	0	0	105	S144 L148 D150 V151	S144-V146 PolarHBondContact O-N 3.38Å; V146-L148 PolarHBondContact O-N 2.8Å; V146-D150 HydrophobicContact CG1-CB 3.64Å; V146-V151 HydrophobicContact CB-CG2 3.85Å; V146-V151 HydrophobicContact CG1-CG2 3.65Å
147	P	49	Very low	44.8	Very low	38 Å²	38	106 Å²	106	25%	0.247	55%	0.549	C	S	.	.			trans	-46.5	137.6	-177.9	-31	35.1	0	0	0	110.7	M76 S145 D149 D150 V151	M76-P147 HydrophobicContact CE-CG 4.19Å; M76-P147 HydrophobicContact SD-CG 4.2Å; S145-P147 WeakPolarHBondContact O-CD 3.32Å; P147-D149 PolarHBondContact O-N 3.09Å; P147-D149 VanDerWaalsContact O-N 3.13Å; P147-D150 HydrophobicContact CB-CB 4.29Å; P147-D150 WeakPolarHBondContact CD-OD2 3.22Å; P147-D150 WeakPolarHBondContact CG-OD2 3.22Å; P147-D150 WeakPolarHBondContact O-CA 3.46Å; P147-D150 WeakPolarHBondContact O-CB 3.06Å; P147-D150 PolarHBondContact O-N 3.43Å; P147-V151 PolarHBondContact O-N 3.09Å; P147-V151 VanDerWaalsContact O-N 3.11Å
148	L	48.5	Very low	46.5	Very low	90 Å²	90	106.4 Å²	106.4	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-56.9	-36.8	-176.2	-169	69.9	0	0	0	110.4	V146 D150 V151 M152	V146-L148 PolarHBondContact O-N 2.8Å; L148-D150 PolarHBondContact O-N 3.4Å; L148-V151 PolarHBondContact O-N 2.69Å; L148-M152 HydrophobicContact CG-CG 4.14Å; L148-M152 WeakPolarHBondContact O-CB 3.08Å; L148-M152 WeakPolarHBondContact O-CG 3.32Å; L148-M152 PolarHBondContact O-N 2.79Å
149	D	54.9	Low	48.1	Very low	57 Å²	57	101.6 Å²	101.6	31%	0.305	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-38.6	172.1	-72	-56.1	0	0	0	113.6	P147 M152 E153 A181 N184	P147-D149 PolarHBondContact O-N 3.09Å; P147-D149 VanDerWaalsContact O-N 3.13Å; D149-M152 PolarHBondContact O-N 3.04Å; D149-E153 WeakPolarHBondContact O-CB 3.43Å; D149-E153 PolarHBondContact O-N 3.35Å; D149-A181 WeakPolarHBondContact OD1-CA 3.15Å; D149-N184 PolarHBondContact OD1-ND2 3.44Å
150	D	58.6	Low	49	Very low	80 Å²	80	106.8 Å²	106.8	43%	0.428	53%	0.528	S	S	.	.	H	α-helix	trans	-66.9	-39.7	175.3	-80	-26.9	0	0	0	111.9	V146 P147 L148 K154	V146-D150 HydrophobicContact CG1-CB 3.64Å; P147-D150 HydrophobicContact CB-CB 4.29Å; P147-D150 WeakPolarHBondContact CD-OD2 3.22Å; P147-D150 WeakPolarHBondContact CG-OD2 3.22Å; P147-D150 WeakPolarHBondContact O-CA 3.46Å; P147-D150 WeakPolarHBondContact O-CB 3.06Å; P147-D150 PolarHBondContact O-N 3.43Å; L148-D150 PolarHBondContact O-N 3.4Å; D150-K154 WeakPolarHBondContact O-CB 3.15Å; D150-K154 PolarHBondContact O-N 2.91Å
151	V	60.6	Low	50.3	Low	59 Å²	59	98.8 Å²	98.8	36%	0.358	52%	0.516	S	S	.	.	H	α-helix	trans	-65.9	-43.8	176.4	-178.2	0	0	0	0	110.7	V146 P147 L148 K154 K155	V146-V151 HydrophobicContact CB-CG2 3.85Å; V146-V151 HydrophobicContact CG1-CG2 3.65Å; P147-V151 PolarHBondContact O-N 3.09Å; P147-V151 VanDerWaalsContact O-N 3.11Å; L148-V151 PolarHBondContact O-N 2.69Å; V151-K154 PolarHBondContact O-N 3.22Å; V151-K155 PolarHBondContact O-N 3.38Å
152	M	59.2	Low	51.7	Low	24 Å²	24	104.6 Å²	104.6	12%	0.118	52%	0.52	C	S	.	.	H	α-helix	trans	-72.1	-41.7	-177.9	-62.1	-81	-90.9	0	0	111	L148 D149 K154 K155 I156 R185 T188	L148-M152 HydrophobicContact CG-CG 4.14Å; L148-M152 WeakPolarHBondContact O-CB 3.08Å; L148-M152 WeakPolarHBondContact O-CG 3.32Å; L148-M152 PolarHBondContact O-N 2.79Å; D149-M152 PolarHBondContact O-N 3.04Å; M152-K154 VanDerWaalsContact C-N 3.33Å; M152-K154 PolarHBondContact O-N 2.83Å; M152-K155 PolarHBondContact O-N 3.07Å; M152-I156 WeakPolarHBondContact O-CD1 3.44Å; M152-I156 VanDerWaalsContact O-CG1 3.25Å; M152-I156 WeakPolarHBondContact O-CG1 3.41Å; M152-I156 PolarHBondContact O-N 3.45Å; M152-R185 HydrophobicContact CE-CB 4.12Å; M152-R185 HydrophobicContact CE-CG 4.24Å; M152-T188 HydrophobicContact CE-CG2 3.93Å; M152-T188 WeakPolarHBondContact CE-OG1 3.44Å; M152-T188 HydrophobicContact SD-CG2 4.1Å
153	E	64.7	Low	53.6	Low	50 Å²	50	98.2 Å²	98.2	23%	0.234	50%	0.502	C	S	.	.	H	α-helix	trans	-67.8	-33.8	175.8	-173.3	162.6	160.7	0	0	111.7	D149 I156 R157 R180	D149-E153 WeakPolarHBondContact O-CB 3.43Å; D149-E153 PolarHBondContact O-N 3.35Å; E153-I156 PolarHBondContact O-N 3.47Å; E153-R157 WeakPolarHBondContact O-CB 3.29Å; E153-R157 WeakPolarHBondContact O-CD 3.37Å; E153-R157 WeakPolarHBondContact O-CG 2.95Å; E153-R157 PolarHBondContact O-N 3.08Å; E153-R157 IonicContact OE1-CZ 3.41Å; E153-R157 IonicContact OE1-NE 2.68Å; E153-R157 PolarHBondContact OE1-NE 3.47Å; E153-R157 IonicContact OE1-NH2 2.7Å; E153-R157 PolarHBondContact OE1-NH2 2.94Å; E153-R180 IonicContact OE2-CZ 3.56Å; E153-R180 IonicContact OE2-NH2 2.73Å; E153-R180 PolarHBondContact OE2-NH2 3.02Å
154	K	64.1	Low	55.5	Low	153 Å²	153	90.9 Å²	90.9	67%	0.665	47%	0.472	S	S	*	.	H	α-helix	trans	-63.2	-45	169.3	-165.9	172.2	-174.9	-177.6	0	111.5	D150 V151 M152 R157 T158	D150-K154 WeakPolarHBondContact O-CB 3.15Å; D150-K154 PolarHBondContact O-N 2.91Å; V151-K154 PolarHBondContact O-N 3.22Å; M152-K154 VanDerWaalsContact C-N 3.33Å; M152-K154 PolarHBondContact O-N 2.83Å; K154-R157 PolarHBondContact O-N 2.93Å; K154-T158 WeakPolarHBondContact O-CG2 3.37Å; K154-T158 PolarHBondContact O-N 2.76Å; K154-T158 VanDerWaalsContact O-N 3.12Å; K154-T158 PolarHBondContact O-OG1 3.35Å; K154-T158 VanDerWaalsContact O-OG1 3.09Å
155	K	62.4	Low	57.6	Low	133 Å²	133	90.6 Å²	90.6	58%	0.578	47%	0.466	S	S	*	.	H	α-helix	trans	-61	-42.8	174	-76.7	-170.1	174.4	-168.9	0	112.8	V151 M152 R157 T158 Y159	V151-K155 PolarHBondContact O-N 3.38Å; M152-K155 PolarHBondContact O-N 3.07Å; K155-R157 VanDerWaalsContact C-N 3.27Å; K155-R157 PolarHBondContact O-N 3.06Å; K155-T158 PolarHBondContact O-N 2.98Å; K155-T158 PolarHBondContact O-OG1 3.38Å; K155-Y159 PolarHBondContact O-N 2.97Å
156	I	63.5	Low	59.6	Low	9 Å²	9	92.6 Å²	92.6	5%	0.046	47%	0.467	C	S	.	.	H	α-helix	trans	-65.4	-29.9	177.7	-68.2	161.7	0	0	0	111.7	M152 E153 V165 L168 F187 T188 L192	M152-I156 WeakPolarHBondContact O-CD1 3.44Å; M152-I156 VanDerWaalsContact O-CG1 3.25Å; M152-I156 WeakPolarHBondContact O-CG1 3.41Å; M152-I156 PolarHBondContact O-N 3.45Å; E153-I156 PolarHBondContact O-N 3.47Å; I156-V165 HydrophobicContact CG2-CG2 4.46Å; I156-L168 HydrophobicContact CD1-CD2 4.26Å; I156-F187 HydrophobicContact CD1-CD1 4.46Å; I156-T188 HydrophobicContact CD1-CG2 4.32Å; I156-T188 HydrophobicContact CG1-CG2 4.23Å; I156-L192 HydrophobicContact CB-CD2 4.46Å; I156-L192 HydrophobicContact CG1-CD2 4.14Å; I156-L192 HydrophobicContact CG2-CD2 4.43Å
157	R	60.2	Low	61.4	Low	177 Å²	177	90.3 Å²	90.3	67%	0.668	45%	0.451	S	S	*	.	H	α-helix	trans	-84	-12.8	175.7	-70.3	169.1	-178.5	-136.3	11.2	114.6	E153 K154 K155	E153-R157 WeakPolarHBondContact O-CB 3.29Å; E153-R157 WeakPolarHBondContact O-CD 3.37Å; E153-R157 WeakPolarHBondContact O-CG 2.95Å; E153-R157 PolarHBondContact O-N 3.08Å; E153-R157 IonicContact OE1-CZ 3.41Å; E153-R157 IonicContact OE1-NE 2.68Å; E153-R157 PolarHBondContact OE1-NE 3.47Å; E153-R157 IonicContact OE1-NH2 2.7Å; E153-R157 PolarHBondContact OE1-NH2 2.94Å; K154-R157 PolarHBondContact O-N 2.93Å; K155-R157 VanDerWaalsContact C-N 3.27Å; K155-R157 PolarHBondContact O-N 3.06Å
158	T	60.9	Low	63.1	Low	104 Å²	104	88.9 Å²	88.9	64%	0.638	44%	0.441	S	S	*	.	H	α-helix	trans	-109.4	-1.5	-179.8	56	0	0	0	0	114.2	K154 K155	K154-T158 WeakPolarHBondContact O-CG2 3.37Å; K154-T158 PolarHBondContact O-N 2.76Å; K154-T158 VanDerWaalsContact O-N 3.12Å; K154-T158 PolarHBondContact O-OG1 3.35Å; K154-T158 VanDerWaalsContact O-OG1 3.09Å; K155-T158 PolarHBondContact O-N 2.98Å; K155-T158 PolarHBondContact O-OG1 3.38Å
159	Y	59.9	Low	64.7	Low	124 Å²	124	86.3 Å²	86.3	49%	0.486	44%	0.436	S	S	.	.	S	Bend	trans	-78	146.9	173	-140.2	-92	0	0	0	110.6	K155 L192	K155-Y159 PolarHBondContact O-N 2.97Å; Y159-L192 HydrophobicContact CD1-CD1 4.06Å; Y159-L192 HydrophobicContact CD2-CD1 3.74Å; Y159-L192 HydrophobicContact CE1-CD1 4.28Å; Y159-L192 HydrophobicContact CE2-CD1 3.97Å; Y159-L192 HydrophobicContact CG-CD1 3.78Å; Y159-L192 HydrophobicContact CG-CD2 4.46Å
160	E	44.7	Very low	66.3	Low	184 Å²	184	87.9 Å²	87.9	86%	0.86	44%	0.44	S	S	*	.	S	Bend	trans	-71.9	135.8	-178.7	-60.2	-173.6	135	0	0	111.6
161	G	53.3	Low	67.7	Low	58 Å²	58	84.1 Å²	84.1	60%	0.598	42%	0.42	S	S	*	.	S	Bend	trans	115.1	136.6	177.3	0	0	0	0	0	113.9	D163	G161-D163 VanDerWaalsContact C-N 3.35Å; G161-D163 PolarHBondContact O-N 3.46Å
162	K	53.9	Low	69.1	Low	200 Å²	200	84.1 Å²	84.1	87%	0.87	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.2	-169.2	-70.5	-179.4	177.9	175.2	0	115.2
163	D	65.8	Low	70.4	Confident	89 Å²	89	91.9 Å²	91.9	48%	0.476	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-13.8	-169.1	-63.5	-47.5	0	0	0	115.5	G161 V165 Q166 E167	G161-D163 VanDerWaalsContact C-N 3.35Å; G161-D163 PolarHBondContact O-N 3.46Å; D163-V165 PolarHBondContact O-N 3.17Å; D163-Q166 WeakPolarHBondContact O-CA 3.39Å; D163-Q166 WeakPolarHBondContact O-CB 3.29Å; D163-Q166 PolarHBondContact O-N 3.44Å; D163-Q166 PolarHBondContact OD1-NE2 2.91Å; D163-E167 PolarHBondContact O-N 3.3Å
164	C	70.9	Confident	71.6	Confident	20 Å²	20	93.3 Å²	93.3	14%	0.135	46%	0.46	C	S	.	.	H	α-helix	trans	-55	-33.8	-175.1	-58.7	0	0	0	0	113.8	L168 F187 L192	C164-L168 WeakPolarHBondContact O-CB 3.28Å; C164-L168 PolarHBondContact O-N 3.28Å; C164-L168 VanDerWaalsContact O-N 3.15Å; C164-F187 HydrophobicContact CB-CE1 4.5Å; C164-F187 WeakPolarHBondContact O-CE1 3.34Å; C164-L192 HydrophobicContact CB-CD2 3.91Å
165	V	73.8	Confident	72.8	Confident	95 Å²	95	86.6 Å²	86.6	58%	0.576	43%	0.43	S	S	*	.	H	α-helix	trans	-75.1	-33	176.1	-178.2	0	0	0	0	111.9	I156 D163 G169	I156-V165 HydrophobicContact CG2-CG2 4.46Å; D163-V165 PolarHBondContact O-N 3.17Å; V165-G169 PolarHBondContact O-N 2.62Å; V165-G169 VanDerWaalsContact O-N 3.13Å
166	Q	77.4	Confident	73.9	Confident	117 Å²	117	85.6 Å²	85.6	55%	0.547	44%	0.438	S	S	.	.	H	α-helix	trans	-70.1	-45.8	175	-55.7	-162.6	60.9	0	0	110.9	D163 G169 K170	D163-Q166 WeakPolarHBondContact O-CA 3.39Å; D163-Q166 WeakPolarHBondContact O-CB 3.29Å; D163-Q166 PolarHBondContact O-N 3.44Å; D163-Q166 PolarHBondContact OD1-NE2 2.91Å; Q166-G169 CarbonylContact O-C 3.54Å; Q166-G169 WeakPolarHBondContact O-CA 3.41Å; Q166-G169 PolarHBondContact O-N 2.79Å; Q166-K170 PolarHBondContact O-N 3.44Å
167	E	83.4	Confident	74.6	Confident	35 Å²	35	90.8 Å²	90.8	16%	0.164	46%	0.457	C	S	.	.	H	α-helix	trans	-62.7	-42.6	178.3	-60.8	-45.6	138.5	0	0	112.1	D163 G169 K170 L171 F187 Y194	D163-E167 PolarHBondContact O-N 3.3Å; E167-G169 VanDerWaalsContact C-N 3.25Å; E167-G169 PolarHBondContact O-N 3.08Å; E167-K170 WeakPolarHBondContact O-CB 3.45Å; E167-K170 PolarHBondContact O-N 3.02Å; E167-K170 VanDerWaalsContact O-N 3.11Å; E167-K170 WeakPolarHBondContact OE1-CE 3.49Å; E167-K170 IonicContact OE1-NZ 3.83Å; E167-K170 PolarHBondContact OE1-NZ 3.43Å; E167-K170 WeakPolarHBondContact OE2-CD 3.35Å; E167-K170 VanDerWaalsContact OE2-CE 3.3Å; E167-K170 WeakPolarHBondContact OE2-CE 3.33Å; E167-K170 IonicContact OE2-NZ 3.81Å; E167-K170 PolarHBondContact OE2-NZ 3.18Å; E167-L171 WeakPolarHBondContact O-CG 3.36Å; E167-L171 PolarHBondContact O-N 3.25Å; E167-F187 HydrophobicContact CB-CE2 4.23Å; E167-F187 HydrophobicContact CB-CZ 4.05Å; E167-Y194 HydrophobicContact CB-CD2 4.01Å; E167-Y194 HydrophobicContact CB-CG 4.42Å; E167-Y194 HydrophobicContact CG-CD2 4.5Å; E167-Y194 VanDerWaalsContact OE2-CD2 3.23Å; E167-Y194 WeakPolarHBondContact OE2-CD2 3.47Å
168	L	83.7	Confident	75.8	Confident	9 Å²	9	84.6 Å²	84.6	5%	0.047	44%	0.435	C	S	.	.	H	α-helix	trans	-58.5	-39.4	170.9	-173.2	71.7	0	0	0	111.5	I156 C164 L171 L172 I183 F187	I156-L168 HydrophobicContact CD1-CD2 4.26Å; C164-L168 WeakPolarHBondContact O-CB 3.28Å; C164-L168 PolarHBondContact O-N 3.28Å; C164-L168 VanDerWaalsContact O-N 3.15Å; L168-L171 PolarHBondContact O-N 3.2Å; L168-L172 HydrophobicContact CG-CD1 4.01Å; L168-L172 WeakPolarHBondContact O-CB 3.36Å; L168-L172 WeakPolarHBondContact O-CD1 3.48Å; L168-L172 VanDerWaalsContact O-CG 3.28Å; L168-L172 WeakPolarHBondContact O-CG 3.5Å; L168-L172 PolarHBondContact O-N 2.66Å; L168-I183 HydrophobicContact CD1-CG2 4.04Å; L168-F187 HydrophobicContact CB-CD1 4.39Å; L168-F187 HydrophobicContact CB-CE1 4.12Å; L168-F187 HydrophobicContact CD1-CB 4.3Å; L168-F187 HydrophobicContact CD1-CD1 3.86Å; L168-F187 HydrophobicContact CD1-CE1 4.45Å; L168-F187 HydrophobicContact CD1-CG 4.2Å
169	G	83.9	Confident	76.9	Confident	35 Å²	35	87.6 Å²	87.6	36%	0.361	44%	0.439	S	S	.	.	H	α-helix	trans	-63.3	-35.9	174	0	0	0	0	0	114	V165 Q166 E167 K173	V165-G169 PolarHBondContact O-N 2.62Å; V165-G169 VanDerWaalsContact O-N 3.13Å; Q166-G169 CarbonylContact O-C 3.54Å; Q166-G169 WeakPolarHBondContact O-CA 3.41Å; Q166-G169 PolarHBondContact O-N 2.79Å; E167-G169 VanDerWaalsContact C-N 3.25Å; E167-G169 PolarHBondContact O-N 3.08Å; G169-K173 PolarHBondContact O-N 3.4Å
170	K	86.6	Confident	78	Confident	91 Å²	91	86.3 Å²	86.3	40%	0.396	43%	0.433	S	S	.	.	H	α-helix	trans	-67.3	-48.8	172.2	-63.4	-178.9	-153.5	160.3	0	111	Q166 E167 L172 K173 L174 Y194	Q166-K170 PolarHBondContact O-N 3.44Å; E167-K170 WeakPolarHBondContact O-CB 3.45Å; E167-K170 PolarHBondContact O-N 3.02Å; E167-K170 VanDerWaalsContact O-N 3.11Å; E167-K170 WeakPolarHBondContact OE1-CE 3.49Å; E167-K170 IonicContact OE1-NZ 3.83Å; E167-K170 PolarHBondContact OE1-NZ 3.43Å; E167-K170 WeakPolarHBondContact OE2-CD 3.35Å; E167-K170 VanDerWaalsContact OE2-CE 3.3Å; E167-K170 WeakPolarHBondContact OE2-CE 3.33Å; E167-K170 IonicContact OE2-NZ 3.81Å; E167-K170 PolarHBondContact OE2-NZ 3.18Å; K170-L172 VanDerWaalsContact C-N 3.32Å; K170-L172 PolarHBondContact O-N 3.16Å; K170-K173 WeakPolarHBondContact O-CB 3.31Å; K170-K173 PolarHBondContact O-N 3.04Å; K170-L174 HydrophobicContact CB-CD1 4.47Å; K170-L174 WeakPolarHBondContact O-CG 3.42Å; K170-L174 PolarHBondContact O-N 3Å; K170-Y194 HydrophobicContact CB-CE2 3.79Å; K170-Y194 HydrophobicContact CD-CE2 4.2Å
171	L	89.9	Confident	79.6	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-59.2	-41.6	178.9	-65.7	173.7	0	0	0	112	E167 L168 K173 L174 F175 I183 F187 Y194 L201	E167-L171 WeakPolarHBondContact O-CG 3.36Å; E167-L171 PolarHBondContact O-N 3.25Å; L168-L171 PolarHBondContact O-N 3.2Å; L171-K173 VanDerWaalsContact C-N 3.29Å; L171-K173 PolarHBondContact O-N 3.43Å; L171-L174 PolarHBondContact O-N 3.03Å; L171-F175 HydrophobicContact CD2-CD2 4.38Å; L171-F175 HydrophobicContact CD2-CE2 3.95Å; L171-F175 PolarHBondContact O-N 3.03Å; L171-I183 HydrophobicContact CB-CG2 3.97Å; L171-F187 HydrophobicContact CD1-CD2 3.58Å; L171-F187 HydrophobicContact CD1-CE2 4.05Å; L171-F187 HydrophobicContact CD1-CG 4.28Å; L171-Y194 HydrophobicContact CD1-CD2 4.37Å; L171-Y194 HydrophobicContact CD2-CD2 3.82Å; L171-Y194 HydrophobicContact CD2-CE2 3.63Å; L171-Y194 HydrophobicContact CG-CD2 3.86Å; L171-Y194 HydrophobicContact CG-CE2 3.9Å; L171-L201 HydrophobicContact CD2-CD1 4.32Å
172	L	88.1	Confident	81.1	Confident	59 Å²	59	80.6 Å²	80.6	31%	0.309	40%	0.395	S	S	.	.	H	α-helix	trans	-65.2	-27.5	175.3	-73.9	163.7	0	0	0	113.7	L168 K170 R180 I183	L168-L172 HydrophobicContact CG-CD1 4.01Å; L168-L172 WeakPolarHBondContact O-CB 3.36Å; L168-L172 WeakPolarHBondContact O-CD1 3.48Å; L168-L172 VanDerWaalsContact O-CG 3.28Å; L168-L172 WeakPolarHBondContact O-CG 3.5Å; L168-L172 PolarHBondContact O-N 2.66Å; K170-L172 VanDerWaalsContact C-N 3.32Å; K170-L172 PolarHBondContact O-N 3.16Å; L172-R180 HydrophobicContact CD2-CB 4.24Å; L172-R180 HydrophobicContact CD2-CG 4.38Å; L172-I183 HydrophobicContact CD2-CB 4.49Å; L172-I183 HydrophobicContact CD2-CD1 3.83Å; L172-I183 HydrophobicContact CD2-CG2 4.43Å; L172-I183 HydrophobicContact CG-CG2 4.46Å
173	K	88.2	Confident	82.6	Confident	187 Å²	187	71.1 Å²	71.1	81%	0.813	35%	0.354	S	S	*	.	H	α-helix	trans	-78.3	-35.3	171.2	-93.3	-176.1	172.1	-179.5	0	113	G169 K170 L171	G169-K173 PolarHBondContact O-N 3.4Å; K170-K173 WeakPolarHBondContact O-CB 3.31Å; K170-K173 PolarHBondContact O-N 3.04Å; L171-K173 VanDerWaalsContact C-N 3.29Å; L171-K173 PolarHBondContact O-N 3.43Å
174	L	88.9	Confident	83.4	Confident	81 Å²	81	67 Å²	67	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-79.1	-33.8	-173.7	-72.6	162.2	0	0	0	113.1	K170 L171 P176 Y194 Y198	K170-L174 HydrophobicContact CB-CD1 4.47Å; K170-L174 WeakPolarHBondContact O-CG 3.42Å; K170-L174 PolarHBondContact O-N 3Å; L171-L174 PolarHBondContact O-N 3.03Å; L174-P176 VanDerWaalsContact C-CD 3.41Å; L174-P176 VanDerWaalsContact O-CD 3.32Å; L174-P176 WeakPolarHBondContact O-CD 3.39Å; L174-Y194 HydrophobicContact CD1-CE2 4.41Å; L174-Y194 WeakPolarHBondContact CD1-OH 3.47Å; L174-Y198 HydrophobicContact CD1-CD2 3.96Å; L174-Y198 HydrophobicContact CD1-CE2 4Å
175	F	90.3	Very high	84	Confident	11 Å²	11	73.7 Å²	73.7	5%	0.048	35%	0.354	C	S	.	.			trans	-123.6	62.5	-172.9	-52.6	-75.9	0	0	0	114.4	L171 R177 F178 Y198 L201 K202 D205	L171-F175 HydrophobicContact CD2-CD2 4.38Å; L171-F175 HydrophobicContact CD2-CE2 3.95Å; L171-F175 PolarHBondContact O-N 3.03Å; F175-R177 PolarHBondContact O-N 3.38Å; F175-F178 HydrophobicContact CB-CD2 3.77Å; F175-F178 HydrophobicContact CB-CE2 4.23Å; F175-F178 PolarHBondContact O-N 3.45Å; F175-Y198 AromaticContact CE2-CD2 3.66Å; F175-Y198 HydrophobicContact CE2-CD2 3.66Å; F175-Y198 HydrophobicContact CE2-CE2 4.22Å; F175-Y198 HydrophobicContact CE2-CG 4.47Å; F175-Y198 AromaticContact CZ-CD2 3.5Å; F175-Y198 HydrophobicContact CZ-CD2 3.5Å; F175-Y198 VanDerWaalsContact CZ-CD2 3.5Å; F175-Y198 AromaticContact CZ-CE2 3.72Å; F175-Y198 HydrophobicContact CZ-CE2 3.72Å; F175-Y198 HydrophobicContact CZ-CG 4.26Å; F175-Y198 WeakPolarHBondContact CZ-O 3.31Å; F175-L201 HydrophobicContact CD1-CB 4.03Å; F175-L201 HydrophobicContact CD2-CB 3.63Å; F175-L201 HydrophobicContact CD2-CD1 3.73Å; F175-L201 HydrophobicContact CD2-CG 4.3Å; F175-L201 HydrophobicContact CE1-CB 4.01Å; F175-L201 HydrophobicContact CE2-CB 3.59Å; F175-L201 HydrophobicContact CE2-CD1 4.07Å; F175-L201 HydrophobicContact CE2-CG 4.49Å; F175-L201 HydrophobicContact CG-CB 3.84Å; F175-L201 HydrophobicContact CG-CD1 4.44Å; F175-L201 HydrophobicContact CZ-CB 3.78Å; F175-K202 HydrophobicContact CE1-CB 3.99Å; F175-K202 HydrophobicContact CZ-CB 4.08Å; F175-D205 HydrophobicContact CD1-CB 4.45Å
176	P	84.9	Confident	84.5	Confident	112 Å²	112	69.4 Å²	69.4	73%	0.727	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-5.7	-176.3	28.9	-36.9	0	0	0	115.2	L174	L174-P176 VanDerWaalsContact C-CD 3.41Å; L174-P176 VanDerWaalsContact O-CD 3.32Å; L174-P176 WeakPolarHBondContact O-CD 3.39Å
177	R	78.6	Confident	85.1	Confident	119 Å²	119	63.9 Å²	63.9	45%	0.449	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-22.5	173.8	-74.9	176.2	72.4	-151.4	16.2	113.1	F175 D205 E208	F175-R177 PolarHBondContact O-N 3.38Å; R177-D205 VanDerWaalsContact CD-OD1 3.28Å; R177-D205 WeakPolarHBondContact CD-OD1 3.26Å; R177-D205 IonicContact CZ-OD1 3.38Å; R177-D205 IonicContact NE-OD1 3.66Å; R177-D205 PolarHBondContact NH1-O 3.34Å; R177-D205 IonicContact NH1-OD1 3.88Å; R177-D205 PolarHBondContact NH1-OD1 3.27Å; R177-E208 PolarHBondContact NH2-O 2.89Å
178	F	85.7	Confident	84.9	Confident	47 Å²	47	63.9 Å²	63.9	21%	0.206	31%	0.305	C	S	.	.	S	Bend	trans	-94.9	149.5	178.1	-56.9	-65.6	0	0	0	112.6	F175 Y182 I183 L201 E204 D205	F175-F178 HydrophobicContact CB-CD2 3.77Å; F175-F178 HydrophobicContact CB-CE2 4.23Å; F175-F178 PolarHBondContact O-N 3.45Å; F178-Y182 HydrophobicContact CB-CD1 4.05Å; F178-Y182 AromaticContact CD1-CD1 3.89Å; F178-Y182 HydrophobicContact CD1-CD1 3.89Å; F178-Y182 HydrophobicContact CD1-CE1 4.16Å; F178-Y182 HydrophobicContact CE1-CE1 4.41Å; F178-Y182 AromaticContact CG-CD1 3.98Å; F178-Y182 HydrophobicContact CG-CD1 3.98Å; F178-I183 HydrophobicContact CB-CD1 4.11Å; F178-I183 HydrophobicContact CB-CG1 3.98Å; F178-L201 HydrophobicContact CD2-CD2 3.64Å; F178-L201 HydrophobicContact CE2-CB 4.24Å; F178-L201 HydrophobicContact CE2-CD2 3.89Å; F178-L201 WeakPolarHBondContact CE2-O 3.16Å; F178-L201 HydrophobicContact CG-CD2 4.24Å; F178-E204 HydrophobicContact CE1-CB 4.32Å; F178-E204 HydrophobicContact CZ-CB 3.73Å; F178-D205 HydrophobicContact CE2-CB 4.15Å; F178-D205 HydrophobicContact CZ-CB 4.26Å
179	K	82.8	Confident	84.9	Confident	166 Å²	166	72.7 Å²	72.7	72%	0.722	34%	0.337	S	S	*	.			trans	-69.3	147.5	173.2	-69	-175	174	-171.5	0	111.1	A181 Y182 I183	K179-A181 VanDerWaalsContact C-N 3.27Å; K179-A181 PolarHBondContact O-N 3.29Å; K179-Y182 WeakPolarHBondContact O-CA 3.15Å; K179-Y182 WeakPolarHBondContact O-CB 3.5Å; K179-Y182 PolarHBondContact O-N 3.18Å; K179-I183 PolarHBondContact O-N 3.11Å; K179-I183 VanDerWaalsContact O-N 3.12Å
180	R	83.6	Confident	85	Confident	97 Å²	97	72.3 Å²	72.3	37%	0.366	33%	0.327	S	S	.	.	H	α-helix	trans	-47	-48.4	171	175.7	177.4	176.4	81.8	-7.3	112.3	E153 L172 Y182 I183 N184	E153-R180 IonicContact OE2-CZ 3.56Å; E153-R180 IonicContact OE2-NH2 2.73Å; E153-R180 PolarHBondContact OE2-NH2 3.02Å; L172-R180 HydrophobicContact CD2-CB 4.24Å; L172-R180 HydrophobicContact CD2-CG 4.38Å; R180-Y182 PolarHBondContact O-N 3.33Å; R180-I183 PolarHBondContact O-N 3.12Å; R180-N184 WeakPolarHBondContact O-CB 3.13Å; R180-N184 PolarHBondContact O-N 3.39Å
181	A	77.4	Confident	84.8	Confident	41 Å²	41	74.3 Å²	74.3	34%	0.339	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-27.5	178	0	0	0	0	0	114	D149 K179 R185	D149-A181 WeakPolarHBondContact OD1-CA 3.15Å; K179-A181 VanDerWaalsContact C-N 3.27Å; K179-A181 PolarHBondContact O-N 3.29Å; A181-R185 WeakPolarHBondContact O-CB 3.43Å; A181-R185 PolarHBondContact O-N 3.39Å
182	Y	84.4	Confident	84.3	Confident	82 Å²	82	75.5 Å²	75.5	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-76.3	-48.6	174	-169.9	-106.1	0	0	0	111.4	F178 K179 R180 N184 R185 V186 L201 E204	F178-Y182 HydrophobicContact CB-CD1 4.05Å; F178-Y182 AromaticContact CD1-CD1 3.89Å; F178-Y182 HydrophobicContact CD1-CD1 3.89Å; F178-Y182 HydrophobicContact CD1-CE1 4.16Å; F178-Y182 HydrophobicContact CE1-CE1 4.41Å; F178-Y182 AromaticContact CG-CD1 3.98Å; F178-Y182 HydrophobicContact CG-CD1 3.98Å; K179-Y182 WeakPolarHBondContact O-CA 3.15Å; K179-Y182 WeakPolarHBondContact O-CB 3.5Å; K179-Y182 PolarHBondContact O-N 3.18Å; R180-Y182 PolarHBondContact O-N 3.33Å; Y182-N184 VanDerWaalsContact C-N 3.33Å; Y182-N184 PolarHBondContact O-N 2.89Å; Y182-R185 WeakPolarHBondContact O-CA 3.05Å; Y182-R185 WeakPolarHBondContact O-CB 3.41Å; Y182-R185 PolarHBondContact O-N 3.47Å; Y182-V186 HydrophobicContact CD1-CG2 4.13Å; Y182-V186 HydrophobicContact CE1-CG2 3.7Å; Y182-V186 HydrophobicContact CE2-CG2 4.48Å; Y182-V186 PolarHBondContact O-N 2.97Å; Y182-L201 HydrophobicContact CD1-CD2 4.02Å; Y182-L201 HydrophobicContact CE1-CD2 3.94Å; Y182-E204 VanDerWaalsContact CE1-OE2 3.28Å; Y182-E204 WeakPolarHBondContact CE1-OE2 3.37Å; Y182-E204 VanDerWaalsContact CZ-OE2 3.31Å; Y182-E204 VanDerWaalsContact OH-CD 3.27Å; Y182-E204 PolarHBondContact OH-OE1 3.43Å; Y182-E204 PolarHBondContact OH-OE2 3.43Å
183	I	87.4	Confident	84.1	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-43.5	177.2	-65.4	167	0	0	0	110.5	L168 L171 L172 F178 K179 R180 R185 V186 F187 L201	L168-I183 HydrophobicContact CD1-CG2 4.04Å; L171-I183 HydrophobicContact CB-CG2 3.97Å; L172-I183 HydrophobicContact CD2-CB 4.49Å; L172-I183 HydrophobicContact CD2-CD1 3.83Å; L172-I183 HydrophobicContact CD2-CG2 4.43Å; L172-I183 HydrophobicContact CG-CG2 4.46Å; F178-I183 HydrophobicContact CB-CD1 4.11Å; F178-I183 HydrophobicContact CB-CG1 3.98Å; K179-I183 PolarHBondContact O-N 3.11Å; K179-I183 VanDerWaalsContact O-N 3.12Å; R180-I183 PolarHBondContact O-N 3.12Å; I183-R185 VanDerWaalsContact C-N 3.3Å; I183-R185 PolarHBondContact O-N 3.46Å; I183-V186 PolarHBondContact O-N 3.32Å; I183-F187 VanDerWaalsContact O-CB 3.22Å; I183-F187 WeakPolarHBondContact O-CB 3.37Å; I183-F187 PolarHBondContact O-N 3.17Å; I183-L201 HydrophobicContact CG1-CD1 4.14Å; I183-L201 HydrophobicContact CG1-CD2 4.26Å; I183-L201 HydrophobicContact CG2-CD1 4.27Å
184	N	82.2	Confident	84.1	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-53.5	-46.7	171.3	-74.8	-8.4	0	0	0	111.2	D149 R180 Y182 F187 T188	D149-N184 PolarHBondContact OD1-ND2 3.44Å; R180-N184 WeakPolarHBondContact O-CB 3.13Å; R180-N184 PolarHBondContact O-N 3.39Å; Y182-N184 VanDerWaalsContact C-N 3.33Å; Y182-N184 PolarHBondContact O-N 2.89Å; N184-F187 PolarHBondContact O-N 2.69Å; N184-T188 WeakPolarHBondContact O-CG2 3.33Å; N184-T188 PolarHBondContact O-N 2.89Å; N184-T188 PolarHBondContact O-OG1 3.46Å
185	R	82.2	Confident	84	Confident	162 Å²	162	71.5 Å²	71.5	61%	0.611	33%	0.328	S	S	*	.	H	α-helix	trans	-68.2	-42.7	-177.7	-158	176.3	-162.7	176.2	4.1	112.8	M152 A181 Y182 I183 T188 R189	M152-R185 HydrophobicContact CE-CB 4.12Å; M152-R185 HydrophobicContact CE-CG 4.24Å; A181-R185 WeakPolarHBondContact O-CB 3.43Å; A181-R185 PolarHBondContact O-N 3.39Å; Y182-R185 WeakPolarHBondContact O-CA 3.05Å; Y182-R185 WeakPolarHBondContact O-CB 3.41Å; Y182-R185 PolarHBondContact O-N 3.47Å; I183-R185 VanDerWaalsContact C-N 3.3Å; I183-R185 PolarHBondContact O-N 3.46Å; R185-T188 PolarHBondContact O-OG1 3.17Å; R185-T188 VanDerWaalsContact O-OG1 3.05Å; R185-R189 WeakPolarHBondContact O-CB 3.47Å; R185-R189 PolarHBondContact O-N 3.18Å
186	V	84.6	Confident	83.9	Confident	5 Å²	5	77.4 Å²	77.4	3%	0.03	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-49.3	173.1	172.4	0	0	0	0	110.4	Y182 I183 T188 R189 N190 Q200 L201	Y182-V186 HydrophobicContact CD1-CG2 4.13Å; Y182-V186 HydrophobicContact CE1-CG2 3.7Å; Y182-V186 HydrophobicContact CE2-CG2 4.48Å; Y182-V186 PolarHBondContact O-N 2.97Å; I183-V186 PolarHBondContact O-N 3.32Å; V186-T188 PolarHBondContact O-N 3.05Å; V186-R189 PolarHBondContact O-N 3.23Å; V186-R189 VanDerWaalsContact O-N 3.13Å; V186-N190 WeakPolarHBondContact O-CB 3.11Å; V186-N190 PolarHBondContact O-N 3.48Å; V186-N190 PolarHBondContact O-ND2 2.81Å; V186-Q200 HydrophobicContact CG1-CB 4.41Å; V186-Q200 HydrophobicContact CG1-CG 4.45Å; V186-L201 HydrophobicContact CB-CD2 4.46Å; V186-L201 HydrophobicContact CG1-CD2 4.46Å; V186-L201 HydrophobicContact CG1-CG 4.16Å; V186-L201 HydrophobicContact CG2-CD2 4.16Å
187	F	89.4	Confident	84.1	Confident	0 Å²	0	72 Å²	72	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-42.6	-178.9	-168.4	-122.1	0	0	0	112.4	I156 C164 E167 L168 L171 I183 N184 N190 L192	I156-F187 HydrophobicContact CD1-CD1 4.46Å; C164-F187 HydrophobicContact CB-CE1 4.5Å; C164-F187 WeakPolarHBondContact O-CE1 3.34Å; E167-F187 HydrophobicContact CB-CE2 4.23Å; E167-F187 HydrophobicContact CB-CZ 4.05Å; L168-F187 HydrophobicContact CB-CD1 4.39Å; L168-F187 HydrophobicContact CB-CE1 4.12Å; L168-F187 HydrophobicContact CD1-CB 4.3Å; L168-F187 HydrophobicContact CD1-CD1 3.86Å; L168-F187 HydrophobicContact CD1-CE1 4.45Å; L168-F187 HydrophobicContact CD1-CG 4.2Å; L171-F187 HydrophobicContact CD1-CD2 3.58Å; L171-F187 HydrophobicContact CD1-CE2 4.05Å; L171-F187 HydrophobicContact CD1-CG 4.28Å; I183-F187 VanDerWaalsContact O-CB 3.22Å; I183-F187 WeakPolarHBondContact O-CB 3.37Å; I183-F187 PolarHBondContact O-N 3.17Å; N184-F187 PolarHBondContact O-N 2.69Å; F187-N190 PolarHBondContact O-N 2.82Å; F187-L192 HydrophobicContact CD1-CB 4.48Å; F187-L192 HydrophobicContact CD1-CD2 4.42Å; F187-L192 HydrophobicContact CD1-CG 4.36Å; F187-L192 HydrophobicContact CE1-CB 3.98Å; F187-L192 HydrophobicContact CE1-CD2 3.92Å; F187-L192 HydrophobicContact CE1-CG 4.12Å; F187-L192 HydrophobicContact CE2-CB 4.38Å; F187-L192 WeakPolarHBondContact CE2-O 3.27Å; F187-L192 HydrophobicContact CZ-CB 3.92Å; F187-L192 WeakPolarHBondContact CZ-O 3.17Å; F187-L192 VanDerWaalsContact O-CA 3.32Å; F187-L192 WeakPolarHBondContact O-CA 3.38Å; F187-L192 PolarHBondContact O-N 3.25Å
188	T	80.9	Confident	84.9	Confident	36 Å²	36	70.4 Å²	70.4	22%	0.221	31%	0.313	C	S	.	.	H	α-helix	trans	-70.6	-35.5	173.5	54	0	0	0	0	113.5	M152 I156 N184 R185 V186 N190 M191	M152-T188 HydrophobicContact CE-CG2 3.93Å; M152-T188 WeakPolarHBondContact CE-OG1 3.44Å; M152-T188 HydrophobicContact SD-CG2 4.1Å; I156-T188 HydrophobicContact CD1-CG2 4.32Å; I156-T188 HydrophobicContact CG1-CG2 4.23Å; N184-T188 WeakPolarHBondContact O-CG2 3.33Å; N184-T188 PolarHBondContact O-N 2.89Å; N184-T188 PolarHBondContact O-OG1 3.46Å; R185-T188 PolarHBondContact O-OG1 3.17Å; R185-T188 VanDerWaalsContact O-OG1 3.05Å; V186-T188 PolarHBondContact O-N 3.05Å; T188-N190 PolarHBondContact O-N 3.45Å; T188-M191 PolarHBondContact O-N 3.23Å
189	R	83.9	Confident	85.2	Confident	194 Å²	194	74.6 Å²	74.6	73%	0.732	33%	0.333	S	S	*	.	H	α-helix	trans	-64	-34.8	177	-179.8	178.9	-177.7	173.2	1.3	111	R185 V186 M191	R185-R189 WeakPolarHBondContact O-CB 3.47Å; R185-R189 PolarHBondContact O-N 3.18Å; V186-R189 PolarHBondContact O-N 3.23Å; V186-R189 VanDerWaalsContact O-N 3.13Å; R189-M191 VanDerWaalsContact C-N 3.27Å; R189-M191 PolarHBondContact O-N 3.05Å
190	N	85.2	Confident	85.6	Confident	27 Å²	27	69 Å²	69	14%	0.144	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	25	179.5	-64.6	-21	0	0	0	113	V186 F187 T188 L192 S193 K196 Q200	V186-N190 WeakPolarHBondContact O-CB 3.11Å; V186-N190 PolarHBondContact O-N 3.48Å; V186-N190 PolarHBondContact O-ND2 2.81Å; F187-N190 PolarHBondContact O-N 2.82Å; T188-N190 PolarHBondContact O-N 3.45Å; N190-L192 VanDerWaalsContact C-N 3.26Å; N190-L192 PolarHBondContact O-N 2.86Å; N190-S193 WeakPolarHBondContact O-CB 3.24Å; N190-S193 PolarHBondContact O-N 2.93Å; N190-K196 HydrophobicContact CB-CB 4.04Å; N190-K196 PolarHBondContact ND2-O 3.14Å; N190-Q200 PolarHBondContact ND2-OE1 2.75Å
191	M	81.9	Confident	86	Confident	133 Å²	133	64.4 Å²	64.4	66%	0.655	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	38.3	175.6	-58.2	-68.4	-75.5	0	0	113.5	T188 R189 S193	T188-M191 PolarHBondContact O-N 3.23Å; R189-M191 VanDerWaalsContact C-N 3.27Å; R189-M191 PolarHBondContact O-N 3.05Å; M191-S193 PolarHBondContact O-N 3.27Å; M191-S193 VanDerWaalsContact O-N 3.16Å
192	L	79.2	Confident	86.7	Confident	24 Å²	24	67.2 Å²	67.2	13%	0.126	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	16.3	-175.4	-54.3	94.9	0	0	0	114.7	I156 Y159 C164 F187 N190 Y194	I156-L192 HydrophobicContact CB-CD2 4.46Å; I156-L192 HydrophobicContact CG1-CD2 4.14Å; I156-L192 HydrophobicContact CG2-CD2 4.43Å; Y159-L192 HydrophobicContact CD1-CD1 4.06Å; Y159-L192 HydrophobicContact CD2-CD1 3.74Å; Y159-L192 HydrophobicContact CE1-CD1 4.28Å; Y159-L192 HydrophobicContact CE2-CD1 3.97Å; Y159-L192 HydrophobicContact CG-CD1 3.78Å; Y159-L192 HydrophobicContact CG-CD2 4.46Å; C164-L192 HydrophobicContact CB-CD2 3.91Å; F187-L192 HydrophobicContact CD1-CB 4.48Å; F187-L192 HydrophobicContact CD1-CD2 4.42Å; F187-L192 HydrophobicContact CD1-CG 4.36Å; F187-L192 HydrophobicContact CE1-CB 3.98Å; F187-L192 HydrophobicContact CE1-CD2 3.92Å; F187-L192 HydrophobicContact CE1-CG 4.12Å; F187-L192 HydrophobicContact CE2-CB 4.38Å; F187-L192 WeakPolarHBondContact CE2-O 3.27Å; F187-L192 HydrophobicContact CZ-CB 3.92Å; F187-L192 WeakPolarHBondContact CZ-O 3.17Å; F187-L192 VanDerWaalsContact O-CA 3.32Å; F187-L192 WeakPolarHBondContact O-CA 3.38Å; F187-L192 PolarHBondContact O-N 3.25Å; N190-L192 VanDerWaalsContact C-N 3.26Å; N190-L192 PolarHBondContact O-N 2.86Å; L192-Y194 PolarHBondContact O-N 2.76Å
193	S	83.8	Confident	86.9	Confident	36 Å²	36	69.2 Å²	69.2	25%	0.252	31%	0.309	S	S	.	.			trans	-69.2	120.3	171.8	177.9	0	0	0	0	110.7	N190 M191 S197	N190-S193 WeakPolarHBondContact O-CB 3.24Å; N190-S193 PolarHBondContact O-N 2.93Å; M191-S193 PolarHBondContact O-N 3.27Å; M191-S193 VanDerWaalsContact O-N 3.16Å; S193-S197 VanDerWaalsContact O-CB 3.3Å; S193-S197 WeakPolarHBondContact O-CB 3.22Å; S193-S197 PolarHBondContact O-N 2.86Å; S193-S197 PolarHBondContact O-OG 3.04Å
194	Y	88	Confident	86.9	Confident	63 Å²	63	71 Å²	71	25%	0.247	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-50.7	173.6	174.2	-101.1	0	0	0	111.8	E167 K170 L171 L174 L192 S197 Y198	E167-Y194 HydrophobicContact CB-CD2 4.01Å; E167-Y194 HydrophobicContact CB-CG 4.42Å; E167-Y194 HydrophobicContact CG-CD2 4.5Å; E167-Y194 VanDerWaalsContact OE2-CD2 3.23Å; E167-Y194 WeakPolarHBondContact OE2-CD2 3.47Å; K170-Y194 HydrophobicContact CB-CE2 3.79Å; K170-Y194 HydrophobicContact CD-CE2 4.2Å; L171-Y194 HydrophobicContact CD1-CD2 4.37Å; L171-Y194 HydrophobicContact CD2-CD2 3.82Å; L171-Y194 HydrophobicContact CD2-CE2 3.63Å; L171-Y194 HydrophobicContact CG-CD2 3.86Å; L171-Y194 HydrophobicContact CG-CE2 3.9Å; L174-Y194 HydrophobicContact CD1-CE2 4.41Å; L174-Y194 WeakPolarHBondContact CD1-OH 3.47Å; L192-Y194 PolarHBondContact O-N 2.76Å; Y194-S197 PolarHBondContact O-N 2.7Å; Y194-Y198 WeakPolarHBondContact O-CB 3.19Å; Y194-Y198 PolarHBondContact O-N 3.41Å
195	E	88.2	Confident	87.1	Confident	145 Å²	145	71.4 Å²	71.4	68%	0.678	32%	0.32	S	S	*	.	H	α-helix	trans	-59.7	-53.6	-173.4	-64.2	177.2	135.2	0	0	112.1	S197 Y198 E199	E195-S197 PolarHBondContact O-N 2.78Å; E195-Y198 WeakPolarHBondContact O-CB 3.26Å; E195-Y198 PolarHBondContact O-N 3.31Å; E195-Y198 VanDerWaalsContact O-N 3.08Å; E195-E199 PolarHBondContact O-N 2.77Å
196	K	87.6	Confident	87.2	Confident	134 Å²	134	66.6 Å²	66.6	58%	0.583	31%	0.306	S	S	*	.	H	α-helix	trans	-59.8	-36.3	178.2	-66.9	-177.7	177.6	-177.4	0	112.5	N190 Q200	N190-K196 HydrophobicContact CB-CB 4.04Å; N190-K196 PolarHBondContact ND2-O 3.14Å; K196-Q200 WeakPolarHBondContact O-CB 3.34Å; K196-Q200 PolarHBondContact O-N 3.35Å; K196-Q200 VanDerWaalsContact O-N 3.11Å
197	S	90.2	Very high	87	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-72.4	-36	177	-55.7	0	0	0	0	112.3	S193 Y194 E195 L201	S193-S197 VanDerWaalsContact O-CB 3.3Å; S193-S197 WeakPolarHBondContact O-CB 3.22Å; S193-S197 PolarHBondContact O-N 2.86Å; S193-S197 PolarHBondContact O-OG 3.04Å; Y194-S197 PolarHBondContact O-N 2.7Å; E195-S197 PolarHBondContact O-N 2.78Å; S197-L201 VanDerWaalsContact O-CB 3.29Å; S197-L201 WeakPolarHBondContact O-CB 3.26Å; S197-L201 WeakPolarHBondContact O-CD1 3.3Å; S197-L201 WeakPolarHBondContact O-CG 3.29Å; S197-L201 PolarHBondContact O-N 3.49Å
198	Y	94.4	Very high	86.2	Confident	85 Å²	85	76.5 Å²	76.5	33%	0.333	35%	0.347	S	S	.	.	H	α-helix	trans	-68.3	-45.7	175.4	174.2	-96.2	0	0	0	111.5	L174 F175 Y194 E195 K202	L174-Y198 HydrophobicContact CD1-CD2 3.96Å; L174-Y198 HydrophobicContact CD1-CE2 4Å; F175-Y198 AromaticContact CE2-CD2 3.66Å; F175-Y198 HydrophobicContact CE2-CD2 3.66Å; F175-Y198 HydrophobicContact CE2-CE2 4.22Å; F175-Y198 HydrophobicContact CE2-CG 4.47Å; F175-Y198 AromaticContact CZ-CD2 3.5Å; F175-Y198 HydrophobicContact CZ-CD2 3.5Å; F175-Y198 VanDerWaalsContact CZ-CD2 3.5Å; F175-Y198 AromaticContact CZ-CE2 3.72Å; F175-Y198 HydrophobicContact CZ-CE2 3.72Å; F175-Y198 HydrophobicContact CZ-CG 4.26Å; F175-Y198 WeakPolarHBondContact CZ-O 3.31Å; Y194-Y198 WeakPolarHBondContact O-CB 3.19Å; Y194-Y198 PolarHBondContact O-N 3.41Å; E195-Y198 WeakPolarHBondContact O-CB 3.26Å; E195-Y198 PolarHBondContact O-N 3.31Å; E195-Y198 VanDerWaalsContact O-N 3.08Å; Y198-K202 HydrophobicContact CE1-CD 4.35Å; Y198-K202 WeakPolarHBondContact O-CB 3.47Å; Y198-K202 PolarHBondContact O-N 2.92Å
199	E	91.4	Very high	85.8	Confident	134 Å²	134	81.2 Å²	81.2	63%	0.626	36%	0.361	S	S	*	.	H	α-helix	trans	-60.1	-49.4	175.4	-71	-173.2	131.8	0	0	111.6	E195 K202 E203	E195-E199 PolarHBondContact O-N 2.77Å; E199-K202 PolarHBondContact O-N 3.01Å; E199-E203 PolarHBondContact O-N 3.06Å
200	Q	91.2	Very high	85.2	Confident	50 Å²	50	77 Å²	77	23%	0.234	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-46	-179.6	-173.4	172	12.4	0	0	112.6	V186 N190 K196 K202 E203 E204	V186-Q200 HydrophobicContact CG1-CB 4.41Å; V186-Q200 HydrophobicContact CG1-CG 4.45Å; N190-Q200 PolarHBondContact ND2-OE1 2.75Å; K196-Q200 WeakPolarHBondContact O-CB 3.34Å; K196-Q200 PolarHBondContact O-N 3.35Å; K196-Q200 VanDerWaalsContact O-N 3.11Å; Q200-K202 VanDerWaalsContact C-N 3.31Å; Q200-K202 PolarHBondContact O-N 3.34Å; Q200-E203 PolarHBondContact O-N 2.99Å; Q200-E204 WeakPolarHBondContact O-CG 3.47Å; Q200-E204 PolarHBondContact O-N 2.95Å; Q200-E204 VanDerWaalsContact O-N 3.09Å
201	L	92.7	Very high	84.2	Confident	0 Å²	0	84.4 Å²	84.4	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-67.9	-31.2	177.8	-69.6	168	0	0	0	112.2	L171 F175 F178 Y182 I183 V186 S197 D205	L171-L201 HydrophobicContact CD2-CD1 4.32Å; F175-L201 HydrophobicContact CD1-CB 4.03Å; F175-L201 HydrophobicContact CD2-CB 3.63Å; F175-L201 HydrophobicContact CD2-CD1 3.73Å; F175-L201 HydrophobicContact CD2-CG 4.3Å; F175-L201 HydrophobicContact CE1-CB 4.01Å; F175-L201 HydrophobicContact CE2-CB 3.59Å; F175-L201 HydrophobicContact CE2-CD1 4.07Å; F175-L201 HydrophobicContact CE2-CG 4.49Å; F175-L201 HydrophobicContact CG-CB 3.84Å; F175-L201 HydrophobicContact CG-CD1 4.44Å; F175-L201 HydrophobicContact CZ-CB 3.78Å; F178-L201 HydrophobicContact CD2-CD2 3.64Å; F178-L201 HydrophobicContact CE2-CB 4.24Å; F178-L201 HydrophobicContact CE2-CD2 3.89Å; F178-L201 WeakPolarHBondContact CE2-O 3.16Å; F178-L201 HydrophobicContact CG-CD2 4.24Å; Y182-L201 HydrophobicContact CD1-CD2 4.02Å; Y182-L201 HydrophobicContact CE1-CD2 3.94Å; I183-L201 HydrophobicContact CG1-CD1 4.14Å; I183-L201 HydrophobicContact CG1-CD2 4.26Å; I183-L201 HydrophobicContact CG2-CD1 4.27Å; V186-L201 HydrophobicContact CB-CD2 4.46Å; V186-L201 HydrophobicContact CG1-CD2 4.46Å; V186-L201 HydrophobicContact CG1-CG 4.16Å; V186-L201 HydrophobicContact CG2-CD2 4.16Å; S197-L201 VanDerWaalsContact O-CB 3.29Å; S197-L201 WeakPolarHBondContact O-CB 3.26Å; S197-L201 WeakPolarHBondContact O-CD1 3.3Å; S197-L201 WeakPolarHBondContact O-CG 3.29Å; S197-L201 PolarHBondContact O-N 3.49Å; L201-D205 WeakPolarHBondContact O-CB 2.93Å; L201-D205 PolarHBondContact O-N 2.85Å
202	K	91.1	Very high	83	Confident	100 Å²	100	81.3 Å²	81.3	44%	0.435	37%	0.366	S	S	.	.	H	α-helix	trans	-68.9	-48.6	174.5	-177.2	-169.3	171.8	-159.2	0	111.6	F175 Y198 E199 Q200 E204 D205 D206	F175-K202 HydrophobicContact CE1-CB 3.99Å; F175-K202 HydrophobicContact CZ-CB 4.08Å; Y198-K202 HydrophobicContact CE1-CD 4.35Å; Y198-K202 WeakPolarHBondContact O-CB 3.47Å; Y198-K202 PolarHBondContact O-N 2.92Å; E199-K202 PolarHBondContact O-N 3.01Å; Q200-K202 VanDerWaalsContact C-N 3.31Å; Q200-K202 PolarHBondContact O-N 3.34Å; K202-E204 PolarHBondContact O-N 3.06Å; K202-D205 PolarHBondContact O-N 2.92Å; K202-D206 WeakPolarHBondContact O-CB 3.32Å; K202-D206 PolarHBondContact O-N 2.81Å
203	E	90.4	Very high	82	Confident	123 Å²	123	84 Å²	84	58%	0.575	39%	0.387	S	S	*	.	H	α-helix	trans	-60.8	-36.4	178.7	-164.3	-164.5	-112.7	0	0	111.4	E199 Q200 R207	E199-E203 PolarHBondContact O-N 3.06Å; Q200-E203 PolarHBondContact O-N 2.99Å; E203-R207 WeakPolarHBondContact O-CB 3.48Å; E203-R207 PolarHBondContact O-N 2.97Å; E203-R207 IonicContact OE2-CZ 2.73Å; E203-R207 IonicContact OE2-NE 2.62Å; E203-R207 IonicContact OE2-NH2 3.32Å; E203-R207 PolarHBondContact OE2-NH2 2.84Å
204	E	86.6	Confident	80.5	Confident	39 Å²	39	89.2 Å²	89.2	18%	0.182	41%	0.405	C	S	.	.	H	α-helix	trans	-72.1	-38.1	174	-69.1	-166.4	133.1	0	0	113.5	F178 Y182 Q200 K202 R207 E208	F178-E204 HydrophobicContact CE1-CB 4.32Å; F178-E204 HydrophobicContact CZ-CB 3.73Å; Y182-E204 VanDerWaalsContact CE1-OE2 3.28Å; Y182-E204 WeakPolarHBondContact CE1-OE2 3.37Å; Y182-E204 VanDerWaalsContact CZ-OE2 3.31Å; Y182-E204 VanDerWaalsContact OH-CD 3.27Å; Y182-E204 PolarHBondContact OH-OE1 3.43Å; Y182-E204 PolarHBondContact OH-OE2 3.43Å; Q200-E204 WeakPolarHBondContact O-CG 3.47Å; Q200-E204 PolarHBondContact O-N 2.95Å; Q200-E204 VanDerWaalsContact O-N 3.09Å; K202-E204 PolarHBondContact O-N 3.06Å; E204-R207 PolarHBondContact O-N 3.4Å; E204-R207 IonicContact OE1-NH1 3.63Å; E204-E208 WeakPolarHBondContact O-CB 3.46Å; E204-E208 PolarHBondContact O-N 3.37Å
205	D	87.1	Confident	78.1	Confident	10 Å²	10	91.1 Å²	91.1	5%	0.053	42%	0.423	C	S	.	.	H	α-helix	trans	-67.5	-39.7	175.9	-166.3	50.2	0	0	0	111.4	F175 R177 F178 L201 K202 E208 R209	F175-D205 HydrophobicContact CD1-CB 4.45Å; R177-D205 VanDerWaalsContact CD-OD1 3.28Å; R177-D205 WeakPolarHBondContact CD-OD1 3.26Å; R177-D205 IonicContact CZ-OD1 3.38Å; R177-D205 IonicContact NE-OD1 3.66Å; R177-D205 PolarHBondContact NH1-O 3.34Å; R177-D205 IonicContact NH1-OD1 3.88Å; R177-D205 PolarHBondContact NH1-OD1 3.27Å; F178-D205 HydrophobicContact CE2-CB 4.15Å; F178-D205 HydrophobicContact CZ-CB 4.26Å; L201-D205 WeakPolarHBondContact O-CB 2.93Å; L201-D205 PolarHBondContact O-N 2.85Å; K202-D205 PolarHBondContact O-N 2.92Å; D205-E208 CarbonylContact O-C 3.52Å; D205-E208 PolarHBondContact O-N 3.45Å; D205-R209 WeakPolarHBondContact O-CB 3.34Å; D205-R209 WeakPolarHBondContact O-CG 3.27Å; D205-R209 PolarHBondContact O-N 3.47Å; D205-R209 IonicContact OD2-CZ 3.9Å; D205-R209 IonicContact OD2-NE 3.68Å; D205-R209 PolarHBondContact OD2-NE 3.28Å; D205-R209 IonicContact OD2-NH2 2.64Å; D205-R209 PolarHBondContact OD2-NH2 3.47Å
206	D	84.4	Confident	75.4	Confident	61 Å²	61	95.2 Å²	95.2	33%	0.326	43%	0.432	S	S	.	.	H	α-helix	trans	-68.3	-40.9	175.1	-74.6	-34.3	0	0	0	111.8	K202 E208 R209 E210	K202-D206 WeakPolarHBondContact O-CB 3.32Å; K202-D206 PolarHBondContact O-N 2.81Å; D206-E208 VanDerWaalsContact C-N 3.32Å; D206-E208 PolarHBondContact O-N 2.96Å; D206-R209 WeakPolarHBondContact O-CB 3.43Å; D206-R209 PolarHBondContact O-N 3.21Å; D206-R209 WeakPolarHBondContact OD1-CD 3.44Å; D206-R209 IonicContact OD1-CZ 2.63Å; D206-R209 IonicContact OD1-NE 3.72Å; D206-R209 IonicContact OD1-NH1 3.78Å; D206-R209 PolarHBondContact OD1-NH1 3.26Å; D206-E210 PolarHBondContact O-N 3.22Å
207	R	79.8	Confident	72.8	Confident	122 Å²	122	95.6 Å²	95.6	46%	0.46	44%	0.439	S	S	.	.	H	α-helix	trans	-55.4	-45.8	169	-107.3	-177.1	-78.6	133.6	-5.5	112	E203 E204 E210 R211	E203-R207 WeakPolarHBondContact O-CB 3.48Å; E203-R207 PolarHBondContact O-N 2.97Å; E203-R207 IonicContact OE2-CZ 2.73Å; E203-R207 IonicContact OE2-NE 2.62Å; E203-R207 IonicContact OE2-NH2 3.32Å; E203-R207 PolarHBondContact OE2-NH2 2.84Å; E204-R207 PolarHBondContact O-N 3.4Å; E204-R207 IonicContact OE1-NH1 3.63Å; R207-E210 PolarHBondContact O-N 2.79Å; R207-R211 WeakPolarHBondContact O-CB 3.27Å; R207-R211 PolarHBondContact O-N 2.95Å
208	E	72	Confident	70.1	Confident	90 Å²	90	102.7 Å²	102.7	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-78.8	-19.9	-178.3	-163.5	68.4	173.9	0	0	112.5	R177 E204 D205 D206 R211 C212	R177-E208 PolarHBondContact NH2-O 2.89Å; E204-E208 WeakPolarHBondContact O-CB 3.46Å; E204-E208 PolarHBondContact O-N 3.37Å; D205-E208 CarbonylContact O-C 3.52Å; D205-E208 PolarHBondContact O-N 3.45Å; D206-E208 VanDerWaalsContact C-N 3.32Å; D206-E208 PolarHBondContact O-N 2.96Å; E208-R211 VanDerWaalsContact OE2-CD 3.3Å; E208-R211 WeakPolarHBondContact OE2-CD 3.33Å; E208-C212 WeakPolarHBondContact O-CB 3.32Å; E208-C212 PolarHBondContact O-N 2.76Å; E208-C212 VanDerWaalsContact O-N 3.1Å; E208-C212 PolarHBondContact O-SG 3.45Å
209	R	72.3	Confident	67	Low	136 Å²	136	107.7 Å²	107.7	51%	0.513	50%	0.502	S	S	.	.	H	α-helix	trans	-69.4	-44.4	165.4	-74.6	166.3	-163.2	-178.6	-4.6	110.6	D205 D206 R211 C212 S213	D205-R209 WeakPolarHBondContact O-CB 3.34Å; D205-R209 WeakPolarHBondContact O-CG 3.27Å; D205-R209 PolarHBondContact O-N 3.47Å; D205-R209 IonicContact OD2-CZ 3.9Å; D205-R209 IonicContact OD2-NE 3.68Å; D205-R209 PolarHBondContact OD2-NE 3.28Å; D205-R209 IonicContact OD2-NH2 2.64Å; D205-R209 PolarHBondContact OD2-NH2 3.47Å; D206-R209 WeakPolarHBondContact O-CB 3.43Å; D206-R209 PolarHBondContact O-N 3.21Å; D206-R209 WeakPolarHBondContact OD1-CD 3.44Å; D206-R209 IonicContact OD1-CZ 2.63Å; D206-R209 IonicContact OD1-NE 3.72Å; D206-R209 IonicContact OD1-NH1 3.78Å; D206-R209 PolarHBondContact OD1-NH1 3.26Å; R209-R211 VanDerWaalsContact C-N 3.32Å; R209-C212 PolarHBondContact O-N 3.35Å; R209-S213 WeakPolarHBondContact O-CB 2.88Å; R209-S213 PolarHBondContact O-N 2.79Å; R209-S213 PolarHBondContact O-OG 3.28Å
210	E	72.4	Confident	64.1	Low	104 Å²	104	105.3 Å²	105.3	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-66.3	-35.7	177.6	-153.2	-153.7	159.5	0	0	111.8	D206 R207 S213 K214	D206-E210 PolarHBondContact O-N 3.22Å; R207-E210 PolarHBondContact O-N 2.79Å; E210-S213 PolarHBondContact O-OG 3Å; E210-S213 VanDerWaalsContact O-OG 3.1Å; E210-K214 VanDerWaalsContact CD-NZ 3.31Å; E210-K214 WeakPolarHBondContact O-CD 3.44Å; E210-K214 WeakPolarHBondContact O-CG 3.33Å; E210-K214 PolarHBondContact O-N 3.46Å; E210-K214 VanDerWaalsContact OE1-CE 3.25Å; E210-K214 WeakPolarHBondContact OE1-CE 3.47Å; E210-K214 IonicContact OE1-NZ 3.24Å; E210-K214 PolarHBondContact OE1-NZ 3.45Å; E210-K214 IonicContact OE2-NZ 2.7Å
211	R	63.5	Low	61.3	Low	184 Å²	184	108.9 Å²	108.9	69%	0.694	53%	0.533	S	S	*	.	H	α-helix	trans	-65.7	-39.6	172.3	-156.6	177.6	-167.7	105.4	5.6	112	R207 E208 R209	R207-R211 WeakPolarHBondContact O-CB 3.27Å; R207-R211 PolarHBondContact O-N 2.95Å; E208-R211 VanDerWaalsContact OE2-CD 3.3Å; E208-R211 WeakPolarHBondContact OE2-CD 3.33Å; R209-R211 VanDerWaalsContact C-N 3.32Å
212	C	57.8	Low	58.5	Low	67 Å²	67	118.5 Å²	118.5	45%	0.453	58%	0.575	S	S	.	*	H	α-helix	trans	-72.9	-36.3	174.6	-72.1	0	0	0	0	113.7	E208 R209 K214 V215	E208-C212 WeakPolarHBondContact O-CB 3.32Å; E208-C212 PolarHBondContact O-N 2.76Å; E208-C212 VanDerWaalsContact O-N 3.1Å; E208-C212 PolarHBondContact O-SG 3.45Å; R209-C212 PolarHBondContact O-N 3.35Å; C212-K214 PolarHBondContact O-N 3.35Å; C212-V215 PolarHBondContact O-N 2.9Å
213	S	58.1	Low	55.8	Low	81 Å²	81	118.6 Å²	118.6	57%	0.566	59%	0.594	S	S	*	*	H	α-helix	trans	-68.6	-24.5	-177.3	68.3	0	0	0	0	113.1	R209 E210 V215	R209-S213 WeakPolarHBondContact O-CB 2.88Å; R209-S213 PolarHBondContact O-N 2.79Å; R209-S213 PolarHBondContact O-OG 3.28Å; E210-S213 PolarHBondContact O-OG 3Å; E210-S213 VanDerWaalsContact O-OG 3.1Å; S213-V215 PolarHBondContact O-N 3.07Å
214	K	50.7	Low	52.9	Low	146 Å²	146	121.4 Å²	121.4	64%	0.635	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-5.9	170.7	-68.7	168.6	-173.1	171.9	0	113.7	E210 C212	E210-K214 VanDerWaalsContact CD-NZ 3.31Å; E210-K214 WeakPolarHBondContact O-CD 3.44Å; E210-K214 WeakPolarHBondContact O-CG 3.33Å; E210-K214 PolarHBondContact O-N 3.46Å; E210-K214 VanDerWaalsContact OE1-CE 3.25Å; E210-K214 WeakPolarHBondContact OE1-CE 3.47Å; E210-K214 IonicContact OE1-NZ 3.24Å; E210-K214 PolarHBondContact OE1-NZ 3.45Å; E210-K214 IonicContact OE2-NZ 2.7Å; C212-K214 PolarHBondContact O-N 3.35Å
215	V	37.4	Very low	50.4	Low	103 Å²	103	125.2 Å²	125.2	62%	0.624	64%	0.639	S	S	*	*			trans	-114.5	102.1	179.9	-177	0	0	0	0	111	C212 S213	C212-V215 PolarHBondContact O-N 2.9Å; S213-V215 PolarHBondContact O-N 3.07Å
216	R	32.9	Very low	47.9	Very low	230 Å²	230	134.3 Å²	134.3	87%	0.868	68%	0.678	S	S	*	*			trans	-104.1	113.8	171.8	-71.3	-175.5	175.7	-176.2	-1	110.9	I218	R216-I218 PolarHBondContact O-N 3.5Å
217	L	33.1	Very low	45.3	Very low	142 Å²	142	142.5 Å²	142.5	74%	0.743	70%	0.704	S	S	*	*			trans	-78.3	112.5	171.4	-77	165.1	0	0	0	110.2	Y265	L217-Y265 HydrophobicContact CD2-CD1 4.22Å
218	I	32.3	Very low	43	Very low	149 Å²	149	142.7 Å²	142.7	76%	0.764	72%	0.721	S	S	*	*			trans	-87.6	130	170	-59.2	176.7	0	0	0	108.3	R216 A220	R216-I218 PolarHBondContact O-N 3.5Å; I218-A220 PolarHBondContact O-N 3.35Å
219	Q	29.6	Very low	41.1	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	74%	0.739	S	S	*	*			trans	-81.8	114.4	177	-170.9	172.9	27.2	0	0	109.9
220	A	30.7	Very low	39.4	Very low	85 Å²	85	145.9 Å²	145.9	70%	0.702	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-63.8	140.3	176.1	0	0	0	0	0	111.3	I218	I218-A220 PolarHBondContact O-N 3.35Å
221	P	31.8	Very low	37.5	Very low	124 Å²	124	145.1 Å²	145.1	81%	0.805	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-66.6	144.6	178.3	28.3	-34.6	0	0	0	111	A223	P221-A223 PolarHBondContact O-N 2.89Å
222	K	33.8	Very low	36.1	Very low	202 Å²	202	144.9 Å²	144.9	88%	0.878	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.5	119	173.3	-73.7	-179.3	177	176.4	0	109.5	E224	K222-E224 PolarHBondContact O-N 2.99Å
223	A	34.2	Very low	35	Very low	102 Å²	102	147.2 Å²	147.2	84%	0.843	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-66.6	118.3	171.5	0	0	0	0	0	110.5	P221 S225	P221-A223 PolarHBondContact O-N 2.89Å; A223-S225 PolarHBondContact O-N 2.92Å
224	E	30	Very low	34	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.9	117	177.5	-64.1	-172.4	128.5	0	0	111	K222 K226	K222-E224 PolarHBondContact O-N 2.99Å; E224-K226 PolarHBondContact O-N 3.36Å
225	S	35.3	Very low	33.1	Very low	119 Å²	119	151.9 Å²	151.9	83%	0.832	80%	0.798	S	S	*	*			trans	-73.9	98.5	172.8	-173	0	0	0	0	109.8	A223 R227	A223-S225 PolarHBondContact O-N 2.92Å; S225-R227 PolarHBondContact O-N 3.19Å
226	K	33.1	Very low	32.7	Very low	201 Å²	201	158.6 Å²	158.6	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-55.3	121.4	176.6	-66	178.4	179.4	177.2	0	110.7	E224	E224-K226 PolarHBondContact O-N 3.36Å
227	R	30.2	Very low	32.7	Very low	232 Å²	232	153.1 Å²	153.1	88%	0.875	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-89	155.2	161.3	-70.2	-173.3	177.9	-170.7	-0.1	110.1	S225	S225-R227 PolarHBondContact O-N 3.19Å
228	P	32.4	Very low	32.4	Very low	126 Å²	126	155.4 Å²	155.4	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.1	158.3	167.1	-20.3	33.2	0	0	0	111.9
229	T	32.2	Very low	32.3	Very low	130 Å²	130	156.2 Å²	156.2	80%	0.798	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-64.5	141.5	-179.2	47.4	0	0	0	0	113.1
230	D	35.1	Very low	32.3	Very low	163 Å²	163	152.4 Å²	152.4	87%	0.872	81%	0.81	S	S	*	*				-157.9	171.9	116.4	-119.4	-33.9	0	0	0	114.6
231	S	32.7	Very low	32	Very low	88 Å²	88	157.2 Å²	157.2	62%	0.615	82%	0.823	S	S	*	*			trans	-78.4	157.8	-148.2	75.4	0	0	0	0	120.8
232	K	35	Very low	31.8	Very low	180 Å²	180	160.1 Å²	160.1	78%	0.783	83%	0.825	S	S	*	*			trans	84.7	95.6	144.3	-77.2	163.4	-176.7	170.8	0	122.5
233	T	33.6	Very low	31.7	Very low	115 Å²	115	155.3 Å²	155.3	71%	0.706	82%	0.817	S	S	*	*				53.2	116.1	122.5	56.9	0	0	0	0	121.4
234	H	37.1	Very low	31.3	Very low	184 Å²	184	158.7 Å²	158.7	85%	0.852	82%	0.816	S	S	*	*				-160.5	155.5	103.6	-119.2	-86.6	0	0	0	113.3
235	N	31.6	Very low	31.1	Very low	142 Å²	142	154.6 Å²	154.6	76%	0.759	81%	0.813	S	S	*	*			trans	-90	149.5	-166.7	-52.8	-24.4	0	0	0	114.4
236	R	30.2	Very low	30.6	Very low	244 Å²	244	157.8 Å²	157.8	92%	0.921	81%	0.812	S	S	*	*			trans	-155.8	160.3	131.9	-104	-160.6	167.3	173	-3.6	110.9
237	P	32.9	Very low	30.3	Very low	114 Å²	114	155.5 Å²	155.5	74%	0.74	81%	0.809	S	S	*	*			trans	-101	165.6	-142.7	38.6	-38.8	0	0	0	115.9
238	E	26.9	Very low	30.1	Very low	191 Å²	191	150 Å²	150	89%	0.893	81%	0.805	S	S	*	*			trans	-70.1	155	171.1	-57.7	-175.8	143.3	0	0	112.9
239	L	30.8	Very low	29.9	Very low	165 Å²	165	151.1 Å²	151.1	86%	0.864	80%	0.8	S	S	*	*			trans	-127.9	146	163.3	-88.7	162.5	0	0	0	108
240	P	28	Very low	29.6	Very low	111 Å²	111	148.6 Å²	148.6	72%	0.721	80%	0.801	S	S	*	*			trans	-75.8	149.7	-160	29.4	-36.1	0	0	0	114	Q242	P240-Q242 PolarHBondContact O-N 3.01Å; P240-Q242 VanDerWaalsContact O-N 3.07Å
241	L	26.3	Very low	29.3	Very low	186 Å²	186	147.2 Å²	147.2	97%	0.974	79%	0.792	S	S	*	*			trans	-63.1	103.5	167.7	-77.8	155.8	0	0	0	110.3
242	Q	27.3	Very low	29.2	Very low	184 Å²	184	149 Å²	149	86%	0.86	80%	0.802	S	S	*	*			trans	-103.1	135.7	168	-159.4	162.8	11.9	0	0	109.7	P240	P240-Q242 PolarHBondContact O-N 3.01Å; P240-Q242 VanDerWaalsContact O-N 3.07Å
243	S	30.2	Very low	28.9	Very low	101 Å²	101	149 Å²	149	71%	0.706	81%	0.809	S	S	*	*			trans	-78	172.7	-176.1	53.8	0	0	0	0	112.5
244	Q	26	Very low	28.6	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	81%	0.809	S	S	*	*			trans	76.4	77.2	176.5	-48.9	-178.9	5.8	0	0	116.2
245	A	26.9	Very low	28.4	Very low	96 Å²	96	149.5 Å²	149.5	79%	0.793	81%	0.812	S	S	*	*			trans	-122.1	91.2	158.4	0	0	0	0	0	110	L247	A245-L247 PolarHBondContact O-N 2.98Å; A245-L247 VanDerWaalsContact O-N 3.16Å
246	F	25.3	Very low	28.1	Very low	186 Å²	186	147.1 Å²	147.1	82%	0.816	81%	0.806	S	S	*	*			trans	-71.8	101.3	174.6	-79.7	-98.2	0	0	0	110.5	C248	F246-C248 PolarHBondContact O-N 2.81Å
247	L	26.8	Very low	28.2	Very low	154 Å²	154	139.3 Å²	139.3	81%	0.806	79%	0.786	S	S	*	*			trans	-86.6	79.7	169.8	-88.8	169.4	0	0	0	111.5	A245 M249	A245-L247 PolarHBondContact O-N 2.98Å; A245-L247 VanDerWaalsContact O-N 3.16Å; L247-M249 VanDerWaalsContact C-N 3.35Å; L247-M249 PolarHBondContact O-N 2.94Å
248	C	24.5	Very low	28.4	Very low	117 Å²	117	139.1 Å²	139.1	79%	0.791	79%	0.785	S	S	*	*			trans	-66.6	89.2	164.7	-76.8	0	0	0	0	110.8	F246 G250	F246-C248 PolarHBondContact O-N 2.81Å; C248-G250 PolarHBondContact O-N 3.14Å
249	M	29.1	Very low	29	Very low	148 Å²	148	138.8 Å²	138.8	73%	0.729	78%	0.783	S	S	*	*			trans	-90	92.4	168.3	-73.7	-61.4	-64.6	0	0	110.2	L247 L251	L247-M249 VanDerWaalsContact C-N 3.35Å; L247-M249 PolarHBondContact O-N 2.94Å; M249-L251 PolarHBondContact O-N 3.09Å
250	G	25.6	Very low	29.4	Very low	78 Å²	78	134.7 Å²	134.7	80%	0.804	77%	0.765	S	S	*	*			trans	-72.8	91.1	-179.9	0	0	0	0	0	113.2	C248	C248-G250 PolarHBondContact O-N 3.14Å
251	L	29.6	Very low	29.8	Very low	133 Å²	133	131.5 Å²	131.5	70%	0.696	75%	0.748	S	S	*	*			trans	-136.4	140.4	166.4	-72.7	174.9	0	0	0	110.2	M249 L253	M249-L251 PolarHBondContact O-N 3.09Å; L251-L253 PolarHBondContact O-N 2.78Å
252	P	29.6	Very low	30.4	Very low	125 Å²	125	129.9 Å²	129.9	81%	0.812	74%	0.74	S	S	*	*			trans	-66.8	128.2	174.2	28.1	-33.3	0	0	0	110	G254	P252-G254 PolarHBondContact O-N 3.13Å
253	L	29.7	Very low	31	Very low	180 Å²	180	125.8 Å²	125.8	94%	0.942	73%	0.732	S	S	*	*			trans	-72.2	84.6	-169.3	-73.8	166.4	0	0	0	113.2	L251	L251-L253 PolarHBondContact O-N 2.78Å
254	G	27.3	Very low	31.1	Very low	67 Å²	67	127 Å²	127	69%	0.691	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-64.3	145.7	158.5	0	0	0	0	0	111.2	P252 C256	P252-G254 PolarHBondContact O-N 3.13Å; G254-C256 PolarHBondContact O-N 2.87Å
255	R	31.9	Very low	31.3	Very low	243 Å²	243	126.4 Å²	126.4	92%	0.917	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-60.8	131	-175.4	-69.5	-175.8	172.5	-160.8	-3.3	111.9
256	C	26.6	Very low	31.8	Very low	93 Å²	93	131 Å²	131	63%	0.628	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-64.6	136.2	166	-164	0	0	0	0	109.8	G254	G254-C256 PolarHBondContact O-N 2.87Å
257	P	30.8	Very low	32.4	Very low	79 Å²	79	131.6 Å²	131.6	51%	0.513	72%	0.715	S	S	.	*	P	Polyproline II helix	trans	-63.5	138.6	-180	-22.8	34	0	0	0	112.3	H259 V260	P257-H259 PolarHBondContact O-N 3.19Å; P257-V260 HydrophobicContact CB-CG2 4.39Å; P257-V260 PolarHBondContact O-N 3.29Å
258	P	36.8	Very low	33.1	Very low	110 Å²	110	128.2 Å²	128.2	71%	0.714	70%	0.7	S	S	*	*	H	α-helix	trans	-61.2	-24.5	-174.4	23.2	-33.7	0	0	0	113.8	V260	P258-V260 PolarHBondContact O-N 3.28Å
259	H	40.7	Very low	34.2	Very low	185 Å²	185	125.5 Å²	125.5	86%	0.856	68%	0.677	S	S	*	*	H	α-helix	trans	-66.8	-12.4	175.1	-100.9	-68.5	0	0	0	115.3	P257	P257-H259 PolarHBondContact O-N 3.19Å
260	V	39	Very low	35.3	Very low	79 Å²	79	122.9 Å²	122.9	48%	0.479	67%	0.669	S	S	.	*	H	α-helix	trans	-99	-27.4	-177.7	-172.9	0	0	0	0	112.2	P257 P258	P257-V260 HydrophobicContact CB-CG2 4.39Å; P257-V260 PolarHBondContact O-N 3.29Å; P258-V260 PolarHBondContact O-N 3.28Å
261	A	36.5	Very low	36.5	Very low	44 Å²	44	119.9 Å²	119.9	36%	0.364	64%	0.635	S	S	.	*	H	α-helix	trans	-68.8	-43.6	-172.6	0	0	0	0	0	113.4	S263	A261-S263 PolarHBondContact O-N 2.73Å; A261-S263 VanDerWaalsContact O-N 3.07Å
262	N	39.4	Very low	37.5	Very low	152 Å²	152	119.9 Å²	119.9	81%	0.813	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	1.7	-171	-65.2	13.7	0	0	0	114.3
263	S	40	Very low	38.6	Very low	97 Å²	97	121 Å²	121	68%	0.678	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-11.2	-178	-175	0	0	0	0	114.4	A261	A261-S263 PolarHBondContact O-N 2.73Å; A261-S263 VanDerWaalsContact O-N 3.07Å
264	L	31.9	Very low	39.6	Very low	126 Å²	126	114.7 Å²	114.7	66%	0.66	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	-7	-163.8	-71.5	172.8	0	0	0	115.5
265	Y	29.6	Very low	40.6	Very low	162 Å²	162	115.2 Å²	115.2	64%	0.635	61%	0.606	S	S	*	*			trans	-139.3	124.3	-172.3	-56.1	-79.3	0	0	0	111.3	L217	L217-Y265 HydrophobicContact CD2-CD1 4.22Å
266	R	37	Very low	41.5	Very low	193 Å²	193	108.2 Å²	108.2	73%	0.728	59%	0.59	S	S	*	*			trans	-100.5	145.3	169.7	-159.4	173.7	-174.7	177.7	-0.4	108.8	D280	R266-D280 IonicContact CZ-OD2 2.68Å; R266-D280 IonicContact NE-OD2 2.68Å; R266-D280 IonicContact NH2-OD2 3.28Å; R266-D280 PolarHBondContact NH2-OD2 3.46Å
267	R	39.1	Very low	42.9	Very low	199 Å²	199	105.3 Å²	105.3	75%	0.751	57%	0.567	S	S	*	*			trans	-79.5	138.9	173.6	-67.3	-177.4	-177.5	171.8	1.3	109.5	A279	R267-A279 HydrophobicContact CB-CB 3.71Å; R267-A279 PolarHBondContact O-N 2.88Å
268	V	41	Very low	44.3	Very low	82 Å²	82	102.1 Å²	102.1	50%	0.497	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	135.5	-177.5	-161.5	0	0	0	0	106.9	V276 E277	V268-V276 HydrophobicContact CG1-CG1 3.34Å; V268-E277 CarbonylContact C-O 3.58Å; V268-E277 WeakPolarHBondContact CA-O 3.29Å; V268-E277 WeakPolarHBondContact CG1-O 3.49Å
269	I	46.9	Very low	45.4	Very low	61 Å²	61	97.3 Å²	97.3	31%	0.313	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.9	179.4	-65.1	-178.1	0	0	0	108.3	E277 A279 H282	I269-E277 PolarHBondContact N-O 3.06Å; I269-E277 PolarHBondContact O-N 3.3Å; I269-A279 HydrophobicContact CD1-CB 4.4Å; I269-A279 HydrophobicContact CG1-CB 4.45Å; I269-H282 HydrophobicContact CB-CB 4.43Å; I269-H282 HydrophobicContact CD1-CB 4.01Å
270	V	53.4	Low	46.4	Very low	92 Å²	92	90.9 Å²	90.9	56%	0.558	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.6	175.8	-173.4	0	0	0	0	107.6	T275 V276	V270-T275 CarbonylContact C-O 3.6Å; V270-T275 VanDerWaalsContact CA-O 3.31Å; V270-T275 WeakPolarHBondContact CA-O 3.36Å; V270-V276 HydrophobicContact CG2-CG2 4.34Å
271	T	49.4	Very low	47.4	Very low	15 Å²	15	91.9 Å²	91.9	9%	0.092	49%	0.488	C	S	.	.			trans	-77	164.7	-177.9	76.1	0	0	0	0	110.9	E273 G274 T275 E277	T271-E273 WeakPolarHBondContact CB-OE2 3.45Å; T271-E273 PolarHBondContact O-N 3.47Å; T271-E273 VanDerWaalsContact O-N 3.14Å; T271-E273 PolarHBondContact OG1-OE2 3.25Å; T271-G274 PolarHBondContact O-N 2.82Å; T271-T275 PolarHBondContact N-O 2.96Å; T271-T275 PolarHBondContact OG1-OG1 3.07Å; T271-E277 HydrophobicContact CG2-CG 4Å
272	P	51	Low	48.7	Very low	133 Å²	133	92.9 Å²	92.9	86%	0.864	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.6	177.4	-26.2	36.9	0	0	0	114.5	G274	P272-G274 VanDerWaalsContact C-N 3.27Å; P272-G274 PolarHBondContact O-N 3.2Å
273	E	52.7	Low	49.7	Very low	148 Å²	148	88.9 Å²	88.9	69%	0.692	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-7.7	176	-51.9	73.4	-158.4	0	0	113.2	T271	T271-E273 WeakPolarHBondContact CB-OE2 3.45Å; T271-E273 PolarHBondContact O-N 3.47Å; T271-E273 VanDerWaalsContact O-N 3.14Å; T271-E273 PolarHBondContact OG1-OE2 3.25Å
274	G	50	Low	50.7	Low	48 Å²	48	90.1 Å²	90.1	50%	0.495	46%	0.456	S	S	.	.	S	Bend	trans	86.4	4	-177.6	0	0	0	0	0	114.9	T271 P272	T271-G274 PolarHBondContact O-N 2.82Å; P272-G274 VanDerWaalsContact C-N 3.27Å; P272-G274 PolarHBondContact O-N 3.2Å
275	T	49.7	Very low	52.2	Low	79 Å²	79	89.1 Å²	89.1	49%	0.485	45%	0.447	S	S	.	.			trans	-69.5	149.2	170.9	12.6	0	0	0	0	111.6	V270 T271	V270-T275 CarbonylContact C-O 3.6Å; V270-T275 VanDerWaalsContact CA-O 3.31Å; V270-T275 WeakPolarHBondContact CA-O 3.36Å; T271-T275 PolarHBondContact N-O 2.96Å; T271-T275 PolarHBondContact OG1-OG1 3.07Å
276	V	51.1	Low	53.5	Low	96 Å²	96	88 Å²	88	58%	0.582	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.5	-170.5	179.9	0	0	0	0	108.8	V268 V270	V268-V276 HydrophobicContact CG1-CG1 3.34Å; V270-V276 HydrophobicContact CG2-CG2 4.34Å
277	E	55.8	Low	54.3	Low	31 Å²	31	84 Å²	84	15%	0.145	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.9	-170.4	-49.4	-167.8	141.2	0	0	110.5	V268 I269 T271 H282 K285	V268-E277 CarbonylContact C-O 3.58Å; V268-E277 WeakPolarHBondContact CA-O 3.29Å; V268-E277 WeakPolarHBondContact CG1-O 3.49Å; I269-E277 PolarHBondContact N-O 3.06Å; I269-E277 PolarHBondContact O-N 3.3Å; T271-E277 HydrophobicContact CG2-CG 4Å; E277-H282 IonicContact OE2-CE1 2.79Å; E277-H282 IonicContact OE2-CG 3.48Å; E277-H282 IonicContact OE2-ND1 3.2Å; E277-H282 PolarHBondContact OE2-ND1 3.38Å; E277-K285 IonicContact OE1-NZ 2.77Å; E277-K285 PolarHBondContact OE1-NZ 3.28Å; E277-K285 IonicContact OE2-NZ 2.69Å
278	S	59.7	Low	54.9	Low	13 Å²	13	79.7 Å²	79.7	9%	0.091	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	148.8	171.3	-159.6	0	0	0	0	110.1	D280 E281 H282	S278-D280 PolarHBondContact O-N 3.47Å; S278-D280 PolarHBondContact OG-OD2 3.01Å; S278-E281 WeakPolarHBondContact CB-OE2 3.43Å; S278-E281 PolarHBondContact N-OE2 3.23Å; S278-E281 PolarHBondContact O-N 3.49Å; S278-H282 WeakPolarHBondContact O-CB 3.35Å; S278-H282 PolarHBondContact O-N 2.99Å
279	A	59.4	Low	55.5	Low	8 Å²	8	80.2 Å²	80.2	7%	0.066	44%	0.437	C	S	.	.	H	α-helix	trans	-57.3	-38.5	171.2	0	0	0	0	0	111.2	R267 I269 H282 E283	R267-A279 HydrophobicContact CB-CB 3.71Å; R267-A279 PolarHBondContact O-N 2.88Å; I269-A279 HydrophobicContact CD1-CB 4.4Å; I269-A279 HydrophobicContact CG1-CB 4.45Å; A279-H282 PolarHBondContact O-N 3.32Å; A279-E283 PolarHBondContact O-N 3.24Å
280	D	61.9	Low	55.1	Low	50 Å²	50	80.7 Å²	80.7	27%	0.267	44%	0.443	S	S	.	.	H	α-helix	trans	-59.4	-47.5	175.9	-28.7	-58.8	0	0	0	111.6	Y43 R266 S278 H282 Q284	Y43-D280 PolarHBondContact OH-OD1 3.28Å; R266-D280 IonicContact CZ-OD2 2.68Å; R266-D280 IonicContact NE-OD2 2.68Å; R266-D280 IonicContact NH2-OD2 3.28Å; R266-D280 PolarHBondContact NH2-OD2 3.46Å; S278-D280 PolarHBondContact O-N 3.47Å; S278-D280 PolarHBondContact OG-OD2 3.01Å; D280-H282 PolarHBondContact O-N 2.87Å; D280-Q284 WeakPolarHBondContact O-CG 3.41Å; D280-Q284 PolarHBondContact O-N 3.22Å
281	E	60.2	Low	54.3	Low	101 Å²	101	79.4 Å²	79.4	47%	0.472	45%	0.448	S	S	.	.	H	α-helix	trans	-69	-32.8	-178.7	-67.1	167.6	158.1	0	0	112.3	S278 K285	S278-E281 WeakPolarHBondContact CB-OE2 3.43Å; S278-E281 PolarHBondContact N-OE2 3.23Å; S278-E281 PolarHBondContact O-N 3.49Å; E281-K285 WeakPolarHBondContact O-CG 3.43Å; E281-K285 PolarHBondContact O-N 3.05Å
282	H	64.3	Low	53.6	Low	64 Å²	64	86.3 Å²	86.3	30%	0.296	48%	0.484	S	S	.	.	H	α-helix	trans	-77.7	-38	-179.5	-161.3	79	0	0	0	111.8	I269 E277 S278 A279 D280 K285 F286	I269-H282 HydrophobicContact CB-CB 4.43Å; I269-H282 HydrophobicContact CD1-CB 4.01Å; E277-H282 IonicContact OE2-CE1 2.79Å; E277-H282 IonicContact OE2-CG 3.48Å; E277-H282 IonicContact OE2-ND1 3.2Å; E277-H282 PolarHBondContact OE2-ND1 3.38Å; S278-H282 WeakPolarHBondContact O-CB 3.35Å; S278-H282 PolarHBondContact O-N 2.99Å; A279-H282 PolarHBondContact O-N 3.32Å; D280-H282 PolarHBondContact O-N 2.87Å; H282-K285 PolarHBondContact O-N 2.86Å; H282-F286 WeakPolarHBondContact O-CB 3.35Å; H282-F286 PolarHBondContact O-N 3.35Å
283	E	60.5	Low	52.7	Low	68 Å²	68	84 Å²	84	32%	0.318	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-38.7	169.3	-78.6	177.1	150.6	0	0	111.3	Y43 A279 F286 L287	Y43-E283 WeakPolarHBondContact CE1-OE2 3.39Å; Y43-E283 PolarHBondContact OH-OE2 2.94Å; A279-E283 PolarHBondContact O-N 3.24Å; E283-F286 WeakPolarHBondContact O-CB 3.48Å; E283-F286 PolarHBondContact O-N 2.93Å; E283-L287 WeakPolarHBondContact O-CG 3.38Å; E283-L287 PolarHBondContact O-N 3.17Å
284	Q	60.7	Low	51.7	Low	123 Å²	123	83 Å²	83	58%	0.575	48%	0.48	S	S	*	.	H	α-helix	trans	-62.3	-46.8	172.5	-76.6	-179.1	-44	0	0	112.6	D280 F286 L287 D288	D280-Q284 WeakPolarHBondContact O-CG 3.41Å; D280-Q284 PolarHBondContact O-N 3.22Å; Q284-F286 PolarHBondContact O-N 3.4Å; Q284-L287 PolarHBondContact O-N 3.09Å; Q284-L287 VanDerWaalsContact O-N 3.08Å; Q284-D288 PolarHBondContact O-N 3.35Å
285	K	63.4	Low	50.8	Low	105 Å²	105	86.2 Å²	86.2	46%	0.457	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-32.1	173.6	-75.7	170.4	-179	166.9	0	113.3	E277 E281 H282 S289	E277-K285 IonicContact OE1-NZ 2.77Å; E277-K285 PolarHBondContact OE1-NZ 3.28Å; E277-K285 IonicContact OE2-NZ 2.69Å; E281-K285 WeakPolarHBondContact O-CG 3.43Å; E281-K285 PolarHBondContact O-N 3.05Å; H282-K285 PolarHBondContact O-N 2.86Å; K285-S289 WeakPolarHBondContact O-CB 3.37Å; K285-S289 PolarHBondContact O-N 3.11Å; K285-S289 PolarHBondContact O-OG 2.87Å
286	F	56.6	Low	50	Low	139 Å²	139	87.2 Å²	87.2	61%	0.61	51%	0.511	S	S	*	.	H	α-helix	trans	-71.9	-36.4	175.3	-168.5	-94.9	0	0	0	112.2	H282 E283 Q284 S289 T290	H282-F286 WeakPolarHBondContact O-CB 3.35Å; H282-F286 PolarHBondContact O-N 3.35Å; E283-F286 WeakPolarHBondContact O-CB 3.48Å; E283-F286 PolarHBondContact O-N 2.93Å; Q284-F286 PolarHBondContact O-N 3.4Å; F286-S289 PolarHBondContact O-OG 3.23Å; F286-T290 HydrophobicContact CE1-CG2 4.37Å; F286-T290 WeakPolarHBondContact O-CG2 3.32Å; F286-T290 PolarHBondContact O-N 2.85Å; F286-T290 PolarHBondContact O-OG1 3.48Å
287	L	53.4	Low	49	Very low	108 Å²	108	90.7 Å²	90.7	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-70.8	-42.1	173.4	-68.6	165.3	0	0	0	112	E283 Q284 S289 T290	E283-L287 WeakPolarHBondContact O-CG 3.38Å; E283-L287 PolarHBondContact O-N 3.17Å; Q284-L287 PolarHBondContact O-N 3.09Å; Q284-L287 VanDerWaalsContact O-N 3.08Å; L287-S289 VanDerWaalsContact C-N 3.34Å; L287-S289 PolarHBondContact O-N 3.33Å; L287-T290 WeakPolarHBondContact CA-OG1 3.39Å; L287-T290 PolarHBondContact O-N 3.05Å; L287-T290 PolarHBondContact O-OG1 3.37Å; L287-T290 VanDerWaalsContact O-OG1 3.06Å
288	D	51.9	Low	47.8	Very low	110 Å²	110	98.3 Å²	98.3	59%	0.588	56%	0.561	S	S	*	*	H	α-helix	trans	-64.4	-37.3	176.8	-71.6	-31.2	0	0	0	112.3	Q284	Q284-D288 PolarHBondContact O-N 3.35Å
289	S	53.2	Low	46.4	Very low	93 Å²	93	104 Å²	104	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-81.1	-10.2	179.2	55	0	0	0	0	114.7	K285 F286 L287	K285-S289 WeakPolarHBondContact O-CB 3.37Å; K285-S289 PolarHBondContact O-N 3.11Å; K285-S289 PolarHBondContact O-OG 2.87Å; F286-S289 PolarHBondContact O-OG 3.23Å; L287-S289 VanDerWaalsContact C-N 3.34Å; L287-S289 PolarHBondContact O-N 3.33Å
290	T	39.1	Very low	45.1	Very low	70 Å²	70	109 Å²	109	43%	0.429	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	2.5	176.3	44.1	0	0	0	0	114	F286 L287 L292	F286-T290 HydrophobicContact CE1-CG2 4.37Å; F286-T290 WeakPolarHBondContact O-CG2 3.32Å; F286-T290 PolarHBondContact O-N 2.85Å; F286-T290 PolarHBondContact O-OG1 3.48Å; L287-T290 WeakPolarHBondContact CA-OG1 3.39Å; L287-T290 PolarHBondContact O-N 3.05Å; L287-T290 PolarHBondContact O-OG1 3.37Å; L287-T290 VanDerWaalsContact O-OG1 3.06Å; T290-L292 VanDerWaalsContact C-N 3.31Å; T290-L292 PolarHBondContact O-N 3.37Å
291	G	35.6	Very low	43.5	Very low	65 Å²	65	111.6 Å²	111.6	67%	0.67	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.7	19.4	167.1	0	0	0	0	0	115.4
292	L	36.4	Very low	42.1	Very low	160 Å²	160	111.8 Å²	111.8	84%	0.838	66%	0.662	S	S	*	*			trans	-112.6	39.1	-175	-72	170	0	0	0	113	T290	T290-L292 VanDerWaalsContact C-N 3.31Å; T290-L292 PolarHBondContact O-N 3.37Å
293	S	31.7	Very low	40.5	Very low	86 Å²	86	116.7 Å²	116.7	60%	0.601	69%	0.685	S	S	*	*			trans	-114.5	137.6	171.6	55.2	0	0	0	0	111.8
294	S	31.5	Very low	38.9	Very low	126 Å²	126	118.5 Å²	118.5	88%	0.881	70%	0.704	S	S	*	*			trans	-80.5	144.9	-170.3	52.2	0	0	0	0	113.5
295	S	30.6	Very low	37.4	Very low	115 Å²	115	121.4 Å²	121.4	80%	0.804	72%	0.717	S	S	*	*			trans	-75.9	153.8	178	50	0	0	0	0	114.5
296	A	32.4	Very low	36.5	Very low	101 Å²	101	121.9 Å²	121.9	84%	0.835	73%	0.731	S	S	*	*			trans	69.9	104.6	160.5	0	0	0	0	0	118.9
297	L	30.4	Very low	35.5	Very low	168 Å²	168	121.5 Å²	121.5	88%	0.88	74%	0.742	S	S	*	*			trans	-75.6	176.1	144.6	-91.4	149.4	0	0	0	110.7
298	E	30.3	Very low	34.4	Very low	192 Å²	192	128.1 Å²	128.1	90%	0.897	76%	0.76	S	S	*	*			trans	83.5	116.9	166	-51	-162.4	155	0	0	118.8
299	T	30.7	Very low	34	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	77%	0.768	S	S	*	*			trans	-78.3	150	165.7	55	0	0	0	0	110.5
300	P	31.6	Very low	32.9	Very low	113 Å²	113	133.9 Å²	133.9	73%	0.734	78%	0.78	S	S	*	*				-152.1	156.3	88.1	39.9	-22.3	0	0	0	118
301	S	28.5	Very low	32.8	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	79%	0.793	S	S	*	*			trans	52.7	124.1	144.3	63.1	0	0	0	0	123.1
302	S	31.2	Very low	32.5	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	80%	0.796	S	S	*	*			trans	103.9	125.4	130.9	78.1	0	0	0	0	122
303	H	29.8	Very low	32.2	Very low	166 Å²	166	137 Å²	137	77%	0.769	79%	0.793	S	S	*	*			trans	64.4	126.3	149.6	-78	-71	0	0	0	125.5
304	C	27.3	Very low	32.2	Very low	106 Å²	106	141.1 Å²	141.1	72%	0.716	80%	0.8	S	S	*	*			trans	79.1	88.1	137.5	-64.5	0	0	0	0	122.2
305	E	30	Very low	32.2	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.864	79%	0.792	S	S	*	*				55	145.2	125.6	-67.5	-158.5	110.7	0	0	124.5
306	P	44.1	Very low	32	Very low	114 Å²	114	138.6 Å²	138.6	74%	0.74	79%	0.789	S	S	*	*			trans	-110.4	171.2	-179.6	42.9	-35.7	0	0	0	115.2
307	P	34.9	Very low	32.1	Very low	131 Å²	131	142.3 Å²	142.3	85%	0.851	79%	0.794	S	S	*	*			trans	-117.3	170.6	154.9	30.7	-16.6	0	0	0	114.7
308	R	31.7	Very low	32	Very low	247 Å²	247	143.9 Å²	143.9	93%	0.932	79%	0.794	S	S	*	*			trans	-100.9	165.5	-165.1	-82.4	-172.5	-174	-152.3	3.6	115.4
309	P	42.1	Very low	32.2	Very low	118 Å²	118	143 Å²	143	77%	0.766	79%	0.793	S	S	*	*			trans	-93.2	174.5	-170.5	38.2	-39.3	0	0	0	115.5
310	K	30.5	Very low	32	Very low	207 Å²	207	141.7 Å²	141.7	90%	0.9	79%	0.79	S	S	*	*			trans	-159.6	162.9	154.6	-108.8	159.4	-174.9	179.6	0	112.9
311	P	37	Very low	32.4	Very low	108 Å²	108	142.3 Å²	142.3	70%	0.701	79%	0.794	S	S	*	*			trans	-124.2	-173.8	-156.8	45	-34.6	0	0	0	116.8
312	S	30.7	Very low	32.5	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	80%	0.801	S	S	*	*			trans	74.9	146.6	162.7	71.5	0	0	0	0	116.5
313	L	29.8	Very low	32.4	Very low	147 Å²	147	144 Å²	144	77%	0.77	80%	0.8	S	S	*	*			cis	-163.2	174.1	48.9	-95.7	174.6	0	0	0	114.4
314	F	30.7	Very low	32.5	Very low	173 Å²	173	142.2 Å²	142.2	76%	0.759	80%	0.8	S	S	*	*			trans	85.2	119	147.3	-102.5	-124.7	0	0	0	123.5
315	T	31	Very low	32.7	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	80%	0.798	S	S	*	*			trans	35.1	138.7	136.1	61.8	0	0	0	0	121.8
316	G	27.6	Very low	32.8	Very low	72 Å²	72	140.8 Å²	140.8	74%	0.742	79%	0.794	S	S	*	*			cis	111.9	121.2	4	0	0	0	0	0	114.1
317	L	33.7	Very low	32.4	Very low	180 Å²	180	141 Å²	141	94%	0.942	80%	0.796	S	S	*	*			trans	-156.5	154.3	173.1	-111.8	169.4	0	0	0	111.3
318	K	28.2	Very low	32.8	Very low	200 Å²	200	140 Å²	140	87%	0.87	79%	0.789	S	S	*	*			trans	-118.9	141.3	178.3	-62.1	175.7	178.1	178.9	0	110.8
319	I	34.4	Very low	32.9	Very low	173 Å²	173	135.5 Å²	135.5	89%	0.887	78%	0.782	S	S	*	*			trans	-138.7	155.8	157.7	-62.1	-172.8	0	0	0	109.4
320	S	26.9	Very low	32.7	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	78%	0.778	S	S	*	*			trans	-96.6	171.2	-159.8	-38.8	0	0	0	0	115.1
321	P	39.4	Very low	32.7	Very low	126 Å²	126	133.2 Å²	133.2	82%	0.818	76%	0.764	S	S	*	*			trans	-90.7	163.8	-177.4	37.1	-35.8	0	0	0	114.7
322	V	31.9	Very low	32.5	Very low	145 Å²	145	135.2 Å²	135.2	88%	0.879	77%	0.768	S	S	*	*			trans	-140.6	155.9	173.3	179.5	0	0	0	0	110.2
323	S	28.5	Very low	32.7	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	76%	0.763	S	S	*	*			trans	-130.2	145.2	-172.4	174.1	0	0	0	0	113.1
324	T	32.4	Very low	32.6	Very low	128 Å²	128	134.2 Å²	134.2	79%	0.785	76%	0.761	S	S	*	*			trans	-149.3	104.5	172.4	-47.5	0	0	0	0	107.8
325	V	30.4	Very low	32.5	Very low	108 Å²	108	132.5 Å²	132.5	66%	0.655	75%	0.753	S	S	*	*				72	94.5	73.3	175.1	0	0	0	0	111.4
326	L	32.5	Very low	32.4	Very low	152 Å²	152	133.8 Å²	133.8	80%	0.796	75%	0.749	S	S	*	*				75.9	168.2	97.2	-76.5	166	0	0	0	114.4
327	P	36.2	Very low	32.4	Very low	119 Å²	119	138.6 Å²	138.6	77%	0.773	75%	0.752	S	S	*	*			cis	-131	-178	3.2	27.5	-2.6	0	0	0	116.5
328	P	43.9	Very low	32.2	Very low	110 Å²	110	135 Å²	135	71%	0.714	74%	0.742	S	S	*	*			trans	-112.8	176.4	-178.9	42.5	-35	0	0	0	115.9
329	I	34	Very low	32.4	Very low	153 Å²	153	131.2 Å²	131.2	79%	0.785	74%	0.738	S	S	*	*			trans	-176.5	150.2	171.9	-107.7	157.3	0	0	0	106.4
330	H	36.8	Very low	32.4	Very low	145 Å²	145	128.6 Å²	128.6	67%	0.671	73%	0.732	S	S	*	*			cis	-170.1	175	-1.6	-120.8	23.9	0	0	0	107.5
331	Q	30.9	Very low	32.5	Very low	132 Å²	132	134.7 Å²	134.7	62%	0.617	74%	0.739	S	S	*	*			cis	-170.3	168.5	-15.3	-146.3	-173.5	9.8	0	0	109.7
332	L	33.5	Very low	32.2	Very low	150 Å²	150	133.9 Å²	133.9	79%	0.785	73%	0.734	S	S	*	*			trans	66.7	148.7	157.8	-57.8	168.6	0	0	0	120.1
333	A	33.3	Very low	31.9	Very low	74 Å²	74	131.1 Å²	131.1	61%	0.612	72%	0.721	S	S	*	*			cis	-167.3	144.6	-22.6	0	0	0	0	0	112.5
334	E	27.6	Very low	31.8	Very low	155 Å²	155	135 Å²	135	72%	0.724	73%	0.728	S	S	*	*			trans	33.1	156.6	140	-46.3	-174.2	129.5	0	0	122.3
335	F	28.5	Very low	31.6	Very low	137 Å²	137	135.8 Å²	135.8	60%	0.601	72%	0.723	S	S	*	*			cis	-170.5	148.1	29.9	-123.6	-38.8	0	0	0	112.6
336	K	28.9	Very low	31.3	Very low	143 Å²	143	137.5 Å²	137.5	62%	0.622	72%	0.724	S	S	*	*			trans	63.3	158	150.4	-70.6	153.6	-177	138.5	0	118.7
337	Q	29.4	Very low	31.1	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	72%	0.721	S	S	*	*			cis	-159	165.6	-11.3	-119.1	159.8	-27.9	0	0	111.5
338	S	28.1	Very low	30.6	Very low	106 Å²	106	138.8 Å²	138.8	74%	0.741	72%	0.721	S	S	*	*			trans	-105.1	-171.7	171.2	61.9	0	0	0	0	110.6
339	P	32.8	Very low	29.9	Very low	119 Å²	119	139 Å²	139	77%	0.773	72%	0.721	S	S	*	*			cis	-134.7	-110	15.5	27.4	2.4	0	0	0	119.8
340	P	34.6	Very low	29.6	Very low	119 Å²	119	135.8 Å²	135.8	77%	0.773	71%	0.712	S	S	*	*				-130.3	-168.1	-116.9	43.9	-25.1	0	0	0	119.7
341	R	29.1	Very low	29.2	Very low	234 Å²	234	134.9 Å²	134.9	88%	0.883	71%	0.711	S	S	*	*			trans	-43.6	171.7	167.7	-80.9	-172.4	179.2	-170.4	1.3	116.4
342	P	32.7	Very low	29	Very low	109 Å²	109	134.1 Å²	134.1	71%	0.708	71%	0.712	S	S	*	*			cis	-149.5	-157.4	29.4	39.3	-14	0	0	0	117.9
343	S	25.9	Very low	28.7	Very low	87 Å²	87	134.2 Å²	134.2	61%	0.608	71%	0.713	S	S	*	*			trans	68.5	124.9	154.4	35.2	0	0	0	0	119.3
344	E	26.5	Very low	28.5	Very low	181 Å²	181	134.8 Å²	134.8	85%	0.846	72%	0.718	S	S	*	*				76.9	142	78	-73.1	165.3	165.5	0	0	113
345	E	27.5	Very low	28.6	Very low	146 Å²	146	134.5 Å²	134.5	68%	0.682	72%	0.717	S	S	*	*			cis	-161.8	163.2	14.8	-129.6	-167	146.3	0	0	113.7
346	Q	25.6	Very low	28.5	Very low	144 Å²	144	132.7 Å²	132.7	67%	0.673	72%	0.717	S	S	*	*			trans	61.8	163.8	148.1	-68	-172.9	33.1	0	0	125.7
347	M	27.8	Very low	28.6	Very low	149 Å²	149	132.7 Å²	132.7	73%	0.734	72%	0.723	S	S	*	*			trans	78.4	106.5	163.4	-49.7	-157.9	85.4	0	0	117.6
348	L	26.2	Very low	28.5	Very low	148 Å²	148	131.2 Å²	131.2	78%	0.775	72%	0.72	S	S	*	*				76.1	139	78.6	-73.5	161.2	0	0	0	112.5
349	T	28.7	Very low	28.3	Very low	116 Å²	116	129.4 Å²	129.4	71%	0.712	71%	0.708	S	S	*	*			cis	-142.3	135.3	17.6	51	0	0	0	0	110.6
350	S	27.1	Very low	28.2	Very low	85 Å²	85	133 Å²	133	59%	0.594	71%	0.714	S	S	*	*				85.9	149.7	91.8	88.6	0	0	0	0	117.6
351	D	27.9	Very low	27.8	Very low	125 Å²	125	135.8 Å²	135.8	67%	0.668	72%	0.717	S	S	*	*			trans	72.1	148.3	147.4	-55	-28.7	0	0	0	121.4
352	N	27.3	Very low	27.5	Very low	117 Å²	117	130.5 Å²	130.5	63%	0.626	71%	0.711	S	S	*	*			cis	-168.5	154.9	-21	-108.8	-30.2	0	0	0	111.8
353	N	27.6	Very low	27.1	Very low	151 Å²	151	130.7 Å²	130.7	81%	0.807	71%	0.71	S	S	*	*			trans	60.5	175.6	155.6	-57.3	-25.5	0	0	0	115.9
354	A	29.5	Very low	27	Very low	87 Å²	87	133.3 Å²	133.3	72%	0.719	72%	0.716	S	S	*	*			cis	-157.9	166.1	-12.9	0	0	0	0	0	106
355	E	28.8	Very low	27	Very low	149 Å²	149	132.7 Å²	132.7	70%	0.696	71%	0.713	S	S	*	*			cis	-157.7	143.2	-8.5	-102.7	-106	-67.7	0	0	104.6
356	T	26	Very low	27	Very low	99 Å²	99	134.2 Å²	134.2	61%	0.607	72%	0.72	S	S	*	*				65.4	149	84.7	-47	0	0	0	0	115.8
357	L	30.8	Very low	27	Very low	142 Å²	142	133.2 Å²	133.2	74%	0.743	73%	0.729	S	S	*	*			trans	98.3	131.6	170	-55.5	173.8	0	0	0	117
358	N	28.3	Very low	27	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	73%	0.725	S	S	*	*			cis	-153.7	174	-30.5	-139.2	-3	0	0	0	110.2
359	S	24.3	Very low	27.1	Very low	68 Å²	68	128.1 Å²	128.1	48%	0.476	72%	0.721	S	S	.	*			trans	-128.3	132.9	177.5	59.4	0	0	0	0	112.7	K955	S359-K955 PolarHBondContact OG-NZ 2.76Å; S359-K955 VanDerWaalsContact OG-NZ 3.09Å
360	E	30.5	Very low	27.1	Very low	194 Å²	194	130.4 Å²	130.4	91%	0.907	72%	0.721	S	S	*	*			trans	-129.3	162.4	165.5	-67.5	-164.6	147.1	0	0	111.1
361	E	24.8	Very low	27	Very low	178 Å²	178	135.7 Å²	135.7	83%	0.832	73%	0.733	S	S	*	*			trans	-125.1	-176.3	-167.8	-63	-175.6	116.2	0	0	112.1
362	T	24.5	Very low	27.1	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	74%	0.743	S	S	*	*			trans	97.5	123.7	156.7	74.2	0	0	0	0	120.5
363	T	23.7	Very low	27.1	Very low	113 Å²	113	143.2 Å²	143.2	69%	0.693	75%	0.749	S	S	*	*			trans	62.9	103	143.9	46.2	0	0	0	0	123.5
364	I	24.8	Very low	27.1	Very low	141 Å²	141	141.7 Å²	141.7	72%	0.723	75%	0.746	S	S	*	*				82.8	133.2	120.5	-66.9	169.9	0	0	0	119.9
365	Q	25.3	Very low	27	Very low	168 Å²	168	142.6 Å²	142.6	79%	0.785	74%	0.739	S	S	*	*			trans	73	111.9	163.1	-80.3	168.7	37.9	0	0	121.2
366	Q	27.3	Very low	27	Very low	178 Å²	178	143.6 Å²	143.6	83%	0.832	74%	0.743	S	S	*	*			trans	34.9	108.3	134.3	-55.7	-176.3	6.3	0	0	117.4
367	S	26.9	Very low	27.5	Very low	124 Å²	124	141.6 Å²	141.6	87%	0.867	73%	0.731	S	S	*	*				163.6	176.9	74.6	55.9	0	0	0	0	110
368	G	26	Very low	27.9	Very low	63 Å²	63	137.4 Å²	137.4	65%	0.649	71%	0.713	S	S	*	*			trans	99.9	106.3	153.9	0	0	0	0	0	118.6
369	N	28.3	Very low	28.3	Very low	126 Å²	126	136 Å²	136	67%	0.674	70%	0.702	S	S	*	*			trans	59.5	113.3	138.7	-66.5	-54.6	0	0	0	122.5
370	K	28.6	Very low	29.3	Very low	165 Å²	165	136.2 Å²	136.2	72%	0.717	71%	0.708	S	S	*	*				51.6	111.6	118.6	-55.1	160.5	-174.1	148.9	0	118.9
371	F	26.7	Very low	30.1	Very low	195 Å²	195	132.6 Å²	132.6	86%	0.855	69%	0.691	S	S	*	*				-155.5	175	110.9	-131.6	-106.1	0	0	0	111.7
372	F	30	Very low	31.3	Very low	199 Å²	199	130 Å²	130	87%	0.873	68%	0.677	S	S	*	*			trans	67	68.6	-169.8	-67.5	-71.2	0	0	0	116.4
373	R	27.2	Very low	32.6	Very low	201 Å²	201	130.8 Å²	130.8	76%	0.758	67%	0.669	S	S	*	*			trans	-94.3	136.3	150.2	-88.8	179.6	162	143.9	1.1	110.1	D375	R373-D375 VanDerWaalsContact CD-OD2 3.28Å; R373-D375 WeakPolarHBondContact CD-OD2 3.41Å; R373-D375 IonicContact NE-OD2 3.74Å; R373-D375 PolarHBondContact NE-OD2 3.24Å; R373-D375 VanDerWaalsContact NE-OD2 3.15Å
374	T	26.6	Very low	33.9	Very low	119 Å²	119	131.2 Å²	131.2	73%	0.73	66%	0.662	S	S	*	*			trans	-132.2	72.4	155	38.6	0	0	0	0	109	H376	T374-H376 PolarHBondContact O-N 2.9Å
375	D	27.7	Very low	35.1	Very low	107 Å²	107	133.5 Å²	133.5	57%	0.572	66%	0.661	S	S	*	*			trans	-69.7	57.2	178.4	-85.6	-59.1	0	0	0	112.5	R373 V377	R373-D375 VanDerWaalsContact CD-OD2 3.28Å; R373-D375 WeakPolarHBondContact CD-OD2 3.41Å; R373-D375 IonicContact NE-OD2 3.74Å; R373-D375 PolarHBondContact NE-OD2 3.24Å; R373-D375 VanDerWaalsContact NE-OD2 3.15Å; D375-V377 PolarHBondContact O-N 3.03Å
376	H	28.2	Very low	36.1	Very low	169 Å²	169	127.5 Å²	127.5	78%	0.782	65%	0.645	S	S	*	*			trans	-77.2	57	171.9	-69.9	-66.4	0	0	0	111.8	T374 S378	T374-H376 PolarHBondContact O-N 2.9Å; H376-S378 PolarHBondContact O-N 3.37Å; H376-S378 VanDerWaalsContact O-N 3.07Å
377	V	37.2	Very low	37.2	Very low	58 Å²	58	125.2 Å²	125.2	35%	0.352	63%	0.629	S	S	.	*			trans	-59.2	110.8	154.9	-179.2	0	0	0	0	106.4	D375 Q381 K382	D375-V377 PolarHBondContact O-N 3.03Å; V377-Q381 HydrophobicContact CG1-CB 3.81Å; V377-K382 HydrophobicContact CG1-CG 4Å
378	S	38.3	Very low	38.4	Very low	54 Å²	54	122.8 Å²	122.8	38%	0.378	61%	0.606	S	S	.	*			trans	-58.9	150.4	-170.1	68.4	0	0	0	0	112	H376 A380 Q381 K382	H376-S378 PolarHBondContact O-N 3.37Å; H376-S378 VanDerWaalsContact O-N 3.07Å; S378-A380 PolarHBondContact O-N 3.2Å; S378-A380 VanDerWaalsContact O-N 3.15Å; S378-Q381 WeakPolarHBondContact O-CA 3.38Å; S378-Q381 PolarHBondContact O-N 2.97Å; S378-Q381 WeakPolarHBondContact OG-CG 3.49Å; S378-Q381 PolarHBondContact OG-N 2.93Å; S378-K382 PolarHBondContact O-N 3.43Å
379	E	38.6	Very low	39.5	Very low	112 Å²	112	124.6 Å²	124.6	52%	0.523	60%	0.601	S	S	.	*	H	α-helix	trans	-48.4	-41.7	174	-105.7	-71.9	100.4	0	0	111.6	Q381 K382 K383	E379-Q381 PolarHBondContact O-N 2.86Å; E379-K382 PolarHBondContact O-N 3.28Å; E379-K383 VanDerWaalsContact O-CB 3.32Å; E379-K383 WeakPolarHBondContact O-CB 3.46Å; E379-K383 PolarHBondContact O-N 3.14Å; E379-K383 WeakPolarHBondContact OE2-CD 3.41Å; E379-K383 WeakPolarHBondContact OE2-CE 3.41Å; E379-K383 IonicContact OE2-NZ 3.63Å; E379-K383 PolarHBondContact OE2-NZ 3.48Å
380	A	43.8	Very low	40.3	Very low	72 Å²	72	125.9 Å²	125.9	60%	0.595	60%	0.596	S	S	*	*	H	α-helix	trans	-60.1	-41.5	173.8	0	0	0	0	0	113.3	S378 K384	S378-A380 PolarHBondContact O-N 3.2Å; S378-A380 VanDerWaalsContact O-N 3.15Å; A380-K384 WeakPolarHBondContact O-CB 3.26Å; A380-K384 PolarHBondContact O-N 3.43Å
381	Q	47.7	Very low	41.3	Very low	118 Å²	118	123.5 Å²	123.5	55%	0.551	59%	0.588	S	S	*	*	H	α-helix	trans	-72.3	-37.6	176.9	-74.3	-179	-1.9	0	0	112.8	V377 S378 E379 K384 R385	V377-Q381 HydrophobicContact CG1-CB 3.81Å; S378-Q381 WeakPolarHBondContact O-CA 3.38Å; S378-Q381 PolarHBondContact O-N 2.97Å; S378-Q381 WeakPolarHBondContact OG-CG 3.49Å; S378-Q381 PolarHBondContact OG-N 2.93Å; E379-Q381 PolarHBondContact O-N 2.86Å; Q381-K384 PolarHBondContact O-N 2.92Å; Q381-R385 PolarHBondContact O-N 3.33Å
382	K	49.5	Very low	42.2	Very low	124 Å²	124	120.4 Å²	120.4	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-63.9	-50.1	172.8	-80	179.2	178.8	171.1	0	111.2	V377 S378 E379 K384 R385 G386	V377-K382 HydrophobicContact CG1-CG 4Å; S378-K382 PolarHBondContact O-N 3.43Å; E379-K382 PolarHBondContact O-N 3.28Å; K382-K384 VanDerWaalsContact C-N 3.34Å; K382-K384 PolarHBondContact O-N 3.05Å; K382-R385 PolarHBondContact O-N 3.47Å; K382-G386 PolarHBondContact O-N 3.21Å
383	K	52.2	Low	42.7	Very low	140 Å²	140	120.1 Å²	120.1	61%	0.609	57%	0.571	S	S	*	*	H	α-helix	trans	-60.3	-40	174.9	-78.1	169.4	167.6	159.5	0	112.1	E379 G386 Y387	E379-K383 VanDerWaalsContact O-CB 3.32Å; E379-K383 WeakPolarHBondContact O-CB 3.46Å; E379-K383 PolarHBondContact O-N 3.14Å; E379-K383 WeakPolarHBondContact OE2-CD 3.41Å; E379-K383 WeakPolarHBondContact OE2-CE 3.41Å; E379-K383 IonicContact OE2-NZ 3.63Å; E379-K383 PolarHBondContact OE2-NZ 3.48Å; K383-G386 PolarHBondContact O-N 3.2Å; K383-Y387 PolarHBondContact O-N 3.06Å
384	K	50.5	Low	43.4	Very low	123 Å²	123	115.9 Å²	115.9	54%	0.535	57%	0.567	S	S	.	*	H	α-helix	trans	-65.1	-40.5	175.7	-166	160.3	-169.7	161.8	0	112.5	A380 Q381 K382 I388	A380-K384 WeakPolarHBondContact O-CB 3.26Å; A380-K384 PolarHBondContact O-N 3.43Å; Q381-K384 PolarHBondContact O-N 2.92Å; K382-K384 VanDerWaalsContact C-N 3.34Å; K382-K384 PolarHBondContact O-N 3.05Å; K384-I388 HydrophobicContact CG-CD1 4.25Å; K384-I388 WeakPolarHBondContact O-CD1 3.5Å; K384-I388 VanDerWaalsContact O-CG1 3.23Å; K384-I388 WeakPolarHBondContact O-CG1 3.2Å; K384-I388 PolarHBondContact O-N 3.12Å
385	R	49.7	Very low	44	Very low	188 Å²	188	114.3 Å²	114.3	71%	0.709	57%	0.566	S	S	*	*	H	α-helix	trans	-63.6	-41.7	170.3	-101.3	-178.7	162.2	-176.6	-5.4	112.5	Q381 K382 I388 N389	Q381-R385 PolarHBondContact O-N 3.33Å; K382-R385 PolarHBondContact O-N 3.47Å; R385-I388 PolarHBondContact O-N 2.96Å; R385-N389 WeakPolarHBondContact O-CB 3.49Å; R385-N389 PolarHBondContact O-N 3.25Å
386	G	47.6	Very low	44.4	Very low	43 Å²	43	114.3 Å²	114.3	44%	0.443	57%	0.57	S	S	.	*	H	α-helix	trans	-61.1	-44.4	176.1	0	0	0	0	0	112.6	K382 K383 N389 R390	K382-G386 PolarHBondContact O-N 3.21Å; K383-G386 PolarHBondContact O-N 3.2Å; G386-N389 PolarHBondContact O-N 3.08Å; G386-R390 PolarHBondContact O-N 3.3Å
387	Y	49	Very low	44.5	Very low	129 Å²	129	112.3 Å²	112.3	51%	0.506	57%	0.569	S	S	.	*	H	α-helix	trans	-65.1	-44.4	177.7	-149.6	-76.8	0	0	0	111.9	K383 N389 R390 E391	K383-Y387 PolarHBondContact O-N 3.06Å; Y387-N389 PolarHBondContact O-N 2.88Å; Y387-R390 VanDerWaalsContact CE2-NH2 3.31Å; Y387-R390 WeakPolarHBondContact O-CB 3.35Å; Y387-R390 PolarHBondContact O-N 3.5Å; Y387-R390 VanDerWaalsContact O-N 3.08Å; Y387-E391 HydrophobicContact CD1-CG 3.99Å; Y387-E391 HydrophobicContact CE1-CG 3.96Å; Y387-E391 PolarHBondContact O-N 3.39Å
388	I	52.6	Low	44.2	Very low	74 Å²	74	115.3 Å²	115.3	38%	0.379	59%	0.593	S	S	.	*	H	α-helix	trans	-59.5	-45.9	175	-70.3	164.4	0	0	0	111	K384 R385 R390 E391 M392	K384-I388 HydrophobicContact CG-CD1 4.25Å; K384-I388 WeakPolarHBondContact O-CD1 3.5Å; K384-I388 VanDerWaalsContact O-CG1 3.23Å; K384-I388 WeakPolarHBondContact O-CG1 3.2Å; K384-I388 PolarHBondContact O-N 3.12Å; R385-I388 PolarHBondContact O-N 2.96Å; I388-R390 PolarHBondContact O-N 2.93Å; I388-E391 PolarHBondContact O-N 3.39Å; I388-M392 HydrophobicContact CG2-CG 4.22Å; I388-M392 VanDerWaalsContact O-CB 3.28Å; I388-M392 WeakPolarHBondContact O-CB 3.36Å; I388-M392 WeakPolarHBondContact O-CG 3.37Å; I388-M392 PolarHBondContact O-N 2.8Å
389	N	49.2	Very low	43.8	Very low	100 Å²	100	118.8 Å²	118.8	54%	0.535	61%	0.612	S	S	.	*	H	α-helix	trans	-67.9	-20.8	177	-76.9	-2	0	0	0	113.2	R385 G386 Y387 R393	R385-N389 WeakPolarHBondContact O-CB 3.49Å; R385-N389 PolarHBondContact O-N 3.25Å; G386-N389 PolarHBondContact O-N 3.08Å; Y387-N389 PolarHBondContact O-N 2.88Å; N389-R393 WeakPolarHBondContact O-CD 3.44Å; N389-R393 VanDerWaalsContact O-CG 3.28Å; N389-R393 WeakPolarHBondContact O-CG 3.32Å
390	R	46.1	Very low	43.2	Very low	154 Å²	154	119.4 Å²	119.4	58%	0.581	63%	0.626	S	S	*	*	H	α-helix	trans	-78	-54.2	173	-168.2	168.6	67.2	175.2	4.2	110.9	G386 Y387 I388 M392 R393 T394	G386-R390 PolarHBondContact O-N 3.3Å; Y387-R390 VanDerWaalsContact CE2-NH2 3.31Å; Y387-R390 WeakPolarHBondContact O-CB 3.35Å; Y387-R390 PolarHBondContact O-N 3.5Å; Y387-R390 VanDerWaalsContact O-N 3.08Å; I388-R390 PolarHBondContact O-N 2.93Å; R390-M392 VanDerWaalsContact C-N 3.33Å; R390-M392 PolarHBondContact O-N 3.49Å; R390-R393 WeakPolarHBondContact O-CB 3.46Å; R390-R393 PolarHBondContact O-N 2.9Å; R390-T394 PolarHBondContact O-N 3.42Å; R390-T394 VanDerWaalsContact O-N 3.08Å; R390-T394 PolarHBondContact O-OG1 2.89Å; R390-T394 VanDerWaalsContact O-OG1 3.06Å
391	E	49.7	Very low	42.6	Very low	114 Å²	114	122.5 Å²	122.5	53%	0.533	64%	0.637	S	S	.	*	H	α-helix	trans	-60.1	-40.3	178.2	-71	-170.6	142.7	0	0	112.9	Y387 I388 R393 T394 A395	Y387-E391 HydrophobicContact CD1-CG 3.99Å; Y387-E391 HydrophobicContact CE1-CG 3.96Å; Y387-E391 PolarHBondContact O-N 3.39Å; I388-E391 PolarHBondContact O-N 3.39Å; E391-R393 PolarHBondContact O-N 3.25Å; E391-T394 PolarHBondContact O-N 3.34Å; E391-T394 VanDerWaalsContact O-N 3.16Å; E391-A395 WeakPolarHBondContact O-CB 3.5Å; E391-A395 PolarHBondContact O-N 2.91Å
392	M	45.4	Very low	41.7	Very low	130 Å²	130	122.2 Å²	122.2	64%	0.64	65%	0.648	S	S	*	*	H	α-helix	trans	-63.4	-22.4	176	-71.6	-73.6	-66	0	0	113.2	I388 R390 T396	I388-M392 HydrophobicContact CG2-CG 4.22Å; I388-M392 VanDerWaalsContact O-CB 3.28Å; I388-M392 WeakPolarHBondContact O-CB 3.36Å; I388-M392 WeakPolarHBondContact O-CG 3.37Å; I388-M392 PolarHBondContact O-N 2.8Å; R390-M392 VanDerWaalsContact C-N 3.33Å; R390-M392 PolarHBondContact O-N 3.49Å; M392-T396 PolarHBondContact O-OG1 3.34Å
393	R	40.5	Very low	40.5	Very low	194 Å²	194	127.7 Å²	127.7	73%	0.732	67%	0.665	S	S	*	*	H	α-helix	trans	-86.9	-32.5	173.6	-75.1	174.6	174.9	-176.1	-3.6	112.4	N389 R390 E391 A395 T396	N389-R393 WeakPolarHBondContact O-CD 3.44Å; N389-R393 VanDerWaalsContact O-CG 3.28Å; N389-R393 WeakPolarHBondContact O-CG 3.32Å; R390-R393 WeakPolarHBondContact O-CB 3.46Å; R390-R393 PolarHBondContact O-N 2.9Å; E391-R393 PolarHBondContact O-N 3.25Å; R393-A395 VanDerWaalsContact C-N 3.3Å; R393-T396 PolarHBondContact O-OG1 2.8Å
394	T	42.4	Very low	39.4	Very low	111 Å²	111	126.5 Å²	126.5	68%	0.681	67%	0.672	S	S	*	*	H	α-helix	trans	-68.4	-31.3	173.2	-29.8	0	0	0	0	111.9	R390 E391 T396	R390-T394 PolarHBondContact O-N 3.42Å; R390-T394 VanDerWaalsContact O-N 3.08Å; R390-T394 PolarHBondContact O-OG1 2.89Å; R390-T394 VanDerWaalsContact O-OG1 3.06Å; E391-T394 PolarHBondContact O-N 3.34Å; E391-T394 VanDerWaalsContact O-N 3.16Å; T394-T396 VanDerWaalsContact C-N 3.3Å; T394-T396 PolarHBondContact O-N 2.83Å
395	A	39.3	Very low	38.2	Very low	86 Å²	86	127.9 Å²	127.9	71%	0.711	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	5	-177.5	0	0	0	0	0	115.5	E391 R393	E391-A395 WeakPolarHBondContact O-CB 3.5Å; E391-A395 PolarHBondContact O-N 2.91Å; R393-A395 VanDerWaalsContact C-N 3.3Å
396	T	35.1	Very low	37.2	Very low	108 Å²	108	126.5 Å²	126.5	66%	0.663	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	9.4	-171.6	31.2	0	0	0	0	115.7	M392 R393 T394	M392-T396 PolarHBondContact O-OG1 3.34Å; R393-T396 PolarHBondContact O-OG1 2.8Å; T394-T396 VanDerWaalsContact C-N 3.3Å; T394-T396 PolarHBondContact O-N 2.83Å
397	V	30.5	Very low	36	Very low	126 Å²	126	130.4 Å²	130.4	76%	0.764	70%	0.704	S	S	*	*			trans	-111.2	78.8	-178.9	-171.5	0	0	0	0	110.8
398	S	31.1	Very low	35.1	Very low	121 Å²	121	128.5 Å²	128.5	85%	0.846	72%	0.715	S	S	*	*			trans	-154.1	128.2	168.6	-68.3	0	0	0	0	110.7
399	T	29.8	Very low	33.8	Very low	128 Å²	128	130.3 Å²	130.3	79%	0.785	73%	0.734	S	S	*	*			trans	-51.7	148.1	-169.3	38.7	0	0	0	0	117.3
400	P	26.6	Very low	32.7	Very low	124 Å²	124	130.2 Å²	130.2	81%	0.805	75%	0.748	S	S	*	*			trans	-83.8	147.7	164.7	35.2	-32.8	0	0	0	111.6
401	V	30.5	Very low	31.9	Very low	138 Å²	138	129.8 Å²	129.8	84%	0.836	76%	0.762	S	S	*	*			trans	-131.8	127.2	168.7	-179.8	0	0	0	0	109.2
402	S	27.6	Very low	30.7	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-82.7	150.3	-173.6	-60.1	0	0	0	0	113.1
403	R	25.4	Very low	29.9	Very low	238 Å²	238	133.8 Å²	133.8	90%	0.898	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-86.5	138.3	167	-63.5	177.3	176.4	-177.8	-3.4	110.5
404	P	28.3	Very low	29.5	Very low	115 Å²	115	131.3 Å²	131.3	75%	0.747	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-80.2	149.1	151.6	33.2	-30.5	0	0	0	110.5
405	I	24.9	Very low	28.9	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	79%	0.785	S	S	*	*			trans	-104.9	137.5	165.7	-65.5	167.9	0	0	0	106.4	T407	I405-T407 HydrophobicContact CG2-CG2 4.19Å
406	I	28.8	Very low	28.3	Very low	160 Å²	160	136.5 Å²	136.5	82%	0.821	79%	0.791	S	S	*	*			trans	-128.3	132.3	169.3	-61.2	-178.2	0	0	0	108.6
407	T	23.4	Very low	28.2	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	80%	0.797	S	S	*	*			trans	-129.7	118.2	-178.9	46.6	0	0	0	0	110	I405	I405-T407 HydrophobicContact CG2-CG2 4.19Å
408	A	29.2	Very low	28.1	Very low	89 Å²	89	138.5 Å²	138.5	74%	0.736	80%	0.802	S	S	*	*			trans	-153.3	130.7	160.1	0	0	0	0	0	106.6
409	S	26.4	Very low	28	Very low	111 Å²	111	139.9 Å²	139.9	78%	0.776	80%	0.8	S	S	*	*			cis	92.3	93.1	30.6	80.4	0	0	0	0	114.5
410	A	25.5	Very low	27.9	Very low	99 Å²	99	138 Å²	138	82%	0.818	79%	0.792	S	S	*	*			trans	53	116.3	149.5	0	0	0	0	0	121
411	V	28.9	Very low	27.9	Very low	145 Å²	145	137.3 Å²	137.3	88%	0.879	79%	0.79	S	S	*	*			trans	-138.3	133.6	131.2	177	0	0	0	0	108.4
412	R	25.3	Very low	27.9	Very low	236 Å²	236	142.6 Å²	142.6	89%	0.891	80%	0.795	S	S	*	*			trans	-107.7	152	149.7	-63.5	171.4	173.2	166.9	-5	104.4
413	S	29	Very low	28.1	Very low	92 Å²	92	146.9 Å²	146.9	64%	0.643	80%	0.8	S	S	*	*			cis	-145.6	-160.1	31.1	33.3	0	0	0	0	108.8
414	D	30.9	Very low	28.4	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	78%	0.778	S	S	*	*			cis	-152.1	-167.7	33.2	-90.4	-68	0	0	0	113.9
415	L	29.5	Very low	28.9	Very low	148 Å²	148	134.9 Å²	134.9	78%	0.775	76%	0.759	S	S	*	*			trans	-107.7	-178.8	-158	-70.3	162.5	0	0	0	114.7
416	D	28.5	Very low	29.4	Very low	158 Å²	158	132.8 Å²	132.8	85%	0.845	75%	0.749	S	S	*	*			trans	74.5	143.5	162.4	-56.7	-28.3	0	0	0	117.2
417	S	31.5	Very low	29.9	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	72%	0.722	S	S	*	*			cis	-144.8	168.2	0.1	58	0	0	0	0	112.6
418	D	28.3	Very low	30.6	Very low	164 Å²	164	122.2 Å²	122.2	88%	0.877	70%	0.695	S	S	*	*			trans	-61	139	175.1	-64.5	-68.8	0	0	0	114.2
419	D	28.7	Very low	31.1	Very low	150 Å²	150	123.4 Å²	123.4	80%	0.802	68%	0.684	S	S	*	*				-151.8	-177.1	127.2	-160.7	6	0	0	0	110.1
420	S	27.8	Very low	31.7	Very low	88 Å²	88	123.2 Å²	123.2	62%	0.615	67%	0.666	S	S	*	*			trans	-141.4	157.3	-136.9	62.8	0	0	0	0	115
421	S	27.4	Very low	32.5	Very low	109 Å²	109	119.3 Å²	119.3	76%	0.762	63%	0.632	S	S	*	*			trans	63.4	91.8	165.9	71.7	0	0	0	0	118.5
422	R	31	Very low	33	Very low	249 Å²	249	113.3 Å²	113.3	94%	0.94	60%	0.597	S	S	*	*			trans	-144.5	148.2	146.3	-95.1	135	-162.7	-134.4	4.5	109.1
423	K	31	Very low	33.5	Very low	202 Å²	202	105.4 Å²	105.4	88%	0.878	57%	0.569	S	S	*	*			trans	-117.2	106.1	-172.9	-67.3	175	-177.3	168.8	0	110.8	G425	K423-G425 PolarHBondContact O-N 3Å
424	P	32	Very low	34	Very low	67 Å²	67	102.6 Å²	102.6	44%	0.435	55%	0.549	S	S	.	.			trans	-75.5	79.4	170.1	30.4	-32.4	0	0	0	109.6	E582	P424-E582 HydrophobicContact CB-CG 4.46Å
425	G	39	Very low	34.4	Very low	34 Å²	34	97.1 Å²	97.1	35%	0.351	53%	0.526	S	S	.	.			trans	-70.4	-48.2	-158.2	0	0	0	0	0	116.2	K423 K429	K423-G425 PolarHBondContact O-N 3Å; G425-K429 WeakPolarHBondContact O-CB 3.13Å; G425-K429 WeakPolarHBondContact O-CD 3.03Å
426	D	36.4	Very low	35	Very low	108 Å²	108	91.1 Å²	91.1	58%	0.578	50%	0.495	S	S	*	.	S	Bend	trans	-121.9	-25.9	-156.5	-66.2	-63.8	0	0	0	116.3	K429 Y430	D426-K429 WeakPolarHBondContact OD1-CD 3.47Å; D426-K429 IonicContact OD1-NZ 2.72Å; D426-K429 PolarHBondContact OD1-NZ 3.35Å; D426-Y430 VanDerWaalsContact O-CB 3.31Å; D426-Y430 WeakPolarHBondContact O-CB 3.29Å; D426-Y430 PolarHBondContact O-N 3.36Å
427	A	38.8	Very low	35.3	Very low	30 Å²	30	84.3 Å²	84.3	25%	0.248	46%	0.459	C	S	.	.	H	α-helix	trans	-70.4	-49.8	175.8	0	0	0	0	0	112.4	K429 Y430 L431 L581 I585	A427-K429 VanDerWaalsContact C-N 3.3Å; A427-K429 PolarHBondContact O-N 3.5Å; A427-Y430 WeakPolarHBondContact O-CB 3.41Å; A427-Y430 PolarHBondContact O-N 3.11Å; A427-Y430 VanDerWaalsContact O-N 3.13Å; A427-L431 PolarHBondContact O-N 3.32Å; A427-L431 VanDerWaalsContact O-N 3.09Å; A427-L581 HydrophobicContact CB-CB 4.09Å; A427-L581 HydrophobicContact CB-CD2 4.08Å; A427-I585 HydrophobicContact CB-CD1 4.49Å
428	V	38.2	Very low	35.5	Very low	34 Å²	34	81.2 Å²	81.2	21%	0.206	44%	0.438	C	S	.	.	H	α-helix	trans	-58.3	-44.4	173	-178.9	0	0	0	0	110.9	Y430 L431 A432 T578 L581	V428-Y430 VanDerWaalsContact C-N 3.32Å; V428-Y430 PolarHBondContact O-N 3.15Å; V428-L431 PolarHBondContact O-N 2.9Å; V428-A432 WeakPolarHBondContact O-CB 3.44Å; V428-A432 PolarHBondContact O-N 3.01Å; V428-T578 HydrophobicContact CG1-CG2 4.22Å; V428-T578 HydrophobicContact CG2-CG2 4.09Å; V428-L581 HydrophobicContact CB-CD1 4.46Å; V428-L581 HydrophobicContact CG2-CB 3.96Å; V428-L581 HydrophobicContact CG2-CD1 4.29Å
429	K	39	Very low	35.6	Very low	114 Å²	114	79 Å²	79	50%	0.496	43%	0.426	S	S	.	.	H	α-helix	trans	-67.4	-28.6	177.3	-176.6	179.8	167	-156.7	0	112.4	G425 D426 A427 K433	G425-K429 WeakPolarHBondContact O-CB 3.13Å; G425-K429 WeakPolarHBondContact O-CD 3.03Å; D426-K429 WeakPolarHBondContact OD1-CD 3.47Å; D426-K429 IonicContact OD1-NZ 2.72Å; D426-K429 PolarHBondContact OD1-NZ 3.35Å; A427-K429 VanDerWaalsContact C-N 3.3Å; A427-K429 PolarHBondContact O-N 3.5Å; K429-K433 WeakPolarHBondContact O-CB 3.43Å; K429-K433 PolarHBondContact O-N 3.05Å; K429-K433 VanDerWaalsContact O-N 3.14Å
430	Y	39.7	Very low	35.7	Very low	106 Å²	106	79.4 Å²	79.4	42%	0.416	43%	0.427	S	S	.	.	H	α-helix	trans	-67	-57.9	169.4	-174.6	-102	0	0	0	110.1	D426 A427 V428 A432 K433 V434 V640	D426-Y430 VanDerWaalsContact O-CB 3.31Å; D426-Y430 WeakPolarHBondContact O-CB 3.29Å; D426-Y430 PolarHBondContact O-N 3.36Å; A427-Y430 WeakPolarHBondContact O-CB 3.41Å; A427-Y430 PolarHBondContact O-N 3.11Å; A427-Y430 VanDerWaalsContact O-N 3.13Å; V428-Y430 VanDerWaalsContact C-N 3.32Å; V428-Y430 PolarHBondContact O-N 3.15Å; Y430-A432 PolarHBondContact O-N 3.3Å; Y430-K433 CarbonylContact O-C 3.55Å; Y430-K433 VanDerWaalsContact O-C 3.28Å; Y430-K433 WeakPolarHBondContact O-CA 3.44Å; Y430-K433 WeakPolarHBondContact O-CB 3.39Å; Y430-K433 PolarHBondContact O-N 3.4Å; Y430-V434 HydrophobicContact CD1-CG2 4.05Å; Y430-V434 HydrophobicContact CD2-CG2 4.47Å; Y430-V434 HydrophobicContact CE1-CG2 3.84Å; Y430-V434 HydrophobicContact CE2-CG2 4.27Å; Y430-V434 HydrophobicContact CG-CG2 4.37Å; Y430-V434 VanDerWaalsContact O-CG2 3.27Å; Y430-V434 WeakPolarHBondContact O-CG2 3.42Å; Y430-V434 PolarHBondContact O-N 3.09Å; Y430-V640 HydrophobicContact CE1-CG2 4.45Å
431	L	40.6	Very low	35.8	Very low	17 Å²	17	80.9 Å²	80.9	9%	0.089	43%	0.432	C	S	.	.	H	α-helix	trans	-67.3	-29.6	-177.4	-74.4	-158.9	0	0	0	114.7	A427 V428 K433 V434 G435 V436 L581	A427-L431 PolarHBondContact O-N 3.32Å; A427-L431 VanDerWaalsContact O-N 3.09Å; V428-L431 PolarHBondContact O-N 2.9Å; L431-K433 VanDerWaalsContact C-N 3.33Å; L431-V434 CarbonylContact O-C 3.4Å; L431-V434 PolarHBondContact O-N 2.76Å; L431-G435 PolarHBondContact O-N 2.9Å; L431-V436 HydrophobicContact CB-CB 4.21Å; L431-V436 HydrophobicContact CD1-CB 4.47Å; L431-V436 HydrophobicContact CD1-CG1 4.27Å; L431-V436 HydrophobicContact CD2-CG2 4.37Å; L431-V436 PolarHBondContact O-N 3.15Å; L431-L581 HydrophobicContact CB-CD1 3.74Å; L431-L581 HydrophobicContact CD1-CD1 3.82Å; L431-L581 HydrophobicContact CD1-CD2 3.74Å; L431-L581 HydrophobicContact CD1-CG 4.12Å; L431-L581 HydrophobicContact CG-CD1 3.93Å; L431-L581 HydrophobicContact CG-CD2 3.82Å; L431-L581 HydrophobicContact CG-CG 4.44Å
432	A	39.9	Very low	35.7	Very low	19 Å²	19	80.9 Å²	80.9	16%	0.157	43%	0.432	C	S	.	.	H	α-helix	trans	-64.3	-38.6	167.2	0	0	0	0	0	111.7	V428 Y430 V434 G435 V437	V428-A432 WeakPolarHBondContact O-CB 3.44Å; V428-A432 PolarHBondContact O-N 3.01Å; Y430-A432 PolarHBondContact O-N 3.3Å; A432-V434 VanDerWaalsContact C-N 3.32Å; A432-V434 PolarHBondContact O-N 2.97Å; A432-G435 PolarHBondContact O-N 3.03Å; A432-G435 VanDerWaalsContact O-N 3.07Å; A432-V437 HydrophobicContact CB-CB 4.47Å
433	K	37	Very low	35.4	Very low	70 Å²	70	80.2 Å²	80.2	30%	0.304	43%	0.43	S	S	.	.	H	α-helix	trans	-81.6	-5.2	177.4	-162.2	175.6	-169.5	-167.7	0	113.8	K429 Y430 L431 F1265 L1268	K429-K433 WeakPolarHBondContact O-CB 3.43Å; K429-K433 PolarHBondContact O-N 3.05Å; K429-K433 VanDerWaalsContact O-N 3.14Å; Y430-K433 CarbonylContact O-C 3.55Å; Y430-K433 VanDerWaalsContact O-C 3.28Å; Y430-K433 WeakPolarHBondContact O-CA 3.44Å; Y430-K433 WeakPolarHBondContact O-CB 3.39Å; Y430-K433 PolarHBondContact O-N 3.4Å; L431-K433 VanDerWaalsContact C-N 3.33Å; K433-F1265 HydrophobicContact CD-CD1 3.5Å; K433-F1265 HydrophobicContact CD-CE1 3.8Å; K433-F1265 HydrophobicContact CD-CG 4.22Å; K433-F1265 VanDerWaalsContact CE-CB 3.48Å; K433-F1265 VanDerWaalsContact CE-CG 3.42Å; K433-F1265 VanDerWaalsContact CE-O 3.32Å; K433-F1265 WeakPolarHBondContact CE-O 3.41Å; K433-F1265 HydrophobicContact CG-CD1 4.19Å; K433-F1265 VanDerWaalsContact NZ-CD2 3.33Å; K433-L1268 VanDerWaalsContact O-CD1 3.24Å; K433-L1268 WeakPolarHBondContact O-CD1 3.37Å
434	V	38.6	Very low	35.2	Very low	34 Å²	34	80.2 Å²	80.2	21%	0.206	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	14	159.2	-142.4	0	0	0	0	113	Y430 L431 A432 V436 V640	Y430-V434 HydrophobicContact CD1-CG2 4.05Å; Y430-V434 HydrophobicContact CD2-CG2 4.47Å; Y430-V434 HydrophobicContact CE1-CG2 3.84Å; Y430-V434 HydrophobicContact CE2-CG2 4.27Å; Y430-V434 HydrophobicContact CG-CG2 4.37Å; Y430-V434 VanDerWaalsContact O-CG2 3.27Å; Y430-V434 WeakPolarHBondContact O-CG2 3.42Å; Y430-V434 PolarHBondContact O-N 3.09Å; L431-V434 CarbonylContact O-C 3.4Å; L431-V434 PolarHBondContact O-N 2.76Å; A432-V434 VanDerWaalsContact C-N 3.32Å; A432-V434 PolarHBondContact O-N 2.97Å; V434-V436 PolarHBondContact O-N 2.78Å; V434-V640 HydrophobicContact CB-CG1 4.09Å; V434-V640 HydrophobicContact CG1-CB 4.44Å; V434-V640 HydrophobicContact CG1-CG1 3.86Å; V434-V640 HydrophobicContact CG1-CG2 4.29Å
435	G	39.3	Very low	34.8	Very low	27 Å²	27	87.9 Å²	87.9	28%	0.278	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	8.8	163.5	0	0	0	0	0	116.3	L431 A432	L431-G435 PolarHBondContact O-N 2.9Å; A432-G435 PolarHBondContact O-N 3.03Å; A432-G435 VanDerWaalsContact O-N 3.07Å
436	V	43	Very low	34.4	Very low	21 Å²	21	92.3 Å²	92.3	13%	0.127	47%	0.472	C	S	.	.	S	Bend	trans	-79.9	-20.2	-178.8	178.5	0	0	0	0	112	L431 V434 A577 V640 L647	L431-V436 HydrophobicContact CB-CB 4.21Å; L431-V436 HydrophobicContact CD1-CB 4.47Å; L431-V436 HydrophobicContact CD1-CG1 4.27Å; L431-V436 HydrophobicContact CD2-CG2 4.37Å; L431-V436 PolarHBondContact O-N 3.15Å; V434-V436 PolarHBondContact O-N 2.78Å; V436-A577 HydrophobicContact CG1-CB 4.5Å; V436-V640 HydrophobicContact CG2-CG1 4.04Å; V436-L647 HydrophobicContact CG1-CD2 4.23Å
437	V	35.2	Very low	33.9	Very low	15 Å²	15	94.1 Å²	94.1	9%	0.091	49%	0.488	C	S	.	.	S	Bend	trans	-129.9	133.7	178.9	-171.3	0	0	0	0	109.4	A432 A574 A577	A432-V437 HydrophobicContact CB-CB 4.47Å; V437-A574 HydrophobicContact CG1-CB 4.25Å; V437-A577 HydrophobicContact CG2-CB 3.69Å
438	S	34.1	Very low	33.6	Very low	48 Å²	48	104.6 Å²	104.6	34%	0.336	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-75.3	134.1	174	46	0	0	0	0	111.1	L440	S438-L440 PolarHBondContact O-N 2.97Å
439	N	31.6	Very low	33.2	Very low	118 Å²	118	115.1 Å²	115.1	63%	0.631	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-62.9	117.7	169.2	-79.3	-28.6	0	0	0	109.3	V441	N439-V441 PolarHBondContact O-N 3.12Å; N439-V441 VanDerWaalsContact O-N 3.14Å
440	L	29.9	Very low	32.8	Very low	158 Å²	158	113 Å²	113	83%	0.827	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-57.5	119.7	169.3	-89.9	72.5	0	0	0	109	S438 S442	S438-L440 PolarHBondContact O-N 2.97Å; L440-S442 PolarHBondContact O-N 3.16Å
441	V	29.3	Very low	32.4	Very low	118 Å²	118	117.8 Å²	117.8	72%	0.715	59%	0.59	S	S	*	*			trans	-71.7	97.3	178.2	178.9	0	0	0	0	108.8	N439 R443	N439-V441 PolarHBondContact O-N 3.12Å; N439-V441 VanDerWaalsContact O-N 3.14Å; V441-R443 VanDerWaalsContact C-N 3.32Å; V441-R443 PolarHBondContact O-N 3.49Å
442	S	25.6	Very low	31.8	Very low	109 Å²	109	122 Å²	122	76%	0.762	62%	0.621	S	S	*	*			trans	-58.3	92.2	168.6	-72.4	0	0	0	0	110.3	L440 K444	L440-S442 PolarHBondContact O-N 3.16Å; S442-K444 VanDerWaalsContact C-N 3.32Å; S442-K444 PolarHBondContact O-N 2.99Å
443	R	26	Very low	31.4	Very low	236 Å²	236	127.6 Å²	127.6	89%	0.891	65%	0.654	S	S	*	*			trans	-60.8	89.2	175.2	-81.3	-177.3	164.8	178.8	-3.9	110.1	V441 R445	V441-R443 VanDerWaalsContact C-N 3.32Å; V441-R443 PolarHBondContact O-N 3.49Å; R443-R445 PolarHBondContact O-N 2.87Å
444	K	26.7	Very low	30.9	Very low	201 Å²	201	134.9 Å²	134.9	87%	0.874	68%	0.679	S	S	*	*			trans	-58.1	102.2	168.9	-77.4	-177.6	176.2	175.9	0	109.1	S442	S442-K444 VanDerWaalsContact C-N 3.32Å; S442-K444 PolarHBondContact O-N 2.99Å
445	R	23.9	Very low	30.7	Very low	229 Å²	229	141.6 Å²	141.6	86%	0.864	71%	0.708	S	S	*	*			trans	-59.5	136.1	162.8	-78.9	-178.5	167.1	177.1	-3.9	108.4	R443 T447	R443-R445 PolarHBondContact O-N 2.87Å; R445-T447 PolarHBondContact O-N 2.88Å
446	P	29.8	Very low	30.2	Very low	127 Å²	127	148.9 Å²	148.9	83%	0.825	73%	0.732	S	S	*	*			trans	-65.8	123.4	178.2	26.7	-33.6	0	0	0	110	R448	P446-R448 PolarHBondContact O-N 2.88Å
447	T	26.8	Very low	29.4	Very low	146 Å²	146	155.6 Å²	155.6	90%	0.896	77%	0.767	S	S	*	*			trans	-81.5	115.3	-179.8	41.4	0	0	0	0	110.8	R445	R445-T447 PolarHBondContact O-N 2.88Å
448	R	32.1	Very low	28.9	Very low	249 Å²	249	160.6 Å²	160.6	94%	0.94	80%	0.797	S	S	*	*			trans	-120.5	133.7	165.5	-144.2	171.7	-176.1	-177.4	-0.5	109.7	P446	P446-R448 PolarHBondContact O-N 2.88Å
449	R	29.4	Very low	28.5	Very low	256 Å²	256	164 Å²	164	97%	0.966	82%	0.817	S	S	*	*			trans	-71	147.2	-169.2	-63.2	169.1	168.4	169.1	-6.5	112.2
450	G	29.9	Very low	28.2	Very low	70 Å²	70	166.8 Å²	166.8	72%	0.722	83%	0.826	S	S	*	*			trans	147.6	88.9	146.1	0	0	0	0	0	119
451	K	32.8	Very low	28.2	Very low	205 Å²	205	167.1 Å²	167.1	89%	0.891	83%	0.827	S	S	*	*			trans	48.6	107.1	144.9	-61.9	-177.2	176.6	-176.8	0	120.3
452	S	27.6	Very low	28.1	Very low	105 Å²	105	169.7 Å²	169.7	73%	0.734	83%	0.831	S	S	*	*				44.8	122.9	120.7	-170.1	0	0	0	0	120
453	T	31.8	Very low	28	Very low	138 Å²	138	172 Å²	172	85%	0.847	83%	0.829	S	S	*	*				-160	171.9	87.1	-68.3	0	0	0	0	110
454	R	26.3	Very low	28	Very low	223 Å²	223	166.4 Å²	166.4	84%	0.842	82%	0.821	S	S	*	*			trans	-117.8	162.5	-155.3	-174.7	-175.2	-176.9	-174.9	3.2	111.7
455	Q	33.9	Very low	28.2	Very low	175 Å²	175	163.3 Å²	163.3	82%	0.818	81%	0.814	S	S	*	*			trans	95.6	153.3	165.2	-54.5	-176.8	40.2	0	0	116.4
456	K	27.9	Very low	28.2	Very low	180 Å²	180	158.7 Å²	158.7	78%	0.783	81%	0.807	S	S	*	*			cis	-179.2	120	-30.8	177.5	-175.1	-178.6	-170.5	0	107.3
457	L	27.4	Very low	28.2	Very low	162 Å²	162	160.1 Å²	160.1	85%	0.848	80%	0.802	S	S	*	*			trans	-172.9	168.3	143	-126.3	72.3	0	0	0	109.8
458	T	25	Very low	28.3	Very low	120 Å²	120	158.8 Å²	158.8	74%	0.736	79%	0.794	S	S	*	*			trans	-142.5	178.3	-173.1	53.4	0	0	0	0	111.1
459	T	24.6	Very low	28.1	Very low	120 Å²	120	152 Å²	152	74%	0.736	79%	0.785	S	S	*	*			trans	86.9	149.8	162.4	-32.2	0	0	0	0	115.3
460	E	26.6	Very low	28.1	Very low	176 Å²	176	146.1 Å²	146.1	82%	0.822	78%	0.777	S	S	*	*			trans	68.9	108.4	174.7	-55.3	-176.9	-163.2	0	0	117.6
461	I	28.7	Very low	28	Very low	165 Å²	165	147.8 Å²	147.8	85%	0.846	78%	0.778	S	S	*	*				-169	132.6	107.6	-93.2	158.8	0	0	0	109.1
462	Q	27.6	Very low	27.8	Very low	171 Å²	171	143.9 Å²	143.9	80%	0.799	77%	0.774	S	S	*	*			trans	-118.6	135.2	168.3	-167.5	177.3	-9.6	0	0	106.7
463	E	23.8	Very low	27.7	Very low	158 Å²	158	143 Å²	143	74%	0.738	77%	0.773	S	S	*	*	S	Bend	trans	68.4	168.6	178.5	-43.2	-157.9	131.2	0	0	118.4
464	V	25.7	Very low	27.8	Very low	118 Å²	118	142.6 Å²	142.6	72%	0.715	77%	0.77	S	S	*	*			trans	65.5	165	164.4	-128.5	0	0	0	0	119.4
465	N	30.3	Very low	27.8	Very low	137 Å²	137	140.4 Å²	140.4	73%	0.733	77%	0.769	S	S	*	*			trans	72.3	111.9	164.1	-54.2	-29.1	0	0	0	115.7
466	N	24.4	Very low	28	Very low	132 Å²	132	136.2 Å²	136.2	71%	0.706	76%	0.755	S	S	*	*			cis	63.7	138.1	40.3	-135.9	54	0	0	0	113
467	E	30	Very low	28.5	Very low	156 Å²	156	133.2 Å²	133.2	73%	0.729	75%	0.747	S	S	*	*			trans	72.9	96.4	166.5	-72	157.9	-111.3	0	0	120.9
468	T	27.8	Very low	29	Very low	119 Å²	119	132.1 Å²	132.1	73%	0.73	75%	0.747	S	S	*	*				77.9	123	108.3	-58.1	0	0	0	0	121.3
469	S	28.5	Very low	30.1	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	74%	0.736	S	S	*	*			trans	73.4	156.9	156.1	86	0	0	0	0	117.5
470	T	29.3	Very low	31.3	Very low	131 Å²	131	132.6 Å²	132.6	80%	0.804	74%	0.737	S	S	*	*			cis	-139.8	120	-1.2	-48.7	0	0	0	0	111.8
471	S	29	Very low	32.6	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	71%	0.705	S	S	*	*	S	Bend	trans	-155.1	152.4	143	78	0	0	0	0	107	A473	S471-A473 PolarHBondContact O-N 3.05Å; S471-A473 VanDerWaalsContact O-N 3.16Å
472	P	28.3	Very low	34	Very low	123 Å²	123	120.9 Å²	120.9	80%	0.799	70%	0.698	S	S	*	*			trans	-61.5	118.7	-141.8	22.4	-34	0	0	0	113.2	V474	P472-V474 PolarHBondContact O-N 3.13Å
473	A	25.7	Very low	35.4	Very low	88 Å²	88	113.7 Å²	113.7	73%	0.727	67%	0.665	S	S	*	*			trans	-65.4	119.8	170.2	0	0	0	0	0	108.9	S471 E475	S471-A473 PolarHBondContact O-N 3.05Å; S471-A473 VanDerWaalsContact O-N 3.16Å; A473-E475 PolarHBondContact O-N 3.45Å
474	V	32.5	Very low	37.3	Very low	128 Å²	128	114 Å²	114	78%	0.776	67%	0.672	S	S	*	*			trans	-77.6	105.2	159.7	-176.9	0	0	0	0	105.8	P472 V476	P472-V474 PolarHBondContact O-N 3.13Å; V474-V476 HydrophobicContact CG1-CG2 3.91Å; V474-V476 PolarHBondContact O-N 3.23Å
475	E	27.3	Very low	39.1	Very low	178 Å²	178	109.2 Å²	109.2	83%	0.832	64%	0.642	S	S	*	*			trans	-68.1	78.9	174.4	-67.2	-173.7	144.2	0	0	110.1	A473 I477	A473-E475 PolarHBondContact O-N 3.45Å; E475-I477 VanDerWaalsContact C-N 3.34Å; E475-I477 PolarHBondContact O-N 3.24Å; E475-I477 VanDerWaalsContact O-N 3.07Å
476	V	37.3	Very low	41.1	Very low	86 Å²	86	106.4 Å²	106.4	52%	0.521	63%	0.63	S	S	.	*			trans	-75.8	95.4	165.3	-176.1	0	0	0	0	107	V474 T478	V474-V476 HydrophobicContact CG1-CG2 3.91Å; V474-V476 PolarHBondContact O-N 3.23Å; V476-T478 PolarHBondContact O-N 3.04Å
477	I	38.3	Very low	43.2	Very low	118 Å²	118	105.2 Å²	105.2	61%	0.605	62%	0.623	S	S	*	*			trans	-43.6	133.2	179.9	-57.5	171.2	0	0	0	110.1	E475 E479	E475-I477 VanDerWaalsContact C-N 3.34Å; E475-I477 PolarHBondContact O-N 3.24Å; E475-I477 VanDerWaalsContact O-N 3.07Å; I477-E479 HydrophobicContact CB-CB 4.3Å; I477-E479 HydrophobicContact CG2-CB 3.88Å; I477-E479 HydrophobicContact CG2-CG 4.11Å; I477-E479 PolarHBondContact O-N 3.19Å
478	T	38.7	Very low	45.1	Very low	139 Å²	139	100.8 Å²	100.8	85%	0.853	61%	0.613	S	S	*	*			trans	-71.8	72.4	168.4	51.7	0	0	0	0	109.5	V476	V476-T478 PolarHBondContact O-N 3.04Å
479	E	46.9	Very low	47	Very low	106 Å²	106	97.9 Å²	97.9	50%	0.495	59%	0.592	S	S	.	*			trans	-100.7	131.8	-174	-143.4	-168	-92.9	0	0	108.1	I477 D481 K529	I477-E479 HydrophobicContact CB-CB 4.3Å; I477-E479 HydrophobicContact CG2-CB 3.88Å; I477-E479 HydrophobicContact CG2-CG 4.11Å; I477-E479 PolarHBondContact O-N 3.19Å; E479-D481 PolarHBondContact O-N 3.34Å; E479-D481 VanDerWaalsContact O-N 3.08Å; E479-K529 WeakPolarHBondContact O-CE 3.44Å; E479-K529 WeakPolarHBondContact OE2-CD 3.3Å; E479-K529 WeakPolarHBondContact OE2-CE 3.23Å; E479-K529 IonicContact OE2-NZ 3.55Å; E479-K529 PolarHBondContact OE2-NZ 3.01Å
480	D	50.9	Low	49	Very low	143 Å²	143	95.4 Å²	95.4	77%	0.765	57%	0.566	S	S	*	*			trans	-63.7	114.8	-167.7	-172.4	2.8	0	0	0	112.5	G482 K529	D480-G482 PolarHBondContact OD1-N 3.29Å; D480-K529 WeakPolarHBondContact O-CE 3.32Å; D480-K529 PolarHBondContact O-NZ 3.35Å
481	D	53.4	Low	51.1	Low	28 Å²	28	93.3 Å²	93.3	15%	0.15	56%	0.555	C	S	.	*			trans	-80.9	-17.1	179.9	-80.3	-9.4	0	0	0	112.7	E479 L483 R490 T528 K529	E479-D481 PolarHBondContact O-N 3.34Å; E479-D481 VanDerWaalsContact O-N 3.08Å; D481-L483 HydrophobicContact CB-CB 4.05Å; D481-L483 HydrophobicContact CB-CG 4.32Å; D481-L483 PolarHBondContact O-N 3.27Å; D481-R490 IonicContact OD2-CZ 3.78Å; D481-R490 IonicContact OD2-NE 2.83Å; D481-R490 PolarHBondContact OD2-NE 3.45Å; D481-R490 IonicContact OD2-NH2 3.28Å; D481-T528 WeakPolarHBondContact OD2-CB 3.48Å; D481-T528 PolarHBondContact OD2-OG1 3.08Å; D481-K529 VanDerWaalsContact OD1-CE 3.22Å; D481-K529 WeakPolarHBondContact OD1-CE 3.48Å; D481-K529 WeakPolarHBondContact OD1-CG 3.36Å
482	G	57.8	Low	53.1	Low	68 Å²	68	94.1 Å²	94.1	70%	0.701	55%	0.548	S	S	*	.	S	Bend	trans	64.3	17.5	-164.5	0	0	0	0	0	113.9	D480	D480-G482 PolarHBondContact OD1-N 3.29Å
483	L	58.5	Low	55.5	Low	20 Å²	20	88.6 Å²	88.6	11%	0.105	51%	0.511	C	S	.	.			trans	-121	120.2	-177.2	-66.9	-177.6	0	0	0	112	D481 L485 R490 V532 Y546	D481-L483 HydrophobicContact CB-CB 4.05Å; D481-L483 HydrophobicContact CB-CG 4.32Å; D481-L483 PolarHBondContact O-N 3.27Å; L483-L485 HydrophobicContact CB-CD1 4.07Å; L483-L485 HydrophobicContact CB-CG 4.18Å; L483-L485 HydrophobicContact CD1-CD1 3.94Å; L483-L485 PolarHBondContact O-N 3.36Å; L483-R490 PolarHBondContact O-NH2 3.01Å; L483-V532 HydrophobicContact CD1-CG2 3.7Å; L483-Y546 HydrophobicContact CD2-CD1 4.21Å; L483-Y546 HydrophobicContact CD2-CD2 4.29Å; L483-Y546 HydrophobicContact CD2-CE1 3.66Å; L483-Y546 HydrophobicContact CD2-CE2 3.77Å; L483-Y546 VanDerWaalsContact CD2-CZ 3.44Å
484	D	62.1	Low	58	Low	164 Å²	164	86.1 Å²	86.1	88%	0.877	49%	0.486	S	S	*	.			trans	-71.9	70.1	171.4	-73	-31.6	0	0	0	111.6
485	L	63.8	Low	60.2	Low	17 Å²	17	82.8 Å²	82.8	9%	0.089	47%	0.468	C	S	.	.			trans	-123	139.4	175.8	-64	173.4	0	0	0	109.7	L483 E489 R490 K550	L483-L485 HydrophobicContact CB-CD1 4.07Å; L483-L485 HydrophobicContact CB-CG 4.18Å; L483-L485 HydrophobicContact CD1-CD1 3.94Å; L483-L485 PolarHBondContact O-N 3.36Å; L485-E489 HydrophobicContact CB-CB 4.23Å; L485-E489 HydrophobicContact CD2-CB 4.04Å; L485-R490 HydrophobicContact CB-CG 4.11Å; L485-R490 PolarHBondContact O-NH1 3.28Å; L485-R490 PolarHBondContact O-NH2 3.15Å; L485-K550 HydrophobicContact CD2-CD 4.05Å
486	T	72.7	Confident	62.5	Low	79 Å²	79	75 Å²	75	49%	0.485	43%	0.431	S	S	.	.			trans	-70.4	157	164.6	61.3	0	0	0	0	110.5	A488 E489 R490	T486-A488 PolarHBondContact O-N 2.98Å; T486-E489 WeakPolarHBondContact CB-OE2 3.48Å; T486-E489 WeakPolarHBondContact CG2-OE2 3.2Å; T486-E489 PolarHBondContact N-OE2 3.01Å; T486-E489 PolarHBondContact O-N 2.64Å; T486-E489 WeakPolarHBondContact OG1-CG 3.24Å; T486-E489 PolarHBondContact OG1-N 3.07Å; T486-E489 PolarHBondContact OG1-OE2 2.74Å; T486-R490 PolarHBondContact O-N 2.79Å
487	N	69.4	Low	64.6	Low	106 Å²	106	70.9 Å²	70.9	57%	0.567	41%	0.406	S	S	*	.	H	α-helix	trans	-62.5	-26.4	177.5	-70.3	-6.9	0	0	0	112.8	R490 C491	N487-R490 PolarHBondContact OD1-NH1 3.27Å; N487-C491 PolarHBondContact O-N 3.11Å; N487-C491 PolarHBondContact O-SG 3.49Å; N487-C491 VanDerWaalsContact O-SG 3.36Å
488	A	69.2	Low	66.7	Low	63 Å²	63	67.1 Å²	67.1	52%	0.521	39%	0.387	S	S	.	.	H	α-helix	trans	-65.6	-48.2	169.8	0	0	0	0	0	111.6	T486 R490 C491 H492	T486-A488 PolarHBondContact O-N 2.98Å; A488-R490 VanDerWaalsContact C-N 3.33Å; A488-R490 PolarHBondContact O-N 3.37Å; A488-C491 PolarHBondContact O-N 3.08Å; A488-H492 PolarHBondContact O-CD2 3.11Å; A488-H492 VanDerWaalsContact O-CD2 3.28Å; A488-H492 PolarHBondContact O-N 2.91Å
489	E	67.9	Low	68.5	Low	59 Å²	59	65.8 Å²	65.8	28%	0.276	38%	0.375	S	S	.	.	H	α-helix	trans	-61.1	-39.8	175.1	-71.5	163.1	108.9	0	0	112.1	L485 T486 C491 H492 L493 K550	L485-E489 HydrophobicContact CB-CB 4.23Å; L485-E489 HydrophobicContact CD2-CB 4.04Å; T486-E489 WeakPolarHBondContact CB-OE2 3.48Å; T486-E489 WeakPolarHBondContact CG2-OE2 3.2Å; T486-E489 PolarHBondContact N-OE2 3.01Å; T486-E489 PolarHBondContact O-N 2.64Å; T486-E489 WeakPolarHBondContact OG1-CG 3.24Å; T486-E489 PolarHBondContact OG1-N 3.07Å; T486-E489 PolarHBondContact OG1-OE2 2.74Å; E489-C491 PolarHBondContact O-N 2.98Å; E489-H492 PolarHBondContact O-N 3.27Å; E489-L493 WeakPolarHBondContact O-CB 3.41Å; E489-L493 PolarHBondContact O-N 3.46Å; E489-K550 WeakPolarHBondContact OE1-CE 3.48Å; E489-K550 IonicContact OE1-NZ 2.68Å; E489-K550 PolarHBondContact OE1-NZ 2.89Å
490	R	70.5	Confident	69.8	Low	55 Å²	55	60.8 Å²	60.8	21%	0.208	35%	0.352	C	S	.	.	H	α-helix	trans	-54.8	-51.4	173.8	-68.5	-168	170.8	71.5	21.3	111.6	D481 L483 L485 T486 N487 A488 L493 L494 T528	D481-R490 IonicContact OD2-CZ 3.78Å; D481-R490 IonicContact OD2-NE 2.83Å; D481-R490 PolarHBondContact OD2-NE 3.45Å; D481-R490 IonicContact OD2-NH2 3.28Å; L483-R490 PolarHBondContact O-NH2 3.01Å; L485-R490 HydrophobicContact CB-CG 4.11Å; L485-R490 PolarHBondContact O-NH1 3.28Å; L485-R490 PolarHBondContact O-NH2 3.15Å; T486-R490 PolarHBondContact O-N 2.79Å; N487-R490 PolarHBondContact OD1-NH1 3.27Å; A488-R490 VanDerWaalsContact C-N 3.33Å; A488-R490 PolarHBondContact O-N 3.37Å; R490-L493 PolarHBondContact O-N 2.99Å; R490-L494 WeakPolarHBondContact O-CB 3.3Å; R490-L494 PolarHBondContact O-N 3.41Å; R490-T528 HydrophobicContact CB-CG2 3.81Å; R490-T528 HydrophobicContact CG-CG2 3.9Å
491	C	73.7	Confident	70.9	Confident	86 Å²	86	57 Å²	57	58%	0.581	33%	0.334	S	S	*	.	H	α-helix	trans	-65.5	-42.5	179.8	-67.2	0	0	0	0	112.9	N487 A488 E489 L494 S495	N487-C491 PolarHBondContact O-N 3.11Å; N487-C491 PolarHBondContact O-SG 3.49Å; N487-C491 VanDerWaalsContact O-SG 3.36Å; A488-C491 PolarHBondContact O-N 3.08Å; E489-C491 PolarHBondContact O-N 2.98Å; C491-L494 PolarHBondContact O-N 2.85Å; C491-S495 WeakPolarHBondContact O-CB 3.42Å; C491-S495 PolarHBondContact O-N 2.95Å
492	H	71.2	Confident	71.8	Confident	123 Å²	123	57.3 Å²	57.3	57%	0.569	34%	0.335	S	S	*	.	H	α-helix	trans	-65.1	-38.1	177.4	-88.1	-89.3	0	0	0	112.6	A488 E489 F496 L553	A488-H492 PolarHBondContact O-CD2 3.11Å; A488-H492 VanDerWaalsContact O-CD2 3.28Å; A488-H492 PolarHBondContact O-N 2.91Å; E489-H492 PolarHBondContact O-N 3.27Å; H492-F496 WeakPolarHBondContact O-CB 3.5Å; H492-F496 PolarHBondContact O-N 2.8Å; H492-L553 HydrophobicContact CB-CD1 4.35Å
493	L	77.2	Confident	72.2	Confident	6 Å²	6	58 Å²	58	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-71.8	-40.4	177.8	-173.2	140.7	0	0	0	111.3	E489 R490 F496 F497 L531 C549 L553	E489-L493 WeakPolarHBondContact O-CB 3.41Å; E489-L493 PolarHBondContact O-N 3.46Å; R490-L493 PolarHBondContact O-N 2.99Å; L493-F496 PolarHBondContact O-N 3.01Å; L493-F497 HydrophobicContact CD2-CD2 3.99Å; L493-F497 HydrophobicContact CD2-CE2 4.29Å; L493-F497 HydrophobicContact CG-CD2 4.03Å; L493-F497 HydrophobicContact CG-CE2 4.2Å; L493-F497 WeakPolarHBondContact O-CD2 3.15Å; L493-F497 PolarHBondContact O-N 3.47Å; L493-L531 HydrophobicContact CD2-CD2 3.36Å; L493-C549 HydrophobicContact CD1-CB 4.25Å; L493-L553 HydrophobicContact CB-CD1 4.22Å
494	L	79.7	Confident	72.5	Confident	37 Å²	37	58.4 Å²	58.4	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-63.5	-45.3	174.8	-168.4	78.1	0	0	0	112.2	R490 C491 F497 N498 F525 K526	R490-L494 WeakPolarHBondContact O-CB 3.3Å; R490-L494 PolarHBondContact O-N 3.41Å; C491-L494 PolarHBondContact O-N 2.85Å; L494-F497 PolarHBondContact O-N 2.97Å; L494-N498 WeakPolarHBondContact O-CB 3.38Å; L494-N498 PolarHBondContact O-N 2.91Å; L494-N498 PolarHBondContact O-ND2 3.01Å; L494-F525 HydrophobicContact CD1-CB 4.06Å; L494-K526 WeakPolarHBondContact CD2-O 3.48Å
495	S	77.3	Confident	73	Confident	57 Å²	57	50.6 Å²	50.6	40%	0.399	28%	0.28	S	S	.	.	H	α-helix	trans	-58.9	-52.2	172.8	162.6	0	0	0	0	110.6	C491 F497 N498 D499	C491-S495 WeakPolarHBondContact O-CB 3.42Å; C491-S495 PolarHBondContact O-N 2.95Å; S495-F497 VanDerWaalsContact C-N 3.34Å; S495-F497 PolarHBondContact O-N 2.82Å; S495-N498 PolarHBondContact O-N 2.83Å; S495-N498 VanDerWaalsContact O-N 3.07Å; S495-D499 WeakPolarHBondContact CB-OD2 3.46Å; S495-D499 VanDerWaalsContact O-CB 3.28Å; S495-D499 WeakPolarHBondContact O-CB 3.28Å; S495-D499 PolarHBondContact O-N 3.09Å; S495-D499 PolarHBondContact OG-OD2 3.37Å
496	F	76.6	Confident	73.4	Confident	14 Å²	14	51.1 Å²	51.1	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-55.7	-45.7	178.5	-179.7	-95.8	0	0	0	112.8	H492 L493 N498 A500 E504 L505 M508 C549 L553	H492-F496 WeakPolarHBondContact O-CB 3.5Å; H492-F496 PolarHBondContact O-N 2.8Å; L493-F496 PolarHBondContact O-N 3.01Å; F496-N498 VanDerWaalsContact C-N 3.31Å; F496-N498 PolarHBondContact O-N 3.48Å; F496-A500 HydrophobicContact CD2-CB 4.06Å; F496-A500 HydrophobicContact CE1-CB 4.31Å; F496-A500 HydrophobicContact CE2-CB 3.8Å; F496-A500 HydrophobicContact CG-CB 4.44Å; F496-A500 HydrophobicContact CZ-CB 3.94Å; F496-A500 WeakPolarHBondContact O-CB 3.4Å; F496-A500 PolarHBondContact O-N 3.15Å; F496-E504 WeakPolarHBondContact CE2-OE2 3.39Å; F496-L505 HydrophobicContact CE1-CD2 4.27Å; F496-M508 HydrophobicContact CE1-CG 4.48Å; F496-M508 HydrophobicContact CE1-SD 3.78Å; F496-M508 HydrophobicContact CZ-SD 4.45Å; F496-C549 WeakPolarHBondContact CD1-SG 3.09Å; F496-L553 HydrophobicContact CB-CD2 4.47Å
497	F	80.5	Confident	73	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.8	-23.1	179.8	-90.6	-85	0	0	0	114.3	L493 L494 S495 M508 I519 R523 F525 L531 L535 C549	L493-F497 HydrophobicContact CD2-CD2 3.99Å; L493-F497 HydrophobicContact CD2-CE2 4.29Å; L493-F497 HydrophobicContact CG-CD2 4.03Å; L493-F497 HydrophobicContact CG-CE2 4.2Å; L493-F497 WeakPolarHBondContact O-CD2 3.15Å; L493-F497 PolarHBondContact O-N 3.47Å; L494-F497 PolarHBondContact O-N 2.97Å; S495-F497 VanDerWaalsContact C-N 3.34Å; S495-F497 PolarHBondContact O-N 2.82Å; F497-M508 HydrophobicContact CE1-CE 4.04Å; F497-M508 HydrophobicContact CZ-CE 4.03Å; F497-M508 HydrophobicContact CZ-SD 4.18Å; F497-I519 HydrophobicContact CD1-CG2 3.89Å; F497-I519 HydrophobicContact CE1-CD1 4.18Å; F497-I519 HydrophobicContact CE1-CG2 4.33Å; F497-R523 PolarHBondContact O-NE 3.35Å; F497-R523 PolarHBondContact O-NH2 3.12Å; F497-F525 HydrophobicContact CB-CD2 4.12Å; F497-F525 HydrophobicContact CB-CE2 4.23Å; F497-L531 HydrophobicContact CB-CD1 3.96Å; F497-L531 HydrophobicContact CB-CD2 3.94Å; F497-L531 HydrophobicContact CD1-CD1 3.79Å; F497-L531 HydrophobicContact CD1-CD2 4.47Å; F497-L531 HydrophobicContact CD2-CD2 3.75Å; F497-L531 HydrophobicContact CE1-CD1 4.44Å; F497-L531 HydrophobicContact CE2-CD2 4.38Å; F497-L531 HydrophobicContact CG-CD1 3.84Å; F497-L531 HydrophobicContact CG-CD2 3.8Å; F497-L531 HydrophobicContact CG-CG 4.49Å; F497-L535 HydrophobicContact CE1-CD1 4.46Å; F497-C549 HydrophobicContact CE2-CB 3.64Å; F497-C549 HydrophobicContact CZ-CB 4.23Å
498	N	82.1	Confident	73	Confident	39 Å²	39	45.3 Å²	45.3	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-86.9	-37.6	173.2	-79.9	-34.7	0	0	0	113.5	L494 S495 F496 R523 P524 F525	L494-N498 WeakPolarHBondContact O-CB 3.38Å; L494-N498 PolarHBondContact O-N 2.91Å; L494-N498 PolarHBondContact O-ND2 3.01Å; S495-N498 PolarHBondContact O-N 2.83Å; S495-N498 VanDerWaalsContact O-N 3.07Å; F496-N498 VanDerWaalsContact C-N 3.31Å; F496-N498 PolarHBondContact O-N 3.48Å; N498-R523 VanDerWaalsContact O-CD 3.29Å; N498-R523 WeakPolarHBondContact O-CD 3.38Å; N498-R523 PolarHBondContact O-NE 3.19Å; N498-R523 VanDerWaalsContact O-NE 3.14Å; N498-R523 PolarHBondContact O-NH1 3.4Å; N498-R523 VanDerWaalsContact O-NH1 3.08Å; N498-P524 WeakPolarHBondContact OD1-CA 3.42Å; N498-F525 PolarHBondContact ND2-O 3.49Å; N498-F525 WeakPolarHBondContact OD1-CD2 3.45Å; N498-F525 PolarHBondContact OD1-N 2.99Å
499	D	77.8	Confident	72.7	Confident	111 Å²	111	46 Å²	46	59%	0.594	25%	0.248	S	C	*	.	H	α-helix	trans	-95.5	-32.2	-167.2	-57.3	-37.3	0	0	0	113.3	S495	S495-D499 WeakPolarHBondContact CB-OD2 3.46Å; S495-D499 VanDerWaalsContact O-CB 3.28Å; S495-D499 WeakPolarHBondContact O-CB 3.28Å; S495-D499 PolarHBondContact O-N 3.09Å; S495-D499 PolarHBondContact OG-OD2 3.37Å
500	A	72.9	Confident	72.7	Confident	2 Å²	2	46.8 Å²	46.8	2%	0.017	27%	0.273	C	S	.	.			trans	-59.6	135.5	-170.8	0	0	0	0	0	113.6	F496 E504 L505 R523	F496-A500 HydrophobicContact CD2-CB 4.06Å; F496-A500 HydrophobicContact CE1-CB 4.31Å; F496-A500 HydrophobicContact CE2-CB 3.8Å; F496-A500 HydrophobicContact CG-CB 4.44Å; F496-A500 HydrophobicContact CZ-CB 3.94Å; F496-A500 WeakPolarHBondContact O-CB 3.4Å; F496-A500 PolarHBondContact O-N 3.15Å; A500-E504 HydrophobicContact CB-CB 3.78Å; A500-L505 HydrophobicContact CB-CD2 4.17Å; A500-L505 HydrophobicContact CB-CG 4.23Å; A500-R523 PolarHBondContact O-NH1 2.89Å; A500-R523 PolarHBondContact O-NH2 3.31Å
501	V	74.6	Confident	72.8	Confident	64 Å²	64	44.6 Å²	44.6	39%	0.388	27%	0.266	S	S	.	.			trans	-69.8	167.8	176.3	-68	0	0	0	0	113	E503 E504 L505	V501-E503 HydrophobicContact CG2-CB 4.29Å; V501-E503 PolarHBondContact O-N 2.79Å; V501-E504 HydrophobicContact CG2-CB 4.08Å; V501-E504 HydrophobicContact CG2-CG 3.91Å; V501-E504 WeakPolarHBondContact O-CB 3.01Å; V501-E504 PolarHBondContact O-N 2.96Å; V501-E504 VanDerWaalsContact O-N 3.11Å; V501-L505 PolarHBondContact O-N 3.45Å; V501-L505 VanDerWaalsContact O-N 3.09Å
502	L	73.2	Confident	72.9	Confident	33 Å²	33	43.2 Å²	43.2	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-42.1	178.6	-178.2	71.1	0	0	0	111.7	T506 R513 A516 Q517 I520	L502-T506 WeakPolarHBondContact O-CG2 3.23Å; L502-T506 PolarHBondContact O-N 3.02Å; L502-T506 VanDerWaalsContact O-N 3.17Å; L502-T506 PolarHBondContact O-OG1 3.28Å; L502-R513 HydrophobicContact CD2-CG 4.44Å; L502-A516 HydrophobicContact CD1-CB 3.76Å; L502-Q517 HydrophobicContact CD1-CB 3.93Å; L502-Q517 HydrophobicContact CD1-CG 4.37Å; L502-I520 HydrophobicContact CB-CD1 3.75Å; L502-I520 HydrophobicContact CD1-CD1 3.82Å; L502-I520 HydrophobicContact CG-CD1 4.41Å
503	E	64.3	Low	73	Confident	83 Å²	83	42.9 Å²	42.9	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-58.1	-52.7	174.9	-68.8	106.4	-137.2	0	0	111.3	V501 L505 T506 L507 S852	V501-E503 HydrophobicContact CG2-CB 4.29Å; V501-E503 PolarHBondContact O-N 2.79Å; E503-L505 VanDerWaalsContact C-N 3.34Å; E503-L505 PolarHBondContact O-N 3.01Å; E503-T506 CarbonylContact O-C 3.59Å; E503-T506 WeakPolarHBondContact O-CA 3.32Å; E503-T506 PolarHBondContact O-N 3.28Å; E503-T506 PolarHBondContact O-OG1 2.87Å; E503-L507 WeakPolarHBondContact O-CG 3.26Å; E503-L507 PolarHBondContact O-N 3.41Å; E503-L507 VanDerWaalsContact O-N 3.11Å; E503-S852 VanDerWaalsContact OE2-CB 3.32Å; E503-S852 WeakPolarHBondContact OE2-CB 3.46Å
504	E	66.4	Low	73.1	Confident	28 Å²	28	51.4 Å²	51.4	13%	0.131	29%	0.288	C	S	.	.	H	α-helix	trans	-52.2	-48.3	178.9	-87.1	-172.9	-107	0	0	112.9	F496 A500 V501 T506 L507 F854	F496-E504 WeakPolarHBondContact CE2-OE2 3.39Å; A500-E504 HydrophobicContact CB-CB 3.78Å; V501-E504 HydrophobicContact CG2-CB 4.08Å; V501-E504 HydrophobicContact CG2-CG 3.91Å; V501-E504 WeakPolarHBondContact O-CB 3.01Å; V501-E504 PolarHBondContact O-N 2.96Å; V501-E504 VanDerWaalsContact O-N 3.11Å; E504-T506 VanDerWaalsContact C-N 3.28Å; E504-T506 PolarHBondContact O-N 3.01Å; E504-L507 WeakPolarHBondContact O-CB 3.16Å; E504-L507 PolarHBondContact O-N 3.45Å; E504-F854 HydrophobicContact CB-CE1 4.41Å; E504-F854 HydrophobicContact CG-CD1 3.87Å; E504-F854 HydrophobicContact CG-CE1 3.12Å; E504-F854 HydrophobicContact CG-CE2 3.99Å; E504-F854 HydrophobicContact CG-CZ 3.16Å
505	L	72	Confident	73.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-35.6	178.3	-68.9	175.3	0	0	0	111.8	F496 A500 V501 E503 L507 M508 C511 A516 I519 I520	F496-L505 HydrophobicContact CE1-CD2 4.27Å; A500-L505 HydrophobicContact CB-CD2 4.17Å; A500-L505 HydrophobicContact CB-CG 4.23Å; V501-L505 PolarHBondContact O-N 3.45Å; V501-L505 VanDerWaalsContact O-N 3.09Å; E503-L505 VanDerWaalsContact C-N 3.34Å; E503-L505 PolarHBondContact O-N 3.01Å; L505-L507 VanDerWaalsContact C-N 3.28Å; L505-L507 PolarHBondContact O-N 3.35Å; L505-M508 HydrophobicContact CD2-CE 3.8Å; L505-M508 WeakPolarHBondContact O-CB 3.42Å; L505-M508 WeakPolarHBondContact O-CG 3.36Å; L505-M508 PolarHBondContact O-N 2.93Å; L505-C511 WeakPolarHBondContact O-CB 3.12Å; L505-C511 PolarHBondContact O-SG 3.13Å; L505-A516 HydrophobicContact CB-CB 3.63Å; L505-A516 HydrophobicContact CD1-CB 4.42Å; L505-A516 WeakPolarHBondContact CD1-O 3.36Å; L505-I519 HydrophobicContact CD1-CB 4.03Å; L505-I519 HydrophobicContact CD1-CG2 3.72Å; L505-I519 HydrophobicContact CD2-CG2 4.11Å; L505-I520 HydrophobicContact CD1-CD1 4.07Å; L505-I520 HydrophobicContact CD1-CG1 3.7Å
506	T	71.8	Confident	73.2	Confident	29 Å²	29	47.6 Å²	47.6	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-76.7	-7.8	174.6	60.2	0	0	0	0	114.9	L502 E503 E504 M508 R513 A516 M836	L502-T506 WeakPolarHBondContact O-CG2 3.23Å; L502-T506 PolarHBondContact O-N 3.02Å; L502-T506 VanDerWaalsContact O-N 3.17Å; L502-T506 PolarHBondContact O-OG1 3.28Å; E503-T506 CarbonylContact O-C 3.59Å; E503-T506 WeakPolarHBondContact O-CA 3.32Å; E503-T506 PolarHBondContact O-N 3.28Å; E503-T506 PolarHBondContact O-OG1 2.87Å; E504-T506 VanDerWaalsContact C-N 3.28Å; E504-T506 PolarHBondContact O-N 3.01Å; T506-M508 VanDerWaalsContact C-N 3.27Å; T506-R513 HydrophobicContact CG2-CB 4.18Å; T506-R513 HydrophobicContact CG2-CG 4.45Å; T506-A516 HydrophobicContact CG2-CB 3.52Å; T506-M836 HydrophobicContact CG2-CE 3.88Å; T506-M836 VanDerWaalsContact OG1-CE 3.28Å; T506-M836 WeakPolarHBondContact OG1-CE 3.38Å
507	L	64.4	Low	73.5	Confident	57 Å²	57	51.7 Å²	51.7	30%	0.298	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-16.3	168.3	-52.1	-175.1	0	0	0	111.9	E503 E504 L505 I831 F854	E503-L507 WeakPolarHBondContact O-CG 3.26Å; E503-L507 PolarHBondContact O-N 3.41Å; E503-L507 VanDerWaalsContact O-N 3.11Å; E504-L507 WeakPolarHBondContact O-CB 3.16Å; E504-L507 PolarHBondContact O-N 3.45Å; L505-L507 VanDerWaalsContact C-N 3.28Å; L505-L507 PolarHBondContact O-N 3.35Å; L507-I831 HydrophobicContact CB-CG2 3.96Å; L507-I831 HydrophobicContact CD1-CG2 3.81Å; L507-I831 HydrophobicContact CD2-CG2 3.84Å; L507-I831 HydrophobicContact CG-CG2 4.06Å; L507-F854 HydrophobicContact CD1-CE1 3.99Å
508	M	69	Low	73.5	Confident	5 Å²	5	53 Å²	53	3%	0.025	29%	0.294	C	S	.	.	S	Bend	trans	-70.1	130.1	177	-57.4	-161.6	-68.2	0	0	111.4	F496 F497 L505 T506 G510 C511 I519 L545 C549 I552	F496-M508 HydrophobicContact CE1-CG 4.48Å; F496-M508 HydrophobicContact CE1-SD 3.78Å; F496-M508 HydrophobicContact CZ-SD 4.45Å; F497-M508 HydrophobicContact CE1-CE 4.04Å; F497-M508 HydrophobicContact CZ-CE 4.03Å; F497-M508 HydrophobicContact CZ-SD 4.18Å; L505-M508 HydrophobicContact CD2-CE 3.8Å; L505-M508 WeakPolarHBondContact O-CB 3.42Å; L505-M508 WeakPolarHBondContact O-CG 3.36Å; L505-M508 PolarHBondContact O-N 2.93Å; T506-M508 VanDerWaalsContact C-N 3.27Å; M508-G510 PolarHBondContact O-N 3.25Å; M508-C511 HydrophobicContact CB-CB 3.8Å; M508-C511 HydrophobicContact CE-CB 4.17Å; M508-C511 WeakPolarHBondContact O-CB 3.14Å; M508-C511 PolarHBondContact O-N 3.48Å; M508-I519 HydrophobicContact CE-CD1 4.2Å; M508-L545 HydrophobicContact CE-CD2 4.44Å; M508-C549 HydrophobicContact SD-CB 4.22Å; M508-I552 HydrophobicContact CB-CD1 4.24Å; M508-I552 HydrophobicContact CG-CD1 3.8Å
509	P	64.5	Low	73.5	Confident	77 Å²	77	51.2 Å²	51.2	50%	0.5	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	132.1	170.7	-27.4	34.9	0	0	0	112.1	C511	P509-C511 PolarHBondContact O-N 3.5Å
510	G	67.5	Low	73.8	Confident	76 Å²	76	48.4 Å²	48.4	78%	0.784	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-14.6	-177.1	0	0	0	0	0	115.6	M508 S512	M508-G510 PolarHBondContact O-N 3.25Å; G510-S512 PolarHBondContact O-N 3.16Å
511	C	72	Confident	74.3	Confident	9 Å²	9	54.7 Å²	54.7	6%	0.061	30%	0.302	C	S	.	.			trans	-84.8	97.2	-180	-164.9	0	0	0	0	111.9	L505 M508 P509 L545	L505-C511 WeakPolarHBondContact O-CB 3.12Å; L505-C511 PolarHBondContact O-SG 3.13Å; M508-C511 HydrophobicContact CB-CB 3.8Å; M508-C511 HydrophobicContact CE-CB 4.17Å; M508-C511 WeakPolarHBondContact O-CB 3.14Å; M508-C511 PolarHBondContact O-N 3.48Å; P509-C511 PolarHBondContact O-N 3.5Å; C511-L545 HydrophobicContact CB-CD2 4.03Å
512	S	75.9	Confident	74.6	Confident	57 Å²	57	53.1 Å²	53.1	40%	0.399	29%	0.291	S	S	.	.			trans	-63.7	161.4	168	74.6	0	0	0	0	112.4	G510 K514 T515 A516	G510-S512 PolarHBondContact O-N 3.16Å; S512-K514 PolarHBondContact O-N 3.29Å; S512-K514 PolarHBondContact OG-N 3.43Å; S512-T515 WeakPolarHBondContact CA-OG1 3.27Å; S512-T515 PolarHBondContact N-OG1 3.35Å; S512-T515 PolarHBondContact O-N 2.72Å; S512-T515 VanDerWaalsContact O-N 3.13Å; S512-T515 PolarHBondContact O-OG1 2.96Å; S512-T515 PolarHBondContact OG-N 2.94Å; S512-T515 PolarHBondContact OG-OG1 3.36Å; S512-A516 WeakPolarHBondContact O-CB 3.42Å; S512-A516 PolarHBondContact O-N 2.86Å
513	R	73.5	Confident	75.1	Confident	116 Å²	116	54.6 Å²	54.6	44%	0.438	29%	0.294	S	S	.	.	H	α-helix	trans	-56.9	-35.5	172.5	-165.5	173.5	-176.1	166.2	3.3	112.7	L502 T506 Q517 S838	L502-R513 HydrophobicContact CD2-CG 4.44Å; T506-R513 HydrophobicContact CG2-CB 4.18Å; T506-R513 HydrophobicContact CG2-CG 4.45Å; R513-Q517 VanDerWaalsContact O-CB 3.29Å; R513-Q517 WeakPolarHBondContact O-CB 3.37Å; R513-Q517 PolarHBondContact O-N 3.25Å; R513-S838 PolarHBondContact NH1-OG 3.3Å
514	K	78.3	Confident	75.8	Confident	186 Å²	186	55.5 Å²	55.5	81%	0.809	31%	0.307	S	S	*	.	H	α-helix	trans	-66.6	-42.1	176	-67	-172.9	177.8	-176	0	112.4	S512 A518	S512-K514 PolarHBondContact O-N 3.29Å; S512-K514 PolarHBondContact OG-N 3.43Å; K514-A518 WeakPolarHBondContact O-CB 3.44Å; K514-A518 PolarHBondContact O-N 2.95Å
515	T	80.9	Confident	76.6	Confident	14 Å²	14	54.3 Å²	54.3	9%	0.086	30%	0.301	C	S	.	.	H	α-helix	trans	-72.9	-36.9	176.8	47.4	0	0	0	0	112.1	S512 Q517 A518 I519 H540 L541	S512-T515 WeakPolarHBondContact CA-OG1 3.27Å; S512-T515 PolarHBondContact N-OG1 3.35Å; S512-T515 PolarHBondContact O-N 2.72Å; S512-T515 VanDerWaalsContact O-N 3.13Å; S512-T515 PolarHBondContact O-OG1 2.96Å; S512-T515 PolarHBondContact OG-N 2.94Å; S512-T515 PolarHBondContact OG-OG1 3.36Å; T515-Q517 VanDerWaalsContact C-N 3.33Å; T515-Q517 PolarHBondContact O-N 3.26Å; T515-A518 PolarHBondContact O-N 2.7Å; T515-I519 VanDerWaalsContact O-CG1 3.27Å; T515-I519 WeakPolarHBondContact O-CG1 3.15Å; T515-I519 PolarHBondContact O-N 3.47Å; T515-H540 VanDerWaalsContact CG2-O 3.3Å; T515-H540 WeakPolarHBondContact CG2-O 3.43Å; T515-L541 HydrophobicContact CG2-CD1 3.9Å; T515-L541 HydrophobicContact CG2-CG 4.05Å
516	A	79.6	Confident	76.9	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-42.6	172.3	0	0	0	0	0	111.8	L502 L505 T506 S512 I519 I520	L502-A516 HydrophobicContact CD1-CB 3.76Å; L505-A516 HydrophobicContact CB-CB 3.63Å; L505-A516 HydrophobicContact CD1-CB 4.42Å; L505-A516 WeakPolarHBondContact CD1-O 3.36Å; T506-A516 HydrophobicContact CG2-CB 3.52Å; S512-A516 WeakPolarHBondContact O-CB 3.42Å; S512-A516 PolarHBondContact O-N 2.86Å; A516-I519 PolarHBondContact O-N 3.34Å; A516-I520 WeakPolarHBondContact O-CG1 3.33Å; A516-I520 PolarHBondContact O-N 2.86Å
517	Q	81.9	Confident	77.3	Confident	99 Å²	99	63.9 Å²	63.9	46%	0.463	34%	0.344	S	S	.	.	H	α-helix	trans	-72.4	-32.3	178	-155.8	156.3	4.5	0	0	112	L502 R513 T515 I520 N521	L502-Q517 HydrophobicContact CD1-CB 3.93Å; L502-Q517 HydrophobicContact CD1-CG 4.37Å; R513-Q517 VanDerWaalsContact O-CB 3.29Å; R513-Q517 WeakPolarHBondContact O-CB 3.37Å; R513-Q517 PolarHBondContact O-N 3.25Å; T515-Q517 VanDerWaalsContact C-N 3.33Å; T515-Q517 PolarHBondContact O-N 3.26Å; Q517-I520 PolarHBondContact O-N 3.17Å; Q517-N521 PolarHBondContact O-N 3.25Å; Q517-N521 PolarHBondContact O-OD1 3.29Å
518	A	81.3	Confident	77.7	Confident	29 Å²	29	61.9 Å²	61.9	24%	0.24	33%	0.334	C	S	.	.	H	α-helix	trans	-64.6	-41.8	168.3	0	0	0	0	0	112.5	K514 T515 I520 N521 M522 L541	K514-A518 WeakPolarHBondContact O-CB 3.44Å; K514-A518 PolarHBondContact O-N 2.95Å; T515-A518 PolarHBondContact O-N 2.7Å; A518-I520 VanDerWaalsContact C-N 3.34Å; A518-I520 PolarHBondContact O-N 3.05Å; A518-N521 PolarHBondContact O-N 3.21Å; A518-M522 WeakPolarHBondContact O-CG 3.38Å; A518-M522 PolarHBondContact O-N 3.21Å; A518-L541 HydrophobicContact CB-CD1 4.23Å
519	I	81.8	Confident	78	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.1	-45.4	174.4	-69.9	160.5	0	0	0	110.6	F497 L505 M508 T515 A516 N521 M522 F525 L535 L541 L545	F497-I519 HydrophobicContact CD1-CG2 3.89Å; F497-I519 HydrophobicContact CE1-CD1 4.18Å; F497-I519 HydrophobicContact CE1-CG2 4.33Å; L505-I519 HydrophobicContact CD1-CB 4.03Å; L505-I519 HydrophobicContact CD1-CG2 3.72Å; L505-I519 HydrophobicContact CD2-CG2 4.11Å; M508-I519 HydrophobicContact CE-CD1 4.2Å; T515-I519 VanDerWaalsContact O-CG1 3.27Å; T515-I519 WeakPolarHBondContact O-CG1 3.15Å; T515-I519 PolarHBondContact O-N 3.47Å; A516-I519 PolarHBondContact O-N 3.34Å; I519-N521 VanDerWaalsContact C-N 3.33Å; I519-N521 PolarHBondContact O-N 2.86Å; I519-M522 HydrophobicContact CG1-CE 4.47Å; I519-M522 PolarHBondContact O-N 3.34Å; I519-F525 HydrophobicContact CG2-CE2 4.16Å; I519-F525 HydrophobicContact CG2-CZ 4.2Å; I519-L535 HydrophobicContact CG1-CD2 4.17Å; I519-L541 HydrophobicContact CD1-CD2 4.24Å; I519-L541 HydrophobicContact CG1-CD2 3.69Å; I519-L545 HydrophobicContact CD1-CD1 4.42Å
520	I	83.5	Confident	78.8	Confident	53 Å²	53	63 Å²	63	27%	0.272	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-42.7	176.6	-72.4	168.6	0	0	0	111.4	L502 L505 A516 Q517 A518 M522 R523	L502-I520 HydrophobicContact CB-CD1 3.75Å; L502-I520 HydrophobicContact CD1-CD1 3.82Å; L502-I520 HydrophobicContact CG-CD1 4.41Å; L505-I520 HydrophobicContact CD1-CD1 4.07Å; L505-I520 HydrophobicContact CD1-CG1 3.7Å; A516-I520 WeakPolarHBondContact O-CG1 3.33Å; A516-I520 PolarHBondContact O-N 2.86Å; Q517-I520 PolarHBondContact O-N 3.17Å; A518-I520 VanDerWaalsContact C-N 3.34Å; A518-I520 PolarHBondContact O-N 3.05Å; I520-M522 PolarHBondContact O-N 3.02Å; I520-R523 WeakPolarHBondContact O-CB 3.11Å; I520-R523 PolarHBondContact O-N 2.74Å
521	N	84.2	Confident	79.4	Confident	134 Å²	134	59.4 Å²	59.4	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-68.5	-13.5	179.1	-67.6	-2.3	0	0	0	114.1	Q517 A518 I519	Q517-N521 PolarHBondContact O-N 3.25Å; Q517-N521 PolarHBondContact O-OD1 3.29Å; A518-N521 PolarHBondContact O-N 3.21Å; I519-N521 VanDerWaalsContact C-N 3.33Å; I519-N521 PolarHBondContact O-N 2.86Å
522	M	80.5	Confident	79.7	Confident	31 Å²	31	61.2 Å²	61.2	15%	0.153	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	1.6	176.7	-69.5	-175.3	-58.3	0	0	113.5	A518 I519 I520 F525 Q534 L535 V538 L541	A518-M522 WeakPolarHBondContact O-CG 3.38Å; A518-M522 PolarHBondContact O-N 3.21Å; I519-M522 HydrophobicContact CG1-CE 4.47Å; I519-M522 PolarHBondContact O-N 3.34Å; I520-M522 PolarHBondContact O-N 3.02Å; M522-F525 HydrophobicContact CB-CE1 3.67Å; M522-F525 HydrophobicContact CB-CZ 3.77Å; M522-Q534 HydrophobicContact SD-CB 4.06Å; M522-L535 HydrophobicContact CE-CD2 4.5Å; M522-V538 HydrophobicContact CE-CG2 4.48Å; M522-V538 HydrophobicContact SD-CG2 3.72Å; M522-L541 HydrophobicContact CE-CD2 3.86Å
523	R	83.2	Confident	79.7	Confident	64 Å²	64	62.2 Å²	62.2	24%	0.242	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-75.8	151.9	178.3	-70.2	174.9	174.7	177.7	-2.5	112.5	F497 N498 A500 I520 F525	F497-R523 PolarHBondContact O-NE 3.35Å; F497-R523 PolarHBondContact O-NH2 3.12Å; N498-R523 VanDerWaalsContact O-CD 3.29Å; N498-R523 WeakPolarHBondContact O-CD 3.38Å; N498-R523 PolarHBondContact O-NE 3.19Å; N498-R523 VanDerWaalsContact O-NE 3.14Å; N498-R523 PolarHBondContact O-NH1 3.4Å; N498-R523 VanDerWaalsContact O-NH1 3.08Å; A500-R523 PolarHBondContact O-NH1 2.89Å; A500-R523 PolarHBondContact O-NH2 3.31Å; I520-R523 WeakPolarHBondContact O-CB 3.11Å; I520-R523 PolarHBondContact O-N 2.74Å; R523-F525 HydrophobicContact CG-CD2 4.29Å; R523-F525 HydrophobicContact CG-CE2 3.84Å
524	P	80.2	Confident	79.9	Confident	101 Å²	101	59.6 Å²	59.6	66%	0.656	31%	0.306	S	S	*	.	P	Polyproline II helix	cis	-88.7	138.9	-2.8	33.7	-32.9	0	0	0	112.8	N498	N498-P524 WeakPolarHBondContact OD1-CA 3.42Å
525	F	82.2	Confident	79.7	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-78.3	130.3	169.4	-49.7	-75.6	0	0	0	109.7	L494 F497 N498 I519 M522 R523 L531 Q534	L494-F525 HydrophobicContact CD1-CB 4.06Å; F497-F525 HydrophobicContact CB-CD2 4.12Å; F497-F525 HydrophobicContact CB-CE2 4.23Å; N498-F525 PolarHBondContact ND2-O 3.49Å; N498-F525 WeakPolarHBondContact OD1-CD2 3.45Å; N498-F525 PolarHBondContact OD1-N 2.99Å; I519-F525 HydrophobicContact CG2-CE2 4.16Å; I519-F525 HydrophobicContact CG2-CZ 4.2Å; M522-F525 HydrophobicContact CB-CE1 3.67Å; M522-F525 HydrophobicContact CB-CZ 3.77Å; R523-F525 HydrophobicContact CG-CD2 4.29Å; R523-F525 HydrophobicContact CG-CE2 3.84Å; F525-L531 HydrophobicContact CB-CB 4.1Å; F525-L531 HydrophobicContact CB-CD1 4.46Å; F525-L531 HydrophobicContact CD1-CB 4.19Å; F525-L531 HydrophobicContact CD1-CD1 3.72Å; F525-L531 HydrophobicContact CD2-CD1 3.71Å; F525-L531 HydrophobicContact CE1-CD1 3.77Å; F525-L531 HydrophobicContact CE2-CD1 3.77Å; F525-L531 HydrophobicContact CG-CB 4.15Å; F525-L531 HydrophobicContact CG-CD1 3.68Å; F525-L531 HydrophobicContact CG-CG 4.49Å; F525-L531 HydrophobicContact CZ-CD1 3.79Å; F525-Q534 HydrophobicContact CE1-CB 4.19Å
526	K	77.8	Confident	79.3	Confident	162 Å²	162	54.1 Å²	54.1	70%	0.704	29%	0.292	S	S	*	.			trans	-82.8	-52.4	-175.3	-63.2	172.3	-176.7	171.7	0	112.9	L494 D530	L494-K526 WeakPolarHBondContact CD2-O 3.48Å; K526-D530 HydrophobicContact CB-CB 4.46Å; K526-D530 WeakPolarHBondContact CB-OD2 3.4Å; K526-D530 PolarHBondContact N-OD2 2.85Å
527	N	80.5	Confident	78.9	Confident	69 Å²	69	57.2 Å²	57.2	37%	0.369	32%	0.323	S	S	.	.	S	Bend	trans	-131.2	167.2	-175.2	-63.1	4.2	0	0	0	109.5	K529 D530 L531	N527-K529 VanDerWaalsContact C-N 3.29Å; N527-K529 PolarHBondContact O-N 3.23Å; N527-D530 WeakPolarHBondContact O-CB 3.29Å; N527-D530 PolarHBondContact O-N 3.3Å; N527-D530 VanDerWaalsContact O-N 3.09Å; N527-L531 PolarHBondContact O-N 2.89Å; N527-L531 VanDerWaalsContact O-N 3.09Å
528	T	73	Confident	78.4	Confident	15 Å²	15	54.9 Å²	54.9	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-58.3	-38.7	173.3	34.9	0	0	0	0	112.8	D481 R490 D530 L531 V532	D481-T528 WeakPolarHBondContact OD2-CB 3.48Å; D481-T528 PolarHBondContact OD2-OG1 3.08Å; R490-T528 HydrophobicContact CB-CG2 3.81Å; R490-T528 HydrophobicContact CG-CG2 3.9Å; T528-D530 VanDerWaalsContact C-N 3.35Å; T528-D530 PolarHBondContact O-N 3.32Å; T528-L531 PolarHBondContact O-N 2.88Å; T528-V532 VanDerWaalsContact O-CG2 3.29Å; T528-V532 WeakPolarHBondContact O-CG2 3.35Å; T528-V532 PolarHBondContact O-N 3.48Å
529	K	75.1	Confident	77.5	Confident	64 Å²	64	65 Å²	65	28%	0.278	35%	0.348	S	S	.	.	H	α-helix	trans	-59.1	-40.7	171.8	-64.3	-158	172.7	-166.2	0	114.4	E479 D480 D481 N527 V532 S533	E479-K529 WeakPolarHBondContact O-CE 3.44Å; E479-K529 WeakPolarHBondContact OE2-CD 3.3Å; E479-K529 WeakPolarHBondContact OE2-CE 3.23Å; E479-K529 IonicContact OE2-NZ 3.55Å; E479-K529 PolarHBondContact OE2-NZ 3.01Å; D480-K529 WeakPolarHBondContact O-CE 3.32Å; D480-K529 PolarHBondContact O-NZ 3.35Å; D481-K529 VanDerWaalsContact OD1-CE 3.22Å; D481-K529 WeakPolarHBondContact OD1-CE 3.48Å; D481-K529 WeakPolarHBondContact OD1-CG 3.36Å; N527-K529 VanDerWaalsContact C-N 3.29Å; N527-K529 PolarHBondContact O-N 3.23Å; K529-V532 PolarHBondContact O-N 2.93Å; K529-S533 WeakPolarHBondContact O-CB 2.96Å; K529-S533 PolarHBondContact O-N 3.47Å
530	D	81.3	Confident	76.6	Confident	40 Å²	40	72.4 Å²	72.4	21%	0.214	38%	0.382	C	S	.	.	H	α-helix	trans	-66.2	-45.3	-179.9	-179	26.9	0	0	0	110.2	K526 N527 T528 S533 Q534	K526-D530 HydrophobicContact CB-CB 4.46Å; K526-D530 WeakPolarHBondContact CB-OD2 3.4Å; K526-D530 PolarHBondContact N-OD2 2.85Å; N527-D530 WeakPolarHBondContact O-CB 3.29Å; N527-D530 PolarHBondContact O-N 3.3Å; N527-D530 VanDerWaalsContact O-N 3.09Å; T528-D530 VanDerWaalsContact C-N 3.35Å; T528-D530 PolarHBondContact O-N 3.32Å; D530-S533 PolarHBondContact O-N 2.87Å; D530-Q534 WeakPolarHBondContact O-CB 3.39Å; D530-Q534 WeakPolarHBondContact O-CG 3.43Å; D530-Q534 PolarHBondContact O-N 3.35Å; D530-Q534 PolarHBondContact OD1-NE2 3.23Å
531	L	80	Confident	75.9	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-57.7	-50.4	171.3	177.8	64.3	0	0	0	112	L493 F497 F525 N527 T528 S533 Q534 L535	L493-L531 HydrophobicContact CD2-CD2 3.36Å; F497-L531 HydrophobicContact CB-CD1 3.96Å; F497-L531 HydrophobicContact CB-CD2 3.94Å; F497-L531 HydrophobicContact CD1-CD1 3.79Å; F497-L531 HydrophobicContact CD1-CD2 4.47Å; F497-L531 HydrophobicContact CD2-CD2 3.75Å; F497-L531 HydrophobicContact CE1-CD1 4.44Å; F497-L531 HydrophobicContact CE2-CD2 4.38Å; F497-L531 HydrophobicContact CG-CD1 3.84Å; F497-L531 HydrophobicContact CG-CD2 3.8Å; F497-L531 HydrophobicContact CG-CG 4.49Å; F525-L531 HydrophobicContact CB-CB 4.1Å; F525-L531 HydrophobicContact CB-CD1 4.46Å; F525-L531 HydrophobicContact CD1-CB 4.19Å; F525-L531 HydrophobicContact CD1-CD1 3.72Å; F525-L531 HydrophobicContact CD2-CD1 3.71Å; F525-L531 HydrophobicContact CE1-CD1 3.77Å; F525-L531 HydrophobicContact CE2-CD1 3.77Å; F525-L531 HydrophobicContact CG-CB 4.15Å; F525-L531 HydrophobicContact CG-CD1 3.68Å; F525-L531 HydrophobicContact CG-CG 4.49Å; F525-L531 HydrophobicContact CZ-CD1 3.79Å; N527-L531 PolarHBondContact O-N 2.89Å; N527-L531 VanDerWaalsContact O-N 3.09Å; T528-L531 PolarHBondContact O-N 2.88Å; L531-S533 PolarHBondContact O-N 3.42Å; L531-Q534 PolarHBondContact O-N 3.24Å; L531-L535 HydrophobicContact CD1-CD1 3.76Å; L531-L535 HydrophobicContact CD1-CD2 4.5Å; L531-L535 HydrophobicContact CD1-CG 3.92Å; L531-L535 HydrophobicContact CG-CD1 3.83Å; L531-L535 HydrophobicContact CG-CG 4.35Å; L531-L535 VanDerWaalsContact O-CB 3.26Å; L531-L535 WeakPolarHBondContact O-CB 3.45Å; L531-L535 WeakPolarHBondContact O-CG 3.4Å; L531-L535 PolarHBondContact O-N 3.18Å
532	V	78.2	Confident	74.9	Confident	46 Å²	46	67.2 Å²	67.2	28%	0.279	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-40.5	179.8	172.2	0	0	0	0	111.7	L483 T528 K529 S536	L483-V532 HydrophobicContact CD1-CG2 3.7Å; T528-V532 VanDerWaalsContact O-CG2 3.29Å; T528-V532 WeakPolarHBondContact O-CG2 3.35Å; T528-V532 PolarHBondContact O-N 3.48Å; K529-V532 PolarHBondContact O-N 2.93Å; V532-S536 VanDerWaalsContact O-CB 3.32Å; V532-S536 WeakPolarHBondContact O-CB 3.19Å; V532-S536 PolarHBondContact O-N 2.83Å; V532-S536 PolarHBondContact O-OG 3.33Å
533	S	76.8	Confident	74	Confident	78 Å²	78	68.8 Å²	68.8	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-45.6	178.7	-173.6	0	0	0	0	111.8	K529 D530 L531 S536 G537	K529-S533 WeakPolarHBondContact O-CB 2.96Å; K529-S533 PolarHBondContact O-N 3.47Å; D530-S533 PolarHBondContact O-N 2.87Å; L531-S533 PolarHBondContact O-N 3.42Å; S533-S536 PolarHBondContact O-N 3.38Å; S533-S536 PolarHBondContact O-OG 2.95Å; S533-G537 PolarHBondContact O-N 3.2Å
534	Q	77.7	Confident	73.3	Confident	61 Å²	61	70 Å²	70	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-70.3	-39.2	177.3	-68.1	-166.3	60.1	0	0	112.4	M522 F525 D530 L531 S536 G537	M522-Q534 HydrophobicContact SD-CB 4.06Å; F525-Q534 HydrophobicContact CE1-CB 4.19Å; D530-Q534 WeakPolarHBondContact O-CB 3.39Å; D530-Q534 WeakPolarHBondContact O-CG 3.43Å; D530-Q534 PolarHBondContact O-N 3.35Å; D530-Q534 PolarHBondContact OD1-NE2 3.23Å; L531-Q534 PolarHBondContact O-N 3.24Å; Q534-S536 VanDerWaalsContact C-N 3.33Å; Q534-S536 PolarHBondContact O-N 2.9Å; Q534-G537 PolarHBondContact O-N 3.09Å
535	L	74.9	Confident	72.8	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-37.4	174	-72.9	176.6	0	0	0	112.6	F497 I519 M522 L531 L541 L545	F497-L535 HydrophobicContact CE1-CD1 4.46Å; I519-L535 HydrophobicContact CG1-CD2 4.17Å; M522-L535 HydrophobicContact CE-CD2 4.5Å; L531-L535 HydrophobicContact CD1-CD1 3.76Å; L531-L535 HydrophobicContact CD1-CD2 4.5Å; L531-L535 HydrophobicContact CD1-CG 3.92Å; L531-L535 HydrophobicContact CG-CD1 3.83Å; L531-L535 HydrophobicContact CG-CG 4.35Å; L531-L535 VanDerWaalsContact O-CB 3.26Å; L531-L535 WeakPolarHBondContact O-CB 3.45Å; L531-L535 WeakPolarHBondContact O-CG 3.4Å; L531-L535 PolarHBondContact O-N 3.18Å; L535-L541 HydrophobicContact CD2-CD2 3.49Å; L535-L541 VanDerWaalsContact CD2-CD2 3.49Å; L535-L545 HydrophobicContact CD2-CD1 4.45Å
536	S	72.6	Confident	72.4	Confident	83 Å²	83	68.2 Å²	68.2	58%	0.58	37%	0.365	S	S	*	.	H	α-helix	trans	-83.5	-24	179.1	56.2	0	0	0	0	114	V532 S533 Q534 V538	V532-S536 VanDerWaalsContact O-CB 3.32Å; V532-S536 WeakPolarHBondContact O-CB 3.19Å; V532-S536 PolarHBondContact O-N 2.83Å; V532-S536 PolarHBondContact O-OG 3.33Å; S533-S536 PolarHBondContact O-N 3.38Å; S533-S536 PolarHBondContact O-OG 2.95Å; Q534-S536 VanDerWaalsContact C-N 3.33Å; Q534-S536 PolarHBondContact O-N 2.9Å; S536-V538 VanDerWaalsContact C-N 3.32Å; S536-V538 PolarHBondContact O-N 3.49Å
537	G	70	Confident	72	Confident	64 Å²	64	65.9 Å²	65.9	66%	0.66	36%	0.357	S	S	*	.	H	α-helix	trans	-69.5	-24.4	176.3	0	0	0	0	0	114.4	S533 Q534	S533-G537 PolarHBondContact O-N 3.2Å; Q534-G537 PolarHBondContact O-N 3.09Å
538	V	71.9	Confident	71.3	Confident	51 Å²	51	64 Å²	64	31%	0.309	35%	0.349	S	S	.	.	S	Bend	trans	-94	115	-178.5	-176.8	0	0	0	0	111.2	M522 S536 H540 L541	M522-V538 HydrophobicContact CE-CG2 4.48Å; M522-V538 HydrophobicContact SD-CG2 3.72Å; S536-V538 VanDerWaalsContact C-N 3.32Å; S536-V538 PolarHBondContact O-N 3.49Å; V538-H540 PolarHBondContact O-N 2.7Å; V538-L541 HydrophobicContact CB-CD1 4.01Å; V538-L541 HydrophobicContact CG1-CD1 3.63Å; V538-L541 PolarHBondContact O-N 2.92Å
539	R	62	Low	71.3	Confident	241 Å²	241	63.3 Å²	63.3	91%	0.909	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-4	-179.1	-76	-174	172.3	-174.7	-1.7	117.8
540	H	63.9	Low	71.1	Confident	155 Å²	155	64 Å²	64	72%	0.718	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	3.7	-173.2	-53.8	-38.5	0	0	0	113.4	T515 V538	T515-H540 VanDerWaalsContact CG2-O 3.3Å; T515-H540 WeakPolarHBondContact CG2-O 3.43Å; V538-H540 PolarHBondContact O-N 2.7Å
541	L	67.9	Low	70.4	Confident	22 Å²	22	65.6 Å²	65.6	12%	0.115	36%	0.356	C	S	.	.			trans	-110.5	149.6	171.4	-77.8	76.8	0	0	0	108.8	T515 A518 I519 M522 L535 V538 L545	T515-L541 HydrophobicContact CG2-CD1 3.9Å; T515-L541 HydrophobicContact CG2-CG 4.05Å; A518-L541 HydrophobicContact CB-CD1 4.23Å; I519-L541 HydrophobicContact CD1-CD2 4.24Å; I519-L541 HydrophobicContact CG1-CD2 3.69Å; M522-L541 HydrophobicContact CE-CD2 3.86Å; L535-L541 HydrophobicContact CD2-CD2 3.49Å; L535-L541 VanDerWaalsContact CD2-CD2 3.49Å; V538-L541 HydrophobicContact CB-CD1 4.01Å; V538-L541 HydrophobicContact CG1-CD1 3.63Å; V538-L541 PolarHBondContact O-N 2.92Å; L541-L545 HydrophobicContact CB-CD1 4.15Å; L541-L545 HydrophobicContact CD2-CD1 4.2Å; L541-L545 HydrophobicContact CG-CD1 4.19Å
542	S	63.5	Low	69.7	Low	57 Å²	57	67.3 Å²	67.3	40%	0.399	37%	0.365	S	S	.	.			trans	-108.9	144.6	176.2	53.9	0	0	0	0	110.5	N544 L545	S542-N544 PolarHBondContact O-N 2.86Å; S542-L545 WeakPolarHBondContact O-CB 3.43Å; S542-L545 WeakPolarHBondContact O-CG 3.45Å; S542-L545 PolarHBondContact O-N 3.33Å
543	S	62.1	Low	69.3	Low	64 Å²	64	66.7 Å²	66.7	45%	0.448	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-39.8	171	43.1	0	0	0	0	111.6	L545 Y546	S543-L545 PolarHBondContact O-N 3.26Å; S543-Y546 WeakPolarHBondContact O-CD1 3.33Å; S543-Y546 WeakPolarHBondContact O-CE1 3.46Å; S543-Y546 PolarHBondContact O-N 3.26Å; S543-Y546 VanDerWaalsContact O-N 3.07Å
544	N	66.9	Low	68.8	Low	90 Å²	90	68.8 Å²	68.8	48%	0.481	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-11.5	179.9	-52.9	39.9	0	0	0	115	S542 Y546 E547 C548	S542-N544 PolarHBondContact O-N 2.86Å; N544-Y546 VanDerWaalsContact C-N 3.3Å; N544-Y546 PolarHBondContact O-N 3.33Å; N544-E547 PolarHBondContact O-N 3.27Å; N544-C548 PolarHBondContact O-N 2.96Å; N544-C548 PolarHBondContact O-SG 3.42Å
545	L	71.6	Confident	68	Low	3 Å²	3	67 Å²	67	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-32.1	171.1	-69.8	170.3	0	0	0	113.2	M508 C511 I519 L535 L541 S542 S543 E547 C549	M508-L545 HydrophobicContact CE-CD2 4.44Å; C511-L545 HydrophobicContact CB-CD2 4.03Å; I519-L545 HydrophobicContact CD1-CD1 4.42Å; L535-L545 HydrophobicContact CD2-CD1 4.45Å; L541-L545 HydrophobicContact CB-CD1 4.15Å; L541-L545 HydrophobicContact CD2-CD1 4.2Å; L541-L545 HydrophobicContact CG-CD1 4.19Å; S542-L545 WeakPolarHBondContact O-CB 3.43Å; S542-L545 WeakPolarHBondContact O-CG 3.45Å; S542-L545 PolarHBondContact O-N 3.33Å; S543-L545 PolarHBondContact O-N 3.26Å; L545-E547 VanDerWaalsContact C-N 3.31Å; L545-E547 PolarHBondContact O-N 3.1Å; L545-C549 WeakPolarHBondContact O-CB 3.46Å; L545-C549 PolarHBondContact O-N 2.94Å
546	Y	72.3	Confident	67.5	Low	62 Å²	62	72.7 Å²	72.7	24%	0.243	38%	0.376	C	S	.	.	H	α-helix	trans	-67.5	-34.5	174.4	73.3	-108.5	0	0	0	111.5	L483 S543 N544 C549 K550	L483-Y546 HydrophobicContact CD2-CD1 4.21Å; L483-Y546 HydrophobicContact CD2-CD2 4.29Å; L483-Y546 HydrophobicContact CD2-CE1 3.66Å; L483-Y546 HydrophobicContact CD2-CE2 3.77Å; L483-Y546 VanDerWaalsContact CD2-CZ 3.44Å; S543-Y546 WeakPolarHBondContact O-CD1 3.33Å; S543-Y546 WeakPolarHBondContact O-CE1 3.46Å; S543-Y546 PolarHBondContact O-N 3.26Å; S543-Y546 VanDerWaalsContact O-N 3.07Å; N544-Y546 VanDerWaalsContact C-N 3.3Å; N544-Y546 PolarHBondContact O-N 3.33Å; Y546-C549 WeakPolarHBondContact O-CB 3.2Å; Y546-C549 PolarHBondContact O-N 2.92Å; Y546-K550 PolarHBondContact O-N 3.16Å
547	E	69.8	Low	67.1	Low	114 Å²	114	71.1 Å²	71.1	53%	0.533	37%	0.365	S	S	.	.	H	α-helix	trans	-74	-38.5	-179.4	-163.7	164.3	-141.7	0	0	110.6	N544 L545 C549 K550 D551	N544-E547 PolarHBondContact O-N 3.27Å; L545-E547 VanDerWaalsContact C-N 3.31Å; L545-E547 PolarHBondContact O-N 3.1Å; E547-C549 VanDerWaalsContact C-N 3.26Å; E547-C549 PolarHBondContact O-N 2.84Å; E547-K550 PolarHBondContact O-N 2.93Å; E547-D551 PolarHBondContact O-N 3.33Å; E547-D551 VanDerWaalsContact O-N 3.08Å
548	C	66.6	Low	66.9	Low	30 Å²	30	69 Å²	69	20%	0.203	34%	0.339	C	S	.	.	H	α-helix	trans	-61.7	-32.6	168.3	-63.8	0	0	0	0	112.8	N544 I552	N544-C548 PolarHBondContact O-N 2.96Å; N544-C548 PolarHBondContact O-SG 3.42Å; C548-I552 PolarHBondContact O-N 3.28Å
549	C	71.8	Confident	66.4	Low	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-71.4	-41.5	173.2	-178.7	0	0	0	0	111.9	L493 F496 F497 M508 L545 Y546 E547 D551 I552 L553	L493-C549 HydrophobicContact CD1-CB 4.25Å; F496-C549 WeakPolarHBondContact CD1-SG 3.09Å; F497-C549 HydrophobicContact CE2-CB 3.64Å; F497-C549 HydrophobicContact CZ-CB 4.23Å; M508-C549 HydrophobicContact SD-CB 4.22Å; L545-C549 WeakPolarHBondContact O-CB 3.46Å; L545-C549 PolarHBondContact O-N 2.94Å; Y546-C549 WeakPolarHBondContact O-CB 3.2Å; Y546-C549 PolarHBondContact O-N 2.92Å; E547-C549 VanDerWaalsContact C-N 3.26Å; E547-C549 PolarHBondContact O-N 2.84Å; C549-D551 VanDerWaalsContact C-N 3.31Å; C549-D551 PolarHBondContact O-N 3.33Å; C549-I552 PolarHBondContact O-N 3.11Å; C549-L553 WeakPolarHBondContact O-CG 2.98Å; C549-L553 PolarHBondContact O-N 3.4Å
550	K	71.3	Confident	66.5	Low	77 Å²	77	59.7 Å²	59.7	34%	0.335	31%	0.306	S	S	.	.	H	α-helix	trans	-57	-44.3	174.5	-175.5	164.4	175.1	146.6	0	111.5	L485 E489 Y546 E547 I552 L553 E554	L485-K550 HydrophobicContact CD2-CD 4.05Å; E489-K550 WeakPolarHBondContact OE1-CE 3.48Å; E489-K550 IonicContact OE1-NZ 2.68Å; E489-K550 PolarHBondContact OE1-NZ 2.89Å; Y546-K550 PolarHBondContact O-N 3.16Å; E547-K550 PolarHBondContact O-N 2.93Å; K550-I552 VanDerWaalsContact C-N 3.32Å; K550-I552 PolarHBondContact O-N 3.24Å; K550-L553 PolarHBondContact O-N 3.43Å; K550-E554 PolarHBondContact O-N 3.49Å
551	D	66.3	Low	66.8	Low	74 Å²	74	60.8 Å²	60.8	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-53.8	-46.4	172.6	-127.1	49.5	0	0	0	111.4	E547 C549 V555 R827	E547-D551 PolarHBondContact O-N 3.33Å; E547-D551 VanDerWaalsContact O-N 3.08Å; C549-D551 VanDerWaalsContact C-N 3.31Å; C549-D551 PolarHBondContact O-N 3.33Å; D551-V555 VanDerWaalsContact O-CB 3.23Å; D551-V555 WeakPolarHBondContact O-CB 3.26Å; D551-V555 WeakPolarHBondContact O-CG2 3.49Å; D551-V555 PolarHBondContact O-N 2.9Å; D551-V555 VanDerWaalsContact O-N 3.07Å; D551-R827 IonicContact OD2-CZ 3.06Å; D551-R827 IonicContact OD2-NH1 3.71Å; D551-R827 PolarHBondContact OD2-NH1 3.14Å
552	I	66.7	Low	66.7	Low	38 Å²	38	60.7 Å²	60.7	20%	0.195	30%	0.303	C	S	.	.	H	α-helix	trans	-71.1	-35.8	179.7	-72.6	168.1	0	0	0	112.7	M508 C548 C549 K550 V555 R556	M508-I552 HydrophobicContact CB-CD1 4.24Å; M508-I552 HydrophobicContact CG-CD1 3.8Å; C548-I552 PolarHBondContact O-N 3.28Å; C549-I552 PolarHBondContact O-N 3.11Å; K550-I552 VanDerWaalsContact C-N 3.32Å; K550-I552 PolarHBondContact O-N 3.24Å; I552-V555 PolarHBondContact O-N 3.25Å; I552-R556 WeakPolarHBondContact O-CB 3.37Å; I552-R556 PolarHBondContact O-N 2.8Å
553	L	69.2	Low	66.8	Low	34 Å²	34	59.2 Å²	59.2	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-71.5	-40.9	177.9	-70.5	173.7	0	0	0	111.8	H492 L493 F496 C549 K550 V555 R556 S557	H492-L553 HydrophobicContact CB-CD1 4.35Å; L493-L553 HydrophobicContact CB-CD1 4.22Å; F496-L553 HydrophobicContact CB-CD2 4.47Å; C549-L553 WeakPolarHBondContact O-CG 2.98Å; C549-L553 PolarHBondContact O-N 3.4Å; K550-L553 PolarHBondContact O-N 3.43Å; L553-V555 VanDerWaalsContact C-N 3.33Å; L553-R556 PolarHBondContact O-N 3.42Å; L553-S557 WeakPolarHBondContact O-CB 3.4Å; L553-S557 PolarHBondContact O-N 2.84Å
554	E	66.6	Low	67.1	Low	122 Å²	122	59.7 Å²	59.7	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-61.4	-45.2	171.7	-173.2	-179.3	179.5	0	0	110.5	K550 R556 S557 S558	K550-E554 PolarHBondContact O-N 3.49Å; E554-R556 PolarHBondContact O-N 3.39Å; E554-S557 PolarHBondContact O-N 2.72Å; E554-S557 PolarHBondContact O-OG 3.38Å; E554-S558 WeakPolarHBondContact O-CB 3.47Å; E554-S558 PolarHBondContact O-N 3.29Å; E554-S558 PolarHBondContact O-OG 3.45Å
555	V	60.2	Low	67.4	Low	24 Å²	24	60.6 Å²	60.6	15%	0.145	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-48.3	174.8	165.4	0	0	0	0	111.6	D551 I552 L553 S558 V559 L824 I828	D551-V555 VanDerWaalsContact O-CB 3.23Å; D551-V555 WeakPolarHBondContact O-CB 3.26Å; D551-V555 WeakPolarHBondContact O-CG2 3.49Å; D551-V555 PolarHBondContact O-N 2.9Å; D551-V555 VanDerWaalsContact O-N 3.07Å; I552-V555 PolarHBondContact O-N 3.25Å; L553-V555 VanDerWaalsContact C-N 3.33Å; V555-S558 PolarHBondContact O-N 3.01Å; V555-V559 WeakPolarHBondContact O-CG2 3.47Å; V555-V559 PolarHBondContact O-N 3.45Å; V555-L824 HydrophobicContact CB-CD1 4.46Å; V555-L824 HydrophobicContact CB-CG 4.41Å; V555-L824 HydrophobicContact CG1-CG 4.29Å; V555-L824 HydrophobicContact CG2-CD1 4.02Å; V555-L824 HydrophobicContact CG2-CG 4.05Å; V555-I828 HydrophobicContact CG1-CD1 3.51Å; V555-I828 HydrophobicContact CG1-CG1 3.33Å
556	R	63.8	Low	67.1	Low	122 Å²	122	60.6 Å²	60.6	46%	0.46	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-45.5	176.3	-174.5	175	-178.7	158.2	1.1	111.7	I552 L553 E554 S558 V559 I560	I552-R556 WeakPolarHBondContact O-CB 3.37Å; I552-R556 PolarHBondContact O-N 2.8Å; L553-R556 PolarHBondContact O-N 3.42Å; E554-R556 PolarHBondContact O-N 3.39Å; R556-S558 VanDerWaalsContact C-N 3.29Å; R556-S558 PolarHBondContact O-N 2.77Å; R556-V559 PolarHBondContact O-N 2.9Å; R556-I560 HydrophobicContact CG-CD1 4.05Å; R556-I560 WeakPolarHBondContact O-CG1 3.22Å; R556-I560 PolarHBondContact O-N 3.37Å
557	S	65	Low	66.9	Low	49 Å²	49	63 Å²	63	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-63.2	-35.2	-179.9	80.9	0	0	0	0	112.5	L553 E554 I560 R561	L553-S557 WeakPolarHBondContact O-CB 3.4Å; L553-S557 PolarHBondContact O-N 2.84Å; E554-S557 PolarHBondContact O-N 2.72Å; E554-S557 PolarHBondContact O-OG 3.38Å; S557-I560 PolarHBondContact O-N 2.81Å; S557-R561 WeakPolarHBondContact O-CB 3.48Å; S557-R561 PolarHBondContact O-N 3.16Å
558	S	65.2	Low	67.1	Low	19 Å²	19	65.6 Å²	65.6	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-70.6	-35.6	177.7	-65.3	0	0	0	0	112.3	E554 V555 R556 L562	E554-S558 WeakPolarHBondContact O-CB 3.47Å; E554-S558 PolarHBondContact O-N 3.29Å; E554-S558 PolarHBondContact O-OG 3.45Å; V555-S558 PolarHBondContact O-N 3.01Å; R556-S558 VanDerWaalsContact C-N 3.29Å; R556-S558 PolarHBondContact O-N 2.77Å; S558-L562 WeakPolarHBondContact O-CG 3.14Å; S558-L562 PolarHBondContact O-N 2.95Å; S558-L562 VanDerWaalsContact O-N 3.12Å
559	V	61.5	Low	67.2	Low	22 Å²	22	66 Å²	66	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-45.3	171.7	175.7	0	0	0	0	111	V555 R556 R561 L562 L563 L824 L825 I828	V555-V559 WeakPolarHBondContact O-CG2 3.47Å; V555-V559 PolarHBondContact O-N 3.45Å; R556-V559 PolarHBondContact O-N 2.9Å; V559-R561 VanDerWaalsContact C-N 3.29Å; V559-R561 PolarHBondContact O-N 2.93Å; V559-L562 CarbonylContact O-C 3.28Å; V559-L562 WeakPolarHBondContact O-CB 3.28Å; V559-L562 PolarHBondContact O-N 3.4Å; V559-L563 HydrophobicContact CG1-CD1 3.87Å; V559-L563 HydrophobicContact CG1-CG 4.35Å; V559-L563 WeakPolarHBondContact O-CB 3.29Å; V559-L563 PolarHBondContact O-N 2.79Å; V559-L824 HydrophobicContact CG2-CD2 4.15Å; V559-L825 HydrophobicContact CG2-CD2 4.21Å; V559-I828 HydrophobicContact CG2-CD1 3.22Å
560	I	64.3	Low	66.9	Low	75 Å²	75	67.5 Å²	67.5	39%	0.385	32%	0.316	S	S	.	.	H	α-helix	trans	-60.7	-40.5	176.6	-65.6	166.3	0	0	0	110.6	R556 S557 L562 L563 N564	R556-I560 HydrophobicContact CG-CD1 4.05Å; R556-I560 WeakPolarHBondContact O-CG1 3.22Å; R556-I560 PolarHBondContact O-N 3.37Å; S557-I560 PolarHBondContact O-N 2.81Å; I560-L562 VanDerWaalsContact C-N 3.29Å; I560-L562 PolarHBondContact O-N 3.13Å; I560-L563 PolarHBondContact O-N 3.35Å; I560-N564 WeakPolarHBondContact O-CB 3.49Å; I560-N564 PolarHBondContact O-N 2.96Å; I560-N564 PolarHBondContact O-OD1 3.39Å
561	R	69.5	Low	66.8	Low	179 Å²	179	69.5 Å²	69.5	68%	0.675	33%	0.326	S	S	*	.	H	α-helix	trans	-63.9	-30.9	174.9	-164.1	-178	-60.9	157.7	4.4	113.3	S557 V559	S557-R561 WeakPolarHBondContact O-CB 3.48Å; S557-R561 PolarHBondContact O-N 3.16Å; V559-R561 VanDerWaalsContact C-N 3.29Å; V559-R561 PolarHBondContact O-N 2.93Å
562	L	67.4	Low	67	Low	19 Å²	19	71 Å²	71	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-77.3	-44.8	173.2	-74.7	171.9	0	0	0	112.1	S558 V559 I560 N564 K565 C566 M817 F818 L825	S558-L562 WeakPolarHBondContact O-CG 3.14Å; S558-L562 PolarHBondContact O-N 2.95Å; S558-L562 VanDerWaalsContact O-N 3.12Å; V559-L562 CarbonylContact O-C 3.28Å; V559-L562 WeakPolarHBondContact O-CB 3.28Å; V559-L562 PolarHBondContact O-N 3.4Å; I560-L562 VanDerWaalsContact C-N 3.29Å; I560-L562 PolarHBondContact O-N 3.13Å; L562-N564 PolarHBondContact O-N 2.87Å; L562-K565 WeakPolarHBondContact O-CB 3.44Å; L562-K565 PolarHBondContact O-N 3.31Å; L562-C566 PolarHBondContact O-N 3.31Å; L562-C566 PolarHBondContact O-SG 2.75Å; L562-M817 WeakPolarHBondContact CD2-O 3.43Å; L562-F818 HydrophobicContact CD1-CD1 4.23Å; L562-F818 HydrophobicContact CD1-CE1 4.23Å; L562-L825 HydrophobicContact CD1-CD1 4.4Å
563	L	64.9	Low	67	Low	27 Å²	27	69.7 Å²	69.7	14%	0.141	33%	0.325	C	S	.	.	H	α-helix	trans	-50.1	-57.5	173	-84	160.8	0	0	0	110.4	V559 I560 K565 C566 E567 L865	V559-L563 HydrophobicContact CG1-CD1 3.87Å; V559-L563 HydrophobicContact CG1-CG 4.35Å; V559-L563 WeakPolarHBondContact O-CB 3.29Å; V559-L563 PolarHBondContact O-N 2.79Å; I560-L563 PolarHBondContact O-N 3.35Å; L563-K565 PolarHBondContact O-N 3Å; L563-C566 PolarHBondContact O-N 3.18Å; L563-E567 WeakPolarHBondContact O-CB 3.23Å; L563-E567 PolarHBondContact O-N 3.39Å; L563-L865 HydrophobicContact CD2-CD1 3.84Å; L563-L865 HydrophobicContact CD2-CD2 3.74Å; L563-L865 HydrophobicContact CD2-CG 3.53Å; L563-L865 HydrophobicContact CG-CD1 4.34Å; L563-L865 HydrophobicContact CG-CD2 4.27Å; L563-L865 HydrophobicContact CG-CG 4.39Å
564	N	68.7	Low	66.7	Low	74 Å²	74	68.8 Å²	68.8	40%	0.396	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-17.3	-178.7	-59.6	15.2	0	0	0	113.1	I560 L562 R568	I560-N564 WeakPolarHBondContact O-CB 3.49Å; I560-N564 PolarHBondContact O-N 2.96Å; I560-N564 PolarHBondContact O-OD1 3.39Å; L562-N564 PolarHBondContact O-N 2.87Å; N564-R568 WeakPolarHBondContact O-CD 3.42Å; N564-R568 VanDerWaalsContact O-CG 3.27Å; N564-R568 WeakPolarHBondContact O-CG 3.16Å
565	K	72	Confident	66.7	Low	109 Å²	109	65.4 Å²	65.4	47%	0.474	31%	0.312	S	S	.	.	H	α-helix	trans	-85.2	-40.5	171.6	-173.8	176.2	176.4	-180	0	111.8	L562 L563 L569 M817	L562-K565 WeakPolarHBondContact O-CB 3.44Å; L562-K565 PolarHBondContact O-N 3.31Å; L563-K565 PolarHBondContact O-N 3Å; K565-L569 WeakPolarHBondContact O-CG 3.31Å; K565-L569 PolarHBondContact O-N 3Å; K565-M817 HydrophobicContact CB-CE 4.47Å; K565-M817 HydrophobicContact CD-CE 4.16Å; K565-M817 HydrophobicContact CD-CG 4.36Å; K565-M817 HydrophobicContact CD-SD 4.48Å; K565-M817 HydrophobicContact CG-CE 4.08Å
566	C	66.1	Low	66.9	Low	3 Å²	3	66.9 Å²	66.9	2%	0.02	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-39.7	172.6	-66.3	0	0	0	0	111.8	L562 L563 L569 T570 M817 L865 F869	L562-C566 PolarHBondContact O-N 3.31Å; L562-C566 PolarHBondContact O-SG 2.75Å; L563-C566 PolarHBondContact O-N 3.18Å; C566-L569 PolarHBondContact O-N 2.95Å; C566-T570 PolarHBondContact O-N 3.03Å; C566-T570 PolarHBondContact O-OG1 3.17Å; C566-M817 WeakPolarHBondContact SG-CE 3.44Å; C566-L865 HydrophobicContact CB-CD2 3.72Å; C566-F869 HydrophobicContact CB-CE2 4.18Å
567	E	67.6	Low	66.8	Low	112 Å²	112	61.2 Å²	61.2	52%	0.523	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-48.9	178.2	-171.2	169.7	-135.8	0	0	110.9	L563 L569 T570 E571	L563-E567 WeakPolarHBondContact O-CB 3.23Å; L563-E567 PolarHBondContact O-N 3.39Å; E567-L569 VanDerWaalsContact C-N 3.33Å; E567-L569 PolarHBondContact O-N 3.25Å; E567-T570 CarbonylContact O-C 3.53Å; E567-T570 WeakPolarHBondContact O-CA 3.24Å; E567-T570 WeakPolarHBondContact O-CB 3.44Å; E567-T570 PolarHBondContact O-N 3.44Å; E567-E571 WeakPolarHBondContact O-CG 3.43Å; E567-E571 PolarHBondContact O-N 2.99Å
568	R	73.5	Confident	66.6	Low	168 Å²	168	60.5 Å²	60.5	63%	0.634	29%	0.29	S	S	*	.	H	α-helix	trans	-58.8	-40.6	174.1	-70.6	170.8	-172.4	-168.2	0.4	113.5	N564 T570 E571 Q572	N564-R568 WeakPolarHBondContact O-CD 3.42Å; N564-R568 VanDerWaalsContact O-CG 3.27Å; N564-R568 WeakPolarHBondContact O-CG 3.16Å; R568-T570 VanDerWaalsContact C-N 3.26Å; R568-T570 PolarHBondContact O-N 3.01Å; R568-E571 PolarHBondContact O-N 3.27Å; R568-Q572 WeakPolarHBondContact O-CB 3.44Å; R568-Q572 VanDerWaalsContact O-CG 3.26Å; R568-Q572 WeakPolarHBondContact O-CG 3.32Å; R568-Q572 PolarHBondContact O-N 2.9Å; R568-Q572 PolarHBondContact O-OE1 3Å
569	L	70.6	Confident	66.2	Low	38 Å²	38	66.2 Å²	66.2	20%	0.199	31%	0.309	C	S	.	.	H	α-helix	trans	-64.8	-33.1	173.4	-70.4	167.6	0	0	0	111.5	K565 C566 E567 V573 M817 F869	K565-L569 WeakPolarHBondContact O-CG 3.31Å; K565-L569 PolarHBondContact O-N 3Å; C566-L569 PolarHBondContact O-N 2.95Å; E567-L569 VanDerWaalsContact C-N 3.33Å; E567-L569 PolarHBondContact O-N 3.25Å; L569-V573 WeakPolarHBondContact O-CB 3.48Å; L569-V573 VanDerWaalsContact O-CG2 3.23Å; L569-V573 WeakPolarHBondContact O-CG2 3.21Å; L569-V573 PolarHBondContact O-N 2.77Å; L569-M817 HydrophobicContact CD1-CE 3.95Å; L569-M817 HydrophobicContact CD1-SD 3.69Å; L569-F869 HydrophobicContact CB-CZ 4.42Å; L569-F869 HydrophobicContact CD1-CZ 4.39Å
570	T	65.5	Low	65.8	Low	33 Å²	33	66.1 Å²	66.1	20%	0.202	31%	0.307	C	S	.	.	H	α-helix	trans	-68.5	-46.1	175.2	-51.6	0	0	0	0	111.2	C566 E567 R568 Q572 V573 A574 P868	C566-T570 PolarHBondContact O-N 3.03Å; C566-T570 PolarHBondContact O-OG1 3.17Å; E567-T570 CarbonylContact O-C 3.53Å; E567-T570 WeakPolarHBondContact O-CA 3.24Å; E567-T570 WeakPolarHBondContact O-CB 3.44Å; E567-T570 PolarHBondContact O-N 3.44Å; R568-T570 VanDerWaalsContact C-N 3.26Å; R568-T570 PolarHBondContact O-N 3.01Å; T570-Q572 VanDerWaalsContact C-N 3.32Å; T570-Q572 PolarHBondContact O-N 2.83Å; T570-V573 PolarHBondContact O-N 2.96Å; T570-A574 WeakPolarHBondContact O-CB 3.29Å; T570-A574 PolarHBondContact O-N 3.26Å; T570-P868 HydrophobicContact CG2-CB 4.04Å; T570-P868 HydrophobicContact CG2-CG 4.36Å; T570-P868 VanDerWaalsContact OG1-CG 3.3Å; T570-P868 WeakPolarHBondContact OG1-CG 3.36Å
571	E	68.7	Low	65.1	Low	118 Å²	118	63 Å²	63	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-60.9	-39.5	175.4	-66.7	174.2	138.9	0	0	111.6	E567 R568 S575	E567-E571 WeakPolarHBondContact O-CG 3.43Å; E567-E571 PolarHBondContact O-N 2.99Å; R568-E571 PolarHBondContact O-N 3.27Å; E571-S575 VanDerWaalsContact O-CB 3.22Å; E571-S575 WeakPolarHBondContact O-CB 3.41Å; E571-S575 PolarHBondContact O-N 2.97Å; E571-S575 PolarHBondContact O-OG 3.12Å
572	Q	69.6	Low	63.9	Low	106 Å²	106	58.9 Å²	58.9	50%	0.495	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-54.7	173.7	-73.9	174.5	-50.9	0	0	111.4	R568 T570 A574 S575 H576	R568-Q572 WeakPolarHBondContact O-CB 3.44Å; R568-Q572 VanDerWaalsContact O-CG 3.26Å; R568-Q572 WeakPolarHBondContact O-CG 3.32Å; R568-Q572 PolarHBondContact O-N 2.9Å; R568-Q572 PolarHBondContact O-OE1 3Å; T570-Q572 VanDerWaalsContact C-N 3.32Å; T570-Q572 PolarHBondContact O-N 2.83Å; Q572-A574 VanDerWaalsContact C-N 3.33Å; Q572-A574 PolarHBondContact O-N 2.79Å; Q572-S575 PolarHBondContact O-N 2.9Å; Q572-S575 PolarHBondContact O-OG 3.13Å; Q572-H576 WeakPolarHBondContact O-CB 3.4Å; Q572-H576 PolarHBondContact O-N 3.16Å
573	V	66	Low	62.7	Low	11 Å²	11	64 Å²	64	7%	0.067	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-42.1	178.2	172.5	0	0	0	0	111.9	L569 T570 A577 L647 E651 V653	L569-V573 WeakPolarHBondContact O-CB 3.48Å; L569-V573 VanDerWaalsContact O-CG2 3.23Å; L569-V573 WeakPolarHBondContact O-CG2 3.21Å; L569-V573 PolarHBondContact O-N 2.77Å; T570-V573 PolarHBondContact O-N 2.96Å; V573-A577 VanDerWaalsContact O-CB 3.31Å; V573-A577 WeakPolarHBondContact O-CB 3.4Å; V573-A577 PolarHBondContact O-N 3.26Å; V573-L647 HydrophobicContact CG1-CD2 3.75Å; V573-L647 HydrophobicContact CG1-CG 4.19Å; V573-E651 HydrophobicContact CG2-CB 3.98Å; V573-E651 HydrophobicContact CG2-CG 3.98Å; V573-V653 HydrophobicContact CG2-CG2 4.34Å
574	A	64.9	Low	61.5	Low	15 Å²	15	66.3 Å²	66.3	12%	0.124	32%	0.323	C	S	.	.	H	α-helix	trans	-70.9	-41	-179.8	0	0	0	0	0	113.1	V437 T570 Q572 A577 T578	V437-A574 HydrophobicContact CG1-CB 4.25Å; T570-A574 WeakPolarHBondContact O-CB 3.29Å; T570-A574 PolarHBondContact O-N 3.26Å; Q572-A574 VanDerWaalsContact C-N 3.33Å; Q572-A574 PolarHBondContact O-N 2.79Å; A574-A577 PolarHBondContact O-N 2.63Å; A574-T578 PolarHBondContact O-N 3.38Å; A574-T578 PolarHBondContact O-OG1 3.47Å
575	S	66.3	Low	59.8	Low	50 Å²	50	66.8 Å²	66.8	35%	0.35	32%	0.324	S	S	.	.	H	α-helix	trans	-68.9	-37.3	176.6	59.4	0	0	0	0	111.8	E571 Q572 T578 R579	E571-S575 VanDerWaalsContact O-CB 3.22Å; E571-S575 WeakPolarHBondContact O-CB 3.41Å; E571-S575 PolarHBondContact O-N 2.97Å; E571-S575 PolarHBondContact O-OG 3.12Å; Q572-S575 PolarHBondContact O-N 2.9Å; Q572-S575 PolarHBondContact O-OG 3.13Å; S575-T578 PolarHBondContact O-N 2.87Å; S575-R579 WeakPolarHBondContact O-CG 3.48Å; S575-R579 PolarHBondContact O-N 3.39Å
576	H	63.5	Low	57.8	Low	55 Å²	55	69.3 Å²	69.3	26%	0.255	34%	0.343	S	S	.	.	H	α-helix	trans	-66.2	-46.9	171.1	-91.1	-130.9	0	0	0	112	Q572 T578 R579 L580 L647 H650 E651	Q572-H576 WeakPolarHBondContact O-CB 3.4Å; Q572-H576 PolarHBondContact O-N 3.16Å; H576-T578 PolarHBondContact O-N 3.44Å; H576-R579 PolarHBondContact O-N 3.26Å; H576-R579 VanDerWaalsContact O-N 3.16Å; H576-L580 VanDerWaalsContact O-CG 3.3Å; H576-L580 WeakPolarHBondContact O-CG 3.35Å; H576-L580 PolarHBondContact O-N 3.08Å; H576-L647 HydrophobicContact CB-CD1 4.38Å; H576-H650 AromaticContact ND1-CE1 3.88Å; H576-H650 AromaticContact ND1-ND1 3.98Å; H576-E651 IonicContact CE1-OE1 2.76Å; H576-E651 IonicContact CG-OE1 2.7Å; H576-E651 IonicContact CG-OE2 3.57Å; H576-E651 IonicContact ND1-OE1 2.79Å; H576-E651 PolarHBondContact ND1-OE1 3.3Å; H576-E651 IonicContact ND1-OE2 3.61Å
577	A	61.1	Low	56	Low	3 Å²	3	76.2 Å²	76.2	3%	0.025	38%	0.379	C	S	.	.	H	α-helix	trans	-53	-39.7	173.5	0	0	0	0	0	112.8	V436 V437 V573 A574 L581 L647	V436-A577 HydrophobicContact CG1-CB 4.5Å; V437-A577 HydrophobicContact CG2-CB 3.69Å; V573-A577 VanDerWaalsContact O-CB 3.31Å; V573-A577 WeakPolarHBondContact O-CB 3.4Å; V573-A577 PolarHBondContact O-N 3.26Å; A574-A577 PolarHBondContact O-N 2.63Å; A577-L581 VanDerWaalsContact O-CD1 3.26Å; A577-L581 WeakPolarHBondContact O-CD1 3.28Å; A577-L581 VanDerWaalsContact O-CG 3.29Å; A577-L581 WeakPolarHBondContact O-CG 3.49Å; A577-L647 HydrophobicContact CB-CD2 3.8Å
578	T	61.5	Low	54.3	Low	34 Å²	34	76.3 Å²	76.3	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-67.1	-49.6	177.4	-52.7	0	0	0	0	111.5	V428 A574 S575 H576 L580 L581 E582	V428-T578 HydrophobicContact CG1-CG2 4.22Å; V428-T578 HydrophobicContact CG2-CG2 4.09Å; A574-T578 PolarHBondContact O-N 3.38Å; A574-T578 PolarHBondContact O-OG1 3.47Å; S575-T578 PolarHBondContact O-N 2.87Å; H576-T578 PolarHBondContact O-N 3.44Å; T578-L580 VanDerWaalsContact C-N 3.3Å; T578-L580 PolarHBondContact O-N 3.28Å; T578-L581 WeakPolarHBondContact O-CB 3.48Å; T578-L581 PolarHBondContact O-N 2.95Å; T578-E582 PolarHBondContact O-N 3.32Å; T578-E582 VanDerWaalsContact O-N 3.12Å
579	R	56.8	Low	52.1	Low	140 Å²	140	73 Å²	73	53%	0.528	40%	0.398	S	S	.	.	H	α-helix	trans	-58.7	-36.8	178.2	-73.9	169.5	171.3	175.9	-4.3	113.6	S575 H576 L581 E582 N583	S575-R579 WeakPolarHBondContact O-CG 3.48Å; S575-R579 PolarHBondContact O-N 3.39Å; H576-R579 PolarHBondContact O-N 3.26Å; H576-R579 VanDerWaalsContact O-N 3.16Å; R579-L581 PolarHBondContact O-N 3.41Å; R579-E582 PolarHBondContact O-N 3.35Å; R579-N583 WeakPolarHBondContact O-CB 3.49Å; R579-N583 VanDerWaalsContact O-CG 3.31Å; R579-N583 PolarHBondContact O-N 2.78Å; R579-N583 VanDerWaalsContact O-N 3.11Å
580	L	53.2	Low	50.1	Low	19 Å²	19	78.9 Å²	78.9	10%	0.099	43%	0.43	C	S	.	.	H	α-helix	trans	-67.9	-25.2	177.8	-62.4	177.9	0	0	0	112.7	H576 T578 T584 V618 L620 L647	H576-L580 VanDerWaalsContact O-CG 3.3Å; H576-L580 WeakPolarHBondContact O-CG 3.35Å; H576-L580 PolarHBondContact O-N 3.08Å; T578-L580 VanDerWaalsContact C-N 3.3Å; T578-L580 PolarHBondContact O-N 3.28Å; L580-T584 PolarHBondContact O-OG1 2.91Å; L580-V618 HydrophobicContact CD1-CB 3.69Å; L580-V618 HydrophobicContact CD1-CG1 4.02Å; L580-V618 HydrophobicContact CD1-CG2 4.44Å; L580-V618 HydrophobicContact CD2-CB 3.79Å; L580-V618 WeakPolarHBondContact CD2-O 3.46Å; L580-V618 HydrophobicContact CG-CB 4.38Å; L580-L620 HydrophobicContact CB-CD1 4.13Å; L580-L620 HydrophobicContact CB-CG 4.19Å; L580-L620 WeakPolarHBondContact O-CD1 3.4Å; L580-L647 HydrophobicContact CD1-CD1 4.12Å
581	L	50.1	Low	48.4	Very low	10 Å²	10	81.6 Å²	81.6	5%	0.052	46%	0.455	C	S	.	.	H	α-helix	trans	-85.4	-28.9	176.8	-64.7	161	0	0	0	112.7	A427 V428 L431 A577 T578 R579 T584 L620	A427-L581 HydrophobicContact CB-CB 4.09Å; A427-L581 HydrophobicContact CB-CD2 4.08Å; V428-L581 HydrophobicContact CB-CD1 4.46Å; V428-L581 HydrophobicContact CG2-CB 3.96Å; V428-L581 HydrophobicContact CG2-CD1 4.29Å; L431-L581 HydrophobicContact CB-CD1 3.74Å; L431-L581 HydrophobicContact CD1-CD1 3.82Å; L431-L581 HydrophobicContact CD1-CD2 3.74Å; L431-L581 HydrophobicContact CD1-CG 4.12Å; L431-L581 HydrophobicContact CG-CD1 3.93Å; L431-L581 HydrophobicContact CG-CD2 3.82Å; L431-L581 HydrophobicContact CG-CG 4.44Å; A577-L581 VanDerWaalsContact O-CD1 3.26Å; A577-L581 WeakPolarHBondContact O-CD1 3.28Å; A577-L581 VanDerWaalsContact O-CG 3.29Å; A577-L581 WeakPolarHBondContact O-CG 3.49Å; T578-L581 WeakPolarHBondContact O-CB 3.48Å; T578-L581 PolarHBondContact O-N 2.95Å; R579-L581 PolarHBondContact O-N 3.41Å; L581-T584 PolarHBondContact O-OG1 3.25Å; L581-L620 HydrophobicContact CD2-CD1 3.44Å; L581-L620 VanDerWaalsContact CD2-CD1 3.44Å; L581-L620 HydrophobicContact CG-CD1 3.96Å
582	E	44	Very low	46.7	Very low	92 Å²	92	84 Å²	84	43%	0.43	47%	0.47	S	S	.	.	H	α-helix	trans	-70.6	-39.8	172.9	-68.2	171.6	148.7	0	0	110.5	P424 T578 R579 T584	P424-E582 HydrophobicContact CB-CG 4.46Å; T578-E582 PolarHBondContact O-N 3.32Å; T578-E582 VanDerWaalsContact O-N 3.12Å; R579-E582 PolarHBondContact O-N 3.35Å; E582-T584 PolarHBondContact O-N 3.14Å
583	N	41.2	Very low	44.7	Very low	126 Å²	126	84.5 Å²	84.5	67%	0.674	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	15.1	-180	-65.9	-8.6	0	0	0	115.2	R579	R579-N583 WeakPolarHBondContact O-CB 3.49Å; R579-N583 VanDerWaalsContact O-CG 3.31Å; R579-N583 PolarHBondContact O-N 2.78Å; R579-N583 VanDerWaalsContact O-N 3.11Å
584	T	41.5	Very low	42.9	Very low	77 Å²	77	90.2 Å²	90.2	47%	0.472	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	18.1	-178.3	37.6	0	0	0	0	114.3	L580 L581 E582	L580-T584 PolarHBondContact O-OG1 2.91Å; L581-T584 PolarHBondContact O-OG1 3.25Å; E582-T584 PolarHBondContact O-N 3.14Å
585	I	31.9	Very low	41.2	Very low	83 Å²	83	97.5 Å²	97.5	43%	0.426	54%	0.543	S	S	.	.			trans	-107.1	67.7	-178.7	-44.8	-178.5	0	0	0	111.7	A427 L587	A427-I585 HydrophobicContact CB-CD1 4.49Å; I585-L587 HydrophobicContact CG2-CD1 4.08Å; I585-L587 HydrophobicContact CG2-CG 4.49Å
586	D	30.9	Very low	39.5	Very low	163 Å²	163	101.2 Å²	101.2	87%	0.872	56%	0.558	S	S	*	*			trans	-93.3	93.4	160.1	-78	-44.3	0	0	0	109.1
587	L	28.6	Very low	37.9	Very low	148 Å²	148	107.5 Å²	107.5	78%	0.775	59%	0.588	S	S	*	*			trans	-98.5	117.8	172.4	-87.1	162.6	0	0	0	109.4	I585 A589	I585-L587 HydrophobicContact CG2-CD1 4.08Å; I585-L587 HydrophobicContact CG2-CG 4.49Å; L587-A589 PolarHBondContact O-N 2.64Å
588	P	30	Very low	36.3	Very low	113 Å²	113	111.9 Å²	111.9	73%	0.734	62%	0.618	S	S	*	*			trans	-66.6	128.2	179.4	26.9	-33.5	0	0	0	110.4	N590	P588-N590 PolarHBondContact O-N 3.1Å
589	A	28.7	Very low	34.9	Very low	99 Å²	99	117.5 Å²	117.5	82%	0.818	65%	0.647	S	S	*	*	S	Bend	trans	-72.9	17.4	-167.9	0	0	0	0	0	116	L587 A591	L587-A589 PolarHBondContact O-N 2.64Å; A589-A591 PolarHBondContact O-N 2.97Å
590	N	27.5	Very low	33.6	Very low	162 Å²	162	114.5 Å²	114.5	87%	0.866	66%	0.66	S	S	*	*			trans	-104.1	61	-170.5	-67.8	-1.9	0	0	0	112.1	P588	P588-N590 PolarHBondContact O-N 3.1Å
591	A	31.3	Very low	32.7	Very low	90 Å²	90	120 Å²	120	74%	0.744	69%	0.694	S	S	*	*	S	Bend	trans	-144.8	14	177.7	0	0	0	0	0	114.9	A589	A589-A591 PolarHBondContact O-N 2.97Å
592	I	31.8	Very low	31.6	Very low	167 Å²	167	126.7 Å²	126.7	86%	0.856	73%	0.73	S	S	*	*			trans	-132.4	87.8	170.1	-54	-179.7	0	0	0	108.3
593	T	28.3	Very low	31.1	Very low	117 Å²	117	131.1 Å²	131.1	72%	0.718	75%	0.75	S	S	*	*			trans	-75.2	160.7	165.4	-21.6	0	0	0	0	109.9
594	D	27.2	Very low	30.4	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	75%	0.754	S	S	*	*			trans	59.4	80.8	162.3	-55.7	-27.5	0	0	0	117.9
595	Q	30	Very low	29.7	Very low	169 Å²	169	137.5 Å²	137.5	79%	0.79	77%	0.77	S	S	*	*				-175.5	148.9	96	-98.1	154	78.7	0	0	115
596	N	29.8	Very low	29.6	Very low	128 Å²	128	140.7 Å²	140.7	68%	0.684	79%	0.788	S	S	*	*			trans	68.4	96.6	160.4	-53	-25	0	0	0	118.8
597	Q	29.5	Very low	29.5	Very low	186 Å²	186	139.8 Å²	139.8	87%	0.869	78%	0.783	S	S	*	*				27.7	133.1	109	-57.6	171.8	3.5	0	0	116.5
598	S	29.1	Very low	29.4	Very low	95 Å²	95	140.8 Å²	140.8	66%	0.664	78%	0.782	S	S	*	*			cis	-161.9	174.6	28.1	64.4	0	0	0	0	114
599	D	32.3	Very low	29.2	Very low	152 Å²	152	140.7 Å²	140.7	81%	0.813	78%	0.783	S	S	*	*			trans	57.9	102.6	151.2	-49.3	-30.6	0	0	0	119.8
600	G	28.8	Very low	29.3	Very low	77 Å²	77	142.4 Å²	142.4	79%	0.794	78%	0.778	S	S	*	*			trans	-85.2	-164.6	177.4	0	0	0	0	0	116.6
601	V	33.9	Very low	29.3	Very low	135 Å²	135	141.5 Å²	141.5	82%	0.818	77%	0.773	S	S	*	*			trans	-166.4	134.4	150.8	141.5	0	0	0	0	105.9
602	D	28.3	Very low	29.1	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	78%	0.779	S	S	*	*			trans	-75.3	141.8	178	-50.3	-79.1	0	0	0	111.5
603	H	32.5	Very low	29.1	Very low	185 Å²	185	145 Å²	145	86%	0.856	78%	0.776	S	S	*	*			trans	-153	121.7	154.6	-113.4	-69.1	0	0	0	111.2
604	E	27	Very low	29.1	Very low	162 Å²	162	147.7 Å²	147.7	76%	0.757	79%	0.786	S	S	*	*			trans	-84.8	161.6	174.9	-59.1	178.7	122.2	0	0	111.6
605	H	27.4	Very low	29.4	Very low	175 Å²	175	144.4 Å²	144.4	81%	0.81	78%	0.783	S	S	*	*			trans	61.6	114.6	166.8	-63.7	-74.1	0	0	0	118.9
606	D	29.6	Very low	29.7	Very low	149 Å²	149	143.5 Å²	143.5	80%	0.797	78%	0.783	S	S	*	*				-148	143.1	118.3	-144.1	-10.6	0	0	0	111
607	D	28.1	Very low	30.3	Very low	144 Å²	144	142 Å²	142	77%	0.77	78%	0.78	S	S	*	*			trans	-112.7	82.6	-164.9	-162.7	3.6	0	0	0	111.7	S609	D607-S609 PolarHBondContact O-N 3.2Å
608	F	27	Very low	31.3	Very low	170 Å²	170	133.9 Å²	133.9	75%	0.746	74%	0.744	S	S	*	*			trans	-96.4	91.9	-172.5	-114.3	-87.4	0	0	0	114.1	I610	F608-I610 HydrophobicContact CD1-CD1 4.41Å; F608-I610 HydrophobicContact CD1-CG1 4.36Å; F608-I610 PolarHBondContact O-N 2.95Å
609	S	25.6	Very low	32.5	Very low	110 Å²	110	136 Å²	136	77%	0.769	74%	0.743	S	S	*	*			trans	-84.1	109.9	177.5	50.9	0	0	0	0	112.7	D607	D607-S609 PolarHBondContact O-N 3.2Å
610	I	29.7	Very low	33.6	Very low	136 Å²	136	130.5 Å²	130.5	70%	0.697	71%	0.713	S	S	*	*			trans	-111.9	100.9	178.8	-59.1	-177	0	0	0	111.8	F608	F608-I610 HydrophobicContact CD1-CD1 4.41Å; F608-I610 HydrophobicContact CD1-CG1 4.36Å; F608-I610 PolarHBondContact O-N 2.95Å
611	N	29	Very low	35.1	Very low	143 Å²	143	127.6 Å²	127.6	77%	0.765	68%	0.68	S	S	*	*			trans	44.7	96	148.8	-62.7	-30.6	0	0	0	119.4	T613	N611-T613 PolarHBondContact O-N 2.9Å
612	K	26.7	Very low	36.2	Very low	203 Å²	203	126.8 Å²	126.8	88%	0.883	68%	0.676	S	S	*	*			trans	-63.8	98.1	163.2	-67.8	174.5	179.3	171.9	0	111.9
613	T	32.3	Very low	37.7	Very low	128 Å²	128	127.3 Å²	127.3	79%	0.785	67%	0.673	S	S	*	*			trans	-81.9	121	159.8	53.9	0	0	0	0	109.7	N611 G615	N611-T613 PolarHBondContact O-N 2.9Å; T613-G615 PolarHBondContact O-N 3.18Å
614	N	27.6	Very low	39.9	Very low	172 Å²	172	121 Å²	121	92%	0.92	64%	0.644	S	S	*	*	S	Bend	trans	-69	97.6	-173.3	-72.4	-36.1	0	0	0	113.1
615	G	33.7	Very low	42.2	Very low	62 Å²	62	113.5 Å²	113.5	64%	0.639	61%	0.61	S	S	*	*			trans	-169.7	118.7	168.2	0	0	0	0	0	111	T613	T613-G615 PolarHBondContact O-N 3.18Å
616	N	36.3	Very low	44.5	Very low	151 Å²	151	109.6 Å²	109.6	81%	0.807	61%	0.607	S	S	*	*			trans	-66	127.6	-179.7	-78.5	-3.9	0	0	0	110.5
617	P	42.4	Very low	47	Very low	95 Å²	95	103.8 Å²	103.8	62%	0.617	58%	0.576	S	S	*	*			trans	-65	139.6	177	27.1	-34.1	0	0	0	111	Q619	P617-Q619 PolarHBondContact O-N 3.12Å
618	V	50.4	Low	49.5	Very low	17 Å²	17	97 Å²	97	10%	0.103	54%	0.54	C	S	.	.			trans	-76.6	90.2	176.9	-176.2	0	0	0	0	109.2	L580 L620 R646 H650	L580-V618 HydrophobicContact CD1-CB 3.69Å; L580-V618 HydrophobicContact CD1-CG1 4.02Å; L580-V618 HydrophobicContact CD1-CG2 4.44Å; L580-V618 HydrophobicContact CD2-CB 3.79Å; L580-V618 WeakPolarHBondContact CD2-O 3.46Å; L580-V618 HydrophobicContact CG-CB 4.38Å; V618-L620 PolarHBondContact O-N 3.14Å; V618-L620 VanDerWaalsContact O-N 3.12Å; V618-R646 HydrophobicContact CG1-CG 3.98Å; V618-H650 HydrophobicContact CG2-CB 3.72Å; V618-H650 WeakPolarHBondContact CG2-CD2 3.42Å
619	Q	53.4	Low	52.1	Low	139 Å²	139	90.9 Å²	90.9	65%	0.65	52%	0.515	S	S	*	.			trans	-53.8	120.3	169.9	-72.1	172.5	-30.6	0	0	110	P617 V621 R646	P617-Q619 PolarHBondContact O-N 3.12Å; Q619-V621 PolarHBondContact O-N 2.71Å; Q619-R646 PolarHBondContact O-NH1 3.11Å
620	L	56.9	Low	54.4	Low	36 Å²	36	91 Å²	91	19%	0.188	51%	0.513	C	S	.	.			trans	-66.2	131.2	171.4	-72.2	167.9	0	0	0	108.8	L580 L581 V618 T622	L580-L620 HydrophobicContact CB-CD1 4.13Å; L580-L620 HydrophobicContact CB-CG 4.19Å; L580-L620 WeakPolarHBondContact O-CD1 3.4Å; L581-L620 HydrophobicContact CD2-CD1 3.44Å; L581-L620 VanDerWaalsContact CD2-CD1 3.44Å; L581-L620 HydrophobicContact CG-CD1 3.96Å; V618-L620 PolarHBondContact O-N 3.14Å; V618-L620 VanDerWaalsContact O-N 3.12Å; L620-T622 PolarHBondContact O-N 3.49Å; L620-T622 VanDerWaalsContact O-N 3.16Å
621	V	59	Low	56.6	Low	16 Å²	16	92.1 Å²	92.1	10%	0.097	52%	0.519	C	S	.	.			trans	-83.2	94.2	-173.2	-178.1	0	0	0	0	108.2	Q619 Q623 L639 L642 N643	Q619-V621 PolarHBondContact O-N 2.71Å; V621-Q623 WeakPolarHBondContact CG1-O 3.47Å; V621-L639 HydrophobicContact CG1-CD1 4.16Å; V621-L639 WeakPolarHBondContact O-CD1 3.16Å; V621-L639 WeakPolarHBondContact O-CG 3.1Å; V621-L642 HydrophobicContact CG1-CD2 4Å; V621-N643 WeakPolarHBondContact CB-OD1 3.22Å; V621-N643 PolarHBondContact N-OD1 3.37Å; V621-N643 PolarHBondContact O-ND2 2.91Å
622	T	57	Low	58.9	Low	118 Å²	118	89.2 Å²	89.2	72%	0.724	50%	0.498	S	S	*	.	S	Bend	trans	-83.1	-26	176.3	52	0	0	0	0	112.9	L620 L639	L620-T622 PolarHBondContact O-N 3.49Å; L620-T622 VanDerWaalsContact O-N 3.16Å; T622-L639 WeakPolarHBondContact O-CD2 3.46Å
623	Q	61	Low	61.6	Low	162 Å²	162	87.4 Å²	87.4	76%	0.757	49%	0.492	S	S	*	.	S	Bend	trans	-120.1	148.5	175.9	-62	-179.2	-0.4	0	0	109.4	V621	V621-Q623 WeakPolarHBondContact CG1-O 3.47Å
624	Q	78.3	Confident	64.1	Low	54 Å²	54	82.2 Å²	82.2	25%	0.252	46%	0.46	S	S	.	.			trans	-63.6	149.5	-176.1	68	-176.1	18.5	0	0	113	A626 L628 R632 L634	Q624-A626 PolarHBondContact O-N 2.86Å; Q624-L628 HydrophobicContact CB-CD1 4.43Å; Q624-R632 PolarHBondContact NE2-O 2.87Å; Q624-R632 PolarHBondContact OE1-O 2.97Å; Q624-L634 HydrophobicContact CB-CD1 3.84Å; Q624-L634 HydrophobicContact CB-CG 4.15Å
625	P	76.1	Confident	66.7	Low	4 Å²	4	77.4 Å²	77.4	3%	0.026	43%	0.431	C	S	.	.			trans	-47.3	125.8	173.2	-30.9	36.5	0	0	0	111.9	I627 L628 L642 A674 E678	P625-I627 PolarHBondContact O-N 2.98Å; P625-I627 VanDerWaalsContact O-N 3.12Å; P625-L628 HydrophobicContact CB-CD1 4.25Å; P625-L628 HydrophobicContact CB-CG 4.21Å; P625-L628 HydrophobicContact CG-CD1 4.27Å; P625-L628 WeakPolarHBondContact O-CB 3.33Å; P625-L628 PolarHBondContact O-N 3.13Å; P625-L642 HydrophobicContact CG-CD2 3.89Å; P625-A674 HydrophobicContact CB-CB 4.15Å; P625-E678 VanDerWaalsContact C-OE1 3.22Å; P625-E678 WeakPolarHBondContact CA-OE1 3.37Å; P625-E678 WeakPolarHBondContact CB-OE1 3.49Å; P625-E678 WeakPolarHBondContact CB-OE2 3.38Å
626	A	75.7	Confident	68.9	Low	92 Å²	92	79 Å²	79	76%	0.76	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.5	-174.7	0	0	0	0	0	113.6	Q624 L628 E678	Q624-A626 PolarHBondContact O-N 2.86Å; A626-L628 VanDerWaalsContact C-N 3.34Å; A626-E678 PolarHBondContact N-OE1 2.9Å
627	I	80.1	Confident	71.1	Confident	27 Å²	27	72.9 Å²	72.9	14%	0.138	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-16.5	173.9	-66.3	-175.8	0	0	0	112.9	P625 W677 E678 H707	P625-I627 PolarHBondContact O-N 2.98Å; P625-I627 VanDerWaalsContact O-N 3.12Å; I627-W677 HydrophobicContact CD1-CD2 3.74Å; I627-W677 HydrophobicContact CD1-CE3 3.01Å; I627-W677 HydrophobicContact CD1-CG 4.49Å; I627-W677 HydrophobicContact CD1-CH2 4.14Å; I627-W677 HydrophobicContact CD1-CZ3 3.24Å; I627-E678 HydrophobicContact CB-CG 4.5Å; I627-E678 HydrophobicContact CD1-CG 3.53Å; I627-E678 HydrophobicContact CG1-CG 3.9Å; I627-E678 WeakPolarHBondContact CG1-OE1 3.4Å; I627-E678 PolarHBondContact N-OE1 2.89Å; I627-H707 HydrophobicContact CG2-CB 4.15Å
628	L	81.5	Confident	73.2	Confident	3 Å²	3	69 Å²	69	2%	0.016	37%	0.369	C	S	.	.	S	Bend	trans	-70	143	170.3	-65.2	174.1	0	0	0	110.3	Q624 P625 A626 P630 L634 I670 A671 A674 W704 C705	Q624-L628 HydrophobicContact CB-CD1 4.43Å; P625-L628 HydrophobicContact CB-CD1 4.25Å; P625-L628 HydrophobicContact CB-CG 4.21Å; P625-L628 HydrophobicContact CG-CD1 4.27Å; P625-L628 WeakPolarHBondContact O-CB 3.33Å; P625-L628 PolarHBondContact O-N 3.13Å; A626-L628 VanDerWaalsContact C-N 3.34Å; L628-P630 VanDerWaalsContact O-CD 3.25Å; L628-P630 WeakPolarHBondContact O-CD 3.26Å; L628-P630 VanDerWaalsContact O-N 3.11Å; L628-L634 HydrophobicContact CD1-CD1 3.92Å; L628-L634 HydrophobicContact CD1-CD2 4.36Å; L628-L634 HydrophobicContact CD1-CG 4.2Å; L628-I670 HydrophobicContact CD2-CG2 4.29Å; L628-A671 HydrophobicContact CD1-CB 3.81Å; L628-A674 HydrophobicContact CD2-CB 3.99Å; L628-A674 HydrophobicContact CG-CB 4.2Å; L628-W704 CarbonylContact C-O 3.57Å; L628-W704 VanDerWaalsContact CA-O 3.31Å; L628-W704 WeakPolarHBondContact CA-O 3.46Å; L628-W704 HydrophobicContact CD2-CB 4.36Å; L628-C705 HydrophobicContact CD2-CB 4.32Å
629	N	80.9	Confident	74.8	Confident	41 Å²	41	69.8 Å²	69.8	22%	0.219	37%	0.373	C	S	.	.			trans	-51.7	114.3	179	-177.5	-11.4	0	0	0	111	L631 R632 L703 W704	N629-L631 PolarHBondContact O-N 2.94Å; N629-L631 WeakPolarHBondContact OD1-CB 3.39Å; N629-L631 PolarHBondContact OD1-N 2.99Å; N629-R632 PolarHBondContact O-N 2.94Å; N629-L703 WeakPolarHBondContact CB-O 3.14Å; N629-L703 PolarHBondContact ND2-O 2.99Å; N629-W704 PolarHBondContact N-O 3.03Å
630	P	74	Confident	76.1	Confident	111 Å²	111	63.6 Å²	63.6	72%	0.721	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19	-174.9	-27.7	36.4	0	0	0	114.9	L628 R632	L628-P630 VanDerWaalsContact O-CD 3.25Å; L628-P630 WeakPolarHBondContact O-CD 3.26Å; L628-P630 VanDerWaalsContact O-N 3.11Å; P630-R632 PolarHBondContact O-N 2.85Å
631	L	76	Confident	77.5	Confident	160 Å²	160	61.9 Å²	61.9	84%	0.838	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	4.8	175.5	-57.5	176.7	0	0	0	113.7	N629	N629-L631 PolarHBondContact O-N 2.94Å; N629-L631 WeakPolarHBondContact OD1-CB 3.39Å; N629-L631 PolarHBondContact OD1-N 2.99Å
632	R	78.9	Confident	78.9	Confident	83 Å²	83	61.2 Å²	61.2	31%	0.313	33%	0.331	S	S	.	.			trans	-138.6	124.7	-177.7	-62.7	-172.9	168.6	-147.8	-8.1	111.3	Q624 N629 P630 E700 W704	Q624-R632 PolarHBondContact NE2-O 2.87Å; Q624-R632 PolarHBondContact OE1-O 2.97Å; N629-R632 PolarHBondContact O-N 2.94Å; P630-R632 PolarHBondContact O-N 2.85Å; R632-E700 IonicContact NH1-OE2 3.92Å; R632-W704 HydrophobicContact CB-CD2 4.41Å; R632-W704 HydrophobicContact CB-CE3 3.83Å; R632-W704 HydrophobicContact CB-CH2 3.78Å; R632-W704 HydrophobicContact CB-CZ2 4.35Å; R632-W704 HydrophobicContact CB-CZ3 3.49Å; R632-W704 VanDerWaalsContact CB-CZ3 3.49Å
633	E	82.6	Confident	80.3	Confident	165 Å²	165	56.6 Å²	56.6	77%	0.771	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-100	139.1	179.9	-63.9	-176.6	164.5	0	0	112.3
634	L	84.1	Confident	81.4	Confident	19 Å²	19	49.4 Å²	49.4	10%	0.099	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-74.5	128.3	167.3	-63.6	179.6	0	0	0	110.5	Q624 L628 Q638 L642 V667 A671 W704	Q624-L634 HydrophobicContact CB-CD1 3.84Å; Q624-L634 HydrophobicContact CB-CG 4.15Å; L628-L634 HydrophobicContact CD1-CD1 3.92Å; L628-L634 HydrophobicContact CD1-CD2 4.36Å; L628-L634 HydrophobicContact CD1-CG 4.2Å; L634-Q638 HydrophobicContact CB-CB 4.41Å; L634-L642 HydrophobicContact CD1-CD2 4.17Å; L634-V667 HydrophobicContact CD2-CG1 3.55Å; L634-A671 HydrophobicContact CD1-CB 3.85Å; L634-A671 HydrophobicContact CD2-CB 4.2Å; L634-W704 HydrophobicContact CD2-CH2 4.45Å; L634-W704 HydrophobicContact CD2-CZ3 3.96Å
635	K	83	Confident	81.9	Confident	70 Å²	70	47 Å²	47	30%	0.304	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-64.8	150	173.7	-68.7	-160.6	169.7	-157.2	0	110.6	Y637 Q638 L639 L879	K635-Y637 VanDerWaalsContact C-N 3.28Å; K635-Y637 HydrophobicContact CB-CD1 3.72Å; K635-Y637 HydrophobicContact CB-CE1 3.47Å; K635-Y637 VanDerWaalsContact CB-CE1 3.47Å; K635-Y637 HydrophobicContact CD-CE1 3.94Å; K635-Y637 HydrophobicContact CG-CE1 4.25Å; K635-Y637 PolarHBondContact O-N 3Å; K635-Q638 HydrophobicContact CB-CG 4.29Å; K635-Q638 WeakPolarHBondContact O-CA 3.45Å; K635-Q638 VanDerWaalsContact O-CB 3.26Å; K635-Q638 WeakPolarHBondContact O-CB 3.37Å; K635-Q638 PolarHBondContact O-N 3.49Å; K635-L639 PolarHBondContact O-N 3.33Å; K635-L879 HydrophobicContact CD-CD2 4.29Å
636	P	80.2	Confident	82.3	Confident	96 Å²	96	49.3 Å²	49.3	62%	0.623	27%	0.265	S	S	*	.	H	α-helix	trans	-53.1	-37.1	-171.9	-31	36.1	0	0	0	115.4	Q638 L639 V640	P636-Q638 VanDerWaalsContact C-N 3.34Å; P636-Q638 PolarHBondContact O-N 2.88Å; P636-L639 WeakPolarHBondContact O-CB 3.42Å; P636-L639 PolarHBondContact O-N 2.7Å; P636-V640 PolarHBondContact O-N 2.92Å; P636-V640 VanDerWaalsContact O-N 3.17Å
637	Y	81.7	Confident	82.7	Confident	22 Å²	22	45.3 Å²	45.3	9%	0.086	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-32.5	174.8	74	-88.3	0	0	0	113.3	K635 L639 V640 G641 L663 R873 V878 L879	K635-Y637 VanDerWaalsContact C-N 3.28Å; K635-Y637 HydrophobicContact CB-CD1 3.72Å; K635-Y637 HydrophobicContact CB-CE1 3.47Å; K635-Y637 VanDerWaalsContact CB-CE1 3.47Å; K635-Y637 HydrophobicContact CD-CE1 3.94Å; K635-Y637 HydrophobicContact CG-CE1 4.25Å; K635-Y637 PolarHBondContact O-N 3Å; Y637-L639 VanDerWaalsContact C-N 3.32Å; Y637-V640 PolarHBondContact O-N 2.64Å; Y637-G641 PolarHBondContact O-N 3.39Å; Y637-L663 HydrophobicContact CE2-CB 4.01Å; Y637-L663 HydrophobicContact CE2-CD2 4.09Å; Y637-L663 WeakPolarHBondContact CE2-O 3.33Å; Y637-L663 PolarHBondContact OH-O 3.45Å; Y637-R873 PolarHBondContact O-NH1 3.23Å; Y637-V878 HydrophobicContact CD1-CG1 3.11Å; Y637-V878 HydrophobicContact CD2-CG1 3.56Å; Y637-V878 HydrophobicContact CE1-CG1 3.4Å; Y637-V878 HydrophobicContact CE2-CG1 3.83Å; Y637-V878 HydrophobicContact CG-CG1 3.18Å; Y637-L879 HydrophobicContact CE1-CD2 4.11Å
638	Q	86.7	Confident	82.9	Confident	13 Å²	13	44.3 Å²	44.3	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-69	-35.6	177.7	-59.4	177.1	-33.5	0	0	110.1	L634 K635 P636 G641 L642 Q668	L634-Q638 HydrophobicContact CB-CB 4.41Å; K635-Q638 HydrophobicContact CB-CG 4.29Å; K635-Q638 WeakPolarHBondContact O-CA 3.45Å; K635-Q638 VanDerWaalsContact O-CB 3.26Å; K635-Q638 WeakPolarHBondContact O-CB 3.37Å; K635-Q638 PolarHBondContact O-N 3.49Å; P636-Q638 VanDerWaalsContact C-N 3.34Å; P636-Q638 PolarHBondContact O-N 2.88Å; Q638-G641 PolarHBondContact O-N 2.89Å; Q638-L642 WeakPolarHBondContact O-CB 3.29Å; Q638-L642 PolarHBondContact O-N 2.95Å; Q638-Q668 HydrophobicContact CB-CG 3.82Å; Q638-Q668 HydrophobicContact CG-CG 4Å
639	L	83.7	Confident	83.2	Confident	35 Å²	35	45.9 Å²	45.9	18%	0.183	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-40.7	170.4	-166.4	78.4	0	0	0	112.2	V621 T622 K635 P636 Y637 G641 L642 N643	V621-L639 HydrophobicContact CG1-CD1 4.16Å; V621-L639 WeakPolarHBondContact O-CD1 3.16Å; V621-L639 WeakPolarHBondContact O-CG 3.1Å; T622-L639 WeakPolarHBondContact O-CD2 3.46Å; K635-L639 PolarHBondContact O-N 3.33Å; P636-L639 WeakPolarHBondContact O-CB 3.42Å; P636-L639 PolarHBondContact O-N 2.7Å; Y637-L639 VanDerWaalsContact C-N 3.32Å; L639-G641 VanDerWaalsContact C-N 3.33Å; L639-L642 WeakPolarHBondContact O-CB 3.35Å; L639-L642 PolarHBondContact O-N 3.17Å; L639-N643 PolarHBondContact O-N 3.38Å; L639-N643 PolarHBondContact O-ND2 3.37Å
640	V	81.7	Confident	83.3	Confident	9 Å²	9	47.8 Å²	47.8	6%	0.055	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-38.6	172.7	177.1	0	0	0	0	111.4	Y430 V434 V436 P636 Y637 N643 W644	Y430-V640 HydrophobicContact CE1-CG2 4.45Å; V434-V640 HydrophobicContact CB-CG1 4.09Å; V434-V640 HydrophobicContact CG1-CB 4.44Å; V434-V640 HydrophobicContact CG1-CG1 3.86Å; V434-V640 HydrophobicContact CG1-CG2 4.29Å; V436-V640 HydrophobicContact CG2-CG1 4.04Å; P636-V640 PolarHBondContact O-N 2.92Å; P636-V640 VanDerWaalsContact O-N 3.17Å; Y637-V640 PolarHBondContact O-N 2.64Å; V640-N643 PolarHBondContact O-N 3.01Å; V640-W644 PolarHBondContact O-N 3.39Å
641	G	86.1	Confident	83.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-41.1	174.7	0	0	0	0	0	112.7	Y637 Q638 L639 W644 L645	Y637-G641 PolarHBondContact O-N 3.39Å; Q638-G641 PolarHBondContact O-N 2.89Å; L639-G641 VanDerWaalsContact C-N 3.33Å; G641-W644 PolarHBondContact O-N 3.3Å; G641-L645 WeakPolarHBondContact O-CG 3.48Å; G641-L645 PolarHBondContact O-N 2.73Å
642	L	88.3	Confident	84	Confident	1 Å²	1	43 Å²	43	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-45.9	172.9	176	61.2	0	0	0	111.9	V621 P625 L634 Q638 L639 L645 R646 A671 F672	V621-L642 HydrophobicContact CG1-CD2 4Å; P625-L642 HydrophobicContact CG-CD2 3.89Å; L634-L642 HydrophobicContact CD1-CD2 4.17Å; Q638-L642 WeakPolarHBondContact O-CB 3.29Å; Q638-L642 PolarHBondContact O-N 2.95Å; L639-L642 WeakPolarHBondContact O-CB 3.35Å; L639-L642 PolarHBondContact O-N 3.17Å; L642-L645 PolarHBondContact O-N 2.94Å; L642-R646 PolarHBondContact O-N 3.39Å; L642-A671 HydrophobicContact CD1-CB 4.24Å; L642-A671 HydrophobicContact CD2-CB 4.28Å; L642-F672 VanDerWaalsContact CD1-CA 3.45Å; L642-F672 HydrophobicContact CD1-CB 3.99Å; L642-F672 HydrophobicContact CD1-CD2 4.45Å
643	N	85.4	Confident	84.2	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.112	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-40.2	177.7	-81.2	-60.4	0	0	0	112.5	V621 L639 V640 R646 L647	V621-N643 WeakPolarHBondContact CB-OD1 3.22Å; V621-N643 PolarHBondContact N-OD1 3.37Å; V621-N643 PolarHBondContact O-ND2 2.91Å; L639-N643 PolarHBondContact O-N 3.38Å; L639-N643 PolarHBondContact O-ND2 3.37Å; V640-N643 PolarHBondContact O-N 3.01Å; N643-R646 PolarHBondContact O-N 2.84Å; N643-L647 WeakPolarHBondContact O-CB 3.21Å; N643-L647 PolarHBondContact O-N 3.21Å
644	W	84.8	Confident	84.5	Confident	12 Å²	12	32.7 Å²	32.7	5%	0.045	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-43.6	172.4	-179.9	77.7	0	0	0	111.9	V640 G641 L647 L648 I656 L657 L871	V640-W644 PolarHBondContact O-N 3.39Å; G641-W644 PolarHBondContact O-N 3.3Å; W644-L647 PolarHBondContact O-N 2.94Å; W644-L648 HydrophobicContact CD2-CD1 4.11Å; W644-L648 HydrophobicContact CD2-CG 4.48Å; W644-L648 HydrophobicContact CE3-CD1 4.13Å; W644-L648 HydrophobicContact CH2-CD1 3.65Å; W644-L648 HydrophobicContact CZ2-CD1 3.61Å; W644-L648 HydrophobicContact CZ2-CG 4.47Å; W644-L648 HydrophobicContact CZ3-CD1 3.91Å; W644-L648 WeakPolarHBondContact O-CG 3.38Å; W644-L648 PolarHBondContact O-N 3.05Å; W644-I656 WeakPolarHBondContact CH2-O 3.34Å; W644-L657 HydrophobicContact CZ3-CD1 4.5Å; W644-L871 HydrophobicContact CB-CD2 4.16Å; W644-L871 HydrophobicContact CD2-CB 3.84Å; W644-L871 HydrophobicContact CD2-CD2 3.84Å; W644-L871 HydrophobicContact CD2-CG 4.43Å; W644-L871 HydrophobicContact CE3-CB 3.75Å; W644-L871 HydrophobicContact CE3-CD2 3.73Å; W644-L871 HydrophobicContact CE3-CG 4.4Å; W644-L871 HydrophobicContact CG-CD2 4.05Å; W644-L871 HydrophobicContact CH2-CB 3.67Å; W644-L871 HydrophobicContact CZ2-CB 3.74Å; W644-L871 HydrophobicContact CZ3-CB 3.67Å; W644-L871 HydrophobicContact CZ3-CD2 4.4Å
645	L	88.6	Confident	84.6	Confident	4 Å²	4	32 Å²	32	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-65.4	-37.5	174.8	-67.5	173	0	0	0	112.7	G641 L642 L648 H649 F672 L792	G641-L645 WeakPolarHBondContact O-CG 3.48Å; G641-L645 PolarHBondContact O-N 2.73Å; L642-L645 PolarHBondContact O-N 2.94Å; L645-L648 PolarHBondContact O-N 2.87Å; L645-H649 PolarHBondContact O-N 3.03Å; L645-F672 HydrophobicContact CB-CB 4.42Å; L645-F672 HydrophobicContact CB-CD2 3.5Å; L645-F672 VanDerWaalsContact CB-CD2 3.5Å; L645-F672 HydrophobicContact CB-CE2 3.79Å; L645-F672 HydrophobicContact CB-CG 3.9Å; L645-F672 HydrophobicContact CB-CZ 4.42Å; L645-F672 HydrophobicContact CD1-CB 3.87Å; L645-F672 HydrophobicContact CD1-CD1 4.45Å; L645-F672 HydrophobicContact CD1-CD2 4.45Å; L645-F672 HydrophobicContact CD1-CG 4.01Å; L645-F672 WeakPolarHBondContact O-CE2 3.44Å; L645-L792 HydrophobicContact CD1-CD2 4.36Å; L645-L792 HydrophobicContact CD2-CD1 3.66Å; L645-L792 HydrophobicContact CD2-CD2 4.09Å
646	R	85	Confident	84.9	Confident	52 Å²	52	28.7 Å²	28.7	20%	0.196	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-39.3	175.1	-172	176.4	179.6	169.4	-0.5	111.8	V618 Q619 L642 N643 H649 H650	V618-R646 HydrophobicContact CG1-CG 3.98Å; Q619-R646 PolarHBondContact O-NH1 3.11Å; L642-R646 PolarHBondContact O-N 3.39Å; N643-R646 PolarHBondContact O-N 2.84Å; R646-H649 PolarHBondContact O-N 3.08Å; R646-H650 PolarHBondContact O-N 2.99Å; R646-H650 VanDerWaalsContact O-N 3.16Å
647	L	83.2	Confident	85.5	Confident	8 Å²	8	24.1 Å²	24.1	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-62.3	-51.1	173.2	177.2	66.1	0	0	0	111.3	V436 V573 H576 A577 L580 N643 W644 H649 H650 E651	V436-L647 HydrophobicContact CG1-CD2 4.23Å; V573-L647 HydrophobicContact CG1-CD2 3.75Å; V573-L647 HydrophobicContact CG1-CG 4.19Å; H576-L647 HydrophobicContact CB-CD1 4.38Å; A577-L647 HydrophobicContact CB-CD2 3.8Å; L580-L647 HydrophobicContact CD1-CD1 4.12Å; N643-L647 WeakPolarHBondContact O-CB 3.21Å; N643-L647 PolarHBondContact O-N 3.21Å; W644-L647 PolarHBondContact O-N 2.94Å; L647-H649 VanDerWaalsContact C-N 3.26Å; L647-H649 PolarHBondContact O-N 2.98Å; L647-H650 PolarHBondContact O-N 3.15Å; L647-H650 VanDerWaalsContact O-N 3.09Å; L647-E651 HydrophobicContact CD1-CG 4.06Å; L647-E651 HydrophobicContact CG-CG 4.49Å; L647-E651 PolarHBondContact O-N 2.87Å
648	L	85.7	Confident	85.8	Confident	5 Å²	5	23.1 Å²	23.1	3%	0.026	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-37.1	177.5	-68.1	-174.3	0	0	0	112.8	W644 L645 Q652 V653	W644-L648 HydrophobicContact CD2-CD1 4.11Å; W644-L648 HydrophobicContact CD2-CG 4.48Å; W644-L648 HydrophobicContact CE3-CD1 4.13Å; W644-L648 HydrophobicContact CH2-CD1 3.65Å; W644-L648 HydrophobicContact CZ2-CD1 3.61Å; W644-L648 HydrophobicContact CZ2-CG 4.47Å; W644-L648 HydrophobicContact CZ3-CD1 3.91Å; W644-L648 WeakPolarHBondContact O-CG 3.38Å; W644-L648 PolarHBondContact O-N 3.05Å; L645-L648 PolarHBondContact O-N 2.87Å; L648-Q652 PolarHBondContact O-N 3.2Å; L648-Q652 VanDerWaalsContact O-N 3.15Å; L648-V653 HydrophobicContact CD2-CB 4.03Å; L648-V653 HydrophobicContact CD2-CG1 3.83Å; L648-V653 PolarHBondContact O-N 2.73Å
649	H	87.2	Confident	85.8	Confident	37 Å²	37	22.5 Å²	22.5	17%	0.171	11%	0.107	C	C	.	.	H	α-helix	trans	-62.2	-43.8	174.5	172.5	-114.6	0	0	0	112.6	L645 R646 L647 Q652 F672 L676 N681 H762 Y763	L645-H649 PolarHBondContact O-N 3.03Å; R646-H649 PolarHBondContact O-N 3.08Å; L647-H649 VanDerWaalsContact C-N 3.26Å; L647-H649 PolarHBondContact O-N 2.98Å; H649-Q652 PolarHBondContact O-N 2.64Å; H649-F672 HydrophobicContact CB-CE2 4.12Å; H649-F672 HydrophobicContact CB-CZ 4.09Å; H649-L676 VanDerWaalsContact CE1-CD2 3.44Å; H649-L676 WeakPolarHBondContact CE1-CD2 3.43Å; H649-N681 PolarHBondContact CE1-ND2 2.95Å; H649-N681 PolarHBondContact NE2-ND2 3.2Å; H649-H762 AromaticContact NE2-CE1 3.66Å; H649-Y763 WeakPolarHBondContact CB-OH 3.5Å; H649-Y763 AromaticContact CD2-CE2 3.75Å; H649-Y763 PolarHBondContact CD2-OH 3.42Å
650	H	82.7	Confident	85.6	Confident	81 Å²	81	21.6 Å²	21.6	38%	0.375	10%	0.102	S	C	.	.	H	α-helix	trans	-66	-48.9	177.7	-178.9	-95	0	0	0	111.9	H576 V618 R646 L647 Q652	H576-H650 AromaticContact ND1-CE1 3.88Å; H576-H650 AromaticContact ND1-ND1 3.98Å; V618-H650 HydrophobicContact CG2-CB 3.72Å; V618-H650 WeakPolarHBondContact CG2-CD2 3.42Å; R646-H650 PolarHBondContact O-N 2.99Å; R646-H650 VanDerWaalsContact O-N 3.16Å; L647-H650 PolarHBondContact O-N 3.15Å; L647-H650 VanDerWaalsContact O-N 3.09Å; H650-Q652 WeakPolarHBondContact O-CG 3.42Å; H650-Q652 PolarHBondContact O-N 2.98Å
651	E	80.4	Confident	85.5	Confident	39 Å²	39	22.2 Å²	22.2	18%	0.182	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	1.5	178.3	-59.6	-50.4	121	0	0	113.6	V573 H576 L647 V653	V573-E651 HydrophobicContact CG2-CB 3.98Å; V573-E651 HydrophobicContact CG2-CG 3.98Å; H576-E651 IonicContact CE1-OE1 2.76Å; H576-E651 IonicContact CG-OE1 2.7Å; H576-E651 IonicContact CG-OE2 3.57Å; H576-E651 IonicContact ND1-OE1 2.79Å; H576-E651 PolarHBondContact ND1-OE1 3.3Å; H576-E651 IonicContact ND1-OE2 3.61Å; L647-E651 HydrophobicContact CD1-CG 4.06Å; L647-E651 HydrophobicContact CG-CG 4.49Å; L647-E651 PolarHBondContact O-N 2.87Å; E651-V653 HydrophobicContact CB-CG2 4.22Å; E651-V653 PolarHBondContact O-N 3.24Å
652	Q	83.8	Confident	85.1	Confident	131 Å²	131	24.2 Å²	24.2	61%	0.612	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	31.3	178.3	-56.7	-154.5	21.8	0	0	113.8	L648 H649 H650 R790	L648-Q652 PolarHBondContact O-N 3.2Å; L648-Q652 VanDerWaalsContact O-N 3.15Å; H649-Q652 PolarHBondContact O-N 2.64Å; H650-Q652 WeakPolarHBondContact O-CG 3.42Å; H650-Q652 PolarHBondContact O-N 2.98Å; Q652-R790 VanDerWaalsContact CD-NH2 3.25Å; Q652-R790 PolarHBondContact O-NH1 2.91Å
653	V	82.8	Confident	84.8	Confident	12 Å²	12	24.2 Å²	24.2	7%	0.073	13%	0.126	C	C	.	.			trans	-102.5	148.6	-178.7	174.4	0	0	0	0	111	V573 L648 E651 F869	V573-V653 HydrophobicContact CG2-CG2 4.34Å; L648-V653 HydrophobicContact CD2-CB 4.03Å; L648-V653 HydrophobicContact CD2-CG1 3.83Å; L648-V653 PolarHBondContact O-N 2.73Å; E651-V653 HydrophobicContact CB-CG2 4.22Å; E651-V653 PolarHBondContact O-N 3.24Å; V653-F869 HydrophobicContact CG1-CD1 3.52Å; V653-F869 HydrophobicContact CG1-CE1 3.58Å
654	N	89.4	Confident	84.8	Confident	20 Å²	20	24.2 Å²	24.2	11%	0.107	13%	0.13	C	C	.	.			trans	-99.8	144.9	174	-70.5	-24.9	0	0	0	110	R790 R791 V813	N654-R790 VanDerWaalsContact OD1-CA 3.29Å; N654-R790 WeakPolarHBondContact OD1-CA 3.45Å; N654-R791 HydrophobicContact CB-CB 4.39Å; N654-R791 VanDerWaalsContact CB-O 3.31Å; N654-R791 WeakPolarHBondContact CB-O 3.44Å; N654-R791 PolarHBondContact OD1-N 2.52Å; N654-V813 VanDerWaalsContact C-CG1 3.5Å; N654-V813 HydrophobicContact CB-CG1 3.52Å; N654-V813 VanDerWaalsContact CB-O 3.32Å; N654-V813 WeakPolarHBondContact CB-O 3.39Å; N654-V813 PolarHBondContact ND2-O 3.39Å; N654-V813 WeakPolarHBondContact O-CG1 3.32Å
655	G	86.8	Confident	85.1	Confident	3 Å²	3	24.5 Å²	24.5	3%	0.031	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	167.9	-168.8	0	0	0	0	0	116	R791 L793	G655-R791 PolarHBondContact N-O 3.03Å; G655-L793 PolarHBondContact O-N 3.47Å
656	I	89.8	Confident	85.2	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.3	176	-49.7	-179.8	0	0	0	108.9	W644 A658 L793 T795 L809 V813 F869 C870 L871	W644-I656 WeakPolarHBondContact CH2-O 3.34Å; I656-A658 HydrophobicContact CG2-CB 4.19Å; I656-A658 PolarHBondContact O-N 2.97Å; I656-L793 CarbonylContact C-O 3.53Å; I656-L793 WeakPolarHBondContact CA-O 3.21Å; I656-L793 HydrophobicContact CB-CB 4.46Å; I656-L793 HydrophobicContact CG1-CB 4.25Å; I656-L793 HydrophobicContact CG1-CD1 4.37Å; I656-L793 HydrophobicContact CG2-CB 4.17Å; I656-T795 HydrophobicContact CG2-CG2 4.21Å; I656-L809 HydrophobicContact CD1-CB 4.39Å; I656-V813 HydrophobicContact CD1-CG2 4.06Å; I656-V813 HydrophobicContact CG1-CG2 3.76Å; I656-F869 PolarHBondContact N-O 2.99Å; I656-C870 HydrophobicContact CB-CB 4.4Å; I656-C870 WeakPolarHBondContact O-CA 3.38Å; I656-L871 PolarHBondContact O-N 3.19Å; I656-L871 VanDerWaalsContact O-N 3.09Å
657	L	91.2	Very high	85.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	100.4	168	-171.7	63.6	0	0	0	108.7	W644 K665 Q668 L793 L794 T795 L871	W644-L657 HydrophobicContact CZ3-CD1 4.5Å; L657-K665 HydrophobicContact CD2-CB 4.12Å; L657-K665 HydrophobicContact CD2-CG 3.9Å; L657-K665 HydrophobicContact CG-CD 4.28Å; L657-K665 HydrophobicContact CG-CG 4.1Å; L657-K665 WeakPolarHBondContact O-CD 3.41Å; L657-Q668 HydrophobicContact CD2-CB 4.09Å; L657-L793 PolarHBondContact N-O 3.22Å; L657-L794 HydrophobicContact CB-CD2 3.83Å; L657-L794 HydrophobicContact CD2-CD2 4.14Å; L657-T795 PolarHBondContact O-N 3.16Å; L657-L871 HydrophobicContact CD1-CB 4.22Å; L657-L871 HydrophobicContact CD1-CD2 3.95Å; L657-L871 HydrophobicContact CD1-CG 4.22Å
658	A	87.7	Confident	85.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.132	C	C	.	.			trans	-108.5	24.7	-173.9	0	0	0	0	0	113	I656 T795 P798 C870 L871 R872	I656-A658 HydrophobicContact CG2-CB 4.19Å; I656-A658 PolarHBondContact O-N 2.97Å; A658-T795 HydrophobicContact CB-CG2 3.92Å; A658-P798 HydrophobicContact CB-CB 4.04Å; A658-P798 HydrophobicContact CB-CG 4.13Å; A658-C870 VanDerWaalsContact CB-SG 3.54Å; A658-L871 CarbonylContact C-O 3.54Å; A658-L871 WeakPolarHBondContact CA-O 3.43Å; A658-L871 PolarHBondContact N-O 3.17Å; A658-R872 HydrophobicContact CB-CB 4.24Å; A658-R872 WeakPolarHBondContact O-CG 3.42Å
659	D	87	Confident	86.3	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-46.9	152	167.5	-78	-17.2	0	0	0	112.2	L663 K665 Q668 L871 R873	D659-L663 HydrophobicContact CB-CB 4.11Å; D659-L663 HydrophobicContact CB-CD1 4.05Å; D659-K665 HydrophobicContact CB-CD 4.04Å; D659-K665 HydrophobicContact CB-CG 3.81Å; D659-K665 PolarHBondContact O-NZ 3.16Å; D659-Q668 PolarHBondContact OD2-NE2 2.76Å; D659-L871 PolarHBondContact N-O 3.22Å; D659-R873 VanDerWaalsContact CG-NH2 3.33Å; D659-R873 WeakPolarHBondContact OD1-CB 3.35Å; D659-R873 IonicContact OD1-CZ 2.66Å; D659-R873 PolarHBondContact OD1-N 2.88Å; D659-R873 IonicContact OD1-NE 3.77Å; D659-R873 PolarHBondContact OD1-NE 2.9Å; D659-R873 IonicContact OD1-NH2 3.01Å; D659-R873 PolarHBondContact OD1-NH2 3.23Å; D659-R873 VanDerWaalsContact OD1-NH2 3.16Å; D659-R873 IonicContact OD2-CZ 2.72Å; D659-R873 IonicContact OD2-NE 3.77Å; D659-R873 IonicContact OD2-NH2 3.99Å; D659-R873 PolarHBondContact OD2-NH2 3.03Å
660	E	80.4	Confident	86.7	Confident	17 Å²	17	21.5 Å²	21.5	8%	0.079	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-59.1	163.3	172.2	-169.9	162.8	-162.5	0	0	112.9	L663 K665 R873 L874 K875 R1172	E660-L663 HydrophobicContact CB-CD1 4.13Å; E660-L663 HydrophobicContact CB-CG 4.48Å; E660-K665 PolarHBondContact O-NZ 3.35Å; E660-R873 PolarHBondContact N-O 3.01Å; E660-L874 HydrophobicContact CB-CD2 4.43Å; E660-L874 WeakPolarHBondContact OE2-CA 3.49Å; E660-K875 HydrophobicContact CG-CD 4.4Å; E660-K875 HydrophobicContact CG-CG 4.11Å; E660-K875 WeakPolarHBondContact OE2-CG 3.32Å; E660-K875 PolarHBondContact OE2-N 2.75Å; E660-R1172 IonicContact OE1-CZ 3.34Å; E660-R1172 IonicContact OE1-NE 2.64Å; E660-R1172 IonicContact OE1-NH2 3.77Å; E660-R1172 PolarHBondContact OE1-NH2 3.41Å
661	M	80.4	Confident	87.1	Confident	21 Å²	21	17.7 Å²	17.7	10%	0.103	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	141	174.5	-58.5	-151.4	76	0	0	110.7	E768 K875 Q1173 D1176	M661-E768 WeakPolarHBondContact CE-OE1 3.28Å; M661-K875 WeakPolarHBondContact O-CE 3.49Å; M661-Q1173 HydrophobicContact CE-CG 4.15Å; M661-Q1173 HydrophobicContact SD-CB 3.97Å; M661-Q1173 HydrophobicContact SD-CG 3.82Å; M661-D1176 HydrophobicContact CB-CB 4.38Å
662	G	76.8	Confident	87.7	Confident	43 Å²	43	15.9 Å²	15.9	44%	0.443	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-16.9	-178	0	0	0	0	0	116.2	G664	G662-G664 PolarHBondContact O-N 3.31Å
663	L	82.6	Confident	88.1	Confident	1 Å²	1	9.7 Å²	9.7	1%	0.005	7%	0.068	C	C	.	.	S	Bend	trans	-72.9	18.8	178.4	-67.6	-175.7	0	0	0	115.3	Y637 D659 E660 K665 Q668 R873 V878 L879	Y637-L663 HydrophobicContact CE2-CB 4.01Å; Y637-L663 HydrophobicContact CE2-CD2 4.09Å; Y637-L663 WeakPolarHBondContact CE2-O 3.33Å; Y637-L663 PolarHBondContact OH-O 3.45Å; D659-L663 HydrophobicContact CB-CB 4.11Å; D659-L663 HydrophobicContact CB-CD1 4.05Å; E660-L663 HydrophobicContact CB-CD1 4.13Å; E660-L663 HydrophobicContact CB-CG 4.48Å; L663-K665 PolarHBondContact O-N 2.84Å; L663-Q668 PolarHBondContact O-NE2 2.88Å; L663-Q668 VanDerWaalsContact O-NE2 3.13Å; L663-R873 HydrophobicContact CD1-CB 4.23Å; L663-R873 VanDerWaalsContact CD1-O 3.28Å; L663-R873 WeakPolarHBondContact CD1-O 3.33Å; L663-V878 HydrophobicContact CD2-CB 4.2Å; L663-V878 HydrophobicContact CD2-CG1 3.95Å; L663-L879 HydrophobicContact CD2-CD1 3.69Å; L663-L879 HydrophobicContact CD2-CG 4.07Å
664	G	84.7	Confident	88.5	Confident	20 Å²	20	9.1 Å²	9.1	21%	0.206	6%	0.064	C	C	.	.			trans	64.3	35.3	172.9	0	0	0	0	0	115.6	G662 T666 V667 Q668	G662-G664 PolarHBondContact O-N 3.31Å; G664-T666 PolarHBondContact O-N 3.08Å; G664-T666 VanDerWaalsContact O-N 3.17Å; G664-V667 WeakPolarHBondContact O-CA 3.41Å; G664-V667 WeakPolarHBondContact O-CB 3.48Å; G664-V667 PolarHBondContact O-N 2.91Å; G664-Q668 PolarHBondContact O-N 3.16Å
665	K	90.3	Very high	88.5	Confident	18 Å²	18	8.3 Å²	8.3	8%	0.078	6%	0.06	C	C	.	.	H	α-helix	trans	-49.4	-39.4	175.4	-72.9	-172.2	-74.2	-84.1	0	113.3	L657 D659 E660 L663 Q668 A669 T795	L657-K665 HydrophobicContact CD2-CB 4.12Å; L657-K665 HydrophobicContact CD2-CG 3.9Å; L657-K665 HydrophobicContact CG-CD 4.28Å; L657-K665 HydrophobicContact CG-CG 4.1Å; L657-K665 WeakPolarHBondContact O-CD 3.41Å; D659-K665 HydrophobicContact CB-CD 4.04Å; D659-K665 HydrophobicContact CB-CG 3.81Å; D659-K665 PolarHBondContact O-NZ 3.16Å; E660-K665 PolarHBondContact O-NZ 3.35Å; L663-K665 PolarHBondContact O-N 2.84Å; K665-Q668 PolarHBondContact O-N 3.22Å; K665-A669 WeakPolarHBondContact O-CB 3.41Å; K665-A669 PolarHBondContact O-N 2.79Å; K665-T795 WeakPolarHBondContact CD-O 3.37Å; K665-T795 VanDerWaalsContact CE-C 3.48Å; K665-T795 WeakPolarHBondContact CE-O 3.32Å; K665-T795 PolarHBondContact NZ-O 3.08Å; K665-T795 VanDerWaalsContact NZ-O 3.13Å
666	T	91.9	Very high	88.6	Confident	28 Å²	28	8.3 Å²	8.3	17%	0.172	6%	0.059	C	C	.	.	H	α-helix	trans	-57.9	-46.7	173.6	-52.5	0	0	0	0	111.9	G664 A669 I670 W697 E700	G664-T666 PolarHBondContact O-N 3.08Å; G664-T666 VanDerWaalsContact O-N 3.17Å; T666-A669 PolarHBondContact O-N 2.82Å; T666-I670 HydrophobicContact CG2-CD1 3.99Å; T666-I670 VanDerWaalsContact O-CG1 3.27Å; T666-I670 WeakPolarHBondContact O-CG1 3.29Å; T666-I670 PolarHBondContact O-N 2.88Å; T666-W697 HydrophobicContact CG2-CD2 3.89Å; T666-W697 HydrophobicContact CG2-CE3 3.79Å; T666-W697 HydrophobicContact CG2-CH2 3.93Å; T666-W697 HydrophobicContact CG2-CZ2 4Å; T666-W697 HydrophobicContact CG2-CZ3 3.82Å; T666-E700 HydrophobicContact CG2-CB 4.14Å; T666-E700 HydrophobicContact CG2-CG 4.26Å
667	V	91.2	Very high	88.5	Confident	14 Å²	14	11.4 Å²	11.4	9%	0.085	7%	0.071	C	C	.	.	H	α-helix	trans	-65.3	-43.9	178.5	-178	0	0	0	0	110.8	L634 G664 A669 I670 A671 W704	L634-V667 HydrophobicContact CD2-CG1 3.55Å; G664-V667 WeakPolarHBondContact O-CA 3.41Å; G664-V667 WeakPolarHBondContact O-CB 3.48Å; G664-V667 PolarHBondContact O-N 2.91Å; V667-A669 VanDerWaalsContact C-N 3.31Å; V667-A669 PolarHBondContact O-N 3.05Å; V667-I670 PolarHBondContact O-N 3.44Å; V667-A671 WeakPolarHBondContact O-CB 3.47Å; V667-A671 PolarHBondContact O-N 3.38Å; V667-W704 HydrophobicContact CB-CZ2 4.38Å; V667-W704 HydrophobicContact CG1-CD2 3.94Å; V667-W704 HydrophobicContact CG1-CE3 3.97Å; V667-W704 HydrophobicContact CG1-CH2 3.63Å; V667-W704 HydrophobicContact CG1-CZ2 3.59Å; V667-W704 HydrophobicContact CG1-CZ3 3.82Å; V667-W704 HydrophobicContact CG2-CZ2 3.8Å
668	Q	92	Very high	88.3	Confident	1 Å²	1	15.1 Å²	15.1	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-60	-40.1	175.3	-66.7	179.4	65.2	0	0	112.1	Q638 L657 D659 L663 G664 K665 F672	Q638-Q668 HydrophobicContact CB-CG 3.82Å; Q638-Q668 HydrophobicContact CG-CG 4Å; L657-Q668 HydrophobicContact CD2-CB 4.09Å; D659-Q668 PolarHBondContact OD2-NE2 2.76Å; L663-Q668 PolarHBondContact O-NE2 2.88Å; L663-Q668 VanDerWaalsContact O-NE2 3.13Å; G664-Q668 PolarHBondContact O-N 3.16Å; K665-Q668 PolarHBondContact O-N 3.22Å; Q668-F672 WeakPolarHBondContact O-CB 3.06Å; Q668-F672 PolarHBondContact O-N 3.15Å
669	A	94.3	Very high	88.1	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-69.1	-36	175.9	0	0	0	0	0	113.2	K665 T666 V667 L673 W697 I765 L794	K665-A669 WeakPolarHBondContact O-CB 3.41Å; K665-A669 PolarHBondContact O-N 2.79Å; T666-A669 PolarHBondContact O-N 2.82Å; V667-A669 VanDerWaalsContact C-N 3.31Å; V667-A669 PolarHBondContact O-N 3.05Å; A669-L673 WeakPolarHBondContact O-CG 3.1Å; A669-L673 PolarHBondContact O-N 3.27Å; A669-W697 HydrophobicContact CB-CH2 3.92Å; A669-W697 HydrophobicContact CB-CZ3 4.38Å; A669-I765 HydrophobicContact CB-CD1 4.26Å; A669-L794 HydrophobicContact CB-CD1 4.07Å
670	I	93.8	Very high	87.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.6	-45.5	174.6	-66.6	166.6	0	0	0	110.5	L628 T666 V667 F672 L673 A674 W697 E700 L701 W704 C705	L628-I670 HydrophobicContact CD2-CG2 4.29Å; T666-I670 HydrophobicContact CG2-CD1 3.99Å; T666-I670 VanDerWaalsContact O-CG1 3.27Å; T666-I670 WeakPolarHBondContact O-CG1 3.29Å; T666-I670 PolarHBondContact O-N 2.88Å; V667-I670 PolarHBondContact O-N 3.44Å; I670-F672 VanDerWaalsContact C-N 3.25Å; I670-F672 PolarHBondContact O-N 2.86Å; I670-L673 PolarHBondContact O-N 3Å; I670-L673 VanDerWaalsContact O-N 3.15Å; I670-A674 PolarHBondContact O-N 2.69Å; I670-W697 HydrophobicContact CG1-CZ3 4.28Å; I670-E700 HydrophobicContact CD1-CB 3.75Å; I670-L701 HydrophobicContact CD1-CD2 4.17Å; I670-L701 HydrophobicContact CD1-CG 4.14Å; I670-L701 HydrophobicContact CG1-CD2 3.82Å; I670-L701 HydrophobicContact CG1-CG 4.28Å; I670-L701 HydrophobicContact CG2-CD2 4.39Å; I670-W704 HydrophobicContact CG2-CB 4.01Å; I670-C705 HydrophobicContact CG2-CB 3.85Å
671	A	91.9	Very high	87.8	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-58.5	-38.5	174.1	0	0	0	0	0	112	L628 L634 L642 V667 A674 S675	L628-A671 HydrophobicContact CD1-CB 3.81Å; L634-A671 HydrophobicContact CD1-CB 3.85Å; L634-A671 HydrophobicContact CD2-CB 4.2Å; L642-A671 HydrophobicContact CD1-CB 4.24Å; L642-A671 HydrophobicContact CD2-CB 4.28Å; V667-A671 WeakPolarHBondContact O-CB 3.47Å; V667-A671 PolarHBondContact O-N 3.38Å; A671-A674 PolarHBondContact O-N 2.67Å; A671-S675 PolarHBondContact O-N 3.27Å
672	F	93.1	Very high	87.9	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-64	-47.4	173.7	176.5	-116.2	0	0	0	112.1	L642 L645 H649 Q668 I670 A674 S675 L676 Y763 L792	L642-F672 VanDerWaalsContact CD1-CA 3.45Å; L642-F672 HydrophobicContact CD1-CB 3.99Å; L642-F672 HydrophobicContact CD1-CD2 4.45Å; L645-F672 HydrophobicContact CB-CB 4.42Å; L645-F672 HydrophobicContact CB-CD2 3.5Å; L645-F672 VanDerWaalsContact CB-CD2 3.5Å; L645-F672 HydrophobicContact CB-CE2 3.79Å; L645-F672 HydrophobicContact CB-CG 3.9Å; L645-F672 HydrophobicContact CB-CZ 4.42Å; L645-F672 HydrophobicContact CD1-CB 3.87Å; L645-F672 HydrophobicContact CD1-CD1 4.45Å; L645-F672 HydrophobicContact CD1-CD2 4.45Å; L645-F672 HydrophobicContact CD1-CG 4.01Å; L645-F672 WeakPolarHBondContact O-CE2 3.44Å; H649-F672 HydrophobicContact CB-CE2 4.12Å; H649-F672 HydrophobicContact CB-CZ 4.09Å; Q668-F672 WeakPolarHBondContact O-CB 3.06Å; Q668-F672 PolarHBondContact O-N 3.15Å; I670-F672 VanDerWaalsContact C-N 3.25Å; I670-F672 PolarHBondContact O-N 2.86Å; F672-A674 VanDerWaalsContact C-N 3.31Å; F672-A674 PolarHBondContact O-N 2.87Å; F672-S675 PolarHBondContact O-N 3.42Å; F672-S675 PolarHBondContact O-OG 3.37Å; F672-L676 HydrophobicContact CD1-CD1 4.28Å; F672-L676 HydrophobicContact CE1-CD1 3.7Å; F672-L676 HydrophobicContact CE1-CG 4.32Å; F672-L676 HydrophobicContact CE2-CD1 4.34Å; F672-L676 HydrophobicContact CE2-CD2 4.11Å; F672-L676 HydrophobicContact CE2-CG 4.11Å; F672-L676 HydrophobicContact CZ-CD1 3.75Å; F672-L676 HydrophobicContact CZ-CD2 4.09Å; F672-L676 HydrophobicContact CZ-CG 4.01Å; F672-L676 WeakPolarHBondContact O-CG 3.49Å; F672-L676 PolarHBondContact O-N 2.97Å; F672-Y763 HydrophobicContact CE1-CD1 4Å; F672-Y763 HydrophobicContact CE1-CD2 4.5Å; F672-Y763 AromaticContact CE1-CE1 3.61Å; F672-Y763 HydrophobicContact CE1-CE1 3.61Å; F672-Y763 HydrophobicContact CE1-CE2 4.15Å; F672-Y763 HydrophobicContact CE1-CG 4.44Å; F672-Y763 AromaticContact CE1-CZ 3.71Å; F672-Y763 AromaticContact CZ-CE1 3.9Å; F672-Y763 HydrophobicContact CZ-CE1 3.9Å; F672-Y763 HydrophobicContact CZ-CE2 4.05Å; F672-Y763 AromaticContact CZ-CZ 3.56Å; F672-L792 HydrophobicContact CD1-CD2 4.37Å
673	L	93	Very high	88.2	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-61.3	-36.6	174.8	-71.3	170.8	0	0	0	112.8	A669 I670 L676 W677 H685 I687 I738 I765	A669-L673 WeakPolarHBondContact O-CG 3.1Å; A669-L673 PolarHBondContact O-N 3.27Å; I670-L673 PolarHBondContact O-N 3Å; I670-L673 VanDerWaalsContact O-N 3.15Å; L673-L676 HydrophobicContact CD2-CD1 4.44Å; L673-L676 PolarHBondContact O-N 2.95Å; L673-W677 PolarHBondContact O-N 3.03Å; L673-H685 HydrophobicContact CD2-CB 4.09Å; L673-I687 HydrophobicContact CD1-CD1 4.04Å; L673-I738 HydrophobicContact CD1-CD1 3.85Å; L673-I738 HydrophobicContact CD1-CG1 4.48Å; L673-I765 HydrophobicContact CD1-CD1 3.75Å; L673-I765 HydrophobicContact CD2-CD1 4.21Å; L673-I765 HydrophobicContact CG-CD1 3.99Å
674	A	90.7	Very high	88.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-47	172.3	0	0	0	0	0	111.5	P625 L628 I670 A671 F672 L676 W677 E678	P625-A674 HydrophobicContact CB-CB 4.15Å; L628-A674 HydrophobicContact CD2-CB 3.99Å; L628-A674 HydrophobicContact CG-CB 4.2Å; I670-A674 PolarHBondContact O-N 2.69Å; A671-A674 PolarHBondContact O-N 2.67Å; F672-A674 VanDerWaalsContact C-N 3.31Å; F672-A674 PolarHBondContact O-N 2.87Å; A674-L676 VanDerWaalsContact C-N 3.28Å; A674-L676 PolarHBondContact O-N 2.79Å; A674-W677 WeakPolarHBondContact O-CB 3.1Å; A674-W677 PolarHBondContact O-N 3.09Å; A674-W677 VanDerWaalsContact O-N 3.08Å; A674-E678 PolarHBondContact O-N 3.16Å
675	S	88.3	Confident	89	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-30.9	176.7	75.9	0	0	0	0	113.5	A671 F672 S679	A671-S675 PolarHBondContact O-N 3.27Å; F672-S675 PolarHBondContact O-N 3.42Å; F672-S675 PolarHBondContact O-OG 3.37Å; S675-S679 VanDerWaalsContact O-CB 3.29Å; S675-S679 WeakPolarHBondContact O-CB 3.41Å; S675-S679 PolarHBondContact O-N 3.37Å; S675-S679 PolarHBondContact O-OG 2.86Å
676	L	89.6	Confident	89.2	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-69	-40.9	171.9	-71	-177.2	0	0	0	111.8	H649 F672 L673 A674 S679 G680 N681 Y763	H649-L676 VanDerWaalsContact CE1-CD2 3.44Å; H649-L676 WeakPolarHBondContact CE1-CD2 3.43Å; F672-L676 HydrophobicContact CD1-CD1 4.28Å; F672-L676 HydrophobicContact CE1-CD1 3.7Å; F672-L676 HydrophobicContact CE1-CG 4.32Å; F672-L676 HydrophobicContact CE2-CD1 4.34Å; F672-L676 HydrophobicContact CE2-CD2 4.11Å; F672-L676 HydrophobicContact CE2-CG 4.11Å; F672-L676 HydrophobicContact CZ-CD1 3.75Å; F672-L676 HydrophobicContact CZ-CD2 4.09Å; F672-L676 HydrophobicContact CZ-CG 4.01Å; F672-L676 WeakPolarHBondContact O-CG 3.49Å; F672-L676 PolarHBondContact O-N 2.97Å; L673-L676 HydrophobicContact CD2-CD1 4.44Å; L673-L676 PolarHBondContact O-N 2.95Å; A674-L676 VanDerWaalsContact C-N 3.28Å; A674-L676 PolarHBondContact O-N 2.79Å; L676-S679 CarbonylContact O-C 3.43Å; L676-S679 PolarHBondContact O-N 3.37Å; L676-G680 PolarHBondContact O-N 3.02Å; L676-N681 CarbonylContact C-O 3.53Å; L676-N681 HydrophobicContact CB-CB 4.28Å; L676-N681 WeakPolarHBondContact O-CA 3.34Å; L676-N681 WeakPolarHBondContact O-CB 3.42Å; L676-N681 PolarHBondContact O-N 2.88Å; L676-Y763 HydrophobicContact CD1-CD2 3.62Å; L676-Y763 HydrophobicContact CD1-CE2 3.64Å; L676-Y763 HydrophobicContact CD1-CG 4.42Å
677	W	88.7	Confident	89.4	Confident	68 Å²	68	23.1 Å²	23.1	26%	0.258	13%	0.132	S	C	.	.	H	α-helix	trans	-60.8	-47.7	175.4	-165.6	110.3	0	0	0	110.6	I627 L673 A674 S679 G680 R682 L708	I627-W677 HydrophobicContact CD1-CD2 3.74Å; I627-W677 HydrophobicContact CD1-CE3 3.01Å; I627-W677 HydrophobicContact CD1-CG 4.49Å; I627-W677 HydrophobicContact CD1-CH2 4.14Å; I627-W677 HydrophobicContact CD1-CZ3 3.24Å; L673-W677 PolarHBondContact O-N 3.03Å; A674-W677 WeakPolarHBondContact O-CB 3.1Å; A674-W677 PolarHBondContact O-N 3.09Å; A674-W677 VanDerWaalsContact O-N 3.08Å; W677-S679 VanDerWaalsContact C-N 3.32Å; W677-S679 PolarHBondContact O-N 2.65Å; W677-G680 PolarHBondContact O-N 3.48Å; W677-G680 VanDerWaalsContact O-N 3.17Å; W677-R682 VanDerWaalsContact CD1-CD 3.42Å; W677-R682 VanDerWaalsContact CD2-CD 3.5Å; W677-R682 VanDerWaalsContact CE3-CZ 3.49Å; W677-R682 VanDerWaalsContact CG-CD 3.48Å; W677-R682 PolarHBondContact O-NH1 3.34Å; W677-R682 PolarHBondContact O-NH2 2.88Å; W677-L708 HydrophobicContact CG-CD2 4.19Å
678	E	85.6	Confident	89.6	Confident	78 Å²	78	22.5 Å²	22.5	36%	0.364	13%	0.128	S	C	.	.	H	α-helix	trans	-57.5	-44.8	173.9	-68.9	173.4	176.2	0	0	111.3	P625 A626 I627 A674 G680	P625-E678 VanDerWaalsContact C-OE1 3.22Å; P625-E678 WeakPolarHBondContact CA-OE1 3.37Å; P625-E678 WeakPolarHBondContact CB-OE1 3.49Å; P625-E678 WeakPolarHBondContact CB-OE2 3.38Å; A626-E678 PolarHBondContact N-OE1 2.9Å; I627-E678 HydrophobicContact CB-CG 4.5Å; I627-E678 HydrophobicContact CD1-CG 3.53Å; I627-E678 HydrophobicContact CG1-CG 3.9Å; I627-E678 WeakPolarHBondContact CG1-OE1 3.4Å; I627-E678 PolarHBondContact N-OE1 2.89Å; A674-E678 PolarHBondContact O-N 3.16Å; E678-G680 PolarHBondContact O-N 2.77Å
679	S	83.4	Confident	89.5	Confident	60 Å²	60	22.4 Å²	22.4	42%	0.42	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	4.8	178.5	-56.7	0	0	0	0	115.2	S675 L676 W677	S675-S679 VanDerWaalsContact O-CB 3.29Å; S675-S679 WeakPolarHBondContact O-CB 3.41Å; S675-S679 PolarHBondContact O-N 3.37Å; S675-S679 PolarHBondContact O-OG 2.86Å; L676-S679 CarbonylContact O-C 3.43Å; L676-S679 PolarHBondContact O-N 3.37Å; W677-S679 VanDerWaalsContact C-N 3.32Å; W677-S679 PolarHBondContact O-N 2.65Å
680	G	80.6	Confident	89.2	Confident	39 Å²	39	23.6 Å²	23.6	40%	0.402	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.6	-32.4	179.9	0	0	0	0	0	114.6	L676 W677 E678 R682	L676-G680 PolarHBondContact O-N 3.02Å; W677-G680 PolarHBondContact O-N 3.48Å; W677-G680 VanDerWaalsContact O-N 3.17Å; E678-G680 PolarHBondContact O-N 2.77Å; G680-R682 VanDerWaalsContact C-NH1 3.32Å; G680-R682 PolarHBondContact O-N 2.73Å; G680-R682 PolarHBondContact O-NH1 3.4Å
681	N	80.9	Confident	88.7	Confident	56 Å²	56	26.7 Å²	26.7	30%	0.299	16%	0.157	S	C	.	.			trans	-78.3	88	-169.5	-74.1	-28.1	0	0	0	112.3	H649 L676 G683 H685 H762	H649-N681 PolarHBondContact CE1-ND2 2.95Å; H649-N681 PolarHBondContact NE2-ND2 3.2Å; L676-N681 CarbonylContact C-O 3.53Å; L676-N681 HydrophobicContact CB-CB 4.28Å; L676-N681 WeakPolarHBondContact O-CA 3.34Å; L676-N681 WeakPolarHBondContact O-CB 3.42Å; L676-N681 PolarHBondContact O-N 2.88Å; N681-G683 VanDerWaalsContact C-N 3.31Å; N681-G683 PolarHBondContact O-N 3.05Å; N681-H685 PolarHBondContact O-NE2 3.22Å; N681-H762 PolarHBondContact ND2-CE1 2.8Å
682	R	82.5	Confident	87.9	Confident	103 Å²	103	29.4 Å²	29.4	39%	0.389	18%	0.176	S	C	.	.			trans	-77.1	-3.5	-177.8	-59.9	-49.9	-167.4	-78.3	21.7	115.9	W677 G680 N737	W677-R682 VanDerWaalsContact CD1-CD 3.42Å; W677-R682 VanDerWaalsContact CD2-CD 3.5Å; W677-R682 VanDerWaalsContact CE3-CZ 3.49Å; W677-R682 VanDerWaalsContact CG-CD 3.48Å; W677-R682 PolarHBondContact O-NH1 3.34Å; W677-R682 PolarHBondContact O-NH2 2.88Å; G680-R682 VanDerWaalsContact C-NH1 3.32Å; G680-R682 PolarHBondContact O-N 2.73Å; G680-R682 PolarHBondContact O-NH1 3.4Å; R682-N737 WeakPolarHBondContact O-CB 3.01Å; R682-N737 PolarHBondContact O-ND2 3.14Å
683	G	82.3	Confident	87.4	Confident	33 Å²	33	30.3 Å²	30.3	34%	0.34	18%	0.182	S	C	.	.			trans	107.6	-159	-178.2	0	0	0	0	0	113.7	N681 H685	N681-G683 VanDerWaalsContact C-N 3.31Å; N681-G683 PolarHBondContact O-N 3.05Å; G683-H685 VanDerWaalsContact CA-CD2 3.42Å; G683-H685 WeakPolarHBondContact CA-CD2 3.49Å; G683-H685 VanDerWaalsContact CA-NE2 3.34Å; G683-H685 WeakPolarHBondContact CA-NE2 2.94Å; G683-H685 PolarHBondContact N-NE2 2.87Å
684	P	91.3	Very high	87.1	Confident	21 Å²	21	30.4 Å²	30.4	14%	0.136	18%	0.182	C	C	.	.			cis	-71.4	143.1	2.3	30.3	-36.1	0	0	0	112.6	P734 F736 I759 F761 H762	P684-P734 HydrophobicContact CB-CG 3.95Å; P684-P734 HydrophobicContact CG-CG 3.96Å; P684-F736 HydrophobicContact CB-CD2 4.48Å; P684-F736 HydrophobicContact CB-CE2 3.92Å; P684-I759 HydrophobicContact CG-CG2 3.97Å; P684-F761 HydrophobicContact CB-CD1 4.13Å; P684-F761 HydrophobicContact CB-CE1 4.49Å; P684-F761 HydrophobicContact CG-CD1 4.37Å; P684-F761 CarbonylContact O-C 3.54Å; P684-F761 WeakPolarHBondContact O-CA 3.32Å; P684-H762 PolarHBondContact O-N 2.81Å
685	H	94.2	Very high	86.7	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	153.1	172.7	-52.3	-81.3	0	0	0	110.4	L673 N681 G683 N737 I738 L739 H762 Y763	L673-H685 HydrophobicContact CD2-CB 4.09Å; N681-H685 PolarHBondContact O-NE2 3.22Å; G683-H685 VanDerWaalsContact CA-CD2 3.42Å; G683-H685 WeakPolarHBondContact CA-CD2 3.49Å; G683-H685 VanDerWaalsContact CA-NE2 3.34Å; G683-H685 WeakPolarHBondContact CA-NE2 2.94Å; G683-H685 PolarHBondContact N-NE2 2.87Å; H685-N737 PolarHBondContact CD2-O 3.3Å; H685-N737 PolarHBondContact N-O 3.37Å; H685-I738 HydrophobicContact CB-CG1 4.36Å; H685-I738 WeakPolarHBondContact O-CA 3.26Å; H685-L739 PolarHBondContact O-N 3.44Å; H685-H762 AromaticContact CE1-ND1 3.83Å; H685-Y763 CarbonylContact C-O 3.37Å; H685-Y763 WeakPolarHBondContact CA-O 3.47Å
686	L	94.6	Very high	86.6	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.2	178.3	178.2	62.6	0	0	0	109.4	I688 L739 T741 M756 F761 Y763 G764 I765 F786 V788	L686-I688 HydrophobicContact CD1-CG1 4.18Å; L686-I688 HydrophobicContact CD2-CD1 3.99Å; L686-I688 HydrophobicContact CD2-CG1 4.13Å; L686-I688 HydrophobicContact CG-CD1 4.32Å; L686-I688 HydrophobicContact CG-CG1 3.89Å; L686-L739 HydrophobicContact CD1-CB 4.2Å; L686-L739 HydrophobicContact CD1-CD2 4.18Å; L686-L739 HydrophobicContact CD1-CG 4.38Å; L686-T741 HydrophobicContact CD1-CG2 4.23Å; L686-M756 HydrophobicContact CD1-CE 4.39Å; L686-M756 HydrophobicContact CD1-SD 4.01Å; L686-M756 HydrophobicContact CD2-SD 4.39Å; L686-F761 HydrophobicContact CB-CB 4.26Å; L686-F761 HydrophobicContact CB-CD1 3.67Å; L686-F761 HydrophobicContact CB-CD2 4.19Å; L686-F761 HydrophobicContact CB-CE1 3.93Å; L686-F761 HydrophobicContact CB-CE2 4.43Å; L686-F761 HydrophobicContact CB-CG 3.79Å; L686-F761 HydrophobicContact CB-CZ 4.31Å; L686-F761 HydrophobicContact CD1-CE1 4.34Å; L686-F761 HydrophobicContact CD1-CZ 4.17Å; L686-F761 HydrophobicContact CD2-CD2 4.04Å; L686-F761 HydrophobicContact CD2-CE2 3.99Å; L686-F761 HydrophobicContact CD2-CG 4.47Å; L686-F761 HydrophobicContact CD2-CZ 4.38Å; L686-Y763 PolarHBondContact N-O 3.08Å; L686-G764 CarbonylContact O-C 3.56Å; L686-G764 WeakPolarHBondContact O-CA 3.31Å; L686-I765 PolarHBondContact O-N 3.42Å; L686-F786 HydrophobicContact CD2-CD2 3.85Å; L686-F786 HydrophobicContact CD2-CE2 4.3Å; L686-V788 HydrophobicContact CD2-CG2 4.32Å
687	I	95.8	Very high	86.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.2	169.8	-57.3	178.5	0	0	0	107.9	L673 W697 L701 I738 L739 L740 T741 I765	L673-I687 HydrophobicContact CD1-CD1 4.04Å; I687-W697 HydrophobicContact CD1-CE3 4.03Å; I687-W697 HydrophobicContact CD1-CZ3 4.03Å; I687-W697 HydrophobicContact CG2-CD2 4.11Å; I687-W697 HydrophobicContact CG2-CE3 4.07Å; I687-W697 HydrophobicContact CG2-CZ3 4.3Å; I687-L701 HydrophobicContact CD1-CD1 4.19Å; I687-I738 HydrophobicContact CD1-CD1 4.43Å; I687-I738 HydrophobicContact CD1-CG2 3.68Å; I687-I738 HydrophobicContact CG1-CG2 3.95Å; I687-L739 PolarHBondContact N-O 2.89Å; I687-L740 HydrophobicContact CB-CD1 3.89Å; I687-L740 HydrophobicContact CG2-CD1 3.71Å; I687-T741 PolarHBondContact O-N 3.38Å; I687-I765 WeakPolarHBondContact CA-O 3.49Å; I687-I765 HydrophobicContact CG1-CB 4.35Å
688	I	94.2	Very high	86.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.8	173.2	-47.5	-171.1	0	0	0	109.1	L686 T741 Y743 I765 F766 D767 L783 F786	L686-I688 HydrophobicContact CD1-CG1 4.18Å; L686-I688 HydrophobicContact CD2-CD1 3.99Å; L686-I688 HydrophobicContact CD2-CG1 4.13Å; L686-I688 HydrophobicContact CG-CD1 4.32Å; L686-I688 HydrophobicContact CG-CG1 3.89Å; I688-T741 WeakPolarHBondContact CA-O 3.49Å; I688-T741 HydrophobicContact CG1-CG2 4.18Å; I688-Y743 HydrophobicContact CB-CE1 4.43Å; I688-Y743 HydrophobicContact CG2-CD1 3.5Å; I688-Y743 VanDerWaalsContact CG2-CD1 3.5Å; I688-Y743 HydrophobicContact CG2-CD2 4.28Å; I688-Y743 HydrophobicContact CG2-CE1 3.73Å; I688-Y743 HydrophobicContact CG2-CE2 4.47Å; I688-Y743 HydrophobicContact CG2-CG 3.8Å; I688-I765 PolarHBondContact N-O 2.86Å; I688-F766 HydrophobicContact CB-CD1 4.21Å; I688-F766 HydrophobicContact CD1-CD1 4.01Å; I688-F766 HydrophobicContact CD1-CE1 3.65Å; I688-F766 HydrophobicContact CG1-CD1 4.3Å; I688-F766 HydrophobicContact CG1-CE1 4.28Å; I688-D767 PolarHBondContact O-N 2.77Å; I688-L783 HydrophobicContact CD1-CD2 3.54Å; I688-F786 HydrophobicContact CD1-CD2 4.23Å; I688-F786 HydrophobicContact CD1-CE2 3.82Å
689	C	91.8	Very high	86.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	171.5	179.5	63.2	0	0	0	0	112	T741 S742 Y743 D767	C689-T741 PolarHBondContact N-O 2.82Å; C689-T741 VanDerWaalsContact N-O 3.14Å; C689-S742 WeakPolarHBondContact O-CA 3.42Å; C689-S742 WeakPolarHBondContact O-CB 3.47Å; C689-Y743 WeakPolarHBondContact O-CD2 3.29Å; C689-Y743 PolarHBondContact O-N 2.99Å; C689-Y743 VanDerWaalsContact O-N 3.09Å; C689-D767 HydrophobicContact CB-CB 3.97Å
690	P	86.8	Confident	87.1	Confident	25 Å²	25	37.6 Å²	37.6	16%	0.162	21%	0.21	C	C	.	.			trans	-56.5	141.7	159.5	-24.6	33.9	0	0	0	111.7	S692 T693 Q694 E768	P690-S692 PolarHBondContact O-N 2.88Å; P690-S692 VanDerWaalsContact O-N 3.1Å; P690-T693 VanDerWaalsContact CD-OG1 3.28Å; P690-T693 WeakPolarHBondContact CD-OG1 3.36Å; P690-T693 PolarHBondContact O-N 2.84Å; P690-T693 PolarHBondContact O-OG1 2.85Å; P690-Q694 PolarHBondContact O-N 3.05Å; P690-E768 HydrophobicContact CG-CB 3.79Å; P690-E768 HydrophobicContact CG-CG 4.08Å
691	S	83.3	Confident	87.6	Confident	64 Å²	64	35.9 Å²	35.9	45%	0.448	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.1	177.8	-49.5	0	0	0	0	113	T693 S742	S691-T693 VanDerWaalsContact C-N 3.33Å; S691-S742 WeakPolarHBondContact OG-CB 3.32Å; S691-S742 PolarHBondContact OG-OG 2.75Å; S691-S742 VanDerWaalsContact OG-OG 3.12Å
692	S	76.1	Confident	88.1	Confident	58 Å²	58	36.6 Å²	36.6	41%	0.406	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.3	177.7	50.1	0	0	0	0	115.3	P690 L1149	P690-S692 PolarHBondContact O-N 2.88Å; P690-S692 VanDerWaalsContact O-N 3.1Å; S692-L1149 VanDerWaalsContact CB-CD2 3.41Å
693	T	82.5	Confident	88.3	Confident	22 Å²	22	34.9 Å²	34.9	14%	0.135	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-5.1	176	47	0	0	0	0	112.3	P690 S691 D695 N696 W697	P690-T693 VanDerWaalsContact CD-OG1 3.28Å; P690-T693 WeakPolarHBondContact CD-OG1 3.36Å; P690-T693 PolarHBondContact O-N 2.84Å; P690-T693 PolarHBondContact O-OG1 2.85Å; S691-T693 VanDerWaalsContact C-N 3.33Å; T693-D695 PolarHBondContact O-N 3.41Å; T693-N696 WeakPolarHBondContact O-CA 3.27Å; T693-N696 WeakPolarHBondContact O-CB 3.4Å; T693-N696 PolarHBondContact O-N 2.7Å; T693-N696 VanDerWaalsContact O-N 3.08Å; T693-W697 PolarHBondContact O-N 2.99Å
694	Q	86	Confident	88.6	Confident	3 Å²	3	34.5 Å²	34.5	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-44.6	-171.9	-170.3	173.2	-33.6	0	0	112.2	P690 N696 W697 Q698 V712 L740 S742	P690-Q694 PolarHBondContact O-N 3.05Å; Q694-N696 PolarHBondContact O-N 2.68Å; Q694-W697 PolarHBondContact O-N 2.78Å; Q694-Q698 PolarHBondContact O-N 3.08Å; Q694-V712 VanDerWaalsContact NE2-CG1 3.26Å; Q694-L740 HydrophobicContact CG-CD2 4.11Å; Q694-L740 HydrophobicContact CG-CG 4.07Å; Q694-S742 PolarHBondContact OE1-OG 3.12Å
695	D	82.7	Confident	88.5	Confident	78 Å²	78	33.5 Å²	33.5	42%	0.417	18%	0.182	S	C	.	.	H	α-helix	trans	-65.5	-30.6	175.5	-50.9	-52.3	0	0	0	111.7	T693 Q698 R699	T693-D695 PolarHBondContact O-N 3.41Å; D695-Q698 PolarHBondContact O-N 2.83Å; D695-R699 WeakPolarHBondContact O-CG 3.34Å; D695-R699 PolarHBondContact O-N 3.37Å
696	N	85.7	Confident	88.1	Confident	41 Å²	41	37.3 Å²	37.3	22%	0.219	21%	0.207	C	C	.	.	H	α-helix	trans	-70	-43	174.1	-157.9	80.7	0	0	0	111.9	T693 Q694 Q698 R699 E700	T693-N696 WeakPolarHBondContact O-CA 3.27Å; T693-N696 WeakPolarHBondContact O-CB 3.4Å; T693-N696 PolarHBondContact O-N 2.7Å; T693-N696 VanDerWaalsContact O-N 3.08Å; Q694-N696 PolarHBondContact O-N 2.68Å; N696-Q698 VanDerWaalsContact C-N 3.3Å; N696-Q698 PolarHBondContact O-N 2.93Å; N696-R699 PolarHBondContact O-N 3.47Å; N696-R699 PolarHBondContact OD1-NH2 3.32Å; N696-E700 WeakPolarHBondContact O-CG 3.18Å; N696-E700 PolarHBondContact O-N 3.46Å
697	W	90.8	Very high	87.6	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-58.8	-41.9	171.6	-85.6	95.5	0	0	0	111.6	T666 A669 I670 I687 T693 Q694 L701 L740 D767 L794	T666-W697 HydrophobicContact CG2-CD2 3.89Å; T666-W697 HydrophobicContact CG2-CE3 3.79Å; T666-W697 HydrophobicContact CG2-CH2 3.93Å; T666-W697 HydrophobicContact CG2-CZ2 4Å; T666-W697 HydrophobicContact CG2-CZ3 3.82Å; A669-W697 HydrophobicContact CB-CH2 3.92Å; A669-W697 HydrophobicContact CB-CZ3 4.38Å; I670-W697 HydrophobicContact CG1-CZ3 4.28Å; I687-W697 HydrophobicContact CD1-CE3 4.03Å; I687-W697 HydrophobicContact CD1-CZ3 4.03Å; I687-W697 HydrophobicContact CG2-CD2 4.11Å; I687-W697 HydrophobicContact CG2-CE3 4.07Å; I687-W697 HydrophobicContact CG2-CZ3 4.3Å; T693-W697 PolarHBondContact O-N 2.99Å; Q694-W697 PolarHBondContact O-N 2.78Å; W697-L701 VanDerWaalsContact O-CB 3.27Å; W697-L701 WeakPolarHBondContact O-CB 3.31Å; W697-L701 WeakPolarHBondContact O-CD1 3.35Å; W697-L701 VanDerWaalsContact O-CG 3.23Å; W697-L701 WeakPolarHBondContact O-CG 3.45Å; W697-L701 PolarHBondContact O-N 2.84Å; W697-L740 HydrophobicContact CB-CD1 3.96Å; W697-L740 HydrophobicContact CB-CD2 4.02Å; W697-L740 HydrophobicContact CG-CD1 4.42Å; W697-D767 HydrophobicContact CZ2-CB 4.01Å; W697-D767 PolarHBondContact NE1-OD2 3.11Å; W697-L794 HydrophobicContact CH2-CD1 3.73Å; W697-L794 HydrophobicContact CZ2-CD1 3.7Å
698	Q	90.2	Very high	87.2	Confident	85 Å²	85	44.2 Å²	44.2	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-62.8	-47.3	175.8	-176.2	177	-28.1	0	0	112.1	Q694 D695 N696 S702 V712 L740	Q694-Q698 PolarHBondContact O-N 3.08Å; D695-Q698 PolarHBondContact O-N 2.83Å; N696-Q698 VanDerWaalsContact C-N 3.3Å; N696-Q698 PolarHBondContact O-N 2.93Å; Q698-S702 PolarHBondContact O-N 2.75Å; Q698-S702 VanDerWaalsContact O-N 3.1Å; Q698-S702 PolarHBondContact O-OG 2.91Å; Q698-V712 HydrophobicContact CG-CG2 4.39Å; Q698-L740 HydrophobicContact CB-CD2 4.17Å
699	R	87.3	Confident	87	Confident	111 Å²	111	49.2 Å²	49.2	42%	0.419	26%	0.261	S	S	.	.	H	α-helix	trans	-58.5	-55.2	175.1	-72.8	-170.6	-54.7	-161.5	2	111.4	D695 N696 L701 S702 L703	D695-R699 WeakPolarHBondContact O-CG 3.34Å; D695-R699 PolarHBondContact O-N 3.37Å; N696-R699 PolarHBondContact O-N 3.47Å; N696-R699 PolarHBondContact OD1-NH2 3.32Å; R699-L701 VanDerWaalsContact C-N 3.34Å; R699-L701 PolarHBondContact O-N 2.97Å; R699-S702 PolarHBondContact O-N 3.06Å; R699-S702 VanDerWaalsContact O-N 3.13Å; R699-S702 PolarHBondContact O-OG 3.01Å; R699-L703 HydrophobicContact CB-CD1 4.45Å; R699-L703 WeakPolarHBondContact O-CB 3.35Å; R699-L703 VanDerWaalsContact O-CG 3.28Å; R699-L703 WeakPolarHBondContact O-CG 3.25Å; R699-L703 PolarHBondContact O-N 3.03Å
700	E	89.8	Confident	87	Confident	45 Å²	45	51.4 Å²	51.4	21%	0.21	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-39.7	-177.2	-63.4	-68	177.6	0	0	112.1	R632 T666 I670 N696 S702 L703 W704	R632-E700 IonicContact NH1-OE2 3.92Å; T666-E700 HydrophobicContact CG2-CB 4.14Å; T666-E700 HydrophobicContact CG2-CG 4.26Å; I670-E700 HydrophobicContact CD1-CB 3.75Å; N696-E700 WeakPolarHBondContact O-CG 3.18Å; N696-E700 PolarHBondContact O-N 3.46Å; E700-S702 PolarHBondContact O-N 3.06Å; E700-L703 PolarHBondContact O-N 2.89Å; E700-W704 WeakPolarHBondContact O-CB 3.34Å; E700-W704 VanDerWaalsContact O-CD1 3.29Å; E700-W704 PolarHBondContact O-N 2.83Å; E700-W704 PolarHBondContact OE2-NE1 3.2Å
701	L	91.7	Very high	87.2	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-46.7	173.6	-79.2	163.2	0	0	0	111.7	I670 I687 W697 R699 L703 C705 V710 I738	I670-L701 HydrophobicContact CD1-CD2 4.17Å; I670-L701 HydrophobicContact CD1-CG 4.14Å; I670-L701 HydrophobicContact CG1-CD2 3.82Å; I670-L701 HydrophobicContact CG1-CG 4.28Å; I670-L701 HydrophobicContact CG2-CD2 4.39Å; I687-L701 HydrophobicContact CD1-CD1 4.19Å; W697-L701 VanDerWaalsContact O-CB 3.27Å; W697-L701 WeakPolarHBondContact O-CB 3.31Å; W697-L701 WeakPolarHBondContact O-CD1 3.35Å; W697-L701 VanDerWaalsContact O-CG 3.23Å; W697-L701 WeakPolarHBondContact O-CG 3.45Å; W697-L701 PolarHBondContact O-N 2.84Å; R699-L701 VanDerWaalsContact C-N 3.34Å; R699-L701 PolarHBondContact O-N 2.97Å; L701-L703 PolarHBondContact O-N 3.44Å; L701-C705 CarbonylContact O-C 3.57Å; L701-C705 VanDerWaalsContact O-C 3.29Å; L701-C705 WeakPolarHBondContact O-CA 3.17Å; L701-C705 PolarHBondContact O-N 2.85Å; L701-V710 HydrophobicContact CB-CG2 4.14Å; L701-V710 HydrophobicContact CD1-CG1 4.06Å; L701-V710 HydrophobicContact CD1-CG2 3.95Å; L701-V710 HydrophobicContact CD2-CG2 4.42Å; L701-V710 HydrophobicContact CG-CG2 4.4Å; L701-I738 HydrophobicContact CD2-CD1 3.74Å
702	S	90.4	Very high	87.6	Confident	72 Å²	72	50.8 Å²	50.8	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-67.4	-32.3	177.8	67.5	0	0	0	0	114	Q698 R699 E700	Q698-S702 PolarHBondContact O-N 2.75Å; Q698-S702 VanDerWaalsContact O-N 3.1Å; Q698-S702 PolarHBondContact O-OG 2.91Å; R699-S702 PolarHBondContact O-N 3.06Å; R699-S702 VanDerWaalsContact O-N 3.13Å; R699-S702 PolarHBondContact O-OG 3.01Å; E700-S702 PolarHBondContact O-N 3.06Å
703	L	88	Confident	88.3	Confident	67 Å²	67	48 Å²	48	35%	0.351	25%	0.246	S	C	.	.	H	α-helix	trans	-81.4	-38.2	-177.2	-72.5	168.1	0	0	0	113.2	N629 R699 E700 L701	N629-L703 WeakPolarHBondContact CB-O 3.14Å; N629-L703 PolarHBondContact ND2-O 2.99Å; R699-L703 HydrophobicContact CB-CD1 4.45Å; R699-L703 WeakPolarHBondContact O-CB 3.35Å; R699-L703 VanDerWaalsContact O-CG 3.28Å; R699-L703 WeakPolarHBondContact O-CG 3.25Å; R699-L703 PolarHBondContact O-N 3.03Å; E700-L703 PolarHBondContact O-N 2.89Å; L701-L703 PolarHBondContact O-N 3.44Å
704	W	88.5	Confident	88.5	Confident	24 Å²	24	50.3 Å²	50.3	9%	0.091	26%	0.255	C	S	.	.	H	α-helix	trans	-93	-31.7	-177.7	-73.3	90.1	0	0	0	113.3	L628 N629 R632 L634 V667 I670 E700	L628-W704 CarbonylContact C-O 3.57Å; L628-W704 VanDerWaalsContact CA-O 3.31Å; L628-W704 WeakPolarHBondContact CA-O 3.46Å; L628-W704 HydrophobicContact CD2-CB 4.36Å; N629-W704 PolarHBondContact N-O 3.03Å; R632-W704 HydrophobicContact CB-CD2 4.41Å; R632-W704 HydrophobicContact CB-CE3 3.83Å; R632-W704 HydrophobicContact CB-CH2 3.78Å; R632-W704 HydrophobicContact CB-CZ2 4.35Å; R632-W704 HydrophobicContact CB-CZ3 3.49Å; R632-W704 VanDerWaalsContact CB-CZ3 3.49Å; L634-W704 HydrophobicContact CD2-CH2 4.45Å; L634-W704 HydrophobicContact CD2-CZ3 3.96Å; V667-W704 HydrophobicContact CB-CZ2 4.38Å; V667-W704 HydrophobicContact CG1-CD2 3.94Å; V667-W704 HydrophobicContact CG1-CE3 3.97Å; V667-W704 HydrophobicContact CG1-CH2 3.63Å; V667-W704 HydrophobicContact CG1-CZ2 3.59Å; V667-W704 HydrophobicContact CG1-CZ3 3.82Å; V667-W704 HydrophobicContact CG2-CZ2 3.8Å; I670-W704 HydrophobicContact CG2-CB 4.01Å; E700-W704 WeakPolarHBondContact O-CB 3.34Å; E700-W704 VanDerWaalsContact O-CD1 3.29Å; E700-W704 PolarHBondContact O-N 2.83Å; E700-W704 PolarHBondContact OE2-NE1 3.2Å
705	C	88	Confident	88.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	28%	0.275	C	S	.	.			trans	-147.2	63.6	-170.1	-165.4	0	0	0	0	113	L628 I670 L701 H707 L708	L628-C705 HydrophobicContact CD2-CB 4.32Å; I670-C705 HydrophobicContact CG2-CB 3.85Å; L701-C705 CarbonylContact O-C 3.57Å; L701-C705 VanDerWaalsContact O-C 3.29Å; L701-C705 WeakPolarHBondContact O-CA 3.17Å; L701-C705 PolarHBondContact O-N 2.85Å; C705-H707 PolarHBondContact O-N 2.85Å; C705-L708 HydrophobicContact CB-CD1 4Å; C705-L708 PolarHBondContact O-N 2.98Å; C705-L708 WeakPolarHBondContact SG-CD1 3.31Å; C705-L708 VanDerWaalsContact SG-CG 3.56Å
706	P	85.7	Confident	88.5	Confident	83 Å²	83	51 Å²	51	54%	0.539	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.8	-174.8	26.2	-36.1	0	0	0	114.7	L708	P706-L708 VanDerWaalsContact C-N 3.27Å; P706-L708 PolarHBondContact O-N 3.49Å
707	H	84.7	Confident	88.5	Confident	130 Å²	130	52.3 Å²	52.3	60%	0.602	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.1	177.1	-64.2	-71.7	0	0	0	114.8	I627 C705	I627-H707 HydrophobicContact CG2-CB 4.15Å; C705-H707 PolarHBondContact O-N 2.85Å
708	L	86.9	Confident	88.3	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	32%	0.324	C	S	.	.	S	Bend	trans	-88.7	123.6	179.9	-70.6	169.5	0	0	0	111.5	W677 C705 P706 V710 N737 I738	W677-L708 HydrophobicContact CG-CD2 4.19Å; C705-L708 HydrophobicContact CB-CD1 4Å; C705-L708 PolarHBondContact O-N 2.98Å; C705-L708 WeakPolarHBondContact SG-CD1 3.31Å; C705-L708 VanDerWaalsContact SG-CG 3.56Å; P706-L708 VanDerWaalsContact C-N 3.27Å; P706-L708 PolarHBondContact O-N 3.49Å; L708-V710 PolarHBondContact O-N 3.46Å; L708-V710 VanDerWaalsContact O-N 3.07Å; L708-N737 HydrophobicContact CD2-CB 3.92Å; L708-I738 HydrophobicContact CB-CD1 4.36Å; L708-I738 HydrophobicContact CD1-CD1 3.84Å
709	K	89.6	Confident	88.2	Confident	104 Å²	104	61.1 Å²	61.1	45%	0.452	33%	0.331	S	S	.	.			trans	-69.2	104.2	169.1	-69.4	-167.3	177.7	-172.2	0	110	D735 N737 I738	K709-D735 VanDerWaalsContact CD-O 3.23Å; K709-D735 WeakPolarHBondContact CD-O 3.26Å; K709-D735 IonicContact NZ-OD1 3.15Å; K709-D735 PolarHBondContact NZ-OD1 3.24Å; K709-D735 IonicContact NZ-OD2 2.9Å; K709-D735 PolarHBondContact NZ-OD2 3.38Å; K709-N737 WeakPolarHBondContact CB-OD1 3.39Å; K709-N737 PolarHBondContact N-OD1 2.86Å; K709-N737 PolarHBondContact O-N 3.16Å; K709-I738 PolarHBondContact O-N 3.17Å; K709-I738 VanDerWaalsContact O-N 3.08Å
710	V	92.5	Very high	88.3	Confident	46 Å²	46	57.6 Å²	57.6	28%	0.279	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	116.8	176.3	-176.6	0	0	0	0	110.3	L701 L708 V712 I738 L740	L701-V710 HydrophobicContact CB-CG2 4.14Å; L701-V710 HydrophobicContact CD1-CG1 4.06Å; L701-V710 HydrophobicContact CD1-CG2 3.95Å; L701-V710 HydrophobicContact CD2-CG2 4.42Å; L701-V710 HydrophobicContact CG-CG2 4.4Å; L708-V710 PolarHBondContact O-N 3.46Å; L708-V710 VanDerWaalsContact O-N 3.07Å; V710-V712 HydrophobicContact CG1-CG2 4.22Å; V710-I738 HydrophobicContact CG1-CG2 4.26Å; V710-I738 HydrophobicContact CG2-CB 4.28Å; V710-I738 HydrophobicContact CG2-CD1 4.35Å; V710-L740 HydrophobicContact CG1-CB 4.09Å
711	L	91.5	Very high	88.3	Confident	47 Å²	47	61.4 Å²	61.4	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119	171	179.7	57.9	0	0	0	110.1	I723 I727 F736 I738 L739 L740	L711-I723 HydrophobicContact CD1-CG2 4.22Å; L711-I723 HydrophobicContact CD2-CG2 4Å; L711-I723 HydrophobicContact CG-CG2 4.39Å; L711-I727 HydrophobicContact CD2-CD1 3.87Å; L711-I727 HydrophobicContact CD2-CG1 4.18Å; L711-F736 HydrophobicContact CB-CB 3.8Å; L711-F736 HydrophobicContact CB-CD1 4.07Å; L711-F736 HydrophobicContact CB-CG 3.88Å; L711-F736 HydrophobicContact CD2-CD1 3.45Å; L711-F736 VanDerWaalsContact CD2-CD1 3.45Å; L711-F736 HydrophobicContact CD2-CE1 3.75Å; L711-F736 HydrophobicContact CD2-CG 4.14Å; L711-F736 HydrophobicContact CG-CD1 4.42Å; L711-I738 PolarHBondContact N-O 3.4Å; L711-L739 HydrophobicContact CB-CD1 4.07Å; L711-L739 HydrophobicContact CD2-CD1 3.87Å; L711-L739 HydrophobicContact CG-CD1 3.88Å; L711-L740 PolarHBondContact O-N 2.76Å
712	V	91.8	Very high	88.1	Confident	29 Å²	29	63.7 Å²	63.7	18%	0.176	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	105.2	-177.2	-168.5	0	0	0	0	110.2	Q694 Q698 V710 Q714 L740	Q694-V712 VanDerWaalsContact NE2-CG1 3.26Å; Q698-V712 HydrophobicContact CG-CG2 4.39Å; V710-V712 HydrophobicContact CG1-CG2 4.22Å; V712-Q714 HydrophobicContact CG1-CG 3.96Å; V712-Q714 PolarHBondContact O-N 2.91Å; V712-Q714 VanDerWaalsContact O-N 3.16Å; V712-L740 HydrophobicContact CG1-CD2 4.46Å; V712-L740 HydrophobicContact CG2-CD2 4.43Å
713	Y	90.1	Very high	87.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	83.5	-176.5	-164.8	-101.5	0	0	0	111.7	R720 I723 R724 L740 T741 V745 D752 L755 M756	Y713-R720 HydrophobicContact CE1-CG 4.42Å; Y713-R720 HydrophobicContact CE2-CB 4.29Å; Y713-R720 HydrophobicContact CE2-CG 4.47Å; Y713-R720 PolarHBondContact OH-O 3.29Å; Y713-I723 HydrophobicContact CD2-CB 4.26Å; Y713-I723 HydrophobicContact CD2-CG2 3.67Å; Y713-I723 HydrophobicContact CE2-CB 4.09Å; Y713-I723 HydrophobicContact CE2-CG2 3.87Å; Y713-R724 HydrophobicContact CE2-CG 4.09Å; Y713-R724 VanDerWaalsContact OH-CD 3.22Å; Y713-R724 WeakPolarHBondContact OH-CD 3.37Å; Y713-R724 WeakPolarHBondContact OH-CG 3.21Å; Y713-L740 PolarHBondContact N-O 3.4Å; Y713-T741 PolarHBondContact O-OG1 3.35Å; Y713-V745 HydrophobicContact CD1-CG1 3.68Å; Y713-V745 HydrophobicContact CE1-CG1 3.74Å; Y713-D752 PolarHBondContact OH-OD1 2.87Å; Y713-D752 VanDerWaalsContact OH-OD1 3.1Å; Y713-L755 HydrophobicContact CD2-CD2 4.5Å; Y713-L755 HydrophobicContact CE2-CD2 4.11Å; Y713-M756 HydrophobicContact CD1-CE 4.32Å
714	Q	86	Confident	87.9	Confident	71 Å²	71	59.7 Å²	59.7	33%	0.332	32%	0.324	S	S	.	.			trans	-144.2	-175.8	178.4	68.5	-177.5	-6.3	0	0	112.8	V712 R720	V712-Q714 HydrophobicContact CG1-CG 3.96Å; V712-Q714 PolarHBondContact O-N 2.91Å; V712-Q714 VanDerWaalsContact O-N 3.16Å; Q714-R720 WeakPolarHBondContact O-CG 3.46Å
715	G	83.2	Confident	87.7	Confident	42 Å²	42	62.5 Å²	62.5	43%	0.433	34%	0.34	S	S	.	.	S	Bend	trans	98.2	-170.1	176.5	0	0	0	0	0	115	R720	G715-R720 WeakPolarHBondContact O-CD 3.41Å; G715-R720 PolarHBondContact O-NE 2.93Å
716	S	86.2	Confident	87.6	Confident	54 Å²	54	69.7 Å²	69.7	38%	0.378	37%	0.372	S	S	.	.			trans	-59.7	165	-179.6	80.7	0	0	0	0	112.1	E718 Q719 R720	S716-E718 PolarHBondContact O-N 3.38Å; S716-E718 PolarHBondContact OG-N 3.03Å; S716-Q719 PolarHBondContact O-N 2.89Å; S716-Q719 WeakPolarHBondContact OG-CG 3.49Å; S716-Q719 PolarHBondContact OG-N 3.36Å; S716-Q719 VanDerWaalsContact OG-N 3.13Å; S716-R720 WeakPolarHBondContact O-CB 3.34Å; S716-R720 WeakPolarHBondContact O-CG 3.34Å; S716-R720 PolarHBondContact O-N 2.88Å
717	A	85.6	Confident	87.5	Confident	68 Å²	68	66.7 Å²	66.7	56%	0.562	35%	0.351	S	S	*	.	H	α-helix	trans	-57.4	-31.4	174.9	0	0	0	0	0	112.2	K721	A717-K721 WeakPolarHBondContact O-CB 3.27Å; A717-K721 PolarHBondContact O-N 3.18Å
718	E	87.1	Confident	87.4	Confident	158 Å²	158	64.1 Å²	64.1	74%	0.738	34%	0.336	S	S	*	.	H	α-helix	trans	-77.3	-46.2	179.6	-53.6	-167.6	136.6	0	0	112.5	S716 R720 K721 A722	S716-E718 PolarHBondContact O-N 3.38Å; S716-E718 PolarHBondContact OG-N 3.03Å; E718-R720 VanDerWaalsContact C-N 3.25Å; E718-R720 PolarHBondContact O-N 2.96Å; E718-K721 WeakPolarHBondContact O-CA 3.4Å; E718-K721 WeakPolarHBondContact O-CB 3.34Å; E718-K721 PolarHBondContact O-N 2.9Å; E718-A722 PolarHBondContact O-N 3.5Å
719	Q	88.2	Confident	87	Confident	113 Å²	113	69.7 Å²	69.7	53%	0.528	36%	0.362	S	S	.	.	H	α-helix	trans	-56.4	-44.3	173.2	-71.5	169.6	-24.6	0	0	110.3	S716 K721 A722 I723	S716-Q719 PolarHBondContact O-N 2.89Å; S716-Q719 WeakPolarHBondContact OG-CG 3.49Å; S716-Q719 PolarHBondContact OG-N 3.36Å; S716-Q719 VanDerWaalsContact OG-N 3.13Å; Q719-K721 PolarHBondContact O-N 3.11Å; Q719-A722 PolarHBondContact O-N 2.8Å; Q719-I723 VanDerWaalsContact O-CG1 3.32Å; Q719-I723 WeakPolarHBondContact O-CG1 3.29Å; Q719-I723 PolarHBondContact O-N 2.86Å
720	R	89.9	Confident	86.2	Confident	36 Å²	36	66.7 Å²	66.7	14%	0.136	35%	0.354	C	S	.	.	H	α-helix	trans	-71.7	-25.3	176.9	-68	-172.1	-56.7	105.2	-7	113.8	Y713 Q714 G715 S716 E718 R724 D752	Y713-R720 HydrophobicContact CE1-CG 4.42Å; Y713-R720 HydrophobicContact CE2-CB 4.29Å; Y713-R720 HydrophobicContact CE2-CG 4.47Å; Y713-R720 PolarHBondContact OH-O 3.29Å; Q714-R720 WeakPolarHBondContact O-CG 3.46Å; G715-R720 WeakPolarHBondContact O-CD 3.41Å; G715-R720 PolarHBondContact O-NE 2.93Å; S716-R720 WeakPolarHBondContact O-CB 3.34Å; S716-R720 WeakPolarHBondContact O-CG 3.34Å; S716-R720 PolarHBondContact O-N 2.88Å; E718-R720 VanDerWaalsContact C-N 3.25Å; E718-R720 PolarHBondContact O-N 2.96Å; R720-R724 VanDerWaalsContact O-CG 3.27Å; R720-R724 WeakPolarHBondContact O-CG 3.31Å; R720-R724 PolarHBondContact O-N 2.99Å; R720-R724 VanDerWaalsContact O-N 3.12Å; R720-R724 PolarHBondContact O-NE 3.39Å; R720-D752 IonicContact CZ-OD2 3.71Å; R720-D752 IonicContact NH1-OD1 3.7Å; R720-D752 PolarHBondContact NH1-OD1 2.9Å; R720-D752 IonicContact NH1-OD2 2.75Å; R720-D752 PolarHBondContact NH1-OD2 2.84Å
721	K	87.9	Confident	84.7	Confident	125 Å²	125	73.1 Å²	73.1	54%	0.543	38%	0.381	S	S	.	.	H	α-helix	trans	-68.1	-47.4	167.6	-177	-171.4	175.1	-167.7	0	110.8	A717 E718 Q719 I723 R724 L725	A717-K721 WeakPolarHBondContact O-CB 3.27Å; A717-K721 PolarHBondContact O-N 3.18Å; E718-K721 WeakPolarHBondContact O-CA 3.4Å; E718-K721 WeakPolarHBondContact O-CB 3.34Å; E718-K721 PolarHBondContact O-N 2.9Å; Q719-K721 PolarHBondContact O-N 3.11Å; K721-I723 PolarHBondContact O-N 3.42Å; K721-R724 PolarHBondContact O-N 2.87Å; K721-L725 HydrophobicContact CG-CD1 4.38Å; K721-L725 WeakPolarHBondContact O-CG 3.09Å; K721-L725 PolarHBondContact O-N 3.09Å
722	A	87.9	Confident	83.2	Confident	51 Å²	51	76.6 Å²	76.6	42%	0.421	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-42.1	177	0	0	0	0	0	112	E718 Q719 L725 K726	E718-A722 PolarHBondContact O-N 3.5Å; Q719-A722 PolarHBondContact O-N 2.8Å; A722-L725 PolarHBondContact O-N 3.05Å; A722-K726 PolarHBondContact O-N 3.44Å
723	I	87	Confident	82	Confident	35 Å²	35	83 Å²	83	18%	0.179	44%	0.437	C	S	.	.	H	α-helix	trans	-63.1	-41.9	174.4	-62.7	161.3	0	0	0	111.2	L711 Y713 Q719 K721 L725 K726 I727	L711-I723 HydrophobicContact CD1-CG2 4.22Å; L711-I723 HydrophobicContact CD2-CG2 4Å; L711-I723 HydrophobicContact CG-CG2 4.39Å; Y713-I723 HydrophobicContact CD2-CB 4.26Å; Y713-I723 HydrophobicContact CD2-CG2 3.67Å; Y713-I723 HydrophobicContact CE2-CB 4.09Å; Y713-I723 HydrophobicContact CE2-CG2 3.87Å; Q719-I723 VanDerWaalsContact O-CG1 3.32Å; Q719-I723 WeakPolarHBondContact O-CG1 3.29Å; Q719-I723 PolarHBondContact O-N 2.86Å; K721-I723 PolarHBondContact O-N 3.42Å; I723-L725 PolarHBondContact O-N 2.87Å; I723-K726 PolarHBondContact O-N 3.33Å; I723-I727 HydrophobicContact CG2-CD1 3.89Å; I723-I727 VanDerWaalsContact O-CG1 3.29Å; I723-I727 WeakPolarHBondContact O-CG1 3.32Å; I723-I727 PolarHBondContact O-N 2.99Å
724	R	87.9	Confident	81	Confident	21 Å²	21	85 Å²	85	8%	0.079	45%	0.45	C	S	.	.	H	α-helix	trans	-62.8	-39.7	176.2	-76.2	174.2	-49.9	-163.4	26.1	112.9	Y713 R720 K721 I727 Y728 E751 D752 L755	Y713-R724 HydrophobicContact CE2-CG 4.09Å; Y713-R724 VanDerWaalsContact OH-CD 3.22Å; Y713-R724 WeakPolarHBondContact OH-CD 3.37Å; Y713-R724 WeakPolarHBondContact OH-CG 3.21Å; R720-R724 VanDerWaalsContact O-CG 3.27Å; R720-R724 WeakPolarHBondContact O-CG 3.31Å; R720-R724 PolarHBondContact O-N 2.99Å; R720-R724 VanDerWaalsContact O-N 3.12Å; R720-R724 PolarHBondContact O-NE 3.39Å; K721-R724 PolarHBondContact O-N 2.87Å; R724-I727 PolarHBondContact O-N 2.97Å; R724-Y728 HydrophobicContact CB-CE2 4.45Å; R724-Y728 VanDerWaalsContact O-CG 3.26Å; R724-Y728 PolarHBondContact O-N 3.25Å; R724-E751 IonicContact CZ-OE2 2.7Å; R724-E751 VanDerWaalsContact CZ-OE2 3.24Å; R724-E751 IonicContact NH1-OE2 2.64Å; R724-E751 PolarHBondContact NH1-OE2 2.7Å; R724-E751 IonicContact NH2-OE2 3.41Å; R724-E751 PolarHBondContact NH2-OE2 3.42Å; R724-D752 IonicContact CZ-OD1 3.58Å; R724-D752 IonicContact NH1-OD1 2.79Å; R724-D752 PolarHBondContact NH1-OD1 3.5Å; R724-L755 HydrophobicContact CG-CD1 4.34Å; R724-L755 HydrophobicContact CG-CD2 4.03Å
725	L	84.8	Confident	80.8	Confident	82 Å²	82	87.3 Å²	87.3	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-49	177.5	-71.7	169.6	0	0	0	110.9	K721 A722 I723 I727 Y728 E729	K721-L725 HydrophobicContact CG-CD1 4.38Å; K721-L725 WeakPolarHBondContact O-CG 3.09Å; K721-L725 PolarHBondContact O-N 3.09Å; A722-L725 PolarHBondContact O-N 3.05Å; I723-L725 PolarHBondContact O-N 2.87Å; L725-I727 VanDerWaalsContact C-N 3.25Å; L725-I727 PolarHBondContact O-N 2.75Å; L725-Y728 CarbonylContact O-C 3.59Å; L725-Y728 WeakPolarHBondContact O-CA 3.29Å; L725-Y728 PolarHBondContact O-N 2.67Å; L725-E729 WeakPolarHBondContact O-CG 3.21Å; L725-E729 PolarHBondContact O-N 2.79Å
726	K	85	Confident	81	Confident	153 Å²	153	86 Å²	86	67%	0.665	45%	0.447	S	S	*	.	H	α-helix	trans	-55.8	-35.5	174.7	-68.2	-175.6	177	-167.8	0	114.1	A722 I723 E729 S730	A722-K726 PolarHBondContact O-N 3.44Å; I723-K726 PolarHBondContact O-N 3.33Å; K726-E729 WeakPolarHBondContact CA-OE2 3.37Å; K726-S730 PolarHBondContact O-N 2.97Å
727	I	84.4	Confident	81.1	Confident	19 Å²	19	84.7 Å²	84.7	10%	0.097	44%	0.436	C	S	.	.	H	α-helix	trans	-77.5	-22.8	176.7	-58.2	165.2	0	0	0	112.1	L711 I723 R724 L725 S730 F736 L755 I759	L711-I727 HydrophobicContact CD2-CD1 3.87Å; L711-I727 HydrophobicContact CD2-CG1 4.18Å; I723-I727 HydrophobicContact CG2-CD1 3.89Å; I723-I727 VanDerWaalsContact O-CG1 3.29Å; I723-I727 WeakPolarHBondContact O-CG1 3.32Å; I723-I727 PolarHBondContact O-N 2.99Å; R724-I727 PolarHBondContact O-N 2.97Å; L725-I727 VanDerWaalsContact C-N 3.25Å; L725-I727 PolarHBondContact O-N 2.75Å; I727-S730 PolarHBondContact O-OG 3.21Å; I727-S730 VanDerWaalsContact O-OG 3.06Å; I727-F736 HydrophobicContact CD1-CE1 4.15Å; I727-F736 HydrophobicContact CG1-CE1 4.07Å; I727-F736 HydrophobicContact CG2-CE1 4.43Å; I727-L755 HydrophobicContact CB-CD1 4.22Å; I727-L755 HydrophobicContact CD1-CD1 4.21Å; I727-L755 HydrophobicContact CD1-CD2 4.13Å; I727-L755 HydrophobicContact CG2-CD1 3.9Å; I727-I759 HydrophobicContact CG2-CD1 4.13Å
728	Y	81.9	Confident	81.5	Confident	77 Å²	77	81.4 Å²	81.4	30%	0.302	41%	0.409	S	S	.	.	H	α-helix	trans	-86.7	-25.5	174.6	-65.1	-18	0	0	0	112.9	R724 L725 L755	R724-Y728 HydrophobicContact CB-CE2 4.45Å; R724-Y728 VanDerWaalsContact O-CG 3.26Å; R724-Y728 PolarHBondContact O-N 3.25Å; L725-Y728 CarbonylContact O-C 3.59Å; L725-Y728 WeakPolarHBondContact O-CA 3.29Å; L725-Y728 PolarHBondContact O-N 2.67Å; Y728-L755 HydrophobicContact CD1-CD1 4.32Å; Y728-L755 HydrophobicContact CE1-CD1 3.6Å
729	E	79.3	Confident	81.8	Confident	132 Å²	132	73.9 Å²	73.9	62%	0.617	37%	0.374	S	S	*	.	H	α-helix	trans	-71.5	-29.2	172	-71.2	153	-159.1	0	0	112.1	L725 K726 E731	L725-E729 WeakPolarHBondContact O-CG 3.21Å; L725-E729 PolarHBondContact O-N 2.79Å; K726-E729 WeakPolarHBondContact CA-OE2 3.37Å; E729-E731 PolarHBondContact O-N 3.06Å
730	S	71.5	Confident	82.1	Confident	41 Å²	41	68.5 Å²	68.5	29%	0.287	35%	0.349	S	S	.	.			trans	-78.6	82.9	173.1	62.3	0	0	0	0	111.5	K726 I727 S732 Q733	K726-S730 PolarHBondContact O-N 2.97Å; I727-S730 PolarHBondContact O-OG 3.21Å; I727-S730 VanDerWaalsContact O-OG 3.06Å; S730-S732 PolarHBondContact O-N 3.22Å; S730-Q733 WeakPolarHBondContact CB-O 3.4Å
731	E	60.5	Low	82.3	Confident	182 Å²	182	66.8 Å²	66.8	85%	0.85	34%	0.342	S	S	*	.			trans	-64.1	-32.5	-167.7	-62.2	-164.4	132.8	0	0	115.6	E729	E729-E731 PolarHBondContact O-N 3.06Å
732	S	61.9	Low	82.4	Confident	120 Å²	120	61 Å²	61	84%	0.839	32%	0.317	S	S	*	.	S	Bend	trans	-106.2	-41.3	-171.6	-69.1	0	0	0	0	115.3	S730	S730-S732 PolarHBondContact O-N 3.22Å
733	Q	64.8	Low	82.5	Confident	164 Å²	164	58.8 Å²	58.8	77%	0.766	30%	0.298	S	S	*	.	S	Bend	trans	-146.6	142.9	176.7	-67.4	-169.8	3.5	0	0	110.4	S730	S730-Q733 WeakPolarHBondContact CB-O 3.4Å
734	P	69	Low	82.5	Confident	40 Å²	40	59.5 Å²	59.5	26%	0.26	31%	0.309	S	S	.	.			trans	-72.3	136.7	174.8	28.8	-32.7	0	0	0	111.5	P684 F736	P684-P734 HydrophobicContact CB-CG 3.95Å; P684-P734 HydrophobicContact CG-CG 3.96Å; P734-F736 HydrophobicContact CB-CD1 3.8Å; P734-F736 HydrophobicContact CB-CE1 3.43Å; P734-F736 VanDerWaalsContact CB-CE1 3.43Å; P734-F736 HydrophobicContact CB-CE2 4.28Å; P734-F736 HydrophobicContact CB-CG 4.39Å; P734-F736 HydrophobicContact CB-CZ 3.7Å; P734-F736 HydrophobicContact CG-CE1 4.46Å; P734-F736 HydrophobicContact CG-CZ 4.29Å; P734-F736 PolarHBondContact O-N 3.03Å
735	D	82.3	Confident	82.5	Confident	120 Å²	120	59.7 Å²	59.7	64%	0.642	31%	0.313	S	S	*	.	S	Bend	trans	-76.3	35	177.7	-166	45.3	0	0	0	113.9	K709	K709-D735 VanDerWaalsContact CD-O 3.23Å; K709-D735 WeakPolarHBondContact CD-O 3.26Å; K709-D735 IonicContact NZ-OD1 3.15Å; K709-D735 PolarHBondContact NZ-OD1 3.24Å; K709-D735 IonicContact NZ-OD2 2.9Å; K709-D735 PolarHBondContact NZ-OD2 3.38Å
736	F	87.5	Confident	82.4	Confident	14 Å²	14	55.9 Å²	55.9	6%	0.061	29%	0.293	C	S	.	.			trans	-142.9	141.3	176.5	62.7	-98.2	0	0	0	111.5	P684 L711 I727 P734 L739 I759	P684-F736 HydrophobicContact CB-CD2 4.48Å; P684-F736 HydrophobicContact CB-CE2 3.92Å; L711-F736 HydrophobicContact CB-CB 3.8Å; L711-F736 HydrophobicContact CB-CD1 4.07Å; L711-F736 HydrophobicContact CB-CG 3.88Å; L711-F736 HydrophobicContact CD2-CD1 3.45Å; L711-F736 VanDerWaalsContact CD2-CD1 3.45Å; L711-F736 HydrophobicContact CD2-CE1 3.75Å; L711-F736 HydrophobicContact CD2-CG 4.14Å; L711-F736 HydrophobicContact CG-CD1 4.42Å; I727-F736 HydrophobicContact CD1-CE1 4.15Å; I727-F736 HydrophobicContact CG1-CE1 4.07Å; I727-F736 HydrophobicContact CG2-CE1 4.43Å; P734-F736 HydrophobicContact CB-CD1 3.8Å; P734-F736 HydrophobicContact CB-CE1 3.43Å; P734-F736 VanDerWaalsContact CB-CE1 3.43Å; P734-F736 HydrophobicContact CB-CE2 4.28Å; P734-F736 HydrophobicContact CB-CG 4.39Å; P734-F736 HydrophobicContact CB-CZ 3.7Å; P734-F736 HydrophobicContact CG-CE1 4.46Å; P734-F736 HydrophobicContact CG-CZ 4.29Å; P734-F736 PolarHBondContact O-N 3.03Å; F736-L739 HydrophobicContact CD2-CB 4.2Å; F736-L739 HydrophobicContact CE2-CB 3.69Å; F736-L739 HydrophobicContact CE2-CD1 4.32Å; F736-L739 HydrophobicContact CE2-CG 4.46Å; F736-L739 HydrophobicContact CZ-CB 4.27Å; F736-L739 HydrophobicContact CZ-CD1 4.2Å; F736-I759 HydrophobicContact CZ-CD1 4.31Å
737	N	89.6	Confident	82.4	Confident	27 Å²	27	49.4 Å²	49.4	14%	0.144	27%	0.266	C	S	.	.	S	Bend	trans	-81.1	-35.9	173.1	-54.7	111.3	0	0	0	110.7	R682 H685 L708 K709	R682-N737 WeakPolarHBondContact O-CB 3.01Å; R682-N737 PolarHBondContact O-ND2 3.14Å; H685-N737 PolarHBondContact CD2-O 3.3Å; H685-N737 PolarHBondContact N-O 3.37Å; L708-N737 HydrophobicContact CD2-CB 3.92Å; K709-N737 WeakPolarHBondContact CB-OD1 3.39Å; K709-N737 PolarHBondContact N-OD1 2.86Å; K709-N737 PolarHBondContact O-N 3.16Å
738	I	93.6	Very high	82.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.8	-175.4	-66.3	171.3	0	0	0	110.2	L673 H685 I687 L701 L708 K709 V710 L711	L673-I738 HydrophobicContact CD1-CD1 3.85Å; L673-I738 HydrophobicContact CD1-CG1 4.48Å; H685-I738 HydrophobicContact CB-CG1 4.36Å; H685-I738 WeakPolarHBondContact O-CA 3.26Å; I687-I738 HydrophobicContact CD1-CD1 4.43Å; I687-I738 HydrophobicContact CD1-CG2 3.68Å; I687-I738 HydrophobicContact CG1-CG2 3.95Å; L701-I738 HydrophobicContact CD2-CD1 3.74Å; L708-I738 HydrophobicContact CB-CD1 4.36Å; L708-I738 HydrophobicContact CD1-CD1 3.84Å; K709-I738 PolarHBondContact O-N 3.17Å; K709-I738 VanDerWaalsContact O-N 3.08Å; V710-I738 HydrophobicContact CG1-CG2 4.26Å; V710-I738 HydrophobicContact CG2-CB 4.28Å; V710-I738 HydrophobicContact CG2-CD1 4.35Å; L711-I738 PolarHBondContact N-O 3.4Å
739	L	93.7	Very high	82.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111	163.2	-166.5	66.1	0	0	0	109	H685 L686 I687 L711 F736 M756 I759 F761	H685-L739 PolarHBondContact O-N 3.44Å; L686-L739 HydrophobicContact CD1-CB 4.2Å; L686-L739 HydrophobicContact CD1-CD2 4.18Å; L686-L739 HydrophobicContact CD1-CG 4.38Å; I687-L739 PolarHBondContact N-O 2.89Å; L711-L739 HydrophobicContact CB-CD1 4.07Å; L711-L739 HydrophobicContact CD2-CD1 3.87Å; L711-L739 HydrophobicContact CG-CD1 3.88Å; F736-L739 HydrophobicContact CD2-CB 4.2Å; F736-L739 HydrophobicContact CE2-CB 3.69Å; F736-L739 HydrophobicContact CE2-CD1 4.32Å; F736-L739 HydrophobicContact CE2-CG 4.46Å; F736-L739 HydrophobicContact CZ-CB 4.27Å; F736-L739 HydrophobicContact CZ-CD1 4.2Å; L739-M756 HydrophobicContact CD2-CE 3.61Å; L739-M756 HydrophobicContact CD2-SD 3.92Å; L739-I759 HydrophobicContact CD2-CD1 4.42Å; L739-F761 HydrophobicContact CB-CE1 4.08Å; L739-F761 HydrophobicContact CD2-CE1 4.02Å; L739-F761 HydrophobicContact CD2-CZ 3.75Å
740	L	94.3	Very high	82.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.8	174.9	177.6	61.7	0	0	0	109.4	I687 Q694 W697 Q698 V710 L711 V712 Y713	I687-L740 HydrophobicContact CB-CD1 3.89Å; I687-L740 HydrophobicContact CG2-CD1 3.71Å; Q694-L740 HydrophobicContact CG-CD2 4.11Å; Q694-L740 HydrophobicContact CG-CG 4.07Å; W697-L740 HydrophobicContact CB-CD1 3.96Å; W697-L740 HydrophobicContact CB-CD2 4.02Å; W697-L740 HydrophobicContact CG-CD1 4.42Å; Q698-L740 HydrophobicContact CB-CD2 4.17Å; V710-L740 HydrophobicContact CG1-CB 4.09Å; L711-L740 PolarHBondContact O-N 2.76Å; V712-L740 HydrophobicContact CG1-CD2 4.46Å; V712-L740 HydrophobicContact CG2-CD2 4.43Å; Y713-L740 PolarHBondContact N-O 3.4Å
741	T	92.9	Very high	83	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	174.1	175.8	-160	0	0	0	0	111.9	L686 I687 I688 C689 Y713 M756	L686-T741 HydrophobicContact CD1-CG2 4.23Å; I687-T741 PolarHBondContact O-N 3.38Å; I688-T741 WeakPolarHBondContact CA-O 3.49Å; I688-T741 HydrophobicContact CG1-CG2 4.18Å; C689-T741 PolarHBondContact N-O 2.82Å; C689-T741 VanDerWaalsContact N-O 3.14Å; Y713-T741 PolarHBondContact O-OG1 3.35Å; T741-M756 HydrophobicContact CG2-CE 4.01Å
742	S	91.5	Very high	84.2	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	154.2	176.2	58.7	0	0	0	0	113.4	C689 S691 Q694 A744 V745 G746	C689-S742 WeakPolarHBondContact O-CA 3.42Å; C689-S742 WeakPolarHBondContact O-CB 3.47Å; S691-S742 WeakPolarHBondContact OG-CB 3.32Å; S691-S742 PolarHBondContact OG-OG 2.75Å; S691-S742 VanDerWaalsContact OG-OG 3.12Å; Q694-S742 PolarHBondContact OE1-OG 3.12Å; S742-A744 PolarHBondContact O-N 3.16Å; S742-V745 PolarHBondContact O-N 3.45Å; S742-V745 VanDerWaalsContact O-N 3.16Å; S742-G746 PolarHBondContact O-N 3.49Å
743	Y	89.5	Confident	85.3	Confident	5 Å²	5	39.6 Å²	39.6	2%	0.02	22%	0.219	C	C	.	.	H	α-helix	trans	-50.6	-33.1	177.7	-76	-66.1	0	0	0	114.1	I688 C689 T747 D767 M771 L772 R779 L783	I688-Y743 HydrophobicContact CB-CE1 4.43Å; I688-Y743 HydrophobicContact CG2-CD1 3.5Å; I688-Y743 VanDerWaalsContact CG2-CD1 3.5Å; I688-Y743 HydrophobicContact CG2-CD2 4.28Å; I688-Y743 HydrophobicContact CG2-CE1 3.73Å; I688-Y743 HydrophobicContact CG2-CE2 4.47Å; I688-Y743 HydrophobicContact CG2-CG 3.8Å; C689-Y743 WeakPolarHBondContact O-CD2 3.29Å; C689-Y743 PolarHBondContact O-N 2.99Å; C689-Y743 VanDerWaalsContact O-N 3.09Å; Y743-T747 PolarHBondContact O-OG1 2.86Å; Y743-D767 WeakPolarHBondContact CE2-O 3.33Å; Y743-D767 PolarHBondContact OH-O 3.28Å; Y743-M771 HydrophobicContact CD2-CB 4.21Å; Y743-M771 HydrophobicContact CD2-CG 4.19Å; Y743-M771 HydrophobicContact CE1-CB 4.49Å; Y743-M771 HydrophobicContact CE2-CB 3.83Å; Y743-M771 HydrophobicContact CE2-CG 4.02Å; Y743-L772 HydrophobicContact CE1-CD2 3.98Å; Y743-R779 HydrophobicContact CD1-CG 4.48Å; Y743-L783 HydrophobicContact CD1-CD1 3.84Å; Y743-L783 HydrophobicContact CE1-CD1 3.82Å
744	A	86.8	Confident	86.3	Confident	49 Å²	49	34.1 Å²	34.1	41%	0.405	20%	0.201	S	C	.	.	H	α-helix	trans	-71.3	-56.6	177.5	0	0	0	0	0	111.2	S742 T747 S748	S742-A744 PolarHBondContact O-N 3.16Å; A744-T747 PolarHBondContact O-N 3.21Å; A744-S748 WeakPolarHBondContact O-CB 3.08Å; A744-S748 PolarHBondContact O-N 3.1Å; A744-S748 VanDerWaalsContact O-N 3.16Å; A744-S748 PolarHBondContact O-OG 3.1Å
745	V	87.3	Confident	87	Confident	26 Å²	26	32.2 Å²	32.2	16%	0.158	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-52.6	-176.1	177.9	0	0	0	0	110.9	Y713 S742 T747 S748	Y713-V745 HydrophobicContact CD1-CG1 3.68Å; Y713-V745 HydrophobicContact CE1-CG1 3.74Å; S742-V745 PolarHBondContact O-N 3.45Å; S742-V745 VanDerWaalsContact O-N 3.16Å; V745-T747 PolarHBondContact O-N 3.48Å; V745-T747 VanDerWaalsContact O-N 3.09Å; V745-S748 PolarHBondContact O-N 2.94Å
746	G	83.5	Confident	87.2	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-21.8	-176.1	0	0	0	0	0	115.1	S742 R753 F786	S742-G746 PolarHBondContact O-N 3.49Å; G746-R753 WeakPolarHBondContact O-CG 3.36Å; G746-F786 WeakPolarHBondContact O-CZ 3.27Å
747	T	84.5	Confident	87.1	Confident	17 Å²	17	30.5 Å²	30.5	10%	0.104	18%	0.175	C	C	.	.	H	α-helix	trans	-110.2	-5.3	-177	68.6	0	0	0	0	115.5	Y743 A744 V745 R753 R779 N782 L783	Y743-T747 PolarHBondContact O-OG1 2.86Å; A744-T747 PolarHBondContact O-N 3.21Å; V745-T747 PolarHBondContact O-N 3.48Å; V745-T747 VanDerWaalsContact O-N 3.09Å; T747-R753 WeakPolarHBondContact O-CD 3.49Å; T747-R753 PolarHBondContact O-NE 3.33Å; T747-R779 HydrophobicContact CG2-CG 4.27Å; T747-N782 HydrophobicContact CG2-CB 3.99Å; T747-N782 PolarHBondContact O-ND2 2.86Å; T747-L783 HydrophobicContact CG2-CD1 4.5Å; T747-L783 HydrophobicContact CG2-CD2 3.55Å; T747-L783 HydrophobicContact CG2-CG 3.77Å
748	S	79.9	Confident	86.9	Confident	79 Å²	79	36.3 Å²	36.3	55%	0.552	20%	0.196	S	C	*	.	H	α-helix	trans	-80.6	-73.2	-173.2	-68	0	0	0	0	113.6	A744 V745 R753	A744-S748 WeakPolarHBondContact O-CB 3.08Å; A744-S748 PolarHBondContact O-N 3.1Å; A744-S748 VanDerWaalsContact O-N 3.16Å; A744-S748 PolarHBondContact O-OG 3.1Å; V745-S748 PolarHBondContact O-N 2.94Å; S748-R753 PolarHBondContact O-NH2 3.1Å
749	A	82.6	Confident	86.5	Confident	28 Å²	28	37.2 Å²	37.2	23%	0.231	20%	0.2	C	C	.	.	S	Bend	trans	-71.3	162.7	-174	0	0	0	0	0	112.1	D752 R753	A749-D752 HydrophobicContact CB-CB 4.29Å; A749-D752 WeakPolarHBondContact CB-OD2 3.38Å; A749-D752 PolarHBondContact N-OD2 3.47Å; A749-R753 WeakPolarHBondContact O-CG 3.44Å; A749-R753 PolarHBondContact O-NE 3.08Å
750	I	83.2	Confident	86.3	Confident	120 Å²	120	41.6 Å²	41.6	62%	0.615	22%	0.223	S	C	*	.	H	α-helix	trans	-70.7	-43.4	172.1	-61.1	169.8	0	0	0	109.4	D752 R753 A754	I750-D752 PolarHBondContact O-N 3.08Å; I750-R753 CarbonylContact O-C 3.5Å; I750-R753 PolarHBondContact O-N 2.72Å; I750-A754 PolarHBondContact O-N 3.03Å
751	E	83.7	Confident	86.1	Confident	84 Å²	84	41.6 Å²	41.6	39%	0.393	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-42.9	179.7	-62.5	149	-147.9	0	0	112.5	R724 R753 A754 L755	R724-E751 IonicContact CZ-OE2 2.7Å; R724-E751 VanDerWaalsContact CZ-OE2 3.24Å; R724-E751 IonicContact NH1-OE2 2.64Å; R724-E751 PolarHBondContact NH1-OE2 2.7Å; R724-E751 IonicContact NH2-OE2 3.41Å; R724-E751 PolarHBondContact NH2-OE2 3.42Å; E751-R753 VanDerWaalsContact C-N 3.33Å; E751-R753 PolarHBondContact O-N 3.24Å; E751-A754 WeakPolarHBondContact O-CB 3.38Å; E751-A754 PolarHBondContact O-N 3.03Å; E751-A754 VanDerWaalsContact O-N 3.1Å; E751-L755 PolarHBondContact O-N 2.97Å
752	D	86.5	Confident	86.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-40.9	178.6	-52.6	-25.7	0	0	0	110.6	Y713 R720 R724 A749 I750 A754 L755 M756	Y713-D752 PolarHBondContact OH-OD1 2.87Å; Y713-D752 VanDerWaalsContact OH-OD1 3.1Å; R720-D752 IonicContact CZ-OD2 3.71Å; R720-D752 IonicContact NH1-OD1 3.7Å; R720-D752 PolarHBondContact NH1-OD1 2.9Å; R720-D752 IonicContact NH1-OD2 2.75Å; R720-D752 PolarHBondContact NH1-OD2 2.84Å; R724-D752 IonicContact CZ-OD1 3.58Å; R724-D752 IonicContact NH1-OD1 2.79Å; R724-D752 PolarHBondContact NH1-OD1 3.5Å; A749-D752 HydrophobicContact CB-CB 4.29Å; A749-D752 WeakPolarHBondContact CB-OD2 3.38Å; A749-D752 PolarHBondContact N-OD2 3.47Å; I750-D752 PolarHBondContact O-N 3.08Å; D752-A754 VanDerWaalsContact C-N 3.27Å; D752-A754 PolarHBondContact O-N 2.87Å; D752-L755 WeakPolarHBondContact O-CB 3.47Å; D752-L755 PolarHBondContact O-N 2.85Å; D752-M756 VanDerWaalsContact O-CG 3.27Å; D752-M756 WeakPolarHBondContact O-CG 3.49Å; D752-M756 PolarHBondContact O-N 3.14Å; D752-M756 VanDerWaalsContact O-N 3.08Å
753	R	85.5	Confident	86.2	Confident	55 Å²	55	43.3 Å²	43.3	21%	0.208	23%	0.231	C	C	.	.	H	α-helix	trans	-72.4	-17.9	174.6	-70	179.1	-72.4	153	-2.3	113.3	G746 T747 S748 A749 I750 E751 K757 N782 F786	G746-R753 WeakPolarHBondContact O-CG 3.36Å; T747-R753 WeakPolarHBondContact O-CD 3.49Å; T747-R753 PolarHBondContact O-NE 3.33Å; S748-R753 PolarHBondContact O-NH2 3.1Å; A749-R753 WeakPolarHBondContact O-CG 3.44Å; A749-R753 PolarHBondContact O-NE 3.08Å; I750-R753 CarbonylContact O-C 3.5Å; I750-R753 PolarHBondContact O-N 2.72Å; E751-R753 VanDerWaalsContact C-N 3.33Å; E751-R753 PolarHBondContact O-N 3.24Å; R753-K757 WeakPolarHBondContact O-CB 3.46Å; R753-K757 WeakPolarHBondContact O-CD 3.37Å; R753-K757 VanDerWaalsContact O-CG 3.22Å; R753-K757 WeakPolarHBondContact O-CG 3.27Å; R753-K757 PolarHBondContact O-N 2.94Å; R753-N782 VanDerWaalsContact CD-OD1 3.31Å; R753-N782 WeakPolarHBondContact CD-OD1 3.46Å; R753-N782 PolarHBondContact NH1-OD1 2.85Å; R753-F786 HydrophobicContact CG-CE1 4.46Å
754	A	84.7	Confident	86.4	Confident	48 Å²	48	43 Å²	43	40%	0.397	23%	0.23	S	C	.	.	H	α-helix	trans	-77	-44.6	170.2	0	0	0	0	0	110.7	I750 E751 D752 M756 K757 R758	I750-A754 PolarHBondContact O-N 3.03Å; E751-A754 WeakPolarHBondContact O-CB 3.38Å; E751-A754 PolarHBondContact O-N 3.03Å; E751-A754 VanDerWaalsContact O-N 3.1Å; D752-A754 VanDerWaalsContact C-N 3.27Å; D752-A754 PolarHBondContact O-N 2.87Å; A754-M756 PolarHBondContact O-N 2.96Å; A754-K757 PolarHBondContact O-N 3.33Å; A754-K757 VanDerWaalsContact O-N 3.1Å; A754-R758 PolarHBondContact O-N 2.96Å
755	L	84.9	Confident	86.8	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-54.2	-52.5	172.2	-177.7	76.8	0	0	0	111.3	Y713 R724 I727 Y728 E751 D752 K757 R758 I759	Y713-L755 HydrophobicContact CD2-CD2 4.5Å; Y713-L755 HydrophobicContact CE2-CD2 4.11Å; R724-L755 HydrophobicContact CG-CD1 4.34Å; R724-L755 HydrophobicContact CG-CD2 4.03Å; I727-L755 HydrophobicContact CB-CD1 4.22Å; I727-L755 HydrophobicContact CD1-CD1 4.21Å; I727-L755 HydrophobicContact CD1-CD2 4.13Å; I727-L755 HydrophobicContact CG2-CD1 3.9Å; Y728-L755 HydrophobicContact CD1-CD1 4.32Å; Y728-L755 HydrophobicContact CE1-CD1 3.6Å; E751-L755 PolarHBondContact O-N 2.97Å; D752-L755 WeakPolarHBondContact O-CB 3.47Å; D752-L755 PolarHBondContact O-N 2.85Å; L755-K757 PolarHBondContact O-N 3.3Å; L755-K757 VanDerWaalsContact O-N 3.08Å; L755-R758 PolarHBondContact O-N 3.13Å; L755-I759 HydrophobicContact CD1-CD1 3.9Å; L755-I759 HydrophobicContact CD1-CG1 4.46Å; L755-I759 HydrophobicContact CD2-CD1 4.39Å; L755-I759 HydrophobicContact CG-CD1 3.8Å; L755-I759 PolarHBondContact O-N 3.2Å; L755-I759 VanDerWaalsContact O-N 3.1Å
756	M	86.3	Confident	87.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-5.8	-179.5	-59.4	-69.1	175.2	0	0	114.3	L686 Y713 L739 T741 D752 A754 F761 F786	L686-M756 HydrophobicContact CD1-CE 4.39Å; L686-M756 HydrophobicContact CD1-SD 4.01Å; L686-M756 HydrophobicContact CD2-SD 4.39Å; Y713-M756 HydrophobicContact CD1-CE 4.32Å; L739-M756 HydrophobicContact CD2-CE 3.61Å; L739-M756 HydrophobicContact CD2-SD 3.92Å; T741-M756 HydrophobicContact CG2-CE 4.01Å; D752-M756 VanDerWaalsContact O-CG 3.27Å; D752-M756 WeakPolarHBondContact O-CG 3.49Å; D752-M756 PolarHBondContact O-N 3.14Å; D752-M756 VanDerWaalsContact O-N 3.08Å; A754-M756 PolarHBondContact O-N 2.96Å; M756-F761 HydrophobicContact SD-CE2 4.09Å; M756-F761 HydrophobicContact SD-CZ 4.01Å; M756-F786 HydrophobicContact CB-CD1 3.84Å; M756-F786 HydrophobicContact CB-CD2 3.99Å; M756-F786 HydrophobicContact CB-CE1 3.62Å; M756-F786 HydrophobicContact CB-CE2 3.76Å; M756-F786 HydrophobicContact CB-CG 4.03Å; M756-F786 HydrophobicContact CB-CZ 3.57Å; M756-F786 HydrophobicContact CG-CD2 4.47Å; M756-F786 HydrophobicContact CG-CE1 4.28Å; M756-F786 HydrophobicContact CG-CE2 3.85Å; M756-F786 HydrophobicContact CG-CZ 3.74Å; M756-F786 HydrophobicContact SD-CE2 4.28Å
757	K	85	Confident	87.6	Confident	97 Å²	97	40 Å²	40	42%	0.422	21%	0.206	S	C	.	.	H	α-helix	trans	-102.7	-23.2	170.8	-80	179.7	171.1	-162.2	0	113.5	R753 A754 L755 R787	R753-K757 WeakPolarHBondContact O-CB 3.46Å; R753-K757 WeakPolarHBondContact O-CD 3.37Å; R753-K757 VanDerWaalsContact O-CG 3.22Å; R753-K757 WeakPolarHBondContact O-CG 3.27Å; R753-K757 PolarHBondContact O-N 2.94Å; A754-K757 PolarHBondContact O-N 3.33Å; A754-K757 VanDerWaalsContact O-N 3.1Å; L755-K757 PolarHBondContact O-N 3.3Å; L755-K757 VanDerWaalsContact O-N 3.08Å; K757-R787 VanDerWaalsContact O-CD 3.26Å; K757-R787 WeakPolarHBondContact O-CD 3.49Å; K757-R787 PolarHBondContact O-NE 2.69Å
758	R	84.8	Confident	87.8	Confident	150 Å²	150	40.1 Å²	40.1	57%	0.566	21%	0.205	S	C	*	.	H	α-helix	trans	-80.9	-41.7	177.7	-173.3	176.7	178.1	-176.4	-1.9	111.2	A754 L755	A754-R758 PolarHBondContact O-N 2.96Å; L755-R758 PolarHBondContact O-N 3.13Å
759	I	86.2	Confident	88.1	Confident	18 Å²	18	36.4 Å²	36.4	9%	0.092	18%	0.179	C	C	.	.	S	Bend	trans	-75.3	129.8	176.8	-54.1	163.9	0	0	0	109.5	P684 I727 F736 L739 L755 F761	P684-I759 HydrophobicContact CG-CG2 3.97Å; I727-I759 HydrophobicContact CG2-CD1 4.13Å; F736-I759 HydrophobicContact CZ-CD1 4.31Å; L739-I759 HydrophobicContact CD2-CD1 4.42Å; L755-I759 HydrophobicContact CD1-CD1 3.9Å; L755-I759 HydrophobicContact CD1-CG1 4.46Å; L755-I759 HydrophobicContact CD2-CD1 4.39Å; L755-I759 HydrophobicContact CG-CD1 3.8Å; L755-I759 PolarHBondContact O-N 3.2Å; L755-I759 VanDerWaalsContact O-N 3.1Å; I759-F761 HydrophobicContact CB-CD2 4.37Å; I759-F761 HydrophobicContact CB-CE1 4.28Å; I759-F761 HydrophobicContact CB-CE2 3.77Å; I759-F761 HydrophobicContact CB-CZ 3.73Å; I759-F761 HydrophobicContact CD1-CE1 4.42Å; I759-F761 HydrophobicContact CD1-CZ 3.82Å; I759-F761 HydrophobicContact CG1-CZ 4.4Å; I759-F761 HydrophobicContact CG2-CD1 3.87Å; I759-F761 HydrophobicContact CG2-CD2 4.14Å; I759-F761 HydrophobicContact CG2-CE1 3.56Å; I759-F761 HydrophobicContact CG2-CE2 3.85Å; I759-F761 HydrophobicContact CG2-CG 4.17Å; I759-F761 HydrophobicContact CG2-CZ 3.55Å
760	N	88.5	Confident	88	Confident	92 Å²	92	36.2 Å²	36.2	49%	0.492	17%	0.173	S	C	.	.			trans	-93.6	106.9	170.8	-62	-26.9	0	0	0	108.5	R787	N760-R787 WeakPolarHBondContact OD1-CD 3.45Å; N760-R787 PolarHBondContact OD1-NH1 2.67Å
761	F	91.4	Very high	87.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	135.8	-179.8	-60.3	-82.4	0	0	0	111.9	P684 L686 L739 M756 I759 R787 V788 Q789	P684-F761 HydrophobicContact CB-CD1 4.13Å; P684-F761 HydrophobicContact CB-CE1 4.49Å; P684-F761 HydrophobicContact CG-CD1 4.37Å; P684-F761 CarbonylContact O-C 3.54Å; P684-F761 WeakPolarHBondContact O-CA 3.32Å; L686-F761 HydrophobicContact CB-CB 4.26Å; L686-F761 HydrophobicContact CB-CD1 3.67Å; L686-F761 HydrophobicContact CB-CD2 4.19Å; L686-F761 HydrophobicContact CB-CE1 3.93Å; L686-F761 HydrophobicContact CB-CE2 4.43Å; L686-F761 HydrophobicContact CB-CG 3.79Å; L686-F761 HydrophobicContact CB-CZ 4.31Å; L686-F761 HydrophobicContact CD1-CE1 4.34Å; L686-F761 HydrophobicContact CD1-CZ 4.17Å; L686-F761 HydrophobicContact CD2-CD2 4.04Å; L686-F761 HydrophobicContact CD2-CE2 3.99Å; L686-F761 HydrophobicContact CD2-CG 4.47Å; L686-F761 HydrophobicContact CD2-CZ 4.38Å; L739-F761 HydrophobicContact CB-CE1 4.08Å; L739-F761 HydrophobicContact CD2-CE1 4.02Å; L739-F761 HydrophobicContact CD2-CZ 3.75Å; M756-F761 HydrophobicContact SD-CE2 4.09Å; M756-F761 HydrophobicContact SD-CZ 4.01Å; I759-F761 HydrophobicContact CB-CD2 4.37Å; I759-F761 HydrophobicContact CB-CE1 4.28Å; I759-F761 HydrophobicContact CB-CE2 3.77Å; I759-F761 HydrophobicContact CB-CZ 3.73Å; I759-F761 HydrophobicContact CD1-CE1 4.42Å; I759-F761 HydrophobicContact CD1-CZ 3.82Å; I759-F761 HydrophobicContact CG1-CZ 4.4Å; I759-F761 HydrophobicContact CG2-CD1 3.87Å; I759-F761 HydrophobicContact CG2-CD2 4.14Å; I759-F761 HydrophobicContact CG2-CE1 3.56Å; I759-F761 HydrophobicContact CG2-CE2 3.85Å; I759-F761 HydrophobicContact CG2-CG 4.17Å; I759-F761 HydrophobicContact CG2-CZ 3.55Å; F761-R787 PolarHBondContact N-O 3.06Å; F761-V788 HydrophobicContact CB-CG2 4.28Å; F761-V788 HydrophobicContact CD2-CG2 4.37Å; F761-V788 WeakPolarHBondContact O-CA 3.42Å; F761-Q789 PolarHBondContact O-N 3.44Å
762	H	91.3	Very high	87.9	Confident	32 Å²	32	29.4 Å²	29.4	15%	0.148	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	-51.7	177	-175.3	-124.6	0	0	0	111.2	H649 N681 P684 H685 Q789 R790	H649-H762 AromaticContact NE2-CE1 3.66Å; N681-H762 PolarHBondContact ND2-CE1 2.8Å; P684-H762 PolarHBondContact O-N 2.81Å; H685-H762 AromaticContact CE1-ND1 3.83Å; H762-Q789 PolarHBondContact CD2-OE1 2.82Å; H762-R790 WeakPolarHBondContact O-CB 3.35Å; H762-R790 PolarHBondContact O-N 3.41Å
763	Y	94	Very high	87.5	Confident	7 Å²	7	30.7 Å²	30.7	3%	0.027	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142.2	168.9	-90.6	-96.8	0	0	0	111.8	H649 F672 L676 H685 L686 R790 L792	H649-Y763 WeakPolarHBondContact CB-OH 3.5Å; H649-Y763 AromaticContact CD2-CE2 3.75Å; H649-Y763 PolarHBondContact CD2-OH 3.42Å; F672-Y763 HydrophobicContact CE1-CD1 4Å; F672-Y763 HydrophobicContact CE1-CD2 4.5Å; F672-Y763 AromaticContact CE1-CE1 3.61Å; F672-Y763 HydrophobicContact CE1-CE1 3.61Å; F672-Y763 HydrophobicContact CE1-CE2 4.15Å; F672-Y763 HydrophobicContact CE1-CG 4.44Å; F672-Y763 AromaticContact CE1-CZ 3.71Å; F672-Y763 AromaticContact CZ-CE1 3.9Å; F672-Y763 HydrophobicContact CZ-CE1 3.9Å; F672-Y763 HydrophobicContact CZ-CE2 4.05Å; F672-Y763 AromaticContact CZ-CZ 3.56Å; L676-Y763 HydrophobicContact CD1-CD2 3.62Å; L676-Y763 HydrophobicContact CD1-CE2 3.64Å; L676-Y763 HydrophobicContact CD1-CG 4.42Å; H685-Y763 CarbonylContact C-O 3.37Å; H685-Y763 WeakPolarHBondContact CA-O 3.47Å; L686-Y763 PolarHBondContact N-O 3.08Å; Y763-R790 CarbonylContact C-O 3.55Å; Y763-R790 WeakPolarHBondContact CA-O 3.49Å; Y763-R790 HydrophobicContact CD1-CB 3.57Å; Y763-R790 HydrophobicContact CD2-CB 3.8Å; Y763-R790 HydrophobicContact CD2-CG 4.17Å; Y763-R790 HydrophobicContact CE1-CB 3.35Å; Y763-R790 HydrophobicContact CE1-CG 4.19Å; Y763-R790 HydrophobicContact CE2-CB 3.6Å; Y763-R790 HydrophobicContact CE2-CG 3.67Å; Y763-R790 HydrophobicContact CG-CB 3.78Å; Y763-L792 HydrophobicContact CD1-CB 4.46Å
764	G	94.2	Very high	87.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.9	159.6	0	0	0	0	0	109.3	L686 F766 V788 R790 L792	L686-G764 CarbonylContact O-C 3.56Å; L686-G764 WeakPolarHBondContact O-CA 3.31Å; G764-F766 WeakPolarHBondContact O-CD2 3.5Å; G764-F766 VanDerWaalsContact O-CE2 3.29Å; G764-F766 WeakPolarHBondContact O-CE2 3.31Å; G764-V788 VanDerWaalsContact N-CG1 3.3Å; G764-R790 PolarHBondContact N-O 3.2Å; G764-L792 PolarHBondContact O-N 3.07Å
765	I	95.7	Very high	86.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.4	172.8	-52.2	-173	0	0	0	107.6	A669 L673 L686 I687 I688 L792 L794	A669-I765 HydrophobicContact CB-CD1 4.26Å; L673-I765 HydrophobicContact CD1-CD1 3.75Å; L673-I765 HydrophobicContact CD2-CD1 4.21Å; L673-I765 HydrophobicContact CG-CD1 3.99Å; L686-I765 PolarHBondContact O-N 3.42Å; I687-I765 WeakPolarHBondContact CA-O 3.49Å; I687-I765 HydrophobicContact CG1-CB 4.35Å; I688-I765 PolarHBondContact N-O 2.86Å; I765-L792 WeakPolarHBondContact CA-O 3.41Å; I765-L792 HydrophobicContact CD1-CD2 4.34Å; I765-L792 HydrophobicContact CG1-CB 4.4Å; I765-L792 HydrophobicContact CG1-CD2 4.39Å; I765-L792 HydrophobicContact CG2-CD2 4.48Å; I765-L794 HydrophobicContact CG2-CD1 3.68Å; I765-L794 HydrophobicContact CG2-CD2 4.44Å; I765-L794 HydrophobicContact CG2-CG 3.89Å
766	F	94.5	Very high	86.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	104	-178.3	-56.3	-99.2	0	0	0	108.6	I688 G764 L772 L783 R791 L792 L793 L794 F812	I688-F766 HydrophobicContact CB-CD1 4.21Å; I688-F766 HydrophobicContact CD1-CD1 4.01Å; I688-F766 HydrophobicContact CD1-CE1 3.65Å; I688-F766 HydrophobicContact CG1-CD1 4.3Å; I688-F766 HydrophobicContact CG1-CE1 4.28Å; G764-F766 WeakPolarHBondContact O-CD2 3.5Å; G764-F766 VanDerWaalsContact O-CE2 3.29Å; G764-F766 WeakPolarHBondContact O-CE2 3.31Å; F766-L772 HydrophobicContact CB-CD1 4.39Å; F766-L783 HydrophobicContact CE1-CD2 4.46Å; F766-R791 HydrophobicContact CE2-CG 4.34Å; F766-L792 PolarHBondContact N-O 3.02Å; F766-L793 HydrophobicContact CB-CD2 3.67Å; F766-L793 HydrophobicContact CD2-CD2 4.04Å; F766-L793 HydrophobicContact CG-CD2 4.1Å; F766-L794 PolarHBondContact O-N 3.22Å; F766-F812 HydrophobicContact CD1-CE1 4.09Å; F766-F812 HydrophobicContact CD1-CZ 4.08Å; F766-F812 AromaticContact CD2-CE1 3.85Å; F766-F812 HydrophobicContact CD2-CE1 3.85Å; F766-F812 AromaticContact CE1-CE1 3.95Å; F766-F812 HydrophobicContact CE1-CE1 3.95Å; F766-F812 AromaticContact CE1-CZ 3.66Å; F766-F812 HydrophobicContact CE1-CZ 3.66Å; F766-F812 AromaticContact CE2-CE1 3.71Å; F766-F812 HydrophobicContact CE2-CE1 3.71Å; F766-F812 HydrophobicContact CE2-CZ 4.17Å; F766-F812 HydrophobicContact CG-CE1 4.05Å; F766-F812 AromaticContact CZ-CE1 3.76Å; F766-F812 HydrophobicContact CZ-CE1 3.76Å; F766-F812 AromaticContact CZ-CZ 3.72Å; F766-F812 HydrophobicContact CZ-CZ 3.72Å
767	D	92.9	Very high	86.5	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.064	18%	0.179	C	C	.	.	S	Bend	trans	-82.1	152.9	-179.3	-169.5	26.3	0	0	0	111.7	I688 C689 W697 Y743 A769 L794	I688-D767 PolarHBondContact O-N 2.77Å; C689-D767 HydrophobicContact CB-CB 3.97Å; W697-D767 HydrophobicContact CZ2-CB 4.01Å; W697-D767 PolarHBondContact NE1-OD2 3.11Å; Y743-D767 WeakPolarHBondContact CE2-O 3.33Å; Y743-D767 PolarHBondContact OH-O 3.28Å; D767-A769 VanDerWaalsContact C-N 3.33Å; D767-A769 PolarHBondContact O-N 3.08Å; D767-L794 HydrophobicContact CB-CD1 4.45Å
768	E	87.4	Confident	86.5	Confident	19 Å²	19	38.1 Å²	38.1	9%	0.089	19%	0.188	C	C	.	.	S	Bend	trans	43.1	56.4	-170	-74.3	-64.2	176.8	0	0	113	M661 P690 H770 M771 L794	M661-E768 WeakPolarHBondContact CE-OE1 3.28Å; P690-E768 HydrophobicContact CG-CB 3.79Å; P690-E768 HydrophobicContact CG-CG 4.08Å; E768-H770 PolarHBondContact O-N 2.93Å; E768-H770 IonicContact OE2-CE1 2.79Å; E768-H770 PolarHBondContact OE2-CE1 2.83Å; E768-H770 VanDerWaalsContact OE2-CE1 3.24Å; E768-H770 IonicContact OE2-ND1 3.25Å; E768-H770 PolarHBondContact OE2-ND1 2.88Å; E768-M771 VanDerWaalsContact O-CB 3.32Å; E768-M771 WeakPolarHBondContact O-CB 3.42Å; E768-M771 WeakPolarHBondContact O-CG 3.24Å; E768-M771 PolarHBondContact O-N 2.88Å; E768-L794 PolarHBondContact N-O 3.02Å
769	A	87.1	Confident	86.6	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.008	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-58.3	-11.7	-173.6	0	0	0	0	0	114.8	D767 M771 L772 L793 L794 L809	D767-A769 VanDerWaalsContact C-N 3.33Å; D767-A769 PolarHBondContact O-N 3.08Å; A769-M771 PolarHBondContact O-N 2.82Å; A769-M771 VanDerWaalsContact O-N 3.09Å; A769-L772 VanDerWaalsContact O-CB 3.29Å; A769-L772 WeakPolarHBondContact O-CB 3.49Å; A769-L772 PolarHBondContact O-N 2.91Å; A769-L793 HydrophobicContact CB-CB 3.87Å; A769-L793 HydrophobicContact CB-CD1 4.12Å; A769-L793 HydrophobicContact CB-CD2 4.04Å; A769-L793 HydrophobicContact CB-CG 4.23Å; A769-L794 WeakPolarHBondContact CB-O 3.26Å; A769-L794 PolarHBondContact N-O 3.48Å; A769-L809 HydrophobicContact CB-CD2 4.38Å; A769-L809 WeakPolarHBondContact O-CD2 3.41Å
770	H	80	Confident	86.7	Confident	25 Å²	25	34.3 Å²	34.3	12%	0.116	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-54.4	-23.7	165.3	80.4	-101.9	0	0	0	112.4	E768 L772 K773	E768-H770 PolarHBondContact O-N 2.93Å; E768-H770 IonicContact OE2-CE1 2.79Å; E768-H770 PolarHBondContact OE2-CE1 2.83Å; E768-H770 VanDerWaalsContact OE2-CE1 3.24Å; E768-H770 IonicContact OE2-ND1 3.25Å; E768-H770 PolarHBondContact OE2-ND1 2.88Å; H770-L772 PolarHBondContact O-N 3.03Å; H770-L772 VanDerWaalsContact O-N 3.15Å; H770-K773 WeakPolarHBondContact O-CB 3.37Å; H770-K773 WeakPolarHBondContact O-CD 3.29Å; H770-K773 WeakPolarHBondContact O-CG 3.49Å; H770-K773 PolarHBondContact O-N 2.89Å
771	M	81.1	Confident	86.6	Confident	59 Å²	59	36.8 Å²	36.8	29%	0.291	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-62.1	-10.6	169.4	-77.2	-70.1	111.4	0	0	114.9	Y743 E768 A769 R779	Y743-M771 HydrophobicContact CD2-CB 4.21Å; Y743-M771 HydrophobicContact CD2-CG 4.19Å; Y743-M771 HydrophobicContact CE1-CB 4.49Å; Y743-M771 HydrophobicContact CE2-CB 3.83Å; Y743-M771 HydrophobicContact CE2-CG 4.02Å; E768-M771 VanDerWaalsContact O-CB 3.32Å; E768-M771 WeakPolarHBondContact O-CB 3.42Å; E768-M771 WeakPolarHBondContact O-CG 3.24Å; E768-M771 PolarHBondContact O-N 2.88Å; A769-M771 PolarHBondContact O-N 2.82Å; A769-M771 VanDerWaalsContact O-N 3.09Å; M771-R779 PolarHBondContact O-NH1 3.27Å; M771-R779 PolarHBondContact SD-NH1 3.19Å
772	L	83.2	Confident	86.4	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-103.1	-7.1	179.3	-55.8	179.8	0	0	0	113.9	Y743 F766 A769 H770 N774 Y780 L783 L793 L809 F812	Y743-L772 HydrophobicContact CE1-CD2 3.98Å; F766-L772 HydrophobicContact CB-CD1 4.39Å; A769-L772 VanDerWaalsContact O-CB 3.29Å; A769-L772 WeakPolarHBondContact O-CB 3.49Å; A769-L772 PolarHBondContact O-N 2.91Å; H770-L772 PolarHBondContact O-N 3.03Å; H770-L772 VanDerWaalsContact O-N 3.15Å; L772-N774 PolarHBondContact O-N 3.42Å; L772-Y780 HydrophobicContact CB-CD2 4.36Å; L772-Y780 WeakPolarHBondContact O-CD2 3.4Å; L772-L783 HydrophobicContact CD2-CD1 3.46Å; L772-L783 VanDerWaalsContact CD2-CD1 3.46Å; L772-L793 HydrophobicContact CD1-CD2 3.81Å; L772-L809 HydrophobicContact CB-CD2 4.18Å; L772-F812 HydrophobicContact CD1-CD1 3.84Å; L772-F812 HydrophobicContact CD1-CD2 4.39Å; L772-F812 HydrophobicContact CD1-CE1 3.83Å; L772-F812 HydrophobicContact CD1-CE2 4.39Å; L772-F812 HydrophobicContact CD1-CG 4.12Å; L772-F812 HydrophobicContact CD1-CZ 4.12Å
773	K	78	Confident	86.3	Confident	27 Å²	27	36.4 Å²	36.4	12%	0.117	17%	0.174	C	C	.	.			trans	-61	4.3	-163.8	76.5	-173.7	-161.7	151.4	0	118.9	H770 N801 E805 S808 N1289	H770-K773 WeakPolarHBondContact O-CB 3.37Å; H770-K773 WeakPolarHBondContact O-CD 3.29Å; H770-K773 WeakPolarHBondContact O-CG 3.49Å; H770-K773 PolarHBondContact O-N 2.89Å; K773-N801 PolarHBondContact NZ-ND2 2.72Å; K773-E805 HydrophobicContact CB-CB 4.05Å; K773-E805 HydrophobicContact CB-CG 4.14Å; K773-E805 HydrophobicContact CD-CG 4.37Å; K773-E805 VanDerWaalsContact CD-OE1 3.29Å; K773-E805 WeakPolarHBondContact CD-OE1 3.44Å; K773-E805 WeakPolarHBondContact CE-OE1 3.27Å; K773-E805 HydrophobicContact CG-CG 4.42Å; K773-E805 IonicContact NZ-OE1 2.94Å; K773-E805 PolarHBondContact NZ-OE1 3.1Å; K773-E805 IonicContact NZ-OE2 2.95Å; K773-S808 VanDerWaalsContact C-OG 3.23Å; K773-S808 VanDerWaalsContact CA-OG 3.32Å; K773-S808 WeakPolarHBondContact CA-OG 3.28Å; K773-S808 PolarHBondContact O-OG 2.9Å; K773-N1289 VanDerWaalsContact CE-OD1 3.31Å; K773-N1289 WeakPolarHBondContact CE-OD1 3.43Å; K773-N1289 PolarHBondContact NZ-OD1 3.45Å
774	N	78.4	Confident	85.9	Confident	75 Å²	75	38.1 Å²	38.1	40%	0.401	18%	0.183	S	C	.	.			trans	-135.2	106	173.8	179	-1.9	0	0	0	110	L772 T776 S777	L772-N774 PolarHBondContact O-N 3.42Å; N774-T776 VanDerWaalsContact CG-OG1 3.32Å; N774-T776 PolarHBondContact ND2-OG1 3.07Å; N774-T776 PolarHBondContact O-N 3.33Å; N774-T776 WeakPolarHBondContact OD1-CB 3.23Å; N774-T776 PolarHBondContact OD1-N 2.95Å; N774-T776 PolarHBondContact OD1-OG1 2.89Å; N774-S777 WeakPolarHBondContact O-CB 3.25Å; N774-S777 PolarHBondContact O-N 2.95Å; N774-S777 PolarHBondContact O-OG 3.23Å
775	M	78.7	Confident	85.5	Confident	27 Å²	27	42.6 Å²	42.6	13%	0.133	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.3	-178.5	65.8	178.3	95.1	0	0	115	S777 Y780 V807 K826	M775-S777 PolarHBondContact O-N 2.9Å; M775-Y780 HydrophobicContact CB-CD1 3.77Å; M775-Y780 HydrophobicContact CB-CD2 4.23Å; M775-Y780 HydrophobicContact CB-CE1 3.55Å; M775-Y780 HydrophobicContact CB-CE2 4Å; M775-Y780 HydrophobicContact CB-CG 4.13Å; M775-Y780 WeakPolarHBondContact O-CD1 3.36Å; M775-V807 HydrophobicContact CE-CG1 4.14Å; M775-K826 HydrophobicContact CE-CG 4.4Å; M775-K826 HydrophobicContact SD-CD 4.41Å; M775-K826 WeakPolarHBondContact SD-CE 3.45Å
776	T	80.2	Confident	85.1	Confident	91 Å²	91	42.9 Å²	42.9	56%	0.558	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-18.7	172.6	69.5	0	0	0	0	112.3	N774 R781	N774-T776 VanDerWaalsContact CG-OG1 3.32Å; N774-T776 PolarHBondContact ND2-OG1 3.07Å; N774-T776 PolarHBondContact O-N 3.33Å; N774-T776 WeakPolarHBondContact OD1-CB 3.23Å; N774-T776 PolarHBondContact OD1-N 2.95Å; N774-T776 PolarHBondContact OD1-OG1 2.89Å; T776-R781 PolarHBondContact O-NE 3.13Å; T776-R781 PolarHBondContact O-NH2 3.37Å
777	S	83.9	Confident	84.7	Confident	34 Å²	34	49.9 Å²	49.9	24%	0.238	24%	0.235	C	C	.	.	S	Bend	trans	-62.3	146.1	-176.7	72.4	0	0	0	0	112.4	N774 M775 R779 Y780 R781	N774-S777 WeakPolarHBondContact O-CB 3.25Å; N774-S777 PolarHBondContact O-N 2.95Å; N774-S777 PolarHBondContact O-OG 3.23Å; M775-S777 PolarHBondContact O-N 2.9Å; S777-R779 PolarHBondContact O-N 3.12Å; S777-Y780 PolarHBondContact O-N 2.63Å; S777-Y780 VanDerWaalsContact OG-CB 3.27Å; S777-Y780 WeakPolarHBondContact OG-CB 3.26Å; S777-Y780 PolarHBondContact OG-N 2.89Å; S777-Y780 VanDerWaalsContact OG-N 3.16Å; S777-R781 PolarHBondContact O-N 3.21Å; S777-R781 VanDerWaalsContact O-N 3.14Å
778	Q	84.7	Confident	84.6	Confident	131 Å²	131	50.2 Å²	50.2	61%	0.612	24%	0.237	S	C	*	.	H	α-helix	trans	-63.9	-32.7	176.4	-170.2	-179	8.7	0	0	111.5	N782	Q778-N782 VanDerWaalsContact O-CB 3.29Å; Q778-N782 WeakPolarHBondContact O-CB 3.06Å; Q778-N782 VanDerWaalsContact O-CG 3.29Å; Q778-N782 PolarHBondContact O-N 3.31Å; Q778-N782 PolarHBondContact O-ND2 3.05Å
779	R	87.1	Confident	84.6	Confident	81 Å²	81	55.1 Å²	55.1	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-58.9	-55.6	173.5	-176.1	-167.9	-70.3	159	-11.5	111	Y743 T747 M771 S777 R781 N782 L783	Y743-R779 HydrophobicContact CD1-CG 4.48Å; T747-R779 HydrophobicContact CG2-CG 4.27Å; M771-R779 PolarHBondContact O-NH1 3.27Å; M771-R779 PolarHBondContact SD-NH1 3.19Å; S777-R779 PolarHBondContact O-N 3.12Å; R779-R781 VanDerWaalsContact C-N 3.34Å; R779-R781 PolarHBondContact O-N 2.91Å; R779-N782 PolarHBondContact O-N 3.1Å; R779-L783 HydrophobicContact CG-CD1 3.83Å; R779-L783 HydrophobicContact CG-CG 4.41Å; R779-L783 WeakPolarHBondContact O-CG 3.39Å; R779-L783 PolarHBondContact O-N 2.86Å
780	Y	88.2	Confident	84.8	Confident	7 Å²	7	57.3 Å²	57.3	3%	0.027	27%	0.268	C	S	.	.	H	α-helix	trans	-55.6	-49.6	179.1	-176.6	-82.5	0	0	0	111.3	L772 M775 S777 N782 L783 M784 S808 S811 F812	L772-Y780 HydrophobicContact CB-CD2 4.36Å; L772-Y780 WeakPolarHBondContact O-CD2 3.4Å; M775-Y780 HydrophobicContact CB-CD1 3.77Å; M775-Y780 HydrophobicContact CB-CD2 4.23Å; M775-Y780 HydrophobicContact CB-CE1 3.55Å; M775-Y780 HydrophobicContact CB-CE2 4Å; M775-Y780 HydrophobicContact CB-CG 4.13Å; M775-Y780 WeakPolarHBondContact O-CD1 3.36Å; S777-Y780 PolarHBondContact O-N 2.63Å; S777-Y780 VanDerWaalsContact OG-CB 3.27Å; S777-Y780 WeakPolarHBondContact OG-CB 3.26Å; S777-Y780 PolarHBondContact OG-N 2.89Å; S777-Y780 VanDerWaalsContact OG-N 3.16Å; Y780-N782 PolarHBondContact O-N 2.83Å; Y780-L783 PolarHBondContact O-N 3.01Å; Y780-M784 HydrophobicContact CD1-SD 4.4Å; Y780-M784 HydrophobicContact CE1-SD 3.61Å; Y780-M784 WeakPolarHBondContact O-CB 3.25Å; Y780-M784 PolarHBondContact O-N 3.12Å; Y780-S808 WeakPolarHBondContact CE2-O 3.4Å; Y780-S808 PolarHBondContact OH-O 3.35Å; Y780-S811 WeakPolarHBondContact OH-CB 3.43Å; Y780-F812 HydrophobicContact CD2-CD2 4.05Å; Y780-F812 HydrophobicContact CE2-CB 3.84Å; Y780-F812 AromaticContact CE2-CD2 3.75Å; Y780-F812 HydrophobicContact CE2-CD2 3.75Å; Y780-F812 HydrophobicContact CE2-CG 4.22Å; Y780-F812 PolarHBondContact OH-N 3Å
781	R	86.2	Confident	85.4	Confident	144 Å²	144	56.9 Å²	56.9	54%	0.543	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-37.2	178.4	-72.2	-176.1	-78.7	149.9	-10.1	113.2	T776 S777 R779 N785	T776-R781 PolarHBondContact O-NE 3.13Å; T776-R781 PolarHBondContact O-NH2 3.37Å; S777-R781 PolarHBondContact O-N 3.21Å; S777-R781 VanDerWaalsContact O-N 3.14Å; R779-R781 VanDerWaalsContact C-N 3.34Å; R779-R781 PolarHBondContact O-N 2.91Å; R781-N785 PolarHBondContact O-ND2 2.72Å
782	N	86.9	Confident	86	Confident	22 Å²	22	54.3 Å²	54.3	12%	0.118	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-45.9	174.4	-81.8	-27.9	0	0	0	111.8	T747 R753 Q778 R779 Y780 N785 F786	T747-N782 HydrophobicContact CG2-CB 3.99Å; T747-N782 PolarHBondContact O-ND2 2.86Å; R753-N782 VanDerWaalsContact CD-OD1 3.31Å; R753-N782 WeakPolarHBondContact CD-OD1 3.46Å; R753-N782 PolarHBondContact NH1-OD1 2.85Å; Q778-N782 VanDerWaalsContact O-CB 3.29Å; Q778-N782 WeakPolarHBondContact O-CB 3.06Å; Q778-N782 VanDerWaalsContact O-CG 3.29Å; Q778-N782 PolarHBondContact O-N 3.31Å; Q778-N782 PolarHBondContact O-ND2 3.05Å; R779-N782 PolarHBondContact O-N 3.1Å; Y780-N782 PolarHBondContact O-N 2.83Å; N782-N785 WeakPolarHBondContact O-CB 3.48Å; N782-N785 PolarHBondContact O-N 3.42Å; N782-F786 VanDerWaalsContact O-CD1 3.29Å; N782-F786 WeakPolarHBondContact O-CD1 3.14Å; N782-F786 WeakPolarHBondContact O-CE1 3.3Å
783	L	89.4	Confident	86.5	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-71.5	-36.3	-177.4	-66	174.5	0	0	0	113.1	I688 Y743 T747 F766 L772 R779 Y780 N785 F786 F812	I688-L783 HydrophobicContact CD1-CD2 3.54Å; Y743-L783 HydrophobicContact CD1-CD1 3.84Å; Y743-L783 HydrophobicContact CE1-CD1 3.82Å; T747-L783 HydrophobicContact CG2-CD1 4.5Å; T747-L783 HydrophobicContact CG2-CD2 3.55Å; T747-L783 HydrophobicContact CG2-CG 3.77Å; F766-L783 HydrophobicContact CE1-CD2 4.46Å; L772-L783 HydrophobicContact CD2-CD1 3.46Å; L772-L783 VanDerWaalsContact CD2-CD1 3.46Å; R779-L783 HydrophobicContact CG-CD1 3.83Å; R779-L783 HydrophobicContact CG-CG 4.41Å; R779-L783 WeakPolarHBondContact O-CG 3.39Å; R779-L783 PolarHBondContact O-N 2.86Å; Y780-L783 PolarHBondContact O-N 3.01Å; L783-N785 PolarHBondContact O-N 3.11Å; L783-N785 VanDerWaalsContact O-N 3.16Å; L783-F786 HydrophobicContact CD2-CD2 4.06Å; L783-F786 HydrophobicContact CD2-CE1 4.49Å; L783-F786 HydrophobicContact CD2-CE2 3.51Å; L783-F786 HydrophobicContact CD2-CZ 3.76Å; L783-F786 WeakPolarHBondContact O-CB 3.46Å; L783-F786 PolarHBondContact O-N 3.35Å; L783-F812 HydrophobicContact CB-CE2 3.88Å; L783-F812 HydrophobicContact CB-CZ 4.02Å
784	M	86.3	Confident	87.2	Confident	43 Å²	43	53 Å²	53	21%	0.212	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-26.8	178.1	-165.8	173.1	-162.5	0	0	112	Y780 R791 F812 P815 L819	Y780-M784 HydrophobicContact CD1-SD 4.4Å; Y780-M784 HydrophobicContact CE1-SD 3.61Å; Y780-M784 WeakPolarHBondContact O-CB 3.25Å; Y780-M784 PolarHBondContact O-N 3.12Å; M784-R791 PolarHBondContact O-NH2 2.92Å; M784-F812 HydrophobicContact CB-CE2 4.42Å; M784-P815 HydrophobicContact CE-CB 3.86Å; M784-P815 HydrophobicContact CE-CG 4.17Å; M784-L819 HydrophobicContact CE-CD1 4.34Å; M784-L819 HydrophobicContact CE-CD2 3.6Å; M784-L819 HydrophobicContact CE-CG 3.91Å
785	N	85.9	Confident	87.6	Confident	94 Å²	94	49.4 Å²	49.4	50%	0.503	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	0.4	176.6	-85.4	-74.5	0	0	0	114.9	R781 N782 L783	R781-N785 PolarHBondContact O-ND2 2.72Å; N782-N785 WeakPolarHBondContact O-CB 3.48Å; N782-N785 PolarHBondContact O-N 3.42Å; L783-N785 PolarHBondContact O-N 3.11Å; L783-N785 VanDerWaalsContact O-N 3.16Å
786	F	87.8	Confident	87.7	Confident	7 Å²	7	48.4 Å²	48.4	3%	0.031	22%	0.224	C	C	.	.	S	Bend	trans	-78.1	142.2	176.6	-70.9	6.6	0	0	0	110.7	L686 I688 G746 R753 M756 N782 L783 V788	L686-F786 HydrophobicContact CD2-CD2 3.85Å; L686-F786 HydrophobicContact CD2-CE2 4.3Å; I688-F786 HydrophobicContact CD1-CD2 4.23Å; I688-F786 HydrophobicContact CD1-CE2 3.82Å; G746-F786 WeakPolarHBondContact O-CZ 3.27Å; R753-F786 HydrophobicContact CG-CE1 4.46Å; M756-F786 HydrophobicContact CB-CD1 3.84Å; M756-F786 HydrophobicContact CB-CD2 3.99Å; M756-F786 HydrophobicContact CB-CE1 3.62Å; M756-F786 HydrophobicContact CB-CE2 3.76Å; M756-F786 HydrophobicContact CB-CG 4.03Å; M756-F786 HydrophobicContact CB-CZ 3.57Å; M756-F786 HydrophobicContact CG-CD2 4.47Å; M756-F786 HydrophobicContact CG-CE1 4.28Å; M756-F786 HydrophobicContact CG-CE2 3.85Å; M756-F786 HydrophobicContact CG-CZ 3.74Å; M756-F786 HydrophobicContact SD-CE2 4.28Å; N782-F786 VanDerWaalsContact O-CD1 3.29Å; N782-F786 WeakPolarHBondContact O-CD1 3.14Å; N782-F786 WeakPolarHBondContact O-CE1 3.3Å; L783-F786 HydrophobicContact CD2-CD2 4.06Å; L783-F786 HydrophobicContact CD2-CE1 4.49Å; L783-F786 HydrophobicContact CD2-CE2 3.51Å; L783-F786 HydrophobicContact CD2-CZ 3.76Å; L783-F786 WeakPolarHBondContact O-CB 3.46Å; L783-F786 PolarHBondContact O-N 3.35Å; F786-V788 HydrophobicContact CB-CG2 4Å; F786-V788 PolarHBondContact O-N 2.68Å
787	R	85.6	Confident	87.5	Confident	147 Å²	147	44.9 Å²	44.9	56%	0.555	20%	0.203	S	C	*	.			trans	-79.8	86.5	177.8	-70.2	-167.6	-179.2	169.6	-1.7	110.3	K757 N760 F761	K757-R787 VanDerWaalsContact O-CD 3.26Å; K757-R787 WeakPolarHBondContact O-CD 3.49Å; K757-R787 PolarHBondContact O-NE 2.69Å; N760-R787 WeakPolarHBondContact OD1-CD 3.45Å; N760-R787 PolarHBondContact OD1-NH1 2.67Å; F761-R787 PolarHBondContact N-O 3.06Å
788	V	89.7	Confident	86.8	Confident	18 Å²	18	43.7 Å²	43.7	11%	0.109	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	118.6	-177	173.3	0	0	0	0	108.3	L686 F761 G764 F786 R790 R791	L686-V788 HydrophobicContact CD2-CG2 4.32Å; F761-V788 HydrophobicContact CB-CG2 4.28Å; F761-V788 HydrophobicContact CD2-CG2 4.37Å; F761-V788 WeakPolarHBondContact O-CA 3.42Å; G764-V788 VanDerWaalsContact N-CG1 3.3Å; F786-V788 HydrophobicContact CB-CG2 4Å; F786-V788 PolarHBondContact O-N 2.68Å; V788-R790 WeakPolarHBondContact CG1-O 3.29Å; V788-R791 HydrophobicContact CG1-CG 3.8Å
789	Q	88.3	Confident	86.2	Confident	122 Å²	122	37.7 Å²	37.7	57%	0.57	17%	0.166	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	-51.3	-177.4	-65.3	177.9	-12.6	0	0	112	F761 H762	F761-Q789 PolarHBondContact O-N 3.44Å; H762-Q789 PolarHBondContact CD2-OE1 2.82Å
790	R	90.5	Very high	85.1	Confident	48 Å²	48	34.1 Å²	34.1	18%	0.181	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.7	176.9	-56.2	-65	174.6	-154	-7.6	111.8	Q652 N654 H762 Y763 G764 V788	Q652-R790 VanDerWaalsContact CD-NH2 3.25Å; Q652-R790 PolarHBondContact O-NH1 2.91Å; N654-R790 VanDerWaalsContact OD1-CA 3.29Å; N654-R790 WeakPolarHBondContact OD1-CA 3.45Å; H762-R790 WeakPolarHBondContact O-CB 3.35Å; H762-R790 PolarHBondContact O-N 3.41Å; Y763-R790 CarbonylContact C-O 3.55Å; Y763-R790 WeakPolarHBondContact CA-O 3.49Å; Y763-R790 HydrophobicContact CD1-CB 3.57Å; Y763-R790 HydrophobicContact CD2-CB 3.8Å; Y763-R790 HydrophobicContact CD2-CG 4.17Å; Y763-R790 HydrophobicContact CE1-CB 3.35Å; Y763-R790 HydrophobicContact CE1-CG 4.19Å; Y763-R790 HydrophobicContact CE2-CB 3.6Å; Y763-R790 HydrophobicContact CE2-CG 3.67Å; Y763-R790 HydrophobicContact CG-CB 3.78Å; G764-R790 PolarHBondContact N-O 3.2Å; V788-R790 WeakPolarHBondContact CG1-O 3.29Å
791	R	92.7	Very high	83.9	Confident	16 Å²	16	33.9 Å²	33.9	6%	0.06	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.5	-176.1	-64.3	-178.2	178.8	-164.5	-3.5	110.2	N654 G655 F766 M784 V788 F812	N654-R791 HydrophobicContact CB-CB 4.39Å; N654-R791 VanDerWaalsContact CB-O 3.31Å; N654-R791 WeakPolarHBondContact CB-O 3.44Å; N654-R791 PolarHBondContact OD1-N 2.52Å; G655-R791 PolarHBondContact N-O 3.03Å; F766-R791 HydrophobicContact CE2-CG 4.34Å; M784-R791 PolarHBondContact O-NH2 2.92Å; V788-R791 HydrophobicContact CG1-CG 3.8Å; R791-F812 WeakPolarHBondContact CD-O 3.43Å; R791-F812 PolarHBondContact NH1-O 3.09Å
792	L	94	Very high	82.9	Confident	4 Å²	4	27.4 Å²	27.4	2%	0.021	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.1	172.6	175.9	57.8	0	0	0	108.5	L645 F672 Y763 G764 I765 F766 L794	L645-L792 HydrophobicContact CD1-CD2 4.36Å; L645-L792 HydrophobicContact CD2-CD1 3.66Å; L645-L792 HydrophobicContact CD2-CD2 4.09Å; F672-L792 HydrophobicContact CD1-CD2 4.37Å; Y763-L792 HydrophobicContact CD1-CB 4.46Å; G764-L792 PolarHBondContact O-N 3.07Å; I765-L792 WeakPolarHBondContact CA-O 3.41Å; I765-L792 HydrophobicContact CD1-CD2 4.34Å; I765-L792 HydrophobicContact CG1-CB 4.4Å; I765-L792 HydrophobicContact CG1-CD2 4.39Å; I765-L792 HydrophobicContact CG2-CD2 4.48Å; F766-L792 PolarHBondContact N-O 3.02Å; L792-L794 HydrophobicContact CD1-CD2 4.24Å; L792-L794 HydrophobicContact CD2-CD2 4.05Å; L792-L794 HydrophobicContact CG-CD2 3.88Å
793	L	93.6	Very high	81.9	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.2	171.1	-63.7	-170.2	0	0	0	109.7	G655 I656 L657 F766 A769 L772 L809 F812 V813	G655-L793 PolarHBondContact O-N 3.47Å; I656-L793 CarbonylContact C-O 3.53Å; I656-L793 WeakPolarHBondContact CA-O 3.21Å; I656-L793 HydrophobicContact CB-CB 4.46Å; I656-L793 HydrophobicContact CG1-CB 4.25Å; I656-L793 HydrophobicContact CG1-CD1 4.37Å; I656-L793 HydrophobicContact CG2-CB 4.17Å; L657-L793 PolarHBondContact N-O 3.22Å; F766-L793 HydrophobicContact CB-CD2 3.67Å; F766-L793 HydrophobicContact CD2-CD2 4.04Å; F766-L793 HydrophobicContact CG-CD2 4.1Å; A769-L793 HydrophobicContact CB-CB 3.87Å; A769-L793 HydrophobicContact CB-CD1 4.12Å; A769-L793 HydrophobicContact CB-CD2 4.04Å; A769-L793 HydrophobicContact CB-CG 4.23Å; L772-L793 HydrophobicContact CD1-CD2 3.81Å; L793-L809 HydrophobicContact CD1-CB 4.08Å; L793-L809 HydrophobicContact CD1-CD2 4.09Å; L793-F812 HydrophobicContact CD2-CD1 3.89Å; L793-F812 HydrophobicContact CD2-CE1 4.1Å; L793-V813 HydrophobicContact CD1-CG2 3.41Å; L793-V813 VanDerWaalsContact CD1-CG2 3.41Å; L793-V813 HydrophobicContact CG-CG2 3.69Å
794	L	92.9	Very high	80.9	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.7	168.7	-44.9	177.4	0	0	0	108.4	L657 A669 W697 I765 F766 D767 E768 A769 L792	L657-L794 HydrophobicContact CB-CD2 3.83Å; L657-L794 HydrophobicContact CD2-CD2 4.14Å; A669-L794 HydrophobicContact CB-CD1 4.07Å; W697-L794 HydrophobicContact CH2-CD1 3.73Å; W697-L794 HydrophobicContact CZ2-CD1 3.7Å; I765-L794 HydrophobicContact CG2-CD1 3.68Å; I765-L794 HydrophobicContact CG2-CD2 4.44Å; I765-L794 HydrophobicContact CG2-CG 3.89Å; F766-L794 PolarHBondContact O-N 3.22Å; D767-L794 HydrophobicContact CB-CD1 4.45Å; E768-L794 PolarHBondContact N-O 3.02Å; A769-L794 WeakPolarHBondContact CB-O 3.26Å; A769-L794 PolarHBondContact N-O 3.48Å; L792-L794 HydrophobicContact CD1-CD2 4.24Å; L792-L794 HydrophobicContact CD2-CD2 4.05Å; L792-L794 HydrophobicContact CG-CD2 3.88Å
795	T	87.7	Confident	80.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.133	C	C	.	.			trans	-148.4	148.6	174.2	-172.1	0	0	0	0	111.3	I656 L657 A658 K665 T797 P798	I656-T795 HydrophobicContact CG2-CG2 4.21Å; L657-T795 PolarHBondContact O-N 3.16Å; A658-T795 HydrophobicContact CB-CG2 3.92Å; K665-T795 WeakPolarHBondContact CD-O 3.37Å; K665-T795 VanDerWaalsContact CE-C 3.48Å; K665-T795 WeakPolarHBondContact CE-O 3.32Å; K665-T795 PolarHBondContact NZ-O 3.08Å; K665-T795 VanDerWaalsContact NZ-O 3.13Å; T795-T797 VanDerWaalsContact OG1-C 3.26Å; T795-T797 PolarHBondContact OG1-N 3.34Å; T795-T797 PolarHBondContact OG1-O 2.67Å; T795-P798 HydrophobicContact CG2-CB 4.12Å
796	G	79.8	Confident	79.6	Confident	6 Å²	6	24.2 Å²	24.2	6%	0.062	11%	0.112	C	C	.	.	S	Bend	trans	-86.5	-14.9	162.5	0	0	0	0	0	113.6
797	T	75.6	Confident	79	Confident	18 Å²	18	24.1 Å²	24.1	11%	0.11	11%	0.112	C	C	.	.			trans	-142.6	94.4	-171.5	53.2	0	0	0	0	109.2	T795 L799 Q800 Y1169	T795-T797 VanDerWaalsContact OG1-C 3.26Å; T795-T797 PolarHBondContact OG1-N 3.34Å; T795-T797 PolarHBondContact OG1-O 2.67Å; T797-L799 VanDerWaalsContact C-N 3.29Å; T797-L799 PolarHBondContact O-N 3.38Å; T797-Q800 PolarHBondContact OG1-NE2 3.39Å; T797-Y1169 HydrophobicContact CG2-CD1 3.35Å; T797-Y1169 HydrophobicContact CG2-CE1 4.08Å; T797-Y1169 HydrophobicContact CG2-CG 4.03Å
798	P	70	Confident	78.7	Confident	9 Å²	9	17.2 Å²	17.2	6%	0.058	9%	0.086	C	C	.	.	S	Bend	trans	-73.3	-20.3	-177.6	28.8	-35.1	0	0	0	113.6	A658 T795 R872 T1217	A658-P798 HydrophobicContact CB-CB 4.04Å; A658-P798 HydrophobicContact CB-CG 4.13Å; T795-P798 HydrophobicContact CG2-CB 4.12Å; P798-R872 VanDerWaalsContact CD-NH1 3.28Å; P798-T1217 HydrophobicContact CG-CG2 4.25Å
799	L	72.7	Confident	78.3	Confident	4 Å²	4	16.5 Å²	16.5	2%	0.021	8%	0.081	C	C	.	.			trans	-132.6	144.9	173.2	-164.8	79.1	0	0	0	107.8	T797 N802 L803 L806 M1212 V1216	T797-L799 VanDerWaalsContact C-N 3.29Å; T797-L799 PolarHBondContact O-N 3.38Å; L799-N802 WeakPolarHBondContact CD1-O 3.29Å; L799-L803 HydrophobicContact CD1-CD2 4.27Å; L799-L806 HydrophobicContact CD1-CB 4.19Å; L799-M1212 HydrophobicContact CD2-CG 4.18Å; L799-M1212 HydrophobicContact CD2-SD 4.47Å; L799-V1216 HydrophobicContact CD2-CB 4.02Å; L799-V1216 HydrophobicContact CD2-CG1 4.24Å; L799-V1216 HydrophobicContact CD2-CG2 3.82Å
800	Q	62.8	Low	77.8	Confident	7 Å²	7	11.6 Å²	11.6	3%	0.033	6%	0.059	C	C	.	.	S	Bend	trans	-130	-38	173.1	-66.5	-176.2	-19.1	0	0	113.5	T797 E805 Y1169	T797-Q800 PolarHBondContact OG1-NE2 3.39Å; Q800-E805 PolarHBondContact N-OE2 2.88Å; Q800-E805 VanDerWaalsContact N-OE2 3.14Å; Q800-Y1169 HydrophobicContact CB-CD2 3.91Å; Q800-Y1169 HydrophobicContact CB-CE2 4.05Å; Q800-Y1169 HydrophobicContact CG-CD2 3.93Å; Q800-Y1169 HydrophobicContact CG-CE2 4.36Å; Q800-Y1169 HydrophobicContact CG-CG 4.15Å; Q800-Y1169 WeakPolarHBondContact O-CE2 3.41Å
801	N	62.8	Low	77.4	Confident	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.05	C	C	.	.	S	Bend	trans	-141.2	-30.6	-175.3	-56.7	-102.4	0	0	0	113.9	K773 E805 K1209 I1286	K773-N801 PolarHBondContact NZ-ND2 2.72Å; N801-E805 PolarHBondContact N-OE2 3.16Å; N801-K1209 WeakPolarHBondContact OD1-CE 3.28Å; N801-K1209 PolarHBondContact OD1-NZ 3.42Å; N801-I1286 CarbonylContact C-O 3.58Å; N801-I1286 VanDerWaalsContact CB-O 3.31Å; N801-I1286 WeakPolarHBondContact CB-O 3.28Å
802	N	65.4	Low	77	Confident	9 Å²	9	8.6 Å²	8.6	5%	0.048	5%	0.048	C	C	.	.			trans	-156.4	144.9	-171	-164.8	-62.5	0	0	0	112.6	L799 L804 E805	L799-N802 WeakPolarHBondContact CD1-O 3.29Å; N802-L804 PolarHBondContact O-N 3.46Å; N802-L804 VanDerWaalsContact O-N 3.13Å; N802-L804 WeakPolarHBondContact OD1-CB 3.42Å; N802-L804 WeakPolarHBondContact OD1-CD1 3.34Å; N802-L804 VanDerWaalsContact OD1-CG 3.29Å; N802-L804 WeakPolarHBondContact OD1-CG 3.19Å; N802-L804 PolarHBondContact OD1-N 2.97Å; N802-E805 HydrophobicContact CB-CG 4.47Å; N802-E805 PolarHBondContact N-OE2 3.4Å; N802-E805 WeakPolarHBondContact O-CB 3.45Å; N802-E805 WeakPolarHBondContact O-CG 3.22Å; N802-E805 PolarHBondContact O-N 2.95Å
803	L	66.8	Low	76.5	Confident	33 Å²	33	8.4 Å²	8.4	17%	0.173	5%	0.047	C	C	.	.	H	α-helix	trans	-58.1	-22.8	174.2	-62	172.7	0	0	0	113.5	L799 E805 L806 V807 F829 V1216	L799-L803 HydrophobicContact CD1-CD2 4.27Å; L803-E805 PolarHBondContact O-N 2.86Å; L803-L806 VanDerWaalsContact O-CB 3.29Å; L803-L806 WeakPolarHBondContact O-CB 3.46Å; L803-L806 PolarHBondContact O-N 3.47Å; L803-V807 WeakPolarHBondContact O-CG2 3.48Å; L803-V807 PolarHBondContact O-N 3.26Å; L803-V807 VanDerWaalsContact O-N 3.09Å; L803-F829 HydrophobicContact CB-CD1 3.49Å; L803-F829 VanDerWaalsContact CB-CD1 3.49Å; L803-F829 HydrophobicContact CB-CE1 3.94Å; L803-F829 HydrophobicContact CB-CG 4.37Å; L803-F829 HydrophobicContact CD1-CD1 3.93Å; L803-F829 HydrophobicContact CD1-CE1 4.02Å; L803-F829 HydrophobicContact CG-CD1 4.33Å; L803-V1216 HydrophobicContact CD2-CG1 4.41Å; L803-V1216 HydrophobicContact CD2-CG2 3.84Å
804	L	68.7	Low	75.8	Confident	39 Å²	39	9.2 Å²	9.2	20%	0.204	5%	0.051	C	C	.	.	H	α-helix	trans	-61.9	-27.8	170.3	-69.8	164.2	0	0	0	113.4	N802 S808 F829 Q830	N802-L804 PolarHBondContact O-N 3.46Å; N802-L804 VanDerWaalsContact O-N 3.13Å; N802-L804 WeakPolarHBondContact OD1-CB 3.42Å; N802-L804 WeakPolarHBondContact OD1-CD1 3.34Å; N802-L804 VanDerWaalsContact OD1-CG 3.29Å; N802-L804 WeakPolarHBondContact OD1-CG 3.19Å; N802-L804 PolarHBondContact OD1-N 2.97Å; L804-S808 PolarHBondContact O-N 2.97Å; L804-S808 VanDerWaalsContact O-N 3.16Å; L804-F829 HydrophobicContact CD2-CB 3.63Å; L804-F829 HydrophobicContact CG-CB 3.99Å; L804-Q830 HydrophobicContact CD1-CG 3.67Å; L804-Q830 HydrophobicContact CD2-CG 4.15Å
805	E	72.8	Confident	75.1	Confident	12 Å²	12	10.4 Å²	10.4	6%	0.056	6%	0.058	C	C	.	.	H	α-helix	trans	-65.6	-46.1	174.2	-61	-177.6	146.5	0	0	109.5	K773 Q800 N801 N802 L803 V807 S808 L809	K773-E805 HydrophobicContact CB-CB 4.05Å; K773-E805 HydrophobicContact CB-CG 4.14Å; K773-E805 HydrophobicContact CD-CG 4.37Å; K773-E805 VanDerWaalsContact CD-OE1 3.29Å; K773-E805 WeakPolarHBondContact CD-OE1 3.44Å; K773-E805 WeakPolarHBondContact CE-OE1 3.27Å; K773-E805 HydrophobicContact CG-CG 4.42Å; K773-E805 IonicContact NZ-OE1 2.94Å; K773-E805 PolarHBondContact NZ-OE1 3.1Å; K773-E805 IonicContact NZ-OE2 2.95Å; Q800-E805 PolarHBondContact N-OE2 2.88Å; Q800-E805 VanDerWaalsContact N-OE2 3.14Å; N801-E805 PolarHBondContact N-OE2 3.16Å; N802-E805 HydrophobicContact CB-CG 4.47Å; N802-E805 PolarHBondContact N-OE2 3.4Å; N802-E805 WeakPolarHBondContact O-CB 3.45Å; N802-E805 WeakPolarHBondContact O-CG 3.22Å; N802-E805 PolarHBondContact O-N 2.95Å; L803-E805 PolarHBondContact O-N 2.86Å; E805-V807 PolarHBondContact O-N 2.94Å; E805-S808 WeakPolarHBondContact O-CB 3.45Å; E805-S808 PolarHBondContact O-N 2.72Å; E805-S808 VanDerWaalsContact O-N 3.08Å; E805-S808 PolarHBondContact O-OG 3.02Å; E805-L809 PolarHBondContact O-N 3.22Å; E805-L809 VanDerWaalsContact O-N 3.1Å
806	L	72.4	Confident	74.3	Confident	9 Å²	9	19.2 Å²	19.2	5%	0.047	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-45.1	175.4	-174.9	74.6	0	0	0	112.4	L799 L803 S808 L809 L810 L866	L799-L806 HydrophobicContact CD1-CB 4.19Å; L803-L806 VanDerWaalsContact O-CB 3.29Å; L803-L806 WeakPolarHBondContact O-CB 3.46Å; L803-L806 PolarHBondContact O-N 3.47Å; L806-S808 PolarHBondContact O-N 3.01Å; L806-L809 PolarHBondContact O-N 3.42Å; L806-L809 VanDerWaalsContact O-N 3.1Å; L806-L810 HydrophobicContact CG-CD1 4.48Å; L806-L810 PolarHBondContact O-N 3.48Å; L806-L866 HydrophobicContact CD1-CD1 3.99Å; L806-L866 HydrophobicContact CD1-CD2 3.66Å; L806-L866 HydrophobicContact CD1-CG 4.45Å; L806-L866 HydrophobicContact CD2-CD1 3.75Å; L806-L866 HydrophobicContact CD2-CD2 3.97Å; L806-L866 HydrophobicContact CD2-CG 4.21Å; L806-L866 HydrophobicContact CG-CD1 4.42Å; L806-L866 HydrophobicContact CG-CD2 3.99Å
807	V	73.2	Confident	73.8	Confident	5 Å²	5	19.9 Å²	19.9	3%	0.03	10%	0.101	C	C	.	.	H	α-helix	trans	-57.6	-38.3	174.1	176.9	0	0	0	0	111.2	M775 L803 E805 S811 L825 F829	M775-V807 HydrophobicContact CE-CG1 4.14Å; L803-V807 WeakPolarHBondContact O-CG2 3.48Å; L803-V807 PolarHBondContact O-N 3.26Å; L803-V807 VanDerWaalsContact O-N 3.09Å; E805-V807 PolarHBondContact O-N 2.94Å; V807-S811 VanDerWaalsContact O-CB 3.23Å; V807-S811 WeakPolarHBondContact O-CB 3.35Å; V807-S811 PolarHBondContact O-N 2.75Å; V807-S811 PolarHBondContact O-OG 3.26Å; V807-L825 HydrophobicContact CG1-CB 3.88Å; V807-L825 HydrophobicContact CG1-CD1 4.37Å; V807-F829 HydrophobicContact CG2-CB 4.39Å; V807-F829 HydrophobicContact CG2-CD2 3.3Å; V807-F829 HydrophobicContact CG2-CE2 3.56Å; V807-F829 HydrophobicContact CG2-CG 3.85Å; V807-F829 HydrophobicContact CG2-CZ 4.29Å
808	S	79.8	Confident	73.4	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.007	10%	0.099	C	C	.	.	H	α-helix	trans	-68.9	-34.6	177.2	80.5	0	0	0	0	113	K773 Y780 L804 E805 L806 F812	K773-S808 VanDerWaalsContact C-OG 3.23Å; K773-S808 VanDerWaalsContact CA-OG 3.32Å; K773-S808 WeakPolarHBondContact CA-OG 3.28Å; K773-S808 PolarHBondContact O-OG 2.9Å; Y780-S808 WeakPolarHBondContact CE2-O 3.4Å; Y780-S808 PolarHBondContact OH-O 3.35Å; L804-S808 PolarHBondContact O-N 2.97Å; L804-S808 VanDerWaalsContact O-N 3.16Å; E805-S808 WeakPolarHBondContact O-CB 3.45Å; E805-S808 PolarHBondContact O-N 2.72Å; E805-S808 VanDerWaalsContact O-N 3.08Å; E805-S808 PolarHBondContact O-OG 3.02Å; L806-S808 PolarHBondContact O-N 3.01Å; S808-F812 WeakPolarHBondContact O-CB 3.31Å; S808-F812 PolarHBondContact O-N 3.07Å
809	L	82	Confident	73.2	Confident	4 Å²	4	23.7 Å²	23.7	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-68	-50.5	173.6	-59.5	-179.5	0	0	0	110.7	I656 A769 L772 L793 E805 L806 S811 F812 V813	I656-L809 HydrophobicContact CD1-CB 4.39Å; A769-L809 HydrophobicContact CB-CD2 4.38Å; A769-L809 WeakPolarHBondContact O-CD2 3.41Å; L772-L809 HydrophobicContact CB-CD2 4.18Å; L793-L809 HydrophobicContact CD1-CB 4.08Å; L793-L809 HydrophobicContact CD1-CD2 4.09Å; E805-L809 PolarHBondContact O-N 3.22Å; E805-L809 VanDerWaalsContact O-N 3.1Å; L806-L809 PolarHBondContact O-N 3.42Å; L806-L809 VanDerWaalsContact O-N 3.1Å; L809-S811 VanDerWaalsContact C-N 3.3Å; L809-S811 PolarHBondContact O-N 3.2Å; L809-F812 WeakPolarHBondContact O-CA 3.46Å; L809-F812 WeakPolarHBondContact O-CB 3.45Å; L809-F812 PolarHBondContact O-N 3.09Å; L809-V813 VanDerWaalsContact O-CG2 3.29Å; L809-V813 WeakPolarHBondContact O-CG2 3.2Å; L809-V813 PolarHBondContact O-N 2.75Å
810	L	78.2	Confident	72.7	Confident	18 Å²	18	33.3 Å²	33.3	9%	0.094	16%	0.161	C	C	.	.	H	α-helix	trans	-56.9	-42.4	176.4	-72.2	172.9	0	0	0	112.5	L806 F812 V813 M814 F818 L866	L806-L810 HydrophobicContact CG-CD1 4.48Å; L806-L810 PolarHBondContact O-N 3.48Å; L810-F812 PolarHBondContact O-N 2.76Å; L810-V813 PolarHBondContact O-N 2.66Å; L810-M814 PolarHBondContact O-N 3.4Å; L810-F818 HydrophobicContact CB-CD2 4.34Å; L810-F818 HydrophobicContact CB-CE2 4.16Å; L810-L866 HydrophobicContact CD1-CD2 3.96Å; L810-L866 HydrophobicContact CD2-CD2 4.08Å; L810-L866 HydrophobicContact CG-CD2 4.27Å
811	S	81.2	Confident	72.6	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-20.9	176.4	-58.6	0	0	0	0	113.8	Y780 V807 L809	Y780-S811 WeakPolarHBondContact OH-CB 3.43Å; V807-S811 VanDerWaalsContact O-CB 3.23Å; V807-S811 WeakPolarHBondContact O-CB 3.35Å; V807-S811 PolarHBondContact O-N 2.75Å; V807-S811 PolarHBondContact O-OG 3.26Å; L809-S811 VanDerWaalsContact C-N 3.3Å; L809-S811 PolarHBondContact O-N 3.2Å
812	F	85.2	Confident	72.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-88.6	-35.2	175	-168.5	-88.4	0	0	0	112.5	F766 L772 Y780 L783 M784 R791 L793 S808 L809 L810	F766-F812 HydrophobicContact CD1-CE1 4.09Å; F766-F812 HydrophobicContact CD1-CZ 4.08Å; F766-F812 AromaticContact CD2-CE1 3.85Å; F766-F812 HydrophobicContact CD2-CE1 3.85Å; F766-F812 AromaticContact CE1-CE1 3.95Å; F766-F812 HydrophobicContact CE1-CE1 3.95Å; F766-F812 AromaticContact CE1-CZ 3.66Å; F766-F812 HydrophobicContact CE1-CZ 3.66Å; F766-F812 AromaticContact CE2-CE1 3.71Å; F766-F812 HydrophobicContact CE2-CE1 3.71Å; F766-F812 HydrophobicContact CE2-CZ 4.17Å; F766-F812 HydrophobicContact CG-CE1 4.05Å; F766-F812 AromaticContact CZ-CE1 3.76Å; F766-F812 HydrophobicContact CZ-CE1 3.76Å; F766-F812 AromaticContact CZ-CZ 3.72Å; F766-F812 HydrophobicContact CZ-CZ 3.72Å; L772-F812 HydrophobicContact CD1-CD1 3.84Å; L772-F812 HydrophobicContact CD1-CD2 4.39Å; L772-F812 HydrophobicContact CD1-CE1 3.83Å; L772-F812 HydrophobicContact CD1-CE2 4.39Å; L772-F812 HydrophobicContact CD1-CG 4.12Å; L772-F812 HydrophobicContact CD1-CZ 4.12Å; Y780-F812 HydrophobicContact CD2-CD2 4.05Å; Y780-F812 HydrophobicContact CE2-CB 3.84Å; Y780-F812 AromaticContact CE2-CD2 3.75Å; Y780-F812 HydrophobicContact CE2-CD2 3.75Å; Y780-F812 HydrophobicContact CE2-CG 4.22Å; Y780-F812 PolarHBondContact OH-N 3Å; L783-F812 HydrophobicContact CB-CE2 3.88Å; L783-F812 HydrophobicContact CB-CZ 4.02Å; M784-F812 HydrophobicContact CB-CE2 4.42Å; R791-F812 WeakPolarHBondContact CD-O 3.43Å; R791-F812 PolarHBondContact NH1-O 3.09Å; L793-F812 HydrophobicContact CD2-CD1 3.89Å; L793-F812 HydrophobicContact CD2-CE1 4.1Å; S808-F812 WeakPolarHBondContact O-CB 3.31Å; S808-F812 PolarHBondContact O-N 3.07Å; L809-F812 WeakPolarHBondContact O-CA 3.46Å; L809-F812 WeakPolarHBondContact O-CB 3.45Å; L809-F812 PolarHBondContact O-N 3.09Å; L810-F812 PolarHBondContact O-N 2.76Å
813	V	83.8	Confident	72.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-70	-47.9	177	176.7	0	0	0	0	111.1	N654 I656 L793 L809 L810 P815	N654-V813 VanDerWaalsContact C-CG1 3.5Å; N654-V813 HydrophobicContact CB-CG1 3.52Å; N654-V813 VanDerWaalsContact CB-O 3.32Å; N654-V813 WeakPolarHBondContact CB-O 3.39Å; N654-V813 PolarHBondContact ND2-O 3.39Å; N654-V813 WeakPolarHBondContact O-CG1 3.32Å; I656-V813 HydrophobicContact CD1-CG2 4.06Å; I656-V813 HydrophobicContact CG1-CG2 3.76Å; L793-V813 HydrophobicContact CD1-CG2 3.41Å; L793-V813 VanDerWaalsContact CD1-CG2 3.41Å; L793-V813 HydrophobicContact CG-CG2 3.69Å; L809-V813 VanDerWaalsContact O-CG2 3.29Å; L809-V813 WeakPolarHBondContact O-CG2 3.2Å; L809-V813 PolarHBondContact O-N 2.75Å; L810-V813 PolarHBondContact O-N 2.66Å; V813-P815 WeakPolarHBondContact O-CD 3.49Å
814	M	78.4	Confident	72.3	Confident	18 Å²	18	39.1 Å²	39.1	9%	0.089	19%	0.194	C	C	.	.			trans	-124.1	72.3	179.6	-73	174.3	-82.4	0	0	112.3	L810 E816 M817 F818 F869	L810-M814 PolarHBondContact O-N 3.4Å; M814-E816 VanDerWaalsContact C-N 3.29Å; M814-E816 PolarHBondContact O-N 3.02Å; M814-M817 HydrophobicContact CB-CB 4.33Å; M814-M817 PolarHBondContact O-N 3.16Å; M814-M817 HydrophobicContact SD-CE 4.49Å; M814-M817 HydrophobicContact SD-SD 3.75Å; M814-F818 HydrophobicContact CB-CD2 4.01Å; M814-F818 HydrophobicContact CB-CE2 4.12Å; M814-F818 HydrophobicContact CE-CE2 4.13Å; M814-F818 WeakPolarHBondContact O-CD2 3.34Å; M814-F818 PolarHBondContact O-N 3.03Å; M814-F869 HydrophobicContact CE-CB 4.31Å; M814-F869 HydrophobicContact CE-CD1 3.65Å; M814-F869 HydrophobicContact CE-CD2 3.54Å; M814-F869 HydrophobicContact CE-CE1 3.77Å; M814-F869 HydrophobicContact CE-CE2 3.67Å; M814-F869 HydrophobicContact CE-CG 3.54Å; M814-F869 HydrophobicContact CE-CZ 3.79Å; M814-F869 HydrophobicContact SD-CD1 4.2Å; M814-F869 HydrophobicContact SD-CE1 3.84Å; M814-F869 HydrophobicContact SD-CE2 4.41Å; M814-F869 HydrophobicContact SD-CZ 3.96Å
815	P	77.1	Confident	72	Confident	24 Å²	24	37.9 Å²	37.9	16%	0.156	19%	0.188	C	C	.	.	H	α-helix	trans	-53.6	-43	178.9	-27.6	36.2	0	0	0	113.5	M784 V813 M817 F818 L819	M784-P815 HydrophobicContact CE-CB 3.86Å; M784-P815 HydrophobicContact CE-CG 4.17Å; V813-P815 WeakPolarHBondContact O-CD 3.49Å; P815-M817 VanDerWaalsContact C-N 3.28Å; P815-M817 PolarHBondContact O-N 3.36Å; P815-F818 PolarHBondContact O-N 2.92Å; P815-L819 HydrophobicContact CB-CD1 3.87Å; P815-L819 HydrophobicContact CB-CG 4.23Å; P815-L819 WeakPolarHBondContact O-CB 3.36Å; P815-L819 WeakPolarHBondContact O-CD1 3.4Å; P815-L819 WeakPolarHBondContact O-CG 3.49Å; P815-L819 PolarHBondContact O-N 3.35Å
816	E	71.6	Confident	71.7	Confident	186 Å²	186	39.5 Å²	39.5	87%	0.869	20%	0.195	S	C	*	.	H	α-helix	trans	-64.8	-28.6	-174.8	-58.8	-168	164.4	0	0	114.1	M814	M814-E816 VanDerWaalsContact C-N 3.29Å; M814-E816 PolarHBondContact O-N 3.02Å
817	M	68.4	Low	71.1	Confident	20 Å²	20	45.4 Å²	45.4	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-83.2	-41.8	177.1	-72	177	57.2	0	0	111.6	L562 K565 C566 L569 M814 P815	L562-M817 WeakPolarHBondContact CD2-O 3.43Å; K565-M817 HydrophobicContact CB-CE 4.47Å; K565-M817 HydrophobicContact CD-CE 4.16Å; K565-M817 HydrophobicContact CD-CG 4.36Å; K565-M817 HydrophobicContact CD-SD 4.48Å; K565-M817 HydrophobicContact CG-CE 4.08Å; C566-M817 WeakPolarHBondContact SG-CE 3.44Å; L569-M817 HydrophobicContact CD1-CE 3.95Å; L569-M817 HydrophobicContact CD1-SD 3.69Å; M814-M817 HydrophobicContact CB-CB 4.33Å; M814-M817 PolarHBondContact O-N 3.16Å; M814-M817 HydrophobicContact SD-CE 4.49Å; M814-M817 HydrophobicContact SD-SD 3.75Å; P815-M817 VanDerWaalsContact C-N 3.28Å; P815-M817 PolarHBondContact O-N 3.36Å
818	F	68	Low	70.4	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.053	22%	0.217	C	C	.	.	H	α-helix	trans	-99.9	-21.7	-167.8	-66.3	-65.7	0	0	0	115.1	L562 L810 M814 P815 K820 S821 T822 L825	L562-F818 HydrophobicContact CD1-CD1 4.23Å; L562-F818 HydrophobicContact CD1-CE1 4.23Å; L810-F818 HydrophobicContact CB-CD2 4.34Å; L810-F818 HydrophobicContact CB-CE2 4.16Å; M814-F818 HydrophobicContact CB-CD2 4.01Å; M814-F818 HydrophobicContact CB-CE2 4.12Å; M814-F818 HydrophobicContact CE-CE2 4.13Å; M814-F818 WeakPolarHBondContact O-CD2 3.34Å; M814-F818 PolarHBondContact O-N 3.03Å; P815-F818 PolarHBondContact O-N 2.92Å; F818-K820 PolarHBondContact O-N 2.99Å; F818-S821 CarbonylContact O-C 3.29Å; F818-S821 WeakPolarHBondContact O-CA 3.23Å; F818-S821 PolarHBondContact O-N 2.86Å; F818-T822 VanDerWaalsContact O-CG2 3.28Å; F818-T822 WeakPolarHBondContact O-CG2 3.27Å; F818-T822 PolarHBondContact O-N 3.47Å; F818-L825 HydrophobicContact CD1-CD1 3.63Å; F818-L825 HydrophobicContact CE1-CD1 4.18Å
819	L	64.9	Low	69.5	Low	94 Å²	94	46.7 Å²	46.7	49%	0.492	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-48.3	-52.4	-176	-92.9	166.7	0	0	0	113.1	M784 P815 S821 T822	M784-L819 HydrophobicContact CE-CD1 4.34Å; M784-L819 HydrophobicContact CE-CD2 3.6Å; M784-L819 HydrophobicContact CE-CG 3.91Å; P815-L819 HydrophobicContact CB-CD1 3.87Å; P815-L819 HydrophobicContact CB-CG 4.23Å; P815-L819 WeakPolarHBondContact O-CB 3.36Å; P815-L819 WeakPolarHBondContact O-CD1 3.4Å; P815-L819 WeakPolarHBondContact O-CG 3.49Å; P815-L819 PolarHBondContact O-N 3.35Å; L819-S821 PolarHBondContact O-N 3.12Å; L819-T822 PolarHBondContact O-N 3.37Å; L819-T822 PolarHBondContact O-OG1 3.04Å
820	K	63.1	Low	68.5	Low	207 Å²	207	51.1 Å²	51.1	90%	0.9	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-62.4	-25.5	-179.7	-64.3	-171.9	177.8	-173	0	113.5	F818	F818-K820 PolarHBondContact O-N 2.99Å
821	S	60.2	Low	67.3	Low	17 Å²	17	53 Å²	53	12%	0.119	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-110.9	8.4	-173.7	-51.2	0	0	0	0	112.8	F818 L819 D823 L824 L825	F818-S821 CarbonylContact O-C 3.29Å; F818-S821 WeakPolarHBondContact O-CA 3.23Å; F818-S821 PolarHBondContact O-N 2.86Å; L819-S821 PolarHBondContact O-N 3.12Å; S821-D823 PolarHBondContact O-N 3.01Å; S821-L824 WeakPolarHBondContact O-CB 3.44Å; S821-L824 PolarHBondContact O-N 2.98Å; S821-L825 WeakPolarHBondContact O-CB 3.47Å; S821-L825 VanDerWaalsContact O-CG 3.32Å; S821-L825 WeakPolarHBondContact O-CG 3.28Å; S821-L825 PolarHBondContact O-N 3.03Å
822	T	65.2	Low	65.9	Low	19 Å²	19	56.1 Å²	56.1	12%	0.117	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-41	-175.8	54	0	0	0	0	112.8	F818 L819 K826	F818-T822 VanDerWaalsContact O-CG2 3.28Å; F818-T822 WeakPolarHBondContact O-CG2 3.27Å; F818-T822 PolarHBondContact O-N 3.47Å; L819-T822 PolarHBondContact O-N 3.37Å; L819-T822 PolarHBondContact O-OG1 3.04Å; T822-K826 WeakPolarHBondContact O-CB 3.27Å; T822-K826 WeakPolarHBondContact O-CE 3.37Å; T822-K826 WeakPolarHBondContact O-CG 3.23Å; T822-K826 PolarHBondContact O-N 3.06Å
823	D	64.9	Low	64.4	Low	103 Å²	103	57.5 Å²	57.5	55%	0.551	27%	0.274	S	S	*	.	H	α-helix	trans	-73.2	-33.9	177.3	-71.1	-62.6	0	0	0	112.9	S821 K826 R827	S821-D823 PolarHBondContact O-N 3.01Å; D823-K826 VanDerWaalsContact CG-NZ 3.3Å; D823-K826 WeakPolarHBondContact O-CB 3.37Å; D823-K826 PolarHBondContact O-N 3.1Å; D823-K826 WeakPolarHBondContact OD1-CD 3.38Å; D823-K826 IonicContact OD1-NZ 3.78Å; D823-K826 PolarHBondContact OD1-NZ 2.83Å; D823-K826 IonicContact OD2-NZ 2.68Å; D823-R827 WeakPolarHBondContact O-CG 3.29Å; D823-R827 PolarHBondContact O-N 3.19Å
824	L	60.1	Low	62.7	Low	32 Å²	32	64.7 Å²	64.7	17%	0.168	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-50.7	172.4	-177.3	139.1	0	0	0	110.4	V555 V559 S821 K826 R827 I828	V555-L824 HydrophobicContact CB-CD1 4.46Å; V555-L824 HydrophobicContact CB-CG 4.41Å; V555-L824 HydrophobicContact CG1-CG 4.29Å; V555-L824 HydrophobicContact CG2-CD1 4.02Å; V555-L824 HydrophobicContact CG2-CG 4.05Å; V559-L824 HydrophobicContact CG2-CD2 4.15Å; S821-L824 WeakPolarHBondContact O-CB 3.44Å; S821-L824 PolarHBondContact O-N 2.98Å; L824-K826 PolarHBondContact O-N 2.89Å; L824-R827 PolarHBondContact O-N 3.28Å; L824-I828 HydrophobicContact CD2-CD1 3.63Å; L824-I828 HydrophobicContact CG-CD1 4.23Å; L824-I828 WeakPolarHBondContact O-CD1 3.33Å; L824-I828 VanDerWaalsContact O-CG1 3.26Å; L824-I828 WeakPolarHBondContact O-CG1 3.29Å; L824-I828 PolarHBondContact O-N 3.06Å
825	L	62.6	Low	61	Low	14 Å²	14	65.8 Å²	65.8	7%	0.073	31%	0.313	C	S	.	.	H	α-helix	trans	-65.5	-34.2	174.3	-66.7	170.2	0	0	0	112.6	V559 L562 V807 F818 S821 I828 F829	V559-L825 HydrophobicContact CG2-CD2 4.21Å; L562-L825 HydrophobicContact CD1-CD1 4.4Å; V807-L825 HydrophobicContact CG1-CB 3.88Å; V807-L825 HydrophobicContact CG1-CD1 4.37Å; F818-L825 HydrophobicContact CD1-CD1 3.63Å; F818-L825 HydrophobicContact CE1-CD1 4.18Å; S821-L825 WeakPolarHBondContact O-CB 3.47Å; S821-L825 VanDerWaalsContact O-CG 3.32Å; S821-L825 WeakPolarHBondContact O-CG 3.28Å; S821-L825 PolarHBondContact O-N 3.03Å; L825-I828 HydrophobicContact CD2-CD1 4.08Å; L825-I828 PolarHBondContact O-N 2.87Å; L825-F829 HydrophobicContact CB-CD2 4.48Å; L825-F829 HydrophobicContact CD2-CE2 4.17Å; L825-F829 WeakPolarHBondContact O-CB 3Å; L825-F829 WeakPolarHBondContact O-CD2 3.23Å; L825-F829 PolarHBondContact O-N 2.86Å
826	K	65	Low	58.8	Low	46 Å²	46	69.5 Å²	69.5	20%	0.2	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-50	169.9	-77.1	166.1	-142	155.9	0	111.1	M775 T822 D823 L824 I828 Q830	M775-K826 HydrophobicContact CE-CG 4.4Å; M775-K826 HydrophobicContact SD-CD 4.41Å; M775-K826 WeakPolarHBondContact SD-CE 3.45Å; T822-K826 WeakPolarHBondContact O-CB 3.27Å; T822-K826 WeakPolarHBondContact O-CE 3.37Å; T822-K826 WeakPolarHBondContact O-CG 3.23Å; T822-K826 PolarHBondContact O-N 3.06Å; D823-K826 VanDerWaalsContact CG-NZ 3.3Å; D823-K826 WeakPolarHBondContact O-CB 3.37Å; D823-K826 PolarHBondContact O-N 3.1Å; D823-K826 WeakPolarHBondContact OD1-CD 3.38Å; D823-K826 IonicContact OD1-NZ 3.78Å; D823-K826 PolarHBondContact OD1-NZ 2.83Å; D823-K826 IonicContact OD2-NZ 2.68Å; L824-K826 PolarHBondContact O-N 2.89Å; K826-I828 PolarHBondContact O-N 3.42Å; K826-Q830 WeakPolarHBondContact O-CB 3.28Å; K826-Q830 WeakPolarHBondContact O-CG 3.28Å; K826-Q830 PolarHBondContact O-N 3.18Å
827	R	60.6	Low	56.9	Low	133 Å²	133	67.9 Å²	67.9	50%	0.502	33%	0.327	S	S	.	.	H	α-helix	trans	-56.3	-52.5	177.5	-71.7	-179.8	-177.2	-167.4	1.8	110.1	D551 D823 L824 Q830 I831	D551-R827 IonicContact OD2-CZ 3.06Å; D551-R827 IonicContact OD2-NH1 3.71Å; D551-R827 PolarHBondContact OD2-NH1 3.14Å; D823-R827 WeakPolarHBondContact O-CG 3.29Å; D823-R827 PolarHBondContact O-N 3.19Å; L824-R827 PolarHBondContact O-N 3.28Å; R827-Q830 PolarHBondContact O-N 3.21Å; R827-I831 WeakPolarHBondContact O-CB 3.48Å; R827-I831 WeakPolarHBondContact O-CD1 3.15Å; R827-I831 WeakPolarHBondContact O-CG1 3.31Å; R827-I831 PolarHBondContact O-N 2.77Å
828	I	58.7	Low	55	Low	9 Å²	9	69.8 Å²	69.8	5%	0.046	34%	0.343	C	S	.	.	H	α-helix	trans	-51.8	-61	178.2	-70.7	158.7	0	0	0	111.5	V555 V559 L824 L825 K826 Q830 I831 Y832	V555-I828 HydrophobicContact CG1-CD1 3.51Å; V555-I828 HydrophobicContact CG1-CG1 3.33Å; V559-I828 HydrophobicContact CG2-CD1 3.22Å; L824-I828 HydrophobicContact CD2-CD1 3.63Å; L824-I828 HydrophobicContact CG-CD1 4.23Å; L824-I828 WeakPolarHBondContact O-CD1 3.33Å; L824-I828 VanDerWaalsContact O-CG1 3.26Å; L824-I828 WeakPolarHBondContact O-CG1 3.29Å; L824-I828 PolarHBondContact O-N 3.06Å; L825-I828 HydrophobicContact CD2-CD1 4.08Å; L825-I828 PolarHBondContact O-N 2.87Å; K826-I828 PolarHBondContact O-N 3.42Å; I828-Q830 VanDerWaalsContact C-N 3.3Å; I828-Q830 PolarHBondContact O-N 2.84Å; I828-I831 WeakPolarHBondContact O-CB 3.5Å; I828-I831 PolarHBondContact O-N 2.79Å; I828-I831 VanDerWaalsContact O-N 3.12Å; I828-Y832 HydrophobicContact CG2-CD1 4.21Å; I828-Y832 HydrophobicContact CG2-CD2 3.97Å; I828-Y832 HydrophobicContact CG2-CE1 3.63Å; I828-Y832 HydrophobicContact CG2-CE2 3.41Å; I828-Y832 VanDerWaalsContact CG2-CE2 3.41Å; I828-Y832 HydrophobicContact CG2-CG 4.36Å; I828-Y832 WeakPolarHBondContact CG2-OH 3.44Å; I828-Y832 WeakPolarHBondContact O-CD1 3.47Å; I828-Y832 VanDerWaalsContact O-CG 3.27Å; I828-Y832 PolarHBondContact O-N 3.01Å
829	F	60.6	Low	53.2	Low	23 Å²	23	79.6 Å²	79.6	10%	0.101	38%	0.379	C	S	.	.	H	α-helix	trans	-74.7	-18	-174.5	-75.8	-79.6	0	0	0	113.2	L803 L804 V807 L825 Y832 S833	L803-F829 HydrophobicContact CB-CD1 3.49Å; L803-F829 VanDerWaalsContact CB-CD1 3.49Å; L803-F829 HydrophobicContact CB-CE1 3.94Å; L803-F829 HydrophobicContact CB-CG 4.37Å; L803-F829 HydrophobicContact CD1-CD1 3.93Å; L803-F829 HydrophobicContact CD1-CE1 4.02Å; L803-F829 HydrophobicContact CG-CD1 4.33Å; L804-F829 HydrophobicContact CD2-CB 3.63Å; L804-F829 HydrophobicContact CG-CB 3.99Å; V807-F829 HydrophobicContact CG2-CB 4.39Å; V807-F829 HydrophobicContact CG2-CD2 3.3Å; V807-F829 HydrophobicContact CG2-CE2 3.56Å; V807-F829 HydrophobicContact CG2-CG 3.85Å; V807-F829 HydrophobicContact CG2-CZ 4.29Å; L825-F829 HydrophobicContact CB-CD2 4.48Å; L825-F829 HydrophobicContact CD2-CE2 4.17Å; L825-F829 WeakPolarHBondContact O-CB 3Å; L825-F829 WeakPolarHBondContact O-CD2 3.23Å; L825-F829 PolarHBondContact O-N 2.86Å; F829-Y832 AromaticContact CD1-CD2 3.77Å; F829-Y832 HydrophobicContact CD1-CD2 3.77Å; F829-Y832 HydrophobicContact CD1-CE2 4.41Å; F829-Y832 AromaticContact CE1-CD2 3.95Å; F829-Y832 HydrophobicContact CE1-CD2 3.95Å; F829-Y832 HydrophobicContact CE1-CE2 4.25Å; F829-Y832 HydrophobicContact CG-CD2 4.38Å; F829-S833 VanDerWaalsContact O-CB 3.26Å; F829-S833 WeakPolarHBondContact O-CB 3.4Å; F829-S833 PolarHBondContact O-N 3.35Å
830	Q	60.4	Low	51.5	Low	98 Å²	98	82.5 Å²	82.5	46%	0.458	39%	0.39	S	S	.	.	H	α-helix	trans	-71.6	-42.2	165.7	-76.2	170.4	16	0	0	111.6	L804 K826 R827 I828 S833 K834	L804-Q830 HydrophobicContact CD1-CG 3.67Å; L804-Q830 HydrophobicContact CD2-CG 4.15Å; K826-Q830 WeakPolarHBondContact O-CB 3.28Å; K826-Q830 WeakPolarHBondContact O-CG 3.28Å; K826-Q830 PolarHBondContact O-N 3.18Å; R827-Q830 PolarHBondContact O-N 3.21Å; I828-Q830 VanDerWaalsContact C-N 3.3Å; I828-Q830 PolarHBondContact O-N 2.84Å; Q830-S833 PolarHBondContact O-N 3.06Å; Q830-S833 PolarHBondContact O-OG 2.85Å; Q830-K834 PolarHBondContact O-N 3.44Å
831	I	52.6	Low	49.9	Very low	57 Å²	57	81.6 Å²	81.6	29%	0.292	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-49.1	175.3	-69.8	163.6	0	0	0	109.4	L507 R827 I828 S833 K834	L507-I831 HydrophobicContact CB-CG2 3.96Å; L507-I831 HydrophobicContact CD1-CG2 3.81Å; L507-I831 HydrophobicContact CD2-CG2 3.84Å; L507-I831 HydrophobicContact CG-CG2 4.06Å; R827-I831 WeakPolarHBondContact O-CB 3.48Å; R827-I831 WeakPolarHBondContact O-CD1 3.15Å; R827-I831 WeakPolarHBondContact O-CG1 3.31Å; R827-I831 PolarHBondContact O-N 2.77Å; I828-I831 WeakPolarHBondContact O-CB 3.5Å; I828-I831 PolarHBondContact O-N 2.79Å; I828-I831 VanDerWaalsContact O-N 3.12Å; I831-S833 PolarHBondContact O-N 3.38Å; I831-K834 PolarHBondContact O-N 2.76Å
832	Y	53	Low	48.5	Very low	66 Å²	66	87.3 Å²	87.3	26%	0.259	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.9	176.4	-62.4	1.4	0	0	0	113.9	I828 F829 R858	I828-Y832 HydrophobicContact CG2-CD1 4.21Å; I828-Y832 HydrophobicContact CG2-CD2 3.97Å; I828-Y832 HydrophobicContact CG2-CE1 3.63Å; I828-Y832 HydrophobicContact CG2-CE2 3.41Å; I828-Y832 VanDerWaalsContact CG2-CE2 3.41Å; I828-Y832 HydrophobicContact CG2-CG 4.36Å; I828-Y832 WeakPolarHBondContact CG2-OH 3.44Å; I828-Y832 WeakPolarHBondContact O-CD1 3.47Å; I828-Y832 VanDerWaalsContact O-CG 3.27Å; I828-Y832 PolarHBondContact O-N 3.01Å; F829-Y832 AromaticContact CD1-CD2 3.77Å; F829-Y832 HydrophobicContact CD1-CD2 3.77Å; F829-Y832 HydrophobicContact CD1-CE2 4.41Å; F829-Y832 AromaticContact CE1-CD2 3.95Å; F829-Y832 HydrophobicContact CE1-CD2 3.95Å; F829-Y832 HydrophobicContact CE1-CE2 4.25Å; F829-Y832 HydrophobicContact CG-CD2 4.38Å; Y832-R858 HydrophobicContact CE2-CB 4.31Å; Y832-R858 HydrophobicContact CE2-CG 4.45Å; Y832-R858 PolarHBondContact OH-NE 3.42Å
833	S	53.1	Low	46.7	Very low	29 Å²	29	96.2 Å²	96.2	20%	0.203	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-36.2	-178	81.9	0	0	0	0	112.3	F829 Q830 I831 P1285	F829-S833 VanDerWaalsContact O-CB 3.26Å; F829-S833 WeakPolarHBondContact O-CB 3.4Å; F829-S833 PolarHBondContact O-N 3.35Å; Q830-S833 PolarHBondContact O-N 3.06Å; Q830-S833 PolarHBondContact O-OG 2.85Å; I831-S833 PolarHBondContact O-N 3.38Å; S833-P1285 WeakPolarHBondContact O-CB 3.45Å; S833-P1285 WeakPolarHBondContact O-CD 3.46Å; S833-P1285 WeakPolarHBondContact O-CG 3.49Å
834	K	48.6	Very low	45.1	Very low	152 Å²	152	96 Å²	96	66%	0.661	47%	0.466	S	S	*	.			trans	-61.2	127.9	-171.3	-75.1	-179.9	-177.9	174	0	111.6	Q830 I831	Q830-K834 PolarHBondContact O-N 3.44Å; I831-K834 PolarHBondContact O-N 2.76Å
835	P	41.8	Very low	43.6	Very low	41 Å²	41	98.6 Å²	98.6	27%	0.266	49%	0.491	S	S	.	.			trans	-77.8	149.3	171.7	35	-26	0	0	0	108.4	N837 P1285	P835-N837 PolarHBondContact O-N 2.85Å; P835-P1285 VanDerWaalsContact CD-CD 3.44Å
836	M	31.9	Very low	41.8	Very low	102 Å²	102	105.4 Å²	105.4	50%	0.502	53%	0.528	S	S	.	.			trans	-80.1	105.2	176.4	-139.6	-164.9	-163.7	0	0	110.1	T506 S838	T506-M836 HydrophobicContact CG2-CE 3.88Å; T506-M836 VanDerWaalsContact OG1-CE 3.28Å; T506-M836 WeakPolarHBondContact OG1-CE 3.38Å; M836-S838 VanDerWaalsContact C-N 3.32Å; M836-S838 PolarHBondContact O-N 3.21Å
837	N	30.6	Very low	40.2	Very low	151 Å²	151	110 Å²	110	81%	0.807	56%	0.555	S	S	*	*			trans	-68.4	81.4	176.7	-75.8	20	0	0	0	111.7	P835	P835-N837 PolarHBondContact O-N 2.85Å
838	S	28.6	Very low	38.9	Very low	61 Å²	61	107.1 Å²	107.1	43%	0.427	56%	0.555	S	S	.	*			trans	-167.1	84.3	162.6	59	0	0	0	0	111.7	R513 M836	R513-S838 PolarHBondContact NH1-OG 3.3Å; M836-S838 VanDerWaalsContact C-N 3.32Å; M836-S838 PolarHBondContact O-N 3.21Å
839	R	30.9	Very low	38.1	Very low	218 Å²	218	110 Å²	110	82%	0.823	57%	0.574	S	S	*	*			trans	-171.1	58.2	162.7	-114.2	172.6	-179.5	168.2	-1.5	112.2
840	E	29.1	Very low	37	Very low	154 Å²	154	116 Å²	116	72%	0.72	61%	0.605	S	S	*	*	S	Bend	trans	-90.6	156.4	138.3	-70.3	-178.2	130	0	0	105.9	K1305	E840-K1305 IonicContact OE1-NZ 2.79Å; E840-K1305 PolarHBondContact OE1-NZ 3.35Å
841	E	29.3	Very low	36.4	Very low	189 Å²	189	112.6 Å²	112.6	88%	0.883	59%	0.588	S	S	*	*	S	Bend	trans	64	75.2	-173.7	-61.3	176.5	-163.8	0	0	115.8
842	D	30.2	Very low	36.3	Very low	136 Å²	136	110.7 Å²	110.7	73%	0.727	58%	0.58	S	S	*	*			trans	-159.4	120.8	137.6	-112.6	-27.7	0	0	0	109.2	S844	D842-S844 PolarHBondContact O-N 3.08Å
843	Q	28.9	Very low	36.1	Very low	207 Å²	207	112.2 Å²	112.2	97%	0.967	60%	0.601	S	S	*	*			trans	-91.2	85.7	-173.4	-68.8	-175.9	6.3	0	0	112.1
844	S	30.1	Very low	36	Very low	99 Å²	99	111.9 Å²	111.9	69%	0.692	60%	0.595	S	S	*	*			trans	-148	116.9	164.3	60.4	0	0	0	0	111.1	D842	D842-S844 PolarHBondContact O-N 3.08Å
845	A	28.5	Very low	36.1	Very low	86 Å²	86	108.2 Å²	108.2	71%	0.711	58%	0.581	S	S	*	*			trans	-68.6	169.6	171.9	0	0	0	0	0	111.7
846	N	26.4	Very low	36.8	Very low	157 Å²	157	109.1 Å²	109.1	84%	0.84	58%	0.581	S	S	*	*	S	Bend	trans	69.4	40.2	168.4	-55.5	-0.1	0	0	0	116.9
847	N	29.4	Very low	38.2	Very low	143 Å²	143	109.2 Å²	109.2	77%	0.765	58%	0.581	S	S	*	*			trans	-138.7	126.3	153.6	-92.3	-70.4	0	0	0	111.5
848	S	34.4	Very low	39.4	Very low	72 Å²	72	104.5 Å²	104.5	50%	0.503	55%	0.552	S	S	.	*			trans	-68.4	147.7	170.8	51.5	0	0	0	0	110.3	I850	S848-I850 PolarHBondContact O-N 2.91Å
849	P	42	Very low	41	Very low	68 Å²	68	102.6 Å²	102.6	44%	0.442	54%	0.536	S	S	.	.			trans	-70	98.5	176.6	23.9	-28.5	0	0	0	109.9	R851 S1281 V1283	P849-R851 PolarHBondContact O-N 2.88Å; P849-S1281 WeakPolarHBondContact O-CA 3.46Å; P849-S1281 WeakPolarHBondContact O-CB 3.22Å; P849-V1283 HydrophobicContact CG-CG2 3.76Å
850	I	38.3	Very low	42.5	Very low	149 Å²	149	95.3 Å²	95.3	76%	0.764	52%	0.516	S	S	*	.	B	Isolated β-bridge	trans	-50.6	118.9	175.5	-62	167.8	0	0	0	109.1	S848	S848-I850 PolarHBondContact O-N 2.91Å
851	R	45.9	Very low	44	Very low	27 Å²	27	90.8 Å²	90.8	10%	0.102	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-62.2	147.1	169.1	-76.5	172.2	-160	153.6	7.9	109.9	P849 N1215 L1280 S1281 I1282	P849-R851 PolarHBondContact O-N 2.88Å; R851-N1215 PolarHBondContact NH2-ND2 3.36Å; R851-L1280 WeakPolarHBondContact CD-O 3.36Å; R851-L1280 WeakPolarHBondContact CG-O 3.32Å; R851-L1280 PolarHBondContact NE-O 3.13Å; R851-L1280 VanDerWaalsContact NH2-CB 3.31Å; R851-S1281 VanDerWaalsContact NE-C 3.3Å; R851-S1281 PolarHBondContact NE-O 2.97Å; R851-S1281 PolarHBondContact NH2-O 3.4Å; R851-I1282 HydrophobicContact CG-CB 4.18Å; R851-I1282 VanDerWaalsContact NE-CG1 3.32Å
852	S	50.6	Low	45.5	Very low	18 Å²	18	82.4 Å²	82.4	13%	0.126	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-61.2	138.5	164.6	62.3	0	0	0	0	109.5	E503 F854 E855 E856	E503-S852 VanDerWaalsContact OE2-CB 3.32Å; E503-S852 WeakPolarHBondContact OE2-CB 3.46Å; S852-F854 PolarHBondContact O-N 2.69Å; S852-E855 WeakPolarHBondContact O-CB 3.37Å; S852-E855 PolarHBondContact O-N 3.36Å; S852-E855 WeakPolarHBondContact OG-CG 3.12Å; S852-E855 PolarHBondContact OG-N 2.75Å; S852-E855 PolarHBondContact OG-OE1 3.24Å; S852-E855 VanDerWaalsContact OG-OE1 3.14Å; S852-E856 PolarHBondContact O-N 2.91Å
853	S	49.7	Very low	47.2	Very low	98 Å²	98	78 Å²	78	69%	0.685	43%	0.433	S	S	*	.	H	α-helix	trans	-55.3	-26.4	174.4	51.7	0	0	0	0	112.3	E856 E857	S853-E856 PolarHBondContact O-N 3.14Å; S853-E857 PolarHBondContact O-N 2.94Å
854	F	50.1	Low	48.8	Very low	21 Å²	21	71 Å²	71	9%	0.092	41%	0.407	C	S	.	.	H	α-helix	trans	-64.2	-38.5	174	-171.4	-135.1	0	0	0	114.3	E504 L507 S852 E856 R858	E504-F854 HydrophobicContact CB-CE1 4.41Å; E504-F854 HydrophobicContact CG-CD1 3.87Å; E504-F854 HydrophobicContact CG-CE1 3.12Å; E504-F854 HydrophobicContact CG-CE2 3.99Å; E504-F854 HydrophobicContact CG-CZ 3.16Å; L507-F854 HydrophobicContact CD1-CE1 3.99Å; S852-F854 PolarHBondContact O-N 2.69Å; F854-E856 VanDerWaalsContact C-N 3.35Å; F854-R858 VanDerWaalsContact CZ-NH1 3.3Å; F854-R858 WeakPolarHBondContact O-CB 3.48Å; F854-R858 VanDerWaalsContact O-CD 3.26Å; F854-R858 WeakPolarHBondContact O-CD 3.49Å; F854-R858 WeakPolarHBondContact O-CG 3.31Å; F854-R858 PolarHBondContact O-N 2.92Å
855	E	52.4	Low	50.5	Low	75 Å²	75	67.9 Å²	67.9	35%	0.35	38%	0.382	S	S	.	.	H	α-helix	trans	-66.5	-38.6	171.7	-81	164.7	-134	0	0	111.4	S852 R858 L859	S852-E855 WeakPolarHBondContact O-CB 3.37Å; S852-E855 PolarHBondContact O-N 3.36Å; S852-E855 WeakPolarHBondContact OG-CG 3.12Å; S852-E855 PolarHBondContact OG-N 2.75Å; S852-E855 PolarHBondContact OG-OE1 3.24Å; S852-E855 VanDerWaalsContact OG-OE1 3.14Å; E855-R858 PolarHBondContact O-N 3Å; E855-L859 WeakPolarHBondContact O-CB 3.5Å; E855-L859 PolarHBondContact O-N 2.88Å
856	E	56.5	Low	52.4	Low	60 Å²	60	64.8 Å²	64.8	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-69.3	-46.8	179.1	-175.5	163.1	-142.4	0	0	112.3	S852 S853 F854 R858 L859 V860	S852-E856 PolarHBondContact O-N 2.91Å; S853-E856 PolarHBondContact O-N 3.14Å; F854-E856 VanDerWaalsContact C-N 3.35Å; E856-R858 VanDerWaalsContact C-N 3.25Å; E856-R858 PolarHBondContact O-N 3.31Å; E856-L859 WeakPolarHBondContact O-CB 3.22Å; E856-L859 PolarHBondContact O-N 2.91Å; E856-L859 VanDerWaalsContact O-N 3.08Å; E856-V860 WeakPolarHBondContact O-CG2 3.49Å; E856-V860 PolarHBondContact O-N 3.46Å
857	E	59.9	Low	54.3	Low	105 Å²	105	61.5 Å²	61.5	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-56.9	-42.3	174.9	-162.2	-153.4	150.6	0	0	111	S853 V860 Q861	S853-E857 PolarHBondContact O-N 2.94Å; E857-V860 PolarHBondContact O-N 3.33Å; E857-Q861 WeakPolarHBondContact O-CG 3.29Å; E857-Q861 PolarHBondContact O-N 2.81Å; E857-Q861 PolarHBondContact OE1-NE2 2.98Å
858	R	57.4	Low	56.2	Low	51 Å²	51	55.4 Å²	55.4	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-69.5	-32.8	177.1	-74	168.9	160.4	-175.9	-7.3	113.2	Y832 F854 E855 E856 V860 Q861 A862	Y832-R858 HydrophobicContact CE2-CB 4.31Å; Y832-R858 HydrophobicContact CE2-CG 4.45Å; Y832-R858 PolarHBondContact OH-NE 3.42Å; F854-R858 VanDerWaalsContact CZ-NH1 3.3Å; F854-R858 WeakPolarHBondContact O-CB 3.48Å; F854-R858 VanDerWaalsContact O-CD 3.26Å; F854-R858 WeakPolarHBondContact O-CD 3.49Å; F854-R858 WeakPolarHBondContact O-CG 3.31Å; F854-R858 PolarHBondContact O-N 2.92Å; E855-R858 PolarHBondContact O-N 3Å; E856-R858 VanDerWaalsContact C-N 3.25Å; E856-R858 PolarHBondContact O-N 3.31Å; R858-V860 VanDerWaalsContact C-N 3.33Å; R858-Q861 PolarHBondContact O-N 2.92Å; R858-A862 WeakPolarHBondContact O-CB 3.28Å; R858-A862 PolarHBondContact O-N 3.46Å
859	L	60.3	Low	58.2	Low	21 Å²	21	52 Å²	52	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-40.5	171.3	-168.6	76.5	0	0	0	110.6	E855 E856 A862 K863 V1216	E855-L859 WeakPolarHBondContact O-CB 3.5Å; E855-L859 PolarHBondContact O-N 2.88Å; E856-L859 WeakPolarHBondContact O-CB 3.22Å; E856-L859 PolarHBondContact O-N 2.91Å; E856-L859 VanDerWaalsContact O-N 3.08Å; L859-A862 PolarHBondContact O-N 3.1Å; L859-K863 VanDerWaalsContact O-CG 3.29Å; L859-K863 WeakPolarHBondContact O-CG 3.4Å; L859-K863 PolarHBondContact O-N 3.45Å; L859-V1216 HydrophobicContact CD1-CG2 3.83Å
860	V	63.7	Low	60.1	Low	65 Å²	65	50 Å²	50	39%	0.394	26%	0.264	S	S	.	.	H	α-helix	trans	-66.3	-44.6	175.2	174.3	0	0	0	0	111.4	E856 E857 R858 A862 K863 S864	E856-V860 WeakPolarHBondContact O-CG2 3.49Å; E856-V860 PolarHBondContact O-N 3.46Å; E857-V860 PolarHBondContact O-N 3.33Å; R858-V860 VanDerWaalsContact C-N 3.33Å; V860-A862 VanDerWaalsContact C-N 3.29Å; V860-A862 PolarHBondContact O-N 3.49Å; V860-K863 WeakPolarHBondContact O-CB 3.47Å; V860-K863 PolarHBondContact O-N 2.9Å; V860-K863 VanDerWaalsContact O-N 3.15Å; V860-S864 PolarHBondContact O-N 3.35Å; V860-S864 PolarHBondContact O-OG 2.99Å
861	Q	60.5	Low	62.2	Low	60 Å²	60	43.7 Å²	43.7	28%	0.28	23%	0.232	S	C	.	.	H	α-helix	trans	-61.6	-34.9	172.9	-67.6	173.7	18	0	0	112.6	E857 R858 S864 L865	E857-Q861 WeakPolarHBondContact O-CG 3.29Å; E857-Q861 PolarHBondContact O-N 2.81Å; E857-Q861 PolarHBondContact OE1-NE2 2.98Å; R858-Q861 PolarHBondContact O-N 2.92Å; Q861-S864 PolarHBondContact O-OG 3.02Å; Q861-S864 VanDerWaalsContact O-OG 3.11Å; Q861-L865 WeakPolarHBondContact O-CG 3.46Å; Q861-L865 PolarHBondContact O-N 3.03Å
862	A	61.3	Low	63.9	Low	13 Å²	13	43.8 Å²	43.8	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-71.9	-33.3	174.1	0	0	0	0	0	112.5	R858 L859 V860 L866	R858-A862 WeakPolarHBondContact O-CB 3.28Å; R858-A862 PolarHBondContact O-N 3.46Å; L859-A862 PolarHBondContact O-N 3.1Å; V860-A862 VanDerWaalsContact C-N 3.29Å; V860-A862 PolarHBondContact O-N 3.49Å; A862-L866 WeakPolarHBondContact O-CG 3.43Å
863	K	64.6	Low	65.5	Low	44 Å²	44	43.7 Å²	43.7	19%	0.191	23%	0.229	C	C	.	.	H	α-helix	trans	-67.5	-46.1	174.6	-77.5	166.8	175.9	177.5	0	112.1	L859 V860 L865 L866 Q867 N1215 V1216	L859-K863 VanDerWaalsContact O-CG 3.29Å; L859-K863 WeakPolarHBondContact O-CG 3.4Å; L859-K863 PolarHBondContact O-N 3.45Å; V860-K863 WeakPolarHBondContact O-CB 3.47Å; V860-K863 PolarHBondContact O-N 2.9Å; V860-K863 VanDerWaalsContact O-N 3.15Å; K863-L865 VanDerWaalsContact C-N 3.28Å; K863-L865 PolarHBondContact O-N 3Å; K863-L866 PolarHBondContact O-N 3.15Å; K863-Q867 PolarHBondContact O-N 2.91Å; K863-Q867 VanDerWaalsContact O-N 3.15Å; K863-N1215 WeakPolarHBondContact CE-O 3.43Å; K863-N1215 PolarHBondContact NZ-O 3.26Å; K863-V1216 WeakPolarHBondContact CE-O 3.2Å; K863-V1216 WeakPolarHBondContact CG-O 3.32Å
864	S	63.7	Low	67	Low	60 Å²	60	39.9 Å²	39.9	42%	0.42	20%	0.201	S	C	.	.	H	α-helix	trans	-63.7	-33	178.8	61.6	0	0	0	0	112.6	V860 Q861 L866 P868	V860-S864 PolarHBondContact O-N 3.35Å; V860-S864 PolarHBondContact O-OG 2.99Å; Q861-S864 PolarHBondContact O-OG 3.02Å; Q861-S864 VanDerWaalsContact O-OG 3.11Å; S864-L866 PolarHBondContact O-N 3.21Å; S864-P868 WeakPolarHBondContact O-CD 3.42Å
865	L	64.6	Low	68.3	Low	33 Å²	33	39.1 Å²	39.1	17%	0.173	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.4	170.1	-80.7	170.5	0	0	0	114.5	L563 C566 Q861 K863 F869	L563-L865 HydrophobicContact CD2-CD1 3.84Å; L563-L865 HydrophobicContact CD2-CD2 3.74Å; L563-L865 HydrophobicContact CD2-CG 3.53Å; L563-L865 HydrophobicContact CG-CD1 4.34Å; L563-L865 HydrophobicContact CG-CD2 4.27Å; L563-L865 HydrophobicContact CG-CG 4.39Å; C566-L865 HydrophobicContact CB-CD2 3.72Å; Q861-L865 WeakPolarHBondContact O-CG 3.46Å; Q861-L865 PolarHBondContact O-N 3.03Å; K863-L865 VanDerWaalsContact C-N 3.28Å; K863-L865 PolarHBondContact O-N 3Å; L865-F869 WeakPolarHBondContact O-CD2 3.01Å
866	L	68.8	Low	69.2	Low	20 Å²	20	39.1 Å²	39.1	11%	0.105	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-39.4	-176.9	-69	177.5	0	0	0	113.6	L806 L810 A862 K863 S864 P868 F869 C870	L806-L866 HydrophobicContact CD1-CD1 3.99Å; L806-L866 HydrophobicContact CD1-CD2 3.66Å; L806-L866 HydrophobicContact CD1-CG 4.45Å; L806-L866 HydrophobicContact CD2-CD1 3.75Å; L806-L866 HydrophobicContact CD2-CD2 3.97Å; L806-L866 HydrophobicContact CD2-CG 4.21Å; L806-L866 HydrophobicContact CG-CD1 4.42Å; L806-L866 HydrophobicContact CG-CD2 3.99Å; L810-L866 HydrophobicContact CD1-CD2 3.96Å; L810-L866 HydrophobicContact CD2-CD2 4.08Å; L810-L866 HydrophobicContact CG-CD2 4.27Å; A862-L866 WeakPolarHBondContact O-CG 3.43Å; K863-L866 PolarHBondContact O-N 3.15Å; S864-L866 PolarHBondContact O-N 3.21Å; L866-P868 VanDerWaalsContact C-CD 3.48Å; L866-F869 PolarHBondContact O-N 3.29Å; L866-C870 HydrophobicContact CB-CB 4.46Å; L866-C870 WeakPolarHBondContact O-CB 3.49Å; L866-C870 PolarHBondContact O-N 3.42Å
867	Q	67.2	Low	69.9	Low	89 Å²	89	38.8 Å²	38.8	42%	0.416	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.4	-48.7	-171.6	-171.8	174.2	3.7	0	0	115.4	K863 F869	K863-Q867 PolarHBondContact O-N 2.91Å; K863-Q867 VanDerWaalsContact O-N 3.15Å; Q867-F869 PolarHBondContact O-N 3.49Å
868	P	69.3	Low	70.4	Confident	14 Å²	14	35.5 Å²	35.5	9%	0.091	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-34.1	177.8	27.2	-39.5	0	0	0	114.3	T570 S864 L866	T570-P868 HydrophobicContact CG2-CB 4.04Å; T570-P868 HydrophobicContact CG2-CG 4.36Å; T570-P868 VanDerWaalsContact OG1-CG 3.3Å; T570-P868 WeakPolarHBondContact OG1-CG 3.36Å; S864-P868 WeakPolarHBondContact O-CD 3.42Å; L866-P868 VanDerWaalsContact C-CD 3.48Å
869	F	76.2	Confident	70.9	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-7.7	-169.1	-51.5	-62.2	0	0	0	113.2	C566 L569 V653 I656 M814 L865 L866 Q867	C566-F869 HydrophobicContact CB-CE2 4.18Å; L569-F869 HydrophobicContact CB-CZ 4.42Å; L569-F869 HydrophobicContact CD1-CZ 4.39Å; V653-F869 HydrophobicContact CG1-CD1 3.52Å; V653-F869 HydrophobicContact CG1-CE1 3.58Å; I656-F869 PolarHBondContact N-O 2.99Å; M814-F869 HydrophobicContact CE-CB 4.31Å; M814-F869 HydrophobicContact CE-CD1 3.65Å; M814-F869 HydrophobicContact CE-CD2 3.54Å; M814-F869 HydrophobicContact CE-CE1 3.77Å; M814-F869 HydrophobicContact CE-CE2 3.67Å; M814-F869 HydrophobicContact CE-CG 3.54Å; M814-F869 HydrophobicContact CE-CZ 3.79Å; M814-F869 HydrophobicContact SD-CD1 4.2Å; M814-F869 HydrophobicContact SD-CE1 3.84Å; M814-F869 HydrophobicContact SD-CE2 4.41Å; M814-F869 HydrophobicContact SD-CZ 3.96Å; L865-F869 WeakPolarHBondContact O-CD2 3.01Å; L866-F869 PolarHBondContact O-N 3.29Å; Q867-F869 PolarHBondContact O-N 3.49Å
870	C	80.7	Confident	71.2	Confident	25 Å²	25	36.5 Å²	36.5	17%	0.169	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	102.7	-170.7	-167	0	0	0	0	112.4	I656 A658 L866	I656-C870 HydrophobicContact CB-CB 4.4Å; I656-C870 WeakPolarHBondContact O-CA 3.38Å; A658-C870 VanDerWaalsContact CB-SG 3.54Å; L866-C870 HydrophobicContact CB-CB 4.46Å; L866-C870 WeakPolarHBondContact O-CB 3.49Å; L866-C870 PolarHBondContact O-N 3.42Å
871	L	83.2	Confident	71.5	Confident	17 Å²	17	41 Å²	41	9%	0.089	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	114.5	172.6	-179.3	60.8	0	0	0	109.8	W644 I656 L657 A658 D659 R873	W644-L871 HydrophobicContact CB-CD2 4.16Å; W644-L871 HydrophobicContact CD2-CB 3.84Å; W644-L871 HydrophobicContact CD2-CD2 3.84Å; W644-L871 HydrophobicContact CD2-CG 4.43Å; W644-L871 HydrophobicContact CE3-CB 3.75Å; W644-L871 HydrophobicContact CE3-CD2 3.73Å; W644-L871 HydrophobicContact CE3-CG 4.4Å; W644-L871 HydrophobicContact CG-CD2 4.05Å; W644-L871 HydrophobicContact CH2-CB 3.67Å; W644-L871 HydrophobicContact CZ2-CB 3.74Å; W644-L871 HydrophobicContact CZ3-CB 3.67Å; W644-L871 HydrophobicContact CZ3-CD2 4.4Å; I656-L871 PolarHBondContact O-N 3.19Å; I656-L871 VanDerWaalsContact O-N 3.09Å; L657-L871 HydrophobicContact CD1-CB 4.22Å; L657-L871 HydrophobicContact CD1-CD2 3.95Å; L657-L871 HydrophobicContact CD1-CG 4.22Å; A658-L871 CarbonylContact C-O 3.54Å; A658-L871 WeakPolarHBondContact CA-O 3.43Å; A658-L871 PolarHBondContact N-O 3.17Å; D659-L871 PolarHBondContact N-O 3.22Å; L871-R873 HydrophobicContact CD1-CG 4.45Å
872	R	82.4	Confident	72.2	Confident	28 Å²	28	39.5 Å²	39.5	11%	0.106	23%	0.231	C	C	.	.			trans	-122.1	128.6	173.3	174.7	173	-175.2	137.8	4	110.5	A658 P798 E1213 T1217	A658-R872 HydrophobicContact CB-CB 4.24Å; A658-R872 WeakPolarHBondContact O-CG 3.42Å; P798-R872 VanDerWaalsContact CD-NH1 3.28Å; R872-E1213 IonicContact CZ-OE1 3.82Å; R872-E1213 VanDerWaalsContact NH1-CD 3.32Å; R872-E1213 IonicContact NH1-OE1 3.24Å; R872-E1213 PolarHBondContact NH1-OE1 2.68Å; R872-E1213 VanDerWaalsContact NH2-CD 3.31Å; R872-E1213 IonicContact NH2-OE1 2.74Å; R872-E1213 PolarHBondContact NH2-OE1 3.17Å; R872-E1213 VanDerWaalsContact NH2-OE1 3.11Å; R872-E1213 IonicContact NH2-OE2 2.79Å; R872-E1213 PolarHBondContact NH2-OE2 2.75Å; R872-T1217 PolarHBondContact NH1-OG1 3.1Å
873	R	82.9	Confident	73.2	Confident	17 Å²	17	39.9 Å²	39.9	6%	0.064	23%	0.232	C	C	.	.			trans	-132.9	150.1	171.1	-62.8	164.6	-68	-167.7	6.3	110.2	Y637 D659 E660 L663 L871 V878	Y637-R873 PolarHBondContact O-NH1 3.23Å; D659-R873 VanDerWaalsContact CG-NH2 3.33Å; D659-R873 WeakPolarHBondContact OD1-CB 3.35Å; D659-R873 IonicContact OD1-CZ 2.66Å; D659-R873 PolarHBondContact OD1-N 2.88Å; D659-R873 IonicContact OD1-NE 3.77Å; D659-R873 PolarHBondContact OD1-NE 2.9Å; D659-R873 IonicContact OD1-NH2 3.01Å; D659-R873 PolarHBondContact OD1-NH2 3.23Å; D659-R873 VanDerWaalsContact OD1-NH2 3.16Å; D659-R873 IonicContact OD2-CZ 2.72Å; D659-R873 IonicContact OD2-NE 3.77Å; D659-R873 IonicContact OD2-NH2 3.99Å; D659-R873 PolarHBondContact OD2-NH2 3.03Å; E660-R873 PolarHBondContact N-O 3.01Å; L663-R873 HydrophobicContact CD1-CB 4.23Å; L663-R873 VanDerWaalsContact CD1-O 3.28Å; L663-R873 WeakPolarHBondContact CD1-O 3.33Å; L871-R873 HydrophobicContact CD1-CG 4.45Å; R873-V878 HydrophobicContact CB-CG2 3.94Å
874	L	80.6	Confident	74.3	Confident	17 Å²	17	42.1 Å²	42.1	9%	0.089	25%	0.251	C	S	.	.			trans	-102.3	158.9	179.5	-59.5	-175	0	0	0	112.7	E660 S876 Q877 V878 C1219	E660-L874 HydrophobicContact CB-CD2 4.43Å; E660-L874 WeakPolarHBondContact OE2-CA 3.49Å; L874-S876 VanDerWaalsContact C-N 3.34Å; L874-S876 PolarHBondContact O-N 3.08Å; L874-Q877 HydrophobicContact CB-CB 4.46Å; L874-Q877 HydrophobicContact CB-CG 4.15Å; L874-Q877 PolarHBondContact O-N 3.24Å; L874-V878 WeakPolarHBondContact O-CB 3.3Å; L874-V878 WeakPolarHBondContact O-CG2 3.35Å; L874-V878 PolarHBondContact O-N 3.13Å; L874-C1219 HydrophobicContact CD1-CB 3.81Å
875	K	77.5	Confident	75.5	Confident	5 Å²	5	42.2 Å²	42.2	2%	0.022	24%	0.244	C	C	.	.	H	α-helix	trans	-53.1	-49.9	171.2	-71	174.3	-177.4	-176	0	111.3	E660 M661 Q877 V878 L879 L882 D1176 H1179	E660-K875 HydrophobicContact CG-CD 4.4Å; E660-K875 HydrophobicContact CG-CG 4.11Å; E660-K875 WeakPolarHBondContact OE2-CG 3.32Å; E660-K875 PolarHBondContact OE2-N 2.75Å; M661-K875 WeakPolarHBondContact O-CE 3.49Å; K875-Q877 VanDerWaalsContact C-N 3.28Å; K875-Q877 PolarHBondContact O-N 3.25Å; K875-V878 PolarHBondContact O-N 3Å; K875-V878 VanDerWaalsContact O-N 3.13Å; K875-L879 WeakPolarHBondContact O-CA 3.22Å; K875-L879 PolarHBondContact O-N 3.02Å; K875-L882 HydrophobicContact CB-CD1 4.17Å; K875-L882 HydrophobicContact CD-CD1 4.25Å; K875-L882 HydrophobicContact CG-CD1 4.26Å; K875-D1176 IonicContact NZ-OD1 3.01Å; K875-D1176 PolarHBondContact NZ-OD1 2.9Å; K875-D1176 IonicContact NZ-OD2 2.99Å; K875-D1176 PolarHBondContact NZ-OD2 2.65Å; K875-H1179 VanDerWaalsContact CD-CE1 3.49Å; K875-H1179 WeakPolarHBondContact CD-CE1 3.05Å; K875-H1179 PolarHBondContact NZ-CE1 2.84Å; K875-H1179 PolarHBondContact NZ-O 3.3Å
876	S	72.8	Confident	76.7	Confident	75 Å²	75	44 Å²	44	52%	0.524	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-32.6	-178.4	51.8	0	0	0	0	113.9	L874 V878	L874-S876 VanDerWaalsContact C-N 3.34Å; L874-S876 PolarHBondContact O-N 3.08Å; S876-V878 VanDerWaalsContact C-N 3.31Å; S876-V878 PolarHBondContact O-N 3.48Å
877	Q	71.3	Confident	77.8	Confident	54 Å²	54	46 Å²	46	25%	0.252	27%	0.272	S	S	.	.	H	α-helix	trans	-76.1	-18.1	178.8	-70.1	172.4	-32.3	0	0	113.7	L874 K875 V1267	L874-Q877 HydrophobicContact CB-CB 4.46Å; L874-Q877 HydrophobicContact CB-CG 4.15Å; L874-Q877 PolarHBondContact O-N 3.24Å; K875-Q877 VanDerWaalsContact C-N 3.28Å; K875-Q877 PolarHBondContact O-N 3.25Å; Q877-V1267 HydrophobicContact CB-CG1 3.85Å; Q877-V1267 HydrophobicContact CG-CG1 4.01Å
878	V	70.1	Confident	79	Confident	36 Å²	36	46.1 Å²	46.1	22%	0.218	27%	0.272	C	S	.	.	H	α-helix	trans	-127.9	-28.2	-160.6	174.6	0	0	0	0	112.9	Y637 L663 R873 L874 K875 S876	Y637-V878 HydrophobicContact CD1-CG1 3.11Å; Y637-V878 HydrophobicContact CD2-CG1 3.56Å; Y637-V878 HydrophobicContact CE1-CG1 3.4Å; Y637-V878 HydrophobicContact CE2-CG1 3.83Å; Y637-V878 HydrophobicContact CG-CG1 3.18Å; L663-V878 HydrophobicContact CD2-CB 4.2Å; L663-V878 HydrophobicContact CD2-CG1 3.95Å; R873-V878 HydrophobicContact CB-CG2 3.94Å; L874-V878 WeakPolarHBondContact O-CB 3.3Å; L874-V878 WeakPolarHBondContact O-CG2 3.35Å; L874-V878 PolarHBondContact O-N 3.13Å; K875-V878 PolarHBondContact O-N 3Å; K875-V878 VanDerWaalsContact O-N 3.13Å; S876-V878 VanDerWaalsContact C-N 3.31Å; S876-V878 PolarHBondContact O-N 3.48Å
879	L	68.2	Low	80.2	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.052	29%	0.288	C	S	.	.			trans	-132.2	66	-171.9	-62.5	177.1	0	0	0	110.6	K635 Y637 L663 K875 Q881 L882 L1181	K635-L879 HydrophobicContact CD-CD2 4.29Å; Y637-L879 HydrophobicContact CE1-CD2 4.11Å; L663-L879 HydrophobicContact CD2-CD1 3.69Å; L663-L879 HydrophobicContact CD2-CG 4.07Å; K875-L879 WeakPolarHBondContact O-CA 3.22Å; K875-L879 PolarHBondContact O-N 3.02Å; L879-Q881 PolarHBondContact O-N 3.12Å; L879-L882 HydrophobicContact CB-CD1 3.88Å; L879-L882 HydrophobicContact CB-CG 3.96Å; L879-L882 HydrophobicContact CD1-CD1 3.71Å; L879-L882 HydrophobicContact CD1-CG 4.22Å; L879-L882 HydrophobicContact CG-CD1 4.47Å; L879-L882 PolarHBondContact O-N 2.92Å; L879-L1181 HydrophobicContact CD1-CD1 4.35Å; L879-L1181 HydrophobicContact CD1-CD2 3.75Å; L879-L1181 HydrophobicContact CD1-CG 4Å; L879-L1181 HydrophobicContact CD2-CD2 4.03Å
880	G	66.6	Low	81.1	Confident	83 Å²	83	50.1 Å²	50.1	86%	0.856	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-0.4	168.2	0	0	0	0	0	114.7
881	Q	68.7	Low	81.7	Confident	160 Å²	160	53.7 Å²	53.7	75%	0.748	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-7.9	171.7	-65	176.4	-31	0	0	113.5	L879	L879-Q881 PolarHBondContact O-N 3.12Å
882	L	75	Confident	82.2	Confident	28 Å²	28	53.4 Å²	53.4	15%	0.147	31%	0.312	C	S	.	.	S	Bend	trans	-79.5	135.8	175.9	-77.8	174.2	0	0	0	110.1	K875 L879 L1181	K875-L882 HydrophobicContact CB-CD1 4.17Å; K875-L882 HydrophobicContact CD-CD1 4.25Å; K875-L882 HydrophobicContact CG-CD1 4.26Å; L879-L882 HydrophobicContact CB-CD1 3.88Å; L879-L882 HydrophobicContact CB-CG 3.96Å; L879-L882 HydrophobicContact CD1-CD1 3.71Å; L879-L882 HydrophobicContact CD1-CG 4.22Å; L879-L882 HydrophobicContact CG-CD1 4.47Å; L879-L882 PolarHBondContact O-N 2.92Å; L882-L1181 HydrophobicContact CD2-CD2 4.5Å
883	P	83.3	Confident	82.7	Confident	21 Å²	21	54.9 Å²	54.9	14%	0.136	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-54.8	153.6	167.7	-25.4	35.3	0	0	0	112	Q1183 K1184 N1185	P883-Q1183 HydrophobicContact CG-CG 4.37Å; P883-K1184 WeakPolarHBondContact CG-O 3.46Å; P883-N1185 WeakPolarHBondContact CB-O 3.44Å; P883-N1185 WeakPolarHBondContact CG-O 3.5Å
884	P	86.5	Confident	83.1	Confident	91 Å²	91	55.4 Å²	55.4	59%	0.591	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-63.8	150.9	177.2	27.8	-34.7	0	0	0	111.5	P1186 V1187	P884-P1186 HydrophobicContact CG-CB 4.17Å; P884-V1187 PolarHBondContact O-N 3.27Å
885	K	88.8	Confident	83.6	Confident	62 Å²	62	55.6 Å²	55.6	27%	0.27	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	114	168.5	-173.4	177.6	77.8	164.6	0	109.5	E1175 D1176 H1179 V1187 V1189	K885-E1175 IonicContact NZ-OE2 3.44Å; K885-E1175 PolarHBondContact NZ-OE2 2.75Å; K885-D1176 IonicContact NZ-OD1 2.74Å; K885-H1179 HydrophobicContact CD-CB 3.89Å; K885-V1187 CarbonylContact C-O 3.6Å; K885-V1187 VanDerWaalsContact CA-O 3.26Å; K885-V1187 WeakPolarHBondContact CA-O 3.43Å; K885-V1187 HydrophobicContact CB-CB 4.39Å; K885-V1187 HydrophobicContact CD-CG1 4.32Å; K885-V1187 HydrophobicContact CG-CB 4.1Å; K885-V1187 HydrophobicContact CG-CG1 4.06Å; K885-V1189 HydrophobicContact CD-CG2 3.82Å; K885-V1189 HydrophobicContact CG-CG2 3.95Å
886	T	91.4	Very high	84.2	Confident	69 Å²	69	64.3 Å²	64.3	42%	0.423	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	151.2	168.7	68.5	0	0	0	0	109.7	V1187 H1188 V1189	T886-V1187 PolarHBondContact N-O 3.31Å; T886-H1188 PolarHBondContact OG1-ND1 3.48Å; T886-V1189 PolarHBondContact O-N 2.77Å
887	S	90.5	Very high	85	Confident	63 Å²	63	64.2 Å²	64.2	44%	0.441	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	123.6	169.1	-168.6	0	0	0	0	109.2	V1189 R1191	S887-V1189 CarbonylContact C-O 3.49Å; S887-V1189 VanDerWaalsContact CA-O 3.27Å; S887-V1189 WeakPolarHBondContact CA-O 3.3Å; S887-R1191 PolarHBondContact OG-NE 2.79Å; S887-R1191 PolarHBondContact OG-NH2 3.21Å
888	E	93.3	Very high	85.9	Confident	91 Å²	91	61.7 Å²	61.7	43%	0.425	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	156.6	174.4	61.7	-179.5	-142	0	0	110.8	V890 V1189 I1190 R1191	E888-V890 HydrophobicContact CG-CG2 4.38Å; E888-V1189 PolarHBondContact N-O 2.66Å; E888-I1190 HydrophobicContact CG-CB 4.25Å; E888-I1190 HydrophobicContact CG-CG1 4.04Å; E888-I1190 HydrophobicContact CG-CG2 4.2Å; E888-I1190 WeakPolarHBondContact OE1-CG1 3.43Å; E888-I1190 WeakPolarHBondContact OE1-CG2 3.48Å; E888-R1191 PolarHBondContact O-N 2.9Å
889	V	93.8	Very high	86.9	Confident	70 Å²	70	61 Å²	61	42%	0.424	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.1	170.8	179.5	0	0	0	0	106.9	R1191 I1193 L1203	V889-R1191 HydrophobicContact CG2-CB 4.43Å; V889-I1193 HydrophobicContact CG1-CB 4.47Å; V889-I1193 HydrophobicContact CG1-CG1 3.82Å; V889-L1203 HydrophobicContact CG1-CD2 3.81Å; V889-L1203 HydrophobicContact CG2-CD2 4.47Å
890	V	94.9	Very high	87.9	Confident	30 Å²	30	64.1 Å²	64.1	18%	0.182	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.1	177.6	-177.6	0	0	0	0	107.7	E888 V892 W1074 I1190 R1191 L1192 I1193	E888-V890 HydrophobicContact CG-CG2 4.38Å; V890-V892 HydrophobicContact CG1-CG2 3.87Å; V890-W1074 HydrophobicContact CG2-CZ2 4.36Å; V890-I1190 HydrophobicContact CG2-CG2 3.75Å; V890-R1191 PolarHBondContact N-O 2.68Å; V890-L1192 HydrophobicContact CB-CD2 4.08Å; V890-L1192 HydrophobicContact CG1-CD2 4.48Å; V890-I1193 PolarHBondContact O-N 3.2Å
891	L	94.3	Very high	88.9	Confident	100 Å²	100	62.8 Å²	62.8	52%	0.524	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127.5	166.6	-61.8	177.8	0	0	0	108.2	I1193	L891-I1193 WeakPolarHBondContact CA-O 3.42Å; L891-I1193 HydrophobicContact CD2-CB 4.19Å; L891-I1193 HydrophobicContact CD2-CG2 4.03Å
892	V	93.6	Very high	89.9	Confident	11 Å²	11	55.5 Å²	55.5	7%	0.067	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.3	-176	-177.2	0	0	0	0	108.9	V890 G1070 W1074 L1192 I1193 S1194 E1195	V890-V892 HydrophobicContact CG1-CG2 3.87Å; V892-G1070 VanDerWaalsContact CG1-O 3.28Å; V892-G1070 WeakPolarHBondContact CG1-O 3.27Å; V892-W1074 HydrophobicContact CG1-CB 4.19Å; V892-W1074 HydrophobicContact CG2-CB 4.37Å; V892-W1074 HydrophobicContact CG2-CG 4.27Å; V892-L1192 HydrophobicContact CG2-CD2 4.3Å; V892-I1193 PolarHBondContact N-O 3.12Å; V892-S1194 WeakPolarHBondContact O-CA 3.47Å; V892-E1195 PolarHBondContact O-N 2.85Å
893	A	93.3	Very high	90.5	Very high	59 Å²	59	58.8 Å²	58.8	49%	0.488	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-62.7	135.4	174.9	0	0	0	0	0	111.1
894	M	90.5	Very high	90.7	Very high	29 Å²	29	60.5 Å²	60.5	14%	0.143	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-67.8	146.4	172.3	-70.4	-174.3	-72.5	0	0	111.2	Q898 A899 Y902 T1197	M894-Q898 HydrophobicContact CB-CB 4.25Å; M894-Q898 HydrophobicContact CB-CG 4.16Å; M894-Q898 HydrophobicContact CG-CG 4.18Å; M894-Q898 HydrophobicContact SD-CG 4.12Å; M894-A899 HydrophobicContact CB-CB 4.07Å; M894-A899 HydrophobicContact CE-CB 4.29Å; M894-Y902 HydrophobicContact CE-CD1 4.24Å; M894-Y902 HydrophobicContact CE-CG 4.15Å; M894-Y902 HydrophobicContact SD-CD2 4.14Å; M894-Y902 HydrophobicContact SD-CG 4.08Å; M894-T1197 HydrophobicContact CE-CG2 3.52Å; M894-T1197 HydrophobicContact CG-CG2 4.33Å; M894-T1197 HydrophobicContact SD-CG2 3.59Å; M894-T1197 VanDerWaalsContact SD-CG2 3.59Å
895	T	91.6	Very high	90.7	Very high	21 Å²	21	56.6 Å²	56.6	13%	0.129	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-66.7	153.8	172.1	58.9	0	0	0	0	110.6	T897 Q898 A899 Q999 S1067	T895-T897 VanDerWaalsContact C-N 3.25Å; T895-T897 PolarHBondContact O-N 3.31Å; T895-T897 VanDerWaalsContact O-N 3.15Å; T895-Q898 WeakPolarHBondContact O-CA 3.43Å; T895-Q898 WeakPolarHBondContact O-CB 3.24Å; T895-Q898 PolarHBondContact O-N 2.97Å; T895-Q898 WeakPolarHBondContact OG1-CB 3.32Å; T895-A899 WeakPolarHBondContact O-CB 3.33Å; T895-A899 PolarHBondContact O-N 3.5Å; T895-Q999 PolarHBondContact OG1-NE2 3.21Å; T895-S1067 PolarHBondContact OG1-O 3.15Å
896	K	90.7	Very high	90.6	Very high	188 Å²	188	53.8 Å²	53.8	82%	0.817	30%	0.298	S	S	*	.	H	α-helix	trans	-56	-37.7	-170.8	-65.1	-178.4	-179.6	178.4	0	113.5	T900	K896-T900 PolarHBondContact O-N 3.27Å; K896-T900 VanDerWaalsContact O-N 3.13Å; K896-T900 PolarHBondContact O-OG1 3Å
897	T	88.3	Confident	90.4	Very high	73 Å²	73	56 Å²	56	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-69.8	-48.2	174.4	45.3	0	0	0	0	111.5	T895 A899 T900 H901 Q999	T895-T897 VanDerWaalsContact C-N 3.25Å; T895-T897 PolarHBondContact O-N 3.31Å; T895-T897 VanDerWaalsContact O-N 3.15Å; T897-A899 VanDerWaalsContact C-N 3.34Å; T897-A899 PolarHBondContact O-N 3.39Å; T897-T900 WeakPolarHBondContact O-CB 3.41Å; T897-T900 PolarHBondContact O-N 3.42Å; T897-T900 VanDerWaalsContact O-N 3.13Å; T897-H901 PolarHBondContact O-CD2 3.12Å; T897-H901 PolarHBondContact O-N 3.48Å; T897-Q999 PolarHBondContact OG1-NE2 2.61Å; T897-Q999 PolarHBondContact OG1-OE1 3.44Å
898	Q	90.9	Very high	90.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-53.8	-48.6	174.4	-173.2	-178.8	16	0	0	112.1	M894 T895 T900 H901 Y902 A995 A996 Q999 G1070	M894-Q898 HydrophobicContact CB-CB 4.25Å; M894-Q898 HydrophobicContact CB-CG 4.16Å; M894-Q898 HydrophobicContact CG-CG 4.18Å; M894-Q898 HydrophobicContact SD-CG 4.12Å; T895-Q898 WeakPolarHBondContact O-CA 3.43Å; T895-Q898 WeakPolarHBondContact O-CB 3.24Å; T895-Q898 PolarHBondContact O-N 2.97Å; T895-Q898 WeakPolarHBondContact OG1-CB 3.32Å; Q898-T900 PolarHBondContact O-N 3.07Å; Q898-H901 PolarHBondContact O-N 2.83Å; Q898-Y902 WeakPolarHBondContact O-CB 3.47Å; Q898-Y902 PolarHBondContact O-N 2.88Å; Q898-A995 PolarHBondContact NE2-O 3.29Å; Q898-A996 PolarHBondContact NE2-O 2.93Å; Q898-Q999 HydrophobicContact CB-CG 3.8Å; Q898-Q999 HydrophobicContact CG-CG 4.12Å; Q898-Q999 VanDerWaalsContact N-CD 3.33Å; Q898-G1070 VanDerWaalsContact OE1-N 3.1Å
899	A	90.3	Very high	89.7	Confident	23 Å²	23	55.2 Å²	55.2	19%	0.19	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-42.4	178.1	0	0	0	0	0	111.8	M894 T895 T897 Y902 H903	M894-A899 HydrophobicContact CB-CB 4.07Å; M894-A899 HydrophobicContact CE-CB 4.29Å; T895-A899 WeakPolarHBondContact O-CB 3.33Å; T895-A899 PolarHBondContact O-N 3.5Å; T897-A899 VanDerWaalsContact C-N 3.34Å; T897-A899 PolarHBondContact O-N 3.39Å; A899-Y902 PolarHBondContact O-N 2.9Å; A899-H903 PolarHBondContact O-N 3.08Å; A899-H903 PolarHBondContact O-ND1 3.21Å
900	T	90.5	Very high	89.1	Confident	75 Å²	75	56.5 Å²	56.5	46%	0.46	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-51.1	177.6	-57.1	0	0	0	0	110.9	K896 T897 Q898 Y902 H903 D904	K896-T900 PolarHBondContact O-N 3.27Å; K896-T900 VanDerWaalsContact O-N 3.13Å; K896-T900 PolarHBondContact O-OG1 3Å; T897-T900 WeakPolarHBondContact O-CB 3.41Å; T897-T900 PolarHBondContact O-N 3.42Å; T897-T900 VanDerWaalsContact O-N 3.13Å; Q898-T900 PolarHBondContact O-N 3.07Å; T900-Y902 VanDerWaalsContact C-N 3.33Å; T900-Y902 PolarHBondContact O-N 2.96Å; T900-H903 PolarHBondContact O-N 3.31Å; T900-D904 PolarHBondContact O-N 3.38Å
901	H	86.7	Confident	88.5	Confident	55 Å²	55	58.4 Å²	58.4	26%	0.255	30%	0.297	S	S	.	.	H	α-helix	trans	-67.1	-31	179.4	-58.5	-47.4	0	0	0	113.3	T897 Q898 L905 F1002 L1005	T897-H901 PolarHBondContact O-CD2 3.12Å; T897-H901 PolarHBondContact O-N 3.48Å; Q898-H901 PolarHBondContact O-N 2.83Å; H901-L905 WeakPolarHBondContact O-CB 3.36Å; H901-L905 PolarHBondContact O-N 3.31Å; H901-F1002 HydrophobicContact CB-CE1 4.41Å; H901-F1002 HydrophobicContact CB-CE2 4.16Å; H901-F1002 HydrophobicContact CB-CZ 3.86Å; H901-L1005 HydrophobicContact CB-CD1 4.03Å; H901-L1005 HydrophobicContact CB-CD2 4.44Å
902	Y	89.3	Confident	87.5	Confident	7 Å²	7	55.9 Å²	55.9	3%	0.027	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-48.9	170.6	-173.1	-82.4	0	0	0	111.3	M894 Q898 A899 T900 D904 L905 V906 L992 A995 A996 T1197 L1198	M894-Y902 HydrophobicContact CE-CD1 4.24Å; M894-Y902 HydrophobicContact CE-CG 4.15Å; M894-Y902 HydrophobicContact SD-CD2 4.14Å; M894-Y902 HydrophobicContact SD-CG 4.08Å; Q898-Y902 WeakPolarHBondContact O-CB 3.47Å; Q898-Y902 PolarHBondContact O-N 2.88Å; A899-Y902 PolarHBondContact O-N 2.9Å; T900-Y902 VanDerWaalsContact C-N 3.33Å; T900-Y902 PolarHBondContact O-N 2.96Å; Y902-D904 PolarHBondContact O-N 3.4Å; Y902-L905 PolarHBondContact O-N 3.47Å; Y902-V906 HydrophobicContact CD1-CG2 3.99Å; Y902-V906 HydrophobicContact CE1-CG2 3.68Å; Y902-V906 WeakPolarHBondContact O-CG2 3.42Å; Y902-V906 PolarHBondContact O-N 3.01Å; Y902-L992 HydrophobicContact CE1-CD2 4.43Å; Y902-L992 HydrophobicContact CE2-CB 4.3Å; Y902-L992 HydrophobicContact CE2-CD2 4.08Å; Y902-A995 HydrophobicContact CD2-CB 3.68Å; Y902-A995 HydrophobicContact CE2-CB 4.39Å; Y902-A996 HydrophobicContact CE2-CB 4.21Å; Y902-T1197 HydrophobicContact CD2-CG2 4.41Å; Y902-T1197 HydrophobicContact CE1-CG2 4.48Å; Y902-T1197 HydrophobicContact CE2-CG2 3.99Å; Y902-L1198 PolarHBondContact OH-N 3Å
903	H	88.8	Confident	86.4	Confident	96 Å²	96	60.2 Å²	60.2	44%	0.444	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-37.3	177.9	-75.6	87	0	0	0	112.4	A899 T900 V906 K907	A899-H903 PolarHBondContact O-N 3.08Å; A899-H903 PolarHBondContact O-ND1 3.21Å; T900-H903 PolarHBondContact O-N 3.31Å; H903-V906 WeakPolarHBondContact O-CB 3.37Å; H903-V906 PolarHBondContact O-N 2.76Å; H903-K907 VanDerWaalsContact O-CG 3.27Å; H903-K907 WeakPolarHBondContact O-CG 3.48Å; H903-K907 PolarHBondContact O-N 2.95Å
904	D	87.6	Confident	85.3	Confident	57 Å²	57	60.9 Å²	60.9	31%	0.305	30%	0.299	S	S	.	.	H	α-helix	trans	-71.8	-33	177.1	-70.1	-23.5	0	0	0	112.8	T900 Y902 K907 R908	T900-D904 PolarHBondContact O-N 3.38Å; Y902-D904 PolarHBondContact O-N 3.4Å; D904-K907 WeakPolarHBondContact OD1-CE 3.37Å; D904-K907 IonicContact OD1-NZ 3.84Å; D904-K907 PolarHBondContact OD1-NZ 2.99Å; D904-R908 VanDerWaalsContact O-CB 3.27Å; D904-R908 WeakPolarHBondContact O-CB 3.47Å; D904-R908 PolarHBondContact O-N 3.07Å
905	L	86.4	Confident	84	Confident	9 Å²	9	64.5 Å²	64.5	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-63.3	-46.8	167.3	178.9	60.1	0	0	0	110.9	H901 Y902 K907 R908 L909 A991 L992 A995 F1002	H901-L905 WeakPolarHBondContact O-CB 3.36Å; H901-L905 PolarHBondContact O-N 3.31Å; Y902-L905 PolarHBondContact O-N 3.47Å; L905-K907 PolarHBondContact O-N 3.36Å; L905-R908 PolarHBondContact O-N 3.45Å; L905-L909 HydrophobicContact CD1-CD1 4.09Å; L905-L909 HydrophobicContact CD1-CG 4.17Å; L905-L909 HydrophobicContact CG-CD1 4.06Å; L905-L909 VanDerWaalsContact O-CG 3.24Å; L905-L909 WeakPolarHBondContact O-CG 3.45Å; L905-L909 PolarHBondContact O-N 3.36Å; L905-A991 HydrophobicContact CD2-CB 4.04Å; L905-L992 HydrophobicContact CD2-CD2 4.01Å; L905-L992 HydrophobicContact CG-CD2 4.11Å; L905-A995 HydrophobicContact CD2-CB 4.09Å; L905-F1002 HydrophobicContact CB-CE1 4.23Å; L905-F1002 HydrophobicContact CD2-CE1 4.01Å; L905-F1002 HydrophobicContact CD2-CZ 4.28Å
906	V	87	Confident	82.4	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.024	33%	0.332	C	S	.	.	H	α-helix	trans	-54.4	-53.3	174.3	160.3	0	0	0	0	111	Y902 H903 R908 L909 R910 L992 L1304	Y902-V906 HydrophobicContact CD1-CG2 3.99Å; Y902-V906 HydrophobicContact CE1-CG2 3.68Å; Y902-V906 WeakPolarHBondContact O-CG2 3.42Å; Y902-V906 PolarHBondContact O-N 3.01Å; H903-V906 WeakPolarHBondContact O-CB 3.37Å; H903-V906 PolarHBondContact O-N 2.76Å; V906-R908 PolarHBondContact O-N 3.16Å; V906-L909 PolarHBondContact O-N 2.97Å; V906-L909 VanDerWaalsContact O-N 3.15Å; V906-R910 WeakPolarHBondContact O-CG 3.34Å; V906-R910 PolarHBondContact O-N 3.48Å; V906-L992 HydrophobicContact CG2-CD2 3.62Å; V906-L1304 HydrophobicContact CB-CD2 4.36Å; V906-L1304 HydrophobicContact CG1-CD2 3.81Å; V906-L1304 HydrophobicContact CG2-CD2 4.48Å
907	K	86.5	Confident	80.8	Confident	116 Å²	116	63.4 Å²	63.4	50%	0.504	32%	0.316	S	S	.	.	H	α-helix	trans	-53.9	-49.7	176	-69	167.4	-158.4	164.3	0	111.7	H903 D904 L905 L909 R910 S911	H903-K907 VanDerWaalsContact O-CG 3.27Å; H903-K907 WeakPolarHBondContact O-CG 3.48Å; H903-K907 PolarHBondContact O-N 2.95Å; D904-K907 WeakPolarHBondContact OD1-CE 3.37Å; D904-K907 IonicContact OD1-NZ 3.84Å; D904-K907 PolarHBondContact OD1-NZ 2.99Å; L905-K907 PolarHBondContact O-N 3.36Å; K907-L909 VanDerWaalsContact C-N 3.27Å; K907-L909 PolarHBondContact O-N 2.88Å; K907-R910 WeakPolarHBondContact O-CB 3.44Å; K907-R910 PolarHBondContact O-N 3.37Å; K907-R910 VanDerWaalsContact O-N 3.12Å; K907-S911 PolarHBondContact O-N 3.47Å; K907-S911 PolarHBondContact O-OG 3.19Å
908	R	84.8	Confident	79.2	Confident	136 Å²	136	63.7 Å²	63.7	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-57.8	-39.4	179.4	-170.6	-178.3	-61.6	149.2	2.3	112	D904 L905 V906 Q912	D904-R908 VanDerWaalsContact O-CB 3.27Å; D904-R908 WeakPolarHBondContact O-CB 3.47Å; D904-R908 PolarHBondContact O-N 3.07Å; L905-R908 PolarHBondContact O-N 3.45Å; V906-R908 PolarHBondContact O-N 3.16Å; R908-Q912 WeakPolarHBondContact O-CB 3.39Å; R908-Q912 WeakPolarHBondContact O-CG 3.23Å; R908-Q912 PolarHBondContact O-N 2.69Å
909	L	83.4	Confident	77.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-73.5	-34.4	176.6	-64.3	174.7	0	0	0	112.9	L905 V906 K907 R913 L982 M988 L992 L1304	L905-L909 HydrophobicContact CD1-CD1 4.09Å; L905-L909 HydrophobicContact CD1-CG 4.17Å; L905-L909 HydrophobicContact CG-CD1 4.06Å; L905-L909 VanDerWaalsContact O-CG 3.24Å; L905-L909 WeakPolarHBondContact O-CG 3.45Å; L905-L909 PolarHBondContact O-N 3.36Å; V906-L909 PolarHBondContact O-N 2.97Å; V906-L909 VanDerWaalsContact O-N 3.15Å; K907-L909 VanDerWaalsContact C-N 3.27Å; K907-L909 PolarHBondContact O-N 2.88Å; L909-R913 PolarHBondContact O-N 3.13Å; L909-L982 HydrophobicContact CD2-CB 4.41Å; L909-L982 HydrophobicContact CD2-CD1 4.21Å; L909-L982 HydrophobicContact CD2-CD2 4.47Å; L909-M988 HydrophobicContact CB-SD 4.4Å; L909-M988 HydrophobicContact CD1-CB 4.09Å; L909-M988 HydrophobicContact CD1-CG 4.49Å; L909-M988 HydrophobicContact CD2-CB 4.25Å; L909-M988 HydrophobicContact CD2-CG 3.76Å; L909-M988 HydrophobicContact CD2-SD 3.84Å; L909-L992 HydrophobicContact CD1-CD1 4.25Å; L909-L992 HydrophobicContact CD1-CD2 4.19Å; L909-L992 HydrophobicContact CD1-CG 4.06Å; L909-L1304 HydrophobicContact CB-CD2 4.48Å
910	R	82.1	Confident	75.3	Confident	97 Å²	97	72.7 Å²	72.7	37%	0.366	37%	0.37	S	S	.	.	H	α-helix	trans	-59.9	-50.6	170	-62.8	-174.8	-169.5	170.7	5	110.6	V906 K907 Q912 R913 S914 L1304 L1306	V906-R910 WeakPolarHBondContact O-CG 3.34Å; V906-R910 PolarHBondContact O-N 3.48Å; K907-R910 WeakPolarHBondContact O-CB 3.44Å; K907-R910 PolarHBondContact O-N 3.37Å; K907-R910 VanDerWaalsContact O-N 3.12Å; R910-Q912 PolarHBondContact O-N 2.95Å; R910-R913 WeakPolarHBondContact O-CB 3.5Å; R910-R913 PolarHBondContact O-N 3.13Å; R910-R913 VanDerWaalsContact O-N 3.13Å; R910-S914 PolarHBondContact O-N 2.82Å; R910-S914 VanDerWaalsContact O-N 3.08Å; R910-L1304 HydrophobicContact CG-CB 4.2Å; R910-L1304 HydrophobicContact CG-CD1 4.29Å; R910-L1304 HydrophobicContact CG-CD2 3.75Å; R910-L1304 HydrophobicContact CG-CG 4.28Å; R910-L1304 PolarHBondContact NE-O 2.73Å; R910-L1304 VanDerWaalsContact NE-O 3.11Å; R910-L1304 PolarHBondContact NH2-O 2.62Å; R910-L1306 PolarHBondContact NH2-O 2.88Å; R910-L1306 PolarHBondContact NH2-OXT 3.06Å
911	S	81.1	Confident	72.8	Confident	70 Å²	70	74.8 Å²	74.8	49%	0.49	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-42.3	-179.1	-55.3	0	0	0	0	112.9	K907 R913 S914 L915	K907-S911 PolarHBondContact O-N 3.47Å; K907-S911 PolarHBondContact O-OG 3.19Å; S911-R913 PolarHBondContact O-N 3.36Å; S911-S914 PolarHBondContact O-N 3.45Å; S911-L915 WeakPolarHBondContact O-CG 3.33Å; S911-L915 PolarHBondContact O-N 2.9Å
912	Q	74.7	Confident	70.1	Confident	47 Å²	47	76.3 Å²	76.3	22%	0.22	41%	0.408	C	S	.	.	H	α-helix	trans	-63.4	-22.9	175.4	-77.7	-178.1	-1	0	0	113.9	R908 R910	R908-Q912 WeakPolarHBondContact O-CB 3.39Å; R908-Q912 WeakPolarHBondContact O-CG 3.23Å; R908-Q912 PolarHBondContact O-N 2.69Å; R910-Q912 PolarHBondContact O-N 2.95Å
913	R	71	Confident	67.4	Low	103 Å²	103	84.4 Å²	84.4	39%	0.389	45%	0.447	S	S	.	.	H	α-helix	trans	-79.7	-49.7	173.4	-173.2	171.5	174.5	178.5	-6.4	110.9	L909 R910 S911 L915 K916 D917	L909-R913 PolarHBondContact O-N 3.13Å; R910-R913 WeakPolarHBondContact O-CB 3.5Å; R910-R913 PolarHBondContact O-N 3.13Å; R910-R913 VanDerWaalsContact O-N 3.13Å; S911-R913 PolarHBondContact O-N 3.36Å; R913-L915 VanDerWaalsContact C-N 3.25Å; R913-L915 PolarHBondContact O-N 3.33Å; R913-K916 WeakPolarHBondContact O-CB 3.49Å; R913-K916 PolarHBondContact O-N 3.27Å; R913-D917 PolarHBondContact O-N 3.47Å
914	S	68.6	Low	64.7	Low	72 Å²	72	86.4 Å²	86.4	50%	0.503	46%	0.461	S	S	.	.	H	α-helix	trans	-54.5	-41	176.2	-165.6	0	0	0	0	112.5	R910 S911 K916 D917 T918	R910-S914 PolarHBondContact O-N 2.82Å; R910-S914 VanDerWaalsContact O-N 3.08Å; S911-S914 PolarHBondContact O-N 3.45Å; S914-K916 PolarHBondContact O-N 2.93Å; S914-D917 PolarHBondContact O-N 3.17Å; S914-T918 PolarHBondContact O-N 2.94Å; S914-T918 PolarHBondContact O-OG1 3.47Å
915	L	64.2	Low	62	Low	105 Å²	105	89.8 Å²	89.8	55%	0.55	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-14.3	176.6	-75	165.9	0	0	0	114.6	S911 R913 T918 N919	S911-L915 WeakPolarHBondContact O-CG 3.33Å; S911-L915 PolarHBondContact O-N 2.9Å; R913-L915 VanDerWaalsContact C-N 3.25Å; R913-L915 PolarHBondContact O-N 3.33Å; L915-T918 PolarHBondContact O-OG1 2.65Å; L915-N919 WeakPolarHBondContact O-CB 3.42Å; L915-N919 PolarHBondContact O-ND2 3.49Å
916	K	58	Low	59.7	Low	97 Å²	97	93.6 Å²	93.6	42%	0.422	51%	0.513	S	S	.	.	H	α-helix	trans	-93.1	-34.5	171.4	-71.1	179	175.8	-178.9	0	111.9	R913 S914 T918 S920 Q983	R913-K916 WeakPolarHBondContact O-CB 3.49Å; R913-K916 PolarHBondContact O-N 3.27Å; S914-K916 PolarHBondContact O-N 2.93Å; K916-T918 VanDerWaalsContact C-N 3.34Å; K916-S920 WeakPolarHBondContact O-CB 3.07Å; K916-S920 PolarHBondContact O-N 3.15Å; K916-S920 VanDerWaalsContact O-N 3.15Å; K916-S920 PolarHBondContact O-OG 2.63Å; K916-Q983 PolarHBondContact NZ-O 3Å
917	D	56.7	Low	57.4	Low	89 Å²	89	100.6 Å²	100.6	48%	0.476	55%	0.55	S	S	.	.	H	α-helix	trans	-73.5	-27.7	179.6	-59.4	-31.1	0	0	0	111.2	R913 S914 S920 N921	R913-D917 PolarHBondContact O-N 3.47Å; S914-D917 PolarHBondContact O-N 3.17Å; D917-S920 PolarHBondContact O-OG 3.03Å; D917-N921 PolarHBondContact O-ND2 3.04Å; D917-N921 VanDerWaalsContact O-ND2 3.12Å
918	T	55.3	Low	54.7	Low	79 Å²	79	102.9 Å²	102.9	49%	0.485	57%	0.567	S	S	.	*	H	α-helix	trans	-72.7	-53.7	166.9	54.5	0	0	0	0	112	S914 L915 K916 S920 N921	S914-T918 PolarHBondContact O-N 2.94Å; S914-T918 PolarHBondContact O-OG1 3.47Å; L915-T918 PolarHBondContact O-OG1 2.65Å; K916-T918 VanDerWaalsContact C-N 3.34Å; T918-S920 PolarHBondContact O-N 3.38Å; T918-N921 PolarHBondContact O-N 3.47Å
919	N	49.6	Very low	52	Low	125 Å²	125	103.9 Å²	103.9	67%	0.668	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-0.9	-177.7	-79.1	-54.2	0	0	0	115.1	L915	L915-N919 WeakPolarHBondContact O-CB 3.42Å; L915-N919 PolarHBondContact O-ND2 3.49Å
920	S	48.8	Very low	49.4	Very low	88 Å²	88	110.8 Å²	110.8	62%	0.615	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-7.4	172	47.8	0	0	0	0	113.9	K916 D917 T918	K916-S920 WeakPolarHBondContact O-CB 3.07Å; K916-S920 PolarHBondContact O-N 3.15Å; K916-S920 VanDerWaalsContact O-N 3.15Å; K916-S920 PolarHBondContact O-OG 2.63Å; D917-S920 PolarHBondContact O-OG 3.03Å; T918-S920 PolarHBondContact O-N 3.38Å
921	N	37.6	Very low	46.9	Very low	118 Å²	118	113.4 Å²	113.4	63%	0.631	64%	0.639	S	S	*	*	S	Bend	trans	-97.4	116.1	165.2	-71	-58.4	0	0	0	108.8	D917 T918 Q923	D917-N921 PolarHBondContact O-ND2 3.04Å; D917-N921 VanDerWaalsContact O-ND2 3.12Å; T918-N921 PolarHBondContact O-N 3.47Å; N921-Q923 PolarHBondContact O-N 3.24Å
922	G	31.2	Very low	44.4	Very low	87 Å²	87	119.1 Å²	119.1	90%	0.897	66%	0.658	S	S	*	*			trans	-74.7	93.6	-169.9	0	0	0	0	0	114.2
923	Q	33	Very low	42.3	Very low	178 Å²	178	123.1 Å²	123.1	83%	0.832	69%	0.69	S	S	*	*			trans	-131.8	141.1	161.1	-66.2	-176.5	-70.2	0	0	108.8	N921	N921-Q923 PolarHBondContact O-N 3.24Å
924	D	30.1	Very low	40.3	Very low	138 Å²	138	126.8 Å²	126.8	74%	0.738	71%	0.712	S	S	*	*			trans	-68.4	128.1	-167.4	-74.5	-65	0	0	0	113.3	S926	D924-S926 PolarHBondContact O-N 3.1Å
925	P	32.7	Very low	38.5	Very low	127 Å²	127	131.7 Å²	131.7	83%	0.825	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	58.5	177.4	34.4	-36.3	0	0	0	111.3
926	S	38.3	Very low	37.1	Very low	90 Å²	90	130 Å²	130	63%	0.629	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	-3.5	-176	56.9	0	0	0	0	114.6	D924	D924-S926 PolarHBondContact O-N 3.1Å
927	L	36.7	Very low	35.9	Very low	151 Å²	151	132.6 Å²	132.6	79%	0.791	76%	0.759	S	S	*	*	S	Bend	trans	-124.6	14.7	-171.1	-67.7	176.7	0	0	0	115.1
928	L	30.7	Very low	34.8	Very low	164 Å²	164	135.8 Å²	135.8	86%	0.859	77%	0.771	S	S	*	*			trans	-131.8	62.2	176.1	-71.3	176	0	0	0	112.2
929	L	28.6	Very low	33.9	Very low	157 Å²	157	138.4 Å²	138.4	82%	0.822	78%	0.782	S	S	*	*	S	Bend	trans	-120.1	147.6	146.5	-101.1	166.7	0	0	0	106.5
930	N	27.6	Very low	33.1	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	78%	0.784	S	S	*	*			trans	70.2	101.4	-172.3	-48.8	-1.8	0	0	0	113.8
931	N	30.1	Very low	32.5	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	79%	0.794	S	S	*	*			trans	-167.9	75.5	147.1	-100.2	-9.1	0	0	0	105.9
932	E	29.5	Very low	32.3	Very low	190 Å²	190	139.8 Å²	139.8	89%	0.888	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.6	143.4	161	-65.1	179.1	132.7	0	0	107.3
933	C	30.7	Very low	32.4	Very low	132 Å²	132	143.8 Å²	143.8	89%	0.892	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-103.8	120.7	172.9	-66.7	0	0	0	0	107.5
934	E	28.2	Very low	32.6	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-82.7	156.6	-175.5	-58.1	164.6	136.1	0	0	111.4
935	D	31.8	Very low	32.9	Very low	175 Å²	175	138 Å²	138	94%	0.936	80%	0.796	S	S	*	*			trans	-150.6	99.5	162.2	-103.7	-38.4	0	0	0	107.9
936	G	33.1	Very low	33	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	79%	0.791	S	S	*	*			trans	85.2	141.1	-178.6	0	0	0	0	0	115.1
937	D	34.7	Very low	33.2	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	79%	0.79	S	S	*	*			cis	-156.7	150.5	0.4	-147.9	-3.9	0	0	0	113
938	E	33.2	Very low	33	Very low	155 Å²	155	140.2 Å²	140.2	72%	0.724	79%	0.791	S	S	*	*			trans	46.5	118.8	159	-90.3	-170.3	-154.9	0	0	125
939	N	35	Very low	33.1	Very low	134 Å²	134	136 Å²	136	72%	0.717	79%	0.787	S	S	*	*			trans	90	115.4	139.8	-58.5	-44.1	0	0	0	124
940	A	32.9	Very low	33.2	Very low	86 Å²	86	137.8 Å²	137.8	71%	0.711	79%	0.791	S	S	*	*			trans	49.9	140	135.6	0	0	0	0	0	122.2
941	D	36.8	Very low	33.3	Very low	157 Å²	157	142.1 Å²	142.1	84%	0.84	80%	0.798	S	S	*	*			cis	-152.1	152.4	-1	-91.8	-34.8	0	0	0	109.9
942	P	33.5	Very low	33.3	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	80%	0.798	S	S	*	*			trans	-121.2	140	-178.8	39	-27.1	0	0	0	116.7
943	D	33.6	Very low	33.4	Very low	171 Å²	171	136.4 Å²	136.4	91%	0.914	79%	0.794	S	S	*	*			trans	-169.5	149	166	-137.6	29.5	0	0	0	109.5
944	A	36.7	Very low	33.2	Very low	71 Å²	71	141.4 Å²	141.4	59%	0.587	79%	0.794	S	S	*	*			cis	-168.3	165.5	-32.3	0	0	0	0	0	110.8
945	S	36	Very low	33.3	Very low	122 Å²	122	140.7 Å²	140.7	85%	0.853	79%	0.789	S	S	*	*			trans	67	157.7	158.3	74.5	0	0	0	0	120.3
946	D	36.3	Very low	33.1	Very low	136 Å²	136	142.9 Å²	142.9	73%	0.727	79%	0.79	S	S	*	*			cis	-159.3	157.1	-41.7	-157.2	48.4	0	0	0	108.2	K948	D946-K948 IonicContact OD2-NZ 2.69Å; D946-K948 PolarHBondContact OD2-NZ 3.22Å
947	P	40.9	Very low	33	Very low	94 Å²	94	144.1 Å²	144.1	61%	0.61	79%	0.793	S	S	*	*			trans	-109.5	172.8	-168.9	40.4	-34.5	0	0	0	115.2
948	K	33.5	Very low	32.5	Very low	186 Å²	186	147.7 Å²	147.7	81%	0.809	80%	0.795	S	S	*	*			trans	176.9	151.8	135.3	-94	144.4	-154.7	123.6	0	116.1	D946	D946-K948 IonicContact OD2-NZ 2.69Å; D946-K948 PolarHBondContact OD2-NZ 3.22Å
949	G	32.3	Very low	32.3	Very low	76 Å²	76	146.2 Å²	146.2	78%	0.784	79%	0.792	S	S	*	*			trans	99.9	140.9	159.5	0	0	0	0	0	116.5
950	E	32	Very low	31.8	Very low	194 Å²	194	145.9 Å²	145.9	91%	0.907	79%	0.79	S	S	*	*			cis	-158.7	173.6	-20	-167.3	156.6	-154.9	0	0	108.9
951	Y	28.3	Very low	31.5	Very low	235 Å²	235	148.7 Å²	148.7	92%	0.922	79%	0.793	S	S	*	*			trans	-88.8	139.3	-167	-82.2	-109.8	0	0	0	116.2
952	A	31.4	Very low	31	Very low	98 Å²	98	151.3 Å²	151.3	81%	0.81	79%	0.793	S	S	*	*			trans	-163.1	141.8	138	0	0	0	0	0	112.1
953	P	29.7	Very low	30.7	Very low	123 Å²	123	152.4 Å²	152.4	80%	0.799	80%	0.797	S	S	*	*			trans	-109.2	148.3	-168.4	38.7	-33.1	0	0	0	115.9
954	R	26.9	Very low	30.4	Very low	237 Å²	237	149.8 Å²	149.8	89%	0.894	79%	0.788	S	S	*	*			trans	-142	130.1	164.1	-77	-168.4	169.5	-176.2	-3.2	115.1
955	K	29.9	Very low	30.1	Very low	166 Å²	166	153.3 Å²	153.3	72%	0.722	80%	0.802	S	S	*	*			trans	20.7	114.9	147.1	-55.9	175.6	-175.7	175.7	0	118	S359	S359-K955 PolarHBondContact OG-NZ 2.76Å; S359-K955 VanDerWaalsContact OG-NZ 3.09Å
956	K	28.4	Very low	29.7	Very low	220 Å²	220	154.9 Å²	154.9	96%	0.957	80%	0.801	S	S	*	*			trans	-95.8	128	159.5	-87.6	-173.7	174.4	179	0	111.3
957	A	30.2	Very low	29.3	Very low	97 Å²	97	151.5 Å²	151.5	80%	0.802	80%	0.797	S	S	*	*			trans	-135.1	116.2	167.6	0	0	0	0	0	110.5
958	R	25.7	Very low	28.5	Very low	226 Å²	226	154.3 Å²	154.3	85%	0.853	81%	0.813	S	S	*	*			trans	24	132.6	153.2	-125.7	-173	175.8	164.8	-5.2	122.5
959	L	27.7	Very low	28.2	Very low	124 Å²	124	154.3 Å²	154.3	65%	0.649	81%	0.813	S	S	*	*			trans	92.4	137.3	135.1	-126.7	71.6	0	0	0	119.6
960	D	24.9	Very low	27.8	Very low	126 Å²	126	156.2 Å²	156.2	67%	0.674	82%	0.815	S	S	*	*			trans	54.2	141.3	162.2	-50.5	-32.1	0	0	0	119
961	N	27.6	Very low	27.5	Very low	146 Å²	146	156 Å²	156	78%	0.781	81%	0.811	S	S	*	*			cis	-154.6	-179	32.6	-129.1	-39	0	0	0	114.2
962	Y	25.7	Very low	27.3	Very low	212 Å²	212	150.7 Å²	150.7	83%	0.831	81%	0.805	S	S	*	*			trans	-71.3	157.6	176.2	-70.8	-106.7	0	0	0	114.1
963	T	27	Very low	27.1	Very low	140 Å²	140	150.5 Å²	150.5	86%	0.859	79%	0.794	S	S	*	*				-171.3	158.2	121.8	-74	0	0	0	0	110.7
964	T	26.6	Very low	27.1	Very low	116 Å²	116	147.4 Å²	147.4	71%	0.712	77%	0.773	S	S	*	*			trans	-82.1	149.5	-167.7	44.6	0	0	0	0	116.2
965	V	31.5	Very low	27.3	Very low	146 Å²	146	141.2 Å²	141.2	89%	0.885	77%	0.766	S	S	*	*			trans	-134.7	139.1	142.5	-178.8	0	0	0	0	107.7
966	N	26.4	Very low	27.4	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	77%	0.766	S	S	*	*			trans	-80.4	134.6	-173	-64	-50.8	0	0	0	112.5
967	G	28.4	Very low	27.7	Very low	64 Å²	64	134.3 Å²	134.3	66%	0.66	75%	0.745	S	S	*	*			trans	-169.4	123.1	170.1	0	0	0	0	0	110.4	K969	G967-K969 PolarHBondContact O-N 2.95Å
968	T	25.3	Very low	28.2	Very low	154 Å²	154	133.8 Å²	133.8	95%	0.945	73%	0.728	S	S	*	*			trans	-64.5	92.9	-171.7	45.7	0	0	0	0	112.4
969	K	26.7	Very low	28.9	Very low	186 Å²	186	125.3 Å²	125.3	81%	0.809	70%	0.703	S	S	*	*			trans	-139	143.2	177	-67.6	-171.6	176.9	-177.2	0	111.1	G967	G967-K969 PolarHBondContact O-N 2.95Å
970	S	24.6	Very low	29.7	Very low	116 Å²	116	125.9 Å²	125.9	81%	0.811	70%	0.703	S	S	*	*			trans	-64.5	135.1	178.5	48.5	0	0	0	0	112.4	P972	S970-P972 WeakPolarHBondContact O-CD 3.38Å
971	F	24.3	Very low	31	Very low	188 Å²	188	123 Å²	123	83%	0.825	69%	0.692	S	S	*	*			trans	-83.3	118.1	173.1	-82.7	-87.5	0	0	0	111.5	V973	F971-V973 HydrophobicContact CB-CG2 4.35Å; F971-V973 PolarHBondContact O-N 3.1Å
972	P	24.8	Very low	32.5	Very low	124 Å²	124	117 Å²	117	81%	0.805	66%	0.66	S	S	*	*			trans	-85.9	89.8	-179.4	33.5	-33.4	0	0	0	111.9	S970	S970-P972 WeakPolarHBondContact O-CD 3.38Å
973	V	26.4	Very low	34.2	Very low	95 Å²	95	112 Å²	112	58%	0.576	64%	0.644	S	S	*	*			trans	-136.7	126.7	179.4	-161.8	0	0	0	0	105.5	F971	F971-V973 HydrophobicContact CB-CG2 4.35Å; F971-V973 PolarHBondContact O-N 3.1Å
974	T	30.5	Very low	36.4	Very low	58 Å²	58	106.8 Å²	106.8	36%	0.356	61%	0.613	S	S	.	*			cis	-142.1	55	27.7	-29.2	0	0	0	0	114.2	K976	T974-K976 PolarHBondContact O-N 2.74Å
975	S	31.2	Very low	38.7	Very low	106 Å²	106	102.6 Å²	102.6	74%	0.741	59%	0.588	S	S	*	*	H	α-helix	trans	-61.6	-12.2	-171.1	62.2	0	0	0	0	117.4
976	K	32.3	Very low	40.7	Very low	167 Å²	167	98.7 Å²	98.7	73%	0.726	57%	0.567	S	S	*	*	H	α-helix	trans	-79.1	-46.4	-172.2	-72.5	178.3	177.5	171.9	0	114.6	T974 I978 S979 E980	T974-K976 PolarHBondContact O-N 2.74Å; K976-I978 PolarHBondContact O-N 2.94Å; K976-S979 WeakPolarHBondContact O-CB 3.47Å; K976-S979 PolarHBondContact O-N 3.21Å; K976-S979 VanDerWaalsContact O-N 3.14Å; K976-S979 PolarHBondContact O-OG 3.41Å; K976-E980 PolarHBondContact O-N 2.98Å
977	S	34.3	Very low	43.3	Very low	75 Å²	75	94.7 Å²	94.7	52%	0.524	55%	0.546	S	S	.	.	H	α-helix	trans	-60.8	-48.7	-170.4	52.1	0	0	0	0	112.9	S979 E980	S977-S979 VanDerWaalsContact C-N 3.28Å; S977-S979 PolarHBondContact O-N 2.88Å; S977-E980 PolarHBondContact O-N 3.23Å
978	I	40.3	Very low	45.9	Very low	86 Å²	86	92.6 Å²	92.6	44%	0.441	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-36.3	178	-59.8	176.6	0	0	0	110.8	K976 E980 S981	K976-I978 PolarHBondContact O-N 2.94Å; I978-E980 VanDerWaalsContact C-N 3.32Å; I978-E980 PolarHBondContact O-N 3.31Å; I978-S981 PolarHBondContact O-N 2.59Å; I978-S981 PolarHBondContact O-OG 3.13Å
979	S	41.5	Very low	48.8	Very low	47 Å²	47	85.3 Å²	85.3	33%	0.329	47%	0.474	S	S	.	.	H	α-helix	trans	-63.8	-32	-176.8	81.8	0	0	0	0	113.8	K976 S977	K976-S979 WeakPolarHBondContact O-CB 3.47Å; K976-S979 PolarHBondContact O-N 3.21Å; K976-S979 VanDerWaalsContact O-N 3.14Å; K976-S979 PolarHBondContact O-OG 3.41Å; S977-S979 VanDerWaalsContact C-N 3.28Å; S977-S979 PolarHBondContact O-N 2.88Å
980	E	43.5	Very low	51.6	Low	137 Å²	137	79.1 Å²	79.1	64%	0.64	45%	0.452	S	S	*	.	H	α-helix	trans	-73.6	-30.2	178.4	-63.1	-161.1	161.4	0	0	112.7	K976 S977 I978 L982 Q983	K976-E980 PolarHBondContact O-N 2.98Å; S977-E980 PolarHBondContact O-N 3.23Å; I978-E980 VanDerWaalsContact C-N 3.32Å; I978-E980 PolarHBondContact O-N 3.31Å; E980-L982 VanDerWaalsContact C-N 3.33Å; E980-L982 PolarHBondContact O-N 3.09Å; E980-Q983 VanDerWaalsContact O-CG 3.3Å; E980-Q983 WeakPolarHBondContact O-CG 3.27Å
981	S	52.6	Low	54.6	Low	65 Å²	65	74.7 Å²	74.7	46%	0.455	42%	0.422	S	S	.	.	H	α-helix	trans	-66.8	-31.4	-178.8	78.4	0	0	0	0	113.6	I978 N987	I978-S981 PolarHBondContact O-N 2.59Å; I978-S981 PolarHBondContact O-OG 3.13Å; S981-N987 PolarHBondContact O-ND2 2.86Å
982	L	58.9	Low	57.7	Low	19 Å²	19	65.7 Å²	65.7	10%	0.099	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-4.8	-174.4	-69.7	172.4	0	0	0	113.9	L909 E980 S984 M988 A991	L909-L982 HydrophobicContact CD2-CB 4.41Å; L909-L982 HydrophobicContact CD2-CD1 4.21Å; L909-L982 HydrophobicContact CD2-CD2 4.47Å; E980-L982 VanDerWaalsContact C-N 3.33Å; E980-L982 PolarHBondContact O-N 3.09Å; L982-S984 PolarHBondContact O-N 2.81Å; L982-M988 WeakPolarHBondContact O-CG 3.41Å; L982-A991 HydrophobicContact CD2-CB 4.21Å
983	Q	61.9	Low	60.9	Low	108 Å²	108	60.2 Å²	60.2	51%	0.505	35%	0.346	S	S	.	.			trans	-59.1	-14.3	-172.6	-68.6	-178.9	13.7	0	0	116.1	K916 E980	K916-Q983 PolarHBondContact NZ-O 3Å; E980-Q983 VanDerWaalsContact O-CG 3.3Å; E980-Q983 WeakPolarHBondContact O-CG 3.27Å
984	S	71.4	Confident	63.9	Low	30 Å²	30	58.4 Å²	58.4	21%	0.21	33%	0.33	C	S	.	.	S	Bend	trans	-101.7	127.9	-175.9	155.6	0	0	0	0	111.2	L982 C986 N987 M988	L982-S984 PolarHBondContact O-N 2.81Å; S984-C986 PolarHBondContact O-N 3.05Å; S984-C986 VanDerWaalsContact O-N 3.12Å; S984-N987 WeakPolarHBondContact CB-OD1 3.48Å; S984-N987 WeakPolarHBondContact O-CA 3.29Å; S984-N987 WeakPolarHBondContact O-CB 3.18Å; S984-N987 PolarHBondContact O-N 3.26Å; S984-N987 PolarHBondContact OG-OD1 3.48Å; S984-M988 PolarHBondContact O-N 3.35Å; S984-M988 VanDerWaalsContact O-N 3.07Å
985	P	75.3	Confident	66.7	Low	29 Å²	29	55.7 Å²	55.7	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-55.2	-32.3	178.8	-28.2	35.5	0	0	0	114.9	N987 M988 V989 V1296 L1300	P985-N987 VanDerWaalsContact C-N 3.3Å; P985-N987 PolarHBondContact O-N 3.12Å; P985-M988 HydrophobicContact CB-CE 4.32Å; P985-M988 HydrophobicContact CG-CE 4.1Å; P985-M988 PolarHBondContact O-N 2.98Å; P985-V989 WeakPolarHBondContact O-CB 3.22Å; P985-V989 PolarHBondContact O-N 3.19Å; P985-V1296 HydrophobicContact CB-CG1 3.63Å; P985-L1300 HydrophobicContact CB-CD2 4.31Å
986	C	74.3	Confident	69.6	Low	64 Å²	64	50.6 Å²	50.6	43%	0.432	28%	0.278	S	S	.	.	H	α-helix	trans	-67.4	-32.4	174.6	-172	0	0	0	0	112.1	S984 T990	S984-C986 PolarHBondContact O-N 3.05Å; S984-C986 VanDerWaalsContact O-N 3.12Å; C986-T990 WeakPolarHBondContact O-CB 3.32Å; C986-T990 PolarHBondContact O-N 2.82Å; C986-T990 PolarHBondContact O-OG1 3.44Å
987	N	81.3	Confident	72.5	Confident	71 Å²	71	42.7 Å²	42.7	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-74.3	-41	177.2	-58.1	23.6	0	0	0	109.8	S981 S984 P985 T990 A991	S981-N987 PolarHBondContact O-ND2 2.86Å; S984-N987 WeakPolarHBondContact CB-OD1 3.48Å; S984-N987 WeakPolarHBondContact O-CA 3.29Å; S984-N987 WeakPolarHBondContact O-CB 3.18Å; S984-N987 PolarHBondContact O-N 3.26Å; S984-N987 PolarHBondContact OG-OD1 3.48Å; P985-N987 VanDerWaalsContact C-N 3.3Å; P985-N987 PolarHBondContact O-N 3.12Å; N987-T990 PolarHBondContact O-N 3.21Å; N987-A991 PolarHBondContact O-N 3.06Å
988	M	83.1	Confident	75.2	Confident	20 Å²	20	39.3 Å²	39.3	10%	0.099	22%	0.219	C	C	.	.	H	α-helix	trans	-56.7	-51.8	172.6	-58.6	-163.8	-110.8	0	0	111.7	L909 L982 S984 P985 T990 A991 L992 L1300	L909-M988 HydrophobicContact CB-SD 4.4Å; L909-M988 HydrophobicContact CD1-CB 4.09Å; L909-M988 HydrophobicContact CD1-CG 4.49Å; L909-M988 HydrophobicContact CD2-CB 4.25Å; L909-M988 HydrophobicContact CD2-CG 3.76Å; L909-M988 HydrophobicContact CD2-SD 3.84Å; L982-M988 WeakPolarHBondContact O-CG 3.41Å; S984-M988 PolarHBondContact O-N 3.35Å; S984-M988 VanDerWaalsContact O-N 3.07Å; P985-M988 HydrophobicContact CB-CE 4.32Å; P985-M988 HydrophobicContact CG-CE 4.1Å; P985-M988 PolarHBondContact O-N 2.98Å; M988-T990 VanDerWaalsContact C-N 3.29Å; M988-T990 PolarHBondContact O-N 3.02Å; M988-A991 PolarHBondContact O-N 3.13Å; M988-A991 VanDerWaalsContact O-N 3.16Å; M988-L992 WeakPolarHBondContact O-CG 3.32Å; M988-L992 PolarHBondContact O-N 2.89Å; M988-L1300 HydrophobicContact CB-CD1 4.14Å; M988-L1300 HydrophobicContact CB-CD2 4.14Å; M988-L1300 HydrophobicContact CE-CD2 3.85Å; M988-L1300 HydrophobicContact SD-CD2 3.82Å
989	V	86	Confident	77.4	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-36	175.1	155.6	0	0	0	0	112.5	P985 R993 F1166 L1198 V1296 L1300	P985-V989 WeakPolarHBondContact O-CB 3.22Å; P985-V989 PolarHBondContact O-N 3.19Å; V989-R993 WeakPolarHBondContact O-CG 3.48Å; V989-R993 PolarHBondContact O-N 3.35Å; V989-R993 VanDerWaalsContact O-N 3.07Å; V989-F1166 HydrophobicContact CG1-CE1 4.23Å; V989-F1166 HydrophobicContact CG1-CZ 3.64Å; V989-L1198 HydrophobicContact CB-CD2 4.29Å; V989-L1198 HydrophobicContact CG1-CD2 4.15Å; V989-L1198 HydrophobicContact CG2-CD2 4.21Å; V989-L1198 WeakPolarHBondContact O-CD2 3.32Å; V989-V1296 HydrophobicContact CB-CG1 4.45Å; V989-V1296 HydrophobicContact CG2-CG1 3.92Å; V989-L1300 HydrophobicContact CG2-CB 4.34Å
990	T	86.1	Confident	79.4	Confident	56 Å²	56	34.4 Å²	34.4	34%	0.344	19%	0.191	S	C	.	.	H	α-helix	trans	-70	-37.3	175.6	-56.7	0	0	0	0	112.2	C986 N987 M988 R993 K994 F1095	C986-T990 WeakPolarHBondContact O-CB 3.32Å; C986-T990 PolarHBondContact O-N 2.82Å; C986-T990 PolarHBondContact O-OG1 3.44Å; N987-T990 PolarHBondContact O-N 3.21Å; M988-T990 VanDerWaalsContact C-N 3.29Å; M988-T990 PolarHBondContact O-N 3.02Å; T990-R993 PolarHBondContact O-N 3.28Å; T990-K994 PolarHBondContact O-N 2.79Å; T990-F1095 HydrophobicContact CG2-CE1 4.02Å; T990-F1095 HydrophobicContact CG2-CZ 4.29Å
991	A	86.4	Confident	81.4	Confident	22 Å²	22	28 Å²	28	18%	0.182	16%	0.161	C	C	.	.	H	α-helix	trans	-67.7	-44	176.8	0	0	0	0	0	111.7	L905 L982 N987 M988 R993 K994 A995	L905-A991 HydrophobicContact CD2-CB 4.04Å; L982-A991 HydrophobicContact CD2-CB 4.21Å; N987-A991 PolarHBondContact O-N 3.06Å; M988-A991 PolarHBondContact O-N 3.13Å; M988-A991 VanDerWaalsContact O-N 3.16Å; A991-R993 PolarHBondContact O-N 2.95Å; A991-K994 WeakPolarHBondContact O-CB 3.23Å; A991-K994 PolarHBondContact O-N 3.37Å; A991-A995 PolarHBondContact O-N 3.32Å
992	L	89.7	Confident	82.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-41.3	174.1	-68.3	171.2	0	0	0	111.8	Y902 L905 V906 L909 M988 K994 A995 A996 L1198 L1300	Y902-L992 HydrophobicContact CE1-CD2 4.43Å; Y902-L992 HydrophobicContact CE2-CB 4.3Å; Y902-L992 HydrophobicContact CE2-CD2 4.08Å; L905-L992 HydrophobicContact CD2-CD2 4.01Å; L905-L992 HydrophobicContact CG-CD2 4.11Å; V906-L992 HydrophobicContact CG2-CD2 3.62Å; L909-L992 HydrophobicContact CD1-CD1 4.25Å; L909-L992 HydrophobicContact CD1-CD2 4.19Å; L909-L992 HydrophobicContact CD1-CG 4.06Å; M988-L992 WeakPolarHBondContact O-CG 3.32Å; M988-L992 PolarHBondContact O-N 2.89Å; L992-K994 PolarHBondContact O-N 3.04Å; L992-A995 PolarHBondContact O-N 2.87Å; L992-A996 WeakPolarHBondContact O-CB 3.42Å; L992-A996 PolarHBondContact O-N 3.14Å; L992-L1198 HydrophobicContact CB-CB 4.47Å; L992-L1198 HydrophobicContact CB-CD2 3.53Å; L992-L1198 HydrophobicContact CD1-CD2 4.09Å; L992-L1198 HydrophobicContact CG-CD2 4.47Å; L992-L1300 HydrophobicContact CD1-CD1 3.87Å
993	R	91	Very high	83.2	Confident	9 Å²	9	28.2 Å²	28.2	3%	0.034	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-34.8	172.6	-81	-174.3	63.8	143	6.2	114.1	V989 T990 A991 N997 F1095 D1163 I1164 L1198 M1202	V989-R993 WeakPolarHBondContact O-CG 3.48Å; V989-R993 PolarHBondContact O-N 3.35Å; V989-R993 VanDerWaalsContact O-N 3.07Å; T990-R993 PolarHBondContact O-N 3.28Å; A991-R993 PolarHBondContact O-N 2.95Å; R993-N997 PolarHBondContact O-N 3.16Å; R993-N997 PolarHBondContact O-ND2 2.96Å; R993-F1095 HydrophobicContact CB-CE2 4.08Å; R993-F1095 HydrophobicContact CB-CZ 4.02Å; R993-D1163 IonicContact CZ-OD2 2.71Å; R993-D1163 IonicContact NE-OD2 3.66Å; R993-D1163 IonicContact NH2-OD2 3.87Å; R993-D1163 PolarHBondContact NH2-OD2 3.3Å; R993-I1164 PolarHBondContact NH1-O 3.18Å; R993-I1164 PolarHBondContact NH2-O 3.36Å; R993-L1198 HydrophobicContact CG-CD2 4.23Å; R993-M1202 HydrophobicContact CG-SD 4.02Å
994	K	90.6	Very high	83.4	Confident	57 Å²	57	25 Å²	25	25%	0.248	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-48.8	171.9	-83	179.5	145.8	-144.2	0	110.5	T990 A991 L992 A996 N997 H998 L1001	T990-K994 PolarHBondContact O-N 2.79Å; A991-K994 WeakPolarHBondContact O-CB 3.23Å; A991-K994 PolarHBondContact O-N 3.37Å; L992-K994 PolarHBondContact O-N 3.04Å; K994-A996 PolarHBondContact O-N 2.96Å; K994-N997 PolarHBondContact O-N 3.13Å; K994-H998 PolarHBondContact O-N 2.97Å; K994-L1001 HydrophobicContact CB-CB 4.01Å; K994-L1001 HydrophobicContact CD-CB 4.45Å; K994-L1001 HydrophobicContact CG-CB 4.2Å; K994-L1001 PolarHBondContact NZ-O 3.06Å
995	A	89.7	Confident	83.6	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-41.7	-179.2	0	0	0	0	0	113.1	Q898 Y902 L905 A991 L992 N997 F1002	Q898-A995 PolarHBondContact NE2-O 3.29Å; Y902-A995 HydrophobicContact CD2-CB 3.68Å; Y902-A995 HydrophobicContact CE2-CB 4.39Å; L905-A995 HydrophobicContact CD2-CB 4.09Å; A991-A995 PolarHBondContact O-N 3.32Å; L992-A995 PolarHBondContact O-N 2.87Å; A995-N997 PolarHBondContact O-N 2.97Å; A995-F1002 HydrophobicContact CB-CD2 4.45Å; A995-F1002 HydrophobicContact CB-CE1 4.31Å; A995-F1002 HydrophobicContact CB-CE2 3.41Å; A995-F1002 VanDerWaalsContact CB-CE2 3.41Å; A995-F1002 HydrophobicContact CB-CZ 3.33Å
996	A	91.8	Very high	83.6	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-25.2	174.8	0	0	0	0	0	113.4	Q898 Y902 L992 K994 S1194 T1197 E1199	Q898-A996 PolarHBondContact NE2-O 2.93Å; Y902-A996 HydrophobicContact CE2-CB 4.21Å; L992-A996 WeakPolarHBondContact O-CB 3.42Å; L992-A996 PolarHBondContact O-N 3.14Å; K994-A996 PolarHBondContact O-N 2.96Å; A996-S1194 PolarHBondContact O-OG 3.1Å; A996-T1197 HydrophobicContact CB-CG2 4.08Å; A996-E1199 HydrophobicContact CB-CG 4.27Å
997	N	92.4	Very high	83.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-88.8	-51	-179.6	-83	-48.7	0	0	0	113.9	R993 K994 A995 L1001 S1069 K1071 M1098 H1162 D1163	R993-N997 PolarHBondContact O-N 3.16Å; R993-N997 PolarHBondContact O-ND2 2.96Å; K994-N997 PolarHBondContact O-N 3.13Å; A995-N997 PolarHBondContact O-N 2.97Å; N997-L1001 HydrophobicContact CB-CD1 4.09Å; N997-S1069 VanDerWaalsContact O-CB 3.27Å; N997-S1069 WeakPolarHBondContact O-CB 3.36Å; N997-S1069 PolarHBondContact O-OG 3.07Å; N997-K1071 PolarHBondContact OD1-NZ 3.01Å; N997-M1098 HydrophobicContact CB-SD 4Å; N997-H1162 PolarHBondContact OD1-CE1 3.26Å; N997-H1162 VanDerWaalsContact OD1-CE1 3.24Å; N997-H1162 PolarHBondContact OD1-ND1 3.34Å; N997-H1162 VanDerWaalsContact OD1-ND1 3.1Å; N997-D1163 WeakPolarHBondContact OD1-CB 3.36Å
998	H	90.8	Very high	84	Confident	4 Å²	4	24.2 Å²	24.2	2%	0.019	15%	0.151	C	C	.	.			trans	-162.1	143.8	-179.6	-163.3	-88.1	0	0	0	113.6	K994 A1000 L1001 I1065 S1069 I1072 M1098 I1101	K994-H998 PolarHBondContact O-N 2.97Å; H998-A1000 WeakPolarHBondContact CE1-CB 3.27Å; H998-A1000 WeakPolarHBondContact ND1-CB 3.37Å; H998-A1000 PolarHBondContact ND1-N 3.2Å; H998-A1000 PolarHBondContact O-N 2.94Å; H998-L1001 HydrophobicContact CB-CD1 4.07Å; H998-L1001 HydrophobicContact CB-CG 4.16Å; H998-L1001 WeakPolarHBondContact O-CB 3.15Å; H998-L1001 PolarHBondContact O-N 2.74Å; H998-I1065 WeakPolarHBondContact NE2-CA 3.36Å; H998-I1065 PolarHBondContact NE2-O 3.37Å; H998-S1069 VanDerWaalsContact CD2-CB 3.41Å; H998-S1069 WeakPolarHBondContact CD2-CB 3.5Å; H998-I1072 WeakPolarHBondContact CD2-CD1 3.36Å; H998-I1072 WeakPolarHBondContact NE2-CD1 3.17Å; H998-M1098 HydrophobicContact CB-CE 4.25Å; H998-M1098 HydrophobicContact CB-SD 4.01Å; H998-I1101 HydrophobicContact CB-CD1 4.19Å
999	Q	87.5	Confident	83.9	Confident	25 Å²	25	27.2 Å²	27.2	12%	0.117	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-62	-41.5	178.4	-76.5	172.2	80.4	0	0	113.4	T895 T897 Q898 L1001 F1002 L1005 G1068	T895-Q999 PolarHBondContact OG1-NE2 3.21Å; T897-Q999 PolarHBondContact OG1-NE2 2.61Å; T897-Q999 PolarHBondContact OG1-OE1 3.44Å; Q898-Q999 HydrophobicContact CB-CG 3.8Å; Q898-Q999 HydrophobicContact CG-CG 4.12Å; Q898-Q999 VanDerWaalsContact N-CD 3.33Å; Q999-L1001 PolarHBondContact O-N 2.73Å; Q999-F1002 WeakPolarHBondContact O-CB 3.33Å; Q999-F1002 WeakPolarHBondContact O-CD2 3.36Å; Q999-F1002 PolarHBondContact O-N 2.87Å; Q999-L1005 HydrophobicContact CB-CD1 4.47Å; Q999-G1068 WeakPolarHBondContact CB-O 3.28Å; Q999-G1068 VanDerWaalsContact CG-O 3.27Å; Q999-G1068 WeakPolarHBondContact CG-O 3.45Å; Q999-G1068 PolarHBondContact N-O 3.42Å; Q999-G1068 VanDerWaalsContact NE2-C 3.33Å; Q999-G1068 PolarHBondContact NE2-O 2.97Å
1000	A	83.6	Confident	83.8	Confident	6 Å²	6	30.4 Å²	30.4	5%	0.05	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-72.4	4.2	-179.3	0	0	0	0	0	114.3	H998 D1042 H1043	H998-A1000 WeakPolarHBondContact CE1-CB 3.27Å; H998-A1000 WeakPolarHBondContact ND1-CB 3.37Å; H998-A1000 PolarHBondContact ND1-N 3.2Å; H998-A1000 PolarHBondContact O-N 2.94Å; A1000-D1042 HydrophobicContact CB-CB 4.34Å; A1000-D1042 PolarHBondContact O-N 3.05Å; A1000-H1043 HydrophobicContact CB-CB 3.74Å; A1000-H1043 WeakPolarHBondContact O-CB 3.41Å; A1000-H1043 PolarHBondContact O-N 3.26Å
1001	L	84.3	Confident	83.7	Confident	1 Å²	1	30 Å²	30	1%	0.005	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-87.8	-10.7	167.4	-66.9	173.4	0	0	0	113.7	K994 N997 H998 Q999 I1097 M1098 I1101	K994-L1001 HydrophobicContact CB-CB 4.01Å; K994-L1001 HydrophobicContact CD-CB 4.45Å; K994-L1001 HydrophobicContact CG-CB 4.2Å; K994-L1001 PolarHBondContact NZ-O 3.06Å; N997-L1001 HydrophobicContact CB-CD1 4.09Å; H998-L1001 HydrophobicContact CB-CD1 4.07Å; H998-L1001 HydrophobicContact CB-CG 4.16Å; H998-L1001 WeakPolarHBondContact O-CB 3.15Å; H998-L1001 PolarHBondContact O-N 2.74Å; Q999-L1001 PolarHBondContact O-N 2.73Å; L1001-I1097 HydrophobicContact CD2-CB 3.89Å; L1001-I1097 HydrophobicContact CD2-CG2 3.56Å; L1001-M1098 HydrophobicContact CD1-SD 3.92Å; L1001-I1101 HydrophobicContact CD1-CD1 4.41Å; L1001-I1101 HydrophobicContact CD2-CD1 3.59Å; L1001-I1101 HydrophobicContact CG-CD1 3.67Å
1002	F	79.3	Confident	83.6	Confident	29 Å²	29	29.1 Å²	29.1	13%	0.127	18%	0.178	C	C	.	.	S	Bend	trans	-70.9	172	162.9	-75.3	-99	0	0	0	110.8	H901 L905 A995 Q999 L1005 S1041 D1042	H901-F1002 HydrophobicContact CB-CE1 4.41Å; H901-F1002 HydrophobicContact CB-CE2 4.16Å; H901-F1002 HydrophobicContact CB-CZ 3.86Å; L905-F1002 HydrophobicContact CB-CE1 4.23Å; L905-F1002 HydrophobicContact CD2-CE1 4.01Å; L905-F1002 HydrophobicContact CD2-CZ 4.28Å; A995-F1002 HydrophobicContact CB-CD2 4.45Å; A995-F1002 HydrophobicContact CB-CE1 4.31Å; A995-F1002 HydrophobicContact CB-CE2 3.41Å; A995-F1002 VanDerWaalsContact CB-CE2 3.41Å; A995-F1002 HydrophobicContact CB-CZ 3.33Å; Q999-F1002 WeakPolarHBondContact O-CB 3.33Å; Q999-F1002 WeakPolarHBondContact O-CD2 3.36Å; Q999-F1002 PolarHBondContact O-N 2.87Å; F1002-L1005 HydrophobicContact CB-CD1 3.59Å; F1002-L1005 HydrophobicContact CB-CG 3.75Å; F1002-L1005 HydrophobicContact CD1-CD1 4.17Å; F1002-L1005 HydrophobicContact CD2-CD1 3.57Å; F1002-L1005 HydrophobicContact CE2-CD1 4.14Å; F1002-L1005 HydrophobicContact CG-CD1 3.55Å; F1002-L1005 HydrophobicContact CG-CG 4.1Å; F1002-S1041 CarbonylContact O-C 3.52Å; F1002-S1041 WeakPolarHBondContact O-CA 3.39Å; F1002-S1041 WeakPolarHBondContact O-CB 3.41Å; F1002-D1042 PolarHBondContact O-N 2.77Å
1003	S	71.2	Confident	83.5	Confident	60 Å²	60	34.7 Å²	34.7	42%	0.42	20%	0.199	S	C	.	.	S	Bend	trans	-118.9	122.4	171.1	54	0	0	0	0	108.3	M1040	S1003-M1040 WeakPolarHBondContact CB-O 3.41Å
1004	G	65.9	Low	83.2	Confident	41 Å²	41	36.9 Å²	36.9	42%	0.423	21%	0.212	S	C	.	.	S	Bend	trans	84.7	32.5	175	0	0	0	0	0	115.7	Y1007 D1042	G1004-Y1007 WeakPolarHBondContact CA-O 3.49Å; G1004-D1042 PolarHBondContact N-OD1 3.19Å
1005	L	75.4	Confident	83	Confident	62 Å²	62	34.2 Å²	34.2	33%	0.325	20%	0.2	S	C	.	.	S	Bend	trans	-96.9	-52.4	168.2	-63.4	-176.3	0	0	0	111.6	H901 Q999 F1002 D1042	H901-L1005 HydrophobicContact CB-CD1 4.03Å; H901-L1005 HydrophobicContact CB-CD2 4.44Å; Q999-L1005 HydrophobicContact CB-CD1 4.47Å; F1002-L1005 HydrophobicContact CB-CD1 3.59Å; F1002-L1005 HydrophobicContact CB-CG 3.75Å; F1002-L1005 HydrophobicContact CD1-CD1 4.17Å; F1002-L1005 HydrophobicContact CD2-CD1 3.57Å; F1002-L1005 HydrophobicContact CE2-CD1 4.14Å; F1002-L1005 HydrophobicContact CG-CD1 3.55Å; F1002-L1005 HydrophobicContact CG-CG 4.1Å; L1005-D1042 WeakPolarHBondContact CA-OD2 3.36Å; L1005-D1042 WeakPolarHBondContact CB-OD2 3.44Å; L1005-D1042 PolarHBondContact N-OD2 2.94Å
1006	A	75.2	Confident	82.8	Confident	40 Å²	40	34.3 Å²	34.3	33%	0.331	20%	0.201	S	C	.	.	S	Bend	trans	-86.1	-25.1	-179.9	0	0	0	0	0	113	D1042 L1060	A1006-D1042 HydrophobicContact CB-CB 4.27Å; A1006-D1042 PolarHBondContact N-OD2 3.24Å; A1006-L1060 HydrophobicContact CB-CD1 4.3Å; A1006-L1060 HydrophobicContact CB-CD2 3.71Å
1007	Y	80.6	Confident	82.5	Confident	4 Å²	4	40 Å²	40	2%	0.016	23%	0.227	C	C	.	.	S	Bend	trans	-113.7	109.1	178.3	-64.2	-81.2	0	0	0	109.8	G1004 L1012 I1015 D1042 I1045 H1046 Y1058 L1060	G1004-Y1007 WeakPolarHBondContact CA-O 3.49Å; Y1007-L1012 HydrophobicContact CG-CD2 4.34Å; Y1007-I1015 HydrophobicContact CD1-CD1 3.62Å; Y1007-I1015 HydrophobicContact CE1-CD1 3.83Å; Y1007-D1042 HydrophobicContact CD2-CB 4Å; Y1007-D1042 HydrophobicContact CE2-CB 4.32Å; Y1007-D1042 WeakPolarHBondContact CE2-O 3.47Å; Y1007-I1045 HydrophobicContact CD1-CG2 3.85Å; Y1007-I1045 HydrophobicContact CD2-CB 3.89Å; Y1007-I1045 HydrophobicContact CD2-CD1 4.16Å; Y1007-I1045 HydrophobicContact CD2-CG2 3.71Å; Y1007-I1045 HydrophobicContact CE1-CG2 3.86Å; Y1007-I1045 HydrophobicContact CE2-CB 3.86Å; Y1007-I1045 HydrophobicContact CE2-CG2 3.72Å; Y1007-I1045 HydrophobicContact CG-CB 4.42Å; Y1007-I1045 HydrophobicContact CG-CD1 4.48Å; Y1007-I1045 HydrophobicContact CG-CG2 3.79Å; Y1007-H1046 HydrophobicContact CE2-CB 4.41Å; Y1007-H1046 WeakPolarHBondContact OH-CA 3.41Å; Y1007-Y1058 VanDerWaalsContact CE1-O 3.26Å; Y1007-Y1058 WeakPolarHBondContact CE1-O 3.38Å; Y1007-Y1058 PolarHBondContact OH-O 2.89Å; Y1007-L1060 HydrophobicContact CE2-CD1 4.32Å; Y1007-L1060 HydrophobicContact CE2-CD2 3.89Å; Y1007-L1060 HydrophobicContact CE2-CG 4.18Å
1008	T	82.5	Confident	82.1	Confident	71 Å²	71	41.4 Å²	41.4	44%	0.436	24%	0.237	S	C	.	.			trans	-75.7	164	178.7	83.2	0	0	0	0	111.9	S1010 N1011 L1012	T1008-S1010 PolarHBondContact O-N 2.79Å; T1008-S1010 VanDerWaalsContact O-N 3.09Å; T1008-S1010 PolarHBondContact OG1-N 2.96Å; T1008-N1011 PolarHBondContact O-N 3.06Å; T1008-N1011 PolarHBondContact OG1-N 2.98Å; T1008-N1011 PolarHBondContact OG1-OD1 3.46Å; T1008-L1012 WeakPolarHBondContact O-CG 3.32Å; T1008-L1012 PolarHBondContact O-N 2.91Å
1009	D	81.5	Confident	81.6	Confident	83 Å²	83	41.4 Å²	41.4	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-55.1	-24.7	173.2	-80.6	-40.5	0	0	0	114.1	R1013 Y1034	D1009-R1013 WeakPolarHBondContact O-CG 3.47Å; D1009-Y1034 PolarHBondContact OD1-OH 3.36Å
1010	S	83.5	Confident	81.3	Confident	68 Å²	68	43.6 Å²	43.6	48%	0.476	25%	0.247	S	C	.	.	H	α-helix	trans	-72.3	-60.4	169.6	-166.8	0	0	0	0	109.7	T1008 L1012 R1013 D1014	T1008-S1010 PolarHBondContact O-N 2.79Å; T1008-S1010 VanDerWaalsContact O-N 3.09Å; T1008-S1010 PolarHBondContact OG1-N 2.96Å; S1010-L1012 PolarHBondContact O-N 3.25Å; S1010-R1013 WeakPolarHBondContact O-CA 2.99Å; S1010-R1013 WeakPolarHBondContact O-CB 3.46Å; S1010-R1013 PolarHBondContact O-N 2.95Å; S1010-D1014 PolarHBondContact O-N 2.93Å; S1010-D1014 PolarHBondContact OG-OD2 2.89Å; S1010-D1014 VanDerWaalsContact OG-OD2 3.12Å
1011	N	84.5	Confident	81.1	Confident	49 Å²	49	50.1 Å²	50.1	26%	0.262	28%	0.281	S	S	.	.	H	α-helix	trans	-51.6	-36.6	-177.8	-53.7	34.1	0	0	0	111.8	T1008 D1014 I1015	T1008-N1011 PolarHBondContact O-N 3.06Å; T1008-N1011 PolarHBondContact OG1-N 2.98Å; T1008-N1011 PolarHBondContact OG1-OD1 3.46Å; N1011-D1014 WeakPolarHBondContact CA-OD2 3.47Å; N1011-D1014 PolarHBondContact N-OD2 3.41Å; N1011-D1014 PolarHBondContact O-N 3.39Å; N1011-I1015 VanDerWaalsContact O-CB 3.25Å; N1011-I1015 WeakPolarHBondContact O-CB 3.48Å; N1011-I1015 WeakPolarHBondContact O-CD1 3.08Å; N1011-I1015 WeakPolarHBondContact O-CG1 3.21Å; N1011-I1015 PolarHBondContact O-N 3.24Å
1012	L	85.4	Confident	80.8	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-69.5	-31	178	-68.1	178.5	0	0	0	113.6	Y1007 T1008 S1010 A1016 Y1034 L1037 L1038 I1045	Y1007-L1012 HydrophobicContact CG-CD2 4.34Å; T1008-L1012 WeakPolarHBondContact O-CG 3.32Å; T1008-L1012 PolarHBondContact O-N 2.91Å; S1010-L1012 PolarHBondContact O-N 3.25Å; L1012-A1016 WeakPolarHBondContact O-CB 3.21Å; L1012-A1016 PolarHBondContact O-N 2.75Å; L1012-Y1034 HydrophobicContact CB-CD2 3.87Å; L1012-Y1034 HydrophobicContact CB-CE2 3.81Å; L1012-L1037 HydrophobicContact CD2-CB 4.27Å; L1012-L1038 HydrophobicContact CD1-CD2 3.77Å; L1012-L1038 HydrophobicContact CD1-CG 4.38Å; L1012-I1045 HydrophobicContact CD2-CD1 3.85Å; L1012-I1045 HydrophobicContact CD2-CG2 4.34Å
1013	R	86.3	Confident	80.7	Confident	116 Å²	116	55 Å²	55	44%	0.438	31%	0.314	S	S	.	.	H	α-helix	trans	-75.6	-44.1	170.1	-66.4	174.1	-165	176	7.4	110.8	D1009 S1010 I1015 A1016 E1017 Y1034	D1009-R1013 WeakPolarHBondContact O-CG 3.47Å; S1010-R1013 WeakPolarHBondContact O-CA 2.99Å; S1010-R1013 WeakPolarHBondContact O-CB 3.46Å; S1010-R1013 PolarHBondContact O-N 2.95Å; R1013-I1015 PolarHBondContact O-N 3.01Å; R1013-A1016 WeakPolarHBondContact O-CA 3.47Å; R1013-A1016 PolarHBondContact O-N 3.05Å; R1013-E1017 PolarHBondContact O-N 3.05Å; R1013-Y1034 HydrophobicContact CG-CD2 3.58Å; R1013-Y1034 HydrophobicContact CG-CE2 3.56Å; R1013-Y1034 HydrophobicContact CG-CG 4.14Å; R1013-Y1034 PolarHBondContact NH2-OH 2.62Å
1014	D	85.8	Confident	80.8	Confident	56 Å²	56	56.1 Å²	56.1	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-39	176.9	-50.9	-40.2	0	0	0	110.5	S1010 N1011 S1018 Y1058	S1010-D1014 PolarHBondContact O-N 2.93Å; S1010-D1014 PolarHBondContact OG-OD2 2.89Å; S1010-D1014 VanDerWaalsContact OG-OD2 3.12Å; N1011-D1014 WeakPolarHBondContact CA-OD2 3.47Å; N1011-D1014 PolarHBondContact N-OD2 3.41Å; N1011-D1014 PolarHBondContact O-N 3.39Å; D1014-S1018 VanDerWaalsContact O-CB 3.23Å; D1014-S1018 WeakPolarHBondContact O-CB 3.22Å; D1014-S1018 PolarHBondContact O-N 2.89Å; D1014-S1018 PolarHBondContact O-OG 3.02Å; D1014-Y1058 WeakPolarHBondContact CB-OH 3.19Å
1015	I	85.3	Confident	81	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-69	-42	171.2	-71.8	164.1	0	0	0	112.1	Y1007 N1011 R1013 S1018 L1019 L1037 I1045 L1055 Y1058	Y1007-I1015 HydrophobicContact CD1-CD1 3.62Å; Y1007-I1015 HydrophobicContact CE1-CD1 3.83Å; N1011-I1015 VanDerWaalsContact O-CB 3.25Å; N1011-I1015 WeakPolarHBondContact O-CB 3.48Å; N1011-I1015 WeakPolarHBondContact O-CD1 3.08Å; N1011-I1015 WeakPolarHBondContact O-CG1 3.21Å; N1011-I1015 PolarHBondContact O-N 3.24Å; R1013-I1015 PolarHBondContact O-N 3.01Å; I1015-S1018 PolarHBondContact O-N 3.07Å; I1015-L1019 HydrophobicContact CG2-CD1 4.07Å; I1015-L1019 HydrophobicContact CG2-CG 4.45Å; I1015-L1019 WeakPolarHBondContact O-CB 3.23Å; I1015-L1019 WeakPolarHBondContact O-CG 3.46Å; I1015-L1019 PolarHBondContact O-N 2.88Å; I1015-L1037 HydrophobicContact CB-CD1 4.45Å; I1015-L1037 HydrophobicContact CG2-CD1 3.8Å; I1015-I1045 HydrophobicContact CD1-CG2 4.26Å; I1015-L1055 HydrophobicContact CB-CD2 4.3Å; I1015-L1055 HydrophobicContact CG1-CD2 4.25Å; I1015-L1055 HydrophobicContact CG2-CD1 3.85Å; I1015-L1055 HydrophobicContact CG2-CD2 3.93Å; I1015-Y1058 HydrophobicContact CD1-CD1 4.22Å; I1015-Y1058 HydrophobicContact CD1-CD2 4.44Å; I1015-Y1058 HydrophobicContact CD1-CG 3.98Å; I1015-Y1058 HydrophobicContact CG1-CD1 4.08Å; I1015-Y1058 HydrophobicContact CG1-CD2 3.7Å; I1015-Y1058 HydrophobicContact CG1-CE1 4.39Å; I1015-Y1058 HydrophobicContact CG1-CE2 4.03Å; I1015-Y1058 HydrophobicContact CG1-CG 3.73Å
1016	A	85.8	Confident	81	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-40.4	178.9	0	0	0	0	0	112.6	L1012 R1013 H1020 I1033 L1037	L1012-A1016 WeakPolarHBondContact O-CB 3.21Å; L1012-A1016 PolarHBondContact O-N 2.75Å; R1013-A1016 WeakPolarHBondContact O-CA 3.47Å; R1013-A1016 PolarHBondContact O-N 3.05Å; A1016-H1020 PolarHBondContact O-N 3.02Å; A1016-I1033 HydrophobicContact CB-CB 4.05Å; A1016-I1033 HydrophobicContact CB-CG2 3.82Å; A1016-L1037 HydrophobicContact CB-CD1 4.21Å
1017	E	85.3	Confident	81.1	Confident	120 Å²	120	62.2 Å²	62.2	56%	0.561	34%	0.342	S	S	*	.	H	α-helix	trans	-67.6	-43.5	172.6	-68.8	-178.5	-160.8	0	0	111	R1013 L1019 H1020 L1021	R1013-E1017 PolarHBondContact O-N 3.05Å; E1017-L1019 VanDerWaalsContact C-N 3.31Å; E1017-L1019 PolarHBondContact O-N 3.06Å; E1017-H1020 WeakPolarHBondContact O-CB 3.4Å; E1017-H1020 PolarHBondContact O-N 3.03Å; E1017-H1020 VanDerWaalsContact O-N 3.12Å; E1017-L1021 PolarHBondContact O-N 3.05Å; E1017-L1021 VanDerWaalsContact O-N 3.15Å
1018	S	83.7	Confident	81	Confident	29 Å²	29	63.9 Å²	63.9	20%	0.203	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-35.2	175.1	-60.3	0	0	0	0	113	D1014 I1015 L1021	D1014-S1018 VanDerWaalsContact O-CB 3.23Å; D1014-S1018 WeakPolarHBondContact O-CB 3.22Å; D1014-S1018 PolarHBondContact O-N 2.89Å; D1014-S1018 PolarHBondContact O-OG 3.02Å; I1015-S1018 PolarHBondContact O-N 3.07Å; S1018-L1021 PolarHBondContact O-N 3.24Å
1019	L	81	Confident	81	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-70	-37.9	172.3	-79.2	172.5	0	0	0	112.1	I1015 E1017 L1021 D1022 H1025 I1033 Y1052 L1055	I1015-L1019 HydrophobicContact CG2-CD1 4.07Å; I1015-L1019 HydrophobicContact CG2-CG 4.45Å; I1015-L1019 WeakPolarHBondContact O-CB 3.23Å; I1015-L1019 WeakPolarHBondContact O-CG 3.46Å; I1015-L1019 PolarHBondContact O-N 2.88Å; E1017-L1019 VanDerWaalsContact C-N 3.31Å; E1017-L1019 PolarHBondContact O-N 3.06Å; L1019-L1021 PolarHBondContact O-N 2.99Å; L1019-D1022 VanDerWaalsContact O-CB 3.29Å; L1019-D1022 WeakPolarHBondContact O-CB 3.36Å; L1019-D1022 PolarHBondContact O-N 3.15Å; L1019-H1025 WeakPolarHBondContact O-CB 3.36Å; L1019-I1033 HydrophobicContact CB-CD1 4.38Å; L1019-I1033 HydrophobicContact CB-CG2 4.43Å; L1019-I1033 HydrophobicContact CD1-CG2 3.83Å; L1019-Y1052 HydrophobicContact CD2-CD1 4.11Å; L1019-Y1052 HydrophobicContact CD2-CD2 3.8Å; L1019-Y1052 HydrophobicContact CD2-CE1 4.35Å; L1019-Y1052 HydrophobicContact CD2-CE2 4.09Å; L1019-Y1052 HydrophobicContact CD2-CG 3.83Å; L1019-L1055 HydrophobicContact CD1-CD1 4.16Å; L1019-L1055 HydrophobicContact CD2-CD1 3.67Å; L1019-L1055 HydrophobicContact CD2-CG 4.15Å; L1019-L1055 HydrophobicContact CG-CD1 3.82Å; L1019-L1055 HydrophobicContact CG-CD2 4.33Å; L1019-L1055 HydrophobicContact CG-CG 4.34Å
1020	H	81.6	Confident	81.1	Confident	70 Å²	70	61.9 Å²	61.9	32%	0.324	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-26.9	175.6	-175.5	79.2	0	0	0	112.5	A1016 E1017 D1022 S1026 A1028 P1030	A1016-H1020 PolarHBondContact O-N 3.02Å; E1017-H1020 WeakPolarHBondContact O-CB 3.4Å; E1017-H1020 PolarHBondContact O-N 3.03Å; E1017-H1020 VanDerWaalsContact O-N 3.12Å; H1020-D1022 VanDerWaalsContact C-N 3.32Å; H1020-S1026 PolarHBondContact CE1-O 3.07Å; H1020-S1026 WeakPolarHBondContact O-CA 3.18Å; H1020-A1028 PolarHBondContact CE1-O 3.04Å; H1020-A1028 PolarHBondContact ND1-O 3.5Å; H1020-P1030 HydrophobicContact CB-CG 3.94Å
1021	L	79.4	Confident	81.2	Confident	143 Å²	143	63.9 Å²	63.9	75%	0.749	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.7	171.2	-63.5	174.2	0	0	0	113.8	E1017 S1018 L1019	E1017-L1021 PolarHBondContact O-N 3.05Å; E1017-L1021 VanDerWaalsContact O-N 3.15Å; S1018-L1021 PolarHBondContact O-N 3.24Å; L1019-L1021 PolarHBondContact O-N 2.99Å
1022	D	77.9	Confident	81.2	Confident	22 Å²	22	66.3 Å²	66.3	12%	0.118	36%	0.363	C	S	.	.	S	Bend	trans	-72.3	132.2	175	-168.8	-66.5	0	0	0	110.3	L1019 H1020 S1024 H1025 S1026 Y1052	L1019-D1022 VanDerWaalsContact O-CB 3.29Å; L1019-D1022 WeakPolarHBondContact O-CB 3.36Å; L1019-D1022 PolarHBondContact O-N 3.15Å; H1020-D1022 VanDerWaalsContact C-N 3.32Å; D1022-S1024 PolarHBondContact O-N 2.92Å; D1022-S1024 WeakPolarHBondContact OD1-CA 3.44Å; D1022-S1024 WeakPolarHBondContact OD1-CB 3.46Å; D1022-S1024 PolarHBondContact OD1-N 3.29Å; D1022-S1024 PolarHBondContact OD1-OG 2.72Å; D1022-H1025 PolarHBondContact O-N 3.35Å; D1022-S1026 PolarHBondContact O-N 3.5Å; D1022-Y1052 WeakPolarHBondContact OD2-CD1 3.44Å
1023	P	76	Confident	81.1	Confident	112 Å²	112	67.1 Å²	67.1	73%	0.727	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-31.7	175.6	-29.7	36.3	0	0	0	114.2	H1025 S1026	P1023-H1025 VanDerWaalsContact C-N 3.34Å; P1023-H1025 PolarHBondContact O-N 2.97Å; P1023-S1026 PolarHBondContact O-OG 1.86Å
1024	S	74.9	Confident	81.2	Confident	83 Å²	83	62.6 Å²	62.6	58%	0.58	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-29.3	178.6	-47.2	0	0	0	0	114	D1022	D1022-S1024 PolarHBondContact O-N 2.92Å; D1022-S1024 WeakPolarHBondContact OD1-CA 3.44Å; D1022-S1024 WeakPolarHBondContact OD1-CB 3.46Å; D1022-S1024 PolarHBondContact OD1-N 3.29Å; D1022-S1024 PolarHBondContact OD1-OG 2.72Å
1025	H	70.1	Confident	81.1	Confident	62 Å²	62	66 Å²	66	29%	0.287	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-0.7	-171.5	-71.7	-4	0	0	0	114.3	L1019 D1022 P1023 N1027 A1028 Y1052	L1019-H1025 WeakPolarHBondContact O-CB 3.36Å; D1022-H1025 PolarHBondContact O-N 3.35Å; P1023-H1025 VanDerWaalsContact C-N 3.34Å; P1023-H1025 PolarHBondContact O-N 2.97Å; H1025-N1027 PolarHBondContact O-N 3.17Å; H1025-A1028 WeakPolarHBondContact O-CB 3.4Å; H1025-A1028 PolarHBondContact O-N 3.41Å; H1025-Y1052 AromaticContact NE2-CZ 3.86Å; H1025-Y1052 PolarHBondContact NE2-OH 2.89Å; H1025-Y1052 VanDerWaalsContact NE2-OH 3.12Å
1026	S	73.9	Confident	81	Confident	52 Å²	52	70.2 Å²	70.2	36%	0.364	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.8	-21.5	164.9	60.4	0	0	0	0	118	H1020 D1022 P1023	H1020-S1026 PolarHBondContact CE1-O 3.07Å; H1020-S1026 WeakPolarHBondContact O-CA 3.18Å; D1022-S1026 PolarHBondContact O-N 3.5Å; P1023-S1026 PolarHBondContact O-OG 1.86Å
1027	N	77.8	Confident	81	Confident	157 Å²	157	70.4 Å²	70.4	84%	0.84	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	1.8	-179.3	-71.6	-106.6	0	0	0	113.6	H1025	H1025-N1027 PolarHBondContact O-N 3.17Å
1028	A	78.6	Confident	80.9	Confident	39 Å²	39	66.4 Å²	66.4	32%	0.322	37%	0.37	S	S	.	.	S	Bend	trans	-106.2	141.8	-179.4	0	0	0	0	0	111.2	H1020 H1025 I1033	H1020-A1028 PolarHBondContact CE1-O 3.04Å; H1020-A1028 PolarHBondContact ND1-O 3.5Å; H1025-A1028 WeakPolarHBondContact O-CB 3.4Å; H1025-A1028 PolarHBondContact O-N 3.41Å; A1028-I1033 HydrophobicContact CB-CD1 4.07Å; A1028-I1033 HydrophobicContact CB-CG1 4.2Å
1029	D	83.2	Confident	80.7	Confident	75 Å²	75	69 Å²	69	40%	0.401	39%	0.393	S	S	.	.			trans	-67.1	123.5	176.6	-178.9	-11.9	0	0	0	110.4	N1031 L1032 I1033	D1029-N1031 PolarHBondContact O-N 3.27Å; D1029-N1031 VanDerWaalsContact O-N 3.11Å; D1029-N1031 WeakPolarHBondContact OD1-CB 3.34Å; D1029-N1031 PolarHBondContact OD1-N 3.03Å; D1029-N1031 PolarHBondContact OD1-ND2 3.2Å; D1029-L1032 HydrophobicContact CB-CB 4.31Å; D1029-L1032 HydrophobicContact CB-CD1 4.04Å; D1029-L1032 HydrophobicContact CB-CG 4.03Å; D1029-L1032 PolarHBondContact O-N 2.89Å; D1029-I1033 PolarHBondContact O-N 2.94Å; D1029-I1033 VanDerWaalsContact O-N 3.1Å
1030	P	83.7	Confident	80.7	Confident	36 Å²	36	70.8 Å²	70.8	23%	0.234	40%	0.402	C	S	.	.	H	α-helix	trans	-52.1	-31.6	176	-26.6	34	0	0	0	113.9	H1020 I1033 Y1034	H1020-P1030 HydrophobicContact CB-CG 3.94Å; P1030-I1033 PolarHBondContact O-N 3.3Å; P1030-Y1034 WeakPolarHBondContact O-CB 3.47Å; P1030-Y1034 PolarHBondContact O-N 3.33Å
1031	N	84.8	Confident	80.7	Confident	110 Å²	110	67.6 Å²	67.6	59%	0.588	39%	0.387	S	S	*	.	H	α-helix	trans	-67	-38.9	177.6	-60.6	-84	0	0	0	111.8	D1029 Y1034 E1035	D1029-N1031 PolarHBondContact O-N 3.27Å; D1029-N1031 VanDerWaalsContact O-N 3.11Å; D1029-N1031 WeakPolarHBondContact OD1-CB 3.34Å; D1029-N1031 PolarHBondContact OD1-N 3.03Å; D1029-N1031 PolarHBondContact OD1-ND2 3.2Å; N1031-Y1034 PolarHBondContact O-N 3.26Å; N1031-E1035 PolarHBondContact O-N 3.19Å
1032	L	84.7	Confident	81	Confident	101 Å²	101	60.9 Å²	60.9	53%	0.529	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-36.7	176	-64.5	178.1	0	0	0	111.4	D1029 Y1034 E1035 D1036	D1029-L1032 HydrophobicContact CB-CB 4.31Å; D1029-L1032 HydrophobicContact CB-CD1 4.04Å; D1029-L1032 HydrophobicContact CB-CG 4.03Å; D1029-L1032 PolarHBondContact O-N 2.89Å; L1032-Y1034 VanDerWaalsContact C-N 3.33Å; L1032-E1035 PolarHBondContact O-N 2.99Å; L1032-D1036 PolarHBondContact O-N 3.34Å
1033	I	83.8	Confident	81.2	Confident	20 Å²	20	60 Å²	60	10%	0.103	35%	0.347	C	S	.	.	H	α-helix	trans	-60.9	-44.9	172	-59.1	172.9	0	0	0	109.9	A1016 L1019 A1028 D1029 P1030 D1036 L1037	A1016-I1033 HydrophobicContact CB-CB 4.05Å; A1016-I1033 HydrophobicContact CB-CG2 3.82Å; L1019-I1033 HydrophobicContact CB-CD1 4.38Å; L1019-I1033 HydrophobicContact CB-CG2 4.43Å; L1019-I1033 HydrophobicContact CD1-CG2 3.83Å; A1028-I1033 HydrophobicContact CB-CD1 4.07Å; A1028-I1033 HydrophobicContact CB-CG1 4.2Å; D1029-I1033 PolarHBondContact O-N 2.94Å; D1029-I1033 VanDerWaalsContact O-N 3.1Å; P1030-I1033 PolarHBondContact O-N 3.3Å; I1033-D1036 PolarHBondContact O-N 3.37Å; I1033-L1037 HydrophobicContact CG2-CD1 3.86Å; I1033-L1037 HydrophobicContact CG2-CG 4.28Å; I1033-L1037 WeakPolarHBondContact O-CB 3.3Å; I1033-L1037 WeakPolarHBondContact O-CG 3.27Å; I1033-L1037 PolarHBondContact O-N 3.13Å
1034	Y	86.9	Confident	81.7	Confident	21 Å²	21	58.1 Å²	58.1	8%	0.082	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-41.2	175.9	174.9	-111.2	0	0	0	112.8	D1009 L1012 R1013 P1030 N1031 L1032 L1037 L1038	D1009-Y1034 PolarHBondContact OD1-OH 3.36Å; L1012-Y1034 HydrophobicContact CB-CD2 3.87Å; L1012-Y1034 HydrophobicContact CB-CE2 3.81Å; R1013-Y1034 HydrophobicContact CG-CD2 3.58Å; R1013-Y1034 HydrophobicContact CG-CE2 3.56Å; R1013-Y1034 HydrophobicContact CG-CG 4.14Å; R1013-Y1034 PolarHBondContact NH2-OH 2.62Å; P1030-Y1034 WeakPolarHBondContact O-CB 3.47Å; P1030-Y1034 PolarHBondContact O-N 3.33Å; N1031-Y1034 PolarHBondContact O-N 3.26Å; L1032-Y1034 VanDerWaalsContact C-N 3.33Å; Y1034-L1037 PolarHBondContact O-N 2.83Å; Y1034-L1038 HydrophobicContact CD1-CD1 4.03Å; Y1034-L1038 HydrophobicContact CD2-CG 4.47Å; Y1034-L1038 HydrophobicContact CE1-CD1 3.6Å; Y1034-L1038 HydrophobicContact CE1-CG 4.47Å; Y1034-L1038 HydrophobicContact CE2-CD1 4.12Å; Y1034-L1038 HydrophobicContact CE2-CD2 4.43Å; Y1034-L1038 HydrophobicContact CE2-CG 4.14Å; Y1034-L1038 HydrophobicContact CG-CD1 4.49Å; Y1034-L1038 WeakPolarHBondContact O-CB 3.38Å; Y1034-L1038 WeakPolarHBondContact O-CG 3.5Å; Y1034-L1038 PolarHBondContact O-N 3.2Å
1035	E	83.7	Confident	82.1	Confident	126 Å²	126	54.2 Å²	54.2	59%	0.589	30%	0.301	S	S	*	.	H	α-helix	trans	-64.1	-41.1	174.3	-75.4	-163.8	156.7	0	0	113.1	N1031 L1032 A1039	N1031-E1035 PolarHBondContact O-N 3.19Å; L1032-E1035 PolarHBondContact O-N 2.99Å; E1035-A1039 PolarHBondContact O-N 2.93Å
1036	D	85.2	Confident	82.9	Confident	90 Å²	90	51.4 Å²	51.4	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-67.1	-42.5	175.1	-91.8	-25.4	0	0	0	111.4	L1032 I1033 L1038 A1039 M1040	L1032-D1036 PolarHBondContact O-N 3.34Å; I1033-D1036 PolarHBondContact O-N 3.37Å; D1036-L1038 PolarHBondContact O-N 3.32Å; D1036-A1039 WeakPolarHBondContact O-CB 3.47Å; D1036-A1039 PolarHBondContact O-N 2.86Å; D1036-A1039 VanDerWaalsContact O-N 3.08Å; D1036-M1040 WeakPolarHBondContact O-CG 3.27Å; D1036-M1040 PolarHBondContact O-N 3.47Å
1037	L	85.1	Confident	83.3	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-41.1	176.3	-74.6	170.8	0	0	0	112.2	L1012 I1015 A1016 I1033 Y1034 A1039 M1040 I1045 L1048	L1012-L1037 HydrophobicContact CD2-CB 4.27Å; I1015-L1037 HydrophobicContact CB-CD1 4.45Å; I1015-L1037 HydrophobicContact CG2-CD1 3.8Å; A1016-L1037 HydrophobicContact CB-CD1 4.21Å; I1033-L1037 HydrophobicContact CG2-CD1 3.86Å; I1033-L1037 HydrophobicContact CG2-CG 4.28Å; I1033-L1037 WeakPolarHBondContact O-CB 3.3Å; I1033-L1037 WeakPolarHBondContact O-CG 3.27Å; I1033-L1037 PolarHBondContact O-N 3.13Å; Y1034-L1037 PolarHBondContact O-N 2.83Å; L1037-A1039 PolarHBondContact O-N 3.29Å; L1037-M1040 HydrophobicContact CD2-SD 4.31Å; L1037-M1040 WeakPolarHBondContact O-CB 3.33Å; L1037-M1040 PolarHBondContact O-N 3.05Å; L1037-I1045 HydrophobicContact CD2-CG1 4.22Å; L1037-L1048 HydrophobicContact CD2-CD1 3.69Å
1038	L	82.9	Confident	83.6	Confident	36 Å²	36	46.5 Å²	46.5	19%	0.188	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-23.2	173.9	-80.6	173.2	0	0	0	113.6	L1012 Y1034 D1036	L1012-L1038 HydrophobicContact CD1-CD2 3.77Å; L1012-L1038 HydrophobicContact CD1-CG 4.38Å; Y1034-L1038 HydrophobicContact CD1-CD1 4.03Å; Y1034-L1038 HydrophobicContact CD2-CG 4.47Å; Y1034-L1038 HydrophobicContact CE1-CD1 3.6Å; Y1034-L1038 HydrophobicContact CE1-CG 4.47Å; Y1034-L1038 HydrophobicContact CE2-CD1 4.12Å; Y1034-L1038 HydrophobicContact CE2-CD2 4.43Å; Y1034-L1038 HydrophobicContact CE2-CG 4.14Å; Y1034-L1038 HydrophobicContact CG-CD1 4.49Å; Y1034-L1038 WeakPolarHBondContact O-CB 3.38Å; Y1034-L1038 WeakPolarHBondContact O-CG 3.5Å; Y1034-L1038 PolarHBondContact O-N 3.2Å; D1036-L1038 PolarHBondContact O-N 3.32Å
1039	A	80	Confident	83.9	Confident	83 Å²	83	44.7 Å²	44.7	69%	0.686	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.2	176.3	0	0	0	0	0	113.5	E1035 D1036 L1037	E1035-A1039 PolarHBondContact O-N 2.93Å; D1036-A1039 WeakPolarHBondContact O-CB 3.47Å; D1036-A1039 PolarHBondContact O-N 2.86Å; D1036-A1039 VanDerWaalsContact O-N 3.08Å; L1037-A1039 PolarHBondContact O-N 3.29Å
1040	M	79.8	Confident	83.9	Confident	44 Å²	44	45.2 Å²	45.2	22%	0.217	24%	0.24	C	C	.	.	S	Bend	trans	-89.4	156.3	179.6	-66.8	176.7	65.8	0	0	111.8	S1003 D1036 L1037 Q1044 I1045 L1048	S1003-M1040 WeakPolarHBondContact CB-O 3.41Å; D1036-M1040 WeakPolarHBondContact O-CG 3.27Å; D1036-M1040 PolarHBondContact O-N 3.47Å; L1037-M1040 HydrophobicContact CD2-SD 4.31Å; L1037-M1040 WeakPolarHBondContact O-CB 3.33Å; L1037-M1040 PolarHBondContact O-N 3.05Å; M1040-Q1044 HydrophobicContact CB-CB 4.3Å; M1040-Q1044 HydrophobicContact CE-CB 3.52Å; M1040-I1045 HydrophobicContact CB-CD1 4.35Å; M1040-I1045 HydrophobicContact CB-CG1 3.95Å; M1040-L1048 HydrophobicContact CE-CD1 3.59Å; M1040-L1048 HydrophobicContact CE-CG 3.96Å; M1040-L1048 HydrophobicContact SD-CD1 3.92Å
1041	S	83.1	Confident	83.9	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.021	25%	0.254	C	S	.	.			trans	-85.7	153.7	168.1	49.4	0	0	0	0	111.6	F1002 H1043 Q1044 I1045	F1002-S1041 CarbonylContact O-C 3.52Å; F1002-S1041 WeakPolarHBondContact O-CA 3.39Å; F1002-S1041 WeakPolarHBondContact O-CB 3.41Å; S1041-H1043 VanDerWaalsContact C-N 3.26Å; S1041-H1043 PolarHBondContact O-N 3.49Å; S1041-Q1044 WeakPolarHBondContact O-CA 3.46Å; S1041-Q1044 VanDerWaalsContact O-CB 3.32Å; S1041-Q1044 WeakPolarHBondContact O-CB 3.34Å; S1041-Q1044 PolarHBondContact O-N 3.48Å; S1041-Q1044 WeakPolarHBondContact OG-CG 3.37Å; S1041-Q1044 PolarHBondContact OG-OE1 2.99Å; S1041-I1045 PolarHBondContact O-N 3.14Å; S1041-I1045 VanDerWaalsContact O-N 3.07Å
1042	D	84.3	Confident	83.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-55.7	-38.6	-172.7	-63.9	-7.1	0	0	0	112.7	A1000 F1002 G1004 L1005 A1006 Y1007 Q1044 I1045 H1046	A1000-D1042 HydrophobicContact CB-CB 4.34Å; A1000-D1042 PolarHBondContact O-N 3.05Å; F1002-D1042 PolarHBondContact O-N 2.77Å; G1004-D1042 PolarHBondContact N-OD1 3.19Å; L1005-D1042 WeakPolarHBondContact CA-OD2 3.36Å; L1005-D1042 WeakPolarHBondContact CB-OD2 3.44Å; L1005-D1042 PolarHBondContact N-OD2 2.94Å; A1006-D1042 HydrophobicContact CB-CB 4.27Å; A1006-D1042 PolarHBondContact N-OD2 3.24Å; Y1007-D1042 HydrophobicContact CD2-CB 4Å; Y1007-D1042 HydrophobicContact CE2-CB 4.32Å; Y1007-D1042 WeakPolarHBondContact CE2-O 3.47Å; D1042-Q1044 VanDerWaalsContact C-N 3.31Å; D1042-Q1044 PolarHBondContact O-N 2.97Å; D1042-I1045 PolarHBondContact O-N 2.73Å; D1042-H1046 WeakPolarHBondContact O-CB 3.47Å; D1042-H1046 PolarHBondContact O-N 3.44Å
1043	H	83.2	Confident	83.4	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.023	25%	0.247	C	C	.	.	H	α-helix	trans	-65.4	-30.3	174	159.2	-91	0	0	0	113.2	A1000 S1041 K1047 D1100 I1101	A1000-H1043 HydrophobicContact CB-CB 3.74Å; A1000-H1043 WeakPolarHBondContact O-CB 3.41Å; A1000-H1043 PolarHBondContact O-N 3.26Å; S1041-H1043 VanDerWaalsContact C-N 3.26Å; S1041-H1043 PolarHBondContact O-N 3.49Å; H1043-K1047 VanDerWaalsContact NE2-CE 3.29Å; H1043-K1047 WeakPolarHBondContact NE2-CE 3.46Å; H1043-K1047 PolarHBondContact O-N 3.28Å; H1043-D1100 WeakPolarHBondContact CE1-CB 2.93Å; H1043-I1101 HydrophobicContact CB-CD1 4.09Å; H1043-I1101 HydrophobicContact CB-CG1 4Å; H1043-I1101 VanDerWaalsContact CD2-CG1 3.48Å; H1043-I1101 WeakPolarHBondContact CD2-CG1 3.33Å; H1043-I1101 VanDerWaalsContact CG-CG1 3.44Å
1044	Q	85.1	Confident	83.1	Confident	71 Å²	71	51.6 Å²	51.6	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-74.1	-36.9	173.4	-60.6	173.4	-92.2	0	0	111.7	M1040 S1041 D1042 H1046 K1047 L1048	M1040-Q1044 HydrophobicContact CB-CB 4.3Å; M1040-Q1044 HydrophobicContact CE-CB 3.52Å; S1041-Q1044 WeakPolarHBondContact O-CA 3.46Å; S1041-Q1044 VanDerWaalsContact O-CB 3.32Å; S1041-Q1044 WeakPolarHBondContact O-CB 3.34Å; S1041-Q1044 PolarHBondContact O-N 3.48Å; S1041-Q1044 WeakPolarHBondContact OG-CG 3.37Å; S1041-Q1044 PolarHBondContact OG-OE1 2.99Å; D1042-Q1044 VanDerWaalsContact C-N 3.31Å; D1042-Q1044 PolarHBondContact O-N 2.97Å; Q1044-H1046 VanDerWaalsContact C-N 3.34Å; Q1044-K1047 PolarHBondContact O-N 2.88Å; Q1044-L1048 PolarHBondContact O-N 3.01Å; Q1044-L1048 VanDerWaalsContact O-N 3.08Å
1045	I	84.9	Confident	82.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-44.7	172.9	-62.6	153.8	0	0	0	109	Y1007 L1012 I1015 L1037 M1040 S1041 D1042 K1047 L1048 C1049	Y1007-I1045 HydrophobicContact CD1-CG2 3.85Å; Y1007-I1045 HydrophobicContact CD2-CB 3.89Å; Y1007-I1045 HydrophobicContact CD2-CD1 4.16Å; Y1007-I1045 HydrophobicContact CD2-CG2 3.71Å; Y1007-I1045 HydrophobicContact CE1-CG2 3.86Å; Y1007-I1045 HydrophobicContact CE2-CB 3.86Å; Y1007-I1045 HydrophobicContact CE2-CG2 3.72Å; Y1007-I1045 HydrophobicContact CG-CB 4.42Å; Y1007-I1045 HydrophobicContact CG-CD1 4.48Å; Y1007-I1045 HydrophobicContact CG-CG2 3.79Å; L1012-I1045 HydrophobicContact CD2-CD1 3.85Å; L1012-I1045 HydrophobicContact CD2-CG2 4.34Å; I1015-I1045 HydrophobicContact CD1-CG2 4.26Å; L1037-I1045 HydrophobicContact CD2-CG1 4.22Å; M1040-I1045 HydrophobicContact CB-CD1 4.35Å; M1040-I1045 HydrophobicContact CB-CG1 3.95Å; S1041-I1045 PolarHBondContact O-N 3.14Å; S1041-I1045 VanDerWaalsContact O-N 3.07Å; D1042-I1045 PolarHBondContact O-N 2.73Å; I1045-K1047 VanDerWaalsContact C-N 3.32Å; I1045-K1047 PolarHBondContact O-N 2.79Å; I1045-L1048 CarbonylContact O-C 3.57Å; I1045-L1048 WeakPolarHBondContact O-CA 3.31Å; I1045-L1048 WeakPolarHBondContact O-CB 3.48Å; I1045-L1048 PolarHBondContact O-N 2.8Å; I1045-C1049 PolarHBondContact O-N 2.97Å; I1045-C1049 PolarHBondContact O-SG 3.16Å
1046	H	85.4	Confident	82.5	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.019	25%	0.251	C	S	.	.	H	α-helix	trans	-55.6	-42.4	172.3	176.9	40.9	0	0	0	113	Y1007 D1042 Q1044 L1048 C1049 Q1050 L1060	Y1007-H1046 HydrophobicContact CE2-CB 4.41Å; Y1007-H1046 WeakPolarHBondContact OH-CA 3.41Å; D1042-H1046 WeakPolarHBondContact O-CB 3.47Å; D1042-H1046 PolarHBondContact O-N 3.44Å; Q1044-H1046 VanDerWaalsContact C-N 3.34Å; H1046-L1048 VanDerWaalsContact C-N 3.31Å; H1046-L1048 PolarHBondContact O-N 2.9Å; H1046-C1049 CarbonylContact O-C 3.57Å; H1046-C1049 WeakPolarHBondContact O-CA 3.49Å; H1046-C1049 WeakPolarHBondContact O-CB 3.47Å; H1046-C1049 PolarHBondContact O-N 3.38Å; H1046-C1049 VanDerWaalsContact O-N 3.12Å; H1046-Q1050 WeakPolarHBondContact O-CG 3.33Å; H1046-Q1050 PolarHBondContact O-N 3.46Å; H1046-L1060 HydrophobicContact CB-CD1 3.97Å; H1046-L1060 HydrophobicContact CB-CG 4Å; H1046-L1060 PolarHBondContact CE1-N 3.39Å; H1046-L1060 PolarHBondContact ND1-N 3.22Å
1047	K	84	Confident	82.4	Confident	59 Å²	59	47.9 Å²	47.9	26%	0.257	26%	0.26	S	S	.	.	H	α-helix	trans	-66.1	-27.1	173.3	-80.1	-165.8	170.7	-170.4	0	113.8	H1043 Q1044 I1045 F1051 D1100	H1043-K1047 VanDerWaalsContact NE2-CE 3.29Å; H1043-K1047 WeakPolarHBondContact NE2-CE 3.46Å; H1043-K1047 PolarHBondContact O-N 3.28Å; Q1044-K1047 PolarHBondContact O-N 2.88Å; I1045-K1047 VanDerWaalsContact C-N 3.32Å; I1045-K1047 PolarHBondContact O-N 2.79Å; K1047-F1051 WeakPolarHBondContact O-CB 3.34Å; K1047-F1051 PolarHBondContact O-N 3.3Å; K1047-D1100 IonicContact NZ-OD1 2.6Å; K1047-D1100 PolarHBondContact NZ-OD1 3.25Å
1048	L	83.9	Confident	82.1	Confident	47 Å²	47	50.9 Å²	50.9	25%	0.246	27%	0.271	C	S	.	.	H	α-helix	trans	-70	-44.9	166.4	-64	176.9	0	0	0	110.5	L1037 M1040 Q1044 I1045 H1046 Q1050 F1051 Y1052	L1037-L1048 HydrophobicContact CD2-CD1 3.69Å; M1040-L1048 HydrophobicContact CE-CD1 3.59Å; M1040-L1048 HydrophobicContact CE-CG 3.96Å; M1040-L1048 HydrophobicContact SD-CD1 3.92Å; Q1044-L1048 PolarHBondContact O-N 3.01Å; Q1044-L1048 VanDerWaalsContact O-N 3.08Å; I1045-L1048 CarbonylContact O-C 3.57Å; I1045-L1048 WeakPolarHBondContact O-CA 3.31Å; I1045-L1048 WeakPolarHBondContact O-CB 3.48Å; I1045-L1048 PolarHBondContact O-N 2.8Å; H1046-L1048 VanDerWaalsContact C-N 3.31Å; H1046-L1048 PolarHBondContact O-N 2.9Å; L1048-Q1050 PolarHBondContact O-N 3.48Å; L1048-F1051 PolarHBondContact O-N 3.45Å; L1048-Y1052 HydrophobicContact CD2-CE2 4.22Å; L1048-Y1052 WeakPolarHBondContact O-CD2 3.49Å; L1048-Y1052 PolarHBondContact O-N 2.95Å
1049	C	84.6	Confident	82.1	Confident	1 Å²	1	52 Å²	52	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-61.4	-28.3	177.9	-60	0	0	0	0	113.6	I1045 H1046 L1055 T1059	I1045-C1049 PolarHBondContact O-N 2.97Å; I1045-C1049 PolarHBondContact O-SG 3.16Å; H1046-C1049 CarbonylContact O-C 3.57Å; H1046-C1049 WeakPolarHBondContact O-CA 3.49Å; H1046-C1049 WeakPolarHBondContact O-CB 3.47Å; H1046-C1049 PolarHBondContact O-N 3.38Å; H1046-C1049 VanDerWaalsContact O-N 3.12Å; C1049-L1055 HydrophobicContact CB-CB 4.13Å; C1049-L1055 WeakPolarHBondContact CB-O 3.34Å; C1049-L1055 CarbonylContact O-C 3.59Å; C1049-T1059 VanDerWaalsContact C-CG2 3.47Å; C1049-T1059 HydrophobicContact CB-CG2 3.69Å; C1049-T1059 WeakPolarHBondContact O-CG2 3.22Å
1050	Q	83	Confident	82.1	Confident	86 Å²	86	49.2 Å²	49.2	40%	0.402	25%	0.253	S	S	.	.	H	α-helix	trans	-77.2	-22.8	170.9	-73.3	-174.9	-29.9	0	0	113.8	H1046 L1048 T1059 E1104	H1046-Q1050 WeakPolarHBondContact O-CG 3.33Å; H1046-Q1050 PolarHBondContact O-N 3.46Å; L1048-Q1050 PolarHBondContact O-N 3.48Å; Q1050-T1059 HydrophobicContact CG-CG2 4.01Å; Q1050-E1104 PolarHBondContact NE2-OE1 2.73Å
1051	F	83	Confident	82.1	Confident	122 Å²	122	50.1 Å²	50.1	54%	0.535	26%	0.264	S	S	.	.	H	α-helix	trans	-91	-33.8	-175.1	-172.7	-91.5	0	0	0	113	Y70 K1047 L1048	Y70-F1051 WeakPolarHBondContact OH-CZ 3.33Å; K1047-F1051 WeakPolarHBondContact O-CB 3.34Å; K1047-F1051 PolarHBondContact O-N 3.3Å; L1048-F1051 PolarHBondContact O-N 3.45Å
1052	Y	82.1	Confident	82	Confident	33 Å²	33	53.4 Å²	53.4	13%	0.129	29%	0.285	C	S	.	.			trans	-101.5	118.4	178	-64.8	-84.4	0	0	0	110.3	L1019 D1022 H1025 L1048 T1054 L1055 S1056	L1019-Y1052 HydrophobicContact CD2-CD1 4.11Å; L1019-Y1052 HydrophobicContact CD2-CD2 3.8Å; L1019-Y1052 HydrophobicContact CD2-CE1 4.35Å; L1019-Y1052 HydrophobicContact CD2-CE2 4.09Å; L1019-Y1052 HydrophobicContact CD2-CG 3.83Å; D1022-Y1052 WeakPolarHBondContact OD2-CD1 3.44Å; H1025-Y1052 AromaticContact NE2-CZ 3.86Å; H1025-Y1052 PolarHBondContact NE2-OH 2.89Å; H1025-Y1052 VanDerWaalsContact NE2-OH 3.12Å; L1048-Y1052 HydrophobicContact CD2-CE2 4.22Å; L1048-Y1052 WeakPolarHBondContact O-CD2 3.49Å; L1048-Y1052 PolarHBondContact O-N 2.95Å; Y1052-T1054 PolarHBondContact O-N 3.41Å; Y1052-L1055 HydrophobicContact CD2-CD1 4.39Å; Y1052-L1055 WeakPolarHBondContact O-CA 3.35Å; Y1052-L1055 PolarHBondContact O-N 3Å; Y1052-S1056 PolarHBondContact O-N 3.41Å
1053	E	77.2	Confident	81.9	Confident	177 Å²	177	60.6 Å²	60.6	83%	0.827	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-58.3	-35.3	-179.2	-172.6	173.3	-166.5	0	0	112.3	L1055 S1056	E1053-L1055 PolarHBondContact O-N 2.98Å; E1053-S1056 VanDerWaalsContact O-CB 3.28Å; E1053-S1056 WeakPolarHBondContact O-CB 3.46Å; E1053-S1056 PolarHBondContact O-N 3.4Å; E1053-S1056 VanDerWaalsContact O-N 3.16Å; E1053-S1056 PolarHBondContact O-OG 3.15Å
1054	T	78.9	Confident	81.8	Confident	69 Å²	69	62.5 Å²	62.5	42%	0.423	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-59.7	-23.5	172.8	51.4	0	0	0	0	114.1	Y1052	Y1052-T1054 PolarHBondContact O-N 3.41Å
1055	L	80.8	Confident	81.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-103.5	2.6	179.6	-62.9	-170.8	0	0	0	113.8	I1015 L1019 C1049 Y1052 E1053 S1057 Y1058	I1015-L1055 HydrophobicContact CB-CD2 4.3Å; I1015-L1055 HydrophobicContact CG1-CD2 4.25Å; I1015-L1055 HydrophobicContact CG2-CD1 3.85Å; I1015-L1055 HydrophobicContact CG2-CD2 3.93Å; L1019-L1055 HydrophobicContact CD1-CD1 4.16Å; L1019-L1055 HydrophobicContact CD2-CD1 3.67Å; L1019-L1055 HydrophobicContact CD2-CG 4.15Å; L1019-L1055 HydrophobicContact CG-CD1 3.82Å; L1019-L1055 HydrophobicContact CG-CD2 4.33Å; L1019-L1055 HydrophobicContact CG-CG 4.34Å; C1049-L1055 HydrophobicContact CB-CB 4.13Å; C1049-L1055 WeakPolarHBondContact CB-O 3.34Å; C1049-L1055 CarbonylContact O-C 3.59Å; Y1052-L1055 HydrophobicContact CD2-CD1 4.39Å; Y1052-L1055 WeakPolarHBondContact O-CA 3.35Å; Y1052-L1055 PolarHBondContact O-N 3Å; E1053-L1055 PolarHBondContact O-N 2.98Å; L1055-S1057 PolarHBondContact O-N 3.41Å; L1055-S1057 VanDerWaalsContact O-N 3.15Å; L1055-Y1058 HydrophobicContact CD2-CD2 4.13Å; L1055-Y1058 HydrophobicContact CD2-CE2 4.48Å; L1055-Y1058 WeakPolarHBondContact O-CB 3.24Å; L1055-Y1058 PolarHBondContact O-N 3.44Å
1056	S	77.1	Confident	81.8	Confident	64 Å²	64	61 Å²	61	45%	0.448	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-55	-34.7	-176.9	55.7	0	0	0	0	113.3	Y1052 E1053 Y1058 T1059	Y1052-S1056 PolarHBondContact O-N 3.41Å; E1053-S1056 VanDerWaalsContact O-CB 3.28Å; E1053-S1056 WeakPolarHBondContact O-CB 3.46Å; E1053-S1056 PolarHBondContact O-N 3.4Å; E1053-S1056 VanDerWaalsContact O-N 3.16Å; E1053-S1056 PolarHBondContact O-OG 3.15Å; S1056-Y1058 PolarHBondContact O-N 3.34Å; S1056-T1059 WeakPolarHBondContact O-CB 3.47Å; S1056-T1059 WeakPolarHBondContact O-CG2 3.29Å; S1056-T1059 PolarHBondContact O-N 2.68Å; S1056-T1059 VanDerWaalsContact O-N 3.13Å; S1056-T1059 PolarHBondContact O-OG1 3.28Å
1057	S	81.3	Confident	81.8	Confident	95 Å²	95	63.9 Å²	63.9	66%	0.664	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-60.6	-24.7	173.8	53.7	0	0	0	0	114.6	L1055	L1055-S1057 PolarHBondContact O-N 3.41Å; L1055-S1057 VanDerWaalsContact O-N 3.15Å
1058	Y	80.3	Confident	81.8	Confident	67 Å²	67	61.3 Å²	61.3	26%	0.263	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-96.2	9.7	178.3	-61	-74.8	0	0	0	112.9	Y1007 D1014 I1015 L1055 S1056	Y1007-Y1058 VanDerWaalsContact CE1-O 3.26Å; Y1007-Y1058 WeakPolarHBondContact CE1-O 3.38Å; Y1007-Y1058 PolarHBondContact OH-O 2.89Å; D1014-Y1058 WeakPolarHBondContact CB-OH 3.19Å; I1015-Y1058 HydrophobicContact CD1-CD1 4.22Å; I1015-Y1058 HydrophobicContact CD1-CD2 4.44Å; I1015-Y1058 HydrophobicContact CD1-CG 3.98Å; I1015-Y1058 HydrophobicContact CG1-CD1 4.08Å; I1015-Y1058 HydrophobicContact CG1-CD2 3.7Å; I1015-Y1058 HydrophobicContact CG1-CE1 4.39Å; I1015-Y1058 HydrophobicContact CG1-CE2 4.03Å; I1015-Y1058 HydrophobicContact CG1-CG 3.73Å; L1055-Y1058 HydrophobicContact CD2-CD2 4.13Å; L1055-Y1058 HydrophobicContact CD2-CE2 4.48Å; L1055-Y1058 WeakPolarHBondContact O-CB 3.24Å; L1055-Y1058 PolarHBondContact O-N 3.44Å; S1056-Y1058 PolarHBondContact O-N 3.34Å
1059	T	82	Confident	82.2	Confident	60 Å²	60	59 Å²	59	37%	0.368	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-69.6	140.3	174.2	54.6	0	0	0	0	111.7	C1049 Q1050 S1056	C1049-T1059 VanDerWaalsContact C-CG2 3.47Å; C1049-T1059 HydrophobicContact CB-CG2 3.69Å; C1049-T1059 WeakPolarHBondContact O-CG2 3.22Å; Q1050-T1059 HydrophobicContact CG-CG2 4.01Å; S1056-T1059 WeakPolarHBondContact O-CB 3.47Å; S1056-T1059 WeakPolarHBondContact O-CG2 3.29Å; S1056-T1059 PolarHBondContact O-N 2.68Å; S1056-T1059 VanDerWaalsContact O-N 3.13Å; S1056-T1059 PolarHBondContact O-OG1 3.28Å
1060	L	80.5	Confident	82.5	Confident	25 Å²	25	59.2 Å²	59.2	13%	0.131	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-69.9	142.9	174.3	-55.8	-177.8	0	0	0	109.9	A1006 Y1007 H1046	A1006-L1060 HydrophobicContact CB-CD1 4.3Å; A1006-L1060 HydrophobicContact CB-CD2 3.71Å; Y1007-L1060 HydrophobicContact CE2-CD1 4.32Å; Y1007-L1060 HydrophobicContact CE2-CD2 3.89Å; Y1007-L1060 HydrophobicContact CE2-CG 4.18Å; H1046-L1060 HydrophobicContact CB-CD1 3.97Å; H1046-L1060 HydrophobicContact CB-CG 4Å; H1046-L1060 PolarHBondContact CE1-N 3.39Å; H1046-L1060 PolarHBondContact ND1-N 3.22Å
1061	S	79.8	Confident	83	Confident	63 Å²	63	55.1 Å²	55.1	44%	0.441	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-65.3	146.3	174	65.6	0	0	0	0	111.1	E1063 S1064	S1061-E1063 PolarHBondContact O-N 3.37Å; S1061-E1063 VanDerWaalsContact O-N 3.17Å; S1061-S1064 VanDerWaalsContact O-CB 3.25Å; S1061-S1064 WeakPolarHBondContact O-CB 3.47Å; S1061-S1064 PolarHBondContact O-N 2.72Å; S1061-S1064 PolarHBondContact OG-N 3.22Å
1062	P	79.8	Confident	83.5	Confident	72 Å²	72	49.3 Å²	49.3	47%	0.468	28%	0.282	S	S	.	.	H	α-helix	trans	-52.7	-37.5	175.5	-30.4	37.3	0	0	0	113.6	S1064 I1065 I1066 I1108	P1062-S1064 VanDerWaalsContact C-N 3.31Å; P1062-S1064 PolarHBondContact O-N 3.12Å; P1062-I1065 PolarHBondContact O-N 2.94Å; P1062-I1066 PolarHBondContact O-N 3.14Å; P1062-I1108 HydrophobicContact CB-CD1 3.83Å; P1062-I1108 HydrophobicContact CB-CG1 3.99Å; P1062-I1108 HydrophobicContact CB-CG2 3.84Å
1063	E	82.5	Confident	84	Confident	152 Å²	152	52 Å²	52	71%	0.71	30%	0.296	S	S	*	.	H	α-helix	trans	-64.6	-31.5	177.4	-60.3	-177.4	163.2	0	0	113.1	S1061 I1065 I1066 S1067	S1061-E1063 PolarHBondContact O-N 3.37Å; S1061-E1063 VanDerWaalsContact O-N 3.17Å; E1063-I1065 VanDerWaalsContact C-N 3.3Å; E1063-I1065 PolarHBondContact O-N 3.39Å; E1063-I1066 PolarHBondContact O-N 2.81Å; E1063-S1067 WeakPolarHBondContact O-CB 3.46Å; E1063-S1067 PolarHBondContact O-N 3.48Å; E1063-S1067 PolarHBondContact O-OG 2.84Å
1064	S	82	Confident	84.8	Confident	45 Å²	45	45.7 Å²	45.7	32%	0.315	27%	0.265	S	S	.	.	H	α-helix	trans	-65.9	-33.7	175.4	-171.8	0	0	0	0	111.7	S1061 P1062 G1068	S1061-S1064 VanDerWaalsContact O-CB 3.25Å; S1061-S1064 WeakPolarHBondContact O-CB 3.47Å; S1061-S1064 PolarHBondContact O-N 2.72Å; S1061-S1064 PolarHBondContact OG-N 3.22Å; P1062-S1064 VanDerWaalsContact C-N 3.31Å; P1062-S1064 PolarHBondContact O-N 3.12Å; S1064-G1068 WeakPolarHBondContact O-CA 3.38Å; S1064-G1068 PolarHBondContact O-N 3.46Å
1065	I	83.6	Confident	85.5	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-71.1	-40.9	175.8	-59.7	177.6	0	0	0	110.9	H998 P1062 E1063 I1101 E1104 I1108	H998-I1065 WeakPolarHBondContact NE2-CA 3.36Å; H998-I1065 PolarHBondContact NE2-O 3.37Å; P1062-I1065 PolarHBondContact O-N 2.94Å; E1063-I1065 VanDerWaalsContact C-N 3.3Å; E1063-I1065 PolarHBondContact O-N 3.39Å; I1065-I1101 HydrophobicContact CG2-CG2 4.03Å; I1065-E1104 HydrophobicContact CD1-CG 3.95Å; I1065-I1108 HydrophobicContact CB-CD1 4.38Å; I1065-I1108 HydrophobicContact CD1-CD1 4.09Å
1066	I	85.8	Confident	86.1	Confident	37 Å²	37	44.9 Å²	44.9	19%	0.19	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-49.7	179.5	-60.3	175.9	0	0	0	111.3	P1062 E1063 G1068 N1076 F1105 I1108	P1062-I1066 PolarHBondContact O-N 3.14Å; E1063-I1066 PolarHBondContact O-N 2.81Å; I1066-G1068 PolarHBondContact O-N 2.85Å; I1066-N1076 HydrophobicContact CG2-CB 4.25Å; I1066-F1105 HydrophobicContact CG1-CD2 4.14Å; I1066-I1108 HydrophobicContact CD1-CG2 3.96Å
1067	S	85.8	Confident	86.8	Confident	65 Å²	65	45.4 Å²	45.4	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-73.6	-12.5	178.6	61.7	0	0	0	0	114.1	T895 E1063 S1069	T895-S1067 PolarHBondContact OG1-O 3.15Å; E1063-S1067 WeakPolarHBondContact O-CB 3.46Å; E1063-S1067 PolarHBondContact O-N 3.48Å; E1063-S1067 PolarHBondContact O-OG 2.84Å; S1067-S1069 PolarHBondContact O-N 3.33Å; S1067-S1069 VanDerWaalsContact O-N 3.17Å
1068	G	84.6	Confident	87.4	Confident	4 Å²	4	42.5 Å²	42.5	4%	0.041	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-10	178.9	0	0	0	0	0	115.7	Q999 S1064 I1066	Q999-G1068 WeakPolarHBondContact CB-O 3.28Å; Q999-G1068 VanDerWaalsContact CG-O 3.27Å; Q999-G1068 WeakPolarHBondContact CG-O 3.45Å; Q999-G1068 PolarHBondContact N-O 3.42Å; Q999-G1068 VanDerWaalsContact NE2-C 3.33Å; Q999-G1068 PolarHBondContact NE2-O 2.97Å; S1064-G1068 WeakPolarHBondContact O-CA 3.38Å; S1064-G1068 PolarHBondContact O-N 3.46Å; I1066-G1068 PolarHBondContact O-N 2.85Å
1069	S	90.6	Very high	87.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.221	C	C	.	.			trans	-156	139	176.2	179.3	0	0	0	0	113.5	N997 H998 S1067 K1071 I1072 Q1073	N997-S1069 VanDerWaalsContact O-CB 3.27Å; N997-S1069 WeakPolarHBondContact O-CB 3.36Å; N997-S1069 PolarHBondContact O-OG 3.07Å; H998-S1069 VanDerWaalsContact CD2-CB 3.41Å; H998-S1069 WeakPolarHBondContact CD2-CB 3.5Å; S1067-S1069 PolarHBondContact O-N 3.33Å; S1067-S1069 VanDerWaalsContact O-N 3.17Å; S1069-K1071 PolarHBondContact O-N 2.79Å; S1069-K1071 PolarHBondContact OG-N 2.89Å; S1069-K1071 VanDerWaalsContact OG-N 3.09Å; S1069-I1072 PolarHBondContact O-N 3.03Å; S1069-Q1073 PolarHBondContact O-N 2.88Å
1070	G	91.6	Very high	88.4	Confident	4 Å²	4	39 Å²	39	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-34.4	169.3	0	0	0	0	0	112.8	V892 Q898 Q1073 W1074	V892-G1070 VanDerWaalsContact CG1-O 3.28Å; V892-G1070 WeakPolarHBondContact CG1-O 3.27Å; Q898-G1070 VanDerWaalsContact OE1-N 3.1Å; G1070-Q1073 PolarHBondContact O-N 2.91Å; G1070-W1074 WeakPolarHBondContact O-CB 3.44Å; G1070-W1074 PolarHBondContact O-N 3.03Å
1071	K	94.1	Very high	89	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69	-36.9	177.9	-63.7	-170.9	-177.7	-174.7	0	112.7	N997 S1069 L1075 H1162 L1192 S1194 E1199	N997-K1071 PolarHBondContact OD1-NZ 3.01Å; S1069-K1071 PolarHBondContact O-N 2.79Å; S1069-K1071 PolarHBondContact OG-N 2.89Å; S1069-K1071 VanDerWaalsContact OG-N 3.09Å; K1071-L1075 WeakPolarHBondContact O-CG 3.48Å; K1071-L1075 PolarHBondContact O-N 3.19Å; K1071-H1162 VanDerWaalsContact CD-CE1 3.5Å; K1071-H1162 WeakPolarHBondContact CD-CE1 3.11Å; K1071-H1162 PolarHBondContact NZ-O 2.95Å; K1071-L1192 HydrophobicContact CD-CB 4.23Å; K1071-L1192 HydrophobicContact CG-CB 4.46Å; K1071-L1192 PolarHBondContact NZ-O 3.44Å; K1071-S1194 WeakPolarHBondContact CE-OG 3.45Å; K1071-E1199 VanDerWaalsContact CE-OE2 3.31Å; K1071-E1199 WeakPolarHBondContact CE-OE2 3.04Å; K1071-E1199 VanDerWaalsContact NZ-CD 3.25Å; K1071-E1199 IonicContact NZ-OE1 2.76Å; K1071-E1199 PolarHBondContact NZ-OE1 3.33Å; K1071-E1199 IonicContact NZ-OE2 3.35Å; K1071-E1199 PolarHBondContact NZ-OE2 3.41Å
1072	I	93.6	Very high	89.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-73.9	-37.4	175	-62.4	-167.4	0	0	0	110.6	H998 S1069 L1075 N1076 M1098 I1101 L1102 F1105	H998-I1072 WeakPolarHBondContact CD2-CD1 3.36Å; H998-I1072 WeakPolarHBondContact NE2-CD1 3.17Å; S1069-I1072 PolarHBondContact O-N 3.03Å; I1072-L1075 WeakPolarHBondContact O-CB 3.35Å; I1072-L1075 PolarHBondContact O-N 3.35Å; I1072-N1076 WeakPolarHBondContact O-CB 3.37Å; I1072-N1076 PolarHBondContact O-N 2.76Å; I1072-M1098 HydrophobicContact CD1-CE 3.81Å; I1072-M1098 HydrophobicContact CG1-CE 4.09Å; I1072-I1101 HydrophobicContact CD1-CG2 3.61Å; I1072-L1102 HydrophobicContact CG1-CD2 4.49Å; I1072-F1105 HydrophobicContact CG2-CB 4.43Å; I1072-F1105 HydrophobicContact CG2-CD1 4.48Å; I1072-F1105 HydrophobicContact CG2-CD2 3.57Å; I1072-F1105 HydrophobicContact CG2-CE2 3.88Å; I1072-F1105 HydrophobicContact CG2-CG 3.9Å; I1072-F1105 HydrophobicContact CG2-CZ 4.45Å
1073	Q	92.2	Very high	90	Very high	89 Å²	89	39.2 Å²	39.2	42%	0.416	21%	0.208	S	C	.	.	H	α-helix	trans	-59.8	-45.9	171.5	-172.9	176.5	-10.4	0	0	111.5	S1069 G1070 L1075 N1076 D1077	S1069-Q1073 PolarHBondContact O-N 2.88Å; G1070-Q1073 PolarHBondContact O-N 2.91Å; Q1073-L1075 VanDerWaalsContact C-N 3.31Å; Q1073-L1075 PolarHBondContact O-N 2.77Å; Q1073-N1076 WeakPolarHBondContact O-CB 3.15Å; Q1073-N1076 PolarHBondContact O-N 2.71Å; Q1073-N1076 VanDerWaalsContact O-N 3.13Å; Q1073-D1077 VanDerWaalsContact O-CG 3.24Å; Q1073-D1077 PolarHBondContact O-N 3.4Å
1074	W	94.5	Very high	90.4	Very high	46 Å²	46	36.8 Å²	36.8	17%	0.174	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-39.2	174.7	-176	94.7	0	0	0	112.6	V890 V892 G1070 D1077 N1078 I1160 I1190 L1192	V890-W1074 HydrophobicContact CG2-CZ2 4.36Å; V892-W1074 HydrophobicContact CG1-CB 4.19Å; V892-W1074 HydrophobicContact CG2-CB 4.37Å; V892-W1074 HydrophobicContact CG2-CG 4.27Å; G1070-W1074 WeakPolarHBondContact O-CB 3.44Å; G1070-W1074 PolarHBondContact O-N 3.03Å; W1074-D1077 PolarHBondContact O-N 2.96Å; W1074-N1078 HydrophobicContact CH2-CB 4.11Å; W1074-N1078 HydrophobicContact CZ2-CB 4.09Å; W1074-N1078 HydrophobicContact CZ3-CB 4.36Å; W1074-N1078 PolarHBondContact NE1-ND2 3.48Å; W1074-N1078 WeakPolarHBondContact O-CB 3.18Å; W1074-N1078 PolarHBondContact O-N 3.41Å; W1074-N1078 PolarHBondContact O-ND2 3.35Å; W1074-I1160 HydrophobicContact CZ3-CD1 4.34Å; W1074-I1190 HydrophobicContact CH2-CD1 3.97Å; W1074-I1190 HydrophobicContact CH2-CG2 3.85Å; W1074-I1190 HydrophobicContact CZ2-CG2 4.2Å; W1074-L1192 HydrophobicContact CD2-CD2 3.83Å; W1074-L1192 HydrophobicContact CE3-CD1 3.82Å; W1074-L1192 HydrophobicContact CE3-CD2 3.6Å; W1074-L1192 HydrophobicContact CE3-CG 4.36Å; W1074-L1192 HydrophobicContact CH2-CD2 4.12Å; W1074-L1192 HydrophobicContact CZ2-CD2 4.29Å; W1074-L1192 HydrophobicContact CZ3-CD1 4.18Å; W1074-L1192 HydrophobicContact CZ3-CD2 3.76Å
1075	L	93.9	Very high	90.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-43.8	173.4	-76.9	170.1	0	0	0	111.7	K1071 I1072 Q1073 D1077 N1078 L1079 I1091 L1102 F1105 I1160 L1192	K1071-L1075 WeakPolarHBondContact O-CG 3.48Å; K1071-L1075 PolarHBondContact O-N 3.19Å; I1072-L1075 WeakPolarHBondContact O-CB 3.35Å; I1072-L1075 PolarHBondContact O-N 3.35Å; Q1073-L1075 VanDerWaalsContact C-N 3.31Å; Q1073-L1075 PolarHBondContact O-N 2.77Å; L1075-D1077 PolarHBondContact O-N 2.9Å; L1075-N1078 PolarHBondContact O-N 3.17Å; L1075-L1079 WeakPolarHBondContact O-CB 3.29Å; L1075-L1079 PolarHBondContact O-N 2.75Å; L1075-I1091 HydrophobicContact CD2-CD1 4.49Å; L1075-L1102 HydrophobicContact CD1-CD2 3.59Å; L1075-F1105 HydrophobicContact CB-CE1 3.95Å; L1075-F1105 HydrophobicContact CB-CZ 4.05Å; L1075-I1160 HydrophobicContact CD2-CD1 3.81Å; L1075-I1160 HydrophobicContact CD2-CG2 4.44Å; L1075-L1192 HydrophobicContact CG-CD1 4.35Å
1076	N	92.6	Very high	91.1	Very high	52 Å²	52	43 Å²	43	28%	0.278	25%	0.246	S	C	.	.	H	α-helix	trans	-56.5	-39.3	176.3	-177.6	82.5	0	0	0	112	I1066 I1072 Q1073 P1080 F1105	I1066-N1076 HydrophobicContact CG2-CB 4.25Å; I1072-N1076 WeakPolarHBondContact O-CB 3.37Å; I1072-N1076 PolarHBondContact O-N 2.76Å; Q1073-N1076 WeakPolarHBondContact O-CB 3.15Å; Q1073-N1076 PolarHBondContact O-N 2.71Å; Q1073-N1076 VanDerWaalsContact O-N 3.13Å; N1076-P1080 WeakPolarHBondContact O-CD 3.48Å; N1076-P1080 WeakPolarHBondContact O-CG 3.25Å; N1076-F1105 HydrophobicContact CB-CE2 3.99Å; N1076-F1105 HydrophobicContact CB-CZ 4.2Å
1077	D	92	Very high	91.4	Very high	74 Å²	74	43.4 Å²	43.4	40%	0.396	25%	0.248	S	C	.	.	H	α-helix	trans	-85	-17	-174.1	-61.2	-11.8	0	0	0	113.6	Q1073 W1074 L1075 K1081	Q1073-D1077 VanDerWaalsContact O-CG 3.24Å; Q1073-D1077 PolarHBondContact O-N 3.4Å; W1074-D1077 PolarHBondContact O-N 2.96Å; L1075-D1077 PolarHBondContact O-N 2.9Å; D1077-K1081 WeakPolarHBondContact O-CE 3.48Å; D1077-K1081 PolarHBondContact O-NZ 2.65Å
1078	N	93.3	Very high	91.7	Very high	35 Å²	35	43.6 Å²	43.6	19%	0.187	24%	0.238	C	C	.	.	H	α-helix	trans	-123.3	-29.5	-173.6	-62	-67.6	0	0	0	115	W1074 L1075 P1080 K1081 L1082	W1074-N1078 HydrophobicContact CH2-CB 4.11Å; W1074-N1078 HydrophobicContact CZ2-CB 4.09Å; W1074-N1078 HydrophobicContact CZ3-CB 4.36Å; W1074-N1078 PolarHBondContact NE1-ND2 3.48Å; W1074-N1078 WeakPolarHBondContact O-CB 3.18Å; W1074-N1078 PolarHBondContact O-N 3.41Å; W1074-N1078 PolarHBondContact O-ND2 3.35Å; L1075-N1078 PolarHBondContact O-N 3.17Å; N1078-P1080 VanDerWaalsContact C-CD 3.41Å; N1078-P1080 VanDerWaalsContact C-N 3.31Å; N1078-K1081 WeakPolarHBondContact O-CB 3.34Å; N1078-K1081 PolarHBondContact O-N 3.29Å; N1078-K1081 VanDerWaalsContact O-N 3.08Å; N1078-K1081 PolarHBondContact OD1-NZ 2.79Å; N1078-L1082 PolarHBondContact O-N 3.19Å
1079	L	92.1	Very high	92.2	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-56.5	-37	173.1	-167.2	75.9	0	0	0	112.8	L1075 K1081 V1083 I1089 F1105 L1106 V1139	L1075-L1079 WeakPolarHBondContact O-CB 3.29Å; L1075-L1079 PolarHBondContact O-N 2.75Å; L1079-K1081 VanDerWaalsContact C-N 3.34Å; L1079-K1081 PolarHBondContact O-N 2.92Å; L1079-V1083 WeakPolarHBondContact O-CB 3.49Å; L1079-V1083 WeakPolarHBondContact O-CG2 3.47Å; L1079-V1083 PolarHBondContact O-N 3.07Å; L1079-V1083 VanDerWaalsContact O-N 3.14Å; L1079-I1089 HydrophobicContact CD1-CD1 3.52Å; L1079-I1089 HydrophobicContact CD1-CG2 4.4Å; L1079-F1105 HydrophobicContact CD2-CE1 4.14Å; L1079-L1106 HydrophobicContact CD2-CD2 3.59Å; L1079-V1139 HydrophobicContact CD1-CG2 4.27Å
1080	P	91	Very high	92.4	Very high	52 Å²	52	43.4 Å²	43.4	34%	0.338	24%	0.236	S	C	.	.	H	α-helix	trans	-64.9	-33.7	174.5	-22.3	34.8	0	0	0	114.1	N1076 N1078 S1084	N1076-P1080 WeakPolarHBondContact O-CD 3.48Å; N1076-P1080 WeakPolarHBondContact O-CG 3.25Å; N1078-P1080 VanDerWaalsContact C-CD 3.41Å; N1078-P1080 VanDerWaalsContact C-N 3.31Å; P1080-S1084 WeakPolarHBondContact O-CB 3.34Å; P1080-S1084 PolarHBondContact O-N 3.35Å; P1080-S1084 PolarHBondContact O-OG 3.48Å
1081	K	93.1	Very high	92.6	Very high	105 Å²	105	43.2 Å²	43.2	46%	0.457	24%	0.235	S	C	.	.	H	α-helix	trans	-67.6	-55.7	-179.9	-57.9	172.2	-172.3	151.9	0	110	D1077 N1078 L1079 V1083 S1084 E1085	D1077-K1081 WeakPolarHBondContact O-CE 3.48Å; D1077-K1081 PolarHBondContact O-NZ 2.65Å; N1078-K1081 WeakPolarHBondContact O-CB 3.34Å; N1078-K1081 PolarHBondContact O-N 3.29Å; N1078-K1081 VanDerWaalsContact O-N 3.08Å; N1078-K1081 PolarHBondContact OD1-NZ 2.79Å; L1079-K1081 VanDerWaalsContact C-N 3.34Å; L1079-K1081 PolarHBondContact O-N 2.92Å; K1081-V1083 VanDerWaalsContact C-N 3.28Å; K1081-V1083 PolarHBondContact O-N 3.23Å; K1081-S1084 CarbonylContact O-C 3.56Å; K1081-S1084 WeakPolarHBondContact O-CA 3.46Å; K1081-S1084 WeakPolarHBondContact O-CB 3.27Å; K1081-S1084 PolarHBondContact O-N 3.19Å; K1081-S1084 PolarHBondContact O-OG 3.06Å; K1081-E1085 WeakPolarHBondContact O-CG 3.35Å; K1081-E1085 PolarHBondContact O-N 3.11Å
1082	L	91.7	Very high	92.6	Very high	27 Å²	27	43.2 Å²	43.2	14%	0.141	24%	0.235	C	C	.	.	H	α-helix	trans	-55.2	-41.5	178.3	-65.4	168	0	0	0	112.2	N1078 E1085 G1086 H1087 I1089 T1158	N1078-L1082 PolarHBondContact O-N 3.19Å; L1082-E1085 WeakPolarHBondContact CA-OE2 3.48Å; L1082-E1085 PolarHBondContact O-N 2.97Å; L1082-G1086 PolarHBondContact O-N 3.03Å; L1082-H1087 WeakPolarHBondContact O-CB 3.47Å; L1082-H1087 PolarHBondContact O-N 3.01Å; L1082-I1089 HydrophobicContact CB-CD1 3.67Å; L1082-I1089 HydrophobicContact CD1-CD1 4.14Å; L1082-T1158 HydrophobicContact CD1-CG2 4.29Å
1083	V	90.6	Very high	92.7	Very high	32 Å²	32	43.2 Å²	43.2	19%	0.194	24%	0.235	C	C	.	.	H	α-helix	trans	-71.1	-34.9	175.9	173.2	0	0	0	0	112.2	L1079 K1081 E1085 G1086 I1089 E1138	L1079-V1083 WeakPolarHBondContact O-CB 3.49Å; L1079-V1083 WeakPolarHBondContact O-CG2 3.47Å; L1079-V1083 PolarHBondContact O-N 3.07Å; L1079-V1083 VanDerWaalsContact O-N 3.14Å; K1081-V1083 VanDerWaalsContact C-N 3.28Å; K1081-V1083 PolarHBondContact O-N 3.23Å; V1083-E1085 VanDerWaalsContact C-N 3.28Å; V1083-E1085 PolarHBondContact O-N 2.67Å; V1083-G1086 PolarHBondContact O-N 3.07Å; V1083-G1086 VanDerWaalsContact O-N 3.1Å; V1083-I1089 HydrophobicContact CG2-CD1 3.99Å; V1083-E1138 HydrophobicContact CG1-CG 3.86Å; V1083-E1138 HydrophobicContact CG2-CB 4.2Å; V1083-E1138 HydrophobicContact CG2-CG 4.32Å
1084	S	90	Very high	92.7	Very high	100 Å²	100	40.4 Å²	40.4	70%	0.699	22%	0.222	S	C	*	.	H	α-helix	trans	-69.2	-25.6	174.6	72.3	0	0	0	0	113.6	P1080 K1081 G1086	P1080-S1084 WeakPolarHBondContact O-CB 3.34Å; P1080-S1084 PolarHBondContact O-N 3.35Å; P1080-S1084 PolarHBondContact O-OG 3.48Å; K1081-S1084 CarbonylContact O-C 3.56Å; K1081-S1084 WeakPolarHBondContact O-CA 3.46Å; K1081-S1084 WeakPolarHBondContact O-CB 3.27Å; K1081-S1084 PolarHBondContact O-N 3.19Å; K1081-S1084 PolarHBondContact O-OG 3.06Å; S1084-G1086 VanDerWaalsContact C-N 3.26Å
1085	E	90.9	Very high	92.5	Very high	120 Å²	120	40.2 Å²	40.2	56%	0.561	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-9.5	171.6	-68.3	155.9	171.6	0	0	112.3	K1081 L1082 V1083 H1087	K1081-E1085 WeakPolarHBondContact O-CG 3.35Å; K1081-E1085 PolarHBondContact O-N 3.11Å; L1082-E1085 WeakPolarHBondContact CA-OE2 3.48Å; L1082-E1085 PolarHBondContact O-N 2.97Å; V1083-E1085 VanDerWaalsContact C-N 3.28Å; V1083-E1085 PolarHBondContact O-N 2.67Å; E1085-H1087 IonicContact OE2-CD2 3.63Å
1086	G	89.3	Confident	92.4	Very high	58 Å²	58	42.9 Å²	42.9	60%	0.598	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.8	7.6	177.7	0	0	0	0	0	115.2	L1082 V1083 S1084	L1082-G1086 PolarHBondContact O-N 3.03Å; V1083-G1086 PolarHBondContact O-N 3.07Å; V1083-G1086 VanDerWaalsContact O-N 3.1Å; S1084-G1086 VanDerWaalsContact C-N 3.26Å
1087	H	92.5	Very high	92.2	Very high	47 Å²	47	42.8 Å²	42.8	22%	0.218	24%	0.237	C	C	.	.			trans	-70.3	146.6	-179.3	-66.4	-55.1	0	0	0	112.7	L1082 E1085 D1157	L1082-H1087 WeakPolarHBondContact O-CB 3.47Å; L1082-H1087 PolarHBondContact O-N 3.01Å; E1085-H1087 IonicContact OE2-CD2 3.63Å; H1087-D1157 WeakPolarHBondContact CA-OD1 3.33Å; H1087-D1157 WeakPolarHBondContact CB-OD1 3.46Å; H1087-D1157 IonicContact CE1-OD2 2.63Å; H1087-D1157 IonicContact CG-OD1 3.51Å; H1087-D1157 IonicContact CG-OD2 3.64Å; H1087-D1157 IonicContact ND1-OD1 3.51Å; H1087-D1157 IonicContact ND1-OD2 3.95Å; H1087-D1157 PolarHBondContact ND1-OD2 3.07Å
1088	R	92.8	Very high	92.3	Very high	68 Å²	68	39.3 Å²	39.3	26%	0.257	22%	0.218	S	C	.	.			trans	-112.2	127.9	177.4	-76.9	-166.7	-63.9	-171.7	-4.2	110	F1132 N1133 S1135 I1137 G1155 A1156 D1157 T1158	R1088-F1132 HydrophobicContact CB-CZ 4.25Å; R1088-F1132 PolarHBondContact NH1-O 2.9Å; R1088-N1133 PolarHBondContact NH1-O 3.12Å; R1088-S1135 PolarHBondContact NH1-O 3.26Å; R1088-I1137 WeakPolarHBondContact CD-O 3.32Å; R1088-G1155 PolarHBondContact NE-O 3.31Å; R1088-G1155 VanDerWaalsContact NH2-CA 3.29Å; R1088-G1155 PolarHBondContact NH2-O 3.46Å; R1088-A1156 WeakPolarHBondContact O-CA 3.49Å; R1088-A1156 VanDerWaalsContact O-CB 3.3Å; R1088-A1156 WeakPolarHBondContact O-CB 3.05Å; R1088-D1157 PolarHBondContact N-OD1 3.01Å; R1088-D1157 PolarHBondContact O-N 2.8Å; R1088-D1157 VanDerWaalsContact O-OD1 3.12Å; R1088-T1158 PolarHBondContact O-N 2.84Å
1089	I	94.6	Very high	92.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	120.4	-152.5	-51.3	176.5	0	0	0	110.9	L1079 L1082 V1083 I1091 E1138 V1139 F1140 T1158 I1160	L1079-I1089 HydrophobicContact CD1-CD1 3.52Å; L1079-I1089 HydrophobicContact CD1-CG2 4.4Å; L1082-I1089 HydrophobicContact CB-CD1 3.67Å; L1082-I1089 HydrophobicContact CD1-CD1 4.14Å; V1083-I1089 HydrophobicContact CG2-CD1 3.99Å; I1089-I1091 HydrophobicContact CG2-CG1 4.15Å; I1089-E1138 PolarHBondContact N-O 3.41Å; I1089-V1139 CarbonylContact O-C 3.57Å; I1089-V1139 WeakPolarHBondContact O-CA 3.15Å; I1089-F1140 PolarHBondContact O-N 2.78Å; I1089-T1158 WeakPolarHBondContact CA-O 3.43Å; I1089-T1158 HydrophobicContact CG2-CG2 4.39Å; I1089-I1160 HydrophobicContact CG2-CD1 3.65Å; I1089-I1160 HydrophobicContact CG2-CG1 3.95Å
1090	L	94.8	Very high	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.5	167.5	-52.7	-175.1	0	0	0	109.3	F1092 F1132 F1140 L1142 L1153 A1156 T1158 V1159 I1160 C1178	L1090-F1092 HydrophobicContact CB-CD2 4.49Å; L1090-F1092 HydrophobicContact CB-CE2 3.95Å; L1090-F1092 HydrophobicContact CB-CZ 4.36Å; L1090-F1092 HydrophobicContact CD1-CE2 4.04Å; L1090-F1092 HydrophobicContact CD1-CZ 4.04Å; L1090-F1132 HydrophobicContact CD2-CE1 3.87Å; L1090-F1132 HydrophobicContact CD2-CZ 3.96Å; L1090-F1140 HydrophobicContact CD2-CB 3.72Å; L1090-F1140 HydrophobicContact CD2-CD1 4.29Å; L1090-F1140 HydrophobicContact CD2-CG 4.37Å; L1090-L1142 HydrophobicContact CB-CD1 4.33Å; L1090-L1142 HydrophobicContact CD1-CD1 4.39Å; L1090-L1142 HydrophobicContact CD2-CD1 4.05Å; L1090-L1142 HydrophobicContact CG-CD1 4.49Å; L1090-L1153 HydrophobicContact CD1-CB 4.03Å; L1090-L1153 HydrophobicContact CD1-CD1 3.71Å; L1090-L1153 HydrophobicContact CD2-CB 4.5Å; L1090-L1153 HydrophobicContact CD2-CD1 4.07Å; L1090-A1156 HydrophobicContact CD1-CB 4.08Å; L1090-A1156 HydrophobicContact CD2-CB 3.57Å; L1090-A1156 HydrophobicContact CG-CB 3.5Å; L1090-A1156 VanDerWaalsContact CG-CB 3.5Å; L1090-T1158 PolarHBondContact N-O 3.04Å; L1090-V1159 HydrophobicContact CB-CG2 4.44Å; L1090-V1159 HydrophobicContact CD1-CG2 4.21Å; L1090-V1159 HydrophobicContact CG-CG2 4.5Å; L1090-I1160 PolarHBondContact O-N 2.98Å; L1090-C1178 HydrophobicContact CD1-CB 4.06Å
1091	I	95.4	Very high	92.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	114.7	172.4	-52.1	-178.6	0	0	0	109.2	L1075 I1089 L1102 V1139 F1140 L1141 L1142 I1160 H1162	L1075-I1091 HydrophobicContact CD2-CD1 4.49Å; I1089-I1091 HydrophobicContact CG2-CG1 4.15Å; I1091-L1102 HydrophobicContact CG2-CD1 4.07Å; I1091-V1139 HydrophobicContact CD1-CG1 3.69Å; I1091-V1139 HydrophobicContact CG1-CG1 3.99Å; I1091-F1140 PolarHBondContact N-O 2.89Å; I1091-L1141 HydrophobicContact CB-CD2 4.03Å; I1091-L1141 HydrophobicContact CD1-CD2 4.22Å; I1091-L1141 HydrophobicContact CG2-CD2 4.49Å; I1091-L1142 PolarHBondContact O-N 2.93Å; I1091-I1160 CarbonylContact C-O 3.42Å; I1091-I1160 WeakPolarHBondContact CA-O 3.41Å; I1091-I1160 HydrophobicContact CG1-CB 4.38Å; I1091-I1160 HydrophobicContact CG1-CD1 4.49Å; I1091-H1162 HydrophobicContact CG2-CB 4.42Å
1092	F	94.7	Very high	92.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134.1	179.2	-70.1	-68.6	0	0	0	112.5	L1090 L1142 V1159 I1160 I1161 H1162 A1174	L1090-F1092 HydrophobicContact CB-CD2 4.49Å; L1090-F1092 HydrophobicContact CB-CE2 3.95Å; L1090-F1092 HydrophobicContact CB-CZ 4.36Å; L1090-F1092 HydrophobicContact CD1-CE2 4.04Å; L1090-F1092 HydrophobicContact CD1-CZ 4.04Å; F1092-L1142 WeakPolarHBondContact CA-O 3.44Å; F1092-L1142 HydrophobicContact CD1-CB 3.48Å; F1092-L1142 VanDerWaalsContact CD1-CB 3.48Å; F1092-L1142 HydrophobicContact CD1-CD1 4.32Å; F1092-L1142 HydrophobicContact CE1-CB 3.4Å; F1092-L1142 VanDerWaalsContact CE1-CB 3.4Å; F1092-L1142 HydrophobicContact CE1-CD1 3.48Å; F1092-L1142 VanDerWaalsContact CE1-CD1 3.48Å; F1092-L1142 HydrophobicContact CE1-CG 4.02Å; F1092-L1142 HydrophobicContact CG-CB 4.49Å; F1092-L1142 HydrophobicContact CZ-CB 4.38Å; F1092-L1142 HydrophobicContact CZ-CD1 3.67Å; F1092-V1159 HydrophobicContact CD2-CG1 3.67Å; F1092-V1159 HydrophobicContact CE2-CG1 3.63Å; F1092-I1160 PolarHBondContact N-O 3.28Å; F1092-I1161 HydrophobicContact CB-CG1 4.41Å; F1092-H1162 WeakPolarHBondContact O-CB 3.49Å; F1092-H1162 PolarHBondContact O-N 2.82Å; F1092-A1174 HydrophobicContact CD1-CB 4.15Å; F1092-A1174 HydrophobicContact CD2-CB 4.19Å; F1092-A1174 HydrophobicContact CE1-CB 3.9Å; F1092-A1174 HydrophobicContact CE2-CB 3.92Å; F1092-A1174 HydrophobicContact CG-CB 4.3Å; F1092-A1174 HydrophobicContact CZ-CB 3.78Å
1093	S	94.6	Very high	92.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.5	168.6	179.9	0	0	0	0	113.1	F1095 L1142 S1143 T1144 D1163	S1093-F1095 PolarHBondContact OG-N 2.63Å; S1093-L1142 PolarHBondContact N-O 3.45Å; S1093-L1142 VanDerWaalsContact N-O 3.13Å; S1093-S1143 WeakPolarHBondContact O-CA 3.43Å; S1093-T1144 PolarHBondContact O-N 2.84Å; S1093-T1144 PolarHBondContact O-OG1 2.6Å; S1093-D1163 VanDerWaalsContact CA-OD1 3.23Å; S1093-D1163 WeakPolarHBondContact CA-OD1 3.46Å; S1093-D1163 VanDerWaalsContact CB-OD1 3.32Å; S1093-D1163 WeakPolarHBondContact CB-OD1 3.49Å; S1093-D1163 PolarHBondContact OG-OD1 3.36Å
1094	Q	92	Very high	92.3	Very high	30 Å²	30	30.9 Å²	30.9	14%	0.14	17%	0.173	C	C	.	.	S	Bend	trans	-78.8	-24.8	173.6	-56.6	-63	-21.8	0	0	112.8	T1144 D1163 D1165 D1171	Q1094-T1144 PolarHBondContact NE2-OG1 3.07Å; Q1094-D1163 PolarHBondContact N-OD1 3.12Å; Q1094-D1165 PolarHBondContact OE1-OD2 2.84Å; Q1094-D1171 PolarHBondContact NE2-OD1 3.15Å
1095	F	90.7	Very high	92.4	Very high	42 Å²	42	26.2 Å²	26.2	18%	0.184	14%	0.14	C	C	.	.			trans	-104	116.5	-176.7	-64.7	-79.9	0	0	0	111.4	T990 R993 S1093 I1097 M1098 L1099 D1163	T990-F1095 HydrophobicContact CG2-CE1 4.02Å; T990-F1095 HydrophobicContact CG2-CZ 4.29Å; R993-F1095 HydrophobicContact CB-CE2 4.08Å; R993-F1095 HydrophobicContact CB-CZ 4.02Å; S1093-F1095 PolarHBondContact OG-N 2.63Å; F1095-I1097 PolarHBondContact O-N 3.43Å; F1095-M1098 HydrophobicContact CB-CB 3.98Å; F1095-M1098 WeakPolarHBondContact O-CA 3.45Å; F1095-M1098 WeakPolarHBondContact O-CB 3.36Å; F1095-M1098 PolarHBondContact O-N 3.08Å; F1095-L1099 PolarHBondContact O-N 2.76Å; F1095-D1163 WeakPolarHBondContact CD2-OD2 3.48Å; F1095-D1163 VanDerWaalsContact CE2-OD2 3.29Å; F1095-D1163 WeakPolarHBondContact CE2-OD2 3.28Å
1096	V	91.2	Very high	92.5	Very high	55 Å²	55	20.5 Å²	20.5	33%	0.333	11%	0.113	S	C	.	.	H	α-helix	trans	-59.6	-34.9	175.9	-177.5	0	0	0	0	111.7	M1098 L1099 D1100 D1117	V1096-M1098 PolarHBondContact O-N 2.91Å; V1096-L1099 WeakPolarHBondContact O-CA 3.38Å; V1096-L1099 WeakPolarHBondContact O-CB 3.39Å; V1096-L1099 PolarHBondContact O-N 3.03Å; V1096-D1100 PolarHBondContact O-N 3.43Å; V1096-D1117 HydrophobicContact CG1-CB 4.49Å; V1096-D1117 HydrophobicContact CG2-CB 4.48Å
1097	I	89.5	Confident	92.6	Very high	51 Å²	51	22 Å²	22	26%	0.262	10%	0.101	S	C	.	.	H	α-helix	trans	-66	-25	175.8	-43	177.3	0	0	0	111.7	L1001 F1095 D1100 I1101	L1001-I1097 HydrophobicContact CD2-CB 3.89Å; L1001-I1097 HydrophobicContact CD2-CG2 3.56Å; F1095-I1097 PolarHBondContact O-N 3.43Å; I1097-D1100 WeakPolarHBondContact O-CB 3.38Å; I1097-D1100 PolarHBondContact O-N 3.39Å; I1097-I1101 WeakPolarHBondContact O-CG1 3.45Å; I1097-I1101 PolarHBondContact O-N 3.2Å
1098	M	93	Very high	92.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-74.9	-35.8	171.3	-169.5	68.9	-139.8	0	0	111.1	N997 H998 L1001 I1072 F1095 V1096 D1100 I1101 L1102 H1162	N997-M1098 HydrophobicContact CB-SD 4Å; H998-M1098 HydrophobicContact CB-CE 4.25Å; H998-M1098 HydrophobicContact CB-SD 4.01Å; L1001-M1098 HydrophobicContact CD1-SD 3.92Å; I1072-M1098 HydrophobicContact CD1-CE 3.81Å; I1072-M1098 HydrophobicContact CG1-CE 4.09Å; F1095-M1098 HydrophobicContact CB-CB 3.98Å; F1095-M1098 WeakPolarHBondContact O-CA 3.45Å; F1095-M1098 WeakPolarHBondContact O-CB 3.36Å; F1095-M1098 PolarHBondContact O-N 3.08Å; V1096-M1098 PolarHBondContact O-N 2.91Å; M1098-D1100 PolarHBondContact O-N 2.83Å; M1098-I1101 HydrophobicContact CE-CB 4.27Å; M1098-I1101 HydrophobicContact CE-CG2 4.15Å; M1098-I1101 PolarHBondContact O-N 2.83Å; M1098-I1101 HydrophobicContact SD-CD1 4.46Å; M1098-L1102 HydrophobicContact CE-CD1 4.47Å; M1098-L1102 HydrophobicContact CE-CD2 4.12Å; M1098-L1102 HydrophobicContact CE-CG 3.92Å; M1098-L1102 HydrophobicContact CG-CD1 4.22Å; M1098-L1102 HydrophobicContact CG-CG 4.49Å; M1098-L1102 WeakPolarHBondContact O-CB 3.4Å; M1098-L1102 VanDerWaalsContact O-CG 3.31Å; M1098-L1102 WeakPolarHBondContact O-CG 3.32Å; M1098-L1102 PolarHBondContact O-N 2.9Å; M1098-H1162 WeakPolarHBondContact CE-NE2 3.39Å
1099	L	93.2	Very high	92.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-32.4	171.9	-56.8	177.2	0	0	0	111.7	F1095 V1096 L1102 E1103 D1117 L1141	F1095-L1099 PolarHBondContact O-N 2.76Å; V1096-L1099 WeakPolarHBondContact O-CA 3.38Å; V1096-L1099 WeakPolarHBondContact O-CB 3.39Å; V1096-L1099 PolarHBondContact O-N 3.03Å; L1099-L1102 HydrophobicContact CD2-CD1 4.42Å; L1099-E1103 VanDerWaalsContact O-CB 3.22Å; L1099-E1103 WeakPolarHBondContact O-CB 3.31Å; L1099-E1103 PolarHBondContact O-N 3.39Å; L1099-D1117 HydrophobicContact CD1-CB 4.24Å; L1099-L1141 HydrophobicContact CD2-CB 4.4Å
1100	D	91.8	Very high	91.9	Very high	32 Å²	32	25.6 Å²	25.6	17%	0.171	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-40.5	172	-72.8	-66.4	0	0	0	113.1	H1043 K1047 V1096 I1097 M1098 E1104 R1115	H1043-D1100 WeakPolarHBondContact CE1-CB 2.93Å; K1047-D1100 IonicContact NZ-OD1 2.6Å; K1047-D1100 PolarHBondContact NZ-OD1 3.25Å; V1096-D1100 PolarHBondContact O-N 3.43Å; I1097-D1100 WeakPolarHBondContact O-CB 3.38Å; I1097-D1100 PolarHBondContact O-N 3.39Å; M1098-D1100 PolarHBondContact O-N 2.83Å; D1100-E1104 PolarHBondContact O-N 3.2Å; D1100-R1115 IonicContact OD1-CZ 2.84Å; D1100-R1115 IonicContact OD1-NH1 3.57Å; D1100-R1115 PolarHBondContact OD1-NH1 3.07Å; D1100-R1115 IonicContact OD1-NH2 3.81Å; D1100-R1115 PolarHBondContact OD1-NH2 3.17Å; D1100-R1115 IonicContact OD2-NH2 3.79Å
1101	I	91.7	Very high	91.6	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-71.1	-41	177.1	-64.1	166.6	0	0	0	110.7	H998 L1001 H1043 I1065 I1072 I1097 M1098 E1103 E1104 F1105	H998-I1101 HydrophobicContact CB-CD1 4.19Å; L1001-I1101 HydrophobicContact CD1-CD1 4.41Å; L1001-I1101 HydrophobicContact CD2-CD1 3.59Å; L1001-I1101 HydrophobicContact CG-CD1 3.67Å; H1043-I1101 HydrophobicContact CB-CD1 4.09Å; H1043-I1101 HydrophobicContact CB-CG1 4Å; H1043-I1101 VanDerWaalsContact CD2-CG1 3.48Å; H1043-I1101 WeakPolarHBondContact CD2-CG1 3.33Å; H1043-I1101 VanDerWaalsContact CG-CG1 3.44Å; I1065-I1101 HydrophobicContact CG2-CG2 4.03Å; I1072-I1101 HydrophobicContact CD1-CG2 3.61Å; I1097-I1101 WeakPolarHBondContact O-CG1 3.45Å; I1097-I1101 PolarHBondContact O-N 3.2Å; M1098-I1101 HydrophobicContact CE-CB 4.27Å; M1098-I1101 HydrophobicContact CE-CG2 4.15Å; M1098-I1101 PolarHBondContact O-N 2.83Å; M1098-I1101 HydrophobicContact SD-CD1 4.46Å; I1101-E1103 VanDerWaalsContact C-N 3.3Å; I1101-E1103 PolarHBondContact O-N 3.4Å; I1101-E1104 PolarHBondContact O-N 2.78Å; I1101-F1105 PolarHBondContact O-N 3.08Å
1102	L	93.3	Very high	91.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-65.5	-34.1	175.4	-70.5	168.8	0	0	0	112	I1072 L1075 I1091 M1098 L1099 L1106 L1141	I1072-L1102 HydrophobicContact CG1-CD2 4.49Å; L1075-L1102 HydrophobicContact CD1-CD2 3.59Å; I1091-L1102 HydrophobicContact CG2-CD1 4.07Å; M1098-L1102 HydrophobicContact CE-CD1 4.47Å; M1098-L1102 HydrophobicContact CE-CD2 4.12Å; M1098-L1102 HydrophobicContact CE-CG 3.92Å; M1098-L1102 HydrophobicContact CG-CD1 4.22Å; M1098-L1102 HydrophobicContact CG-CG 4.49Å; M1098-L1102 WeakPolarHBondContact O-CB 3.4Å; M1098-L1102 VanDerWaalsContact O-CG 3.31Å; M1098-L1102 WeakPolarHBondContact O-CG 3.32Å; M1098-L1102 PolarHBondContact O-N 2.9Å; L1099-L1102 HydrophobicContact CD2-CD1 4.42Å; L1102-L1106 WeakPolarHBondContact O-CB 3.48Å; L1102-L1106 VanDerWaalsContact O-CG 3.24Å; L1102-L1106 WeakPolarHBondContact O-CG 3.47Å; L1102-L1106 PolarHBondContact O-N 3.29Å; L1102-L1141 HydrophobicContact CB-CD1 4.34Å; L1102-L1141 HydrophobicContact CB-CD2 4.04Å
1103	E	92.9	Very high	91.4	Very high	23 Å²	23	35.9 Å²	35.9	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-45	171.3	165.7	157.5	-159.7	0	0	111.4	L1099 I1101 L1106 R1107 Y1113 R1115 L1141	L1099-E1103 VanDerWaalsContact O-CB 3.22Å; L1099-E1103 WeakPolarHBondContact O-CB 3.31Å; L1099-E1103 PolarHBondContact O-N 3.39Å; I1101-E1103 VanDerWaalsContact C-N 3.3Å; I1101-E1103 PolarHBondContact O-N 3.4Å; E1103-L1106 PolarHBondContact O-N 2.91Å; E1103-R1107 WeakPolarHBondContact O-CG 3.35Å; E1103-R1107 PolarHBondContact O-N 2.83Å; E1103-R1107 IonicContact OE1-CZ 3.71Å; E1103-R1107 IonicContact OE1-NE 3.78Å; E1103-R1107 IonicContact OE1-NH2 3.39Å; E1103-R1107 PolarHBondContact OE1-NH2 3.44Å; E1103-Y1113 HydrophobicContact CB-CE2 4.37Å; E1103-Y1113 HydrophobicContact CG-CE2 3.81Å; E1103-Y1113 WeakPolarHBondContact CG-OH 3.36Å; E1103-Y1113 PolarHBondContact OE1-OH 2.95Å; E1103-R1115 VanDerWaalsContact OE2-CD 3.29Å; E1103-R1115 WeakPolarHBondContact OE2-CD 3.26Å; E1103-R1115 IonicContact OE2-CZ 2.66Å; E1103-R1115 IonicContact OE2-NE 2.73Å; E1103-R1115 IonicContact OE2-NH1 3.75Å; E1103-R1115 PolarHBondContact OE2-NH1 3.03Å; E1103-L1141 HydrophobicContact CB-CD1 3.92Å
1104	E	89.5	Confident	91.3	Very high	19 Å²	19	36.3 Å²	36.3	9%	0.089	17%	0.169	C	C	.	.	H	α-helix	trans	-66.6	-40.9	177	-157.1	64.4	-171.3	0	0	112.1	Q1050 I1065 D1100 I1101 L1106 R1107 I1108	Q1050-E1104 PolarHBondContact NE2-OE1 2.73Å; I1065-E1104 HydrophobicContact CD1-CG 3.95Å; D1100-E1104 PolarHBondContact O-N 3.2Å; I1101-E1104 PolarHBondContact O-N 2.78Å; E1104-L1106 VanDerWaalsContact C-N 3.33Å; E1104-L1106 PolarHBondContact O-N 2.85Å; E1104-R1107 WeakPolarHBondContact O-CB 3.37Å; E1104-R1107 PolarHBondContact O-N 3.03Å; E1104-R1107 VanDerWaalsContact OE2-CD 3.31Å; E1104-R1107 WeakPolarHBondContact OE2-CD 3.46Å; E1104-R1107 IonicContact OE2-CZ 3.08Å; E1104-R1107 IonicContact OE2-NE 2.88Å; E1104-R1107 IonicContact OE2-NH1 2.67Å; E1104-R1107 PolarHBondContact OE2-NH1 2.78Å; E1104-I1108 HydrophobicContact CG-CD1 4.25Å; E1104-I1108 WeakPolarHBondContact O-CD1 3.34Å; E1104-I1108 VanDerWaalsContact O-CG1 3.27Å; E1104-I1108 WeakPolarHBondContact O-CG1 3.45Å; E1104-I1108 PolarHBondContact O-N 3.3Å
1105	F	92.2	Very high	91.4	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-40.9	171.4	164.5	-109.3	0	0	0	113.2	I1066 I1072 L1075 N1076 L1079 I1101 I1108 T1109	I1066-F1105 HydrophobicContact CG1-CD2 4.14Å; I1072-F1105 HydrophobicContact CG2-CB 4.43Å; I1072-F1105 HydrophobicContact CG2-CD1 4.48Å; I1072-F1105 HydrophobicContact CG2-CD2 3.57Å; I1072-F1105 HydrophobicContact CG2-CE2 3.88Å; I1072-F1105 HydrophobicContact CG2-CG 3.9Å; I1072-F1105 HydrophobicContact CG2-CZ 4.45Å; L1075-F1105 HydrophobicContact CB-CE1 3.95Å; L1075-F1105 HydrophobicContact CB-CZ 4.05Å; N1076-F1105 HydrophobicContact CB-CE2 3.99Å; N1076-F1105 HydrophobicContact CB-CZ 4.2Å; L1079-F1105 HydrophobicContact CD2-CE1 4.14Å; I1101-F1105 PolarHBondContact O-N 3.08Å; F1105-I1108 PolarHBondContact O-N 2.8Å; F1105-T1109 HydrophobicContact CD2-CG2 4.07Å; F1105-T1109 HydrophobicContact CE2-CG2 3.61Å; F1105-T1109 HydrophobicContact CZ-CG2 4.09Å; F1105-T1109 PolarHBondContact O-N 3.15Å; F1105-T1109 PolarHBondContact O-OG1 3.34Å
1106	L	92.8	Very high	91.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-72.6	-27	177.9	-70.1	170.5	0	0	0	113	L1079 L1102 E1103 E1104 T1109 N1110 R1111 Y1113 V1139 L1141	L1079-L1106 HydrophobicContact CD2-CD2 3.59Å; L1102-L1106 WeakPolarHBondContact O-CB 3.48Å; L1102-L1106 VanDerWaalsContact O-CG 3.24Å; L1102-L1106 WeakPolarHBondContact O-CG 3.47Å; L1102-L1106 PolarHBondContact O-N 3.29Å; E1103-L1106 PolarHBondContact O-N 2.91Å; E1104-L1106 VanDerWaalsContact C-N 3.33Å; E1104-L1106 PolarHBondContact O-N 2.85Å; L1106-T1109 WeakPolarHBondContact CA-OG1 3.22Å; L1106-N1110 PolarHBondContact O-N 3.4Å; L1106-R1111 HydrophobicContact CD2-CB 4.03Å; L1106-R1111 PolarHBondContact O-N 3.45Å; L1106-Y1113 HydrophobicContact CB-CD1 3.89Å; L1106-Y1113 HydrophobicContact CB-CE1 4.43Å; L1106-Y1113 HydrophobicContact CB-CG 4.4Å; L1106-Y1113 HydrophobicContact CD1-CG 4.19Å; L1106-V1139 HydrophobicContact CD1-CB 4.32Å; L1106-V1139 HydrophobicContact CD1-CG1 3.83Å; L1106-V1139 HydrophobicContact CD2-CG2 4.28Å; L1106-L1141 HydrophobicContact CD1-CD1 4.08Å; L1106-L1141 HydrophobicContact CD1-CD2 3.82Å; L1106-L1141 HydrophobicContact CD1-CG 4Å
1107	R	91	Very high	91.4	Very high	91 Å²	91	33 Å²	33	34%	0.343	15%	0.149	S	C	.	.	H	α-helix	trans	-70.5	-47.5	169	-66	165	-174.5	-174.2	-5.6	111.5	E1103 E1104 T1109 N1110 Y1113	E1103-R1107 WeakPolarHBondContact O-CG 3.35Å; E1103-R1107 PolarHBondContact O-N 2.83Å; E1103-R1107 IonicContact OE1-CZ 3.71Å; E1103-R1107 IonicContact OE1-NE 3.78Å; E1103-R1107 IonicContact OE1-NH2 3.39Å; E1103-R1107 PolarHBondContact OE1-NH2 3.44Å; E1104-R1107 WeakPolarHBondContact O-CB 3.37Å; E1104-R1107 PolarHBondContact O-N 3.03Å; E1104-R1107 VanDerWaalsContact OE2-CD 3.31Å; E1104-R1107 WeakPolarHBondContact OE2-CD 3.46Å; E1104-R1107 IonicContact OE2-CZ 3.08Å; E1104-R1107 IonicContact OE2-NE 2.88Å; E1104-R1107 IonicContact OE2-NH1 2.67Å; E1104-R1107 PolarHBondContact OE2-NH1 2.78Å; R1107-T1109 VanDerWaalsContact C-N 3.27Å; R1107-T1109 PolarHBondContact O-N 3.45Å; R1107-N1110 WeakPolarHBondContact O-CA 3.36Å; R1107-N1110 PolarHBondContact O-N 2.84Å; R1107-Y1113 HydrophobicContact CG-CE1 4.07Å; R1107-Y1113 PolarHBondContact NE-OH 3.25Å; R1107-Y1113 VanDerWaalsContact NE-OH 3.11Å
1108	I	88.8	Confident	91.1	Very high	57 Å²	57	33.4 Å²	33.4	29%	0.292	17%	0.166	S	C	.	.	H	α-helix	trans	-59.3	-39.3	177.9	-67.1	161.6	0	0	0	111.1	P1062 I1065 I1066 E1104 F1105 N1110	P1062-I1108 HydrophobicContact CB-CD1 3.83Å; P1062-I1108 HydrophobicContact CB-CG1 3.99Å; P1062-I1108 HydrophobicContact CB-CG2 3.84Å; I1065-I1108 HydrophobicContact CB-CD1 4.38Å; I1065-I1108 HydrophobicContact CD1-CD1 4.09Å; I1066-I1108 HydrophobicContact CD1-CG2 3.96Å; E1104-I1108 HydrophobicContact CG-CD1 4.25Å; E1104-I1108 WeakPolarHBondContact O-CD1 3.34Å; E1104-I1108 VanDerWaalsContact O-CG1 3.27Å; E1104-I1108 WeakPolarHBondContact O-CG1 3.45Å; E1104-I1108 PolarHBondContact O-N 3.3Å; F1105-I1108 PolarHBondContact O-N 2.8Å; I1108-N1110 VanDerWaalsContact C-N 3.29Å; I1108-N1110 PolarHBondContact O-N 3.4Å
1109	T	88.7	Confident	90.8	Very high	40 Å²	40	38.2 Å²	38.2	25%	0.245	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.1	175.9	55.2	0	0	0	0	114.3	F1105 L1106 R1107 R1111	F1105-T1109 HydrophobicContact CD2-CG2 4.07Å; F1105-T1109 HydrophobicContact CE2-CG2 3.61Å; F1105-T1109 HydrophobicContact CZ-CG2 4.09Å; F1105-T1109 PolarHBondContact O-N 3.15Å; F1105-T1109 PolarHBondContact O-OG1 3.34Å; L1106-T1109 WeakPolarHBondContact CA-OG1 3.22Å; R1107-T1109 VanDerWaalsContact C-N 3.27Å; R1107-T1109 PolarHBondContact O-N 3.45Å; T1109-R1111 PolarHBondContact O-N 3.46Å
1110	N	88.9	Confident	90.4	Very high	92 Å²	92	39 Å²	39	49%	0.492	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	55.5	-180	-169.5	4.1	0	0	0	113.6	Y63 L1106 R1107 I1108	Y63-N1110 PolarHBondContact OH-OD1 2.8Å; L1106-N1110 PolarHBondContact O-N 3.4Å; R1107-N1110 WeakPolarHBondContact O-CA 3.36Å; R1107-N1110 PolarHBondContact O-N 2.84Å; I1108-N1110 VanDerWaalsContact C-N 3.29Å; I1108-N1110 PolarHBondContact O-N 3.4Å
1111	R	88.4	Confident	90	Very high	47 Å²	47	40.8 Å²	40.8	18%	0.177	22%	0.217	C	C	.	.			trans	-112.4	145.3	179.4	-64.7	-165.5	170.4	-73.3	-8.2	112.2	L1106 T1109 Y1113 E1138	L1106-R1111 HydrophobicContact CD2-CB 4.03Å; L1106-R1111 PolarHBondContact O-N 3.45Å; T1109-R1111 PolarHBondContact O-N 3.46Å; R1111-Y1113 WeakPolarHBondContact O-CD1 3.4Å; R1111-Y1113 PolarHBondContact O-N 3.46Å; R1111-E1138 IonicContact NH1-OE2 3.71Å; R1111-E1138 PolarHBondContact NH1-OE2 3.06Å; R1111-E1138 VanDerWaalsContact NH1-OE2 3.13Å
1112	R	91.6	Very high	89.2	Confident	113 Å²	113	45.4 Å²	45.4	43%	0.426	25%	0.245	S	C	.	.			trans	-83.2	118.3	179.6	-64.2	173.3	-60.4	132.3	13.3	110.1	S1136 E1138 V1139	R1112-S1136 VanDerWaalsContact CZ-O 3.32Å; R1112-S1136 PolarHBondContact NH1-O 2.96Å; R1112-S1136 PolarHBondContact NH1-OG 3.08Å; R1112-S1136 PolarHBondContact NH2-O 3.29Å; R1112-E1138 IonicContact CZ-OE1 3.87Å; R1112-E1138 VanDerWaalsContact CZ-OE1 3.26Å; R1112-E1138 IonicContact NE-OE1 3.07Å; R1112-E1138 PolarHBondContact NE-OE1 2.81Å; R1112-E1138 IonicContact NH2-OE1 3.87Å; R1112-E1138 PolarHBondContact NH2-OE1 2.81Å; R1112-E1138 PolarHBondContact O-N 3.32Å; R1112-V1139 PolarHBondContact O-N 3.29Å
1113	Y	94	Very high	88.6	Confident	57 Å²	57	50.3 Å²	50.3	22%	0.224	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	157.9	-178	69.2	-85.2	0	0	0	113.2	E1103 L1106 R1107 R1111 V1139 L1141	E1103-Y1113 HydrophobicContact CB-CE2 4.37Å; E1103-Y1113 HydrophobicContact CG-CE2 3.81Å; E1103-Y1113 WeakPolarHBondContact CG-OH 3.36Å; E1103-Y1113 PolarHBondContact OE1-OH 2.95Å; L1106-Y1113 HydrophobicContact CB-CD1 3.89Å; L1106-Y1113 HydrophobicContact CB-CE1 4.43Å; L1106-Y1113 HydrophobicContact CB-CG 4.4Å; L1106-Y1113 HydrophobicContact CD1-CG 4.19Å; R1107-Y1113 HydrophobicContact CG-CE1 4.07Å; R1107-Y1113 PolarHBondContact NE-OH 3.25Å; R1107-Y1113 VanDerWaalsContact NE-OH 3.11Å; R1111-Y1113 WeakPolarHBondContact O-CD1 3.4Å; R1111-Y1113 PolarHBondContact O-N 3.46Å; Y1113-V1139 CarbonylContact C-O 3.59Å; Y1113-V1139 VanDerWaalsContact CA-O 3.23Å; Y1113-V1139 WeakPolarHBondContact CA-O 3.42Å; Y1113-L1141 HydrophobicContact CD2-CD1 4.26Å
1114	I	93.2	Very high	88.2	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.051	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	149.2	161.2	-71.3	169.2	0	0	0	108.4	L1128 R1131 F1132 I1137 V1139 F1140 L1141	I1114-L1128 HydrophobicContact CG2-CB 4.16Å; I1114-L1128 HydrophobicContact CG2-CD2 4.15Å; I1114-R1131 HydrophobicContact CD1-CB 4.4Å; I1114-R1131 HydrophobicContact CD1-CG 4.1Å; I1114-F1132 HydrophobicContact CD1-CB 4.08Å; I1114-I1137 HydrophobicContact CD1-CD1 3.61Å; I1114-I1137 HydrophobicContact CD1-CG2 4.37Å; I1114-I1137 HydrophobicContact CG1-CD1 3.92Å; I1114-I1137 HydrophobicContact CG1-CG2 4.23Å; I1114-V1139 PolarHBondContact N-O 3.33Å; I1114-F1140 HydrophobicContact CB-CD2 4.12Å; I1114-F1140 HydrophobicContact CB-CE2 4.24Å; I1114-F1140 HydrophobicContact CB-CG 4.49Å; I1114-F1140 HydrophobicContact CG2-CD2 3.88Å; I1114-F1140 HydrophobicContact CG2-CE2 3.49Å; I1114-F1140 VanDerWaalsContact CG2-CE2 3.49Å; I1114-F1140 HydrophobicContact CG2-CZ 3.83Å; I1114-F1140 CarbonylContact O-C 3.56Å; I1114-F1140 WeakPolarHBondContact O-CA 3.33Å; I1114-F1140 WeakPolarHBondContact O-CD2 3.39Å; I1114-L1141 PolarHBondContact O-N 2.68Å
1115	R	93.4	Very high	87.9	Confident	52 Å²	52	53.7 Å²	53.7	20%	0.196	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.1	173.8	177	177.7	169.1	166	0.3	111	D1100 E1103 D1117 L1141	D1100-R1115 IonicContact OD1-CZ 2.84Å; D1100-R1115 IonicContact OD1-NH1 3.57Å; D1100-R1115 PolarHBondContact OD1-NH1 3.07Å; D1100-R1115 IonicContact OD1-NH2 3.81Å; D1100-R1115 PolarHBondContact OD1-NH2 3.17Å; D1100-R1115 IonicContact OD2-NH2 3.79Å; E1103-R1115 VanDerWaalsContact OE2-CD 3.29Å; E1103-R1115 WeakPolarHBondContact OE2-CD 3.26Å; E1103-R1115 IonicContact OE2-CZ 2.66Å; E1103-R1115 IonicContact OE2-NE 2.73Å; E1103-R1115 IonicContact OE2-NH1 3.75Å; E1103-R1115 PolarHBondContact OE2-NH1 3.03Å; R1115-D1117 IonicContact CZ-OD2 3.53Å; R1115-D1117 IonicContact NE-OD2 2.63Å; R1115-D1117 PolarHBondContact NE-OD2 3.45Å; R1115-D1117 IonicContact NH2-OD2 2.73Å; R1115-D1117 PolarHBondContact NH2-OD2 3.06Å; R1115-L1141 WeakPolarHBondContact CA-O 3.39Å; R1115-L1141 HydrophobicContact CB-CB 4.28Å; R1115-L1141 HydrophobicContact CG-CB 4.41Å
1116	M	90.2	Very high	87.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	123.3	167.3	177.5	179.6	61.4	0	0	110.7	T1120 R1125 I1129 F1140 L1141 L1142 S1143 I1151	M1116-T1120 HydrophobicContact CG-CG2 4.31Å; M1116-R1125 HydrophobicContact CG-CG 4.19Å; M1116-R1125 HydrophobicContact SD-CB 3.62Å; M1116-R1125 HydrophobicContact SD-CG 3.55Å; M1116-R1125 VanDerWaalsContact SD-CG 3.55Å; M1116-I1129 HydrophobicContact CE-CD1 4.4Å; M1116-I1129 HydrophobicContact CE-CG1 4.42Å; M1116-F1140 HydrophobicContact CB-CE2 3.68Å; M1116-F1140 HydrophobicContact CB-CZ 4.09Å; M1116-F1140 HydrophobicContact CE-CZ 4.28Å; M1116-L1141 PolarHBondContact N-O 3.07Å; M1116-L1142 HydrophobicContact CB-CD2 4.06Å; M1116-L1142 HydrophobicContact CE-CD2 3.48Å; M1116-L1142 VanDerWaalsContact CE-CD2 3.48Å; M1116-S1143 PolarHBondContact O-N 3Å; M1116-I1151 HydrophobicContact CE-CD1 3.91Å
1117	D	90.7	Very high	87.2	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.027	34%	0.336	C	S	.	.			trans	-133.8	-163.8	178.5	70.5	48.1	0	0	0	112.5	V1096 L1099 R1115 S1119 T1120	V1096-D1117 HydrophobicContact CG1-CB 4.49Å; V1096-D1117 HydrophobicContact CG2-CB 4.48Å; L1099-D1117 HydrophobicContact CD1-CB 4.24Å; R1115-D1117 IonicContact CZ-OD2 3.53Å; R1115-D1117 IonicContact NE-OD2 2.63Å; R1115-D1117 PolarHBondContact NE-OD2 3.45Å; R1115-D1117 IonicContact NH2-OD2 2.73Å; R1115-D1117 PolarHBondContact NH2-OD2 3.06Å; D1117-S1119 PolarHBondContact O-N 3.48Å; D1117-S1119 WeakPolarHBondContact OD1-CB 3.41Å; D1117-S1119 PolarHBondContact OD1-N 3.01Å; D1117-S1119 PolarHBondContact OD1-OG 2.98Å; D1117-T1120 PolarHBondContact N-OG1 3.19Å; D1117-T1120 VanDerWaalsContact N-OG1 3.14Å
1118	G	84.3	Confident	87.1	Confident	60 Å²	60	58.1 Å²	58.1	62%	0.619	33%	0.325	S	S	*	.	S	Bend	trans	-66	-23	-178.5	0	0	0	0	0	114.5	R1125	G1118-R1125 PolarHBondContact O-NH2 3.23Å
1119	S	86	Confident	87	Confident	100 Å²	100	55.7 Å²	55.7	70%	0.699	31%	0.313	S	S	*	.	S	Bend	trans	-84.6	-29.8	-177.4	67.7	0	0	0	0	113.7	D1117	D1117-S1119 PolarHBondContact O-N 3.48Å; D1117-S1119 WeakPolarHBondContact OD1-CB 3.41Å; D1117-S1119 PolarHBondContact OD1-N 3.01Å; D1117-S1119 PolarHBondContact OD1-OG 2.98Å
1120	T	85.7	Confident	86.9	Confident	16 Å²	16	57.5 Å²	57.5	10%	0.098	32%	0.321	C	S	.	.	S	Bend	trans	-52.6	123.3	-179.6	-48.5	0	0	0	0	111.1	M1116 D1117 E1124 R1125 L1128	M1116-T1120 HydrophobicContact CG-CG2 4.31Å; D1117-T1120 PolarHBondContact N-OG1 3.19Å; D1117-T1120 VanDerWaalsContact N-OG1 3.14Å; T1120-E1124 HydrophobicContact CG2-CB 4.45Å; T1120-R1125 HydrophobicContact CG2-CG 3.93Å; T1120-R1125 PolarHBondContact O-NE 2.96Å; T1120-R1125 PolarHBondContact O-NH2 3.38Å; T1120-L1128 HydrophobicContact CG2-CD1 3.79Å
1121	P	82.3	Confident	87	Confident	70 Å²	70	59.3 Å²	59.3	46%	0.455	32%	0.321	S	S	.	.			trans	-56.8	139.1	179.3	-27.2	35.2	0	0	0	113	S1123 E1124 R1125	P1121-S1123 PolarHBondContact O-N 2.78Å; P1121-S1123 VanDerWaalsContact O-N 3.16Å; P1121-E1124 HydrophobicContact CB-CB 4.48Å; P1121-E1124 WeakPolarHBondContact CD-OE2 3.33Å; P1121-E1124 PolarHBondContact O-N 3.09Å; P1121-R1125 WeakPolarHBondContact O-CG 3.49Å; P1121-R1125 PolarHBondContact O-N 3.2Å
1122	V	76.1	Confident	87.1	Confident	99 Å²	99	57 Å²	57	60%	0.6	31%	0.312	S	S	*	.	H	α-helix	trans	-57.6	-35.6	-174.6	-179.9	0	0	0	0	112.5	E1124 R1125	V1122-E1124 VanDerWaalsContact C-N 3.28Å; V1122-E1124 PolarHBondContact O-N 3.2Å; V1122-R1125 PolarHBondContact O-N 2.97Å
1123	S	79.3	Confident	86.9	Confident	104 Å²	104	53.4 Å²	53.4	73%	0.727	30%	0.302	S	S	*	.	H	α-helix	trans	-64.3	-26.6	176	50	0	0	0	0	114.4	P1121	P1121-S1123 PolarHBondContact O-N 2.78Å; P1121-S1123 VanDerWaalsContact O-N 3.16Å
1124	E	84.6	Confident	86.5	Confident	67 Å²	67	55.6 Å²	55.6	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-89.1	-28	-178.9	-173.8	175.8	-163	0	0	112	T1120 P1121 V1122 Q1126 T1127 L1128	T1120-E1124 HydrophobicContact CG2-CB 4.45Å; P1121-E1124 HydrophobicContact CB-CB 4.48Å; P1121-E1124 WeakPolarHBondContact CD-OE2 3.33Å; P1121-E1124 PolarHBondContact O-N 3.09Å; V1122-E1124 VanDerWaalsContact C-N 3.28Å; V1122-E1124 PolarHBondContact O-N 3.2Å; E1124-Q1126 VanDerWaalsContact C-N 3.32Å; E1124-Q1126 PolarHBondContact O-N 3.45Å; E1124-T1127 WeakPolarHBondContact O-CB 3.34Å; E1124-T1127 PolarHBondContact O-N 3.05Å; E1124-T1127 VanDerWaalsContact O-N 3.07Å; E1124-L1128 HydrophobicContact CG-CD1 4.19Å; E1124-L1128 HydrophobicContact CG-CG 4.12Å; E1124-L1128 PolarHBondContact O-N 3.02Å
1125	R	84	Confident	85.8	Confident	46 Å²	46	56.6 Å²	56.6	17%	0.174	33%	0.333	C	S	.	.	H	α-helix	trans	-55.1	-43.9	-176.2	-64.6	-178.3	-167.9	-171.1	-2.8	112.9	M1116 G1118 T1120 P1121 V1122 L1128 I1129	M1116-R1125 HydrophobicContact CG-CG 4.19Å; M1116-R1125 HydrophobicContact SD-CB 3.62Å; M1116-R1125 HydrophobicContact SD-CG 3.55Å; M1116-R1125 VanDerWaalsContact SD-CG 3.55Å; G1118-R1125 PolarHBondContact O-NH2 3.23Å; T1120-R1125 HydrophobicContact CG2-CG 3.93Å; T1120-R1125 PolarHBondContact O-NE 2.96Å; T1120-R1125 PolarHBondContact O-NH2 3.38Å; P1121-R1125 WeakPolarHBondContact O-CG 3.49Å; P1121-R1125 PolarHBondContact O-N 3.2Å; V1122-R1125 PolarHBondContact O-N 2.97Å; R1125-L1128 PolarHBondContact O-N 2.96Å; R1125-I1129 WeakPolarHBondContact O-CD1 3.5Å; R1125-I1129 WeakPolarHBondContact O-CG1 3.49Å; R1125-I1129 PolarHBondContact O-N 3.47Å
1126	Q	82.1	Confident	85.4	Confident	69 Å²	69	58.2 Å²	58.2	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-45.9	178.2	-174.7	61.5	80.2	0	0	110.6	E1124 L1128 I1129 D1130	E1124-Q1126 VanDerWaalsContact C-N 3.32Å; E1124-Q1126 PolarHBondContact O-N 3.45Å; Q1126-L1128 VanDerWaalsContact C-N 3.33Å; Q1126-L1128 PolarHBondContact O-N 2.7Å; Q1126-I1129 WeakPolarHBondContact O-CB 3.45Å; Q1126-I1129 PolarHBondContact O-N 2.68Å; Q1126-I1129 VanDerWaalsContact O-N 3.14Å; Q1126-D1130 WeakPolarHBondContact CG-OD2 3.42Å; Q1126-D1130 PolarHBondContact NE2-OD1 3.36Å; Q1126-D1130 PolarHBondContact NE2-OD2 2.9Å; Q1126-D1130 VanDerWaalsContact O-CG 3.27Å; Q1126-D1130 PolarHBondContact O-N 3.33Å; Q1126-D1130 VanDerWaalsContact O-OD2 3.08Å
1127	T	87.9	Confident	85.4	Confident	93 Å²	93	58.9 Å²	58.9	57%	0.571	36%	0.356	S	S	*	.	H	α-helix	trans	-58.2	-40.4	175.6	-43.8	0	0	0	0	112.9	E1124 R1131	E1124-T1127 WeakPolarHBondContact O-CB 3.34Å; E1124-T1127 PolarHBondContact O-N 3.05Å; E1124-T1127 VanDerWaalsContact O-N 3.07Å; T1127-R1131 WeakPolarHBondContact O-CB 3.42Å; T1127-R1131 PolarHBondContact O-N 2.89Å
1128	L	89.1	Confident	85.4	Confident	24 Å²	24	60 Å²	60	13%	0.126	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-39.1	176.1	-64.5	176.9	0	0	0	112.5	I1114 T1120 E1124 R1125 Q1126 F1132	I1114-L1128 HydrophobicContact CG2-CB 4.16Å; I1114-L1128 HydrophobicContact CG2-CD2 4.15Å; T1120-L1128 HydrophobicContact CG2-CD1 3.79Å; E1124-L1128 HydrophobicContact CG-CD1 4.19Å; E1124-L1128 HydrophobicContact CG-CG 4.12Å; E1124-L1128 PolarHBondContact O-N 3.02Å; R1125-L1128 PolarHBondContact O-N 2.96Å; Q1126-L1128 VanDerWaalsContact C-N 3.33Å; Q1126-L1128 PolarHBondContact O-N 2.7Å; L1128-F1132 WeakPolarHBondContact O-CB 3.5Å; L1128-F1132 PolarHBondContact O-N 2.79Å
1129	I	86.9	Confident	85.9	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-46.1	176	-69.6	157.5	0	0	0	110.6	M1116 R1125 Q1126 F1132 N1133 I1151 N1152 L1153	M1116-I1129 HydrophobicContact CE-CD1 4.4Å; M1116-I1129 HydrophobicContact CE-CG1 4.42Å; R1125-I1129 WeakPolarHBondContact O-CD1 3.5Å; R1125-I1129 WeakPolarHBondContact O-CG1 3.49Å; R1125-I1129 PolarHBondContact O-N 3.47Å; Q1126-I1129 WeakPolarHBondContact O-CB 3.45Å; Q1126-I1129 PolarHBondContact O-N 2.68Å; Q1126-I1129 VanDerWaalsContact O-N 3.14Å; I1129-F1132 PolarHBondContact O-N 3.3Å; I1129-N1133 WeakPolarHBondContact CG2-ND2 3.41Å; I1129-N1133 PolarHBondContact O-N 2.88Å; I1129-N1133 PolarHBondContact O-ND2 3.44Å; I1129-I1151 HydrophobicContact CD1-CB 3.76Å; I1129-I1151 HydrophobicContact CD1-CG2 3.44Å; I1129-I1151 VanDerWaalsContact CD1-CG2 3.44Å; I1129-N1152 WeakPolarHBondContact CG2-O 3.25Å; I1129-L1153 HydrophobicContact CG1-CD2 4.35Å; I1129-L1153 HydrophobicContact CG2-CD2 4.26Å
1130	D	87.4	Confident	86.3	Confident	78 Å²	78	52.3 Å²	52.3	42%	0.417	30%	0.298	S	S	.	.	H	α-helix	trans	-68.5	-40.9	-179.1	-62.6	-32.9	0	0	0	110.7	Q1126 F1132 N1133 S1134	Q1126-D1130 WeakPolarHBondContact CG-OD2 3.42Å; Q1126-D1130 PolarHBondContact NE2-OD1 3.36Å; Q1126-D1130 PolarHBondContact NE2-OD2 2.9Å; Q1126-D1130 VanDerWaalsContact O-CG 3.27Å; Q1126-D1130 PolarHBondContact O-N 3.33Å; Q1126-D1130 VanDerWaalsContact O-OD2 3.08Å; D1130-F1132 PolarHBondContact O-N 3.13Å; D1130-N1133 PolarHBondContact O-N 3.24Å; D1130-S1134 WeakPolarHBondContact O-CB 3.5Å; D1130-S1134 PolarHBondContact O-N 3.05Å; D1130-S1134 PolarHBondContact O-OG 2.95Å; D1130-S1134 VanDerWaalsContact O-OG 3.05Å
1131	R	90.5	Very high	86.8	Confident	129 Å²	129	51.6 Å²	51.6	49%	0.487	29%	0.293	S	S	.	.	H	α-helix	trans	-57.7	-43.6	170.4	-175.7	179.4	-178.8	177.4	1.7	112.2	I1114 T1127 S1135 I1137	I1114-R1131 HydrophobicContact CD1-CB 4.4Å; I1114-R1131 HydrophobicContact CD1-CG 4.1Å; T1127-R1131 WeakPolarHBondContact O-CB 3.42Å; T1127-R1131 PolarHBondContact O-N 2.89Å; R1131-S1135 WeakPolarHBondContact O-CB 3.1Å; R1131-S1135 PolarHBondContact O-N 2.91Å; R1131-S1135 PolarHBondContact O-OG 3.39Å; R1131-I1137 HydrophobicContact CG-CD1 4.46Å
1132	F	90.9	Very high	87.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67	-39.8	177.6	179.8	-101	0	0	0	112.4	R1088 L1090 I1114 L1128 I1129 D1130 I1137 F1140 L1153 A1156	R1088-F1132 HydrophobicContact CB-CZ 4.25Å; R1088-F1132 PolarHBondContact NH1-O 2.9Å; L1090-F1132 HydrophobicContact CD2-CE1 3.87Å; L1090-F1132 HydrophobicContact CD2-CZ 3.96Å; I1114-F1132 HydrophobicContact CD1-CB 4.08Å; L1128-F1132 WeakPolarHBondContact O-CB 3.5Å; L1128-F1132 PolarHBondContact O-N 2.79Å; I1129-F1132 PolarHBondContact O-N 3.3Å; D1130-F1132 PolarHBondContact O-N 3.13Å; F1132-I1137 HydrophobicContact CD2-CB 4.5Å; F1132-I1137 HydrophobicContact CD2-CG2 4.29Å; F1132-F1140 HydrophobicContact CB-CD1 3.78Å; F1132-F1140 HydrophobicContact CB-CE1 3.81Å; F1132-F1140 AromaticContact CD1-CD1 3.69Å; F1132-F1140 HydrophobicContact CD1-CD1 3.69Å; F1132-F1140 HydrophobicContact CD1-CE1 4.3Å; F1132-F1140 HydrophobicContact CD2-CB 4.01Å; F1132-F1140 AromaticContact CD2-CD1 3.8Å; F1132-F1140 HydrophobicContact CD2-CD1 3.8Å; F1132-F1140 HydrophobicContact CD2-CG 4.23Å; F1132-F1140 HydrophobicContact CE1-CD1 4.22Å; F1132-F1140 HydrophobicContact CE2-CB 3.86Å; F1132-F1140 HydrophobicContact CE2-CD1 4.33Å; F1132-F1140 HydrophobicContact CG-CB 4.47Å; F1132-F1140 AromaticContact CG-CD1 3.44Å; F1132-F1140 HydrophobicContact CG-CD1 3.44Å; F1132-F1140 VanDerWaalsContact CG-CD1 3.44Å; F1132-F1140 HydrophobicContact CG-CE1 4.01Å; F1132-F1140 HydrophobicContact CG-CG 4.32Å; F1132-F1140 HydrophobicContact CZ-CB 4.17Å; F1132-L1153 HydrophobicContact CD1-CD2 4.22Å; F1132-A1156 HydrophobicContact CE1-CB 3.83Å; F1132-A1156 HydrophobicContact CZ-CB 3.96Å
1133	N	87	Confident	88	Confident	37 Å²	37	44 Å²	44	20%	0.198	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-37.6	178.4	-72.1	-51.5	0	0	0	112.4	R1088 I1129 D1130 N1152 G1155	R1088-N1133 PolarHBondContact NH1-O 3.12Å; I1129-N1133 WeakPolarHBondContact CG2-ND2 3.41Å; I1129-N1133 PolarHBondContact O-N 2.88Å; I1129-N1133 PolarHBondContact O-ND2 3.44Å; D1130-N1133 PolarHBondContact O-N 3.24Å; N1133-N1152 PolarHBondContact ND2-O 2.9Å; N1133-G1155 PolarHBondContact OD1-N 2.98Å
1134	S	85.3	Confident	88.4	Confident	102 Å²	102	39.1 Å²	39.1	71%	0.713	21%	0.212	S	C	*	.	H	α-helix	trans	-86.3	-26.7	-177.3	67.8	0	0	0	0	115.2	D1130	D1130-S1134 WeakPolarHBondContact O-CB 3.5Å; D1130-S1134 PolarHBondContact O-N 3.05Å; D1130-S1134 PolarHBondContact O-OG 2.95Å; D1130-S1134 VanDerWaalsContact O-OG 3.05Å
1135	S	78.9	Confident	88.1	Confident	32 Å²	32	44.3 Å²	44.3	22%	0.224	23%	0.229	C	C	.	.	S	Bend	trans	-99.4	166.4	-174.6	72.5	0	0	0	0	114.3	R1088 R1131 I1137	R1088-S1135 PolarHBondContact NH1-O 3.26Å; R1131-S1135 WeakPolarHBondContact O-CB 3.1Å; R1131-S1135 PolarHBondContact O-N 2.91Å; R1131-S1135 PolarHBondContact O-OG 3.39Å; S1135-I1137 PolarHBondContact O-N 2.85Å; S1135-I1137 WeakPolarHBondContact OG-CD1 3.34Å; S1135-I1137 WeakPolarHBondContact OG-CG1 3.43Å
1136	S	85	Confident	87.6	Confident	85 Å²	85	42.3 Å²	42.3	59%	0.594	22%	0.222	S	C	*	.			trans	-80.5	23	177.2	61.1	0	0	0	0	114.3	R1112	R1112-S1136 VanDerWaalsContact CZ-O 3.32Å; R1112-S1136 PolarHBondContact NH1-O 2.96Å; R1112-S1136 PolarHBondContact NH1-OG 3.08Å; R1112-S1136 PolarHBondContact NH2-O 3.29Å
1137	I	89.4	Confident	86.9	Confident	15 Å²	15	39 Å²	39	8%	0.077	21%	0.207	C	C	.	.			trans	-71	133.6	-177.5	-71.1	172.4	0	0	0	110.6	R1088 I1114 R1131 F1132 S1135	R1088-I1137 WeakPolarHBondContact CD-O 3.32Å; I1114-I1137 HydrophobicContact CD1-CD1 3.61Å; I1114-I1137 HydrophobicContact CD1-CG2 4.37Å; I1114-I1137 HydrophobicContact CG1-CD1 3.92Å; I1114-I1137 HydrophobicContact CG1-CG2 4.23Å; R1131-I1137 HydrophobicContact CG-CD1 4.46Å; F1132-I1137 HydrophobicContact CD2-CB 4.5Å; F1132-I1137 HydrophobicContact CD2-CG2 4.29Å; S1135-I1137 PolarHBondContact O-N 2.85Å; S1135-I1137 WeakPolarHBondContact OG-CD1 3.34Å; S1135-I1137 WeakPolarHBondContact OG-CG1 3.43Å
1138	E	91.7	Very high	85.7	Confident	27 Å²	27	35.2 Å²	35.2	13%	0.126	19%	0.186	C	C	.	.			trans	-78.1	-44.8	-169.5	-66.6	144.4	-119.1	0	0	112.6	V1083 I1089 R1111 R1112	V1083-E1138 HydrophobicContact CG1-CG 3.86Å; V1083-E1138 HydrophobicContact CG2-CB 4.2Å; V1083-E1138 HydrophobicContact CG2-CG 4.32Å; I1089-E1138 PolarHBondContact N-O 3.41Å; R1111-E1138 IonicContact NH1-OE2 3.71Å; R1111-E1138 PolarHBondContact NH1-OE2 3.06Å; R1111-E1138 VanDerWaalsContact NH1-OE2 3.13Å; R1112-E1138 IonicContact CZ-OE1 3.87Å; R1112-E1138 VanDerWaalsContact CZ-OE1 3.26Å; R1112-E1138 IonicContact NE-OE1 3.07Å; R1112-E1138 PolarHBondContact NE-OE1 2.81Å; R1112-E1138 IonicContact NH2-OE1 3.87Å; R1112-E1138 PolarHBondContact NH2-OE1 2.81Å; R1112-E1138 PolarHBondContact O-N 3.32Å
1139	V	94.4	Very high	84.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138	-167.6	-174.3	0	0	0	0	112.5	L1079 I1089 I1091 L1106 R1112 Y1113 I1114 L1141	L1079-V1139 HydrophobicContact CD1-CG2 4.27Å; I1089-V1139 CarbonylContact O-C 3.57Å; I1089-V1139 WeakPolarHBondContact O-CA 3.15Å; I1091-V1139 HydrophobicContact CD1-CG1 3.69Å; I1091-V1139 HydrophobicContact CG1-CG1 3.99Å; L1106-V1139 HydrophobicContact CD1-CB 4.32Å; L1106-V1139 HydrophobicContact CD1-CG1 3.83Å; L1106-V1139 HydrophobicContact CD2-CG2 4.28Å; R1112-V1139 PolarHBondContact O-N 3.29Å; Y1113-V1139 CarbonylContact C-O 3.59Å; Y1113-V1139 VanDerWaalsContact CA-O 3.23Å; Y1113-V1139 WeakPolarHBondContact CA-O 3.42Å; I1114-V1139 PolarHBondContact N-O 3.33Å; V1139-L1141 HydrophobicContact CG1-CD2 4.33Å
1140	F	94.6	Very high	83.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	107.4	170.1	-156.9	159.4	0	0	0	110.5	I1089 L1090 I1091 I1114 M1116 F1132 L1142 L1153	I1089-F1140 PolarHBondContact O-N 2.78Å; L1090-F1140 HydrophobicContact CD2-CB 3.72Å; L1090-F1140 HydrophobicContact CD2-CD1 4.29Å; L1090-F1140 HydrophobicContact CD2-CG 4.37Å; I1091-F1140 PolarHBondContact N-O 2.89Å; I1114-F1140 HydrophobicContact CB-CD2 4.12Å; I1114-F1140 HydrophobicContact CB-CE2 4.24Å; I1114-F1140 HydrophobicContact CB-CG 4.49Å; I1114-F1140 HydrophobicContact CG2-CD2 3.88Å; I1114-F1140 HydrophobicContact CG2-CE2 3.49Å; I1114-F1140 VanDerWaalsContact CG2-CE2 3.49Å; I1114-F1140 HydrophobicContact CG2-CZ 3.83Å; I1114-F1140 CarbonylContact O-C 3.56Å; I1114-F1140 WeakPolarHBondContact O-CA 3.33Å; I1114-F1140 WeakPolarHBondContact O-CD2 3.39Å; M1116-F1140 HydrophobicContact CB-CE2 3.68Å; M1116-F1140 HydrophobicContact CB-CZ 4.09Å; M1116-F1140 HydrophobicContact CE-CZ 4.28Å; F1132-F1140 HydrophobicContact CB-CD1 3.78Å; F1132-F1140 HydrophobicContact CB-CE1 3.81Å; F1132-F1140 AromaticContact CD1-CD1 3.69Å; F1132-F1140 HydrophobicContact CD1-CD1 3.69Å; F1132-F1140 HydrophobicContact CD1-CE1 4.3Å; F1132-F1140 HydrophobicContact CD2-CB 4.01Å; F1132-F1140 AromaticContact CD2-CD1 3.8Å; F1132-F1140 HydrophobicContact CD2-CD1 3.8Å; F1132-F1140 HydrophobicContact CD2-CG 4.23Å; F1132-F1140 HydrophobicContact CE1-CD1 4.22Å; F1132-F1140 HydrophobicContact CE2-CB 3.86Å; F1132-F1140 HydrophobicContact CE2-CD1 4.33Å; F1132-F1140 HydrophobicContact CG-CB 4.47Å; F1132-F1140 AromaticContact CG-CD1 3.44Å; F1132-F1140 HydrophobicContact CG-CD1 3.44Å; F1132-F1140 VanDerWaalsContact CG-CD1 3.44Å; F1132-F1140 HydrophobicContact CG-CE1 4.01Å; F1132-F1140 HydrophobicContact CG-CG 4.32Å; F1132-F1140 HydrophobicContact CZ-CB 4.17Å; F1140-L1142 HydrophobicContact CB-CD1 4.43Å; F1140-L1142 HydrophobicContact CD1-CD1 4.41Å; F1140-L1142 HydrophobicContact CD2-CD1 4.25Å; F1140-L1142 HydrophobicContact CD2-CD2 3.79Å; F1140-L1142 HydrophobicContact CD2-CG 3.71Å; F1140-L1142 HydrophobicContact CE2-CD2 3.55Å; F1140-L1142 HydrophobicContact CE2-CG 4.03Å; F1140-L1142 HydrophobicContact CG-CD1 4.11Å; F1140-L1142 HydrophobicContact CG-CD2 4.38Å; F1140-L1142 HydrophobicContact CG-CG 4.08Å; F1140-L1142 HydrophobicContact CZ-CD2 3.95Å; F1140-L1153 HydrophobicContact CD1-CD2 3.9Å; F1140-L1153 HydrophobicContact CE1-CD2 3.64Å
1141	L	95	Very high	82.9	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.7	170.7	-63.4	-174.5	0	0	0	110.6	I1091 L1099 L1102 E1103 L1106 Y1113 I1114 R1115 M1116 V1139	I1091-L1141 HydrophobicContact CB-CD2 4.03Å; I1091-L1141 HydrophobicContact CD1-CD2 4.22Å; I1091-L1141 HydrophobicContact CG2-CD2 4.49Å; L1099-L1141 HydrophobicContact CD2-CB 4.4Å; L1102-L1141 HydrophobicContact CB-CD1 4.34Å; L1102-L1141 HydrophobicContact CB-CD2 4.04Å; E1103-L1141 HydrophobicContact CB-CD1 3.92Å; L1106-L1141 HydrophobicContact CD1-CD1 4.08Å; L1106-L1141 HydrophobicContact CD1-CD2 3.82Å; L1106-L1141 HydrophobicContact CD1-CG 4Å; Y1113-L1141 HydrophobicContact CD2-CD1 4.26Å; I1114-L1141 PolarHBondContact O-N 2.68Å; R1115-L1141 WeakPolarHBondContact CA-O 3.39Å; R1115-L1141 HydrophobicContact CB-CB 4.28Å; R1115-L1141 HydrophobicContact CG-CB 4.41Å; M1116-L1141 PolarHBondContact N-O 3.07Å; V1139-L1141 HydrophobicContact CG1-CD2 4.33Å
1142	L	93.3	Very high	82.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.3	-174.5	-72.1	163.4	0	0	0	110.9	L1090 I1091 F1092 S1093 M1116 F1140 L1153	L1090-L1142 HydrophobicContact CB-CD1 4.33Å; L1090-L1142 HydrophobicContact CD1-CD1 4.39Å; L1090-L1142 HydrophobicContact CD2-CD1 4.05Å; L1090-L1142 HydrophobicContact CG-CD1 4.49Å; I1091-L1142 PolarHBondContact O-N 2.93Å; F1092-L1142 WeakPolarHBondContact CA-O 3.44Å; F1092-L1142 HydrophobicContact CD1-CB 3.48Å; F1092-L1142 VanDerWaalsContact CD1-CB 3.48Å; F1092-L1142 HydrophobicContact CD1-CD1 4.32Å; F1092-L1142 HydrophobicContact CE1-CB 3.4Å; F1092-L1142 VanDerWaalsContact CE1-CB 3.4Å; F1092-L1142 HydrophobicContact CE1-CD1 3.48Å; F1092-L1142 VanDerWaalsContact CE1-CD1 3.48Å; F1092-L1142 HydrophobicContact CE1-CG 4.02Å; F1092-L1142 HydrophobicContact CG-CB 4.49Å; F1092-L1142 HydrophobicContact CZ-CB 4.38Å; F1092-L1142 HydrophobicContact CZ-CD1 3.67Å; S1093-L1142 PolarHBondContact N-O 3.45Å; S1093-L1142 VanDerWaalsContact N-O 3.13Å; M1116-L1142 HydrophobicContact CB-CD2 4.06Å; M1116-L1142 HydrophobicContact CE-CD2 3.48Å; M1116-L1142 VanDerWaalsContact CE-CD2 3.48Å; F1140-L1142 HydrophobicContact CB-CD1 4.43Å; F1140-L1142 HydrophobicContact CD1-CD1 4.41Å; F1140-L1142 HydrophobicContact CD2-CD1 4.25Å; F1140-L1142 HydrophobicContact CD2-CD2 3.79Å; F1140-L1142 HydrophobicContact CD2-CG 3.71Å; F1140-L1142 HydrophobicContact CE2-CD2 3.55Å; F1140-L1142 HydrophobicContact CE2-CG 4.03Å; F1140-L1142 HydrophobicContact CG-CD1 4.11Å; F1140-L1142 HydrophobicContact CG-CD2 4.38Å; F1140-L1142 HydrophobicContact CG-CG 4.08Å; F1140-L1142 HydrophobicContact CZ-CD2 3.95Å; L1142-L1153 HydrophobicContact CD1-CD1 3.54Å
1143	S	91.8	Very high	82.3	Confident	9 Å²	9	30.2 Å²	30.2	6%	0.063	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.5	162	-179.1	0	0	0	0	108.7	S1093 M1116 R1145 A1146 G1147	S1093-S1143 WeakPolarHBondContact O-CA 3.43Å; M1116-S1143 PolarHBondContact O-N 3Å; S1143-R1145 PolarHBondContact O-N 3.12Å; S1143-A1146 CarbonylContact O-C 3.57Å; S1143-A1146 WeakPolarHBondContact O-CA 3.4Å; S1143-A1146 WeakPolarHBondContact O-CB 3.41Å; S1143-A1146 PolarHBondContact O-N 3.09Å; S1143-G1147 PolarHBondContact O-N 3.35Å
1144	T	85.9	Confident	82.2	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-53.8	-31.8	-177.2	-41.9	0	0	0	0	112.5	S1093 Q1094 G1148 A1174	S1093-T1144 PolarHBondContact O-N 2.84Å; S1093-T1144 PolarHBondContact O-OG1 2.6Å; Q1094-T1144 PolarHBondContact NE2-OG1 3.07Å; T1144-G1148 PolarHBondContact O-N 2.9Å; T1144-A1174 HydrophobicContact CG2-CB 4.07Å
1145	R	78.7	Confident	82.2	Confident	175 Å²	175	25.5 Å²	25.5	66%	0.66	15%	0.145	S	C	*	.	H	α-helix	trans	-79.8	-20.4	177.2	-61.9	-177.7	-177.2	179.9	1.5	114.6	S1143	S1143-R1145 PolarHBondContact O-N 3.12Å
1146	A	74.8	Confident	82.9	Confident	4 Å²	4	24 Å²	24	3%	0.033	14%	0.135	C	C	.	.	H	α-helix	trans	-85.2	-35.4	169.3	0	0	0	0	0	111.2	S1143 L1149	S1143-A1146 CarbonylContact O-C 3.57Å; S1143-A1146 WeakPolarHBondContact O-CA 3.4Å; S1143-A1146 WeakPolarHBondContact O-CB 3.41Å; S1143-A1146 PolarHBondContact O-N 3.09Å; A1146-L1149 WeakPolarHBondContact O-CB 3.39Å; A1146-L1149 WeakPolarHBondContact O-CD1 3.1Å; A1146-L1149 WeakPolarHBondContact O-CG 3.32Å; A1146-L1149 PolarHBondContact O-N 3.22Å
1147	G	65.9	Low	83.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.2	-35.6	170.2	0	0	0	0	0	113.8	S1143 L1149 R1177	S1143-G1147 PolarHBondContact O-N 3.35Å; G1147-L1149 PolarHBondContact O-N 2.94Å; G1147-L1149 VanDerWaalsContact O-O 3.14Å; G1147-R1177 WeakPolarHBondContact O-CG 3.33Å; G1147-R1177 PolarHBondContact O-NE 3.38Å
1148	G	63.2	Low	83.5	Confident	14 Å²	14	19.5 Å²	19.5	14%	0.144	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-9.8	176.2	0	0	0	0	0	115	T1144 Q1173 R1177	T1144-G1148 PolarHBondContact O-N 2.9Å; G1148-Q1173 PolarHBondContact O-OE1 2.91Å; G1148-R1177 PolarHBondContact O-NH2 2.83Å
1149	L	64.3	Low	83.7	Confident	39 Å²	39	18.2 Å²	18.2	20%	0.204	10%	0.098	C	C	.	.	S	Bend	trans	-69.5	169.5	171.9	-48.4	175.6	0	0	0	110.8	S692 A1146 G1147 I1151 R1177	S692-L1149 VanDerWaalsContact CB-CD2 3.41Å; A1146-L1149 WeakPolarHBondContact O-CB 3.39Å; A1146-L1149 WeakPolarHBondContact O-CD1 3.1Å; A1146-L1149 WeakPolarHBondContact O-CG 3.32Å; A1146-L1149 PolarHBondContact O-N 3.22Å; G1147-L1149 PolarHBondContact O-N 2.94Å; G1147-L1149 VanDerWaalsContact O-O 3.14Å; L1149-I1151 HydrophobicContact CB-CG2 4.36Å; L1149-I1151 PolarHBondContact O-N 3.41Å; L1149-R1177 PolarHBondContact O-NE 3.15Å; L1149-R1177 PolarHBondContact O-NH2 3.02Å; L1149-R1177 VanDerWaalsContact O-NH2 3.11Å
1150	G	62.9	Low	83.7	Confident	25 Å²	25	18.2 Å²	18.2	26%	0.258	10%	0.098	S	C	.	.	S	Bend	trans	-71.9	37.2	-166.8	0	0	0	0	0	117.5
1151	I	78	Confident	83.7	Confident	18 Å²	18	18.3 Å²	18.3	9%	0.092	10%	0.099	C	C	.	.			trans	-84.5	164.8	-165	67.5	-179.9	0	0	0	114.1	M1116 I1129 L1149 L1153 R1177 R1180	M1116-I1151 HydrophobicContact CE-CD1 3.91Å; I1129-I1151 HydrophobicContact CD1-CB 3.76Å; I1129-I1151 HydrophobicContact CD1-CG2 3.44Å; I1129-I1151 VanDerWaalsContact CD1-CG2 3.44Å; L1149-I1151 HydrophobicContact CB-CG2 4.36Å; L1149-I1151 PolarHBondContact O-N 3.41Å; I1151-L1153 HydrophobicContact CD1-CD1 3.55Å; I1151-L1153 HydrophobicContact CD1-CG 3.93Å; I1151-L1153 HydrophobicContact CG1-CD1 4.23Å; I1151-L1153 HydrophobicContact CG1-CG 4.19Å; I1151-R1177 HydrophobicContact CG1-CB 4.16Å; I1151-R1177 HydrophobicContact CG1-CG 3.9Å; I1151-R1180 PolarHBondContact O-NH1 3.29Å
1152	N	82.7	Confident	83.7	Confident	50 Å²	50	18.3 Å²	18.3	27%	0.267	10%	0.099	S	C	.	.			trans	-120.2	111.4	176.3	-175	65.3	0	0	0	110.2	I1129 N1133 T1154 R1180	I1129-N1152 WeakPolarHBondContact CG2-O 3.25Å; N1133-N1152 PolarHBondContact ND2-O 2.9Å; N1152-T1154 PolarHBondContact ND2-OG1 3.39Å; N1152-T1154 WeakPolarHBondContact OD1-CG2 3.32Å; N1152-R1180 VanDerWaalsContact OD1-CD 3.26Å; N1152-R1180 WeakPolarHBondContact OD1-CD 3.03Å; N1152-R1180 PolarHBondContact OD1-NE 2.97Å; N1152-R1180 PolarHBondContact OD1-NH2 3.1Å
1153	L	84.8	Confident	83.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.099	C	C	.	.			trans	-122	41.8	-177.7	-63.9	177.1	0	0	0	111.3	L1090 I1129 F1132 F1140 L1142 I1151 G1155 A1156 R1177	L1090-L1153 HydrophobicContact CD1-CB 4.03Å; L1090-L1153 HydrophobicContact CD1-CD1 3.71Å; L1090-L1153 HydrophobicContact CD2-CB 4.5Å; L1090-L1153 HydrophobicContact CD2-CD1 4.07Å; I1129-L1153 HydrophobicContact CG1-CD2 4.35Å; I1129-L1153 HydrophobicContact CG2-CD2 4.26Å; F1132-L1153 HydrophobicContact CD1-CD2 4.22Å; F1140-L1153 HydrophobicContact CD1-CD2 3.9Å; F1140-L1153 HydrophobicContact CE1-CD2 3.64Å; L1142-L1153 HydrophobicContact CD1-CD1 3.54Å; I1151-L1153 HydrophobicContact CD1-CD1 3.55Å; I1151-L1153 HydrophobicContact CD1-CG 3.93Å; I1151-L1153 HydrophobicContact CG1-CD1 4.23Å; I1151-L1153 HydrophobicContact CG1-CG 4.19Å; L1153-G1155 PolarHBondContact O-N 3.4Å; L1153-A1156 PolarHBondContact O-N 2.9Å; L1153-R1177 HydrophobicContact CD1-CB 4.42Å; L1153-R1177 PolarHBondContact N-O 2.98Å
1154	T	84.8	Confident	83.8	Confident	29 Å²	29	18 Å²	18	18%	0.178	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-5	178.7	47.3	0	0	0	0	114	N1152 R1180	N1152-T1154 PolarHBondContact ND2-OG1 3.39Å; N1152-T1154 WeakPolarHBondContact OD1-CG2 3.32Å; T1154-R1180 HydrophobicContact CG2-CG 3.63Å
1155	G	87.2	Confident	83.9	Confident	11 Å²	11	18.5 Å²	18.5	11%	0.113	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-32.1	169.8	0	0	0	0	0	113.8	R1088 N1133 L1153	R1088-G1155 PolarHBondContact NE-O 3.31Å; R1088-G1155 VanDerWaalsContact NH2-CA 3.29Å; R1088-G1155 PolarHBondContact NH2-O 3.46Å; N1133-G1155 PolarHBondContact OD1-N 2.98Å; L1153-G1155 PolarHBondContact O-N 3.4Å
1156	A	92.2	Very high	84	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	8%	0.075	C	C	.	.			trans	-81.6	155.8	176.2	0	0	0	0	0	111.7	R1088 L1090 F1132 L1153 C1178 Q1183	R1088-A1156 WeakPolarHBondContact O-CA 3.49Å; R1088-A1156 VanDerWaalsContact O-CB 3.3Å; R1088-A1156 WeakPolarHBondContact O-CB 3.05Å; L1090-A1156 HydrophobicContact CD1-CB 4.08Å; L1090-A1156 HydrophobicContact CD2-CB 3.57Å; L1090-A1156 HydrophobicContact CG-CB 3.5Å; L1090-A1156 VanDerWaalsContact CG-CB 3.5Å; F1132-A1156 HydrophobicContact CE1-CB 3.83Å; F1132-A1156 HydrophobicContact CZ-CB 3.96Å; L1153-A1156 PolarHBondContact O-N 2.9Å; A1156-C1178 PolarHBondContact O-SG 2.8Å; A1156-Q1183 PolarHBondContact O-NE2 3.46Å
1157	D	93.1	Very high	84.2	Confident	4 Å²	4	12 Å²	12	2%	0.021	8%	0.075	C	C	.	.			trans	-125.3	-31.8	172.3	52	8.7	0	0	0	112.3	H1087 R1088 N1185 V1187 H1188	H1087-D1157 WeakPolarHBondContact CA-OD1 3.33Å; H1087-D1157 WeakPolarHBondContact CB-OD1 3.46Å; H1087-D1157 IonicContact CE1-OD2 2.63Å; H1087-D1157 IonicContact CG-OD1 3.51Å; H1087-D1157 IonicContact CG-OD2 3.64Å; H1087-D1157 IonicContact ND1-OD1 3.51Å; H1087-D1157 IonicContact ND1-OD2 3.95Å; H1087-D1157 PolarHBondContact ND1-OD2 3.07Å; R1088-D1157 PolarHBondContact N-OD1 3.01Å; R1088-D1157 PolarHBondContact O-N 2.8Å; R1088-D1157 VanDerWaalsContact O-OD1 3.12Å; D1157-N1185 HydrophobicContact CB-CB 3.7Å; D1157-N1185 PolarHBondContact OD2-ND2 2.93Å; D1157-V1187 VanDerWaalsContact O-CA 3.31Å; D1157-V1187 WeakPolarHBondContact O-CA 3.44Å; D1157-V1187 WeakPolarHBondContact O-CG1 3.34Å; D1157-H1188 PolarHBondContact O-N 3.46Å
1158	T	94.5	Very high	85.1	Confident	1 Å²	1	12.8 Å²	12.8	1%	0.006	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137.4	176.1	-55.3	0	0	0	0	111.8	L1082 R1088 I1089 L1090 I1160 I1190	L1082-T1158 HydrophobicContact CD1-CG2 4.29Å; R1088-T1158 PolarHBondContact O-N 2.84Å; I1089-T1158 WeakPolarHBondContact CA-O 3.43Å; I1089-T1158 HydrophobicContact CG2-CG2 4.39Å; L1090-T1158 PolarHBondContact N-O 3.04Å; T1158-I1160 HydrophobicContact CG2-CG1 4.39Å; T1158-I1190 HydrophobicContact CG2-CD1 4.27Å
1159	V	94.8	Very high	85.9	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	110.1	-179.3	-179.3	0	0	0	0	110.2	L1090 F1092 C1178 V1187 H1188 V1189 I1190	L1090-V1159 HydrophobicContact CB-CG2 4.44Å; L1090-V1159 HydrophobicContact CD1-CG2 4.21Å; L1090-V1159 HydrophobicContact CG-CG2 4.5Å; F1092-V1159 HydrophobicContact CD2-CG1 3.67Å; F1092-V1159 HydrophobicContact CE2-CG1 3.63Å; V1159-C1178 HydrophobicContact CG2-CB 3.91Å; V1159-V1187 HydrophobicContact CG2-CG1 4.42Å; V1159-H1188 PolarHBondContact N-O 3.31Å; V1159-V1189 HydrophobicContact CB-CG2 4.33Å; V1159-V1189 CarbonylContact O-C 3.57Å; V1159-V1189 WeakPolarHBondContact O-CA 3.28Å; V1159-I1190 PolarHBondContact O-N 2.78Å
1160	I	95.9	Very high	86.9	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.4	176.1	-53.9	176.7	0	0	0	109.1	W1074 L1075 I1089 L1090 I1091 F1092 T1158 I1190 L1192	W1074-I1160 HydrophobicContact CZ3-CD1 4.34Å; L1075-I1160 HydrophobicContact CD2-CD1 3.81Å; L1075-I1160 HydrophobicContact CD2-CG2 4.44Å; I1089-I1160 HydrophobicContact CG2-CD1 3.65Å; I1089-I1160 HydrophobicContact CG2-CG1 3.95Å; L1090-I1160 PolarHBondContact O-N 2.98Å; I1091-I1160 CarbonylContact C-O 3.42Å; I1091-I1160 WeakPolarHBondContact CA-O 3.41Å; I1091-I1160 HydrophobicContact CG1-CB 4.38Å; I1091-I1160 HydrophobicContact CG1-CD1 4.49Å; F1092-I1160 PolarHBondContact N-O 3.28Å; T1158-I1160 HydrophobicContact CG2-CG1 4.39Å; I1160-I1190 CarbonylContact C-O 3.54Å; I1160-I1190 WeakPolarHBondContact CA-O 3.4Å; I1160-I1190 HydrophobicContact CG1-CB 4.44Å; I1160-L1192 HydrophobicContact CG2-CD1 3.92Å; I1160-L1192 HydrophobicContact CG2-CG 4.05Å
1161	I	95	Very high	88.1	Confident	2 Å²	2	11.7 Å²	11.7	1%	0.01	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	104.5	170.5	-65.3	163.5	0	0	0	106.9	F1092 I1164 D1171 E1175 V1189 I1190 R1191 L1192	F1092-I1161 HydrophobicContact CB-CG1 4.41Å; I1161-I1164 HydrophobicContact CG2-CG2 4Å; I1161-D1171 HydrophobicContact CD1-CB 4.18Å; I1161-E1175 HydrophobicContact CD1-CG 4.17Å; I1161-V1189 HydrophobicContact CD1-CG1 4.1Å; I1161-I1190 PolarHBondContact N-O 2.64Å; I1161-R1191 HydrophobicContact CB-CG 4.47Å; I1161-R1191 HydrophobicContact CD1-CG 4.28Å; I1161-R1191 VanDerWaalsContact CD1-NH1 3.3Å; I1161-L1192 PolarHBondContact O-N 2.81Å
1162	H	95	Very high	88.3	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.071	C	C	.	.	S	Bend	trans	-72.1	-36.1	-178.1	-173.4	-72	0	0	0	111.7	N997 K1071 I1091 F1092 M1098	N997-H1162 PolarHBondContact OD1-CE1 3.26Å; N997-H1162 VanDerWaalsContact OD1-CE1 3.24Å; N997-H1162 PolarHBondContact OD1-ND1 3.34Å; N997-H1162 VanDerWaalsContact OD1-ND1 3.1Å; K1071-H1162 VanDerWaalsContact CD-CE1 3.5Å; K1071-H1162 WeakPolarHBondContact CD-CE1 3.11Å; K1071-H1162 PolarHBondContact NZ-O 2.95Å; I1091-H1162 HydrophobicContact CG2-CB 4.42Å; F1092-H1162 WeakPolarHBondContact O-CB 3.49Å; F1092-H1162 PolarHBondContact O-N 2.82Å; M1098-H1162 WeakPolarHBondContact CE-NE2 3.39Å
1163	D	93.4	Very high	88.4	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.066	C	C	.	.	S	Bend	trans	-149.2	131.7	173.4	78.1	-55.5	0	0	0	113	R993 N997 S1093 Q1094 F1095	R993-D1163 IonicContact CZ-OD2 2.71Å; R993-D1163 IonicContact NE-OD2 3.66Å; R993-D1163 IonicContact NH2-OD2 3.87Å; R993-D1163 PolarHBondContact NH2-OD2 3.3Å; N997-D1163 WeakPolarHBondContact OD1-CB 3.36Å; S1093-D1163 VanDerWaalsContact CA-OD1 3.23Å; S1093-D1163 WeakPolarHBondContact CA-OD1 3.46Å; S1093-D1163 VanDerWaalsContact CB-OD1 3.32Å; S1093-D1163 WeakPolarHBondContact CB-OD1 3.49Å; S1093-D1163 PolarHBondContact OG-OD1 3.36Å; Q1094-D1163 PolarHBondContact N-OD1 3.12Å; F1095-D1163 WeakPolarHBondContact CD2-OD2 3.48Å; F1095-D1163 VanDerWaalsContact CE2-OD2 3.29Å; F1095-D1163 WeakPolarHBondContact CE2-OD2 3.28Å
1164	I	92.2	Very high	88.4	Confident	4 Å²	4	13 Å²	13	2%	0.021	7%	0.066	C	C	.	.			trans	-78	152	-169.7	51	163.5	0	0	0	113.9	R993 I1161 I1193 M1202 L1203	R993-I1164 PolarHBondContact NH1-O 3.18Å; R993-I1164 PolarHBondContact NH2-O 3.36Å; I1161-I1164 HydrophobicContact CG2-CG2 4Å; I1164-I1193 HydrophobicContact CD1-CD1 3.85Å; I1164-I1193 HydrophobicContact CG1-CD1 4.02Å; I1164-I1193 HydrophobicContact CG2-CD1 4.01Å; I1164-M1202 HydrophobicContact CD1-CB 3.83Å; I1164-M1202 HydrophobicContact CD1-CE 4.04Å; I1164-M1202 HydrophobicContact CG1-CE 3.76Å; I1164-L1203 HydrophobicContact CD1-CB 4.1Å
1165	D	88.6	Confident	88.6	Confident	12 Å²	12	11.8 Å²	11.8	6%	0.064	6%	0.059	C	C	.	.			trans	-79.9	161.2	167.7	-147.3	-45.6	0	0	0	111.2	Q1094 N1167 N1170 D1171	Q1094-D1165 PolarHBondContact OE1-OD2 2.84Å; D1165-N1167 PolarHBondContact O-N 3.13Å; D1165-N1167 PolarHBondContact OD1-N 3.27Å; D1165-N1170 HydrophobicContact CB-CB 4.21Å; D1165-N1170 PolarHBondContact OD2-ND2 2.9Å; D1165-D1171 PolarHBondContact N-OD1 3.11Å; D1165-D1171 PolarHBondContact N-OD2 3.4Å
1166	F	80.5	Confident	88.5	Confident	37 Å²	37	11.6 Å²	11.6	16%	0.162	6%	0.055	C	C	.	.	S	Bend	trans	-75.4	-1.2	166.1	-60.3	-87.9	0	0	0	112.5	V989 M1202 K1209 I1291 L1299	V989-F1166 HydrophobicContact CG1-CE1 4.23Å; V989-F1166 HydrophobicContact CG1-CZ 3.64Å; F1166-M1202 HydrophobicContact CD1-CE 4.34Å; F1166-M1202 HydrophobicContact CD1-CG 3.94Å; F1166-M1202 HydrophobicContact CD1-SD 4.17Å; F1166-M1202 HydrophobicContact CE1-CE 4.01Å; F1166-M1202 HydrophobicContact CE1-CG 3.5Å; F1166-M1202 HydrophobicContact CE1-SD 3.37Å; F1166-M1202 WeakPolarHBondContact CE1-SD 3.47Å; F1166-M1202 HydrophobicContact CE2-CE 4.43Å; F1166-M1202 HydrophobicContact CE2-SD 4.45Å; F1166-M1202 HydrophobicContact CZ-CE 4.05Å; F1166-M1202 HydrophobicContact CZ-CG 4.3Å; F1166-M1202 HydrophobicContact CZ-SD 3.54Å; F1166-M1202 VanDerWaalsContact CZ-SD 3.54Å; F1166-K1209 PolarHBondContact O-NZ 2.87Å; F1166-I1291 HydrophobicContact CB-CD1 4.4Å; F1166-I1291 HydrophobicContact CB-CG1 3.82Å; F1166-I1291 HydrophobicContact CD1-CD1 3.46Å; F1166-I1291 VanDerWaalsContact CD1-CD1 3.46Å; F1166-I1291 HydrophobicContact CD1-CG1 3.63Å; F1166-I1291 HydrophobicContact CD2-CD1 3.72Å; F1166-I1291 HydrophobicContact CD2-CG1 4.06Å; F1166-I1291 HydrophobicContact CE1-CD1 3.41Å; F1166-I1291 VanDerWaalsContact CE1-CD1 3.41Å; F1166-I1291 HydrophobicContact CE1-CG1 4.13Å; F1166-I1291 HydrophobicContact CE2-CD1 3.7Å; F1166-I1291 HydrophobicContact CG-CD1 3.6Å; F1166-I1291 HydrophobicContact CG-CG1 3.57Å; F1166-I1291 HydrophobicContact CZ-CD1 3.55Å; F1166-L1299 HydrophobicContact CD1-CD1 4.23Å; F1166-L1299 HydrophobicContact CE1-CD1 3.87Å
1167	N	79.4	Confident	88.1	Confident	6 Å²	6	12.8 Å²	12.8	3%	0.032	6%	0.06	C	C	.	.	S	Bend	trans	-127.8	96.1	178	-171	58.6	0	0	0	109	D1165 Y1169 N1170	D1165-N1167 PolarHBondContact O-N 3.13Å; D1165-N1167 PolarHBondContact OD1-N 3.27Å; N1167-Y1169 PolarHBondContact O-N 3.4Å; N1167-N1170 PolarHBondContact ND2-OD1 3.22Å; N1167-N1170 WeakPolarHBondContact O-CB 3.08Å; N1167-N1170 PolarHBondContact O-N 2.88Å
1168	P	84.4	Confident	87.8	Confident	17 Å²	17	12.6 Å²	12.6	11%	0.11	6%	0.059	C	C	.	.	H	α-helix	trans	-58.4	-23.1	-171.6	23.3	-35.7	0	0	0	113.6	N1170 D1171 R1172 A1206 K1209	P1168-N1170 PolarHBondContact O-N 3.15Å; P1168-D1171 PolarHBondContact O-N 2.7Å; P1168-R1172 WeakPolarHBondContact O-CB 3.48Å; P1168-R1172 PolarHBondContact O-N 3.04Å; P1168-A1206 HydrophobicContact CB-CB 4.19Å; P1168-A1206 HydrophobicContact CG-CB 4.38Å; P1168-K1209 HydrophobicContact CG-CB 4.11Å
1169	Y	81.2	Confident	87.5	Confident	7 Å²	7	13.7 Å²	13.7	3%	0.027	6%	0.064	C	C	.	.	H	α-helix	trans	-63.7	-24.9	175.1	-56.8	-75.8	0	0	0	114	T797 Q800 N1167 Q1173 K1209 E1213	T797-Y1169 HydrophobicContact CG2-CD1 3.35Å; T797-Y1169 HydrophobicContact CG2-CE1 4.08Å; T797-Y1169 HydrophobicContact CG2-CG 4.03Å; Q800-Y1169 HydrophobicContact CB-CD2 3.91Å; Q800-Y1169 HydrophobicContact CB-CE2 4.05Å; Q800-Y1169 HydrophobicContact CG-CD2 3.93Å; Q800-Y1169 HydrophobicContact CG-CE2 4.36Å; Q800-Y1169 HydrophobicContact CG-CG 4.15Å; Q800-Y1169 WeakPolarHBondContact O-CE2 3.41Å; N1167-Y1169 PolarHBondContact O-N 3.4Å; Y1169-Q1173 WeakPolarHBondContact O-CB 3.31Å; Y1169-Q1173 PolarHBondContact O-N 3.16Å; Y1169-K1209 PolarHBondContact OH-O 3.02Å; Y1169-E1213 WeakPolarHBondContact OH-CB 3.39Å
1170	N	83.6	Confident	86.9	Confident	42 Å²	42	17.1 Å²	17.1	23%	0.225	8%	0.076	C	C	.	.	H	α-helix	trans	-71.3	-42.8	173.7	-64.4	0.5	0	0	0	110.3	D1165 N1167 P1168 Q1173 A1174	D1165-N1170 HydrophobicContact CB-CB 4.21Å; D1165-N1170 PolarHBondContact OD2-ND2 2.9Å; N1167-N1170 PolarHBondContact ND2-OD1 3.22Å; N1167-N1170 WeakPolarHBondContact O-CB 3.08Å; N1167-N1170 PolarHBondContact O-N 2.88Å; P1168-N1170 PolarHBondContact O-N 3.15Å; N1170-Q1173 PolarHBondContact O-N 3.41Å; N1170-A1174 PolarHBondContact O-N 3.16Å; N1170-A1174 VanDerWaalsContact O-N 3.13Å
1171	D	88	Confident	85.9	Confident	5 Å²	5	20.2 Å²	20.2	3%	0.027	9%	0.093	C	C	.	.	H	α-helix	trans	-71.7	-46.3	-179.4	-58.7	-20.4	0	0	0	110.2	Q1094 I1161 D1165 P1168 Q1173 A1174 E1175	Q1094-D1171 PolarHBondContact NE2-OD1 3.15Å; I1161-D1171 HydrophobicContact CD1-CB 4.18Å; D1165-D1171 PolarHBondContact N-OD1 3.11Å; D1165-D1171 PolarHBondContact N-OD2 3.4Å; P1168-D1171 PolarHBondContact O-N 2.7Å; D1171-Q1173 VanDerWaalsContact C-N 3.28Å; D1171-Q1173 PolarHBondContact O-N 3.07Å; D1171-A1174 WeakPolarHBondContact O-CA 3.35Å; D1171-A1174 WeakPolarHBondContact O-CB 3.23Å; D1171-A1174 PolarHBondContact O-N 3.24Å; D1171-E1175 WeakPolarHBondContact O-CG 3.43Å; D1171-E1175 PolarHBondContact O-N 2.71Å
1172	R	83.9	Confident	85.2	Confident	59 Å²	59	23 Å²	23	22%	0.223	12%	0.122	C	C	.	.	H	α-helix	trans	-57.6	-38.6	171.9	-174.8	177.5	-179.7	162.6	4.6	112.5	E660 P1168 A1174 E1175 D1176 E1213	E660-R1172 IonicContact OE1-CZ 3.34Å; E660-R1172 IonicContact OE1-NE 2.64Å; E660-R1172 IonicContact OE1-NH2 3.77Å; E660-R1172 PolarHBondContact OE1-NH2 3.41Å; P1168-R1172 WeakPolarHBondContact O-CB 3.48Å; P1168-R1172 PolarHBondContact O-N 3.04Å; R1172-A1174 VanDerWaalsContact C-N 3.29Å; R1172-A1174 PolarHBondContact O-N 3.43Å; R1172-E1175 PolarHBondContact O-N 2.97Å; R1172-D1176 VanDerWaalsContact O-CB 3.32Å; R1172-D1176 WeakPolarHBondContact O-CB 3.49Å; R1172-D1176 VanDerWaalsContact O-CG 3.28Å; R1172-D1176 PolarHBondContact O-N 2.89Å; R1172-E1213 IonicContact NH1-OE2 3.8Å
1173	Q	83.3	Confident	84.8	Confident	35 Å²	35	23.9 Å²	23.9	16%	0.164	13%	0.126	C	C	.	.	H	α-helix	trans	-66.6	-29.3	175.3	175.1	171.1	91.6	0	0	112.6	M661 G1148 Y1169 N1170 D1171 R1177	M661-Q1173 HydrophobicContact CE-CG 4.15Å; M661-Q1173 HydrophobicContact SD-CB 3.97Å; M661-Q1173 HydrophobicContact SD-CG 3.82Å; G1148-Q1173 PolarHBondContact O-OE1 2.91Å; Y1169-Q1173 WeakPolarHBondContact O-CB 3.31Å; Y1169-Q1173 PolarHBondContact O-N 3.16Å; N1170-Q1173 PolarHBondContact O-N 3.41Å; D1171-Q1173 VanDerWaalsContact C-N 3.28Å; D1171-Q1173 PolarHBondContact O-N 3.07Å; Q1173-R1177 WeakPolarHBondContact O-CG 2.96Å; Q1173-R1177 PolarHBondContact O-NE 3.12Å
1174	A	86	Confident	84.4	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-75.4	-45.4	174.1	0	0	0	0	0	111.7	F1092 T1144 N1170 D1171 R1172 D1176 R1177	F1092-A1174 HydrophobicContact CD1-CB 4.15Å; F1092-A1174 HydrophobicContact CD2-CB 4.19Å; F1092-A1174 HydrophobicContact CE1-CB 3.9Å; F1092-A1174 HydrophobicContact CE2-CB 3.92Å; F1092-A1174 HydrophobicContact CG-CB 4.3Å; F1092-A1174 HydrophobicContact CZ-CB 3.78Å; T1144-A1174 HydrophobicContact CG2-CB 4.07Å; N1170-A1174 PolarHBondContact O-N 3.16Å; N1170-A1174 VanDerWaalsContact O-N 3.13Å; D1171-A1174 WeakPolarHBondContact O-CA 3.35Å; D1171-A1174 WeakPolarHBondContact O-CB 3.23Å; D1171-A1174 PolarHBondContact O-N 3.24Å; R1172-A1174 VanDerWaalsContact C-N 3.29Å; R1172-A1174 PolarHBondContact O-N 3.43Å; A1174-D1176 VanDerWaalsContact C-N 3.3Å; A1174-D1176 PolarHBondContact O-N 2.78Å; A1174-R1177 VanDerWaalsContact O-CB 3.31Å; A1174-R1177 WeakPolarHBondContact O-CB 3.21Å; A1174-R1177 WeakPolarHBondContact O-CG 3.29Å; A1174-R1177 PolarHBondContact O-N 2.92Å; A1174-R1177 VanDerWaalsContact O-N 3.08Å
1175	E	88.6	Confident	84.3	Confident	5 Å²	5	36 Å²	36	2%	0.023	18%	0.182	C	C	.	.	H	α-helix	trans	-55.1	-44.7	172.8	-63.1	161.3	-142.5	0	0	112	K885 I1161 D1171 R1172 R1177 C1178 H1179 V1189 R1191	K885-E1175 IonicContact NZ-OE2 3.44Å; K885-E1175 PolarHBondContact NZ-OE2 2.75Å; I1161-E1175 HydrophobicContact CD1-CG 4.17Å; D1171-E1175 WeakPolarHBondContact O-CG 3.43Å; D1171-E1175 PolarHBondContact O-N 2.71Å; R1172-E1175 PolarHBondContact O-N 2.97Å; E1175-R1177 PolarHBondContact O-N 3.14Å; E1175-C1178 PolarHBondContact O-N 2.57Å; E1175-H1179 PolarHBondContact O-N 2.87Å; E1175-V1189 HydrophobicContact CB-CG2 4.41Å; E1175-V1189 HydrophobicContact CG-CG1 3.81Å; E1175-V1189 HydrophobicContact CG-CG2 4.04Å; E1175-R1191 IonicContact OE1-CZ 2.72Å; E1175-R1191 IonicContact OE1-NH1 3.4Å; E1175-R1191 PolarHBondContact OE1-NH1 3.26Å; E1175-R1191 IonicContact OE1-NH2 3.16Å; E1175-R1191 PolarHBondContact OE1-NH2 2.86Å; E1175-R1191 IonicContact OE2-NH2 3.66Å; E1175-R1191 PolarHBondContact OE2-NH2 3.22Å
1176	D	85.3	Confident	84.4	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.032	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	2.4	-179.8	-74.9	-13.9	0	0	0	113.8	M661 K875 K885 R1172 A1174 H1179	M661-D1176 HydrophobicContact CB-CB 4.38Å; K875-D1176 IonicContact NZ-OD1 3.01Å; K875-D1176 PolarHBondContact NZ-OD1 2.9Å; K875-D1176 IonicContact NZ-OD2 2.99Å; K875-D1176 PolarHBondContact NZ-OD2 2.65Å; K885-D1176 IonicContact NZ-OD1 2.74Å; R1172-D1176 VanDerWaalsContact O-CB 3.32Å; R1172-D1176 WeakPolarHBondContact O-CB 3.49Å; R1172-D1176 VanDerWaalsContact O-CG 3.28Å; R1172-D1176 PolarHBondContact O-N 2.89Å; A1174-D1176 VanDerWaalsContact C-N 3.3Å; A1174-D1176 PolarHBondContact O-N 2.78Å; D1176-H1179 IonicContact OD1-CE1 2.72Å; D1176-H1179 PolarHBondContact OD1-CE1 3.11Å
1177	R	83.8	Confident	85	Confident	26 Å²	26	36.3 Å²	36.3	10%	0.098	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-27.1	165.7	-55.7	-48	-175.9	-161.6	-1.5	113.2	G1147 G1148 L1149 I1151 L1153 Q1173 A1174 E1175 R1180	G1147-R1177 WeakPolarHBondContact O-CG 3.33Å; G1147-R1177 PolarHBondContact O-NE 3.38Å; G1148-R1177 PolarHBondContact O-NH2 2.83Å; L1149-R1177 PolarHBondContact O-NE 3.15Å; L1149-R1177 PolarHBondContact O-NH2 3.02Å; L1149-R1177 VanDerWaalsContact O-NH2 3.11Å; I1151-R1177 HydrophobicContact CG1-CB 4.16Å; I1151-R1177 HydrophobicContact CG1-CG 3.9Å; L1153-R1177 HydrophobicContact CD1-CB 4.42Å; L1153-R1177 PolarHBondContact N-O 2.98Å; Q1173-R1177 WeakPolarHBondContact O-CG 2.96Å; Q1173-R1177 PolarHBondContact O-NE 3.12Å; A1174-R1177 VanDerWaalsContact O-CB 3.31Å; A1174-R1177 WeakPolarHBondContact O-CB 3.21Å; A1174-R1177 WeakPolarHBondContact O-CG 3.29Å; A1174-R1177 PolarHBondContact O-N 2.92Å; A1174-R1177 VanDerWaalsContact O-N 3.08Å; E1175-R1177 PolarHBondContact O-N 3.14Å; R1177-R1180 VanDerWaalsContact O-CD 3.27Å; R1177-R1180 WeakPolarHBondContact O-CD 3.33Å
1178	C	87.5	Confident	85.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-53.1	169.9	166.6	0	0	0	0	109.9	L1090 A1156 V1159 E1175 R1180 Q1183	L1090-C1178 HydrophobicContact CD1-CB 4.06Å; A1156-C1178 PolarHBondContact O-SG 2.8Å; V1159-C1178 HydrophobicContact CG2-CB 3.91Å; E1175-C1178 PolarHBondContact O-N 2.57Å; C1178-R1180 PolarHBondContact O-N 3.4Å; C1178-Q1183 PolarHBondContact SG-NE2 2.93Å; C1178-Q1183 VanDerWaalsContact SG-NE2 3.44Å
1179	H	86.5	Confident	86.2	Confident	24 Å²	24	38.2 Å²	38.2	11%	0.111	20%	0.196	C	C	.	.	S	Bend	trans	-79.2	79.2	-178.9	-171.8	-115.7	0	0	0	112.4	K875 K885 E1175 D1176 V1187	K875-H1179 VanDerWaalsContact CD-CE1 3.49Å; K875-H1179 WeakPolarHBondContact CD-CE1 3.05Å; K875-H1179 PolarHBondContact NZ-CE1 2.84Å; K875-H1179 PolarHBondContact NZ-O 3.3Å; K885-H1179 HydrophobicContact CD-CB 3.89Å; E1175-H1179 PolarHBondContact O-N 2.87Å; D1176-H1179 IonicContact OD1-CE1 2.72Å; D1176-H1179 PolarHBondContact OD1-CE1 3.11Å; H1179-V1187 HydrophobicContact CB-CB 4.35Å; H1179-V1187 HydrophobicContact CB-CG1 4.24Å; H1179-V1187 HydrophobicContact CB-CG2 4.15Å
1180	R	82.3	Confident	86.9	Confident	71 Å²	71	38.4 Å²	38.4	27%	0.268	20%	0.197	S	C	.	.	S	Bend	trans	-148	169	-178.9	56.4	176.6	-73.9	175.9	-7.8	112.2	I1151 N1152 T1154 R1177 C1178 G1182 Q1183	I1151-R1180 PolarHBondContact O-NH1 3.29Å; N1152-R1180 VanDerWaalsContact OD1-CD 3.26Å; N1152-R1180 WeakPolarHBondContact OD1-CD 3.03Å; N1152-R1180 PolarHBondContact OD1-NE 2.97Å; N1152-R1180 PolarHBondContact OD1-NH2 3.1Å; T1154-R1180 HydrophobicContact CG2-CG 3.63Å; R1177-R1180 VanDerWaalsContact O-CD 3.27Å; R1177-R1180 WeakPolarHBondContact O-CD 3.33Å; C1178-R1180 PolarHBondContact O-N 3.4Å; R1180-G1182 PolarHBondContact O-N 2.94Å; R1180-Q1183 VanDerWaalsContact O-CB 3.28Å; R1180-Q1183 WeakPolarHBondContact O-CB 3.46Å; R1180-Q1183 PolarHBondContact O-N 3.45Å
1181	L	75.8	Confident	87.5	Confident	65 Å²	65	38.3 Å²	38.3	34%	0.34	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	123.1	173.1	-71.6	171.2	0	0	0	110.4	L879 L882	L879-L1181 HydrophobicContact CD1-CD1 4.35Å; L879-L1181 HydrophobicContact CD1-CD2 3.75Å; L879-L1181 HydrophobicContact CD1-CG 4Å; L879-L1181 HydrophobicContact CD2-CD2 4.03Å; L882-L1181 HydrophobicContact CD2-CD2 4.5Å
1182	G	79.5	Confident	87.9	Confident	60 Å²	60	38.1 Å²	38.1	62%	0.619	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	113.6	-20.8	-171.9	0	0	0	0	0	113.8	R1180	R1180-G1182 PolarHBondContact O-N 2.94Å
1183	Q	86.7	Confident	88.4	Confident	19 Å²	19	35.3 Å²	35.3	9%	0.089	18%	0.182	C	C	.	.			trans	-66.8	139.7	171.4	-178.6	56.7	-84.4	0	0	111.3	P883 A1156 C1178 R1180 N1185 V1187	P883-Q1183 HydrophobicContact CG-CG 4.37Å; A1156-Q1183 PolarHBondContact O-NE2 3.46Å; C1178-Q1183 PolarHBondContact SG-NE2 2.93Å; C1178-Q1183 VanDerWaalsContact SG-NE2 3.44Å; R1180-Q1183 VanDerWaalsContact O-CB 3.28Å; R1180-Q1183 WeakPolarHBondContact O-CB 3.46Å; R1180-Q1183 PolarHBondContact O-N 3.45Å; Q1183-N1185 VanDerWaalsContact CG-O 3.24Å; Q1183-N1185 WeakPolarHBondContact CG-O 3.35Å; Q1183-V1187 HydrophobicContact CG-CG2 3.79Å
1184	K	86	Confident	88.9	Confident	185 Å²	185	33.7 Å²	33.7	80%	0.804	17%	0.174	S	C	*	.			trans	-115.3	-33.4	176.3	-64.6	-175.6	179.1	-177.6	0	113.1	P883	P883-K1184 WeakPolarHBondContact CG-O 3.46Å
1185	N	89.2	Confident	89.1	Confident	74 Å²	74	38.5 Å²	38.5	40%	0.396	20%	0.197	S	C	.	.	S	Bend	trans	-85.9	153.2	-178.6	-68.4	13.7	0	0	0	110.5	P883 D1157 Q1183	P883-N1185 WeakPolarHBondContact CB-O 3.44Å; P883-N1185 WeakPolarHBondContact CG-O 3.5Å; D1157-N1185 HydrophobicContact CB-CB 3.7Å; D1157-N1185 PolarHBondContact OD2-ND2 2.93Å; Q1183-N1185 VanDerWaalsContact CG-O 3.24Å; Q1183-N1185 WeakPolarHBondContact CG-O 3.35Å
1186	P	91.3	Very high	88.9	Confident	56 Å²	56	40.3 Å²	40.3	36%	0.364	22%	0.216	S	C	.	.			trans	-56.8	147.5	163.3	28.8	-35.6	0	0	0	109.9	P884	P884-P1186 HydrophobicContact CG-CB 4.17Å
1187	V	92.7	Very high	89.1	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.6	-177.6	177.5	0	0	0	0	110.5	P884 K885 T886 D1157 V1159 H1179 Q1183 V1189	P884-V1187 PolarHBondContact O-N 3.27Å; K885-V1187 CarbonylContact C-O 3.6Å; K885-V1187 VanDerWaalsContact CA-O 3.26Å; K885-V1187 WeakPolarHBondContact CA-O 3.43Å; K885-V1187 HydrophobicContact CB-CB 4.39Å; K885-V1187 HydrophobicContact CD-CG1 4.32Å; K885-V1187 HydrophobicContact CG-CB 4.1Å; K885-V1187 HydrophobicContact CG-CG1 4.06Å; T886-V1187 PolarHBondContact N-O 3.31Å; D1157-V1187 VanDerWaalsContact O-CA 3.31Å; D1157-V1187 WeakPolarHBondContact O-CA 3.44Å; D1157-V1187 WeakPolarHBondContact O-CG1 3.34Å; V1159-V1187 HydrophobicContact CG2-CG1 4.42Å; H1179-V1187 HydrophobicContact CB-CB 4.35Å; H1179-V1187 HydrophobicContact CB-CG1 4.24Å; H1179-V1187 HydrophobicContact CB-CG2 4.15Å; Q1183-V1187 HydrophobicContact CG-CG2 3.79Å; V1187-V1189 HydrophobicContact CG1-CG2 4.3Å
1188	H	94.3	Very high	89.4	Confident	63 Å²	63	39 Å²	39	29%	0.292	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116	-177.6	-60.3	-58.9	0	0	0	110.2	T886 D1157 V1159	T886-H1188 PolarHBondContact OG1-ND1 3.48Å; D1157-H1188 PolarHBondContact O-N 3.46Å; V1159-H1188 PolarHBondContact N-O 3.31Å
1189	V	94.6	Very high	89.5	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.7	-179.2	-176.2	0	0	0	0	110.9	K885 T886 S887 E888 V1159 I1161 E1175 V1187	K885-V1189 HydrophobicContact CD-CG2 3.82Å; K885-V1189 HydrophobicContact CG-CG2 3.95Å; T886-V1189 PolarHBondContact O-N 2.77Å; S887-V1189 CarbonylContact C-O 3.49Å; S887-V1189 VanDerWaalsContact CA-O 3.27Å; S887-V1189 WeakPolarHBondContact CA-O 3.3Å; E888-V1189 PolarHBondContact N-O 2.66Å; V1159-V1189 HydrophobicContact CB-CG2 4.33Å; V1159-V1189 CarbonylContact O-C 3.57Å; V1159-V1189 WeakPolarHBondContact O-CA 3.28Å; I1161-V1189 HydrophobicContact CD1-CG1 4.1Å; E1175-V1189 HydrophobicContact CB-CG2 4.41Å; E1175-V1189 HydrophobicContact CG-CG1 3.81Å; E1175-V1189 HydrophobicContact CG-CG2 4.04Å; V1187-V1189 HydrophobicContact CG1-CG2 4.3Å
1190	I	95.8	Very high	89.7	Confident	11 Å²	11	41 Å²	41	6%	0.056	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.1	-178.2	-49.8	-176.9	0	0	0	109.2	E888 V890 W1074 T1158 V1159 I1160 I1161 L1192	E888-I1190 HydrophobicContact CG-CB 4.25Å; E888-I1190 HydrophobicContact CG-CG1 4.04Å; E888-I1190 HydrophobicContact CG-CG2 4.2Å; E888-I1190 WeakPolarHBondContact OE1-CG1 3.43Å; E888-I1190 WeakPolarHBondContact OE1-CG2 3.48Å; V890-I1190 HydrophobicContact CG2-CG2 3.75Å; W1074-I1190 HydrophobicContact CH2-CD1 3.97Å; W1074-I1190 HydrophobicContact CH2-CG2 3.85Å; W1074-I1190 HydrophobicContact CZ2-CG2 4.2Å; T1158-I1190 HydrophobicContact CG2-CD1 4.27Å; V1159-I1190 PolarHBondContact O-N 2.78Å; I1160-I1190 CarbonylContact C-O 3.54Å; I1160-I1190 WeakPolarHBondContact CA-O 3.4Å; I1160-I1190 HydrophobicContact CG1-CB 4.44Å; I1161-I1190 PolarHBondContact N-O 2.64Å; I1190-L1192 HydrophobicContact CG2-CD2 3.94Å
1191	R	95.8	Very high	89.8	Confident	40 Å²	40	38.1 Å²	38.1	15%	0.151	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.9	174.3	-54.1	-176.7	-157.6	-83.9	-15.4	110.2	S887 E888 V889 V890 I1161 E1175	S887-R1191 PolarHBondContact OG-NE 2.79Å; S887-R1191 PolarHBondContact OG-NH2 3.21Å; E888-R1191 PolarHBondContact O-N 2.9Å; V889-R1191 HydrophobicContact CG2-CB 4.43Å; V890-R1191 PolarHBondContact N-O 2.68Å; I1161-R1191 HydrophobicContact CB-CG 4.47Å; I1161-R1191 HydrophobicContact CD1-CG 4.28Å; I1161-R1191 VanDerWaalsContact CD1-NH1 3.3Å; E1175-R1191 IonicContact OE1-CZ 2.72Å; E1175-R1191 IonicContact OE1-NH1 3.4Å; E1175-R1191 PolarHBondContact OE1-NH1 3.26Å; E1175-R1191 IonicContact OE1-NH2 3.16Å; E1175-R1191 PolarHBondContact OE1-NH2 2.86Å; E1175-R1191 IonicContact OE2-NH2 3.66Å; E1175-R1191 PolarHBondContact OE2-NH2 3.22Å
1192	L	96	Very high	90.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.2	177.8	-54.7	-175.7	0	0	0	110.3	V890 V892 K1071 W1074 L1075 I1160 I1161 I1190	V890-L1192 HydrophobicContact CB-CD2 4.08Å; V890-L1192 HydrophobicContact CG1-CD2 4.48Å; V892-L1192 HydrophobicContact CG2-CD2 4.3Å; K1071-L1192 HydrophobicContact CD-CB 4.23Å; K1071-L1192 HydrophobicContact CG-CB 4.46Å; K1071-L1192 PolarHBondContact NZ-O 3.44Å; W1074-L1192 HydrophobicContact CD2-CD2 3.83Å; W1074-L1192 HydrophobicContact CE3-CD1 3.82Å; W1074-L1192 HydrophobicContact CE3-CD2 3.6Å; W1074-L1192 HydrophobicContact CE3-CG 4.36Å; W1074-L1192 HydrophobicContact CH2-CD2 4.12Å; W1074-L1192 HydrophobicContact CZ2-CD2 4.29Å; W1074-L1192 HydrophobicContact CZ3-CD1 4.18Å; W1074-L1192 HydrophobicContact CZ3-CD2 3.76Å; L1075-L1192 HydrophobicContact CG-CD1 4.35Å; I1160-L1192 HydrophobicContact CG2-CD1 3.92Å; I1160-L1192 HydrophobicContact CG2-CG 4.05Å; I1161-L1192 PolarHBondContact O-N 2.81Å; I1190-L1192 HydrophobicContact CG2-CD2 3.94Å
1193	I	95.2	Very high	91	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.1	-178.4	-59.8	-64.1	0	0	0	108.4	V889 V890 L891 V892 I1164 E1195 E1199 E1200 L1203	V889-I1193 HydrophobicContact CG1-CB 4.47Å; V889-I1193 HydrophobicContact CG1-CG1 3.82Å; V890-I1193 PolarHBondContact O-N 3.2Å; L891-I1193 WeakPolarHBondContact CA-O 3.42Å; L891-I1193 HydrophobicContact CD2-CB 4.19Å; L891-I1193 HydrophobicContact CD2-CG2 4.03Å; V892-I1193 PolarHBondContact N-O 3.12Å; I1164-I1193 HydrophobicContact CD1-CD1 3.85Å; I1164-I1193 HydrophobicContact CG1-CD1 4.02Å; I1164-I1193 HydrophobicContact CG2-CD1 4.01Å; I1193-E1195 PolarHBondContact O-N 3.19Å; I1193-E1199 HydrophobicContact CD1-CB 4.46Å; I1193-E1199 HydrophobicContact CG2-CB 3.99Å; I1193-E1200 HydrophobicContact CG2-CG 4.03Å; I1193-L1203 HydrophobicContact CG1-CD2 4.37Å
1194	S	93.1	Very high	90.9	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.007	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122.7	177.4	-70.7	0	0	0	0	111.3	V892 A996 K1071 T1197 E1199	V892-S1194 WeakPolarHBondContact O-CA 3.47Å; A996-S1194 PolarHBondContact O-OG 3.1Å; K1071-S1194 WeakPolarHBondContact CE-OG 3.45Å; S1194-T1197 WeakPolarHBondContact O-CB 3.46Å; S1194-T1197 WeakPolarHBondContact O-CG2 3.18Å; S1194-T1197 PolarHBondContact O-N 3.2Å; S1194-T1197 PolarHBondContact O-OG1 2.82Å; S1194-E1199 PolarHBondContact N-OE2 3.03Å
1195	E	91	Very high	90.7	Very high	103 Å²	103	31 Å²	31	48%	0.481	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	139.8	-178.3	-170.6	-175.7	-173.4	0	0	112	V892 I1193 T1197 E1200	V892-E1195 PolarHBondContact O-N 2.85Å; I1193-E1195 PolarHBondContact O-N 3.19Å; E1195-T1197 PolarHBondContact O-N 3.2Å; E1195-E1200 WeakPolarHBondContact CA-OE1 3.33Å
1196	G	84.9	Confident	90.5	Very high	42 Å²	42	27.9 Å²	27.9	43%	0.433	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	16.9	-178.3	0	0	0	0	0	114	E1200	G1196-E1200 PolarHBondContact N-OE1 3.26Å
1197	T	89.3	Confident	90.2	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.15	C	C	.	.	S	Bend	trans	-113.3	168.4	-177.2	78.6	0	0	0	0	114.3	M894 Y902 A996 S1194 E1195 E1199 E1200	M894-T1197 HydrophobicContact CE-CG2 3.52Å; M894-T1197 HydrophobicContact CG-CG2 4.33Å; M894-T1197 HydrophobicContact SD-CG2 3.59Å; M894-T1197 VanDerWaalsContact SD-CG2 3.59Å; Y902-T1197 HydrophobicContact CD2-CG2 4.41Å; Y902-T1197 HydrophobicContact CE1-CG2 4.48Å; Y902-T1197 HydrophobicContact CE2-CG2 3.99Å; A996-T1197 HydrophobicContact CB-CG2 4.08Å; S1194-T1197 WeakPolarHBondContact O-CB 3.46Å; S1194-T1197 WeakPolarHBondContact O-CG2 3.18Å; S1194-T1197 PolarHBondContact O-N 3.2Å; S1194-T1197 PolarHBondContact O-OG1 2.82Å; E1195-T1197 PolarHBondContact O-N 3.2Å; T1197-E1199 PolarHBondContact O-N 3.25Å; T1197-E1199 PolarHBondContact OG1-N 3.01Å; T1197-E1200 PolarHBondContact O-N 2.9Å; T1197-E1200 VanDerWaalsContact O-N 3.12Å
1198	L	89.4	Confident	89.4	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-46.6	-25.4	167.9	176.5	64.1	0	0	0	114.4	Y902 V989 L992 R993 E1200 G1201 M1202 L1299 A1303	Y902-L1198 PolarHBondContact OH-N 3Å; V989-L1198 HydrophobicContact CB-CD2 4.29Å; V989-L1198 HydrophobicContact CG1-CD2 4.15Å; V989-L1198 HydrophobicContact CG2-CD2 4.21Å; V989-L1198 WeakPolarHBondContact O-CD2 3.32Å; L992-L1198 HydrophobicContact CB-CB 4.47Å; L992-L1198 HydrophobicContact CB-CD2 3.53Å; L992-L1198 HydrophobicContact CD1-CD2 4.09Å; L992-L1198 HydrophobicContact CG-CD2 4.47Å; R993-L1198 HydrophobicContact CG-CD2 4.23Å; L1198-E1200 VanDerWaalsContact C-N 3.34Å; L1198-E1200 PolarHBondContact O-N 3.48Å; L1198-G1201 PolarHBondContact O-N 3.2Å; L1198-M1202 HydrophobicContact CG-SD 4.23Å; L1198-M1202 WeakPolarHBondContact O-CG 3.37Å; L1198-M1202 PolarHBondContact O-N 3.09Å; L1198-M1202 VanDerWaalsContact O-N 3.16Å; L1198-L1299 HydrophobicContact CD1-CB 3.77Å; L1198-L1299 HydrophobicContact CD1-CD2 4.45Å; L1198-A1303 HydrophobicContact CB-CB 4.07Å; L1198-A1303 HydrophobicContact CD1-CB 3.98Å
1199	E	90.5	Very high	88.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-29.9	-179.7	-62.9	-168.2	142.8	0	0	113.2	A996 K1071 I1193 S1194 T1197 M1202 L1203	A996-E1199 HydrophobicContact CB-CG 4.27Å; K1071-E1199 VanDerWaalsContact CE-OE2 3.31Å; K1071-E1199 WeakPolarHBondContact CE-OE2 3.04Å; K1071-E1199 VanDerWaalsContact NZ-CD 3.25Å; K1071-E1199 IonicContact NZ-OE1 2.76Å; K1071-E1199 PolarHBondContact NZ-OE1 3.33Å; K1071-E1199 IonicContact NZ-OE2 3.35Å; K1071-E1199 PolarHBondContact NZ-OE2 3.41Å; I1193-E1199 HydrophobicContact CD1-CB 4.46Å; I1193-E1199 HydrophobicContact CG2-CB 3.99Å; S1194-E1199 PolarHBondContact N-OE2 3.03Å; T1197-E1199 PolarHBondContact O-N 3.25Å; T1197-E1199 PolarHBondContact OG1-N 3.01Å; E1199-M1202 WeakPolarHBondContact O-CB 3.48Å; E1199-M1202 PolarHBondContact O-N 3.12Å; E1199-L1203 WeakPolarHBondContact O-CB 3.25Å; E1199-L1203 PolarHBondContact O-N 3.24Å
1200	E	90.1	Very high	87.7	Confident	67 Å²	67	30.9 Å²	30.9	31%	0.313	16%	0.164	S	C	.	.	H	α-helix	trans	-65.7	-45.3	175	-66.7	176.5	-169	0	0	111.6	I1193 E1195 G1196 T1197 L1198 M1202 L1203 R1204	I1193-E1200 HydrophobicContact CG2-CG 4.03Å; E1195-E1200 WeakPolarHBondContact CA-OE1 3.33Å; G1196-E1200 PolarHBondContact N-OE1 3.26Å; T1197-E1200 PolarHBondContact O-N 2.9Å; T1197-E1200 VanDerWaalsContact O-N 3.12Å; L1198-E1200 VanDerWaalsContact C-N 3.34Å; L1198-E1200 PolarHBondContact O-N 3.48Å; E1200-M1202 PolarHBondContact O-N 3.45Å; E1200-L1203 WeakPolarHBondContact O-CB 3.44Å; E1200-L1203 PolarHBondContact O-N 3.5Å; E1200-L1203 VanDerWaalsContact O-N 3.16Å; E1200-R1204 PolarHBondContact O-N 3.44Å
1201	G	85.7	Confident	86.7	Confident	11 Å²	11	33.9 Å²	33.9	11%	0.113	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-35.9	174.4	0	0	0	0	0	111.9	L1198 I1205 L1299	L1198-G1201 PolarHBondContact O-N 3.2Å; G1201-I1205 PolarHBondContact O-N 3.04Å; G1201-I1205 VanDerWaalsContact O-N 3.16Å; G1201-L1299 WeakPolarHBondContact O-CD2 3.45Å
1202	M	89	Confident	85.3	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-68.2	-41	173.4	-71.9	172	33.8	0	0	112.6	R993 I1164 F1166 L1198 E1199 E1200 I1205 A1206 L1299	R993-M1202 HydrophobicContact CG-SD 4.02Å; I1164-M1202 HydrophobicContact CD1-CB 3.83Å; I1164-M1202 HydrophobicContact CD1-CE 4.04Å; I1164-M1202 HydrophobicContact CG1-CE 3.76Å; F1166-M1202 HydrophobicContact CD1-CE 4.34Å; F1166-M1202 HydrophobicContact CD1-CG 3.94Å; F1166-M1202 HydrophobicContact CD1-SD 4.17Å; F1166-M1202 HydrophobicContact CE1-CE 4.01Å; F1166-M1202 HydrophobicContact CE1-CG 3.5Å; F1166-M1202 HydrophobicContact CE1-SD 3.37Å; F1166-M1202 WeakPolarHBondContact CE1-SD 3.47Å; F1166-M1202 HydrophobicContact CE2-CE 4.43Å; F1166-M1202 HydrophobicContact CE2-SD 4.45Å; F1166-M1202 HydrophobicContact CZ-CE 4.05Å; F1166-M1202 HydrophobicContact CZ-CG 4.3Å; F1166-M1202 HydrophobicContact CZ-SD 3.54Å; F1166-M1202 VanDerWaalsContact CZ-SD 3.54Å; L1198-M1202 HydrophobicContact CG-SD 4.23Å; L1198-M1202 WeakPolarHBondContact O-CG 3.37Å; L1198-M1202 PolarHBondContact O-N 3.09Å; L1198-M1202 VanDerWaalsContact O-N 3.16Å; E1199-M1202 WeakPolarHBondContact O-CB 3.48Å; E1199-M1202 PolarHBondContact O-N 3.12Å; E1200-M1202 PolarHBondContact O-N 3.45Å; M1202-I1205 PolarHBondContact O-N 2.98Å; M1202-A1206 WeakPolarHBondContact O-CB 3.44Å; M1202-A1206 PolarHBondContact O-N 2.84Å; M1202-L1299 HydrophobicContact CG-CD1 3.91Å; M1202-L1299 HydrophobicContact CG-CD2 4.3Å
1203	L	89.7	Confident	84	Confident	37 Å²	37	33.7 Å²	33.7	19%	0.194	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-44.9	175.3	-179.1	72.2	0	0	0	110.8	V889 I1164 I1193 E1199 E1200 I1205 A1206 S1207	V889-L1203 HydrophobicContact CG1-CD2 3.81Å; V889-L1203 HydrophobicContact CG2-CD2 4.47Å; I1164-L1203 HydrophobicContact CD1-CB 4.1Å; I1193-L1203 HydrophobicContact CG1-CD2 4.37Å; E1199-L1203 WeakPolarHBondContact O-CB 3.25Å; E1199-L1203 PolarHBondContact O-N 3.24Å; E1200-L1203 WeakPolarHBondContact O-CB 3.44Å; E1200-L1203 PolarHBondContact O-N 3.5Å; E1200-L1203 VanDerWaalsContact O-N 3.16Å; L1203-I1205 PolarHBondContact O-N 2.92Å; L1203-A1206 WeakPolarHBondContact O-CB 3.21Å; L1203-A1206 PolarHBondContact O-N 2.85Å; L1203-A1206 VanDerWaalsContact O-N 3.08Å; L1203-S1207 PolarHBondContact O-N 3.5Å; L1203-S1207 PolarHBondContact O-OG 2.98Å
1204	R	86.4	Confident	82.8	Confident	126 Å²	126	36.2 Å²	36.2	48%	0.475	19%	0.19	S	C	.	.	H	α-helix	trans	-55.2	-50.4	175.5	-165.6	178.4	70.7	-141.2	-0.5	111.3	E1200 A1206 S1207 E1208 D1302	E1200-R1204 PolarHBondContact O-N 3.44Å; R1204-A1206 VanDerWaalsContact C-N 3.32Å; R1204-A1206 PolarHBondContact O-N 2.68Å; R1204-S1207 PolarHBondContact O-N 3.28Å; R1204-E1208 IonicContact NE-OE1 2.76Å; R1204-E1208 VanDerWaalsContact O-CG 3.32Å; R1204-E1208 WeakPolarHBondContact O-CG 3.48Å; R1204-E1208 PolarHBondContact O-N 2.96Å; R1204-D1302 IonicContact CZ-OD2 2.94Å; R1204-D1302 IonicContact NH1-OD2 3.26Å; R1204-D1302 IonicContact NH2-OD2 3.13Å; R1204-D1302 PolarHBondContact NH2-OD2 2.97Å
1205	I	81.4	Confident	81.5	Confident	14 Å²	14	37 Å²	37	7%	0.072	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-35.3	174.9	-77.9	-178.2	0	0	0	112.9	G1201 M1202 L1203 K1209 I1286 D1295 L1299	G1201-I1205 PolarHBondContact O-N 3.04Å; G1201-I1205 VanDerWaalsContact O-N 3.16Å; M1202-I1205 PolarHBondContact O-N 2.98Å; L1203-I1205 PolarHBondContact O-N 2.92Å; I1205-K1209 WeakPolarHBondContact O-CG 3.43Å; I1205-K1209 PolarHBondContact O-N 3.47Å; I1205-I1286 HydrophobicContact CB-CD1 4.41Å; I1205-I1286 HydrophobicContact CD1-CD1 4.42Å; I1205-I1286 HydrophobicContact CG1-CD1 4.31Å; I1205-I1286 HydrophobicContact CG2-CD1 3.48Å; I1205-I1286 VanDerWaalsContact CG2-CD1 3.48Å; I1205-D1295 HydrophobicContact CD1-CB 4.26Å; I1205-L1299 HydrophobicContact CD1-CD1 4.07Å; I1205-L1299 HydrophobicContact CD1-CD2 3.78Å; I1205-L1299 HydrophobicContact CD1-CG 3.78Å
1206	A	84.4	Confident	80.2	Confident	10 Å²	10	32.6 Å²	32.6	8%	0.083	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-43	176.3	0	0	0	0	0	111.5	P1168 M1202 L1203 R1204 K1209 L1210	P1168-A1206 HydrophobicContact CB-CB 4.19Å; P1168-A1206 HydrophobicContact CG-CB 4.38Å; M1202-A1206 WeakPolarHBondContact O-CB 3.44Å; M1202-A1206 PolarHBondContact O-N 2.84Å; L1203-A1206 WeakPolarHBondContact O-CB 3.21Å; L1203-A1206 PolarHBondContact O-N 2.85Å; L1203-A1206 VanDerWaalsContact O-N 3.08Å; R1204-A1206 VanDerWaalsContact C-N 3.32Å; R1204-A1206 PolarHBondContact O-N 2.68Å; A1206-K1209 PolarHBondContact O-N 2.9Å; A1206-L1210 PolarHBondContact O-N 3.02Å; A1206-L1210 VanDerWaalsContact O-N 3.12Å
1207	S	85.6	Confident	79.2	Confident	66 Å²	66	31.2 Å²	31.2	46%	0.462	16%	0.158	S	C	.	.	H	α-helix	trans	-64.4	-44.2	175.7	-63.1	0	0	0	0	112.3	L1203 R1204 K1209 L1210 Q1211	L1203-S1207 PolarHBondContact O-N 3.5Å; L1203-S1207 PolarHBondContact O-OG 2.98Å; R1204-S1207 PolarHBondContact O-N 3.28Å; S1207-K1209 VanDerWaalsContact C-N 3.29Å; S1207-K1209 PolarHBondContact O-N 3.4Å; S1207-L1210 PolarHBondContact O-N 3.05Å; S1207-L1210 VanDerWaalsContact O-N 3.14Å; S1207-Q1211 WeakPolarHBondContact O-CB 3.32Å; S1207-Q1211 PolarHBondContact O-N 3.04Å
1208	E	76.1	Confident	77.6	Confident	52 Å²	52	31.9 Å²	31.9	24%	0.243	17%	0.165	C	C	.	.	H	α-helix	trans	-53.1	-44.6	173.6	-73.6	164.6	-165.4	0	0	111.8	R1204 M1212	R1204-E1208 IonicContact NE-OE1 2.76Å; R1204-E1208 VanDerWaalsContact O-CG 3.32Å; R1204-E1208 WeakPolarHBondContact O-CG 3.48Å; R1204-E1208 PolarHBondContact O-N 2.96Å; E1208-M1212 WeakPolarHBondContact O-CB 3.39Å; E1208-M1212 PolarHBondContact O-N 3.25Å
1209	K	73.7	Confident	75.7	Confident	8 Å²	8	32.2 Å²	32.2	4%	0.035	17%	0.167	C	C	.	.	H	α-helix	trans	-68.8	-34.5	178.1	-71.3	176.6	-172.2	-166.2	0	113.9	N801 F1166 P1168 Y1169 I1205 A1206 S1207 E1213 I1286	N801-K1209 WeakPolarHBondContact OD1-CE 3.28Å; N801-K1209 PolarHBondContact OD1-NZ 3.42Å; F1166-K1209 PolarHBondContact O-NZ 2.87Å; P1168-K1209 HydrophobicContact CG-CB 4.11Å; Y1169-K1209 PolarHBondContact OH-O 3.02Å; I1205-K1209 WeakPolarHBondContact O-CG 3.43Å; I1205-K1209 PolarHBondContact O-N 3.47Å; A1206-K1209 PolarHBondContact O-N 2.9Å; S1207-K1209 VanDerWaalsContact C-N 3.29Å; S1207-K1209 PolarHBondContact O-N 3.4Å; K1209-E1213 PolarHBondContact O-N 3.37Å; K1209-I1286 VanDerWaalsContact CE-CG2 3.48Å
1210	L	78.4	Confident	73.1	Confident	56 Å²	56	37.4 Å²	37.4	29%	0.293	20%	0.199	S	C	.	.	H	α-helix	trans	-69.6	-45.7	176.8	-169.3	78	0	0	0	110.2	A1206 S1207 M1212 E1213 Q1214	A1206-L1210 PolarHBondContact O-N 3.02Å; A1206-L1210 VanDerWaalsContact O-N 3.12Å; S1207-L1210 PolarHBondContact O-N 3.05Å; S1207-L1210 VanDerWaalsContact O-N 3.14Å; L1210-M1212 VanDerWaalsContact C-N 3.31Å; L1210-M1212 PolarHBondContact O-N 3.39Å; L1210-E1213 PolarHBondContact O-N 2.57Å; L1210-E1213 VanDerWaalsContact O-N 3.16Å; L1210-Q1214 PolarHBondContact O-N 2.96Å; L1210-Q1214 VanDerWaalsContact O-N 3.11Å
1211	Q	75.6	Confident	70.5	Confident	74 Å²	74	36.3 Å²	36.3	35%	0.346	20%	0.198	S	C	.	.	H	α-helix	trans	-62.8	-37.7	177.1	-157.8	-169.5	40.4	0	0	111.4	S1207 E1213 Q1214 N1215	S1207-Q1211 WeakPolarHBondContact O-CB 3.32Å; S1207-Q1211 PolarHBondContact O-N 3.04Å; Q1211-E1213 VanDerWaalsContact C-N 3.32Å; Q1211-E1213 PolarHBondContact O-N 3.25Å; Q1211-Q1214 PolarHBondContact O-N 2.67Å; Q1211-N1215 VanDerWaalsContact O-CB 3.27Å; Q1211-N1215 WeakPolarHBondContact O-CB 3.4Å; Q1211-N1215 PolarHBondContact O-N 2.8Å; Q1211-N1215 PolarHBondContact O-ND2 2.97Å; Q1211-N1215 VanDerWaalsContact O-ND2 3.15Å; Q1211-N1215 PolarHBondContact O-OD1 3.49Å
1212	M	66.3	Low	67.7	Low	34 Å²	34	43.6 Å²	43.6	17%	0.167	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-40.3	174.2	-169.2	-174.3	-63	0	0	112.5	L799 E1208 L1210 V1216	L799-M1212 HydrophobicContact CD2-CG 4.18Å; L799-M1212 HydrophobicContact CD2-SD 4.47Å; E1208-M1212 WeakPolarHBondContact O-CB 3.39Å; E1208-M1212 PolarHBondContact O-N 3.25Å; L1210-M1212 VanDerWaalsContact C-N 3.31Å; L1210-M1212 PolarHBondContact O-N 3.39Å; M1212-V1216 WeakPolarHBondContact O-CB 3.37Å; M1212-V1216 VanDerWaalsContact O-CG2 3.24Å; M1212-V1216 WeakPolarHBondContact O-CG2 3.49Å; M1212-V1216 PolarHBondContact O-N 2.94Å; M1212-V1216 VanDerWaalsContact O-N 3.11Å
1213	E	68	Low	65	Low	2 Å²	2	52.2 Å²	52.2	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-51.7	174.2	-177	-164.6	-144.4	0	0	111.4	R872 Y1169 R1172 K1209 L1210 Q1211 N1215 V1216 T1217	R872-E1213 IonicContact CZ-OE1 3.82Å; R872-E1213 VanDerWaalsContact NH1-CD 3.32Å; R872-E1213 IonicContact NH1-OE1 3.24Å; R872-E1213 PolarHBondContact NH1-OE1 2.68Å; R872-E1213 VanDerWaalsContact NH2-CD 3.31Å; R872-E1213 IonicContact NH2-OE1 2.74Å; R872-E1213 PolarHBondContact NH2-OE1 3.17Å; R872-E1213 VanDerWaalsContact NH2-OE1 3.11Å; R872-E1213 IonicContact NH2-OE2 2.79Å; R872-E1213 PolarHBondContact NH2-OE2 2.75Å; Y1169-E1213 WeakPolarHBondContact OH-CB 3.39Å; R1172-E1213 IonicContact NH1-OE2 3.8Å; K1209-E1213 PolarHBondContact O-N 3.37Å; L1210-E1213 PolarHBondContact O-N 2.57Å; L1210-E1213 VanDerWaalsContact O-N 3.16Å; Q1211-E1213 VanDerWaalsContact C-N 3.32Å; Q1211-E1213 PolarHBondContact O-N 3.25Å; E1213-N1215 VanDerWaalsContact C-N 3.25Å; E1213-N1215 PolarHBondContact O-N 3.4Å; E1213-V1216 PolarHBondContact O-N 2.93Å; E1213-V1216 VanDerWaalsContact O-N 3.08Å; E1213-T1217 HydrophobicContact CG-CG2 4.37Å; E1213-T1217 PolarHBondContact O-N 3.25Å; E1213-T1217 PolarHBondContact O-OG1 3.41Å
1214	Q	71	Confident	62.1	Low	52 Å²	52	57.1 Å²	57.1	24%	0.243	29%	0.29	C	S	.	.	H	α-helix	trans	-53.1	-45.5	179.4	-71.3	168.7	-44.8	0	0	111.3	L1210 Q1211 T1217 G1218 C1219 S1221	L1210-Q1214 PolarHBondContact O-N 2.96Å; L1210-Q1214 VanDerWaalsContact O-N 3.11Å; Q1211-Q1214 PolarHBondContact O-N 2.67Å; Q1214-T1217 PolarHBondContact O-N 2.88Å; Q1214-G1218 PolarHBondContact O-N 2.69Å; Q1214-C1219 PolarHBondContact O-N 3.22Å; Q1214-S1221 PolarHBondContact NE2-OG 3.25Å; Q1214-S1221 VanDerWaalsContact NE2-OG 3.14Å
1215	N	65.9	Low	59.3	Low	18 Å²	18	56.6 Å²	56.6	10%	0.096	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-43	177.7	-69	-18.7	0	0	0	112.8	R851 K863 Q1211 E1213 L1280	R851-N1215 PolarHBondContact NH2-ND2 3.36Å; K863-N1215 WeakPolarHBondContact CE-O 3.43Å; K863-N1215 PolarHBondContact NZ-O 3.26Å; Q1211-N1215 VanDerWaalsContact O-CB 3.27Å; Q1211-N1215 WeakPolarHBondContact O-CB 3.4Å; Q1211-N1215 PolarHBondContact O-N 2.8Å; Q1211-N1215 PolarHBondContact O-ND2 2.97Å; Q1211-N1215 VanDerWaalsContact O-ND2 3.15Å; Q1211-N1215 PolarHBondContact O-OD1 3.49Å; E1213-N1215 VanDerWaalsContact C-N 3.25Å; E1213-N1215 PolarHBondContact O-N 3.4Å; N1215-L1280 WeakPolarHBondContact OD1-CD1 3.17Å
1216	V	63.6	Low	56.7	Low	11 Å²	11	64.9 Å²	64.9	7%	0.067	34%	0.339	C	S	.	.	H	α-helix	trans	-71.4	-37.6	178.9	168.5	0	0	0	0	111.5	L799 L803 L859 K863 M1212 E1213	L799-V1216 HydrophobicContact CD2-CB 4.02Å; L799-V1216 HydrophobicContact CD2-CG1 4.24Å; L799-V1216 HydrophobicContact CD2-CG2 3.82Å; L803-V1216 HydrophobicContact CD2-CG1 4.41Å; L803-V1216 HydrophobicContact CD2-CG2 3.84Å; L859-V1216 HydrophobicContact CD1-CG2 3.83Å; K863-V1216 WeakPolarHBondContact CE-O 3.2Å; K863-V1216 WeakPolarHBondContact CG-O 3.32Å; M1212-V1216 WeakPolarHBondContact O-CB 3.37Å; M1212-V1216 VanDerWaalsContact O-CG2 3.24Å; M1212-V1216 WeakPolarHBondContact O-CG2 3.49Å; M1212-V1216 PolarHBondContact O-N 2.94Å; M1212-V1216 VanDerWaalsContact O-N 3.11Å; E1213-V1216 PolarHBondContact O-N 2.93Å; E1213-V1216 VanDerWaalsContact O-N 3.08Å
1217	T	63.1	Low	54	Low	13 Å²	13	73.5 Å²	73.5	8%	0.08	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	11.9	-175.6	71.1	0	0	0	0	115.1	P798 R872 E1213 Q1214 C1219 W1271	P798-T1217 HydrophobicContact CG-CG2 4.25Å; R872-T1217 PolarHBondContact NH1-OG1 3.1Å; E1213-T1217 HydrophobicContact CG-CG2 4.37Å; E1213-T1217 PolarHBondContact O-N 3.25Å; E1213-T1217 PolarHBondContact O-OG1 3.41Å; Q1214-T1217 PolarHBondContact O-N 2.88Å; T1217-C1219 PolarHBondContact O-N 3.34Å; T1217-C1219 PolarHBondContact O-SG 3.46Å; T1217-C1219 VanDerWaalsContact O-SG 3.4Å; T1217-W1271 WeakPolarHBondContact O-CH2 3.21Å; T1217-W1271 WeakPolarHBondContact O-CZ2 3.49Å
1218	G	56.6	Low	51.3	Low	14 Å²	14	76 Å²	76	14%	0.144	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	9	168.8	0	0	0	0	0	115.9	Q1214	Q1214-G1218 PolarHBondContact O-N 2.69Å
1219	C	48.4	Very low	48.9	Very low	11 Å²	11	82.4 Å²	82.4	7%	0.074	42%	0.42	C	S	.	.			trans	-102.8	89	-176.6	-66.1	0	0	0	0	110.4	L874 Q1214 T1217 S1221	L874-C1219 HydrophobicContact CD1-CB 3.81Å; Q1214-C1219 PolarHBondContact O-N 3.22Å; T1217-C1219 PolarHBondContact O-N 3.34Å; T1217-C1219 PolarHBondContact O-SG 3.46Å; T1217-C1219 VanDerWaalsContact O-SG 3.4Å; C1219-S1221 PolarHBondContact O-N 2.64Å
1220	V	36.7	Very low	46.7	Very low	108 Å²	108	91.6 Å²	91.6	66%	0.655	46%	0.463	S	S	*	.			trans	-68.8	125.8	162.6	-176.2	0	0	0	0	108
1221	S	34	Very low	44.3	Very low	44 Å²	44	94.1 Å²	94.1	31%	0.308	49%	0.486	S	S	.	.			trans	-98.1	120.6	169.5	50	0	0	0	0	108.6	Q1214 C1219 Y1223	Q1214-S1221 PolarHBondContact NE2-OG 3.25Å; Q1214-S1221 VanDerWaalsContact NE2-OG 3.14Å; C1219-S1221 PolarHBondContact O-N 2.64Å; S1221-Y1223 PolarHBondContact O-N 3.22Å
1222	E	28.6	Very low	42	Very low	165 Å²	165	99.6 Å²	99.6	77%	0.771	51%	0.511	S	S	*	.	S	Bend	trans	-72.6	32.3	-169.4	-60.1	171.6	139.6	0	0	114.3
1223	Y	31	Very low	40.1	Very low	181 Å²	181	105 Å²	105	71%	0.71	54%	0.541	S	S	*	.			trans	-110	9.9	-166	-72.1	-59.9	0	0	0	116.1	S1221	S1221-Y1223 PolarHBondContact O-N 3.22Å
1224	N	29	Very low	38.1	Very low	141 Å²	141	111.7 Å²	111.7	75%	0.754	58%	0.582	S	S	*	*	S	Bend	trans	-126.2	10.9	-172	-84.7	53.8	0	0	0	114.8
1225	T	27.2	Very low	36	Very low	115 Å²	115	115 Å²	115	71%	0.706	61%	0.606	S	S	*	*	S	Bend	trans	-96.3	-8.6	-170.2	-30.6	0	0	0	0	114.5
1226	E	27.2	Very low	34.3	Very low	188 Å²	188	125.7 Å²	125.7	88%	0.879	65%	0.645	S	S	*	*	S	Bend	trans	-110.1	14.6	-165.6	-61.9	-177.9	156.5	0	0	114.7
1227	Q	27.7	Very low	32.5	Very low	191 Å²	191	132.4 Å²	132.4	89%	0.893	69%	0.686	S	S	*	*	S	Bend	trans	-128.5	25.1	-175.2	-68.5	-166.3	-22.3	0	0	115.1
1228	T	28.3	Very low	30.8	Very low	119 Å²	119	136.5 Å²	136.5	73%	0.73	72%	0.715	S	S	*	*	S	Bend	trans	-135.6	7	-176.4	-21.4	0	0	0	0	115.3
1229	E	26.4	Very low	29.6	Very low	186 Å²	186	140.5 Å²	140.5	87%	0.869	74%	0.741	S	S	*	*	S	Bend	trans	-121.7	-1.1	-174.3	-62.3	-165.5	161.4	0	0	115.5
1230	E	28	Very low	28.7	Very low	200 Å²	200	151.1 Å²	151.1	94%	0.935	78%	0.779	S	S	*	*	S	Bend	trans	-105.7	14.4	-173.2	-65.1	-157.7	135.9	0	0	116.1
1231	S	28.1	Very low	28.2	Very low	110 Å²	110	150.9 Å²	150.9	77%	0.769	78%	0.782	S	S	*	*	S	Bend	trans	-129.8	12.2	-173.5	56.3	0	0	0	0	117.5
1232	E	26.9	Very low	28.1	Very low	188 Å²	188	159.8 Å²	159.8	88%	0.879	81%	0.809	S	S	*	*	S	Bend	trans	-128.9	42.3	177.6	-69.5	-156.6	150	0	0	115.8
1233	D	26.6	Very low	28.2	Very low	147 Å²	147	163.1 Å²	163.1	79%	0.786	82%	0.815	S	S	*	*			trans	-151.2	87.2	163.9	-145.6	-11.9	0	0	0	116.5
1234	T	25.9	Very low	28.3	Very low	143 Å²	143	158.9 Å²	158.9	88%	0.877	81%	0.812	S	S	*	*			trans	-136.7	15	168.1	45.9	0	0	0	0	115
1235	T	27.7	Very low	28.5	Very low	122 Å²	122	161.6 Å²	161.6	75%	0.748	82%	0.817	S	S	*	*	S	Bend	trans	-143.5	73.3	175.7	49.5	0	0	0	0	116.2
1236	R	29.1	Very low	28.7	Very low	243 Å²	243	161 Å²	161	92%	0.917	82%	0.817	S	S	*	*				178.7	110	127.6	-97	150.2	-175.9	175.6	2.4	114.2	S1238	R1236-S1238 PolarHBondContact O-N 3.22Å
1237	V	27.1	Very low	28.8	Very low	151 Å²	151	158 Å²	158	92%	0.915	81%	0.812	S	S	*	*			trans	-74.5	119.7	161	178	0	0	0	0	109.4
1238	S	26.5	Very low	28.7	Very low	99 Å²	99	156.4 Å²	156.4	69%	0.692	81%	0.809	S	S	*	*				160.1	129.1	122.4	-168.5	0	0	0	0	115.7	R1236	R1236-S1238 PolarHBondContact O-N 3.22Å
1239	S	30.7	Very low	28.9	Very low	98 Å²	98	158.9 Å²	158.9	69%	0.685	82%	0.816	S	S	*	*			trans	85.4	122.2	144.3	79.6	0	0	0	0	123.2
1240	R	29.3	Very low	29	Very low	235 Å²	235	157.2 Å²	157.2	89%	0.887	81%	0.813	S	S	*	*			trans	86.1	82.7	133.7	-73.9	173	172.8	-179.5	-1.5	122.8
1241	S	28	Very low	29	Very low	103 Å²	103	153.2 Å²	153.2	72%	0.72	80%	0.804	S	S	*	*				64	112.6	102.6	-158.9	0	0	0	0	122
1242	R	31.6	Very low	29.3	Very low	230 Å²	230	154.3 Å²	154.3	87%	0.868	81%	0.809	S	S	*	*				148.7	111	127.2	-81	167.4	-177	-173.5	-0.5	110.1
1243	R	29	Very low	29.3	Very low	235 Å²	235	150.3 Å²	150.3	89%	0.887	80%	0.802	S	S	*	*				86	106.9	50.9	-172.4	-166.3	-153.9	-169.1	9.8	113.8
1244	S	34.5	Very low	29.3	Very low	93 Å²	93	148 Å²	148	65%	0.65	80%	0.797	S	S	*	*				173.3	120.3	125	-79.8	0	0	0	0	116.5
1245	K	33.4	Very low	29.4	Very low	198 Å²	198	149.4 Å²	149.4	86%	0.861	80%	0.798	S	S	*	*			trans	64.2	148.4	139.6	-57.6	174.1	-175.9	-179.6	0	118.8
1246	S	30.4	Very low	29.3	Very low	102 Å²	102	151.1 Å²	151.1	71%	0.713	80%	0.802	S	S	*	*			cis	-171.7	155.9	-12.3	47.8	0	0	0	0	107
1247	T	30.1	Very low	29.1	Very low	126 Å²	126	142.7 Å²	142.7	77%	0.773	79%	0.792	S	S	*	*			cis	-160.3	153.7	46	46.1	0	0	0	0	112.5
1248	N	24.9	Very low	29.1	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	79%	0.791	S	S	*	*			trans	-109.6	152.6	174.5	-63.2	-4.7	0	0	0	112.7
1249	I	32.2	Very low	29.2	Very low	171 Å²	171	146.2 Å²	146.2	88%	0.877	80%	0.799	S	S	*	*			trans	-139.7	147	154.1	-61.3	-174.4	0	0	0	108.5
1250	L	29.4	Very low	28.9	Very low	151 Å²	151	150.6 Å²	150.6	79%	0.791	81%	0.809	S	S	*	*			trans	-97.5	162	-169.7	-74	78.1	0	0	0	114.1
1251	P	27.8	Very low	28.8	Very low	117 Å²	117	146.8 Å²	146.8	76%	0.76	81%	0.806	S	S	*	*			trans	-91.9	156	167.5	37.2	-34.2	0	0	0	113.6
1252	P	33.9	Very low	28.8	Very low	133 Å²	133	144.5 Å²	144.5	86%	0.864	80%	0.798	S	S	*	*			trans	-106.2	172	165.7	38.9	-31.4	0	0	0	113.3
1253	S	26.5	Very low	28.7	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	80%	0.8	S	S	*	*			trans	-113.4	174.5	-170.6	60.8	0	0	0	0	115.1
1254	S	26.7	Very low	28.8	Very low	98 Å²	98	135.3 Å²	135.3	69%	0.685	79%	0.788	S	S	*	*			trans	59.7	108.7	148.3	56.5	0	0	0	0	120.1
1255	L	29.6	Very low	28.4	Very low	172 Å²	172	136 Å²	136	90%	0.901	78%	0.779	S	S	*	*			trans	-159.2	139.3	131.6	-115.6	161.3	0	0	0	109.9
1256	D	25	Very low	28.1	Very low	158 Å²	158	135.7 Å²	135.7	85%	0.845	78%	0.778	S	S	*	*			trans	-83.3	161.3	-172.6	-57.6	-81.1	0	0	0	114
1257	G	25.6	Very low	28.2	Very low	67 Å²	67	132.9 Å²	132.9	69%	0.691	76%	0.756	S	S	*	*			trans	142.4	109.4	154.7	0	0	0	0	0	117.7
1258	M	25.9	Very low	28.3	Very low	183 Å²	183	129.2 Å²	129.2	90%	0.901	73%	0.732	S	S	*	*			trans	73.1	137	145.9	-56.3	178.3	175.7	0	0	121.2
1259	T	28.5	Very low	28.3	Very low	140 Å²	140	124.4 Å²	124.4	86%	0.859	72%	0.719	S	S	*	*			trans	70	98.6	168.9	64.8	0	0	0	0	118.9	N1261	T1259-N1261 PolarHBondContact O-N 3.39Å
1260	E	24.6	Very low	28.3	Very low	191 Å²	191	121 Å²	121	89%	0.893	70%	0.702	S	S	*	*			trans	-69.1	106.2	163.8	-59	177.5	117.2	0	0	111
1261	N	27.6	Very low	28.3	Very low	155 Å²	155	117.6 Å²	117.6	83%	0.829	68%	0.679	S	S	*	*			trans	-166.4	20.9	161.5	-105.1	-50.7	0	0	0	115.2	T1259	T1259-N1261 PolarHBondContact O-N 3.39Å
1262	G	28.3	Very low	28.3	Very low	54 Å²	54	116.6 Å²	116.6	56%	0.557	67%	0.667	S	S	*	*			trans	-80.3	-24.8	-165.1	0	0	0	0	0	118.4	V1264	G1262-V1264 PolarHBondContact O-N 2.82Å
1263	N	29.5	Very low	28	Very low	169 Å²	169	114 Å²	114	90%	0.904	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-83.3	-1.6	-156.6	-78.6	-16	0	0	0	117.3	F1265	N1263-F1265 PolarHBondContact O-N 3.04Å
1264	V	30.6	Very low	28.1	Very low	103 Å²	103	110.2 Å²	110.2	62%	0.624	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-71.6	-9.6	179.8	-175.2	0	0	0	0	112.7	G1262 V1267	G1262-V1264 PolarHBondContact O-N 2.82Å; V1264-V1267 WeakPolarHBondContact O-CG2 3.48Å
1265	F	27	Very low	28.2	Very low	108 Å²	108	108.3 Å²	108.3	47%	0.474	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-99.5	3.4	-156.1	-82.6	-30.8	0	0	0	118.6	K433 N1263	K433-F1265 HydrophobicContact CD-CD1 3.5Å; K433-F1265 HydrophobicContact CD-CE1 3.8Å; K433-F1265 HydrophobicContact CD-CG 4.22Å; K433-F1265 VanDerWaalsContact CE-CB 3.48Å; K433-F1265 VanDerWaalsContact CE-CG 3.42Å; K433-F1265 VanDerWaalsContact CE-O 3.32Å; K433-F1265 WeakPolarHBondContact CE-O 3.41Å; K433-F1265 HydrophobicContact CG-CD1 4.19Å; K433-F1265 VanDerWaalsContact NZ-CD2 3.33Å; N1263-F1265 PolarHBondContact O-N 3.04Å
1266	K	25.6	Very low	28.1	Very low	191 Å²	191	104.6 Å²	104.6	83%	0.83	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-83.9	-15.2	173.8	-94.7	-172.8	173.5	-175.2	0	115	L1268	K1266-L1268 PolarHBondContact O-N 3.42Å
1267	V	33.8	Very low	28.3	Very low	43 Å²	43	102.8 Å²	102.8	26%	0.261	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.4	-25.1	-149.5	175.2	0	0	0	0	117	Q877 V1264	Q877-V1267 HydrophobicContact CB-CG1 3.85Å; Q877-V1267 HydrophobicContact CG-CG1 4.01Å; V1264-V1267 WeakPolarHBondContact O-CG2 3.48Å
1268	L	30.8	Very low	28.4	Very low	50 Å²	50	101.5 Å²	101.5	26%	0.262	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.3	6.7	-165.2	-87.7	139.1	0	0	0	117.3	K433 K1266 N1270	K433-L1268 VanDerWaalsContact O-CD1 3.24Å; K433-L1268 WeakPolarHBondContact O-CD1 3.37Å; K1266-L1268 PolarHBondContact O-N 3.42Å; L1268-N1270 VanDerWaalsContact C-N 3.3Å; L1268-N1270 PolarHBondContact O-N 3.26Å
1269	G	26.4	Very low	28.4	Very low	54 Å²	54	98.1 Å²	98.1	56%	0.557	57%	0.568	S	S	*	*	S	Bend	trans	-66.4	-31.5	172.8	0	0	0	0	0	113.6	W1271	G1269-W1271 VanDerWaalsContact C-N 3.34Å; G1269-W1271 PolarHBondContact O-N 3.39Å
1270	N	30.7	Very low	28.7	Very low	100 Å²	100	93.8 Å²	93.8	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-71.4	-22.6	-163.2	-63.7	22.1	0	0	0	114.4	L1268 N1272 S1273 A1274	L1268-N1270 VanDerWaalsContact C-N 3.3Å; L1268-N1270 PolarHBondContact O-N 3.26Å; N1270-N1272 VanDerWaalsContact C-N 3.28Å; N1270-N1272 PolarHBondContact O-N 3.13Å; N1270-S1273 PolarHBondContact O-N 2.94Å; N1270-A1274 WeakPolarHBondContact O-CB 3.45Å; N1270-A1274 PolarHBondContact O-N 3.39Å
1271	W	29.8	Very low	28.8	Very low	79 Å²	79	86.3 Å²	86.3	30%	0.299	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-33.7	-177.6	-76.8	74.9	0	0	0	113.5	T1217 G1269	T1217-W1271 WeakPolarHBondContact O-CH2 3.21Å; T1217-W1271 WeakPolarHBondContact O-CZ2 3.49Å; G1269-W1271 VanDerWaalsContact C-N 3.34Å; G1269-W1271 PolarHBondContact O-N 3.39Å
1272	N	27.6	Very low	29	Very low	97 Å²	97	82.5 Å²	82.5	52%	0.519	49%	0.487	S	S	.	.	H	α-helix	trans	-93.8	-18.8	177.9	-72.9	4.9	0	0	0	113.1	N1270	N1270-N1272 VanDerWaalsContact C-N 3.28Å; N1270-N1272 PolarHBondContact O-N 3.13Å
1273	S	27.4	Very low	29.1	Very low	77 Å²	77	83.1 Å²	83.1	54%	0.538	48%	0.48	S	S	.	.	H	α-helix	trans	-86.7	-28.1	178.6	-158.2	0	0	0	0	112.7	N1270 A1275 S1276	N1270-S1273 PolarHBondContact O-N 2.94Å; S1273-A1275 PolarHBondContact O-N 2.88Å; S1273-S1276 PolarHBondContact O-OG 3.5Å
1274	A	30.1	Very low	29.2	Very low	25 Å²	25	78.3 Å²	78.3	21%	0.207	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-1.2	176.5	0	0	0	0	0	113.6	N1270 L1278	N1270-A1274 WeakPolarHBondContact O-CB 3.45Å; N1270-A1274 PolarHBondContact O-N 3.39Å; A1274-L1278 HydrophobicContact CB-CD1 4.37Å; A1274-L1278 WeakPolarHBondContact O-CD1 3.42Å; A1274-L1278 VanDerWaalsContact O-CG 3.24Å; A1274-L1278 WeakPolarHBondContact O-CG 3.25Å
1275	A	28	Very low	29.3	Very low	58 Å²	58	74.8 Å²	74.8	48%	0.479	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1.4	-175	0	0	0	0	0	114.7	S1273	S1273-A1275 PolarHBondContact O-N 2.88Å
1276	S	27.3	Very low	29.6	Very low	94 Å²	94	69.9 Å²	69.9	66%	0.657	41%	0.412	S	S	*	.	S	Bend	trans	-115.6	-13.3	178.7	49.1	0	0	0	0	114.9	S1273	S1273-S1276 PolarHBondContact O-OG 3.5Å
1277	D	28.4	Very low	29.9	Very low	121 Å²	121	63.6 Å²	63.6	65%	0.647	39%	0.392	S	S	*	.			trans	-123.3	8.8	-159	-64.1	22.3	0	0	0	113.3	S1279	D1277-S1279 PolarHBondContact O-N 3.35Å
1278	L	29.6	Very low	29.8	Very low	39 Å²	39	63.9 Å²	63.9	20%	0.204	40%	0.396	C	S	.	.			trans	-98.8	59.9	-167.1	-74.9	178	0	0	0	115.4	A1274 L1280	A1274-L1278 HydrophobicContact CB-CD1 4.37Å; A1274-L1278 WeakPolarHBondContact O-CD1 3.42Å; A1274-L1278 VanDerWaalsContact O-CG 3.24Å; A1274-L1278 WeakPolarHBondContact O-CG 3.25Å; L1278-L1280 VanDerWaalsContact C-N 3.32Å; L1278-L1280 HydrophobicContact CD2-CD1 3.92Å; L1278-L1280 HydrophobicContact CD2-CG 4.5Å; L1278-L1280 PolarHBondContact O-N 3.04Å
1279	S	24.8	Very low	30.2	Very low	113 Å²	113	65.2 Å²	65.2	79%	0.79	40%	0.403	S	S	*	.			trans	-65.3	88.1	165.1	62	0	0	0	0	111.3	D1277	D1277-S1279 PolarHBondContact O-N 3.35Å
1280	L	34.8	Very low	31.1	Very low	48 Å²	48	72.3 Å²	72.3	25%	0.251	41%	0.413	S	S	.	.			trans	-131.2	154.9	-179.5	-70.7	176.5	0	0	0	110.9	R851 N1215 L1278	R851-L1280 WeakPolarHBondContact CD-O 3.36Å; R851-L1280 WeakPolarHBondContact CG-O 3.32Å; R851-L1280 PolarHBondContact NE-O 3.13Å; R851-L1280 VanDerWaalsContact NH2-CB 3.31Å; N1215-L1280 WeakPolarHBondContact OD1-CD1 3.17Å; L1278-L1280 VanDerWaalsContact C-N 3.32Å; L1278-L1280 HydrophobicContact CD2-CD1 3.92Å; L1278-L1280 HydrophobicContact CD2-CG 4.5Å; L1278-L1280 PolarHBondContact O-N 3.04Å
1281	S	26.5	Very low	32.1	Very low	35 Å²	35	69.1 Å²	69.1	25%	0.245	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-84.1	147.2	175.9	41.4	0	0	0	0	113.1	P849 R851	P849-S1281 WeakPolarHBondContact O-CA 3.46Å; P849-S1281 WeakPolarHBondContact O-CB 3.22Å; R851-S1281 VanDerWaalsContact NE-C 3.3Å; R851-S1281 PolarHBondContact NE-O 2.97Å; R851-S1281 PolarHBondContact NH2-O 3.4Å
1282	I	33.1	Very low	33.3	Very low	75 Å²	75	66.3 Å²	66.3	39%	0.385	39%	0.388	S	S	.	.			trans	-123.1	130.1	158.7	-93.5	163	0	0	0	107.5	R851	R851-I1282 HydrophobicContact CG-CB 4.18Å; R851-I1282 VanDerWaalsContact NE-CG1 3.32Å
1283	V	29.9	Very low	34.7	Very low	67 Å²	67	67 Å²	67	41%	0.406	39%	0.388	S	S	.	.			trans	-139.6	139.8	172.9	-172.6	0	0	0	0	107.3	P849	P849-V1283 HydrophobicContact CG-CG2 3.76Å
1284	N	30.7	Very low	36.3	Very low	68 Å²	68	72.2 Å²	72.2	36%	0.364	40%	0.396	S	S	.	.			trans	63.2	120	172.8	-64.6	-32.3	0	0	0	119.7	I1286	N1284-I1286 PolarHBondContact O-N 3.15Å
1285	P	32.3	Very low	37.7	Very low	29 Å²	29	71.8 Å²	71.8	19%	0.188	39%	0.39	C	S	.	.			trans	-92.2	89.8	174.1	36.8	-36.6	0	0	0	112.7	S833 P835	S833-P1285 WeakPolarHBondContact O-CB 3.45Å; S833-P1285 WeakPolarHBondContact O-CD 3.46Å; S833-P1285 WeakPolarHBondContact O-CG 3.49Å; P835-P1285 VanDerWaalsContact CD-CD 3.44Å
1286	I	34.4	Very low	39.4	Very low	5 Å²	5	69.4 Å²	69.4	3%	0.026	37%	0.37	C	S	.	.			trans	-74.4	134.4	179.6	-61.6	174	0	0	0	109.6	N801 I1205 K1209 N1284 D1295	N801-I1286 CarbonylContact C-O 3.58Å; N801-I1286 VanDerWaalsContact CB-O 3.31Å; N801-I1286 WeakPolarHBondContact CB-O 3.28Å; I1205-I1286 HydrophobicContact CB-CD1 4.41Å; I1205-I1286 HydrophobicContact CD1-CD1 4.42Å; I1205-I1286 HydrophobicContact CG1-CD1 4.31Å; I1205-I1286 HydrophobicContact CG2-CD1 3.48Å; I1205-I1286 VanDerWaalsContact CG2-CD1 3.48Å; K1209-I1286 VanDerWaalsContact CE-CG2 3.48Å; N1284-I1286 PolarHBondContact O-N 3.15Å; I1286-D1295 WeakPolarHBondContact CG2-OD2 3.44Å
1287	S	31.1	Very low	41.3	Very low	58 Å²	58	71.6 Å²	71.6	41%	0.406	36%	0.364	S	S	.	.			trans	-119.2	115.4	-172.8	71.4	0	0	0	0	113.1	R1290	S1287-R1290 VanDerWaalsContact O-O 3.08Å
1288	S	32.2	Very low	43.3	Very low	50 Å²	50	68.3 Å²	68.3	35%	0.35	35%	0.35	S	S	.	.	S	Bend	trans	77.6	170.1	171.6	89.5	0	0	0	0	117.7	R1290	S1288-R1290 CarbonylContact O-C 3.55Å; S1288-R1290 PolarHBondContact O-N 2.96Å; S1288-R1290 VanDerWaalsContact O-O 3.1Å; S1288-R1290 PolarHBondContact OG-N 3.11Å; S1288-R1290 PolarHBondContact OG-O 2.92Å
1289	N	38.9	Very low	45.2	Very low	78 Å²	78	66.6 Å²	66.6	42%	0.417	34%	0.341	S	S	.	.	S	Bend	trans	-75.2	23	172.9	-74	4.5	0	0	0	113.7	K773	K773-N1289 VanDerWaalsContact CE-OD1 3.31Å; K773-N1289 WeakPolarHBondContact CE-OD1 3.43Å; K773-N1289 PolarHBondContact NZ-OD1 3.45Å
1290	R	44.8	Very low	47.3	Very low	203 Å²	203	61.4 Å²	61.4	77%	0.766	30%	0.304	S	S	*	.	S	Bend	trans	-122.6	129.3	152.5	-67.4	179.7	179.9	172.6	0.8	105	S1287 S1288 S1292	S1287-R1290 VanDerWaalsContact O-O 3.08Å; S1288-R1290 CarbonylContact O-C 3.55Å; S1288-R1290 PolarHBondContact O-N 2.96Å; S1288-R1290 VanDerWaalsContact O-O 3.1Å; S1288-R1290 PolarHBondContact OG-N 3.11Å; S1288-R1290 PolarHBondContact OG-O 2.92Å; R1290-S1292 PolarHBondContact O-N 2.69Å
1291	I	53.2	Low	49	Very low	32 Å²	32	60.9 Å²	60.9	16%	0.164	31%	0.305	C	S	.	.			trans	-40.3	126.9	163.5	-39.8	157.2	0	0	0	106.9	F1166 D1295 V1296	F1166-I1291 HydrophobicContact CB-CD1 4.4Å; F1166-I1291 HydrophobicContact CB-CG1 3.82Å; F1166-I1291 HydrophobicContact CD1-CD1 3.46Å; F1166-I1291 VanDerWaalsContact CD1-CD1 3.46Å; F1166-I1291 HydrophobicContact CD1-CG1 3.63Å; F1166-I1291 HydrophobicContact CD2-CD1 3.72Å; F1166-I1291 HydrophobicContact CD2-CG1 4.06Å; F1166-I1291 HydrophobicContact CE1-CD1 3.41Å; F1166-I1291 VanDerWaalsContact CE1-CD1 3.41Å; F1166-I1291 HydrophobicContact CE1-CG1 4.13Å; F1166-I1291 HydrophobicContact CE2-CD1 3.7Å; F1166-I1291 HydrophobicContact CG-CD1 3.6Å; F1166-I1291 HydrophobicContact CG-CG1 3.57Å; F1166-I1291 HydrophobicContact CZ-CD1 3.55Å; I1291-D1295 HydrophobicContact CG2-CB 3.72Å; I1291-D1295 WeakPolarHBondContact CG2-OD2 3.3Å; I1291-V1296 HydrophobicContact CB-CG2 3.53Å; I1291-V1296 HydrophobicContact CD1-CG2 3.91Å; I1291-V1296 HydrophobicContact CG1-CG2 4.36Å; I1291-V1296 HydrophobicContact CG2-CB 4.38Å; I1291-V1296 HydrophobicContact CG2-CG2 3.47Å; I1291-V1296 VanDerWaalsContact CG2-CG2 3.47Å
1292	S	55.2	Low	51	Low	20 Å²	20	61.1 Å²	61.1	14%	0.14	30%	0.304	C	S	.	.			trans	-62.8	149.3	175.5	106.4	0	0	0	0	107.7	R1290 R1294 D1295 V1296	R1290-S1292 PolarHBondContact O-N 2.69Å; S1292-R1294 PolarHBondContact O-N 2.93Å; S1292-R1294 WeakPolarHBondContact OG-CB 3.43Å; S1292-R1294 PolarHBondContact OG-N 3.46Å; S1292-D1295 WeakPolarHBondContact CB-OD1 3.35Å; S1292-D1295 PolarHBondContact N-OD2 3.49Å; S1292-D1295 PolarHBondContact O-N 3.06Å; S1292-D1295 PolarHBondContact OG-N 2.93Å; S1292-D1295 PolarHBondContact OG-OD1 3.22Å; S1292-V1296 WeakPolarHBondContact O-CG2 3.42Å; S1292-V1296 PolarHBondContact O-N 2.94Å
1293	E	56.9	Low	52.6	Low	111 Å²	111	57.9 Å²	57.9	52%	0.519	29%	0.288	S	S	.	.	H	α-helix	trans	-61.1	-18.8	-178.4	-151.6	-172.4	139.3	0	0	111.8	R1297	E1293-R1297 VanDerWaalsContact O-CB 3.26Å; E1293-R1297 WeakPolarHBondContact O-CB 3.34Å; E1293-R1297 VanDerWaalsContact O-CD 3.23Å; E1293-R1297 WeakPolarHBondContact O-CD 3.18Å; E1293-R1297 WeakPolarHBondContact O-CG 3.39Å; E1293-R1297 PolarHBondContact O-N 3.11Å; E1293-R1297 IonicContact OE1-CZ 3.82Å; E1293-R1297 VanDerWaalsContact OE1-CZ 3.28Å; E1293-R1297 IonicContact OE1-NE 3.11Å; E1293-R1297 PolarHBondContact OE1-NE 2.91Å; E1293-R1297 IonicContact OE1-NH2 3.39Å; E1293-R1297 PolarHBondContact OE1-NH2 3.09Å
1294	R	60	Low	54.4	Low	188 Å²	188	55.7 Å²	55.7	71%	0.709	27%	0.274	S	S	*	.	H	α-helix	trans	-70.5	-50.6	170.5	-60.5	178.6	177.3	173.3	-3	111.9	S1292 V1296 R1297 S1298	S1292-R1294 PolarHBondContact O-N 2.93Å; S1292-R1294 WeakPolarHBondContact OG-CB 3.43Å; S1292-R1294 PolarHBondContact OG-N 3.46Å; R1294-V1296 VanDerWaalsContact C-N 3.32Å; R1294-V1296 PolarHBondContact O-N 3.37Å; R1294-R1297 CarbonylContact O-C 3.58Å; R1294-R1297 WeakPolarHBondContact O-CA 3.33Å; R1294-R1297 PolarHBondContact O-N 3.02Å; R1294-R1297 VanDerWaalsContact O-N 3.09Å; R1294-S1298 WeakPolarHBondContact O-CB 3.29Å; R1294-S1298 PolarHBondContact O-N 3.47Å
1295	D	60.1	Low	56	Low	16 Å²	16	58.8 Å²	58.8	9%	0.086	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-30.8	178.4	13.7	-54.2	0	0	0	111.9	I1205 I1286 I1291 S1292 S1298 L1299	I1205-D1295 HydrophobicContact CD1-CB 4.26Å; I1286-D1295 WeakPolarHBondContact CG2-OD2 3.44Å; I1291-D1295 HydrophobicContact CG2-CB 3.72Å; I1291-D1295 WeakPolarHBondContact CG2-OD2 3.3Å; S1292-D1295 WeakPolarHBondContact CB-OD1 3.35Å; S1292-D1295 PolarHBondContact N-OD2 3.49Å; S1292-D1295 PolarHBondContact O-N 3.06Å; S1292-D1295 PolarHBondContact OG-N 2.93Å; S1292-D1295 PolarHBondContact OG-OD1 3.22Å; D1295-S1298 PolarHBondContact O-N 3.45Å; D1295-L1299 VanDerWaalsContact O-CB 3.27Å; D1295-L1299 WeakPolarHBondContact O-CB 3.45Å; D1295-L1299 VanDerWaalsContact O-CG 3.3Å; D1295-L1299 WeakPolarHBondContact O-CG 3.47Å; D1295-L1299 PolarHBondContact O-N 3.34Å
1296	V	64	Low	57.1	Low	8 Å²	8	63.2 Å²	63.2	5%	0.048	31%	0.305	C	S	.	.	H	α-helix	trans	-62.1	-46.7	167.1	-176.1	0	0	0	0	110.8	P985 V989 I1291 S1292 R1294 S1298 L1300	P985-V1296 HydrophobicContact CB-CG1 3.63Å; V989-V1296 HydrophobicContact CB-CG1 4.45Å; V989-V1296 HydrophobicContact CG2-CG1 3.92Å; I1291-V1296 HydrophobicContact CB-CG2 3.53Å; I1291-V1296 HydrophobicContact CD1-CG2 3.91Å; I1291-V1296 HydrophobicContact CG1-CG2 4.36Å; I1291-V1296 HydrophobicContact CG2-CB 4.38Å; I1291-V1296 HydrophobicContact CG2-CG2 3.47Å; I1291-V1296 VanDerWaalsContact CG2-CG2 3.47Å; S1292-V1296 WeakPolarHBondContact O-CG2 3.42Å; S1292-V1296 PolarHBondContact O-N 2.94Å; R1294-V1296 VanDerWaalsContact C-N 3.32Å; R1294-V1296 PolarHBondContact O-N 3.37Å; V1296-S1298 VanDerWaalsContact C-N 3.33Å; V1296-L1300 WeakPolarHBondContact O-CB 3.45Å; V1296-L1300 PolarHBondContact O-N 2.9Å
1297	R	67.4	Low	58.3	Low	139 Å²	139	66.1 Å²	66.1	53%	0.525	32%	0.319	S	S	.	.	H	α-helix	trans	-70.3	-26.1	178.3	-72.6	166.8	-175.9	-142.1	6.4	113	E1293 R1294 S1301	E1293-R1297 VanDerWaalsContact O-CB 3.26Å; E1293-R1297 WeakPolarHBondContact O-CB 3.34Å; E1293-R1297 VanDerWaalsContact O-CD 3.23Å; E1293-R1297 WeakPolarHBondContact O-CD 3.18Å; E1293-R1297 WeakPolarHBondContact O-CG 3.39Å; E1293-R1297 PolarHBondContact O-N 3.11Å; E1293-R1297 IonicContact OE1-CZ 3.82Å; E1293-R1297 VanDerWaalsContact OE1-CZ 3.28Å; E1293-R1297 IonicContact OE1-NE 3.11Å; E1293-R1297 PolarHBondContact OE1-NE 2.91Å; E1293-R1297 IonicContact OE1-NH2 3.39Å; E1293-R1297 PolarHBondContact OE1-NH2 3.09Å; R1294-R1297 CarbonylContact O-C 3.58Å; R1294-R1297 WeakPolarHBondContact O-CA 3.33Å; R1294-R1297 PolarHBondContact O-N 3.02Å; R1294-R1297 VanDerWaalsContact O-N 3.09Å; R1297-S1301 VanDerWaalsContact O-CB 3.25Å; R1297-S1301 WeakPolarHBondContact O-CB 3.39Å; R1297-S1301 PolarHBondContact O-N 3.27Å
1298	S	70.2	Confident	59.7	Low	52 Å²	52	66.5 Å²	66.5	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-79.4	-49.7	178.2	-160.1	0	0	0	0	110.3	R1294 D1295 V1296 L1300 S1301 D1302	R1294-S1298 WeakPolarHBondContact O-CB 3.29Å; R1294-S1298 PolarHBondContact O-N 3.47Å; D1295-S1298 PolarHBondContact O-N 3.45Å; V1296-S1298 VanDerWaalsContact C-N 3.33Å; S1298-L1300 VanDerWaalsContact C-N 3.26Å; S1298-L1300 PolarHBondContact O-N 2.88Å; S1298-S1301 CarbonylContact O-C 3.58Å; S1298-S1301 WeakPolarHBondContact O-CA 3.48Å; S1298-S1301 WeakPolarHBondContact O-CB 3.36Å; S1298-S1301 PolarHBondContact O-N 2.7Å; S1298-D1302 PolarHBondContact O-N 2.92Å
1299	L	68.2	Low	61.2	Low	3 Å²	3	67.4 Å²	67.4	2%	0.016	31%	0.313	C	S	.	.	H	α-helix	trans	-56.1	-42.1	170.8	-76.3	174.8	0	0	0	111.8	F1166 L1198 G1201 M1202 I1205 D1295 S1301 D1302 A1303	F1166-L1299 HydrophobicContact CD1-CD1 4.23Å; F1166-L1299 HydrophobicContact CE1-CD1 3.87Å; L1198-L1299 HydrophobicContact CD1-CB 3.77Å; L1198-L1299 HydrophobicContact CD1-CD2 4.45Å; G1201-L1299 WeakPolarHBondContact O-CD2 3.45Å; M1202-L1299 HydrophobicContact CG-CD1 3.91Å; M1202-L1299 HydrophobicContact CG-CD2 4.3Å; I1205-L1299 HydrophobicContact CD1-CD1 4.07Å; I1205-L1299 HydrophobicContact CD1-CD2 3.78Å; I1205-L1299 HydrophobicContact CD1-CG 3.78Å; D1295-L1299 VanDerWaalsContact O-CB 3.27Å; D1295-L1299 WeakPolarHBondContact O-CB 3.45Å; D1295-L1299 VanDerWaalsContact O-CG 3.3Å; D1295-L1299 WeakPolarHBondContact O-CG 3.47Å; D1295-L1299 PolarHBondContact O-N 3.34Å; L1299-S1301 VanDerWaalsContact C-N 3.31Å; L1299-D1302 PolarHBondContact O-N 2.9Å; L1299-A1303 VanDerWaalsContact O-CB 3.25Å; L1299-A1303 WeakPolarHBondContact O-CB 3.14Å; L1299-A1303 PolarHBondContact O-N 3.24Å
1300	L	68.5	Low	62.5	Low	4 Å²	4	66.8 Å²	66.8	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-73.3	-19.3	172.9	-171.9	66.5	0	0	0	112.8	P985 M988 V989 L992 V1296 S1298 L1304	P985-L1300 HydrophobicContact CB-CD2 4.31Å; M988-L1300 HydrophobicContact CB-CD1 4.14Å; M988-L1300 HydrophobicContact CB-CD2 4.14Å; M988-L1300 HydrophobicContact CE-CD2 3.85Å; M988-L1300 HydrophobicContact SD-CD2 3.82Å; V989-L1300 HydrophobicContact CG2-CB 4.34Å; L992-L1300 HydrophobicContact CD1-CD1 3.87Å; V1296-L1300 WeakPolarHBondContact O-CB 3.45Å; V1296-L1300 PolarHBondContact O-N 2.9Å; S1298-L1300 VanDerWaalsContact C-N 3.26Å; S1298-L1300 PolarHBondContact O-N 2.88Å; L1300-L1304 HydrophobicContact CD1-CD1 3.98Å; L1300-L1304 HydrophobicContact CD1-CD2 4.48Å; L1300-L1304 HydrophobicContact CD1-CG 4.06Å; L1300-L1304 HydrophobicContact CG-CD1 3.9Å; L1300-L1304 HydrophobicContact CG-CG 4.32Å; L1300-L1304 VanDerWaalsContact O-CB 3.23Å; L1300-L1304 WeakPolarHBondContact O-CB 3.3Å; L1300-L1304 VanDerWaalsContact O-CD1 3.29Å; L1300-L1304 WeakPolarHBondContact O-CD1 3.15Å; L1300-L1304 WeakPolarHBondContact O-CG 3.45Å; L1300-L1304 PolarHBondContact O-N 3.36Å
1301	S	70.8	Confident	63.6	Low	37 Å²	37	58.3 Å²	58.3	26%	0.259	28%	0.278	S	S	.	.	H	α-helix	trans	-80.6	-37.8	172	-160.6	0	0	0	0	111	R1297 S1298 L1299 L1304 K1305	R1297-S1301 VanDerWaalsContact O-CB 3.25Å; R1297-S1301 WeakPolarHBondContact O-CB 3.39Å; R1297-S1301 PolarHBondContact O-N 3.27Å; S1298-S1301 CarbonylContact O-C 3.58Å; S1298-S1301 WeakPolarHBondContact O-CA 3.48Å; S1298-S1301 WeakPolarHBondContact O-CB 3.36Å; S1298-S1301 PolarHBondContact O-N 2.7Å; L1299-S1301 VanDerWaalsContact C-N 3.31Å; S1301-L1304 CarbonylContact O-C 3.55Å; S1301-L1304 PolarHBondContact O-N 3.4Å; S1301-K1305 WeakPolarHBondContact O-CB 3.34Å; S1301-K1305 VanDerWaalsContact O-CG 3.29Å; S1301-K1305 WeakPolarHBondContact O-CG 3.17Å; S1301-K1305 PolarHBondContact O-N 3.26Å
1302	D	70	Confident	64.3	Low	41 Å²	41	60.1 Å²	60.1	22%	0.219	29%	0.285	C	S	.	.	H	α-helix	trans	-69.7	-50.3	178.1	-66	4.7	0	0	0	109.6	R1204 S1298 L1299 L1304 K1305 L1306	R1204-D1302 IonicContact CZ-OD2 2.94Å; R1204-D1302 IonicContact NH1-OD2 3.26Å; R1204-D1302 IonicContact NH2-OD2 3.13Å; R1204-D1302 PolarHBondContact NH2-OD2 2.97Å; S1298-D1302 PolarHBondContact O-N 2.92Å; L1299-D1302 PolarHBondContact O-N 2.9Å; D1302-L1304 PolarHBondContact O-N 3.16Å; D1302-L1304 VanDerWaalsContact O-N 3.11Å; D1302-K1305 PolarHBondContact O-N 3.21Å; D1302-L1306 WeakPolarHBondContact O-CB 3.23Å; D1302-L1306 WeakPolarHBondContact O-CG 3.34Å; D1302-L1306 PolarHBondContact O-N 2.79Å
1303	A	65.5	Low	65	Low	6 Å²	6	62.9 Å²	62.9	5%	0.05	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	11.5	174.6	0	0	0	0	0	114.6	L1198 L1299	L1198-A1303 HydrophobicContact CB-CB 4.07Å; L1198-A1303 HydrophobicContact CD1-CB 3.98Å; L1299-A1303 VanDerWaalsContact O-CB 3.25Å; L1299-A1303 WeakPolarHBondContact O-CB 3.14Å; L1299-A1303 PolarHBondContact O-N 3.24Å
1304	L	67.5	Low	65.6	Low	22 Å²	22	59.2 Å²	59.2	12%	0.115	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-0.3	162.2	-61.9	179.7	0	0	0	112.4	V906 L909 R910 L1300 S1301 D1302 L1306	V906-L1304 HydrophobicContact CB-CD2 4.36Å; V906-L1304 HydrophobicContact CG1-CD2 3.81Å; V906-L1304 HydrophobicContact CG2-CD2 4.48Å; L909-L1304 HydrophobicContact CB-CD2 4.48Å; R910-L1304 HydrophobicContact CG-CB 4.2Å; R910-L1304 HydrophobicContact CG-CD1 4.29Å; R910-L1304 HydrophobicContact CG-CD2 3.75Å; R910-L1304 HydrophobicContact CG-CG 4.28Å; R910-L1304 PolarHBondContact NE-O 2.73Å; R910-L1304 VanDerWaalsContact NE-O 3.11Å; R910-L1304 PolarHBondContact NH2-O 2.62Å; L1300-L1304 HydrophobicContact CD1-CD1 3.98Å; L1300-L1304 HydrophobicContact CD1-CD2 4.48Å; L1300-L1304 HydrophobicContact CD1-CG 4.06Å; L1300-L1304 HydrophobicContact CG-CD1 3.9Å; L1300-L1304 HydrophobicContact CG-CG 4.32Å; L1300-L1304 VanDerWaalsContact O-CB 3.23Å; L1300-L1304 WeakPolarHBondContact O-CB 3.3Å; L1300-L1304 VanDerWaalsContact O-CD1 3.29Å; L1300-L1304 WeakPolarHBondContact O-CD1 3.15Å; L1300-L1304 WeakPolarHBondContact O-CG 3.45Å; L1300-L1304 PolarHBondContact O-N 3.36Å; S1301-L1304 CarbonylContact O-C 3.55Å; S1301-L1304 PolarHBondContact O-N 3.4Å; D1302-L1304 PolarHBondContact O-N 3.16Å; D1302-L1304 VanDerWaalsContact O-N 3.11Å; L1304-L1306 VanDerWaalsContact C-OXT 3.24Å; L1304-L1306 VanDerWaalsContact CA-OXT 3.29Å; L1304-L1306 WeakPolarHBondContact CA-OXT 3.47Å; L1304-L1306 PolarHBondContact N-OXT 3.08Å
1305	K	65.6	Low	66.1	Low	133 Å²	133	48.5 Å²	48.5	58%	0.578	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-42.1	167.3	-86.7	177.9	172	-173.5	0	109.5	E840 S1301 D1302	E840-K1305 IonicContact OE1-NZ 2.79Å; E840-K1305 PolarHBondContact OE1-NZ 3.35Å; S1301-K1305 WeakPolarHBondContact O-CB 3.34Å; S1301-K1305 VanDerWaalsContact O-CG 3.29Å; S1301-K1305 WeakPolarHBondContact O-CG 3.17Å; S1301-K1305 PolarHBondContact O-N 3.26Å; D1302-K1305 PolarHBondContact O-N 3.21Å
1306	L	55.3	Low	66.6	Low	121 Å²	121	51.5 Å²	51.5	63%	0.634	26%	0.257	S	S	*	.			trans	-60.6	0	145.4	-54.3	169.6	0	0	0	107.4	R910 D1302 L1304	R910-L1306 PolarHBondContact NH2-O 2.88Å; R910-L1306 PolarHBondContact NH2-OXT 3.06Å; D1302-L1306 WeakPolarHBondContact O-CB 3.23Å; D1302-L1306 WeakPolarHBondContact O-CG 3.34Å; D1302-L1306 PolarHBondContact O-N 2.79Å; L1304-L1306 VanDerWaalsContact C-OXT 3.24Å; L1304-L1306 VanDerWaalsContact CA-OXT 3.29Å; L1304-L1306 WeakPolarHBondContact CA-OXT 3.47Å; L1304-L1306 PolarHBondContact N-OXT 3.08Å

Retrieved 1,306 of 1,306 residues in 2463.9 ms (Link to these results)

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