G4VN23_SCHMA Loading...

NAD(P) transhydrogenase, mitochondrial

The transhydrogenation between NADH and NADP is coupled to respiration and ATP hydrolysis and functions as a proton pump across the membrane. May play a role in reactive oxygen species (ROS) detoxification in the adrenal gland.

AlphaFold DB , UniProt , Accession G4VN23, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,090 aa.

						>G4VN23_SCHMA|G4VN23
MAPIFFVSHFSTTIQSHRLIQLKPVGLLYRLYSTKAESSQLGVAYNTLHIGIPKESFINEKRVSVTPHTANLFSKCGFTVFVQTGAGVNSNFLDSDYVKAGAKIITDSLESLYDQSDIILKIRPPSLESPPKLSDEVSMMKPNSTLISLIYPAKNQPLIDSLSKKKVNLLALDCIPRISRAQSFDVLSSMANISGYKGVIEAAGLFNRFFAGQITAAGRIPPAKVLVIGGGVAGLSAVSTAKSLGAIVRAFDTREAVREQVESFGAEFLTVNIQESGEGGGGYAKEMSQKYLEAEMELFAKQAKEVDIIITSALIPGKPAPKLITKAMVESMRPGSVIVDLASEAGGNVETTVPGKLTYHHNVAHIGYTDLPSRLPGQASTLFSNNVANYLLSMTPPGSKDRFYLNLEDDVIRDSLILYNGELMWPPPVRSQPTSAPKLNNSKQLSKAGSNMTVQPEDSSSVFKNKLRSAISTSVCLSGLVGLGLYSPSPAFTTMLTTFGLSSIVGYHTVWGVTPALHSPLMSVTNAISGITAVGGLLLMGGGFYPSSVPESLAASATLLSAINIGGGFVVTQRMLNMFKRPTDLPEYNYVLTIPATGLLGVYGYALLTLPPSLLTDMHQTTYLASSLCCIGALTALSSQKRSRVGNALGMIGVTSGLISTLGLIQPNLELLTQMGACLTGGLLIGSIAAKRIQVTDLPQMVALFHSLVGAAAVLTCIANYMVEMPHLILDPDCYGALQLMKTVAYLGTYIGGITLTGSLIAFGKLQGILKSTPLLLPMRNTLNASLVALSGGCLVGLLSLGPESVLPGLGLLIGGAGVAGGISGLTLTAAIGGADMPVVITVLNSYSGWALCAEGFMLNNSLMTVVGALIGSSGAILSYIMCKAMNRSLPNVILGGYGTTSYSGGKSMVIKGVHHQTNVSSVANYLNDFNEIIITPGYGLCVAKAQYPLAELTKELIKRGKHVRFAIHPVAGRMPGQLNVLLAEAGVPYDIVHEMDEINADFPKTDLVLVIGANDTVNSAAEEDPNSIIAGMPVLRVWLAKKVIVVKRTLGVGYAAVDNPIFFKENTEMLLGDAKTICDDLLNACRNSS
					

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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	28.6	Very low	28.2	Very low	249 Å²	249	144.4 Å²	144.4	100%	1.227	77%	0.771	S	S	*	*				0	167.3	0	-73.3	170.1	171.1	0	0	108.4
2	A	25.7	Very low	28.3	Very low	94 Å²	94	142.3 Å²	142.3	78%	0.777	77%	0.768	S	S	*	*			trans	-77.7	165.4	177.7	0	0	0	0	0	111.4
3	P	40.3	Very low	28.2	Very low	103 Å²	103	139.8 Å²	139.8	67%	0.669	76%	0.76	S	S	*	*				-138.3	-164.9	-64.5	38.2	-21	0	0	0	112.9
4	I	31	Very low	28	Very low	132 Å²	132	140.2 Å²	140.2	68%	0.677	76%	0.76	S	S	*	*			trans	76.2	95.7	163.3	-61.8	161.3	0	0	0	114.5
5	F	27.1	Very low	28	Very low	179 Å²	179	141.5 Å²	141.5	79%	0.785	76%	0.758	S	S	*	*				71.8	147.1	96.8	-56.7	-36.6	0	0	0	114.4
6	F	26.4	Very low	27.9	Very low	180 Å²	180	138.7 Å²	138.7	79%	0.789	75%	0.753	S	S	*	*			cis	-158.1	179	9.4	-134.1	-150.9	0	0	0	107.9
7	V	28.6	Very low	27.8	Very low	114 Å²	114	141 Å²	141	69%	0.691	76%	0.758	S	S	*	*			cis	-143.4	-75.1	3.7	61.6	0	0	0	0	114.8
8	S	25.8	Very low	28	Very low	88 Å²	88	145.1 Å²	145.1	62%	0.615	76%	0.761	S	S	*	*			trans	-158.9	143.1	-160.4	60.9	0	0	0	0	119.4
9	H	27.9	Very low	27.9	Very low	170 Å²	170	144.9 Å²	144.9	79%	0.787	76%	0.76	S	S	*	*			trans	71.4	129.6	142.7	-81	54.2	0	0	0	123.9
10	F	25.1	Very low	27.9	Very low	187 Å²	187	144.1 Å²	144.1	82%	0.82	75%	0.754	S	S	*	*			trans	-0.5	149.1	144.7	-70.3	-84.7	0	0	0	120.2
11	S	23.5	Very low	27.9	Very low	92 Å²	92	144.9 Å²	144.9	64%	0.643	75%	0.754	S	S	*	*			cis	-159.5	164.1	2.5	-162	0	0	0	0	107.2
12	T	29.5	Very low	27.9	Very low	119 Å²	119	139.9 Å²	139.9	73%	0.73	73%	0.732	S	S	*	*				-175.3	135.4	60.5	44.1	0	0	0	0	113.9
13	T	26.8	Very low	27.9	Very low	110 Å²	110	144.6 Å²	144.6	68%	0.675	74%	0.735	S	S	*	*				61.2	112.6	121.4	-43.5	0	0	0	0	124.1
14	I	25.9	Very low	27.3	Very low	146 Å²	146	146 Å²	146	75%	0.749	74%	0.744	S	S	*	*			trans	75.1	143.8	141.7	-78.5	174.1	0	0	0	118.4
15	Q	28.4	Very low	27.1	Very low	159 Å²	159	146.8 Å²	146.8	74%	0.743	75%	0.754	S	S	*	*			cis	-154.6	138.1	13	-144.4	161	15.8	0	0	115.4
16	S	26.7	Very low	27.1	Very low	97 Å²	97	140.6 Å²	140.6	68%	0.678	74%	0.741	S	S	*	*			trans	55.3	162.5	145.3	79.8	0	0	0	0	122
17	H	26.3	Very low	27	Very low	178 Å²	178	140.5 Å²	140.5	82%	0.824	75%	0.748	S	S	*	*			cis	-160.5	173	8.3	-130.6	-31.2	0	0	0	112.4
18	R	30.2	Very low	26.9	Very low	215 Å²	215	142.7 Å²	142.7	81%	0.811	76%	0.755	S	S	*	*			trans	88.4	109.8	171.3	-57.2	-166.4	174.9	-152.1	-2.6	117.6
19	L	26.5	Very low	27	Very low	142 Å²	142	149.8 Å²	149.8	74%	0.743	77%	0.77	S	S	*	*				76.4	135.1	90.3	-64.8	165	0	0	0	112.6
20	I	28.7	Very low	26.9	Very low	127 Å²	127	152.2 Å²	152.2	65%	0.651	77%	0.772	S	S	*	*			cis	-155.4	155.2	9.8	-131.5	161.2	0	0	0	111.4
21	Q	27.1	Very low	27	Very low	161 Å²	161	151.3 Å²	151.3	75%	0.752	78%	0.775	S	S	*	*			trans	32.4	132.8	159.6	-57.9	170	7.8	0	0	120.3
22	L	28	Very low	27.2	Very low	145 Å²	145	158.6 Å²	158.6	76%	0.759	79%	0.79	S	S	*	*				-156.4	133.2	55.2	-85.5	166.1	0	0	0	112.5
23	K	25.9	Very low	27.2	Very low	193 Å²	193	157.7 Å²	157.7	84%	0.839	79%	0.789	S	S	*	*			trans	49.1	120	163.5	-61.3	-178.4	-178.9	179.2	0	116.9
24	P	27.6	Very low	27.3	Very low	131 Å²	131	158.3 Å²	158.3	85%	0.851	79%	0.793	S	S	*	*				-129.7	146.4	53.5	37.4	-25.6	0	0	0	115.7
25	V	27.9	Very low	27.6	Very low	149 Å²	149	160.9 Å²	160.9	90%	0.903	80%	0.799	S	S	*	*			trans	-122.6	139.8	159.5	-179.1	0	0	0	0	105.6
26	G	25.8	Very low	27.7	Very low	50 Å²	50	157.2 Å²	157.2	52%	0.515	80%	0.796	S	S	.	*			cis	162	117.2	-5.1	0	0	0	0	0	110.6	L28	G26-L28 PolarHBondContact O-N 3.3Å
27	L	25.8	Very low	28.1	Very low	177 Å²	177	161 Å²	161	93%	0.927	80%	0.802	S	S	*	*			trans	27.5	51.1	162.8	-151.1	76.6	0	0	0	118.9
28	L	25.2	Very low	28.6	Very low	161 Å²	161	157.6 Å²	157.6	84%	0.843	80%	0.798	S	S	*	*			trans	-108.4	23.2	-178.2	-123.9	167.9	0	0	0	114.2	G26	G26-L28 PolarHBondContact O-N 3.3Å
29	Y	28.8	Very low	29.5	Very low	237 Å²	237	152.3 Å²	152.3	93%	0.929	79%	0.794	S	S	*	*	S	Bend	trans	-119.7	39.1	-174.3	-124.7	-84.9	0	0	0	113.3
30	R	26.2	Very low	31.2	Very low	221 Å²	221	151.4 Å²	151.4	83%	0.834	79%	0.787	S	S	*	*	S	Bend	trans	-142.9	8.3	-178.8	-122.5	179.8	-170	-171.2	2.4	117.2
31	L	25.2	Very low	33.4	Very low	168 Å²	168	150.2 Å²	150.2	88%	0.88	78%	0.781	S	S	*	*	S	Bend	trans	-127	2.7	177.7	-73.1	174.1	0	0	0	115
32	Y	27.8	Very low	36.1	Very low	244 Å²	244	143.7 Å²	143.7	96%	0.957	76%	0.757	S	S	*	*	S	Bend	trans	-113	53.4	160	-84.2	-81.5	0	0	0	110.6
33	S	29.5	Very low	39	Very low	101 Å²	101	140.1 Å²	140.1	71%	0.706	74%	0.741	S	S	*	*			trans	-129.3	79.6	155.4	-174.5	0	0	0	0	106.8	K35	S33-K35 PolarHBondContact O-N 3.19Å
34	T	29.4	Very low	42.1	Very low	123 Å²	123	131.8 Å²	131.8	76%	0.755	71%	0.708	S	S	*	*			trans	-51.6	136.6	147.3	35.9	0	0	0	0	106.9	A36	T34-A36 PolarHBondContact O-N 2.75Å
35	K	31.7	Very low	45.2	Very low	200 Å²	200	125.7 Å²	125.7	87%	0.87	67%	0.668	S	S	*	*			trans	-66.9	83.6	155.3	-75.9	-178.3	175.2	-178.8	0	106.5	S33 E37	S33-K35 PolarHBondContact O-N 3.19Å; K35-E37 PolarHBondContact O-N 3.46Å; K35-E37 VanDerWaalsContact O-N 3.15Å
36	A	31.3	Very low	48.2	Very low	82 Å²	82	124.1 Å²	124.1	68%	0.678	66%	0.655	S	S	*	*			trans	-53.7	115.4	142.7	0	0	0	0	0	104.7	T34 S38	T34-A36 PolarHBondContact O-N 2.75Å; A36-S38 PolarHBondContact O-N 3.22Å
37	E	34.3	Very low	51.3	Low	176 Å²	176	125.9 Å²	125.9	82%	0.822	66%	0.656	S	S	*	*			trans	-53.9	127.2	168.7	-63.4	179.5	128	0	0	106.2	K35 S39	K35-E37 PolarHBondContact O-N 3.46Å; K35-E37 VanDerWaalsContact O-N 3.15Å; E37-S39 PolarHBondContact O-N 3.16Å
38	S	38.1	Very low	54.5	Low	106 Å²	106	118.1 Å²	118.1	74%	0.741	62%	0.615	S	S	*	*			trans	-69.4	87	173.3	53.6	0	0	0	0	106.6	A36 Q40	A36-S38 PolarHBondContact O-N 3.22Å; S38-Q40 VanDerWaalsContact C-N 3.32Å; S38-Q40 PolarHBondContact O-N 2.71Å
39	S	47.7	Very low	57.9	Low	104 Å²	104	113.3 Å²	113.3	73%	0.727	59%	0.588	S	S	*	*			trans	-59.9	95.9	-178.7	42.4	0	0	0	0	107.9	E37 L41	E37-S39 PolarHBondContact O-N 3.16Å; S39-L41 PolarHBondContact O-N 3.07Å
40	Q	62.4	Low	61.1	Low	124 Å²	124	102 Å²	102	58%	0.579	54%	0.544	S	S	*	.			trans	-56.2	116.1	-173.8	-68.1	-178.5	-14.4	0	0	108.2	S38 G42 R402	S38-Q40 VanDerWaalsContact C-N 3.32Å; S38-Q40 PolarHBondContact O-N 2.71Å; Q40-G42 PolarHBondContact O-N 3.19Å; Q40-G42 VanDerWaalsContact O-O 3.1Å; Q40-R402 VanDerWaalsContact CB-CZ 3.48Å; Q40-R402 PolarHBondContact O-NE 2.79Å; Q40-R402 PolarHBondContact O-NH2 3.03Å
41	L	75.3	Confident	64.5	Low	101 Å²	101	91.5 Å²	91.5	53%	0.529	50%	0.504	S	S	.	.	S	Bend	trans	-53.2	141.1	-170.9	-72.1	163.8	0	0	0	110.9	S39 P396 R402 Y404	S39-L41 PolarHBondContact O-N 3.07Å; L41-P396 HydrophobicContact CB-CB 4.12Å; L41-P396 HydrophobicContact CB-CG 4.45Å; L41-P396 WeakPolarHBondContact O-CG 2.98Å; L41-R402 WeakPolarHBondContact O-CD 3.45Å; L41-R402 PolarHBondContact O-NE 3.4Å; L41-Y404 HydrophobicContact CB-CD2 4.41Å; L41-Y404 HydrophobicContact CB-CG 4.48Å; L41-Y404 HydrophobicContact CD2-CE2 4.2Å
42	G	84.1	Confident	67.9	Low	25 Å²	25	83.5 Å²	83.5	26%	0.258	46%	0.462	S	S	.	.	S	Bend	trans	75.5	-175.8	-175	0	0	0	0	0	115.3	Q40 R402 F403	Q40-G42 PolarHBondContact O-N 3.19Å; Q40-G42 VanDerWaalsContact O-O 3.1Å; G42-R402 PolarHBondContact O-NH2 2.71Å; G42-F403 CarbonylContact C-O 3.36Å; G42-F403 WeakPolarHBondContact CA-O 3.25Å
43	V	89.9	Confident	71	Confident	70 Å²	70	72 Å²	72	42%	0.424	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.7	179.9	178.2	0	0	0	0	109.2	T47 L48 R402 F403	V43-T47 WeakPolarHBondContact CG1-OG1 2.88Å; V43-L48 HydrophobicContact CB-CD1 4.18Å; V43-L48 HydrophobicContact CB-CG 4.5Å; V43-L48 HydrophobicContact CG1-CD1 4.09Å; V43-L48 HydrophobicContact CG1-CD2 3.98Å; V43-L48 HydrophobicContact CG1-CG 3.89Å; V43-R402 CarbonylContact O-C 3.58Å; V43-R402 VanDerWaalsContact O-CA 3.25Å; V43-R402 WeakPolarHBondContact O-CA 3.46Å; V43-F403 PolarHBondContact N-O 3.33Å; V43-F403 PolarHBondContact O-N 3.48Å
44	A	90.4	Very high	74	Confident	17 Å²	17	71.3 Å²	71.3	14%	0.14	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	142.3	-178.5	0	0	0	0	0	112	N46 T47 D401	A44-N46 VanDerWaalsContact C-N 3.26Å; A44-N46 WeakPolarHBondContact CB-OD1 3.38Å; A44-N46 PolarHBondContact O-N 3.25Å; A44-T47 PolarHBondContact O-N 2.88Å; A44-T47 VanDerWaalsContact O-N 3.1Å; A44-T47 PolarHBondContact O-OG1 3.07Å; A44-D401 WeakPolarHBondContact CA-O 3.37Å
45	Y	91.7	Very high	76.9	Confident	3 Å²	3	66.4 Å²	66.4	1%	0.012	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-61.5	-33.5	-178.3	-67.9	-19.5	0	0	0	112.9	T47 L48 C76 F78 L392 T395 D401 R402 F403	Y45-T47 PolarHBondContact O-N 3.22Å; Y45-L48 PolarHBondContact O-N 3.46Å; Y45-L48 VanDerWaalsContact O-N 3.14Å; Y45-C76 HydrophobicContact CD2-CB 4.05Å; Y45-C76 WeakPolarHBondContact CD2-O 3.49Å; Y45-C76 HydrophobicContact CE2-CB 4.22Å; Y45-F78 HydrophobicContact CD1-CD1 4.43Å; Y45-F78 AromaticContact CD1-CE1 3.59Å; Y45-F78 HydrophobicContact CD1-CE1 3.59Å; Y45-F78 AromaticContact CD1-CE2 3.67Å; Y45-F78 HydrophobicContact CD1-CE2 3.67Å; Y45-F78 AromaticContact CD1-CZ 3.16Å; Y45-F78 HydrophobicContact CD1-CZ 3.16Å; Y45-F78 HydrophobicContact CD2-CD2 4.33Å; Y45-F78 AromaticContact CD2-CE2 3.82Å; Y45-F78 HydrophobicContact CD2-CE2 3.82Å; Y45-F78 HydrophobicContact CD2-CZ 4.2Å; Y45-F78 HydrophobicContact CE1-CE1 4.15Å; Y45-F78 AromaticContact CE1-CE2 3.82Å; Y45-F78 HydrophobicContact CE1-CE2 3.82Å; Y45-F78 AromaticContact CE1-CZ 3.33Å; Y45-F78 HydrophobicContact CE1-CZ 3.33Å; Y45-F78 AromaticContact CE2-CE2 3.98Å; Y45-F78 HydrophobicContact CE2-CE2 3.98Å; Y45-F78 HydrophobicContact CE2-CZ 4.34Å; Y45-F78 HydrophobicContact CG-CD1 4.48Å; Y45-F78 HydrophobicContact CG-CD2 4.14Å; Y45-F78 HydrophobicContact CG-CE1 4.04Å; Y45-F78 AromaticContact CG-CE2 3.65Å; Y45-F78 HydrophobicContact CG-CE2 3.65Å; Y45-F78 AromaticContact CG-CZ 3.62Å; Y45-F78 HydrophobicContact CG-CZ 3.62Å; Y45-F78 AromaticContact CZ-CE2 3.96Å; Y45-F78 AromaticContact CZ-CZ 3.93Å; Y45-F78 WeakPolarHBondContact O-CA 3.32Å; Y45-L392 HydrophobicContact CE2-CD2 4.19Å; Y45-T395 PolarHBondContact OH-OG1 2.85Å; Y45-D401 PolarHBondContact N-O 3.1Å; Y45-R402 VanDerWaalsContact CE1-O 3.23Å; Y45-R402 WeakPolarHBondContact CE1-O 3.39Å; Y45-F403 HydrophobicContact CD1-CB 4.04Å; Y45-F403 HydrophobicContact CE1-CB 3.82Å
46	N	91	Very high	79.4	Confident	117 Å²	117	59 Å²	59	63%	0.626	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-70.9	-11.4	177.8	68.2	-17.6	0	0	0	114.6	A44 G77	A44-N46 VanDerWaalsContact C-N 3.26Å; A44-N46 WeakPolarHBondContact CB-OD1 3.38Å; A44-N46 PolarHBondContact O-N 3.25Å; N46-G77 VanDerWaalsContact CA-O 3.31Å; N46-G77 WeakPolarHBondContact CA-O 3.42Å
47	T	91.5	Very high	82	Confident	87 Å²	87	60 Å²	60	53%	0.534	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-103	11.7	172.1	56.6	0	0	0	0	112.9	V43 A44 Y45	V43-T47 WeakPolarHBondContact CG1-OG1 2.88Å; A44-T47 PolarHBondContact O-N 2.88Å; A44-T47 VanDerWaalsContact O-N 3.1Å; A44-T47 PolarHBondContact O-OG1 3.07Å; Y45-T47 PolarHBondContact O-N 3.22Å
48	L	93.5	Very high	84.3	Confident	14 Å²	14	57.9 Å²	57.9	7%	0.073	33%	0.326	C	S	.	.			trans	-121.6	133.8	-177.9	-70	169.9	0	0	0	111.9	V43 Y45 F78 T79 D117 I118 F403	V43-L48 HydrophobicContact CB-CD1 4.18Å; V43-L48 HydrophobicContact CB-CG 4.5Å; V43-L48 HydrophobicContact CG1-CD1 4.09Å; V43-L48 HydrophobicContact CG1-CD2 3.98Å; V43-L48 HydrophobicContact CG1-CG 3.89Å; Y45-L48 PolarHBondContact O-N 3.46Å; Y45-L48 VanDerWaalsContact O-N 3.14Å; L48-F78 HydrophobicContact CB-CD1 3.92Å; L48-F78 HydrophobicContact CB-CE1 4.05Å; L48-F78 HydrophobicContact CD1-CE1 4.14Å; L48-T79 PolarHBondContact O-N 3.04Å; L48-D117 HydrophobicContact CD2-CB 3.71Å; L48-I118 HydrophobicContact CD1-CD1 4.44Å; L48-F403 HydrophobicContact CD1-CB 3.54Å; L48-F403 HydrophobicContact CD1-CD1 4.15Å; L48-F403 HydrophobicContact CD1-CG 4.05Å
49	H	96	Very high	86.5	Confident	60 Å²	60	58 Å²	58	28%	0.278	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.9	177.7	-59.8	163.1	0	0	0	111.6	T79 F81 Q115 D117 I118	H49-T79 WeakPolarHBondContact CA-O 3.48Å; H49-F81 HydrophobicContact CB-CD2 3.99Å; H49-F81 HydrophobicContact CB-CE2 3.8Å; H49-F81 AromaticContact CG-CE2 3.66Å; H49-F81 AromaticContact ND1-CE2 3.63Å; H49-Q115 VanDerWaalsContact CB-O 3.27Å; H49-Q115 WeakPolarHBondContact CB-O 3.38Å; H49-Q115 PolarHBondContact ND1-O 2.74Å; H49-D117 IonicContact CG-OD2 3.76Å; H49-D117 PolarHBondContact N-OD2 3.07Å; H49-D117 PolarHBondContact O-N 2.95Å; H49-I118 PolarHBondContact O-N 3.34Å
50	I	97	Very high	88.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.5	176.8	-60.4	179.7	0	0	0	109.7	I52 F73 F78 T79 F81 I118 L120 L391	I50-I52 HydrophobicContact CG2-CD1 3.71Å; I50-F73 HydrophobicContact CD1-CB 4.17Å; I50-F73 HydrophobicContact CD1-CD1 4.14Å; I50-F73 HydrophobicContact CD1-CD2 4.14Å; I50-F73 HydrophobicContact CD1-CG 3.92Å; I50-F78 HydrophobicContact CD1-CB 3.72Å; I50-F78 HydrophobicContact CD1-CD1 3.69Å; I50-F78 HydrophobicContact CD1-CD2 3.92Å; I50-F78 HydrophobicContact CD1-CE1 4.16Å; I50-F78 HydrophobicContact CD1-CE2 4.38Å; I50-F78 HydrophobicContact CD1-CG 3.53Å; I50-F78 HydrophobicContact CD1-CZ 4.46Å; I50-F78 HydrophobicContact CG1-CB 4.12Å; I50-F78 HydrophobicContact CG1-CD1 3.86Å; I50-F78 HydrophobicContact CG1-CE1 4.43Å; I50-F78 HydrophobicContact CG1-CG 4.1Å; I50-T79 PolarHBondContact N-O 2.94Å; I50-F81 PolarHBondContact O-N 3.47Å; I50-I118 CarbonylContact C-O 3.53Å; I50-I118 VanDerWaalsContact CA-O 3.31Å; I50-I118 WeakPolarHBondContact CA-O 3.2Å; I50-I118 HydrophobicContact CG1-CB 4.35Å; I50-L120 HydrophobicContact CG2-CD1 3.54Å; I50-L120 HydrophobicContact CG2-CG 3.85Å; I50-L391 HydrophobicContact CD1-CD2 3.83Å
51	G	96.3	Very high	90.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124.2	177.1	0	0	0	0	0	113.5	P53 S116 I118 L120	G51-P53 WeakPolarHBondContact O-CD 3.47Å; G51-S116 WeakPolarHBondContact CA-OG 3.5Å; G51-S116 PolarHBondContact N-OG 2.94Å; G51-I118 PolarHBondContact N-O 2.72Å; G51-L120 PolarHBondContact O-N 2.78Å; G51-L120 VanDerWaalsContact O-N 3.1Å
52	I	96.4	Very high	91.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	89.2	178.4	-48.4	-53.8	0	0	0	109.3	I50 V63 V65 V80 F81 V82 Q83 L120	I50-I52 HydrophobicContact CG2-CD1 3.71Å; I52-V63 HydrophobicContact CG2-CG2 4Å; I52-V65 HydrophobicContact CD1-CB 3.62Å; I52-V65 HydrophobicContact CD1-CG1 4.23Å; I52-V65 HydrophobicContact CD1-CG2 3.39Å; I52-V65 HydrophobicContact CG1-CB 3.98Å; I52-V65 HydrophobicContact CG1-CG1 4.33Å; I52-V65 HydrophobicContact CG1-CG2 4.3Å; I52-V65 HydrophobicContact CG2-CB 4.21Å; I52-V80 HydrophobicContact CG1-CG1 3.95Å; I52-F81 WeakPolarHBondContact CB-O 3.38Å; I52-F81 PolarHBondContact N-O 3.44Å; I52-V82 HydrophobicContact CB-CB 4.38Å; I52-V82 HydrophobicContact CB-CG1 4.28Å; I52-V82 HydrophobicContact CB-CG2 4.09Å; I52-V82 HydrophobicContact CG1-CG2 4.14Å; I52-V82 HydrophobicContact CG2-CG1 4.29Å; I52-Q83 PolarHBondContact O-N 3.39Å; I52-L120 HydrophobicContact CD1-CB 3.85Å; I52-L120 HydrophobicContact CD1-CD1 4.03Å; I52-L120 HydrophobicContact CD1-CG 4.25Å
53	P	93.8	Very high	91.8	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.019	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-73	155.9	175.1	30.3	-34.8	0	0	0	111.3	G51 L109 L112 K121	G51-P53 WeakPolarHBondContact O-CD 3.47Å; P53-L109 HydrophobicContact CB-CD1 4.42Å; P53-L112 HydrophobicContact CB-CD2 3.71Å; P53-L112 HydrophobicContact CG-CD2 4.46Å; P53-K121 HydrophobicContact CG-CD 3.94Å; P53-K121 HydrophobicContact CG-CG 3.49Å; P53-K121 VanDerWaalsContact CG-CG 3.49Å
54	K	92.2	Very high	92.1	Very high	85 Å²	85	44 Å²	44	37%	0.37	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-70.4	136.5	164.5	-178.5	172	-177.8	171.1	0	108.7	S56 Q83 A86	K54-S56 PolarHBondContact O-N 3.43Å; K54-Q83 HydrophobicContact CB-CG 4.45Å; K54-Q83 VanDerWaalsContact CB-OE1 3.29Å; K54-A86 HydrophobicContact CB-CB 3.93Å
55	E	91.2	Very high	92.4	Very high	20 Å²	20	43.2 Å²	43.2	9%	0.093	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-69.2	130.7	175.8	-73.1	-66.8	-173.5	0	0	111.5	E60 K121 I122 R123	E55-E60 HydrophobicContact CB-CB 4.02Å; E55-E60 HydrophobicContact CB-CG 3.61Å; E55-E60 HydrophobicContact CG-CG 3.91Å; E55-K121 IonicContact OE1-NZ 3.69Å; E55-K121 IonicContact OE2-NZ 3.67Å; E55-K121 PolarHBondContact OE2-NZ 2.97Å; E55-I122 HydrophobicContact CG-CB 4.42Å; E55-I122 WeakPolarHBondContact OE1-CA 3.44Å; E55-I122 WeakPolarHBondContact OE1-CB 3.22Å; E55-I122 PolarHBondContact OE1-N 3.44Å; E55-R123 PolarHBondContact OE1-N 2.98Å
56	S	83.8	Confident	92.7	Very high	45 Å²	45	43.1 Å²	43.1	32%	0.315	22%	0.219	S	C	.	.			trans	-94.2	-12.1	-172	48.3	0	0	0	0	113.2	K54 E136	K54-S56 PolarHBondContact O-N 3.43Å; S56-E136 WeakPolarHBondContact CB-OE1 3.35Å; S56-E136 PolarHBondContact OG-OE1 2.9Å
57	F	85	Confident	92.9	Very high	102 Å²	102	38.5 Å²	38.5	45%	0.447	20%	0.195	S	C	.	.	S	Bend	trans	-75.2	140.9	-179	-169.3	-92.3	0	0	0	112.7	N59 E60	F57-N59 PolarHBondContact O-N 3.01Å; F57-E60 HydrophobicContact CB-CB 4.29Å; F57-E60 WeakPolarHBondContact O-CB 3.42Å; F57-E60 PolarHBondContact O-N 3.22Å; F57-E60 VanDerWaalsContact O-N 3.08Å
58	I	83.1	Confident	93.1	Very high	132 Å²	132	40.7 Å²	40.7	68%	0.677	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	130	-177	-58	175	0	0	0	111	E60	I58-E60 PolarHBondContact O-N 3.46Å
59	N	84.4	Confident	93.2	Very high	109 Å²	109	40.1 Å²	40.1	58%	0.583	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	12.9	-177.5	-61.6	-31.5	0	0	0	116.1	F57 K61 S373	F57-N59 PolarHBondContact O-N 3.01Å; N59-K61 PolarHBondContact O-N 3.21Å; N59-S373 PolarHBondContact O-OG 3.19Å
60	E	91.3	Very high	93.2	Very high	11 Å²	11	37.2 Å²	37.2	5%	0.051	18%	0.182	C	C	.	.			trans	-74.7	123.9	166.7	-167	57	-98.9	0	0	110.1	E55 F57 I58 R62 R123	E55-E60 HydrophobicContact CB-CB 4.02Å; E55-E60 HydrophobicContact CB-CG 3.61Å; E55-E60 HydrophobicContact CG-CG 3.91Å; F57-E60 HydrophobicContact CB-CB 4.29Å; F57-E60 WeakPolarHBondContact O-CB 3.42Å; F57-E60 PolarHBondContact O-N 3.22Å; F57-E60 VanDerWaalsContact O-N 3.08Å; I58-E60 PolarHBondContact O-N 3.46Å; E60-R62 VanDerWaalsContact CD-NH2 3.33Å; E60-R62 IonicContact OE1-CZ 3.56Å; E60-R62 PolarHBondContact OE1-N 2.87Å; E60-R62 IonicContact OE1-NE 3.54Å; E60-R62 PolarHBondContact OE1-NE 2.78Å; E60-R62 IonicContact OE1-NH2 3.32Å; E60-R62 PolarHBondContact OE1-NH2 2.74Å; E60-R62 IonicContact OE2-CZ 3.47Å; E60-R62 IonicContact OE2-NE 2.74Å; E60-R62 IonicContact OE2-NH2 2.69Å; E60-R62 PolarHBondContact OE2-NH2 3.34Å; E60-R123 HydrophobicContact CG-CG 4.48Å; E60-R123 WeakPolarHBondContact OE2-CD 3.42Å; E60-R123 IonicContact OE2-NH1 3.39Å; E60-R123 PolarHBondContact OE2-NH1 2.78Å
61	K	95.3	Very high	93.2	Very high	93 Å²	93	39.7 Å²	39.7	40%	0.404	20%	0.196	S	C	.	.			trans	-118.9	-10.1	-175.3	-65.9	-178.7	-176.5	178.3	0	113.1	N59 N89 S90 S373 P376	N59-K61 PolarHBondContact O-N 3.21Å; K61-N89 HydrophobicContact CB-CB 3.8Å; K61-N89 HydrophobicContact CG-CB 4.09Å; K61-N89 CarbonylContact O-C 3.57Å; K61-N89 VanDerWaalsContact O-C 3.24Å; K61-N89 WeakPolarHBondContact O-CB 3.42Å; K61-S90 PolarHBondContact O-N 2.94Å; K61-S90 PolarHBondContact O-OG 2.8Å; K61-S373 WeakPolarHBondContact CB-OG 3.39Å; K61-S373 PolarHBondContact N-OG 3.11Å; K61-P376 HydrophobicContact CB-CB 3.73Å; K61-P376 HydrophobicContact CB-CG 4.13Å
62	R	96.5	Very high	93	Very high	22 Å²	22	42.7 Å²	42.7	8%	0.083	21%	0.211	C	C	.	.			trans	-79.9	160.1	178.9	-61	173.1	-67.2	161.6	2.2	110.9	E60 S90 I122 M190 P376 A379 S380	E60-R62 VanDerWaalsContact CD-NH2 3.33Å; E60-R62 IonicContact OE1-CZ 3.56Å; E60-R62 PolarHBondContact OE1-N 2.87Å; E60-R62 IonicContact OE1-NE 3.54Å; E60-R62 PolarHBondContact OE1-NE 2.78Å; E60-R62 IonicContact OE1-NH2 3.32Å; E60-R62 PolarHBondContact OE1-NH2 2.74Å; E60-R62 IonicContact OE2-CZ 3.47Å; E60-R62 IonicContact OE2-NE 2.74Å; E60-R62 IonicContact OE2-NH2 2.69Å; E60-R62 PolarHBondContact OE2-NH2 3.34Å; R62-S90 WeakPolarHBondContact CA-OG 3.34Å; R62-I122 HydrophobicContact CB-CD1 3.23Å; R62-I122 HydrophobicContact CG-CD1 4.48Å; R62-M190 PolarHBondContact NH1-SD 3.08Å; R62-P376 HydrophobicContact CG-CB 4.33Å; R62-A379 HydrophobicContact CG-CB 3.89Å; R62-S380 VanDerWaalsContact CA-OG 3.23Å; R62-S380 WeakPolarHBondContact CA-OG 3.37Å
63	V	96.9	Very high	92.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.012	21%	0.211	C	C	.	.			trans	-129.9	138.5	174.3	62.8	0	0	0	0	108.9	I52 V65 A86 F92 Y97 S380	I52-V63 HydrophobicContact CG2-CG2 4Å; V63-V65 VanDerWaalsContact C-N 3.27Å; V63-V65 PolarHBondContact O-N 3.46Å; V63-A86 HydrophobicContact CG2-CB 4.28Å; V63-F92 HydrophobicContact CG1-CD2 4.06Å; V63-Y97 WeakPolarHBondContact CG1-OH 3.48Å; V63-S380 PolarHBondContact N-OG 3.06Å; V63-S380 WeakPolarHBondContact O-CB 3.43Å; V63-S380 PolarHBondContact O-OG 3.16Å
64	S	96.3	Very high	92.9	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.014	22%	0.222	C	C	.	.	S	Bend	trans	-67	-26.3	-171.7	52.4	0	0	0	0	113.7	L120 S384	S64-L120 VanDerWaalsContact CB-O 3.27Å; S64-L120 WeakPolarHBondContact CB-O 3.25Å; S64-L120 PolarHBondContact OG-O 2.83Å; S64-S384 WeakPolarHBondContact O-CA 3.33Å
65	V	97.1	Very high	92.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-136.2	132.8	-179.4	169	0	0	0	0	109.9	I52 V63 T69 A70 F73 Y97 L120 S384	I52-V65 HydrophobicContact CD1-CB 3.62Å; I52-V65 HydrophobicContact CD1-CG1 4.23Å; I52-V65 HydrophobicContact CD1-CG2 3.39Å; I52-V65 HydrophobicContact CG1-CB 3.98Å; I52-V65 HydrophobicContact CG1-CG1 4.33Å; I52-V65 HydrophobicContact CG1-CG2 4.3Å; I52-V65 HydrophobicContact CG2-CB 4.21Å; V63-V65 VanDerWaalsContact C-N 3.27Å; V63-V65 PolarHBondContact O-N 3.46Å; V65-T69 WeakPolarHBondContact CG1-OG1 3.18Å; V65-A70 HydrophobicContact CG1-CB 4.11Å; V65-F73 HydrophobicContact CG1-CD2 4.33Å; V65-F73 HydrophobicContact CG1-CE2 4.13Å; V65-F73 HydrophobicContact CG2-CE2 3.85Å; V65-Y97 WeakPolarHBondContact O-CE1 3.17Å; V65-Y97 PolarHBondContact O-OH 2.9Å; V65-L120 HydrophobicContact CG2-CB 4.37Å; V65-L120 HydrophobicContact CG2-CD1 3.67Å; V65-S384 WeakPolarHBondContact CA-OG 3.28Å
66	T	97.3	Very high	92.7	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	25%	0.247	C	C	.	.			trans	-97.6	163.7	177.1	60.6	0	0	0	0	111.5	H68 T69 A70 F92 S384	T66-H68 PolarHBondContact O-N 3.19Å; T66-H68 VanDerWaalsContact O-N 3.16Å; T66-T69 PolarHBondContact N-OG1 3.16Å; T66-T69 PolarHBondContact O-N 3.44Å; T66-T69 PolarHBondContact O-OG1 3.04Å; T66-A70 WeakPolarHBondContact O-CB 3.43Å; T66-A70 PolarHBondContact O-N 2.86Å; T66-F92 HydrophobicContact CG2-CD2 4.15Å; T66-F92 HydrophobicContact CG2-CE2 3.47Å; T66-F92 VanDerWaalsContact CG2-CE2 3.47Å; T66-F92 HydrophobicContact CG2-CZ 3.76Å; T66-S384 PolarHBondContact N-OG 3.16Å; T66-S384 PolarHBondContact OG1-OG 2.85Å
67	P	96.9	Very high	93	Very high	19 Å²	19	48.2 Å²	48.2	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-55.2	-32.1	175.4	-28.2	36.9	0	0	0	113.7	N71 F92 D96 Y97 A100	P67-N71 PolarHBondContact O-N 3.39Å; P67-N71 VanDerWaalsContact O-N 3.08Å; P67-F92 HydrophobicContact CG-CB 4.05Å; P67-F92 HydrophobicContact CG-CD1 3.96Å; P67-F92 HydrophobicContact CG-CG 4.15Å; P67-D96 HydrophobicContact CB-CB 4.23Å; P67-D96 HydrophobicContact CG-CB 3.9Å; P67-Y97 HydrophobicContact CG-CD1 4.12Å; P67-Y97 HydrophobicContact CG-CD2 4.15Å; P67-Y97 HydrophobicContact CG-CE1 4.02Å; P67-Y97 HydrophobicContact CG-CE2 4.03Å; P67-Y97 HydrophobicContact CG-CG 4.2Å; P67-A100 HydrophobicContact CB-CB 4.21Å; P67-A100 WeakPolarHBondContact O-CB 3.43Å
68	H	95.4	Very high	93.5	Very high	134 Å²	134	43.5 Å²	43.5	62%	0.62	23%	0.226	S	C	*	.	H	α-helix	trans	-62.4	-51	177.6	-179.7	73.1	0	0	0	112.4	T66 N71 L72	T66-H68 PolarHBondContact O-N 3.19Å; T66-H68 VanDerWaalsContact O-N 3.16Å; H68-N71 WeakPolarHBondContact O-CB 3.46Å; H68-N71 PolarHBondContact O-N 3.48Å; H68-L72 PolarHBondContact O-N 3.33Å
69	T	95.3	Very high	94.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-78.8	-25	179	57.8	0	0	0	0	112.9	V65 T66 N71 L72 F73 S384 N385 A388	V65-T69 WeakPolarHBondContact CG1-OG1 3.18Å; T66-T69 PolarHBondContact N-OG1 3.16Å; T66-T69 PolarHBondContact O-N 3.44Å; T66-T69 PolarHBondContact O-OG1 3.04Å; T69-N71 VanDerWaalsContact C-N 3.26Å; T69-N71 PolarHBondContact O-N 2.93Å; T69-L72 WeakPolarHBondContact O-CB 3.42Å; T69-L72 PolarHBondContact O-N 3.28Å; T69-L72 VanDerWaalsContact O-N 3.14Å; T69-F73 WeakPolarHBondContact O-CD2 3.46Å; T69-F73 WeakPolarHBondContact O-CG 3.45Å; T69-F73 PolarHBondContact O-N 3.02Å; T69-S384 WeakPolarHBondContact CG2-OG 3.47Å; T69-S384 PolarHBondContact OG1-OG 2.82Å; T69-N385 VanDerWaalsContact CG2-OD1 3.23Å; T69-N385 WeakPolarHBondContact CG2-OD1 3.25Å; T69-A388 HydrophobicContact CG2-CB 3.88Å
70	A	96.3	Very high	94.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.6	-44.7	168.3	0	0	0	0	0	110.1	V65 T66 L72 F73 S74 V80 Y97 A100 A102	V65-A70 HydrophobicContact CG1-CB 4.11Å; T66-A70 WeakPolarHBondContact O-CB 3.43Å; T66-A70 PolarHBondContact O-N 2.86Å; A70-L72 VanDerWaalsContact C-N 3.32Å; A70-L72 PolarHBondContact O-N 2.66Å; A70-F73 PolarHBondContact O-N 3.46Å; A70-S74 PolarHBondContact O-N 2.9Å; A70-S74 PolarHBondContact O-OG 2.86Å; A70-V80 HydrophobicContact CB-CG1 4.47Å; A70-Y97 HydrophobicContact CB-CD1 4.23Å; A70-A100 HydrophobicContact CB-CB 4.15Å; A70-A102 HydrophobicContact CB-CB 4.37Å
71	N	95.8	Very high	94.9	Very high	52 Å²	52	33.7 Å²	33.7	28%	0.278	18%	0.176	S	C	.	.	H	α-helix	trans	-64.2	-34.3	173.8	-170.8	-112.8	0	0	0	113.2	P67 H68 T69 K75 A100	P67-N71 PolarHBondContact O-N 3.39Å; P67-N71 VanDerWaalsContact O-N 3.08Å; H68-N71 WeakPolarHBondContact O-CB 3.46Å; H68-N71 PolarHBondContact O-N 3.48Å; T69-N71 VanDerWaalsContact C-N 3.26Å; T69-N71 PolarHBondContact O-N 2.93Å; N71-K75 WeakPolarHBondContact O-CB 3.33Å; N71-K75 WeakPolarHBondContact O-CD 3.19Å; N71-K75 VanDerWaalsContact O-CG 3.28Å; N71-K75 WeakPolarHBondContact O-CG 3.21Å; N71-K75 PolarHBondContact O-N 3.5Å; N71-K75 WeakPolarHBondContact OD1-CE 3.48Å; N71-K75 PolarHBondContact OD1-NZ 2.61Å; N71-A100 VanDerWaalsContact CA-O 3.3Å; N71-A100 WeakPolarHBondContact CA-O 3.19Å; N71-A100 HydrophobicContact CB-CB 4Å; N71-A100 WeakPolarHBondContact CB-O 3.37Å; N71-A100 PolarHBondContact ND2-O 3.18Å
72	L	93.3	Very high	95	Very high	63 Å²	63	29.2 Å²	29.2	33%	0.33	16%	0.157	S	C	.	.	H	α-helix	trans	-64.1	-49.6	173	-178.2	62.1	0	0	0	111.4	H68 T69 A70 S74 K75 C76 A388 L392	H68-L72 PolarHBondContact O-N 3.33Å; T69-L72 WeakPolarHBondContact O-CB 3.42Å; T69-L72 PolarHBondContact O-N 3.28Å; T69-L72 VanDerWaalsContact O-N 3.14Å; A70-L72 VanDerWaalsContact C-N 3.32Å; A70-L72 PolarHBondContact O-N 2.66Å; L72-S74 PolarHBondContact O-N 3.16Å; L72-K75 WeakPolarHBondContact O-CB 3.48Å; L72-K75 PolarHBondContact O-N 2.93Å; L72-K75 VanDerWaalsContact O-N 3.16Å; L72-C76 PolarHBondContact O-N 2.7Å; L72-C76 PolarHBondContact O-SG 2.63Å; L72-C76 VanDerWaalsContact O-SG 3.37Å; L72-A388 HydrophobicContact CD2-CB 4.38Å; L72-L392 HydrophobicContact CD2-CD1 3.86Å; L72-L392 HydrophobicContact CG-CD1 4.06Å
73	F	95	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-43.8	177.6	-65.4	-44.9	0	0	0	112.3	I50 V65 T69 A70 K75 C76 G77 F78 V80 L120 A388 L391	I50-F73 HydrophobicContact CD1-CB 4.17Å; I50-F73 HydrophobicContact CD1-CD1 4.14Å; I50-F73 HydrophobicContact CD1-CD2 4.14Å; I50-F73 HydrophobicContact CD1-CG 3.92Å; V65-F73 HydrophobicContact CG1-CD2 4.33Å; V65-F73 HydrophobicContact CG1-CE2 4.13Å; V65-F73 HydrophobicContact CG2-CE2 3.85Å; T69-F73 WeakPolarHBondContact O-CD2 3.46Å; T69-F73 WeakPolarHBondContact O-CG 3.45Å; T69-F73 PolarHBondContact O-N 3.02Å; A70-F73 PolarHBondContact O-N 3.46Å; F73-K75 VanDerWaalsContact C-N 3.3Å; F73-K75 PolarHBondContact O-N 2.78Å; F73-C76 PolarHBondContact O-N 2.89Å; F73-G77 PolarHBondContact O-N 2.89Å; F73-F78 HydrophobicContact CB-CB 4.26Å; F73-F78 HydrophobicContact CB-CD2 4.2Å; F73-F78 HydrophobicContact CD1-CD2 4.29Å; F73-F78 HydrophobicContact CD1-CE2 4.48Å; F73-F78 PolarHBondContact O-N 3.46Å; F73-V80 HydrophobicContact CB-CG2 3.71Å; F73-V80 HydrophobicContact CD2-CG2 4.35Å; F73-L120 HydrophobicContact CE2-CD1 4.04Å; F73-L120 HydrophobicContact CZ-CD1 4.15Å; F73-A388 HydrophobicContact CE1-CB 3.83Å; F73-A388 HydrophobicContact CE2-CB 4.43Å; F73-A388 HydrophobicContact CZ-CB 3.6Å; F73-L391 HydrophobicContact CD1-CD2 4.46Å; F73-L391 HydrophobicContact CE1-CB 4.45Å; F73-L391 HydrophobicContact CE1-CD2 3.83Å; F73-L391 HydrophobicContact CE1-CG 4.47Å; F73-L391 HydrophobicContact CZ-CD2 4.14Å
74	S	93.2	Very high	94.8	Very high	35 Å²	35	33.1 Å²	33.1	25%	0.245	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-32.9	174.7	-62.7	0	0	0	0	113	A70 L72 G77 G101	A70-S74 PolarHBondContact O-N 2.9Å; A70-S74 PolarHBondContact O-OG 2.86Å; L72-S74 PolarHBondContact O-N 3.16Å; S74-G77 PolarHBondContact O-N 2.78Å; S74-G101 PolarHBondContact OG-O 2.85Å
75	K	91.1	Very high	94.6	Very high	159 Å²	159	33.6 Å²	33.6	69%	0.691	19%	0.186	S	C	*	.	H	α-helix	trans	-72.8	-32.6	172.4	-80.2	168.5	171.8	163.5	0	113.4	N71 L72 F73 G77	N71-K75 WeakPolarHBondContact O-CB 3.33Å; N71-K75 WeakPolarHBondContact O-CD 3.19Å; N71-K75 VanDerWaalsContact O-CG 3.28Å; N71-K75 WeakPolarHBondContact O-CG 3.21Å; N71-K75 PolarHBondContact O-N 3.5Å; N71-K75 WeakPolarHBondContact OD1-CE 3.48Å; N71-K75 PolarHBondContact OD1-NZ 2.61Å; L72-K75 WeakPolarHBondContact O-CB 3.48Å; L72-K75 PolarHBondContact O-N 2.93Å; L72-K75 VanDerWaalsContact O-N 3.16Å; F73-K75 VanDerWaalsContact C-N 3.3Å; F73-K75 PolarHBondContact O-N 2.78Å; K75-G77 VanDerWaalsContact C-N 3.28Å
76	C	87.8	Confident	94.4	Very high	44 Å²	44	34 Å²	34	30%	0.297	19%	0.189	S	C	.	.	H	α-helix	trans	-71.4	-24.8	171.1	-67.4	0	0	0	0	112.2	Y45 L72 F73 F78 L392	Y45-C76 HydrophobicContact CD2-CB 4.05Å; Y45-C76 WeakPolarHBondContact CD2-O 3.49Å; Y45-C76 HydrophobicContact CE2-CB 4.22Å; L72-C76 PolarHBondContact O-N 2.7Å; L72-C76 PolarHBondContact O-SG 2.63Å; L72-C76 VanDerWaalsContact O-SG 3.37Å; F73-C76 PolarHBondContact O-N 2.89Å; C76-F78 HydrophobicContact CB-CD2 4.31Å; C76-L392 HydrophobicContact CB-CD2 4.1Å
77	G	90.7	Very high	94.2	Very high	30 Å²	30	33.9 Å²	33.9	31%	0.309	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	124.4	-6	171.2	0	0	0	0	0	115.1	N46 F73 S74 K75	N46-G77 VanDerWaalsContact CA-O 3.31Å; N46-G77 WeakPolarHBondContact CA-O 3.42Å; F73-G77 PolarHBondContact O-N 2.89Å; S74-G77 PolarHBondContact O-N 2.78Å; K75-G77 VanDerWaalsContact C-N 3.28Å
78	F	94.6	Very high	94.1	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.018	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-67.6	143.3	178.2	-65.4	-83.2	0	0	0	112.1	Y45 L48 I50 F73 C76 I118 L391 L392	Y45-F78 HydrophobicContact CD1-CD1 4.43Å; Y45-F78 AromaticContact CD1-CE1 3.59Å; Y45-F78 HydrophobicContact CD1-CE1 3.59Å; Y45-F78 AromaticContact CD1-CE2 3.67Å; Y45-F78 HydrophobicContact CD1-CE2 3.67Å; Y45-F78 AromaticContact CD1-CZ 3.16Å; Y45-F78 HydrophobicContact CD1-CZ 3.16Å; Y45-F78 HydrophobicContact CD2-CD2 4.33Å; Y45-F78 AromaticContact CD2-CE2 3.82Å; Y45-F78 HydrophobicContact CD2-CE2 3.82Å; Y45-F78 HydrophobicContact CD2-CZ 4.2Å; Y45-F78 HydrophobicContact CE1-CE1 4.15Å; Y45-F78 AromaticContact CE1-CE2 3.82Å; Y45-F78 HydrophobicContact CE1-CE2 3.82Å; Y45-F78 AromaticContact CE1-CZ 3.33Å; Y45-F78 HydrophobicContact CE1-CZ 3.33Å; Y45-F78 AromaticContact CE2-CE2 3.98Å; Y45-F78 HydrophobicContact CE2-CE2 3.98Å; Y45-F78 HydrophobicContact CE2-CZ 4.34Å; Y45-F78 HydrophobicContact CG-CD1 4.48Å; Y45-F78 HydrophobicContact CG-CD2 4.14Å; Y45-F78 HydrophobicContact CG-CE1 4.04Å; Y45-F78 AromaticContact CG-CE2 3.65Å; Y45-F78 HydrophobicContact CG-CE2 3.65Å; Y45-F78 AromaticContact CG-CZ 3.62Å; Y45-F78 HydrophobicContact CG-CZ 3.62Å; Y45-F78 AromaticContact CZ-CE2 3.96Å; Y45-F78 AromaticContact CZ-CZ 3.93Å; Y45-F78 WeakPolarHBondContact O-CA 3.32Å; L48-F78 HydrophobicContact CB-CD1 3.92Å; L48-F78 HydrophobicContact CB-CE1 4.05Å; L48-F78 HydrophobicContact CD1-CE1 4.14Å; I50-F78 HydrophobicContact CD1-CB 3.72Å; I50-F78 HydrophobicContact CD1-CD1 3.69Å; I50-F78 HydrophobicContact CD1-CD2 3.92Å; I50-F78 HydrophobicContact CD1-CE1 4.16Å; I50-F78 HydrophobicContact CD1-CE2 4.38Å; I50-F78 HydrophobicContact CD1-CG 3.53Å; I50-F78 HydrophobicContact CD1-CZ 4.46Å; I50-F78 HydrophobicContact CG1-CB 4.12Å; I50-F78 HydrophobicContact CG1-CD1 3.86Å; I50-F78 HydrophobicContact CG1-CE1 4.43Å; I50-F78 HydrophobicContact CG1-CG 4.1Å; F73-F78 HydrophobicContact CB-CB 4.26Å; F73-F78 HydrophobicContact CB-CD2 4.2Å; F73-F78 HydrophobicContact CD1-CD2 4.29Å; F73-F78 HydrophobicContact CD1-CE2 4.48Å; F73-F78 PolarHBondContact O-N 3.46Å; C76-F78 HydrophobicContact CB-CD2 4.31Å; F78-I118 HydrophobicContact CE1-CD1 4.06Å; F78-L391 HydrophobicContact CZ-CD2 4.41Å; F78-L391 HydrophobicContact CZ-CG 4.48Å; F78-L392 HydrophobicContact CE2-CD2 4.15Å
79	T	95.8	Very high	94	Very high	33 Å²	33	33.6 Å²	33.6	20%	0.202	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	123.9	161.5	-65.3	0	0	0	0	108.7	L48 H49 I50 F81 K103	L48-T79 PolarHBondContact O-N 3.04Å; H49-T79 WeakPolarHBondContact CA-O 3.48Å; I50-T79 PolarHBondContact N-O 2.94Å; T79-F81 HydrophobicContact CG2-CE1 4.24Å; T79-F81 HydrophobicContact CG2-CE2 4.13Å; T79-F81 HydrophobicContact CG2-CZ 3.99Å; T79-K103 HydrophobicContact CG2-CD 3.99Å
80	V	96.9	Very high	94	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.4	177	-174.6	0	0	0	0	109.3	I52 A70 F73 V82 A102 K103	I52-V80 HydrophobicContact CG1-CG1 3.95Å; A70-V80 HydrophobicContact CB-CG1 4.47Å; F73-V80 HydrophobicContact CB-CG2 3.71Å; F73-V80 HydrophobicContact CD2-CG2 4.35Å; V80-V82 HydrophobicContact CG1-CG2 4.09Å; V80-A102 HydrophobicContact CB-CB 3.86Å; V80-A102 HydrophobicContact CG1-CB 3.98Å; V80-A102 CarbonylContact O-C 3.52Å; V80-A102 WeakPolarHBondContact O-CA 3.44Å; V80-K103 PolarHBondContact O-N 3.23Å
81	F	96.3	Very high	93.9	Very high	11 Å²	11	40.4 Å²	40.4	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	133.4	170.9	-67.5	-64	0	0	0	110.1	H49 I50 I52 T79 K103 I105 L112 Q115	H49-F81 HydrophobicContact CB-CD2 3.99Å; H49-F81 HydrophobicContact CB-CE2 3.8Å; H49-F81 AromaticContact CG-CE2 3.66Å; H49-F81 AromaticContact ND1-CE2 3.63Å; I50-F81 PolarHBondContact O-N 3.47Å; I52-F81 WeakPolarHBondContact CB-O 3.38Å; I52-F81 PolarHBondContact N-O 3.44Å; T79-F81 HydrophobicContact CG2-CE1 4.24Å; T79-F81 HydrophobicContact CG2-CE2 4.13Å; T79-F81 HydrophobicContact CG2-CZ 3.99Å; F81-K103 CarbonylContact C-O 3.55Å; F81-K103 WeakPolarHBondContact CA-O 3.39Å; F81-K103 HydrophobicContact CD1-CB 3.74Å; F81-K103 HydrophobicContact CD1-CD 4.17Å; F81-K103 HydrophobicContact CE1-CB 4.01Å; F81-K103 HydrophobicContact CE1-CD 3.61Å; F81-K103 HydrophobicContact CE1-CG 4.46Å; F81-K103 HydrophobicContact CZ-CD 4.41Å; F81-I105 HydrophobicContact CB-CG1 4.05Å; F81-I105 HydrophobicContact CD1-CD1 3.67Å; F81-I105 HydrophobicContact CD1-CG1 3.94Å; F81-I105 HydrophobicContact CE1-CD1 4.04Å; F81-I105 HydrophobicContact CG-CD1 4.39Å; F81-I105 HydrophobicContact CG-CG1 4.27Å; F81-L112 HydrophobicContact CB-CD1 3.76Å; F81-Q115 HydrophobicContact CD2-CB 4.46Å; F81-Q115 HydrophobicContact CE2-CB 4.07Å
82	V	95.9	Very high	93.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.1	-179.8	-173.4	0	0	0	0	109.2	I52 V80 A86 Y97 A102 K103 I104 I105	I52-V82 HydrophobicContact CB-CB 4.38Å; I52-V82 HydrophobicContact CB-CG1 4.28Å; I52-V82 HydrophobicContact CB-CG2 4.09Å; I52-V82 HydrophobicContact CG1-CG2 4.14Å; I52-V82 HydrophobicContact CG2-CG1 4.29Å; V80-V82 HydrophobicContact CG1-CG2 4.09Å; V82-A86 HydrophobicContact CG1-CB 4.05Å; V82-Y97 HydrophobicContact CG1-CD1 4.36Å; V82-Y97 HydrophobicContact CG1-CD2 4.45Å; V82-Y97 HydrophobicContact CG1-CE1 4.45Å; V82-Y97 HydrophobicContact CG1-CG 4.34Å; V82-Y97 HydrophobicContact CG2-CD1 3.81Å; V82-Y97 HydrophobicContact CG2-CE1 4.33Å; V82-Y97 HydrophobicContact CG2-CG 4.2Å; V82-A102 HydrophobicContact CG2-CB 3.99Å; V82-K103 PolarHBondContact N-O 3.41Å; V82-I104 HydrophobicContact CB-CD1 4.13Å; V82-I104 CarbonylContact O-C 3.54Å; V82-I104 WeakPolarHBondContact O-CA 3.4Å; V82-I105 PolarHBondContact O-N 3.3Å
83	Q	94.6	Very high	94	Very high	42 Å²	42	41.4 Å²	41.4	20%	0.196	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	136	173	-174.9	-179.1	1.9	0	0	110.2	I52 K54 G85 A86 L112	I52-Q83 PolarHBondContact O-N 3.39Å; K54-Q83 HydrophobicContact CB-CG 4.45Å; K54-Q83 VanDerWaalsContact CB-OE1 3.29Å; Q83-G85 PolarHBondContact O-N 3.26Å; Q83-A86 HydrophobicContact CB-CB 4.48Å; Q83-A86 WeakPolarHBondContact O-CB 3.44Å; Q83-A86 PolarHBondContact O-N 3.24Å; Q83-A86 VanDerWaalsContact O-N 3.1Å; Q83-L112 HydrophobicContact CB-CD2 4.31Å
84	T	94.5	Very high	94	Very high	63 Å²	63	42.9 Å²	42.9	39%	0.387	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	133.7	177.3	-177.2	0	0	0	0	112.4	A86 D94 I105 T106	T84-A86 VanDerWaalsContact C-N 3.29Å; T84-A86 PolarHBondContact O-N 3.3Å; T84-D94 WeakPolarHBondContact CA-OD2 3.38Å; T84-D94 VanDerWaalsContact CB-OD2 3.3Å; T84-D94 WeakPolarHBondContact CB-OD2 3.31Å; T84-D94 PolarHBondContact OG1-OD2 2.91Å; T84-I105 PolarHBondContact N-O 3.31Å; T84-T106 HydrophobicContact CG2-CG2 4.45Å
85	G	92.2	Very high	94.2	Very high	13 Å²	13	44 Å²	44	13%	0.134	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	13.2	-178.9	0	0	0	0	0	115.7	Q83 D94	Q83-G85 PolarHBondContact O-N 3.26Å; G85-D94 WeakPolarHBondContact CA-OD1 3.4Å; G85-D94 PolarHBondContact N-OD1 3Å; G85-D94 PolarHBondContact N-OD2 3.38Å
86	A	93.3	Very high	94.4	Very high	7 Å²	7	38.7 Å²	38.7	6%	0.058	23%	0.227	C	C	.	.	S	Bend	trans	-65.2	-42.9	177.2	0	0	0	0	0	113	K54 V63 V82 Q83 T84	K54-A86 HydrophobicContact CB-CB 3.93Å; V63-A86 HydrophobicContact CG2-CB 4.28Å; V82-A86 HydrophobicContact CG1-CB 4.05Å; Q83-A86 HydrophobicContact CB-CB 4.48Å; Q83-A86 WeakPolarHBondContact O-CB 3.44Å; Q83-A86 PolarHBondContact O-N 3.24Å; Q83-A86 VanDerWaalsContact O-N 3.1Å; T84-A86 VanDerWaalsContact C-N 3.29Å; T84-A86 PolarHBondContact O-N 3.3Å
87	G	93.3	Very high	94.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-82.6	-11.4	-177.7	0	0	0	0	0	115.7	N89 S90 N91 F92	G87-N89 PolarHBondContact O-N 3.04Å; G87-S90 CarbonylContact O-C 3.59Å; G87-S90 WeakPolarHBondContact O-CA 3.31Å; G87-S90 WeakPolarHBondContact O-CB 3.39Å; G87-S90 PolarHBondContact O-N 2.9Å; G87-N91 PolarHBondContact O-N 3.31Å; G87-F92 CarbonylContact C-O 3.54Å; G87-F92 WeakPolarHBondContact CA-O 3.46Å; G87-F92 PolarHBondContact O-N 2.99Å
88	V	94.5	Very high	95.1	Very high	68 Å²	68	39.2 Å²	39.2	41%	0.412	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-61.2	-41.2	-166.3	170.3	0	0	0	0	112.6	S90 N91 F92	V88-S90 PolarHBondContact O-N 2.71Å; V88-S90 VanDerWaalsContact O-N 3.17Å; V88-N91 PolarHBondContact O-N 3.3Å; V88-F92 PolarHBondContact N-O 2.94Å
89	N	93.9	Very high	95.1	Very high	80 Å²	80	46.4 Å²	46.4	43%	0.428	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-67.2	-13.9	176.9	-73.3	-11.1	0	0	0	113.8	K61 G87 P376	K61-N89 HydrophobicContact CB-CB 3.8Å; K61-N89 HydrophobicContact CG-CB 4.09Å; K61-N89 CarbonylContact O-C 3.57Å; K61-N89 VanDerWaalsContact O-C 3.24Å; K61-N89 WeakPolarHBondContact O-CB 3.42Å; G87-N89 PolarHBondContact O-N 3.04Å; N89-P376 VanDerWaalsContact O-CG 3.26Å; N89-P376 WeakPolarHBondContact O-CG 3.34Å
90	S	94.7	Very high	94.9	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.014	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-101.4	6.9	173.2	-73.2	0	0	0	0	113.5	K61 R62 G87 V88 F92 G377 S380	K61-S90 PolarHBondContact O-N 2.94Å; K61-S90 PolarHBondContact O-OG 2.8Å; R62-S90 WeakPolarHBondContact CA-OG 3.34Å; G87-S90 CarbonylContact O-C 3.59Å; G87-S90 WeakPolarHBondContact O-CA 3.31Å; G87-S90 WeakPolarHBondContact O-CB 3.39Å; G87-S90 PolarHBondContact O-N 2.9Å; V88-S90 PolarHBondContact O-N 2.71Å; V88-S90 VanDerWaalsContact O-N 3.17Å; S90-F92 VanDerWaalsContact C-N 3.35Å; S90-G377 WeakPolarHBondContact O-CA 3.46Å; S90-S380 PolarHBondContact OG-OG 3.46Å
91	N	94.1	Very high	94.7	Very high	141 Å²	141	47.5 Å²	47.5	75%	0.754	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	30.3	-172.5	-54.2	-26.5	0	0	0	114.6	G87 V88	G87-N91 PolarHBondContact O-N 3.31Å; V88-N91 PolarHBondContact O-N 3.3Å
92	F	95.7	Very high	94.7	Very high	41 Å²	41	47.2 Å²	47.2	18%	0.18	27%	0.271	C	S	.	.			trans	-108.5	120.5	168.6	-58.5	-61.4	0	0	0	109.8	V63 T66 P67 G87 V88 S90 Y97	V63-F92 HydrophobicContact CG1-CD2 4.06Å; T66-F92 HydrophobicContact CG2-CD2 4.15Å; T66-F92 HydrophobicContact CG2-CE2 3.47Å; T66-F92 VanDerWaalsContact CG2-CE2 3.47Å; T66-F92 HydrophobicContact CG2-CZ 3.76Å; P67-F92 HydrophobicContact CG-CB 4.05Å; P67-F92 HydrophobicContact CG-CD1 3.96Å; P67-F92 HydrophobicContact CG-CG 4.15Å; G87-F92 CarbonylContact C-O 3.54Å; G87-F92 WeakPolarHBondContact CA-O 3.46Å; G87-F92 PolarHBondContact O-N 2.99Å; V88-F92 PolarHBondContact N-O 2.94Å; S90-F92 VanDerWaalsContact C-N 3.35Å; F92-Y97 HydrophobicContact CB-CE2 3.78Å
93	L	95.8	Very high	94.6	Very high	95 Å²	95	52.6 Å²	52.6	50%	0.497	30%	0.295	S	S	.	.			trans	-86	150.9	-178.9	-57	176.9	0	0	0	110.8	S95 D96 Y97	L93-S95 PolarHBondContact O-N 2.75Å; L93-S95 VanDerWaalsContact O-N 3.12Å; L93-D96 WeakPolarHBondContact CB-OD2 3.41Å; L93-D96 PolarHBondContact N-OD2 3.45Å; L93-D96 WeakPolarHBondContact O-CB 3.4Å; L93-D96 PolarHBondContact O-N 3.38Å; L93-Y97 WeakPolarHBondContact O-CD2 3.28Å; L93-Y97 PolarHBondContact O-N 3.33Å
94	D	96.2	Very high	94.6	Very high	32 Å²	32	52.6 Å²	52.6	17%	0.171	30%	0.295	C	S	.	.	H	α-helix	trans	-52.5	-34.8	174	-67.8	17.3	0	0	0	111.8	T84 G85 D96 Y97 V98 I104	T84-D94 WeakPolarHBondContact CA-OD2 3.38Å; T84-D94 VanDerWaalsContact CB-OD2 3.3Å; T84-D94 WeakPolarHBondContact CB-OD2 3.31Å; T84-D94 PolarHBondContact OG1-OD2 2.91Å; G85-D94 WeakPolarHBondContact CA-OD1 3.4Å; G85-D94 PolarHBondContact N-OD1 3Å; G85-D94 PolarHBondContact N-OD2 3.38Å; D94-D96 VanDerWaalsContact C-N 3.25Å; D94-D96 PolarHBondContact O-N 2.82Å; D94-Y97 PolarHBondContact O-N 2.92Å; D94-V98 WeakPolarHBondContact O-CG2 3.28Å; D94-V98 PolarHBondContact O-N 2.9Å; D94-V98 VanDerWaalsContact O-N 3.07Å; D94-I104 HydrophobicContact CB-CD1 3.93Å; D94-I104 HydrophobicContact CB-CG1 4.14Å
95	S	96.1	Very high	94.5	Very high	58 Å²	58	50.3 Å²	50.3	41%	0.406	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-24.8	175.4	62	0	0	0	0	114.1	L93 K99	L93-S95 PolarHBondContact O-N 2.75Å; L93-S95 VanDerWaalsContact O-N 3.12Å; S95-K99 WeakPolarHBondContact O-CE 3.29Å; S95-K99 VanDerWaalsContact O-CG 3.25Å; S95-K99 WeakPolarHBondContact O-CG 3.14Å; S95-K99 PolarHBondContact O-N 2.89Å; S95-K99 VanDerWaalsContact O-N 3.11Å
96	D	95.4	Very high	94.2	Very high	47 Å²	47	54.5 Å²	54.5	25%	0.251	30%	0.304	S	S	.	.	H	α-helix	trans	-82.5	-33.1	178.4	-56.5	-43.4	0	0	0	111.5	P67 L93 D94 K99 A100	P67-D96 HydrophobicContact CB-CB 4.23Å; P67-D96 HydrophobicContact CG-CB 3.9Å; L93-D96 WeakPolarHBondContact CB-OD2 3.41Å; L93-D96 PolarHBondContact N-OD2 3.45Å; L93-D96 WeakPolarHBondContact O-CB 3.4Å; L93-D96 PolarHBondContact O-N 3.38Å; D94-D96 VanDerWaalsContact C-N 3.25Å; D94-D96 PolarHBondContact O-N 2.82Å; D96-K99 PolarHBondContact O-N 2.96Å; D96-K99 IonicContact OD1-NZ 2.63Å; D96-K99 PolarHBondContact OD1-NZ 3.34Å; D96-A100 WeakPolarHBondContact O-CB 3.5Å; D96-A100 PolarHBondContact O-N 3.11Å
97	Y	96.7	Very high	93.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-39	167.8	-69.9	-81.1	0	0	0	111.8	V63 V65 P67 A70 V82 F92 L93 D94 A100 G101 A102	V63-Y97 WeakPolarHBondContact CG1-OH 3.48Å; V65-Y97 WeakPolarHBondContact O-CE1 3.17Å; V65-Y97 PolarHBondContact O-OH 2.9Å; P67-Y97 HydrophobicContact CG-CD1 4.12Å; P67-Y97 HydrophobicContact CG-CD2 4.15Å; P67-Y97 HydrophobicContact CG-CE1 4.02Å; P67-Y97 HydrophobicContact CG-CE2 4.03Å; P67-Y97 HydrophobicContact CG-CG 4.2Å; A70-Y97 HydrophobicContact CB-CD1 4.23Å; V82-Y97 HydrophobicContact CG1-CD1 4.36Å; V82-Y97 HydrophobicContact CG1-CD2 4.45Å; V82-Y97 HydrophobicContact CG1-CE1 4.45Å; V82-Y97 HydrophobicContact CG1-CG 4.34Å; V82-Y97 HydrophobicContact CG2-CD1 3.81Å; V82-Y97 HydrophobicContact CG2-CE1 4.33Å; V82-Y97 HydrophobicContact CG2-CG 4.2Å; F92-Y97 HydrophobicContact CB-CE2 3.78Å; L93-Y97 WeakPolarHBondContact O-CD2 3.28Å; L93-Y97 PolarHBondContact O-N 3.33Å; D94-Y97 PolarHBondContact O-N 2.92Å; Y97-A100 WeakPolarHBondContact O-CB 3.37Å; Y97-A100 PolarHBondContact O-N 3.16Å; Y97-G101 PolarHBondContact O-N 2.99Å; Y97-A102 WeakPolarHBondContact O-CB 3.38Å; Y97-A102 PolarHBondContact O-N 3.22Å
98	V	96	Very high	92.7	Very high	86 Å²	86	62.4 Å²	62.4	52%	0.521	35%	0.349	S	S	.	.	H	α-helix	trans	-62	-47	172.6	174.8	0	0	0	0	111.3	D94 A100 G101 I104	D94-V98 WeakPolarHBondContact O-CG2 3.28Å; D94-V98 PolarHBondContact O-N 2.9Å; D94-V98 VanDerWaalsContact O-N 3.07Å; V98-A100 PolarHBondContact O-N 2.71Å; V98-G101 PolarHBondContact O-N 2.81Å; V98-I104 HydrophobicContact CG2-CD1 4.39Å; V98-I104 HydrophobicContact CG2-CG1 3.71Å
99	K	94.7	Very high	92.2	Very high	154 Å²	154	60.5 Å²	60.5	67%	0.67	34%	0.336	S	S	*	.	H	α-helix	trans	-59.4	-32.2	173.7	-68.6	164.5	-153.9	160.1	0	112.7	S95 D96 G101	S95-K99 WeakPolarHBondContact O-CE 3.29Å; S95-K99 VanDerWaalsContact O-CG 3.25Å; S95-K99 WeakPolarHBondContact O-CG 3.14Å; S95-K99 PolarHBondContact O-N 2.89Å; S95-K99 VanDerWaalsContact O-N 3.11Å; D96-K99 PolarHBondContact O-N 2.96Å; D96-K99 IonicContact OD1-NZ 2.63Å; D96-K99 PolarHBondContact OD1-NZ 3.34Å; K99-G101 VanDerWaalsContact C-N 3.28Å; K99-G101 PolarHBondContact O-N 3.14Å
100	A	92.7	Very high	91.8	Very high	9 Å²	9	61.1 Å²	61.1	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-72.3	-18.2	177.1	0	0	0	0	0	113.8	P67 A70 N71 D96 Y97 V98	P67-A100 HydrophobicContact CB-CB 4.21Å; P67-A100 WeakPolarHBondContact O-CB 3.43Å; A70-A100 HydrophobicContact CB-CB 4.15Å; N71-A100 VanDerWaalsContact CA-O 3.3Å; N71-A100 WeakPolarHBondContact CA-O 3.19Å; N71-A100 HydrophobicContact CB-CB 4Å; N71-A100 WeakPolarHBondContact CB-O 3.37Å; N71-A100 PolarHBondContact ND2-O 3.18Å; D96-A100 WeakPolarHBondContact O-CB 3.5Å; D96-A100 PolarHBondContact O-N 3.11Å; Y97-A100 WeakPolarHBondContact O-CB 3.37Å; Y97-A100 PolarHBondContact O-N 3.16Å; V98-A100 PolarHBondContact O-N 2.71Å
101	G	93.2	Very high	91.5	Very high	48 Å²	48	62.4 Å²	62.4	50%	0.495	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.2	6.9	-176.7	0	0	0	0	0	114.8	S74 Y97 V98 K99	S74-G101 PolarHBondContact OG-O 2.85Å; Y97-G101 PolarHBondContact O-N 2.99Å; V98-G101 PolarHBondContact O-N 2.81Å; K99-G101 VanDerWaalsContact C-N 3.28Å; K99-G101 PolarHBondContact O-N 3.14Å
102	A	94.4	Very high	91.4	Very high	6 Å²	6	55.8 Å²	55.8	5%	0.05	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-86	155.8	173.3	0	0	0	0	0	111.9	A70 V80 V82 Y97	A70-A102 HydrophobicContact CB-CB 4.37Å; V80-A102 HydrophobicContact CB-CB 3.86Å; V80-A102 HydrophobicContact CG1-CB 3.98Å; V80-A102 CarbonylContact O-C 3.52Å; V80-A102 WeakPolarHBondContact O-CA 3.44Å; V82-A102 HydrophobicContact CG2-CB 3.99Å; Y97-A102 WeakPolarHBondContact O-CB 3.38Å; Y97-A102 PolarHBondContact O-N 3.22Å
103	K	94.9	Very high	91.2	Very high	113 Å²	113	53.9 Å²	53.9	49%	0.491	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.9	176.4	-64.9	171	-176.2	169.4	0	109.5	T79 V80 F81 V82	T79-K103 HydrophobicContact CG2-CD 3.99Å; V80-K103 PolarHBondContact O-N 3.23Å; F81-K103 CarbonylContact C-O 3.55Å; F81-K103 WeakPolarHBondContact CA-O 3.39Å; F81-K103 HydrophobicContact CD1-CB 3.74Å; F81-K103 HydrophobicContact CD1-CD 4.17Å; F81-K103 HydrophobicContact CE1-CB 4.01Å; F81-K103 HydrophobicContact CE1-CD 3.61Å; F81-K103 HydrophobicContact CE1-CG 4.46Å; F81-K103 HydrophobicContact CZ-CD 4.41Å; V82-K103 PolarHBondContact N-O 3.41Å
104	I	94.9	Very high	90.8	Very high	41 Å²	41	54.5 Å²	54.5	21%	0.21	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.8	174.4	-53.4	-58.8	0	0	0	109.5	V82 D94 V98 T106	V82-I104 HydrophobicContact CB-CD1 4.13Å; V82-I104 CarbonylContact O-C 3.54Å; V82-I104 WeakPolarHBondContact O-CA 3.4Å; D94-I104 HydrophobicContact CB-CD1 3.93Å; D94-I104 HydrophobicContact CB-CG1 4.14Å; V98-I104 HydrophobicContact CG2-CD1 4.39Å; V98-I104 HydrophobicContact CG2-CG1 3.71Å; I104-T106 HydrophobicContact CG2-CG2 4.38Å
105	I	92.5	Very high	90.5	Very high	16 Å²	16	56.3 Å²	56.3	8%	0.082	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.8	170.4	-60.1	-59.8	0	0	0	108.8	F81 V82 T84 L112	F81-I105 HydrophobicContact CB-CG1 4.05Å; F81-I105 HydrophobicContact CD1-CD1 3.67Å; F81-I105 HydrophobicContact CD1-CG1 3.94Å; F81-I105 HydrophobicContact CE1-CD1 4.04Å; F81-I105 HydrophobicContact CG-CD1 4.39Å; F81-I105 HydrophobicContact CG-CG1 4.27Å; V82-I105 PolarHBondContact O-N 3.3Å; T84-I105 PolarHBondContact N-O 3.31Å; I105-L112 HydrophobicContact CB-CD1 4.15Å; I105-L112 HydrophobicContact CG1-CD1 3.87Å; I105-L112 HydrophobicContact CG2-CB 4.41Å
106	T	85.7	Confident	90.4	Very high	100 Å²	100	53.5 Å²	53.5	61%	0.613	29%	0.294	S	S	*	.			trans	-104.5	-23.7	-175.7	38.2	0	0	0	0	114.2	T84 I104	T84-T106 HydrophobicContact CG2-CG2 4.45Å; I104-T106 HydrophobicContact CG2-CG2 4.38Å
107	D	75.3	Confident	90.4	Very high	126 Å²	126	52.9 Å²	52.9	67%	0.674	29%	0.29	S	S	*	.	S	Bend	trans	-85.5	-51.1	-152.7	-43.5	-27.4	0	0	0	112.5
108	S	80.1	Confident	90.4	Very high	48 Å²	48	52.9 Å²	52.9	34%	0.336	29%	0.29	S	S	.	.			trans	-158.4	163.5	177.1	101.8	0	0	0	0	110.8	E110 S111	S108-E110 WeakPolarHBondContact CB-OE2 3.44Å; S108-E110 PolarHBondContact OG-N 3.16Å; S108-E110 PolarHBondContact OG-OE2 3.32Å; S108-S111 PolarHBondContact OG-N 3.03Å; S108-S111 VanDerWaalsContact OG-N 3.14Å
109	L	83.4	Confident	90.4	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.141	27%	0.266	C	S	.	.	H	α-helix	trans	-73	-36.3	177.7	-178.5	60	0	0	0	111.3	P53 S111 L112 Y113 S134 M139	P53-L109 HydrophobicContact CB-CD1 4.42Å; L109-S111 VanDerWaalsContact C-N 3.31Å; L109-S111 PolarHBondContact O-N 3.08Å; L109-L112 WeakPolarHBondContact O-CB 3.49Å; L109-L112 PolarHBondContact O-N 3.02Å; L109-Y113 HydrophobicContact CD1-CD2 4.07Å; L109-Y113 HydrophobicContact CD1-CE2 3.66Å; L109-Y113 HydrophobicContact CD2-CE2 4.18Å; L109-Y113 HydrophobicContact CG-CD2 3.92Å; L109-Y113 HydrophobicContact CG-CE2 3.71Å; L109-Y113 WeakPolarHBondContact O-CD2 3.13Å; L109-Y113 PolarHBondContact O-N 2.91Å; L109-S134 WeakPolarHBondContact CD2-OG 3.19Å; L109-M139 HydrophobicContact CB-SD 4.27Å; L109-M139 HydrophobicContact CD2-CE 4.44Å; L109-M139 HydrophobicContact CD2-SD 3.89Å; L109-M139 HydrophobicContact CG-SD 3.84Å
110	E	85.2	Confident	90.6	Very high	94 Å²	94	41.6 Å²	41.6	44%	0.439	23%	0.234	S	C	.	.	H	α-helix	trans	-58.4	-42.7	175.1	-54.7	73.7	-166	0	0	110.9	S108 L112 Y113 D114 M139	S108-E110 WeakPolarHBondContact CB-OE2 3.44Å; S108-E110 PolarHBondContact OG-N 3.16Å; S108-E110 PolarHBondContact OG-OE2 3.32Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 3.11Å; E110-Y113 PolarHBondContact O-N 2.77Å; E110-Y113 VanDerWaalsContact O-N 3.07Å; E110-D114 PolarHBondContact O-N 3.49Å; E110-M139 HydrophobicContact CG-CE 3.97Å; E110-M139 HydrophobicContact CG-CG 4.09Å; E110-M139 HydrophobicContact CG-SD 3.99Å; E110-M139 WeakPolarHBondContact OE1-CE 3.46Å
111	S	88	Confident	90.7	Very high	29 Å²	29	41.2 Å²	41.2	20%	0.203	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-34.5	177.8	-175.5	0	0	0	0	113.1	S108 L109 Q115	S108-S111 PolarHBondContact OG-N 3.03Å; S108-S111 VanDerWaalsContact OG-N 3.14Å; L109-S111 VanDerWaalsContact C-N 3.31Å; L109-S111 PolarHBondContact O-N 3.08Å; S111-Q115 WeakPolarHBondContact O-CB 3.37Å; S111-Q115 VanDerWaalsContact O-CG 3.28Å; S111-Q115 WeakPolarHBondContact O-CG 3.24Å; S111-Q115 PolarHBondContact O-N 3.3Å; S111-Q115 PolarHBondContact O-NE2 3.02Å; S111-Q115 VanDerWaalsContact O-NE2 3.15Å; S111-Q115 PolarHBondContact OG-NE2 3.35Å
112	L	91.8	Very high	90.8	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-68.6	-46.4	172.8	-175.1	87	0	0	0	111.3	P53 F81 Q83 I105 L109 E110 S116	P53-L112 HydrophobicContact CB-CD2 3.71Å; P53-L112 HydrophobicContact CG-CD2 4.46Å; F81-L112 HydrophobicContact CB-CD1 3.76Å; Q83-L112 HydrophobicContact CB-CD2 4.31Å; I105-L112 HydrophobicContact CB-CD1 4.15Å; I105-L112 HydrophobicContact CG1-CD1 3.87Å; I105-L112 HydrophobicContact CG2-CB 4.41Å; L109-L112 WeakPolarHBondContact O-CB 3.49Å; L109-L112 PolarHBondContact O-N 3.02Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 3.11Å; L112-S116 WeakPolarHBondContact O-CB 3.25Å; L112-S116 PolarHBondContact O-N 3.19Å; L112-S116 PolarHBondContact O-OG 2.68Å
113	Y	91.4	Very high	90.7	Very high	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-72.2	-30.4	-175.2	-81.6	-67.4	0	0	0	114.2	L109 E110 I119 E136 M139 M140 K141	L109-Y113 HydrophobicContact CD1-CD2 4.07Å; L109-Y113 HydrophobicContact CD1-CE2 3.66Å; L109-Y113 HydrophobicContact CD2-CE2 4.18Å; L109-Y113 HydrophobicContact CG-CD2 3.92Å; L109-Y113 HydrophobicContact CG-CE2 3.71Å; L109-Y113 WeakPolarHBondContact O-CD2 3.13Å; L109-Y113 PolarHBondContact O-N 2.91Å; E110-Y113 PolarHBondContact O-N 2.77Å; E110-Y113 VanDerWaalsContact O-N 3.07Å; Y113-I119 HydrophobicContact CD1-CD1 3.69Å; Y113-I119 HydrophobicContact CD1-CG1 4.16Å; Y113-I119 HydrophobicContact CE1-CD1 4.02Å; Y113-I119 HydrophobicContact CE1-CG1 4.35Å; Y113-I119 HydrophobicContact CE1-CG2 3.92Å; Y113-E136 HydrophobicContact CE2-CB 4.3Å; Y113-E136 HydrophobicContact CE2-CG 4.25Å; Y113-M139 WeakPolarHBondContact CB-O 3.32Å; Y113-M139 HydrophobicContact CD2-CB 3.67Å; Y113-M139 HydrophobicContact CD2-CG 4.41Å; Y113-M139 HydrophobicContact CD2-SD 3.94Å; Y113-M139 HydrophobicContact CE2-CB 4.49Å; Y113-M139 HydrophobicContact CE2-SD 4.26Å; Y113-M139 HydrophobicContact CG-CB 3.86Å; Y113-M140 HydrophobicContact CD1-CE 4.43Å; Y113-M140 HydrophobicContact CD1-CG 3.86Å; Y113-M140 HydrophobicContact CE1-CE 3.8Å; Y113-M140 HydrophobicContact CE1-CG 4.16Å; Y113-K141 PolarHBondContact O-N 2.92Å
114	D	88.6	Confident	90.6	Very high	107 Å²	107	37.8 Å²	37.8	57%	0.572	20%	0.203	S	C	*	.	H	α-helix	trans	-76.3	-38.6	176.3	-173.4	62.8	0	0	0	112.1	E110 S116	E110-D114 PolarHBondContact O-N 3.49Å; D114-S116 VanDerWaalsContact C-N 3.3Å; D114-S116 PolarHBondContact O-N 2.71Å
115	Q	89.8	Confident	90.4	Very high	70 Å²	70	36.1 Å²	36.1	33%	0.327	20%	0.195	S	C	.	.	H	α-helix	trans	-75.4	-13.7	179	-71.1	-177.2	73.1	0	0	114.4	H49 F81 S111	H49-Q115 VanDerWaalsContact CB-O 3.27Å; H49-Q115 WeakPolarHBondContact CB-O 3.38Å; H49-Q115 PolarHBondContact ND1-O 2.74Å; F81-Q115 HydrophobicContact CD2-CB 4.46Å; F81-Q115 HydrophobicContact CE2-CB 4.07Å; S111-Q115 WeakPolarHBondContact O-CB 3.37Å; S111-Q115 VanDerWaalsContact O-CG 3.28Å; S111-Q115 WeakPolarHBondContact O-CG 3.24Å; S111-Q115 PolarHBondContact O-N 3.3Å; S111-Q115 PolarHBondContact O-NE2 3.02Å; S111-Q115 VanDerWaalsContact O-NE2 3.15Å; S111-Q115 PolarHBondContact OG-NE2 3.35Å
116	S	93.9	Very high	90	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.			trans	-100.4	129.2	-170.8	-60	0	0	0	0	113.5	G51 L112 D114	G51-S116 WeakPolarHBondContact CA-OG 3.5Å; G51-S116 PolarHBondContact N-OG 2.94Å; L112-S116 WeakPolarHBondContact O-CB 3.25Å; L112-S116 PolarHBondContact O-N 3.19Å; L112-S116 PolarHBondContact O-OG 2.68Å; D114-S116 VanDerWaalsContact C-N 3.3Å; D114-S116 PolarHBondContact O-N 2.71Å
117	D	95.5	Very high	89.7	Confident	33 Å²	33	34.4 Å²	34.4	18%	0.176	18%	0.183	C	C	.	.	S	Bend	trans	-88.6	-30.3	174	-52.4	-68.4	0	0	0	111.9	L48 H49 K141 S144 T145	L48-D117 HydrophobicContact CD2-CB 3.71Å; H49-D117 IonicContact CG-OD2 3.76Å; H49-D117 PolarHBondContact N-OD2 3.07Å; H49-D117 PolarHBondContact O-N 2.95Å; D117-K141 IonicContact OD1-NZ 2.85Å; D117-K141 PolarHBondContact OD1-NZ 3.37Å; D117-S144 CarbonylContact O-C 3.59Å; D117-S144 WeakPolarHBondContact O-CA 3.35Å; D117-T145 PolarHBondContact O-N 3.29Å
118	I	96.6	Very high	89.4	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128	176.1	-55.5	-180	0	0	0	108.2	L48 H49 I50 G51 F78 L120 T145 I147 L391 F403	L48-I118 HydrophobicContact CD1-CD1 4.44Å; H49-I118 PolarHBondContact O-N 3.34Å; I50-I118 CarbonylContact C-O 3.53Å; I50-I118 VanDerWaalsContact CA-O 3.31Å; I50-I118 WeakPolarHBondContact CA-O 3.2Å; I50-I118 HydrophobicContact CG1-CB 4.35Å; G51-I118 PolarHBondContact N-O 2.72Å; F78-I118 HydrophobicContact CE1-CD1 4.06Å; I118-L120 HydrophobicContact CG2-CD2 3.83Å; I118-L120 HydrophobicContact CG2-CG 4.37Å; I118-T145 CarbonylContact C-O 3.58Å; I118-T145 WeakPolarHBondContact CA-O 3.37Å; I118-I147 HydrophobicContact CG2-CD1 4.49Å; I118-L391 HydrophobicContact CD1-CD1 4.13Å; I118-F403 HydrophobicContact CD1-CD2 4.16Å; I118-F403 HydrophobicContact CD1-CE2 4.1Å; I118-F403 HydrophobicContact CD1-CG 4.4Å; I118-F403 HydrophobicContact CD1-CZ 4.3Å
119	I	96.9	Very high	87.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.4	178.6	-62.9	153.2	0	0	0	107.9	Y113 K121 M140 T145 L146 I147	Y113-I119 HydrophobicContact CD1-CD1 3.69Å; Y113-I119 HydrophobicContact CD1-CG1 4.16Å; Y113-I119 HydrophobicContact CE1-CD1 4.02Å; Y113-I119 HydrophobicContact CE1-CG1 4.35Å; Y113-I119 HydrophobicContact CE1-CG2 3.92Å; I119-K121 HydrophobicContact CG2-CG 4.4Å; I119-M140 HydrophobicContact CD1-CB 4.33Å; I119-M140 HydrophobicContact CD1-CE 4.32Å; I119-M140 HydrophobicContact CD1-CG 3.75Å; I119-M140 HydrophobicContact CD1-SD 4.07Å; I119-T145 PolarHBondContact N-O 3.02Å; I119-L146 HydrophobicContact CB-CD1 4.01Å; I119-L146 HydrophobicContact CG2-CD1 3.7Å; I119-I147 PolarHBondContact O-N 3.41Å
120	L	97.3	Very high	86.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.4	178.3	-54.7	-179.2	0	0	0	109.4	I50 G51 I52 S64 V65 F73 I118 I147 V387 L391	I50-L120 HydrophobicContact CG2-CD1 3.54Å; I50-L120 HydrophobicContact CG2-CG 3.85Å; G51-L120 PolarHBondContact O-N 2.78Å; G51-L120 VanDerWaalsContact O-N 3.1Å; I52-L120 HydrophobicContact CD1-CB 3.85Å; I52-L120 HydrophobicContact CD1-CD1 4.03Å; I52-L120 HydrophobicContact CD1-CG 4.25Å; S64-L120 VanDerWaalsContact CB-O 3.27Å; S64-L120 WeakPolarHBondContact CB-O 3.25Å; S64-L120 PolarHBondContact OG-O 2.83Å; V65-L120 HydrophobicContact CG2-CB 4.37Å; V65-L120 HydrophobicContact CG2-CD1 3.67Å; F73-L120 HydrophobicContact CE2-CD1 4.04Å; F73-L120 HydrophobicContact CZ-CD1 4.15Å; I118-L120 HydrophobicContact CG2-CD2 3.83Å; I118-L120 HydrophobicContact CG2-CG 4.37Å; L120-I147 HydrophobicContact CD2-CB 3.73Å; L120-I147 HydrophobicContact CD2-CD1 3.87Å; L120-I147 HydrophobicContact CD2-CG1 3.97Å; L120-V387 HydrophobicContact CD1-CG1 3.98Å; L120-V387 HydrophobicContact CD2-CG1 3.93Å; L120-V387 HydrophobicContact CG-CG1 4.38Å; L120-L391 HydrophobicContact CD1-CD2 4.41Å
121	K	96.2	Very high	84.3	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.009	23%	0.23	C	C	.	.			trans	-120.4	162.5	176	-86.9	177.5	68.4	84.3	0	111.2	P53 E55 I119 R123 P125 E136 I147 S148	P53-K121 HydrophobicContact CG-CD 3.94Å; P53-K121 HydrophobicContact CG-CG 3.49Å; P53-K121 VanDerWaalsContact CG-CG 3.49Å; E55-K121 IonicContact OE1-NZ 3.69Å; E55-K121 IonicContact OE2-NZ 3.67Å; E55-K121 PolarHBondContact OE2-NZ 2.97Å; I119-K121 HydrophobicContact CG2-CG 4.4Å; K121-R123 WeakPolarHBondContact CE-O 3.31Å; K121-P125 HydrophobicContact CD-CB 4.42Å; K121-E136 WeakPolarHBondContact CE-OE2 3.43Å; K121-E136 IonicContact NZ-OE1 3.78Å; K121-E136 PolarHBondContact NZ-OE1 2.81Å; K121-E136 VanDerWaalsContact NZ-OE1 3.16Å; K121-E136 IonicContact NZ-OE2 2.76Å; K121-E136 PolarHBondContact NZ-OE2 2.94Å; K121-I147 PolarHBondContact N-O 3.37Å; K121-S148 WeakPolarHBondContact O-CA 3.48Å; K121-S148 WeakPolarHBondContact O-CB 3.38Å
122	I	94.8	Very high	82.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-87.1	-56	168.8	-59.1	-176.9	0	0	0	109.4	E55 R62 L149 F383	E55-I122 HydrophobicContact CG-CB 4.42Å; E55-I122 WeakPolarHBondContact OE1-CA 3.44Å; E55-I122 WeakPolarHBondContact OE1-CB 3.22Å; E55-I122 PolarHBondContact OE1-N 3.44Å; R62-I122 HydrophobicContact CB-CD1 3.23Å; R62-I122 HydrophobicContact CG-CD1 4.48Å; I122-L149 HydrophobicContact CG2-CD1 4.48Å; I122-L149 VanDerWaalsContact O-CB 3.25Å; I122-L149 WeakPolarHBondContact O-CB 3.47Å; I122-L149 WeakPolarHBondContact O-CD1 3.49Å; I122-L149 VanDerWaalsContact O-CG 3.3Å; I122-L149 WeakPolarHBondContact O-CG 3.31Å; I122-L149 PolarHBondContact O-N 3.24Å; I122-L149 VanDerWaalsContact O-N 3.1Å; I122-F383 HydrophobicContact CB-CE1 4.33Å; I122-F383 HydrophobicContact CB-CZ 4.14Å; I122-F383 HydrophobicContact CG1-CD1 3.99Å; I122-F383 HydrophobicContact CG1-CE1 3.71Å; I122-F383 HydrophobicContact CG1-CZ 4.01Å; I122-F383 HydrophobicContact CG2-CE2 4.09Å; I122-F383 HydrophobicContact CG2-CZ 4.16Å
123	R	92	Very high	81.3	Confident	58 Å²	58	48.2 Å²	48.2	22%	0.219	26%	0.262	C	S	.	.	S	Bend	trans	-93.6	161.3	-175.4	-61.2	-168.5	82	94.1	2.9	111.3	E55 E60 K121	E55-R123 PolarHBondContact OE1-N 2.98Å; E60-R123 HydrophobicContact CG-CG 4.48Å; E60-R123 WeakPolarHBondContact OE2-CD 3.42Å; E60-R123 IonicContact OE2-NH1 3.39Å; E60-R123 PolarHBondContact OE2-NH1 2.78Å; K121-R123 WeakPolarHBondContact CE-O 3.31Å
124	P	91.8	Very high	80.1	Confident	36 Å²	36	49.4 Å²	49.4	23%	0.234	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-58.8	142.9	170.2	-12	21.4	0	0	0	109.8	L149 I150 L158	P124-L149 WeakPolarHBondContact CA-O 3.33Å; P124-L149 WeakPolarHBondContact CD-O 3.48Å; P124-L149 WeakPolarHBondContact CG-O 3.32Å; P124-I150 HydrophobicContact CB-CD1 4.31Å; P124-L158 HydrophobicContact CB-CD2 3.59Å
125	P	91.2	Very high	79.8	Confident	6 Å²	6	46.5 Å²	46.5	4%	0.039	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-65.8	150.7	177.5	28.4	-38	0	0	0	113.2	K121 E136 V137 M140 L146 L158	K121-P125 HydrophobicContact CD-CB 4.42Å; P125-E136 WeakPolarHBondContact CA-OE2 3.47Å; P125-E136 HydrophobicContact CB-CB 3.86Å; P125-E136 WeakPolarHBondContact CB-OE2 3.45Å; P125-V137 HydrophobicContact CB-CG2 4.35Å; P125-V137 HydrophobicContact CG-CG2 4.18Å; P125-M140 HydrophobicContact CB-CE 3.74Å; P125-M140 HydrophobicContact CG-CE 3.91Å; P125-L146 HydrophobicContact CG-CD2 3.68Å; P125-L158 HydrophobicContact CG-CD1 3.94Å; P125-L158 HydrophobicContact CG-CD2 4.32Å
126	S	85.1	Confident	79.7	Confident	14 Å²	14	43.1 Å²	43.1	10%	0.098	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-73.9	137.4	-177.8	173.6	0	0	0	0	112.8	E128 L133 S134 E136	S126-E128 PolarHBondContact OG-N 2.86Å; S126-E128 VanDerWaalsContact OG-N 3.08Å; S126-E128 PolarHBondContact OG-O 3.1Å; S126-L133 VanDerWaalsContact OG-CB 3.28Å; S126-L133 WeakPolarHBondContact OG-CB 3.49Å; S126-S134 WeakPolarHBondContact CB-O 3.14Å; S126-S134 PolarHBondContact OG-O 3.18Å; S126-E136 PolarHBondContact N-OE2 2.91Å; S126-E136 VanDerWaalsContact N-OE2 3.13Å; S126-E136 PolarHBondContact O-N 2.87Å
127	L	79.5	Confident	79.5	Confident	67 Å²	67	43.4 Å²	43.4	35%	0.351	24%	0.241	S	C	.	.			trans	-103.2	-6.4	163.9	-72	177.9	0	0	0	112.8	V137 P157 L158	L127-V137 HydrophobicContact CD2-CB 4.07Å; L127-V137 HydrophobicContact CD2-CG2 3.76Å; L127-P157 HydrophobicContact CD1-CB 4.47Å; L127-L158 HydrophobicContact CD1-CB 4.14Å; L127-L158 HydrophobicContact CD1-CD1 4.49Å; L127-L158 HydrophobicContact CD2-CD1 4.32Å; L127-L158 HydrophobicContact CG-CD1 4.15Å
128	E	68.2	Low	79.1	Confident	100 Å²	100	45 Å²	45	47%	0.467	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-76.6	130.5	178.9	-72.5	-163.7	-168.3	0	0	110.3	S126 K132 L133 S134 D135	S126-E128 PolarHBondContact OG-N 2.86Å; S126-E128 VanDerWaalsContact OG-N 3.08Å; S126-E128 PolarHBondContact OG-O 3.1Å; E128-K132 WeakPolarHBondContact OE2-CB 3.48Å; E128-K132 WeakPolarHBondContact OE2-CD 3.2Å; E128-L133 HydrophobicContact CB-CB 4.35Å; E128-L133 CarbonylContact O-C 2.99Å; E128-L133 VanDerWaalsContact O-C 3.3Å; E128-L133 VanDerWaalsContact O-O 3.08Å; E128-S134 CarbonylContact O-C 3.57Å; E128-D135 PolarHBondContact O-N 2.99Å
129	S	48.8	Very low	78.7	Confident	78 Å²	78	46.3 Å²	46.3	55%	0.545	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-79.5	160.9	175.3	-44.2	0	0	0	0	112.3	L133	S129-L133 CarbonylContact C-O 3.55Å
130	P	45.1	Very low	78.4	Confident	101 Å²	101	46.3 Å²	46.3	66%	0.656	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	145.3	176.6	-27.3	36.5	0	0	0	111.8	L133	P130-L133 VanDerWaalsContact CA-O 3.24Å; P130-L133 WeakPolarHBondContact CA-O 3.41Å; P130-L133 VanDerWaalsContact CD-O 3.31Å; P130-L133 WeakPolarHBondContact CD-O 3.42Å; P130-L133 WeakPolarHBondContact CG-O 3.49Å
131	P	48.8	Very low	78	Confident	138 Å²	138	49.3 Å²	49.3	90%	0.896	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.3	7	20.1	37.1	-38.2	0	0	0	116.1
132	K	55.1	Low	77.8	Confident	159 Å²	159	53 Å²	53	69%	0.691	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-53.3	-175.2	-74.4	-175.2	175.8	-180	0	113.5	E128	E128-K132 WeakPolarHBondContact OE2-CB 3.48Å; E128-K132 WeakPolarHBondContact OE2-CD 3.2Å
133	L	60.5	Low	77.5	Confident	40 Å²	40	57.3 Å²	57.3	21%	0.209	32%	0.321	C	S	.	.			trans	-140.6	178.3	170.3	-77.2	95.4	0	0	0	108.2	S126 E128 S129 P130	S126-L133 VanDerWaalsContact OG-CB 3.28Å; S126-L133 WeakPolarHBondContact OG-CB 3.49Å; E128-L133 HydrophobicContact CB-CB 4.35Å; E128-L133 CarbonylContact O-C 2.99Å; E128-L133 VanDerWaalsContact O-C 3.3Å; E128-L133 VanDerWaalsContact O-O 3.08Å; S129-L133 CarbonylContact C-O 3.55Å; P130-L133 VanDerWaalsContact CA-O 3.24Å; P130-L133 WeakPolarHBondContact CA-O 3.41Å; P130-L133 VanDerWaalsContact CD-O 3.31Å; P130-L133 WeakPolarHBondContact CD-O 3.42Å; P130-L133 WeakPolarHBondContact CG-O 3.49Å
134	S	67.3	Low	77.6	Confident	26 Å²	26	54.8 Å²	54.8	18%	0.182	31%	0.312	C	S	.	.			trans	-89.9	151.4	163.7	41.8	0	0	0	0	110.7	L109 S126 E128 E136	L109-S134 WeakPolarHBondContact CD2-OG 3.19Å; S126-S134 WeakPolarHBondContact CB-O 3.14Å; S126-S134 PolarHBondContact OG-O 3.18Å; E128-S134 CarbonylContact O-C 3.57Å; S134-E136 PolarHBondContact O-N 3.04Å; S134-E136 VanDerWaalsContact O-N 3.09Å
135	D	82.2	Confident	77.9	Confident	45 Å²	45	53.5 Å²	53.5	24%	0.241	30%	0.304	C	S	.	.			trans	-76.9	91.8	166.8	178.5	-11.5	0	0	0	108.2	E128 V137 S138	E128-D135 PolarHBondContact O-N 2.99Å; D135-V137 PolarHBondContact O-N 2.82Å; D135-V137 WeakPolarHBondContact OD1-CB 3.41Å; D135-V137 PolarHBondContact OD1-N 2.84Å; D135-V137 VanDerWaalsContact OD1-N 3.07Å; D135-S138 PolarHBondContact O-N 2.92Å; D135-S138 PolarHBondContact O-OG 3.44Å; D135-S138 PolarHBondContact OD1-N 2.86Å
136	E	88	Confident	78.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-27.3	-178.8	-68.9	176.8	165.4	0	0	111.5	S56 Y113 K121 P125 S126 S134 M139 M140	S56-E136 WeakPolarHBondContact CB-OE1 3.35Å; S56-E136 PolarHBondContact OG-OE1 2.9Å; Y113-E136 HydrophobicContact CE2-CB 4.3Å; Y113-E136 HydrophobicContact CE2-CG 4.25Å; K121-E136 WeakPolarHBondContact CE-OE2 3.43Å; K121-E136 IonicContact NZ-OE1 3.78Å; K121-E136 PolarHBondContact NZ-OE1 2.81Å; K121-E136 VanDerWaalsContact NZ-OE1 3.16Å; K121-E136 IonicContact NZ-OE2 2.76Å; K121-E136 PolarHBondContact NZ-OE2 2.94Å; P125-E136 WeakPolarHBondContact CA-OE2 3.47Å; P125-E136 HydrophobicContact CB-CB 3.86Å; P125-E136 WeakPolarHBondContact CB-OE2 3.45Å; S126-E136 PolarHBondContact N-OE2 2.91Å; S126-E136 VanDerWaalsContact N-OE2 3.13Å; S126-E136 PolarHBondContact O-N 2.87Å; S134-E136 PolarHBondContact O-N 3.04Å; S134-E136 VanDerWaalsContact O-N 3.09Å; E136-M139 PolarHBondContact O-N 2.9Å; E136-M140 WeakPolarHBondContact O-CG 3.46Å; E136-M140 PolarHBondContact O-N 2.82Å
137	V	88.5	Confident	78.7	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-70.6	-37.5	178.3	-177.6	0	0	0	0	111	P125 L127 D135 M139 M140 L158 L162 K165	P125-V137 HydrophobicContact CB-CG2 4.35Å; P125-V137 HydrophobicContact CG-CG2 4.18Å; L127-V137 HydrophobicContact CD2-CB 4.07Å; L127-V137 HydrophobicContact CD2-CG2 3.76Å; D135-V137 PolarHBondContact O-N 2.82Å; D135-V137 WeakPolarHBondContact OD1-CB 3.41Å; D135-V137 PolarHBondContact OD1-N 2.84Å; D135-V137 VanDerWaalsContact OD1-N 3.07Å; V137-M139 PolarHBondContact O-N 2.82Å; V137-M140 PolarHBondContact O-N 3.21Å; V137-L158 HydrophobicContact CG2-CD1 3.55Å; V137-L162 HydrophobicContact CG1-CD2 3.94Å; V137-L162 HydrophobicContact CG1-CG 4.24Å; V137-L162 HydrophobicContact CG2-CD2 4.15Å; V137-L162 HydrophobicContact CG2-CG 4.37Å; V137-K165 WeakPolarHBondContact O-CE 3.41Å; V137-K165 PolarHBondContact O-NZ 3.17Å
138	S	86.5	Confident	79.5	Confident	65 Å²	65	49.3 Å²	49.3	46%	0.455	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-26.7	174	77.4	0	0	0	0	113.1	D135 K165	D135-S138 PolarHBondContact O-N 2.92Å; D135-S138 PolarHBondContact O-OG 3.44Å; D135-S138 PolarHBondContact OD1-N 2.86Å; S138-K165 PolarHBondContact O-NZ 2.9Å
139	M	88.2	Confident	80.8	Confident	30 Å²	30	45.2 Å²	45.2	15%	0.148	26%	0.262	C	S	.	.	H	α-helix	trans	-85.5	-25.7	-177.3	-57.4	179.7	177.4	0	0	113.4	L109 E110 Y113 E136 V137 K141	L109-M139 HydrophobicContact CB-SD 4.27Å; L109-M139 HydrophobicContact CD2-CE 4.44Å; L109-M139 HydrophobicContact CD2-SD 3.89Å; L109-M139 HydrophobicContact CG-SD 3.84Å; E110-M139 HydrophobicContact CG-CE 3.97Å; E110-M139 HydrophobicContact CG-CG 4.09Å; E110-M139 HydrophobicContact CG-SD 3.99Å; E110-M139 WeakPolarHBondContact OE1-CE 3.46Å; Y113-M139 WeakPolarHBondContact CB-O 3.32Å; Y113-M139 HydrophobicContact CD2-CB 3.67Å; Y113-M139 HydrophobicContact CD2-CG 4.41Å; Y113-M139 HydrophobicContact CD2-SD 3.94Å; Y113-M139 HydrophobicContact CE2-CB 4.49Å; Y113-M139 HydrophobicContact CE2-SD 4.26Å; Y113-M139 HydrophobicContact CG-CB 3.86Å; E136-M139 PolarHBondContact O-N 2.9Å; V137-M139 PolarHBondContact O-N 2.82Å; M139-K141 PolarHBondContact O-N 2.91Å
140	M	90.4	Very high	82.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-63.8	133.8	-172.7	-65.5	179.6	-176.5	0	0	113.4	Y113 I119 P125 E136 V137 L146 L162 K165	Y113-M140 HydrophobicContact CD1-CE 4.43Å; Y113-M140 HydrophobicContact CD1-CG 3.86Å; Y113-M140 HydrophobicContact CE1-CE 3.8Å; Y113-M140 HydrophobicContact CE1-CG 4.16Å; I119-M140 HydrophobicContact CD1-CB 4.33Å; I119-M140 HydrophobicContact CD1-CE 4.32Å; I119-M140 HydrophobicContact CD1-CG 3.75Å; I119-M140 HydrophobicContact CD1-SD 4.07Å; P125-M140 HydrophobicContact CB-CE 3.74Å; P125-M140 HydrophobicContact CG-CE 3.91Å; E136-M140 WeakPolarHBondContact O-CG 3.46Å; E136-M140 PolarHBondContact O-N 2.82Å; V137-M140 PolarHBondContact O-N 3.21Å; M140-L146 HydrophobicContact CE-CD1 4.36Å; M140-L146 HydrophobicContact CE-CD2 3.99Å; M140-L146 HydrophobicContact SD-CD2 4.27Å; M140-L162 HydrophobicContact SD-CD2 3.66Å; M140-K165 VanDerWaalsContact O-CD 3.23Å; M140-K165 WeakPolarHBondContact O-CD 3.22Å; M140-K165 PolarHBondContact O-NZ 2.71Å
141	K	90.2	Very high	85	Confident	65 Å²	65	40.9 Å²	40.9	28%	0.283	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-55.4	133	170.2	-177.4	-174.6	-168.9	171.4	0	111.7	Y113 D117 M139 S144	Y113-K141 PolarHBondContact O-N 2.92Å; D117-K141 IonicContact OD1-NZ 2.85Å; D117-K141 PolarHBondContact OD1-NZ 3.37Å; M139-K141 PolarHBondContact O-N 2.91Å; K141-S144 VanDerWaalsContact O-CB 3.23Å; K141-S144 WeakPolarHBondContact O-CB 3.26Å; K141-S144 PolarHBondContact O-N 3.11Å; K141-S144 PolarHBondContact O-OG 3.06Å
142	P	91	Very high	87	Confident	80 Å²	80	34.5 Å²	34.5	52%	0.519	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	140.6	176.6	-24.7	34.8	0	0	0	112.9	S144 K165	P142-S144 PolarHBondContact O-N 2.81Å; P142-K165 WeakPolarHBondContact CA-O 3.11Å
143	N	90	Very high	88.4	Confident	90 Å²	90	30.9 Å²	30.9	48%	0.481	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	12	-173.9	-31.5	-85.9	0	0	0	115.7	K165 K166	N143-K165 PolarHBondContact N-O 3.22Å; N143-K165 VanDerWaalsContact N-O 3.15Å; N143-K166 WeakPolarHBondContact CA-O 3.38Å; N143-K166 WeakPolarHBondContact OD1-CB 3.45Å
144	S	94.5	Very high	89.6	Confident	4 Å²	4	36.9 Å²	36.9	3%	0.028	20%	0.204	C	C	.	.			trans	-63.8	167.3	170.3	68.8	0	0	0	0	112.1	D117 K141 P142 V167 N168	D117-S144 CarbonylContact O-C 3.59Å; D117-S144 WeakPolarHBondContact O-CA 3.35Å; K141-S144 VanDerWaalsContact O-CB 3.23Å; K141-S144 WeakPolarHBondContact O-CB 3.26Å; K141-S144 PolarHBondContact O-N 3.11Å; K141-S144 PolarHBondContact O-OG 3.06Å; P142-S144 PolarHBondContact O-N 2.81Å; S144-V167 WeakPolarHBondContact O-CA 3.48Å; S144-N168 PolarHBondContact O-N 3.42Å
145	T	96.3	Very high	90.5	Very high	9 Å²	9	38.2 Å²	38.2	6%	0.055	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.9	174.2	-54.6	0	0	0	0	110.3	D117 I118 I119 I147 N168 L170 F403	D117-T145 PolarHBondContact O-N 3.29Å; I118-T145 CarbonylContact C-O 3.58Å; I118-T145 WeakPolarHBondContact CA-O 3.37Å; I119-T145 PolarHBondContact N-O 3.02Å; T145-I147 HydrophobicContact CG2-CG1 4.26Å; T145-N168 CarbonylContact C-O 3.11Å; T145-N168 VanDerWaalsContact CA-O 3.29Å; T145-N168 WeakPolarHBondContact CA-O 3.44Å; T145-N168 HydrophobicContact CG2-CB 4.2Å; T145-L170 HydrophobicContact CG2-CD1 3.42Å; T145-L170 VanDerWaalsContact CG2-CD1 3.42Å; T145-F403 HydrophobicContact CG2-CZ 4.22Å
146	L	96.6	Very high	90.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.9	174.4	173.2	61.6	0	0	0	110	I119 P125 M140 L162 V167 N168 L169 L170	I119-L146 HydrophobicContact CB-CD1 4.01Å; I119-L146 HydrophobicContact CG2-CD1 3.7Å; P125-L146 HydrophobicContact CG-CD2 3.68Å; M140-L146 HydrophobicContact CE-CD1 4.36Å; M140-L146 HydrophobicContact CE-CD2 3.99Å; M140-L146 HydrophobicContact SD-CD2 4.27Å; L146-L162 HydrophobicContact CD2-CD1 4.05Å; L146-L162 HydrophobicContact CD2-CD2 4.1Å; L146-V167 HydrophobicContact CB-CG1 3.87Å; L146-N168 PolarHBondContact N-O 3.5Å; L146-L169 HydrophobicContact CB-CD1 3.96Å; L146-L169 HydrophobicContact CD2-CD1 3.67Å; L146-L169 HydrophobicContact CG-CD1 3.84Å; L146-L170 PolarHBondContact O-N 3.24Å
147	I	97.4	Very high	90.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.8	173.7	-47.4	-173.2	0	0	0	108.6	I118 I119 L120 K121 T145 L170 L172 Y390 L391 M394	I118-I147 HydrophobicContact CG2-CD1 4.49Å; I119-I147 PolarHBondContact O-N 3.41Å; L120-I147 HydrophobicContact CD2-CB 3.73Å; L120-I147 HydrophobicContact CD2-CD1 3.87Å; L120-I147 HydrophobicContact CD2-CG1 3.97Å; K121-I147 PolarHBondContact N-O 3.37Å; T145-I147 HydrophobicContact CG2-CG1 4.26Å; I147-L170 WeakPolarHBondContact CA-O 3.48Å; I147-L170 HydrophobicContact CD1-CD1 4.38Å; I147-L170 HydrophobicContact CG1-CB 4.33Å; I147-L170 HydrophobicContact CG1-CD1 4.03Å; I147-L172 HydrophobicContact CG2-CD1 4.16Å; I147-L172 HydrophobicContact CG2-CD2 3.54Å; I147-L172 HydrophobicContact CG2-CG 3.81Å; I147-Y390 HydrophobicContact CD1-CE1 4.5Å; I147-Y390 HydrophobicContact CG2-CD1 4.2Å; I147-Y390 HydrophobicContact CG2-CE1 4Å; I147-L391 HydrophobicContact CD1-CD1 4.18Å; I147-M394 HydrophobicContact CD1-CE 4.29Å
148	S	96.2	Very high	91.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	175.1	-178.8	54.6	0	0	0	0	111.9	K121 I150 L170 A171 L172	K121-S148 WeakPolarHBondContact O-CA 3.48Å; K121-S148 WeakPolarHBondContact O-CB 3.38Å; S148-I150 WeakPolarHBondContact OG-CD1 3.28Å; S148-L170 PolarHBondContact N-O 3.39Å; S148-A171 WeakPolarHBondContact O-CA 3.33Å; S148-L172 PolarHBondContact O-N 2.97Å
149	L	94.3	Very high	91.4	Very high	14 Å²	14	40.7 Å²	40.7	7%	0.073	22%	0.219	C	C	.	.			trans	-71	132.5	161.9	-61.2	166.3	0	0	0	108.6	I122 P124 Y151 L172 D173 V186 L187 F383	I122-L149 HydrophobicContact CG2-CD1 4.48Å; I122-L149 VanDerWaalsContact O-CB 3.25Å; I122-L149 WeakPolarHBondContact O-CB 3.47Å; I122-L149 WeakPolarHBondContact O-CD1 3.49Å; I122-L149 VanDerWaalsContact O-CG 3.3Å; I122-L149 WeakPolarHBondContact O-CG 3.31Å; I122-L149 PolarHBondContact O-N 3.24Å; I122-L149 VanDerWaalsContact O-N 3.1Å; P124-L149 WeakPolarHBondContact CA-O 3.33Å; P124-L149 WeakPolarHBondContact CD-O 3.48Å; P124-L149 WeakPolarHBondContact CG-O 3.32Å; L149-Y151 HydrophobicContact CB-CE2 4.18Å; L149-L172 HydrophobicContact CD2-CB 4.12Å; L149-D173 WeakPolarHBondContact CA-OD1 3.29Å; L149-D173 HydrophobicContact CD2-CB 3.89Å; L149-V186 HydrophobicContact CD2-CG2 3.9Å; L149-L187 HydrophobicContact CD2-CD2 3.88Å; L149-F383 HydrophobicContact CD1-CE2 4.46Å; L149-F383 HydrophobicContact CG-CE2 4.49Å
150	I	93.6	Very high	91.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.			trans	-125.6	-35.2	-175.1	-67	-63.2	0	0	0	112.7	P124 S148 P152 N155 L158 L169 A171 D173	P124-I150 HydrophobicContact CB-CD1 4.31Å; S148-I150 WeakPolarHBondContact OG-CD1 3.28Å; I150-P152 HydrophobicContact CG2-CB 4.4Å; I150-N155 PolarHBondContact O-ND2 3.09Å; I150-L158 HydrophobicContact CD1-CD2 4.37Å; I150-L169 HydrophobicContact CD1-CD1 3.78Å; I150-L169 HydrophobicContact CD1-CD2 4.49Å; I150-L169 HydrophobicContact CG1-CD1 3.9Å; I150-L169 HydrophobicContact CG1-CD2 4.44Å; I150-L169 HydrophobicContact CG1-CG 4.29Å; I150-L169 HydrophobicContact CG2-CD2 4.29Å; I150-A171 HydrophobicContact CB-CB 3.85Å; I150-A171 HydrophobicContact CG1-CB 4.16Å; I150-D173 PolarHBondContact N-OD1 2.86Å
151	Y	89.5	Confident	91.6	Very high	87 Å²	87	44.1 Å²	44.1	34%	0.341	24%	0.24	S	C	.	.			trans	51.1	60.8	-175.4	-53.5	-61.6	0	0	0	112.7	L149 A153 K154 N155 D173	L149-Y151 HydrophobicContact CB-CE2 4.18Å; Y151-A153 VanDerWaalsContact C-N 3.29Å; Y151-A153 PolarHBondContact O-N 2.87Å; Y151-A153 VanDerWaalsContact O-N 3.13Å; Y151-K154 PolarHBondContact O-N 2.78Å; Y151-N155 PolarHBondContact O-N 3.41Å; Y151-D173 WeakPolarHBondContact CA-OD2 3.34Å; Y151-D173 HydrophobicContact CD1-CB 3.86Å; Y151-D173 WeakPolarHBondContact CD1-OD2 3.34Å; Y151-D173 HydrophobicContact CE1-CB 3.66Å; Y151-D173 PolarHBondContact N-OD1 3.32Å; Y151-D173 PolarHBondContact N-OD2 2.92Å
152	P	89.9	Confident	91.8	Very high	5 Å²	5	41 Å²	41	3%	0.032	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-39.1	-163.7	20.7	-33.5	0	0	0	113.8	I150 K154 N155 I159 D173 I417 W425	I150-P152 HydrophobicContact CG2-CB 4.4Å; P152-K154 PolarHBondContact O-N 2.9Å; P152-N155 PolarHBondContact O-N 3.4Å; P152-N155 VanDerWaalsContact O-N 3.16Å; P152-I159 HydrophobicContact CB-CD1 3.63Å; P152-D173 WeakPolarHBondContact CD-OD2 3.18Å; P152-I417 HydrophobicContact CB-CD1 4.34Å; P152-I417 HydrophobicContact CB-CG2 4.27Å; P152-I417 HydrophobicContact CG-CD1 3.94Å; P152-W425 HydrophobicContact CB-CD2 4.16Å; P152-W425 HydrophobicContact CB-CG 4.34Å; P152-W425 HydrophobicContact CG-CD2 4.27Å; P152-W425 HydrophobicContact CG-CG 4.3Å; P152-W425 HydrophobicContact CG-CZ2 4.4Å
153	A	85.9	Confident	91.9	Very high	83 Å²	83	39.3 Å²	39.3	69%	0.686	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-10.8	177.3	0	0	0	0	0	115.4	Y151 W425	Y151-A153 VanDerWaalsContact C-N 3.29Å; Y151-A153 PolarHBondContact O-N 2.87Å; Y151-A153 VanDerWaalsContact O-N 3.13Å; A153-W425 HydrophobicContact CB-CH2 3.91Å; A153-W425 HydrophobicContact CB-CZ2 3.93Å
154	K	84.2	Confident	92	Very high	166 Å²	166	43 Å²	43	72%	0.722	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-24.7	174.9	-67.2	-176.4	177.2	-178.9	0	113.4	Y151 P152	Y151-K154 PolarHBondContact O-N 2.78Å; P152-K154 PolarHBondContact O-N 2.9Å
155	N	87.8	Confident	91.8	Very high	53 Å²	53	45.4 Å²	45.4	28%	0.283	24%	0.238	S	C	.	.			trans	-117.1	37.9	-163	-69.6	-36.3	0	0	0	113.4	I150 Y151 P152 P157 L158 I159	I150-N155 PolarHBondContact O-ND2 3.09Å; Y151-N155 PolarHBondContact O-N 3.41Å; P152-N155 PolarHBondContact O-N 3.4Å; P152-N155 VanDerWaalsContact O-N 3.16Å; N155-P157 VanDerWaalsContact C-CD 3.46Å; N155-L158 HydrophobicContact CB-CB 4.42Å; N155-L158 WeakPolarHBondContact O-CB 3.12Å; N155-L158 PolarHBondContact O-N 2.98Å; N155-I159 PolarHBondContact O-N 3.13Å
156	Q	89.1	Confident	91.6	Very high	73 Å²	73	50.6 Å²	50.6	34%	0.341	26%	0.26	S	S	.	.	H	α-helix	trans	-50.6	-44.1	-179.4	-168.6	63.7	47.5	0	0	114.4	L158 I159 D160	Q156-L158 PolarHBondContact O-N 2.67Å; Q156-L158 VanDerWaalsContact O-N 3.11Å; Q156-I159 WeakPolarHBondContact O-CB 3.4Å; Q156-I159 PolarHBondContact O-N 3.35Å; Q156-D160 PolarHBondContact NE2-OD1 3.13Å; Q156-D160 PolarHBondContact O-N 3.38Å
157	P	90	Very high	91.5	Very high	84 Å²	84	50.6 Å²	50.6	55%	0.545	26%	0.26	S	S	.	.	H	α-helix	trans	-61.1	-25.5	179.5	-24.2	35.5	0	0	0	114.4	L127 N155 S161	L127-P157 HydrophobicContact CD1-CB 4.47Å; N155-P157 VanDerWaalsContact C-CD 3.46Å; P157-S161 WeakPolarHBondContact O-CB 3.12Å; P157-S161 PolarHBondContact O-N 2.94Å; P157-S161 PolarHBondContact O-OG 3.22Å
158	L	91.7	Very high	91.5	Very high	10 Å²	10	51.1 Å²	51.1	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-75.5	-42.8	174.1	172.4	60.9	0	0	0	111.4	P124 P125 L127 V137 I150 N155 Q156 D160 S161 L162	P124-L158 HydrophobicContact CB-CD2 3.59Å; P125-L158 HydrophobicContact CG-CD1 3.94Å; P125-L158 HydrophobicContact CG-CD2 4.32Å; L127-L158 HydrophobicContact CD1-CB 4.14Å; L127-L158 HydrophobicContact CD1-CD1 4.49Å; L127-L158 HydrophobicContact CD2-CD1 4.32Å; L127-L158 HydrophobicContact CG-CD1 4.15Å; V137-L158 HydrophobicContact CG2-CD1 3.55Å; I150-L158 HydrophobicContact CD1-CD2 4.37Å; N155-L158 HydrophobicContact CB-CB 4.42Å; N155-L158 WeakPolarHBondContact O-CB 3.12Å; N155-L158 PolarHBondContact O-N 2.98Å; Q156-L158 PolarHBondContact O-N 2.67Å; Q156-L158 VanDerWaalsContact O-N 3.11Å; L158-D160 VanDerWaalsContact C-N 3.33Å; L158-D160 PolarHBondContact O-N 3.2Å; L158-S161 PolarHBondContact O-N 3.18Å; L158-L162 HydrophobicContact CD1-CD1 3.78Å; L158-L162 HydrophobicContact CD1-CG 4.05Å; L158-L162 HydrophobicContact CG-CD1 3.89Å; L158-L162 WeakPolarHBondContact O-CG 3.47Å; L158-L162 PolarHBondContact O-N 2.84Å
159	I	92.7	Very high	91.5	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-59.7	-46.7	174.1	-57.4	173.9	0	0	0	109.9	P152 N155 Q156 S161 L162 S163 I417 L418 L423	P152-I159 HydrophobicContact CB-CD1 3.63Å; N155-I159 PolarHBondContact O-N 3.13Å; Q156-I159 WeakPolarHBondContact O-CB 3.4Å; Q156-I159 PolarHBondContact O-N 3.35Å; I159-S161 PolarHBondContact O-N 2.84Å; I159-L162 PolarHBondContact O-N 3.35Å; I159-S163 VanDerWaalsContact O-CB 3.24Å; I159-S163 WeakPolarHBondContact O-CB 3.24Å; I159-S163 PolarHBondContact O-N 3.07Å; I159-I417 HydrophobicContact CD1-CG2 4.06Å; I159-I417 HydrophobicContact CG1-CG2 4.38Å; I159-I417 HydrophobicContact CG2-CG2 4.32Å; I159-L418 HydrophobicContact CG2-CD1 4.24Å; I159-L418 HydrophobicContact CG2-CD2 3.74Å; I159-L418 HydrophobicContact CG2-CG 4.1Å; I159-L423 HydrophobicContact CG2-CD1 3.75Å
160	D	92	Very high	91.6	Very high	72 Å²	72	50.4 Å²	50.4	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-61.7	-27.2	178.9	-58.3	-21.4	0	0	0	112.7	Q156 L158 K164	Q156-D160 PolarHBondContact NE2-OD1 3.13Å; Q156-D160 PolarHBondContact O-N 3.38Å; L158-D160 VanDerWaalsContact C-N 3.33Å; L158-D160 PolarHBondContact O-N 3.2Å; D160-K164 VanDerWaalsContact O-CD 3.31Å; D160-K164 WeakPolarHBondContact O-CD 3.46Å; D160-K164 WeakPolarHBondContact O-CE 3.41Å; D160-K164 VanDerWaalsContact O-CG 3.32Å; D160-K164 WeakPolarHBondContact O-CG 3.42Å
161	S	91.7	Very high	91.7	Very high	30 Å²	30	50.4 Å²	50.4	21%	0.21	26%	0.259	C	S	.	.	H	α-helix	trans	-84.8	-40.9	179.2	-59.2	0	0	0	0	112.1	P157 L158 I159 S163 K164	P157-S161 WeakPolarHBondContact O-CB 3.12Å; P157-S161 PolarHBondContact O-N 2.94Å; P157-S161 PolarHBondContact O-OG 3.22Å; L158-S161 PolarHBondContact O-N 3.18Å; I159-S161 PolarHBondContact O-N 2.84Å; S161-S163 VanDerWaalsContact C-N 3.34Å; S161-K164 PolarHBondContact O-N 3.3Å
162	L	93.3	Very high	92	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-34.4	172.7	-70.8	165.7	0	0	0	112.2	V137 M140 L146 L158 I159 K165 K166 V167 L169 L418	V137-L162 HydrophobicContact CG1-CD2 3.94Å; V137-L162 HydrophobicContact CG1-CG 4.24Å; V137-L162 HydrophobicContact CG2-CD2 4.15Å; V137-L162 HydrophobicContact CG2-CG 4.37Å; M140-L162 HydrophobicContact SD-CD2 3.66Å; L146-L162 HydrophobicContact CD2-CD1 4.05Å; L146-L162 HydrophobicContact CD2-CD2 4.1Å; L158-L162 HydrophobicContact CD1-CD1 3.78Å; L158-L162 HydrophobicContact CD1-CG 4.05Å; L158-L162 HydrophobicContact CG-CD1 3.89Å; L158-L162 WeakPolarHBondContact O-CG 3.47Å; L158-L162 PolarHBondContact O-N 2.84Å; I159-L162 PolarHBondContact O-N 3.35Å; L162-K165 CarbonylContact O-C 3.49Å; L162-K165 PolarHBondContact O-N 3.46Å; L162-K165 VanDerWaalsContact O-N 3.17Å; L162-K166 PolarHBondContact O-N 2.89Å; L162-V167 HydrophobicContact CB-CB 4.34Å; L162-V167 HydrophobicContact CD2-CB 4.27Å; L162-V167 HydrophobicContact CD2-CG1 4.23Å; L162-V167 HydrophobicContact CD2-CG2 4.11Å; L162-V167 PolarHBondContact O-N 2.91Å; L162-L169 HydrophobicContact CD1-CD1 3.9Å; L162-L169 HydrophobicContact CD1-CD2 3.73Å; L162-L169 HydrophobicContact CD1-CG 4.42Å; L162-L418 HydrophobicContact CB-CD1 3.65Å
163	S	93.3	Very high	92.1	Very high	43 Å²	43	47.5 Å²	47.5	30%	0.301	25%	0.249	S	C	.	.	H	α-helix	trans	-59.1	-45.4	174.9	173.3	0	0	0	0	111.9	I159 S161 K165 K166 G421	I159-S163 VanDerWaalsContact O-CB 3.24Å; I159-S163 WeakPolarHBondContact O-CB 3.24Å; I159-S163 PolarHBondContact O-N 3.07Å; S161-S163 VanDerWaalsContact C-N 3.34Å; S163-K165 PolarHBondContact O-N 2.69Å; S163-K166 WeakPolarHBondContact O-CA 3.42Å; S163-K166 PolarHBondContact O-N 2.93Å; S163-G421 WeakPolarHBondContact CB-O 3.47Å; S163-G421 PolarHBondContact OG-O 3.38Å
164	K	92.2	Very high	92.3	Very high	168 Å²	168	44.9 Å²	44.9	73%	0.73	23%	0.226	S	C	*	.	H	α-helix	trans	-60	-29.9	176.1	-67.7	161	-167.1	160.9	0	113.2	D160 S161 K166	D160-K164 VanDerWaalsContact O-CD 3.31Å; D160-K164 WeakPolarHBondContact O-CD 3.46Å; D160-K164 WeakPolarHBondContact O-CE 3.41Å; D160-K164 VanDerWaalsContact O-CG 3.32Å; D160-K164 WeakPolarHBondContact O-CG 3.42Å; S161-K164 PolarHBondContact O-N 3.3Å; K164-K166 VanDerWaalsContact C-N 3.32Å
165	K	90.4	Very high	92.7	Very high	54 Å²	54	37.6 Å²	37.6	24%	0.235	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-0.2	174.5	-77.3	-110.8	-178	176.9	0	113.9	V137 S138 M140 P142 N143 L162 S163 V167	V137-K165 WeakPolarHBondContact O-CE 3.41Å; V137-K165 PolarHBondContact O-NZ 3.17Å; S138-K165 PolarHBondContact O-NZ 2.9Å; M140-K165 VanDerWaalsContact O-CD 3.23Å; M140-K165 WeakPolarHBondContact O-CD 3.22Å; M140-K165 PolarHBondContact O-NZ 2.71Å; P142-K165 WeakPolarHBondContact CA-O 3.11Å; N143-K165 PolarHBondContact N-O 3.22Å; N143-K165 VanDerWaalsContact N-O 3.15Å; L162-K165 CarbonylContact O-C 3.49Å; L162-K165 PolarHBondContact O-N 3.46Å; L162-K165 VanDerWaalsContact O-N 3.17Å; S163-K165 PolarHBondContact O-N 2.69Å; K165-V167 HydrophobicContact CB-CG2 3.81Å; K165-V167 PolarHBondContact O-N 2.93Å
166	K	92.7	Very high	92.6	Very high	119 Å²	119	36.1 Å²	36.1	52%	0.517	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	26.4	-175	-60.6	-167	176.7	-169	0	114.7	N143 L162 S163 K164 N420	N143-K166 WeakPolarHBondContact CA-O 3.38Å; N143-K166 WeakPolarHBondContact OD1-CB 3.45Å; L162-K166 PolarHBondContact O-N 2.89Å; S163-K166 WeakPolarHBondContact O-CA 3.42Å; S163-K166 PolarHBondContact O-N 2.93Å; K164-K166 VanDerWaalsContact C-N 3.32Å; K166-N420 WeakPolarHBondContact CB-O 3.31Å; K166-N420 CarbonylContact O-C 3Å; K166-N420 WeakPolarHBondContact O-CA 3.33Å
167	V	94.1	Very high	92.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.			trans	-65.5	139.8	-177.7	173.1	0	0	0	0	110.8	S144 L146 L162 K165 L418	S144-V167 WeakPolarHBondContact O-CA 3.48Å; L146-V167 HydrophobicContact CB-CG1 3.87Å; L162-V167 HydrophobicContact CB-CB 4.34Å; L162-V167 HydrophobicContact CD2-CB 4.27Å; L162-V167 HydrophobicContact CD2-CG1 4.23Å; L162-V167 HydrophobicContact CD2-CG2 4.11Å; L162-V167 PolarHBondContact O-N 2.91Å; K165-V167 HydrophobicContact CB-CG2 3.81Å; K165-V167 PolarHBondContact O-N 2.93Å; V167-L418 VanDerWaalsContact O-CB 3.3Å; V167-L418 WeakPolarHBondContact O-CB 3.45Å
168	N	96.2	Very high	91.8	Very high	10 Å²	10	37.8 Å²	37.8	5%	0.053	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	112.8	165.5	-73.4	-69.1	0	0	0	108.4	S144 T145 L146 L405 L418 Y419 N420	S144-N168 PolarHBondContact O-N 3.42Å; T145-N168 CarbonylContact C-O 3.11Å; T145-N168 VanDerWaalsContact CA-O 3.29Å; T145-N168 WeakPolarHBondContact CA-O 3.44Å; T145-N168 HydrophobicContact CG2-CB 4.2Å; L146-N168 PolarHBondContact N-O 3.5Å; N168-L405 HydrophobicContact CB-CD1 4.09Å; N168-L418 CarbonylContact C-O 3.39Å; N168-L418 WeakPolarHBondContact CA-O 3.39Å; N168-Y419 WeakPolarHBondContact OD1-CA 3.39Å; N168-Y419 WeakPolarHBondContact OD1-CD2 3.49Å; N168-N420 PolarHBondContact ND2-OD1 3.16Å; N168-N420 PolarHBondContact OD1-N 2.86Å; N168-N420 PolarHBondContact OD1-OD1 3.33Å
169	L	96.4	Very high	91	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.2	-168.7	-176.2	60.5	0	0	0	111.2	L146 I150 L162 I417 L418	L146-L169 HydrophobicContact CB-CD1 3.96Å; L146-L169 HydrophobicContact CD2-CD1 3.67Å; L146-L169 HydrophobicContact CG-CD1 3.84Å; I150-L169 HydrophobicContact CD1-CD1 3.78Å; I150-L169 HydrophobicContact CD1-CD2 4.49Å; I150-L169 HydrophobicContact CG1-CD1 3.9Å; I150-L169 HydrophobicContact CG1-CD2 4.44Å; I150-L169 HydrophobicContact CG1-CG 4.29Å; I150-L169 HydrophobicContact CG2-CD2 4.29Å; L162-L169 HydrophobicContact CD1-CD1 3.9Å; L162-L169 HydrophobicContact CD1-CD2 3.73Å; L162-L169 HydrophobicContact CD1-CG 4.42Å; L169-I417 HydrophobicContact CB-CB 4.34Å; L169-I417 HydrophobicContact CD2-CB 4.06Å; L169-I417 HydrophobicContact CD2-CG2 4.11Å; L169-I417 HydrophobicContact CG-CB 4.14Å; L169-I417 PolarHBondContact O-N 2.99Å; L169-L418 HydrophobicContact CB-CB 3.67Å; L169-L418 HydrophobicContact CB-CD1 4Å; L169-L418 HydrophobicContact CB-CG 3.93Å; L169-L418 HydrophobicContact CD2-CD1 3.92Å; L169-L418 HydrophobicContact CD2-CG 4.1Å; L169-L418 PolarHBondContact N-O 2.78Å; L169-L418 PolarHBondContact O-N 2.88Å
170	L	96.6	Very high	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	114.7	176.9	-58.2	114.4	0	0	0	110.2	T145 L146 I147 S148 Y390 M394 L405 I412 S415 L416	T145-L170 HydrophobicContact CG2-CD1 3.42Å; T145-L170 VanDerWaalsContact CG2-CD1 3.42Å; L146-L170 PolarHBondContact O-N 3.24Å; I147-L170 WeakPolarHBondContact CA-O 3.48Å; I147-L170 HydrophobicContact CD1-CD1 4.38Å; I147-L170 HydrophobicContact CG1-CB 4.33Å; I147-L170 HydrophobicContact CG1-CD1 4.03Å; S148-L170 PolarHBondContact N-O 3.39Å; L170-Y390 HydrophobicContact CB-CE1 4.44Å; L170-Y390 WeakPolarHBondContact CD2-OH 2.96Å; L170-M394 HydrophobicContact CD2-CE 3.97Å; L170-L405 HydrophobicContact CD1-CD2 4.14Å; L170-L405 HydrophobicContact CD2-CD2 4.04Å; L170-I412 HydrophobicContact CD2-CG2 4.23Å; L170-S415 WeakPolarHBondContact CA-O 3.49Å; L170-L416 HydrophobicContact CD1-CD1 4.46Å; L170-L416 HydrophobicContact CD2-CB 4.24Å; L170-L416 HydrophobicContact CD2-CD1 3.95Å; L170-L416 HydrophobicContact CG-CD1 3.86Å
171	A	95.6	Very high	90.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112.8	-179	0	0	0	0	0	110.6	S148 I150 D173 C174 S415 I417	S148-A171 WeakPolarHBondContact O-CA 3.33Å; I150-A171 HydrophobicContact CB-CB 3.85Å; I150-A171 HydrophobicContact CG1-CB 4.16Å; A171-D173 PolarHBondContact O-N 3.43Å; A171-C174 HydrophobicContact CB-CB 4.01Å; A171-C174 PolarHBondContact O-N 3.31Å; A171-S415 PolarHBondContact N-O 3.36Å; A171-S415 WeakPolarHBondContact O-CB 3.48Å; A171-I417 HydrophobicContact CB-CD1 3.85Å; A171-I417 HydrophobicContact CB-CG1 3.5Å; A171-I417 VanDerWaalsContact CB-CG1 3.5Å
172	L	95.6	Very high	89.9	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-65.3	-24.5	179.4	-65.1	171.6	0	0	0	112.7	I147 S148 L149 C174 I175 V186 F383 V387 Y390	I147-L172 HydrophobicContact CG2-CD1 4.16Å; I147-L172 HydrophobicContact CG2-CD2 3.54Å; I147-L172 HydrophobicContact CG2-CG 3.81Å; S148-L172 PolarHBondContact O-N 2.97Å; L149-L172 HydrophobicContact CD2-CB 4.12Å; L172-C174 VanDerWaalsContact C-N 3.29Å; L172-I175 HydrophobicContact CB-CD1 4.48Å; L172-I175 HydrophobicContact CD2-CD1 3.81Å; L172-V186 HydrophobicContact CB-CG2 3.72Å; L172-V186 HydrophobicContact CD1-CG1 4.42Å; L172-F383 HydrophobicContact CD1-CE1 4.11Å; L172-F383 HydrophobicContact CD1-CE2 4.14Å; L172-F383 HydrophobicContact CD1-CZ 3.45Å; L172-F383 VanDerWaalsContact CD1-CZ 3.45Å; L172-V387 HydrophobicContact CD1-CG2 3.69Å; L172-V387 HydrophobicContact CD2-CG2 4.19Å; L172-Y390 HydrophobicContact CD2-CD1 3.8Å; L172-Y390 HydrophobicContact CD2-CE1 4Å
173	D	91.7	Very high	89.7	Confident	29 Å²	29	52.2 Å²	52.2	16%	0.155	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-75.9	-13.2	173	56.4	-70.6	0	0	0	114	L149 I150 Y151 P152 A171 L187	L149-D173 WeakPolarHBondContact CA-OD1 3.29Å; L149-D173 HydrophobicContact CD2-CB 3.89Å; I150-D173 PolarHBondContact N-OD1 2.86Å; Y151-D173 WeakPolarHBondContact CA-OD2 3.34Å; Y151-D173 HydrophobicContact CD1-CB 3.86Å; Y151-D173 WeakPolarHBondContact CD1-OD2 3.34Å; Y151-D173 HydrophobicContact CE1-CB 3.66Å; Y151-D173 PolarHBondContact N-OD1 3.32Å; Y151-D173 PolarHBondContact N-OD2 2.92Å; P152-D173 WeakPolarHBondContact CD-OD2 3.18Å; A171-D173 PolarHBondContact O-N 3.43Å; D173-L187 HydrophobicContact CB-CD1 4.2Å; D173-L187 HydrophobicContact CB-CD2 4.38Å
174	C	91.5	Very high	89.7	Confident	29 Å²	29	50.9 Å²	50.9	20%	0.196	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-98.9	8.6	175.6	-68.8	0	0	0	0	113.4	A171 L172 I417	A171-C174 HydrophobicContact CB-CB 4.01Å; A171-C174 PolarHBondContact O-N 3.31Å; L172-C174 VanDerWaalsContact C-N 3.29Å; C174-I417 HydrophobicContact CB-CD1 4.4Å
175	I	91.4	Very high	89.6	Confident	13 Å²	13	43.5 Å²	43.5	7%	0.067	22%	0.216	C	C	.	.			trans	-64.5	125.2	175	-70.1	175.1	0	0	0	109.7	L172 A181 F184 Y390 V411	L172-I175 HydrophobicContact CB-CD1 4.48Å; L172-I175 HydrophobicContact CD2-CD1 3.81Å; I175-A181 HydrophobicContact CG2-CB 4.13Å; I175-F184 HydrophobicContact CD1-CB 4.07Å; I175-F184 HydrophobicContact CG2-CB 4.24Å; I175-Y390 HydrophobicContact CD1-CD1 4.43Å; I175-Y390 HydrophobicContact CD1-CD2 4.26Å; I175-Y390 HydrophobicContact CD1-CE2 4.36Å; I175-Y390 HydrophobicContact CD1-CG 4.3Å; I175-V411 HydrophobicContact CG2-CG1 4.27Å
176	P	87.1	Confident	89.8	Confident	21 Å²	21	40.9 Å²	40.9	14%	0.136	21%	0.205	C	C	.	.			trans	-72.2	137	-175.4	27.6	-34.1	0	0	0	111.7	I178 A181 V411 D414	P176-I178 HydrophobicContact CG-CD1 4.5Å; P176-I178 PolarHBondContact O-N 2.98Å; P176-A181 WeakPolarHBondContact O-CB 3.33Å; P176-V411 HydrophobicContact CG-CG2 4.42Å; P176-D414 HydrophobicContact CB-CB 4.32Å; P176-D414 WeakPolarHBondContact CB-OD2 3.23Å; P176-D414 HydrophobicContact CG-CB 3.89Å
177	R	81.1	Confident	89.8	Confident	128 Å²	128	37.6 Å²	37.6	48%	0.483	19%	0.193	S	C	.	.			trans	-77.4	64.8	-179.6	-69.6	-173.6	172.8	169.4	4.7	112.9	D185 Y283	R177-D185 IonicContact NE-OD2 2.72Å; R177-Y283 VanDerWaalsContact CZ-OH 3.27Å; R177-Y283 VanDerWaalsContact NH1-CZ 3.26Å; R177-Y283 PolarHBondContact NH1-OH 2.73Å; R177-Y283 VanDerWaalsContact NH1-OH 3.13Å
178	I	81.5	Confident	89.6	Confident	64 Å²	64	39 Å²	39	33%	0.328	20%	0.203	S	C	.	.			trans	-109.7	154.6	173.4	62.1	175.4	0	0	0	110.5	P176 R180 A181 Q182 V411	P176-I178 HydrophobicContact CG-CD1 4.5Å; P176-I178 PolarHBondContact O-N 2.98Å; I178-R180 VanDerWaalsContact C-N 3.31Å; I178-R180 HydrophobicContact CD1-CG 3.59Å; I178-R180 HydrophobicContact CG1-CG 3.86Å; I178-R180 PolarHBondContact O-N 2.84Å; I178-A181 HydrophobicContact CG1-CB 3.78Å; I178-A181 WeakPolarHBondContact O-CA 3.17Å; I178-A181 PolarHBondContact O-N 3.5Å; I178-Q182 PolarHBondContact O-N 2.87Å; I178-V411 HydrophobicContact CD1-CG2 3.96Å
179	S	74.6	Confident	89.5	Confident	103 Å²	103	39.6 Å²	39.6	72%	0.72	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-54.5	-42.5	-172	-45.8	0	0	0	0	113.6	A181 Q182	S179-A181 PolarHBondContact O-N 2.83Å; S179-A181 VanDerWaalsContact O-N 3.11Å; S179-Q182 PolarHBondContact O-N 2.93Å
180	R	81.8	Confident	89.5	Confident	117 Å²	117	40.4 Å²	40.4	44%	0.442	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-66.7	-7.6	177.1	65.8	158.7	-78.2	-163.5	-6.8	115.3	I178 F184 D409 V411	I178-R180 VanDerWaalsContact C-N 3.31Å; I178-R180 HydrophobicContact CD1-CG 3.59Å; I178-R180 HydrophobicContact CG1-CG 3.86Å; I178-R180 PolarHBondContact O-N 2.84Å; R180-F184 WeakPolarHBondContact O-CE2 3.5Å; R180-D409 IonicContact CZ-OD1 2.78Å; R180-D409 IonicContact CZ-OD2 3.48Å; R180-D409 IonicContact NH1-OD1 2.76Å; R180-D409 PolarHBondContact NH1-OD1 2.84Å; R180-D409 IonicContact NH1-OD2 3.46Å; R180-D409 PolarHBondContact NH1-OD2 2.64Å; R180-D409 VanDerWaalsContact NH2-CG 3.3Å; R180-D409 IonicContact NH2-OD1 3.16Å; R180-D409 PolarHBondContact NH2-OD1 3.43Å; R180-D409 IonicContact NH2-OD2 2.8Å; R180-D409 PolarHBondContact NH2-OD2 2.75Å; R180-V411 HydrophobicContact CG-CG2 4.43Å
181	A	86.6	Confident	89.3	Confident	2 Å²	2	41.8 Å²	41.8	2%	0.017	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-115	-2.1	-176.4	0	0	0	0	0	113.5	I175 P176 I178 S179 S183 F184 D185 V411	I175-A181 HydrophobicContact CG2-CB 4.13Å; P176-A181 WeakPolarHBondContact O-CB 3.33Å; I178-A181 HydrophobicContact CG1-CB 3.78Å; I178-A181 WeakPolarHBondContact O-CA 3.17Å; I178-A181 PolarHBondContact O-N 3.5Å; S179-A181 PolarHBondContact O-N 2.83Å; S179-A181 VanDerWaalsContact O-N 3.11Å; A181-S183 PolarHBondContact O-N 2.95Å; A181-F184 HydrophobicContact CB-CD2 3.85Å; A181-F184 HydrophobicContact CB-CE2 4.35Å; A181-F184 WeakPolarHBondContact O-CA 3.38Å; A181-F184 WeakPolarHBondContact O-CB 3.44Å; A181-F184 PolarHBondContact O-N 3.27Å; A181-D185 PolarHBondContact O-N 3.47Å; A181-V411 HydrophobicContact CB-CG1 4.23Å; A181-V411 HydrophobicContact CB-CG2 4Å
182	Q	84.8	Confident	89.3	Confident	139 Å²	139	45.2 Å²	45.2	65%	0.65	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-61.1	-30.7	178.8	-67.7	-179.4	-3.6	0	0	112.7	I178 S179 F184 D185	I178-Q182 PolarHBondContact O-N 2.87Å; S179-Q182 PolarHBondContact O-N 2.93Å; Q182-F184 PolarHBondContact O-N 2.82Å; Q182-D185 PolarHBondContact O-N 3.35Å
183	S	88.5	Confident	89.3	Confident	57 Å²	57	45.5 Å²	45.5	40%	0.399	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-67.9	-15	172.8	50.1	0	0	0	0	114	A181 N386 N389	A181-S183 PolarHBondContact O-N 2.95Å; S183-N386 WeakPolarHBondContact O-CA 3.33Å; S183-N386 PolarHBondContact O-ND2 3.17Å; S183-N389 PolarHBondContact O-ND2 2.7Å
184	F	92.5	Very high	89.5	Confident	14 Å²	14	45.1 Å²	45.1	6%	0.061	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-104.4	-12.4	179.5	-43.3	-37.4	0	0	0	113.1	I175 R180 A181 Q182 V186 N389 Y390 V411	I175-F184 HydrophobicContact CD1-CB 4.07Å; I175-F184 HydrophobicContact CG2-CB 4.24Å; R180-F184 WeakPolarHBondContact O-CE2 3.5Å; A181-F184 HydrophobicContact CB-CD2 3.85Å; A181-F184 HydrophobicContact CB-CE2 4.35Å; A181-F184 WeakPolarHBondContact O-CA 3.38Å; A181-F184 WeakPolarHBondContact O-CB 3.44Å; A181-F184 PolarHBondContact O-N 3.27Å; Q182-F184 PolarHBondContact O-N 2.82Å; F184-V186 PolarHBondContact O-N 2.69Å; F184-N389 HydrophobicContact CD1-CB 3.7Å; F184-N389 VanDerWaalsContact CE1-C 3.47Å; F184-N389 HydrophobicContact CE1-CB 3.81Å; F184-N389 WeakPolarHBondContact CE1-O 3.34Å; F184-Y390 HydrophobicContact CB-CD2 4.34Å; F184-Y390 HydrophobicContact CB-CG 4.47Å; F184-Y390 HydrophobicContact CD2-CD2 4.13Å; F184-Y390 HydrophobicContact CG-CD2 4.17Å; F184-V411 HydrophobicContact CD2-CG1 3.85Å; F184-V411 HydrophobicContact CE2-CG1 4.14Å
185	D	91.2	Very high	89.8	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	23%	0.233	C	C	.	.			trans	-74.4	88.3	-172.1	-175.2	-6.1	0	0	0	112.4	R177 A181 Q182 L187 S188 S189	R177-D185 IonicContact NE-OD2 2.72Å; A181-D185 PolarHBondContact O-N 3.47Å; Q182-D185 PolarHBondContact O-N 3.35Å; D185-L187 PolarHBondContact O-N 2.68Å; D185-L187 WeakPolarHBondContact OD1-CA 3.26Å; D185-L187 WeakPolarHBondContact OD1-CB 3.44Å; D185-L187 PolarHBondContact OD1-N 2.72Å; D185-S188 VanDerWaalsContact CG-OG 3.27Å; D185-S188 PolarHBondContact O-N 2.73Å; D185-S188 PolarHBondContact OD1-N 3.38Å; D185-S188 VanDerWaalsContact OD2-CB 3.31Å; D185-S188 WeakPolarHBondContact OD2-CB 3.48Å; D185-S188 PolarHBondContact OD2-OG 3Å; D185-S189 PolarHBondContact O-N 3.2Å; D185-S189 VanDerWaalsContact O-N 3.14Å
186	V	94.5	Very high	90.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-30.4	173.4	-65.1	0	0	0	0	112.9	L149 L172 F184 S189 M190 F383 N386 V387	L149-V186 HydrophobicContact CD2-CG2 3.9Å; L172-V186 HydrophobicContact CB-CG2 3.72Å; L172-V186 HydrophobicContact CD1-CG1 4.42Å; F184-V186 PolarHBondContact O-N 2.69Å; V186-S189 PolarHBondContact O-N 3.32Å; V186-M190 WeakPolarHBondContact O-CB 3.41Å; V186-M190 VanDerWaalsContact O-CG 3.26Å; V186-M190 WeakPolarHBondContact O-CG 3.45Å; V186-M190 PolarHBondContact O-N 2.73Å; V186-F383 HydrophobicContact CB-CD2 3.79Å; V186-F383 HydrophobicContact CB-CE2 3.84Å; V186-F383 HydrophobicContact CG1-CD2 3.62Å; V186-F383 HydrophobicContact CG1-CE2 3.7Å; V186-F383 HydrophobicContact CG1-CG 4.19Å; V186-F383 HydrophobicContact CG1-CZ 4.32Å; V186-F383 HydrophobicContact CG2-CE2 4.18Å; V186-N386 HydrophobicContact CG1-CB 3.55Å; V186-V387 HydrophobicContact CG1-CG2 4.4Å
187	L	92.2	Very high	90.6	Very high	50 Å²	50	48.3 Å²	48.3	26%	0.262	25%	0.248	S	C	.	.	H	α-helix	trans	-70.1	-41.5	-179	-59.9	-178.7	0	0	0	110.1	L149 D173 D185 M190 A191	L149-L187 HydrophobicContact CD2-CD2 3.88Å; D173-L187 HydrophobicContact CB-CD1 4.2Å; D173-L187 HydrophobicContact CB-CD2 4.38Å; D185-L187 PolarHBondContact O-N 2.68Å; D185-L187 WeakPolarHBondContact OD1-CA 3.26Å; D185-L187 WeakPolarHBondContact OD1-CB 3.44Å; D185-L187 PolarHBondContact OD1-N 2.72Å; L187-M190 PolarHBondContact O-N 3.31Å; L187-A191 WeakPolarHBondContact O-CB 3.42Å; L187-A191 PolarHBondContact O-N 3.04Å
188	S	91.1	Very high	91.3	Very high	30 Å²	30	42.2 Å²	42.2	21%	0.21	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-42	173	-72.2	0	0	0	0	112.1	D185 A191 N192 V232	D185-S188 VanDerWaalsContact CG-OG 3.27Å; D185-S188 PolarHBondContact O-N 2.73Å; D185-S188 PolarHBondContact OD1-N 3.38Å; D185-S188 VanDerWaalsContact OD2-CB 3.31Å; D185-S188 WeakPolarHBondContact OD2-CB 3.48Å; D185-S188 PolarHBondContact OD2-OG 3Å; S188-A191 PolarHBondContact O-N 3.14Å; S188-N192 WeakPolarHBondContact O-CB 3.48Å; S188-N192 PolarHBondContact O-N 2.85Å; S188-V232 WeakPolarHBondContact O-CG1 3.23Å
189	S	93.7	Very high	92.1	Very high	22 Å²	22	39.2 Å²	39.2	15%	0.154	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-41	175	-75.1	0	0	0	0	113.2	D185 V186 I193 N386	D185-S189 PolarHBondContact O-N 3.2Å; D185-S189 VanDerWaalsContact O-N 3.14Å; V186-S189 PolarHBondContact O-N 3.32Å; S189-I193 PolarHBondContact O-N 3.48Å; S189-N386 WeakPolarHBondContact CB-OD1 3.43Å; S189-N386 PolarHBondContact OG-OD1 3.21Å
190	M	95.2	Very high	93.2	Very high	17 Å²	17	37 Å²	37	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-71.1	-37.4	175.9	-66.2	-53.6	95.8	0	0	112	R62 V186 L187 I193 S194 P372 A379 F383	R62-M190 PolarHBondContact NH1-SD 3.08Å; V186-M190 WeakPolarHBondContact O-CB 3.41Å; V186-M190 VanDerWaalsContact O-CG 3.26Å; V186-M190 WeakPolarHBondContact O-CG 3.45Å; V186-M190 PolarHBondContact O-N 2.73Å; L187-M190 PolarHBondContact O-N 3.31Å; M190-I193 HydrophobicContact CE-CD1 4.16Å; M190-I193 PolarHBondContact O-N 2.87Å; M190-S194 PolarHBondContact O-N 2.78Å; M190-S194 PolarHBondContact O-OG 3.48Å; M190-P372 HydrophobicContact CB-CG 4.21Å; M190-P372 HydrophobicContact SD-CB 3.78Å; M190-P372 HydrophobicContact SD-CG 4.32Å; M190-A379 HydrophobicContact CE-CB 4.23Å; M190-A379 WeakPolarHBondContact CE-O 3.23Å; M190-A379 HydrophobicContact SD-CB 4.1Å; M190-F383 HydrophobicContact CE-CB 4.03Å
191	A	93.9	Very high	93.9	Very high	28 Å²	28	33.1 Å²	33.1	23%	0.231	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-44.1	175	0	0	0	0	0	111.9	L187 S188 I193 S194 G195 V232 A233	L187-A191 WeakPolarHBondContact O-CB 3.42Å; L187-A191 PolarHBondContact O-N 3.04Å; S188-A191 PolarHBondContact O-N 3.14Å; A191-I193 VanDerWaalsContact C-N 3.34Å; A191-I193 PolarHBondContact O-N 2.97Å; A191-S194 PolarHBondContact O-N 2.66Å; A191-G195 PolarHBondContact O-N 3.13Å; A191-V232 HydrophobicContact CB-CB 4.1Å; A191-V232 HydrophobicContact CB-CG1 4.42Å; A191-A233 HydrophobicContact CB-CB 4.12Å; A191-A233 WeakPolarHBondContact O-CA 3.42Å; A191-A233 VanDerWaalsContact O-CB 3.26Å; A191-A233 WeakPolarHBondContact O-CB 3.25Å
192	N	94.1	Very high	94.3	Very high	72 Å²	72	33 Å²	33	39%	0.385	18%	0.175	S	C	.	.	H	α-helix	trans	-56.1	-48.6	174.1	-175.4	6.2	0	0	0	111.1	S188 S194 G195 Y196 V232 S236	S188-N192 WeakPolarHBondContact O-CB 3.48Å; S188-N192 PolarHBondContact O-N 2.85Å; N192-S194 PolarHBondContact O-N 3.4Å; N192-G195 PolarHBondContact O-N 3.1Å; N192-Y196 PolarHBondContact O-N 2.58Å; N192-Y196 VanDerWaalsContact O-N 3.08Å; N192-V232 HydrophobicContact CB-CG1 3.92Å; N192-S236 WeakPolarHBondContact O-CB 3.41Å; N192-S236 PolarHBondContact O-OG 2.88Å; N192-S236 WeakPolarHBondContact OD1-CB 3.35Å; N192-S236 PolarHBondContact OD1-OG 3.39Å
193	I	96.5	Very high	94.9	Very high	7 Å²	7	28.2 Å²	28.2	4%	0.036	16%	0.159	C	C	.	.	H	α-helix	trans	-63.5	-40.8	178.1	-69.4	176	0	0	0	111.8	S189 M190 A191 G195 K197 P372 L375 Q378 A379 L382	S189-I193 PolarHBondContact O-N 3.48Å; M190-I193 HydrophobicContact CE-CD1 4.16Å; M190-I193 PolarHBondContact O-N 2.87Å; A191-I193 VanDerWaalsContact C-N 3.34Å; A191-I193 PolarHBondContact O-N 2.97Å; I193-G195 VanDerWaalsContact C-N 3.32Å; I193-G195 PolarHBondContact O-N 2.8Å; I193-K197 WeakPolarHBondContact O-CB 3.44Å; I193-K197 PolarHBondContact O-N 3.28Å; I193-P372 HydrophobicContact CG2-CB 4.34Å; I193-L375 HydrophobicContact CG2-CB 4.07Å; I193-L375 HydrophobicContact CG2-CD2 4.06Å; I193-Q378 HydrophobicContact CD1-CG 4.16Å; I193-A379 HydrophobicContact CD1-CB 3.75Å; I193-L382 HydrophobicContact CD1-CD1 3.96Å; I193-L382 HydrophobicContact CD1-CG 4.43Å; I193-L382 HydrophobicContact CG1-CD1 4.32Å
194	S	96.3	Very high	95.2	Very high	22 Å²	22	28.8 Å²	28.8	15%	0.154	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-37.7	175	-67	0	0	0	0	112.8	M190 A191 N192 G198 P372	M190-S194 PolarHBondContact O-N 2.78Å; M190-S194 PolarHBondContact O-OG 3.48Å; A191-S194 PolarHBondContact O-N 2.66Å; N192-S194 PolarHBondContact O-N 3.4Å; S194-G198 WeakPolarHBondContact O-CA 3.3Å; S194-G198 PolarHBondContact O-N 3.01Å; S194-P372 WeakPolarHBondContact OG-CD 3.27Å; S194-P372 WeakPolarHBondContact OG-CG 3.39Å
195	G	96.5	Very high	95.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-56.1	175.6	0	0	0	0	0	112.6	A191 N192 I193 K197 G198 V199 A233	A191-G195 PolarHBondContact O-N 3.13Å; N192-G195 PolarHBondContact O-N 3.1Å; I193-G195 VanDerWaalsContact C-N 3.32Å; I193-G195 PolarHBondContact O-N 2.8Å; G195-K197 PolarHBondContact O-N 3.16Å; G195-G198 PolarHBondContact O-N 2.77Å; G195-V199 PolarHBondContact O-N 3.5Å; G195-A233 VanDerWaalsContact CA-O 3.24Å; G195-A233 WeakPolarHBondContact CA-O 3.18Å
196	Y	97.8	Very high	95.6	Very high	102 Å²	102	30.2 Å²	30.2	40%	0.4	18%	0.181	S	C	.	.	H	α-helix	trans	-55.1	-53.1	174.3	172.5	-92.6	0	0	0	111.6	N192 G198 V199 I200 S236 T240 L375	N192-Y196 PolarHBondContact O-N 2.58Å; N192-Y196 VanDerWaalsContact O-N 3.08Å; Y196-G198 VanDerWaalsContact C-N 3.33Å; Y196-G198 PolarHBondContact O-N 3.29Å; Y196-V199 PolarHBondContact O-N 3.32Å; Y196-I200 HydrophobicContact CD1-CG1 4.27Å; Y196-I200 HydrophobicContact CE1-CG1 3.8Å; Y196-I200 HydrophobicContact CE2-CD1 4.42Å; Y196-I200 HydrophobicContact CE2-CG1 4.29Å; Y196-I200 WeakPolarHBondContact O-CG1 3.3Å; Y196-I200 PolarHBondContact O-N 3.3Å; Y196-I200 VanDerWaalsContact O-N 3.12Å; Y196-S236 PolarHBondContact N-OG 3.43Å; Y196-T240 HydrophobicContact CD2-CG2 3.54Å; Y196-T240 WeakPolarHBondContact CD2-OG1 3.25Å; Y196-T240 HydrophobicContact CE2-CG2 3.9Å; Y196-T240 HydrophobicContact CG-CG2 4.38Å; Y196-L375 HydrophobicContact CD1-CD2 4.06Å; Y196-L375 HydrophobicContact CE1-CD2 4.14Å
197	K	97.4	Very high	95.5	Very high	28 Å²	28	37.2 Å²	37.2	12%	0.122	22%	0.219	C	C	.	.	H	α-helix	trans	-67.4	-33.4	-175	-174.9	53.3	179.1	151.7	0	112	I193 G195 I200 E201 L371 R374	I193-K197 WeakPolarHBondContact O-CB 3.44Å; I193-K197 PolarHBondContact O-N 3.28Å; G195-K197 PolarHBondContact O-N 3.16Å; K197-I200 PolarHBondContact O-N 3.21Å; K197-E201 HydrophobicContact CD-CG 4.32Å; K197-E201 WeakPolarHBondContact CE-OE1 3.36Å; K197-E201 HydrophobicContact CG-CG 4.42Å; K197-E201 IonicContact NZ-OE1 3.93Å; K197-E201 PolarHBondContact NZ-OE1 2.7Å; K197-E201 WeakPolarHBondContact O-CG 3.19Å; K197-E201 PolarHBondContact O-N 2.77Å; K197-L371 HydrophobicContact CG-CD2 4.27Å; K197-R374 WeakPolarHBondContact CE-O 3.49Å; K197-R374 HydrophobicContact CG-CB 4.32Å
198	G	96.6	Very high	95.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-43.7	172	0	0	0	0	0	112.7	S194 G195 Y196 E201 A202 V339	S194-G198 WeakPolarHBondContact O-CA 3.3Å; S194-G198 PolarHBondContact O-N 3.01Å; G195-G198 PolarHBondContact O-N 2.77Å; Y196-G198 VanDerWaalsContact C-N 3.33Å; Y196-G198 PolarHBondContact O-N 3.29Å; G198-E201 PolarHBondContact O-N 3.29Å; G198-A202 WeakPolarHBondContact O-CB 3.25Å; G198-A202 PolarHBondContact O-N 2.72Å; G198-V339 WeakPolarHBondContact O-CG2 3.39Å
199	V	97.7	Very high	95.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-40.9	173.9	175.8	0	0	0	0	111.7	G195 Y196 A202 A203 F210 A237 T240 A241 L244 I310	G195-V199 PolarHBondContact O-N 3.5Å; Y196-V199 PolarHBondContact O-N 3.32Å; V199-A202 PolarHBondContact O-N 3.5Å; V199-A203 WeakPolarHBondContact O-CB 3.49Å; V199-A203 PolarHBondContact O-N 3.09Å; V199-F210 HydrophobicContact CG1-CE1 3.94Å; V199-F210 HydrophobicContact CG1-CZ 4.42Å; V199-A237 HydrophobicContact CG2-CB 3.83Å; V199-A237 WeakPolarHBondContact CG2-O 3.28Å; V199-T240 HydrophobicContact CB-CG2 3.84Å; V199-T240 HydrophobicContact CG1-CG2 3.76Å; V199-T240 HydrophobicContact CG2-CG2 4.4Å; V199-A241 HydrophobicContact CG1-CB 4.15Å; V199-A241 HydrophobicContact CG2-CB 4.23Å; V199-L244 HydrophobicContact CG1-CD1 3.67Å; V199-I310 HydrophobicContact CB-CD1 4.5Å; V199-I310 HydrophobicContact CG2-CD1 3.5Å
200	I	97.5	Very high	95.8	Very high	56 Å²	56	43.7 Å²	43.7	29%	0.287	24%	0.236	S	C	.	.	H	α-helix	trans	-68.3	-39.4	178.7	-60.2	-57.6	0	0	0	112.2	Y196 K197 A202 A203 G204 T240 L244	Y196-I200 HydrophobicContact CD1-CG1 4.27Å; Y196-I200 HydrophobicContact CE1-CG1 3.8Å; Y196-I200 HydrophobicContact CE2-CD1 4.42Å; Y196-I200 HydrophobicContact CE2-CG1 4.29Å; Y196-I200 WeakPolarHBondContact O-CG1 3.3Å; Y196-I200 PolarHBondContact O-N 3.3Å; Y196-I200 VanDerWaalsContact O-N 3.12Å; K197-I200 PolarHBondContact O-N 3.21Å; I200-A202 VanDerWaalsContact C-N 3.34Å; I200-A203 PolarHBondContact O-N 2.93Å; I200-G204 PolarHBondContact O-N 2.81Å; I200-T240 HydrophobicContact CD1-CG2 4.48Å; I200-L244 HydrophobicContact CD1-CD1 4.43Å
201	E	96.5	Very high	95.8	Very high	35 Å²	35	44.6 Å²	44.6	16%	0.164	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-38.9	172.1	-66.8	-76.1	156.8	0	0	111.1	K197 G198 G204 L205 I366 L371	K197-E201 HydrophobicContact CD-CG 4.32Å; K197-E201 WeakPolarHBondContact CE-OE1 3.36Å; K197-E201 HydrophobicContact CG-CG 4.42Å; K197-E201 IonicContact NZ-OE1 3.93Å; K197-E201 PolarHBondContact NZ-OE1 2.7Å; K197-E201 WeakPolarHBondContact O-CG 3.19Å; K197-E201 PolarHBondContact O-N 2.77Å; G198-E201 PolarHBondContact O-N 3.29Å; E201-G204 PolarHBondContact O-N 2.81Å; E201-L205 PolarHBondContact O-N 2.83Å; E201-I366 HydrophobicContact CB-CD1 4.02Å; E201-I366 HydrophobicContact CB-CG2 4.36Å; E201-L371 HydrophobicContact CG-CD2 4.13Å
202	A	96.9	Very high	95.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-44.1	174.6	0	0	0	0	0	112.5	G198 V199 I200 G204 L205 F206 I308 V337 V339 I366	G198-A202 WeakPolarHBondContact O-CB 3.25Å; G198-A202 PolarHBondContact O-N 2.72Å; V199-A202 PolarHBondContact O-N 3.5Å; I200-A202 VanDerWaalsContact C-N 3.34Å; A202-G204 VanDerWaalsContact C-N 3.27Å; A202-G204 PolarHBondContact O-N 3.38Å; A202-L205 PolarHBondContact O-N 2.92Å; A202-L205 VanDerWaalsContact O-N 3.16Å; A202-F206 WeakPolarHBondContact O-CB 3.11Å; A202-F206 PolarHBondContact O-N 3.29Å; A202-I308 HydrophobicContact CB-CD1 4.31Å; A202-I308 HydrophobicContact CB-CG2 4.06Å; A202-V337 HydrophobicContact CB-CG1 4.07Å; A202-V339 HydrophobicContact CB-CG2 3.74Å; A202-I366 HydrophobicContact CB-CD1 4.32Å
203	A	95.7	Very high	95.6	Very high	39 Å²	39	45.8 Å²	45.8	32%	0.322	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-30.8	175.7	0	0	0	0	0	112.9	V199 I200 L205 F210 L244	V199-A203 WeakPolarHBondContact O-CB 3.49Å; V199-A203 PolarHBondContact O-N 3.09Å; I200-A203 PolarHBondContact O-N 2.93Å; A203-L205 VanDerWaalsContact C-N 3.31Å; A203-L205 PolarHBondContact O-N 3.04Å; A203-F210 HydrophobicContact CB-CD2 4.34Å; A203-F210 HydrophobicContact CB-CE2 3.72Å; A203-F210 HydrophobicContact CB-CZ 3.89Å; A203-L244 HydrophobicContact CB-CD1 4.38Å
204	G	94.8	Very high	95.4	Very high	68 Å²	68	52.3 Å²	52.3	70%	0.701	29%	0.288	S	S	*	.	H	α-helix	trans	-73.5	-16	174.3	0	0	0	0	0	115.1	I200 E201 A202	I200-G204 PolarHBondContact O-N 2.81Å; E201-G204 PolarHBondContact O-N 2.81Å; A202-G204 VanDerWaalsContact C-N 3.27Å; A202-G204 PolarHBondContact O-N 3.38Å
205	L	95.3	Very high	95.2	Very high	46 Å²	46	54 Å²	54	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-113.8	-11.1	180	-73.7	168.5	0	0	0	113.8	E201 A202 A203 V337 L357 I366	E201-L205 PolarHBondContact O-N 2.83Å; A202-L205 PolarHBondContact O-N 2.92Å; A202-L205 VanDerWaalsContact O-N 3.16Å; A203-L205 VanDerWaalsContact C-N 3.31Å; A203-L205 PolarHBondContact O-N 3.04Å; L205-V337 HydrophobicContact CB-CG2 4.28Å; L205-L357 HydrophobicContact CD1-CD1 3.75Å; L205-L357 HydrophobicContact CD1-CD2 3.89Å; L205-L357 HydrophobicContact CD2-CD2 4.17Å; L205-I366 HydrophobicContact CD1-CD1 3.9Å; L205-I366 HydrophobicContact CD1-CG1 3.79Å
206	F	96.9	Very high	95	Very high	12 Å²	12	59.6 Å²	59.6	5%	0.053	34%	0.344	C	S	.	.			trans	-90.8	114.4	-177.5	-177.1	-115.6	0	0	0	111.7	A202 R208 F210 A223 D307 I308 G335 V337	A202-F206 WeakPolarHBondContact O-CB 3.11Å; A202-F206 PolarHBondContact O-N 3.29Å; F206-R208 HydrophobicContact CD1-CB 4.23Å; F206-R208 WeakPolarHBondContact CD1-O 3.32Å; F206-R208 HydrophobicContact CE1-CB 3.58Å; F206-R208 WeakPolarHBondContact CE1-O 3.13Å; F206-R208 HydrophobicContact CZ-CB 3.84Å; F206-R208 VanDerWaalsContact CZ-CZ 3.49Å; F206-R208 PolarHBondContact O-N 3.2Å; F206-F210 HydrophobicContact CB-CE2 4.46Å; F206-F210 HydrophobicContact CD1-CD2 4.15Å; F206-F210 HydrophobicContact CD1-CE2 4.01Å; F206-A223 HydrophobicContact CE1-CB 3.76Å; F206-A223 HydrophobicContact CZ-CB 4.29Å; F206-D307 HydrophobicContact CE1-CB 4.49Å; F206-D307 HydrophobicContact CE2-CB 3.73Å; F206-D307 HydrophobicContact CZ-CB 3.55Å; F206-I308 HydrophobicContact CB-CD1 4.09Å; F206-I308 HydrophobicContact CD1-CD1 4.08Å; F206-I308 HydrophobicContact CD2-CD1 4.33Å; F206-I308 HydrophobicContact CD2-CG1 4.2Å; F206-I308 HydrophobicContact CG-CD1 3.91Å; F206-I308 HydrophobicContact CG-CG1 4.29Å; F206-G335 WeakPolarHBondContact CD2-O 3.48Å; F206-V337 HydrophobicContact CB-CG2 3.92Å; F206-V337 HydrophobicContact CD2-CG2 4.23Å
207	N	92.3	Very high	94.6	Very high	147 Å²	147	59.6 Å²	59.6	79%	0.786	37%	0.365	S	S	*	.	S	Bend	trans	-75.7	25.1	-170.1	-62.8	-37.7	0	0	0	115.4
208	R	93.3	Very high	94.2	Very high	103 Å²	103	59.9 Å²	59.9	39%	0.389	38%	0.376	S	S	.	.	S	Bend	trans	-146.2	157.9	179.4	-76.9	-177.9	-77.9	131.6	-3.4	110.6	F206 D307	F206-R208 HydrophobicContact CD1-CB 4.23Å; F206-R208 WeakPolarHBondContact CD1-O 3.32Å; F206-R208 HydrophobicContact CE1-CB 3.58Å; F206-R208 WeakPolarHBondContact CE1-O 3.13Å; F206-R208 HydrophobicContact CZ-CB 3.84Å; F206-R208 VanDerWaalsContact CZ-CZ 3.49Å; F206-R208 PolarHBondContact O-N 3.2Å; R208-D307 IonicContact CZ-OD1 3.19Å; R208-D307 IonicContact NH1-OD1 3.67Å; R208-D307 PolarHBondContact NH1-OD1 3.3Å; R208-D307 IonicContact NH2-OD1 3.15Å; R208-D307 PolarHBondContact NH2-OD1 3.15Å
209	F	94.6	Very high	94	Very high	117 Å²	117	69.5 Å²	69.5	51%	0.513	41%	0.412	S	S	.	.			trans	-64.9	143.2	177.1	-58.6	-45.4	0	0	0	112.4	A211 I220	F209-A211 WeakPolarHBondContact CB-O 3.33Å; F209-I220 HydrophobicContact CD2-CD1 4.09Å; F209-I220 HydrophobicContact CD2-CG2 4.34Å; F209-I220 HydrophobicContact CE2-CD1 4Å
210	F	96.3	Very high	93.8	Very high	17 Å²	17	72.5 Å²	72.5	8%	0.075	43%	0.427	C	S	.	.	S	Bend	trans	-70.6	-52.7	166.7	-88.6	-131.5	0	0	0	110.4	V199 A203 F206 P222 A223 V225 A241 L244 A246 I308	V199-F210 HydrophobicContact CG1-CE1 3.94Å; V199-F210 HydrophobicContact CG1-CZ 4.42Å; A203-F210 HydrophobicContact CB-CD2 4.34Å; A203-F210 HydrophobicContact CB-CE2 3.72Å; A203-F210 HydrophobicContact CB-CZ 3.89Å; F206-F210 HydrophobicContact CB-CE2 4.46Å; F206-F210 HydrophobicContact CD1-CD2 4.15Å; F206-F210 HydrophobicContact CD1-CE2 4.01Å; F210-P222 CarbonylContact O-C 3.6Å; F210-P222 VanDerWaalsContact O-CA 3.23Å; F210-P222 WeakPolarHBondContact O-CA 3.44Å; F210-P222 WeakPolarHBondContact O-CB 3.32Å; F210-A223 HydrophobicContact CD2-CB 4.43Å; F210-A223 HydrophobicContact CG-CB 4.43Å; F210-A223 PolarHBondContact O-N 3.23Å; F210-V225 HydrophobicContact CE1-CG2 4.15Å; F210-A241 HydrophobicContact CE1-CB 4.39Å; F210-L244 HydrophobicContact CB-CB 3.94Å; F210-L244 VanDerWaalsContact CB-O 3.25Å; F210-L244 WeakPolarHBondContact CB-O 3.46Å; F210-L244 HydrophobicContact CD1-CB 3.64Å; F210-L244 HydrophobicContact CD1-CD1 3.87Å; F210-L244 HydrophobicContact CD1-CG 4.44Å; F210-L244 HydrophobicContact CE1-CB 4.48Å; F210-L244 HydrophobicContact CE1-CD1 3.96Å; F210-L244 HydrophobicContact CG-CB 4.09Å; F210-L244 HydrophobicContact CG-CD1 4.47Å; F210-A246 HydrophobicContact CB-CB 4.28Å; F210-A246 HydrophobicContact CD1-CB 3.76Å; F210-A246 HydrophobicContact CG-CB 4.31Å; F210-I308 HydrophobicContact CD2-CD1 4.46Å; F210-I308 HydrophobicContact CE1-CD1 4.26Å; F210-I308 HydrophobicContact CE2-CD1 3.41Å; F210-I308 VanDerWaalsContact CE2-CD1 3.41Å; F210-I308 HydrophobicContact CZ-CD1 3.29Å
211	A	94.3	Very high	93.6	Very high	37 Å²	37	73.8 Å²	73.8	31%	0.306	44%	0.44	S	S	.	.	S	Bend	trans	-70.7	125.3	175.4	0	0	0	0	0	111.7	F209 L244	F209-A211 WeakPolarHBondContact CB-O 3.33Å; A211-L244 PolarHBondContact N-O 2.89Å; A211-L244 VanDerWaalsContact N-O 3.15Å
212	G	91.4	Very high	93.6	Very high	37 Å²	37	73.8 Å²	73.8	38%	0.381	44%	0.442	S	S	.	.			trans	-73.1	144.5	170.7	0	0	0	0	0	111.4	I220	G212-I220 CarbonylContact C-O 3.3Å; G212-I220 VanDerWaalsContact CA-O 3.28Å; G212-I220 WeakPolarHBondContact CA-O 3.08Å
213	Q	93.4	Very high	93.7	Very high	88 Å²	88	73.8 Å²	73.8	41%	0.411	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	146.7	-175.9	-62	-176.4	6.8	0	0	111	T215 R219 I220	Q213-T215 HydrophobicContact CB-CG2 4.15Å; Q213-R219 CarbonylContact O-C 3.55Å; Q213-R219 WeakPolarHBondContact O-CA 3.16Å; Q213-I220 PolarHBondContact N-O 2.89Å; Q213-I220 PolarHBondContact O-N 3.46Å
214	I	92.2	Very high	93.8	Very high	144 Å²	144	74.6 Å²	74.6	74%	0.738	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.9	166.9	-61.4	175.2	0	0	0	106.5	R219	I214-R219 HydrophobicContact CG1-CB 4.39Å; I214-R219 HydrophobicContact CG1-CG 4.06Å
215	T	92.6	Very high	93.9	Very high	56 Å²	56	71.4 Å²	71.4	34%	0.344	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	170.1	-175.8	71.4	0	0	0	0	109.9	Q213 A217 G218	Q213-T215 HydrophobicContact CB-CG2 4.15Å; T215-A217 PolarHBondContact O-N 3.46Å; T215-A217 PolarHBondContact OG1-N 2.82Å; T215-G218 PolarHBondContact N-O 3.15Å; T215-G218 PolarHBondContact O-N 2.95Å; T215-G218 PolarHBondContact OG1-N 2.95Å; T215-G218 PolarHBondContact OG1-O 2.95Å; T215-G218 VanDerWaalsContact OG1-O 3.06Å
216	A	90.7	Very high	94.1	Very high	118 Å²	118	69.2 Å²	69.2	98%	0.975	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.3	171	0	0	0	0	0	113.2	G218	A216-G218 VanDerWaalsContact C-N 3.27Å
217	A	90	Very high	94.1	Very high	103 Å²	103	68.7 Å²	68.7	85%	0.851	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	3.8	173.8	0	0	0	0	0	113.5	T215	T215-A217 PolarHBondContact O-N 3.46Å; T215-A217 PolarHBondContact OG1-N 2.82Å
218	G	90.1	Very high	94.3	Very high	34 Å²	34	61.7 Å²	61.7	35%	0.351	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	113.9	-172.6	177.8	0	0	0	0	0	114.5	T215 A216	T215-G218 PolarHBondContact N-O 3.15Å; T215-G218 PolarHBondContact O-N 2.95Å; T215-G218 PolarHBondContact OG1-N 2.95Å; T215-G218 PolarHBondContact OG1-O 2.95Å; T215-G218 VanDerWaalsContact OG1-O 3.06Å; A216-G218 VanDerWaalsContact C-N 3.27Å
219	R	92.6	Very high	94.3	Very high	202 Å²	202	57.3 Å²	57.3	76%	0.762	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	112.1	-178.5	179.4	177.2	-174.2	-169.5	3.2	110.7	Q213 I214	Q213-R219 CarbonylContact O-C 3.55Å; Q213-R219 WeakPolarHBondContact O-CA 3.16Å; I214-R219 HydrophobicContact CG1-CB 4.39Å; I214-R219 HydrophobicContact CG1-CG 4.06Å
220	I	92.5	Very high	93.9	Very high	63 Å²	63	52 Å²	52	32%	0.323	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.3	170.8	-55.8	175.1	0	0	0	107.7	F209 G212 Q213	F209-I220 HydrophobicContact CD2-CD1 4.09Å; F209-I220 HydrophobicContact CD2-CG2 4.34Å; F209-I220 HydrophobicContact CE2-CD1 4Å; G212-I220 CarbonylContact C-O 3.3Å; G212-I220 VanDerWaalsContact CA-O 3.28Å; G212-I220 WeakPolarHBondContact CA-O 3.08Å; Q213-I220 PolarHBondContact N-O 2.89Å; Q213-I220 PolarHBondContact O-N 3.46Å
221	P	94.2	Very high	93.6	Very high	84 Å²	84	52.5 Å²	52.5	55%	0.545	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-70.5	148.8	177.4	30.1	-34.6	0	0	0	111.1
222	P	96.2	Very high	93.4	Very high	34 Å²	34	53.8 Å²	53.8	22%	0.221	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-65	155.3	170.7	29.7	-34.8	0	0	0	110.9	F210 I247	F210-P222 CarbonylContact O-C 3.6Å; F210-P222 VanDerWaalsContact O-CA 3.23Å; F210-P222 WeakPolarHBondContact O-CA 3.44Å; F210-P222 WeakPolarHBondContact O-CB 3.32Å; P222-I247 HydrophobicContact CB-CG1 4.3Å; P222-I247 HydrophobicContact CG-CD1 3.59Å; P222-I247 HydrophobicContact CG-CG1 3.71Å
223	A	97.4	Very high	93.6	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-64.2	143.8	168.6	0	0	0	0	0	110.8	F206 F210 A246 I247	F206-A223 HydrophobicContact CE1-CB 3.76Å; F206-A223 HydrophobicContact CZ-CB 4.29Å; F210-A223 HydrophobicContact CD2-CB 4.43Å; F210-A223 HydrophobicContact CG-CB 4.43Å; F210-A223 PolarHBondContact O-N 3.23Å; A223-A246 HydrophobicContact CB-CB 4.38Å; A223-A246 WeakPolarHBondContact O-CB 3.43Å; A223-I247 PolarHBondContact O-N 2.89Å
224	K	98.1	Very high	93.7	Very high	56 Å²	56	48.5 Å²	48.5	24%	0.243	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.5	166.6	-72.3	178.1	176.2	179.7	0	109.9	I247 E305 V306 D307 I308	K224-I247 WeakPolarHBondContact CA-O 3.21Å; K224-E305 HydrophobicContact CD-CB 4.48Å; K224-E305 WeakPolarHBondContact CD-O 3.2Å; K224-E305 IonicContact NZ-OE2 2.71Å; K224-E305 PolarHBondContact NZ-OE2 3.37Å; K224-V306 HydrophobicContact CB-CB 4.11Å; K224-V306 HydrophobicContact CB-CG1 4.08Å; K224-D307 PolarHBondContact N-OD2 2.71Å; K224-D307 PolarHBondContact O-N 3.44Å; K224-I308 PolarHBondContact O-N 2.95Å; K224-I308 VanDerWaalsContact O-N 3.1Å
225	V	98.3	Very high	93.7	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.1	177.3	-175.1	0	0	0	0	109.3	F210 V227 A241 A246 I247 V248 R249 I308 I310	F210-V225 HydrophobicContact CE1-CG2 4.15Å; V225-V227 HydrophobicContact CG1-CG2 4.28Å; V225-A241 HydrophobicContact CB-CB 4.36Å; V225-A241 HydrophobicContact CG1-CB 4.21Å; V225-A241 HydrophobicContact CG2-CB 4.19Å; V225-A246 HydrophobicContact CG2-CB 3.82Å; V225-I247 PolarHBondContact N-O 2.89Å; V225-V248 WeakPolarHBondContact O-CA 3.13Å; V225-R249 PolarHBondContact O-N 3.4Å; V225-I308 WeakPolarHBondContact CA-O 3.45Å; V225-I308 HydrophobicContact CG1-CB 4.36Å; V225-I308 HydrophobicContact CG1-CG2 4.29Å; V225-I308 HydrophobicContact CG2-CB 4.21Å; V225-I308 HydrophobicContact CG2-CD1 4.44Å; V225-I310 HydrophobicContact CG1-CD1 4.11Å; V225-I310 HydrophobicContact CG1-CG1 4.33Å
226	L	98.3	Very high	93.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.1	168.9	-179.7	64.9	0	0	0	109.9	I228 R249 L269 Q302 V306 I308 I309 I310	L226-I228 HydrophobicContact CD2-CD1 3.9Å; L226-I228 HydrophobicContact CD2-CG1 4.03Å; L226-I228 HydrophobicContact CG-CD1 4.4Å; L226-I228 HydrophobicContact CG-CG1 3.98Å; L226-R249 CarbonylContact C-O 3.54Å; L226-R249 WeakPolarHBondContact CA-O 3.43Å; L226-R249 HydrophobicContact CD1-CB 3.99Å; L226-L269 HydrophobicContact CD1-CD1 3.67Å; L226-Q302 HydrophobicContact CD2-CB 3.89Å; L226-V306 HydrophobicContact CB-CB 4.42Å; L226-V306 HydrophobicContact CB-CG1 4.15Å; L226-V306 HydrophobicContact CB-CG2 4.03Å; L226-I308 PolarHBondContact N-O 3.41Å; L226-I309 HydrophobicContact CB-CG1 4.36Å; L226-I309 HydrophobicContact CD2-CG1 4.49Å; L226-I309 HydrophobicContact CD2-CG2 4.37Å; L226-I309 CarbonylContact O-C 3.5Å; L226-I309 WeakPolarHBondContact O-CA 3.48Å; L226-I310 PolarHBondContact O-N 3.48Å
227	V	98	Very high	94.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.8	172.3	-172.1	0	0	0	0	109.8	V225 A237 V238 V248 R249 A250 F251 I310	V225-V227 HydrophobicContact CG1-CG2 4.28Å; V227-A237 HydrophobicContact CG1-CB 4.41Å; V227-A237 HydrophobicContact CG2-CB 4.43Å; V227-V238 HydrophobicContact CB-CG2 3.89Å; V227-V238 HydrophobicContact CG1-CG2 4.16Å; V227-V238 HydrophobicContact CG2-CG2 3.76Å; V227-V248 HydrophobicContact CG2-CG1 4.18Å; V227-R249 PolarHBondContact N-O 3.18Å; V227-A250 HydrophobicContact CB-CB 4.21Å; V227-A250 CarbonylContact O-C 3.59Å; V227-A250 VanDerWaalsContact O-CA 3.23Å; V227-A250 WeakPolarHBondContact O-CA 3.48Å; V227-F251 PolarHBondContact O-N 3.42Å; V227-I310 CarbonylContact C-O 3.57Å; V227-I310 WeakPolarHBondContact CA-O 3.36Å; V227-I310 HydrophobicContact CG2-CB 4.44Å
228	I	96.3	Very high	94.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114.7	-178.5	-58.3	178.5	0	0	0	109	L226 F299 I309 I310 T311 S312 L323 I324	L226-I228 HydrophobicContact CD2-CD1 3.9Å; L226-I228 HydrophobicContact CD2-CG1 4.03Å; L226-I228 HydrophobicContact CG-CD1 4.4Å; L226-I228 HydrophobicContact CG-CG1 3.98Å; I228-F299 HydrophobicContact CB-CZ 4.49Å; I228-F299 HydrophobicContact CD1-CD1 3.73Å; I228-F299 HydrophobicContact CD1-CD2 4.09Å; I228-F299 HydrophobicContact CD1-CE1 3.71Å; I228-F299 HydrophobicContact CD1-CE2 4.05Å; I228-F299 HydrophobicContact CD1-CG 3.95Å; I228-F299 HydrophobicContact CD1-CZ 3.88Å; I228-F299 HydrophobicContact CG1-CD1 4.33Å; I228-F299 HydrophobicContact CG1-CE1 3.9Å; I228-F299 HydrophobicContact CG1-CZ 4.12Å; I228-F299 HydrophobicContact CG2-CE1 4.2Å; I228-F299 HydrophobicContact CG2-CE2 4.05Å; I228-F299 HydrophobicContact CG2-CZ 3.58Å; I228-I309 HydrophobicContact CD1-CG2 4.16Å; I228-I310 PolarHBondContact N-O 2.84Å; I228-T311 HydrophobicContact CB-CG2 4.29Å; I228-T311 HydrophobicContact CD1-CG2 4.23Å; I228-S312 PolarHBondContact O-N 2.83Å; I228-L323 HydrophobicContact CG2-CD1 3.68Å; I228-I324 HydrophobicContact CD1-CD1 3.74Å; I228-I324 HydrophobicContact CD1-CG1 4.27Å
229	G	92.1	Very high	94.7	Very high	10 Å²	10	30.4 Å²	30.4	10%	0.103	17%	0.169	C	C	.	.			trans	92.5	123.8	-166.3	0	0	0	0	0	111.1	G234 F251 S312	G229-G234 WeakPolarHBondContact O-CA 3.39Å; G229-F251 WeakPolarHBondContact CA-O 3.37Å; G229-F251 PolarHBondContact N-O 2.87Å; G229-S312 PolarHBondContact O-OG 3.48Å
230	G	87.8	Confident	95	Very high	5 Å²	5	21.5 Å²	21.5	5%	0.052	14%	0.137	C	C	.	.			trans	-109.3	48.3	173.1	0	0	0	0	0	111.4	D252 R254	G230-D252 WeakPolarHBondContact CA-OD2 3.27Å; G230-D252 PolarHBondContact N-OD2 3.06Å; G230-R254 PolarHBondContact O-NH2 2.94Å
231	G	89	Confident	95.2	Very high	29 Å²	29	18.5 Å²	18.5	30%	0.299	12%	0.122	S	C	.	.	S	Bend	trans	-73.4	-176.3	159.5	0	0	0	0	0	111.1	A233 G234 L235	G231-A233 PolarHBondContact O-N 3.48Å; G231-G234 WeakPolarHBondContact O-CA 3.3Å; G231-G234 PolarHBondContact O-N 2.89Å; G231-L235 PolarHBondContact O-N 3.49Å
232	V	91.5	Very high	95.2	Very high	64 Å²	64	18.6 Å²	18.6	39%	0.388	11%	0.113	S	C	.	.	H	α-helix	trans	-56.5	-37.8	-179.8	-175.8	0	0	0	0	112.3	S188 A191 N192 S236	S188-V232 WeakPolarHBondContact O-CG1 3.23Å; A191-V232 HydrophobicContact CB-CB 4.1Å; A191-V232 HydrophobicContact CB-CG1 4.42Å; N192-V232 HydrophobicContact CB-CG1 3.92Å; V232-S236 VanDerWaalsContact O-CB 3.29Å; V232-S236 WeakPolarHBondContact O-CB 3.35Å; V232-S236 PolarHBondContact O-N 3.12Å; V232-S236 VanDerWaalsContact O-N 3.08Å
233	A	94.5	Very high	95.1	Very high	13 Å²	13	21.6 Å²	21.6	11%	0.107	14%	0.135	C	C	.	.	H	α-helix	trans	-66	-45.1	173.5	0	0	0	0	0	112.7	A191 G195 G231 S236 A237 L341	A191-A233 HydrophobicContact CB-CB 4.12Å; A191-A233 WeakPolarHBondContact O-CA 3.42Å; A191-A233 VanDerWaalsContact O-CB 3.26Å; A191-A233 WeakPolarHBondContact O-CB 3.25Å; G195-A233 VanDerWaalsContact CA-O 3.24Å; G195-A233 WeakPolarHBondContact CA-O 3.18Å; G231-A233 PolarHBondContact O-N 3.48Å; A233-S236 PolarHBondContact O-N 3.18Å; A233-A237 WeakPolarHBondContact O-CB 3.49Å; A233-A237 PolarHBondContact O-N 2.86Å; A233-L341 HydrophobicContact CB-CD1 4.08Å
234	G	95	Very high	95.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.1	-48.1	177.5	0	0	0	0	0	112.9	G229 G231 S236 A237 V238	G229-G234 WeakPolarHBondContact O-CA 3.39Å; G231-G234 WeakPolarHBondContact O-CA 3.3Å; G231-G234 PolarHBondContact O-N 2.89Å; G234-S236 VanDerWaalsContact C-N 3.33Å; G234-S236 PolarHBondContact O-N 2.96Å; G234-A237 CarbonylContact O-C 3.56Å; G234-A237 WeakPolarHBondContact O-CB 3.43Å; G234-A237 PolarHBondContact O-N 3.46Å; G234-A237 VanDerWaalsContact O-N 3.16Å; G234-V238 WeakPolarHBondContact O-CG2 3.35Å; G234-V238 PolarHBondContact O-N 3.48Å
235	L	93.4	Very high	94.9	Very high	26 Å²	26	23.8 Å²	23.8	14%	0.136	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-36.8	177.9	-68.1	167.8	0	0	0	112.3	G231 V238 S239 V257 Q260 V261 F264	G231-L235 PolarHBondContact O-N 3.49Å; L235-V238 PolarHBondContact O-N 3.4Å; L235-S239 WeakPolarHBondContact O-CB 3.4Å; L235-S239 PolarHBondContact O-N 3.24Å; L235-V257 HydrophobicContact CD2-CG1 4.24Å; L235-Q260 HydrophobicContact CD1-CB 4.4Å; L235-Q260 VanDerWaalsContact CD1-OE1 3.24Å; L235-Q260 HydrophobicContact CD2-CB 3.96Å; L235-V261 HydrophobicContact CD2-CG2 3.88Å; L235-F264 HydrophobicContact CB-CE2 4.49Å; L235-F264 HydrophobicContact CD2-CE2 4.45Å
236	S	96.1	Very high	94.9	Very high	12 Å²	12	23.9 Å²	23.9	8%	0.084	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-41.5	171.9	-176.8	0	0	0	0	112.1	N192 Y196 V232 A233 G234 S239 T240	N192-S236 WeakPolarHBondContact O-CB 3.41Å; N192-S236 PolarHBondContact O-OG 2.88Å; N192-S236 WeakPolarHBondContact OD1-CB 3.35Å; N192-S236 PolarHBondContact OD1-OG 3.39Å; Y196-S236 PolarHBondContact N-OG 3.43Å; V232-S236 VanDerWaalsContact O-CB 3.29Å; V232-S236 WeakPolarHBondContact O-CB 3.35Å; V232-S236 PolarHBondContact O-N 3.12Å; V232-S236 VanDerWaalsContact O-N 3.08Å; A233-S236 PolarHBondContact O-N 3.18Å; G234-S236 VanDerWaalsContact C-N 3.33Å; G234-S236 PolarHBondContact O-N 2.96Å; S236-S239 PolarHBondContact O-N 3.24Å; S236-T240 VanDerWaalsContact O-CB 3.28Å; S236-T240 WeakPolarHBondContact O-CB 3.23Å; S236-T240 PolarHBondContact O-N 3.16Å; S236-T240 PolarHBondContact O-OG1 3.43Å
237	A	97.5	Very high	94.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-41.5	173.6	0	0	0	0	0	112.2	V199 V227 A233 G234 T240 A241 I310	V199-A237 HydrophobicContact CG2-CB 3.83Å; V199-A237 WeakPolarHBondContact CG2-O 3.28Å; V227-A237 HydrophobicContact CG1-CB 4.41Å; V227-A237 HydrophobicContact CG2-CB 4.43Å; A233-A237 WeakPolarHBondContact O-CB 3.49Å; A233-A237 PolarHBondContact O-N 2.86Å; G234-A237 CarbonylContact O-C 3.56Å; G234-A237 WeakPolarHBondContact O-CB 3.43Å; G234-A237 PolarHBondContact O-N 3.46Å; G234-A237 VanDerWaalsContact O-N 3.16Å; A237-T240 PolarHBondContact O-N 3.42Å; A237-A241 WeakPolarHBondContact O-CB 3.42Å; A237-A241 PolarHBondContact O-N 2.9Å; A237-I310 HydrophobicContact CB-CD1 4.11Å; A237-I310 HydrophobicContact CB-CG2 4.07Å
238	V	96.9	Very high	94.8	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-53.7	174.5	166.3	0	0	0	0	110.8	V227 G234 L235 T240 A241 K242 V248 A250 F264 A266	V227-V238 HydrophobicContact CB-CG2 3.89Å; V227-V238 HydrophobicContact CG1-CG2 4.16Å; V227-V238 HydrophobicContact CG2-CG2 3.76Å; G234-V238 WeakPolarHBondContact O-CG2 3.35Å; G234-V238 PolarHBondContact O-N 3.48Å; L235-V238 PolarHBondContact O-N 3.4Å; V238-T240 PolarHBondContact O-N 2.81Å; V238-A241 PolarHBondContact O-N 3.47Å; V238-K242 VanDerWaalsContact O-CB 3.26Å; V238-K242 WeakPolarHBondContact O-CB 3.42Å; V238-K242 PolarHBondContact O-N 2.94Å; V238-V248 HydrophobicContact CB-CG1 4.25Å; V238-V248 HydrophobicContact CG1-CG1 4.09Å; V238-V248 HydrophobicContact CG2-CG1 3.96Å; V238-A250 HydrophobicContact CG2-CB 3.81Å; V238-F264 HydrophobicContact CG1-CB 3.97Å; V238-F264 HydrophobicContact CG1-CD2 4.38Å; V238-F264 HydrophobicContact CG1-CG 4.49Å; V238-A266 HydrophobicContact CG1-CB 3.62Å
239	S	93.8	Very high	94.9	Very high	36 Å²	36	29.2 Å²	29.2	25%	0.252	18%	0.184	S	C	.	.	H	α-helix	trans	-61.3	-43.3	-179.6	-177.6	0	0	0	0	112.2	L235 S236 S243	L235-S239 WeakPolarHBondContact O-CB 3.4Å; L235-S239 PolarHBondContact O-N 3.24Å; S236-S239 PolarHBondContact O-N 3.24Å; S239-S243 WeakPolarHBondContact O-CB 3.4Å; S239-S243 PolarHBondContact O-N 2.82Å; S239-S243 PolarHBondContact O-OG 3.24Å
240	T	97.3	Very high	95.1	Very high	16 Å²	16	28.8 Å²	28.8	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-47.3	179.6	-52.6	0	0	0	0	111.7	Y196 V199 I200 S236 A237 V238 K242 S243 L244	Y196-T240 HydrophobicContact CD2-CG2 3.54Å; Y196-T240 WeakPolarHBondContact CD2-OG1 3.25Å; Y196-T240 HydrophobicContact CE2-CG2 3.9Å; Y196-T240 HydrophobicContact CG-CG2 4.38Å; V199-T240 HydrophobicContact CB-CG2 3.84Å; V199-T240 HydrophobicContact CG1-CG2 3.76Å; V199-T240 HydrophobicContact CG2-CG2 4.4Å; I200-T240 HydrophobicContact CD1-CG2 4.48Å; S236-T240 VanDerWaalsContact O-CB 3.28Å; S236-T240 WeakPolarHBondContact O-CB 3.23Å; S236-T240 PolarHBondContact O-N 3.16Å; S236-T240 PolarHBondContact O-OG1 3.43Å; A237-T240 PolarHBondContact O-N 3.42Å; V238-T240 PolarHBondContact O-N 2.81Å; T240-K242 VanDerWaalsContact C-N 3.34Å; T240-K242 PolarHBondContact O-N 3.08Å; T240-S243 PolarHBondContact O-N 3.08Å; T240-L244 WeakPolarHBondContact O-CG 3.4Å; T240-L244 PolarHBondContact O-N 3.45Å; T240-L244 VanDerWaalsContact O-N 3.08Å
241	A	97.2	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65	-37.4	179.2	0	0	0	0	0	112.1	V199 F210 V225 A237 V238 L244 A246 V248	V199-A241 HydrophobicContact CG1-CB 4.15Å; V199-A241 HydrophobicContact CG2-CB 4.23Å; F210-A241 HydrophobicContact CE1-CB 4.39Å; V225-A241 HydrophobicContact CB-CB 4.36Å; V225-A241 HydrophobicContact CG1-CB 4.21Å; V225-A241 HydrophobicContact CG2-CB 4.19Å; A237-A241 WeakPolarHBondContact O-CB 3.42Å; A237-A241 PolarHBondContact O-N 2.9Å; V238-A241 PolarHBondContact O-N 3.47Å; A241-L244 PolarHBondContact O-N 3.42Å; A241-A246 WeakPolarHBondContact O-CB 3.45Å; A241-A246 PolarHBondContact O-N 3.24Å; A241-V248 HydrophobicContact CB-CG2 3.68Å
242	K	95.3	Very high	95.6	Very high	85 Å²	85	28.1 Å²	28.1	37%	0.37	17%	0.168	S	C	.	.	H	α-helix	trans	-64.1	-43.5	173.4	-172.8	79.6	-177.1	-178	0	111.6	V238 T240 L244 G245 V248 F264 G265	V238-K242 VanDerWaalsContact O-CB 3.26Å; V238-K242 WeakPolarHBondContact O-CB 3.42Å; V238-K242 PolarHBondContact O-N 2.94Å; T240-K242 VanDerWaalsContact C-N 3.34Å; T240-K242 PolarHBondContact O-N 3.08Å; K242-L244 PolarHBondContact O-N 3.22Å; K242-G245 WeakPolarHBondContact O-CA 3.48Å; K242-G245 PolarHBondContact O-N 2.95Å; K242-V248 HydrophobicContact CB-CG2 4.1Å; K242-F264 WeakPolarHBondContact CG-O 3.32Å; K242-G265 WeakPolarHBondContact CE-O 3.13Å; K242-G265 PolarHBondContact NZ-O 3.5Å
243	S	94.2	Very high	95.4	Very high	97 Å²	97	26 Å²	26	68%	0.678	16%	0.155	S	C	*	.	H	α-helix	trans	-64.1	-27.4	178.6	-59.8	0	0	0	0	112.9	S239 T240 G245	S239-S243 WeakPolarHBondContact O-CB 3.4Å; S239-S243 PolarHBondContact O-N 2.82Å; S239-S243 PolarHBondContact O-OG 3.24Å; T240-S243 PolarHBondContact O-N 3.08Å; S243-G245 PolarHBondContact O-N 3.45Å
244	L	96.4	Very high	94.8	Very high	67 Å²	67	27.7 Å²	27.7	35%	0.351	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	2.9	170.4	-66.9	175.4	0	0	0	113.9	V199 I200 A203 F210 A211 T240 A241 K242	V199-L244 HydrophobicContact CG1-CD1 3.67Å; I200-L244 HydrophobicContact CD1-CD1 4.43Å; A203-L244 HydrophobicContact CB-CD1 4.38Å; F210-L244 HydrophobicContact CB-CB 3.94Å; F210-L244 VanDerWaalsContact CB-O 3.25Å; F210-L244 WeakPolarHBondContact CB-O 3.46Å; F210-L244 HydrophobicContact CD1-CB 3.64Å; F210-L244 HydrophobicContact CD1-CD1 3.87Å; F210-L244 HydrophobicContact CD1-CG 4.44Å; F210-L244 HydrophobicContact CE1-CB 4.48Å; F210-L244 HydrophobicContact CE1-CD1 3.96Å; F210-L244 HydrophobicContact CG-CB 4.09Å; F210-L244 HydrophobicContact CG-CD1 4.47Å; A211-L244 PolarHBondContact N-O 2.89Å; A211-L244 VanDerWaalsContact N-O 3.15Å; T240-L244 WeakPolarHBondContact O-CG 3.4Å; T240-L244 PolarHBondContact O-N 3.45Å; T240-L244 VanDerWaalsContact O-N 3.08Å; A241-L244 PolarHBondContact O-N 3.42Å; K242-L244 PolarHBondContact O-N 3.22Å
245	G	94.6	Very high	94.2	Very high	36 Å²	36	32.9 Å²	32.9	37%	0.371	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	10.4	174.9	0	0	0	0	0	115.9	K242 S243	K242-G245 WeakPolarHBondContact O-CA 3.48Å; K242-G245 PolarHBondContact O-N 2.95Å; S243-G245 PolarHBondContact O-N 3.45Å
246	A	97.1	Very high	93.4	Very high	4 Å²	4	34.6 Å²	34.6	3%	0.033	20%	0.201	C	C	.	.			trans	-76.3	158.4	177.5	0	0	0	0	0	113	F210 A223 V225 A241 V248	F210-A246 HydrophobicContact CB-CB 4.28Å; F210-A246 HydrophobicContact CD1-CB 3.76Å; F210-A246 HydrophobicContact CG-CB 4.31Å; A223-A246 HydrophobicContact CB-CB 4.38Å; A223-A246 WeakPolarHBondContact O-CB 3.43Å; V225-A246 HydrophobicContact CG2-CB 3.82Å; A241-A246 WeakPolarHBondContact O-CB 3.45Å; A241-A246 PolarHBondContact O-N 3.24Å; A246-V248 PolarHBondContact O-N 3.05Å
247	I	97.1	Very high	92.8	Very high	75 Å²	75	34.2 Å²	34.2	39%	0.385	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	111.9	164	-63.5	176.5	0	0	0	107.3	P222 A223 K224 V225	P222-I247 HydrophobicContact CB-CG1 4.3Å; P222-I247 HydrophobicContact CG-CD1 3.59Å; P222-I247 HydrophobicContact CG-CG1 3.71Å; A223-I247 PolarHBondContact O-N 2.89Å; K224-I247 WeakPolarHBondContact CA-O 3.21Å; V225-I247 PolarHBondContact N-O 2.89Å
248	V	97.9	Very high	92.4	Very high	3 Å²	3	37 Å²	37	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128	-179.7	-174.2	0	0	0	0	110.4	V225 V227 V238 A241 K242 A246 A266 E267	V225-V248 WeakPolarHBondContact O-CA 3.13Å; V227-V248 HydrophobicContact CG2-CG1 4.18Å; V238-V248 HydrophobicContact CB-CG1 4.25Å; V238-V248 HydrophobicContact CG1-CG1 4.09Å; V238-V248 HydrophobicContact CG2-CG1 3.96Å; A241-V248 HydrophobicContact CB-CG2 3.68Å; K242-V248 HydrophobicContact CB-CG2 4.1Å; A246-V248 PolarHBondContact O-N 3.05Å; V248-A266 HydrophobicContact CB-CB 3.89Å; V248-A266 HydrophobicContact CG1-CB 3.96Å; V248-A266 WeakPolarHBondContact O-CA 3.41Å; V248-A266 WeakPolarHBondContact O-CB 3.23Å; V248-E267 PolarHBondContact O-N 3.3Å
249	R	97.8	Very high	91.6	Very high	34 Å²	34	44.8 Å²	44.8	13%	0.128	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.8	166.1	-71.3	176.7	170.6	160	1.8	108.5	V225 L226 V227 E267 L269 E305	V225-R249 PolarHBondContact O-N 3.4Å; L226-R249 CarbonylContact C-O 3.54Å; L226-R249 WeakPolarHBondContact CA-O 3.43Å; L226-R249 HydrophobicContact CD1-CB 3.99Å; V227-R249 PolarHBondContact N-O 3.18Å; R249-E267 CarbonylContact C-O 3.46Å; R249-E267 WeakPolarHBondContact CA-O 3.26Å; R249-E267 HydrophobicContact CG-CB 4.04Å; R249-E267 HydrophobicContact CG-CG 4.26Å; R249-E267 VanDerWaalsContact CG-OE2 3.31Å; R249-E267 WeakPolarHBondContact CG-OE2 3.4Å; R249-E267 IonicContact CZ-OE2 3.66Å; R249-E267 IonicContact NE-OE1 3.61Å; R249-E267 IonicContact NE-OE2 2.71Å; R249-E267 PolarHBondContact NE-OE2 3.35Å; R249-E267 IonicContact NH2-OE1 2.92Å; R249-E267 IonicContact NH2-OE2 2.94Å; R249-L269 HydrophobicContact CB-CD1 4.06Å; R249-L269 HydrophobicContact CB-CG 4.26Å; R249-L269 HydrophobicContact CG-CD2 4.44Å; R249-E305 IonicContact CZ-OE2 2.67Å; R249-E305 IonicContact NH1-OE2 2.96Å; R249-E305 PolarHBondContact NH1-OE2 2.96Å; R249-E305 IonicContact NH2-OE2 3.77Å
250	A	96.5	Very high	91	Very high	2 Å²	2	47.7 Å²	47.7	2%	0.017	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153	174.8	0	0	0	0	0	112.5	V227 V238 V261 E267 F268 L269	V227-A250 HydrophobicContact CB-CB 4.21Å; V227-A250 CarbonylContact O-C 3.59Å; V227-A250 VanDerWaalsContact O-CA 3.23Å; V227-A250 WeakPolarHBondContact O-CA 3.48Å; V238-A250 HydrophobicContact CG2-CB 3.81Å; A250-V261 HydrophobicContact CB-CG1 3.81Å; A250-V261 HydrophobicContact CB-CG2 3.99Å; A250-E267 PolarHBondContact N-O 2.84Å; A250-F268 WeakPolarHBondContact O-CA 3.31Å; A250-L269 PolarHBondContact O-N 2.84Å
251	F	95.2	Very high	90.6	Very high	4 Å²	4	47 Å²	47	2%	0.018	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.8	177.4	178.8	-91.6	0	0	0	110.5	V227 G229 T253 L269 V271 Y291 E295 L298 F299	V227-F251 PolarHBondContact O-N 3.42Å; G229-F251 WeakPolarHBondContact CA-O 3.37Å; G229-F251 PolarHBondContact N-O 2.87Å; F251-T253 HydrophobicContact CE1-CG2 4.06Å; F251-T253 HydrophobicContact CZ-CG2 4.41Å; F251-L269 HydrophobicContact CB-CB 4.43Å; F251-L269 HydrophobicContact CD2-CB 4.28Å; F251-L269 WeakPolarHBondContact CD2-O 3.38Å; F251-V271 HydrophobicContact CE2-CG1 4.21Å; F251-Y291 HydrophobicContact CZ-CE1 4.18Å; F251-E295 HydrophobicContact CE1-CG 3.88Å; F251-E295 WeakPolarHBondContact CE1-OE1 3.48Å; F251-E295 HydrophobicContact CZ-CG 4.03Å; F251-L298 HydrophobicContact CD2-CD2 3.71Å; F251-L298 HydrophobicContact CE2-CD2 3.84Å; F251-F299 HydrophobicContact CB-CE1 4.14Å; F251-F299 AromaticContact CD1-CE1 3.84Å; F251-F299 HydrophobicContact CD1-CE1 3.84Å; F251-F299 AromaticContact CD1-CZ 3.58Å; F251-F299 HydrophobicContact CD1-CZ 3.58Å; F251-F299 HydrophobicContact CE1-CE1 4.41Å; F251-F299 AromaticContact CE1-CZ 3.9Å; F251-F299 HydrophobicContact CE1-CZ 3.9Å; F251-F299 AromaticContact CG-CE1 3.95Å; F251-F299 HydrophobicContact CG-CE1 3.95Å; F251-F299 HydrophobicContact CG-CZ 4.18Å
252	D	91.5	Very high	90.1	Very high	15 Å²	15	51.9 Å²	51.9	8%	0.08	27%	0.273	C	S	.	.			trans	-147.8	148.2	168.5	-164.6	-70.9	0	0	0	108.3	G230 R254 V257 F268	G230-D252 WeakPolarHBondContact CA-OD2 3.27Å; G230-D252 PolarHBondContact N-OD2 3.06Å; D252-R254 PolarHBondContact O-N 3.2Å; D252-R254 VanDerWaalsContact OD1-CB 3.27Å; D252-R254 WeakPolarHBondContact OD1-CB 3.44Å; D252-R254 WeakPolarHBondContact OD1-CG 3.46Å; D252-R254 IonicContact OD1-CZ 3.57Å; D252-R254 PolarHBondContact OD1-N 2.88Å; D252-R254 IonicContact OD1-NE 2.68Å; D252-R254 PolarHBondContact OD1-NE 3.44Å; D252-R254 IonicContact OD1-NH2 3.26Å; D252-R254 PolarHBondContact OD1-NH2 3.12Å; D252-R254 IonicContact OD2-CZ 2.73Å; D252-R254 IonicContact OD2-NE 3.11Å; D252-R254 IonicContact OD2-NH2 3.55Å; D252-R254 PolarHBondContact OD2-NH2 3.02Å; D252-V257 HydrophobicContact CB-CB 4.17Å; D252-V257 HydrophobicContact CB-CG1 4.25Å; D252-V257 HydrophobicContact CB-CG2 4.32Å; D252-F268 HydrophobicContact CB-CE2 4.29Å; D252-F268 HydrophobicContact CB-CZ 4.38Å; D252-F268 WeakPolarHBondContact O-CZ 3.4Å
253	T	87.6	Confident	89.5	Confident	21 Å²	21	52.2 Å²	52.2	13%	0.129	29%	0.286	C	S	.	.	S	Bend	trans	-75.7	-10.8	179	62.7	0	0	0	0	113	F251 G277 A284 M287 Y291	F251-T253 HydrophobicContact CE1-CG2 4.06Å; F251-T253 HydrophobicContact CZ-CG2 4.41Å; T253-G277 WeakPolarHBondContact O-CA 3.32Å; T253-G277 PolarHBondContact O-N 3.18Å; T253-A284 WeakPolarHBondContact OG1-CB 3.42Å; T253-M287 HydrophobicContact CG2-CG 4.15Å; T253-Y291 HydrophobicContact CG2-CE1 3.84Å
254	R	82.3	Confident	88.9	Confident	48 Å²	48	51.6 Å²	51.6	18%	0.181	27%	0.271	C	S	.	.			trans	-96	111	177.8	-57.3	167.6	-65.5	145.8	10.7	110.5	G230 D252 A256 V257 E278 G282 A284	G230-R254 PolarHBondContact O-NH2 2.94Å; D252-R254 PolarHBondContact O-N 3.2Å; D252-R254 VanDerWaalsContact OD1-CB 3.27Å; D252-R254 WeakPolarHBondContact OD1-CB 3.44Å; D252-R254 WeakPolarHBondContact OD1-CG 3.46Å; D252-R254 IonicContact OD1-CZ 3.57Å; D252-R254 PolarHBondContact OD1-N 2.88Å; D252-R254 IonicContact OD1-NE 2.68Å; D252-R254 PolarHBondContact OD1-NE 3.44Å; D252-R254 IonicContact OD1-NH2 3.26Å; D252-R254 PolarHBondContact OD1-NH2 3.12Å; D252-R254 IonicContact OD2-CZ 2.73Å; D252-R254 IonicContact OD2-NE 3.11Å; D252-R254 IonicContact OD2-NH2 3.55Å; D252-R254 PolarHBondContact OD2-NH2 3.02Å; R254-A256 PolarHBondContact O-N 3.2Å; R254-A256 VanDerWaalsContact O-N 3.14Å; R254-V257 HydrophobicContact CB-CG2 3.99Å; R254-V257 WeakPolarHBondContact O-CB 3.36Å; R254-V257 WeakPolarHBondContact O-CG2 3.4Å; R254-V257 PolarHBondContact O-N 2.94Å; R254-E278 HydrophobicContact CB-CG 4.46Å; R254-G282 WeakPolarHBondContact CD-O 3.43Å; R254-G282 PolarHBondContact NH1-O 3.29Å; R254-A284 HydrophobicContact CG-CB 4.31Å
255	E	81.6	Confident	88.2	Confident	109 Å²	109	50.4 Å²	50.4	51%	0.509	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-54	-34.7	-180	-172.3	73.5	165.8	0	0	113.3	V257 R258	E255-V257 PolarHBondContact O-N 3.27Å; E255-R258 VanDerWaalsContact CD-NH1 3.35Å; E255-R258 VanDerWaalsContact CD-NH2 3.31Å; E255-R258 PolarHBondContact O-N 3.42Å; E255-R258 IonicContact OE1-CZ 3.58Å; E255-R258 IonicContact OE1-NH1 3.47Å; E255-R258 PolarHBondContact OE1-NH1 2.76Å; E255-R258 IonicContact OE1-NH2 3.43Å; E255-R258 PolarHBondContact OE1-NH2 3.41Å; E255-R258 IonicContact OE2-CZ 2.64Å; E255-R258 IonicContact OE2-NH1 2.75Å; E255-R258 IonicContact OE2-NH2 3.27Å; E255-R258 PolarHBondContact OE2-NH2 2.73Å
256	A	77.8	Confident	88.1	Confident	61 Å²	61	49 Å²	49	50%	0.504	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-58.3	-13.8	177.4	0	0	0	0	0	115	R254	R254-A256 PolarHBondContact O-N 3.2Å; R254-A256 VanDerWaalsContact O-N 3.14Å
257	V	83.9	Confident	87.9	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.024	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-87.1	-16.4	179.5	-173.3	0	0	0	0	112.3	L235 D252 R254 E255 E259 Q260 V261 F268	L235-V257 HydrophobicContact CD2-CG1 4.24Å; D252-V257 HydrophobicContact CB-CB 4.17Å; D252-V257 HydrophobicContact CB-CG1 4.25Å; D252-V257 HydrophobicContact CB-CG2 4.32Å; R254-V257 HydrophobicContact CB-CG2 3.99Å; R254-V257 WeakPolarHBondContact O-CB 3.36Å; R254-V257 WeakPolarHBondContact O-CG2 3.4Å; R254-V257 PolarHBondContact O-N 2.94Å; E255-V257 PolarHBondContact O-N 3.27Å; V257-E259 PolarHBondContact O-N 2.99Å; V257-Q260 PolarHBondContact O-N 2.96Å; V257-V261 HydrophobicContact CG1-CG2 4.09Å; V257-V261 PolarHBondContact O-N 2.6Å; V257-F268 HydrophobicContact CB-CE2 4.28Å; V257-F268 HydrophobicContact CG1-CE2 4.47Å
258	R	87.3	Confident	87.8	Confident	60 Å²	60	50.2 Å²	50.2	23%	0.226	26%	0.263	C	S	.	.	H	α-helix	trans	-55.4	-52.5	178.8	176.6	174.5	-58.6	118.8	27.2	111.9	E255 Q260 V261 E262 F268	E255-R258 VanDerWaalsContact CD-NH1 3.35Å; E255-R258 VanDerWaalsContact CD-NH2 3.31Å; E255-R258 PolarHBondContact O-N 3.42Å; E255-R258 IonicContact OE1-CZ 3.58Å; E255-R258 IonicContact OE1-NH1 3.47Å; E255-R258 PolarHBondContact OE1-NH1 2.76Å; E255-R258 IonicContact OE1-NH2 3.43Å; E255-R258 PolarHBondContact OE1-NH2 3.41Å; E255-R258 IonicContact OE2-CZ 2.64Å; E255-R258 IonicContact OE2-NH1 2.75Å; E255-R258 IonicContact OE2-NH2 3.27Å; E255-R258 PolarHBondContact OE2-NH2 2.73Å; R258-Q260 PolarHBondContact O-N 2.83Å; R258-V261 PolarHBondContact O-N 3.21Å; R258-V261 VanDerWaalsContact O-N 3.12Å; R258-E262 VanDerWaalsContact CD-OE1 3.27Å; R258-E262 WeakPolarHBondContact CD-OE1 3.1Å; R258-E262 HydrophobicContact CG-CG 3.95Å; R258-E262 WeakPolarHBondContact CG-OE1 3.24Å; R258-E262 WeakPolarHBondContact CG-OE2 3.39Å; R258-E262 WeakPolarHBondContact O-CB 3.29Å; R258-E262 WeakPolarHBondContact O-CG 3.48Å; R258-E262 PolarHBondContact O-N 3.48Å; R258-F268 HydrophobicContact CB-CB 4.39Å; R258-F268 HydrophobicContact CB-CD1 4Å; R258-F268 HydrophobicContact CB-CD2 4.04Å; R258-F268 HydrophobicContact CB-CE1 4.25Å; R258-F268 HydrophobicContact CB-CE2 4.28Å; R258-F268 HydrophobicContact CB-CG 3.87Å; R258-F268 HydrophobicContact CB-CZ 4.37Å; R258-F268 HydrophobicContact CG-CB 3.89Å; R258-F268 HydrophobicContact CG-CD1 4.14Å; R258-F268 HydrophobicContact CG-CD2 4.46Å; R258-F268 HydrophobicContact CG-CG 3.9Å
259	E	81.2	Confident	87.6	Confident	163 Å²	163	50.6 Å²	50.6	76%	0.762	27%	0.265	S	S	*	.	H	α-helix	trans	-57.3	-36.3	-178.4	-173.8	172.6	-168.4	0	0	111.6	V257 S263	V257-E259 PolarHBondContact O-N 2.99Å; E259-S263 VanDerWaalsContact O-CB 3.27Å; E259-S263 WeakPolarHBondContact O-CB 3.21Å; E259-S263 PolarHBondContact O-N 2.89Å
260	Q	82	Confident	87	Confident	97 Å²	97	52.7 Å²	52.7	45%	0.453	28%	0.282	S	S	.	.	H	α-helix	trans	-70.4	-45.3	177.4	-60.6	-177.9	-11.2	0	0	111.8	L235 V257 R258 S263 F264	L235-Q260 HydrophobicContact CD1-CB 4.4Å; L235-Q260 VanDerWaalsContact CD1-OE1 3.24Å; L235-Q260 HydrophobicContact CD2-CB 3.96Å; V257-Q260 PolarHBondContact O-N 2.96Å; R258-Q260 PolarHBondContact O-N 2.83Å; Q260-S263 PolarHBondContact O-N 3.43Å; Q260-S263 PolarHBondContact O-OG 2.92Å; Q260-F264 WeakPolarHBondContact O-CD2 3.35Å; Q260-F264 PolarHBondContact O-N 3.31Å
261	V	87.6	Confident	86.5	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-44.9	176.1	167	0	0	0	0	111.8	L235 A250 V257 R258 S263 F264 G265 A266 F268	L235-V261 HydrophobicContact CD2-CG2 3.88Å; A250-V261 HydrophobicContact CB-CG1 3.81Å; A250-V261 HydrophobicContact CB-CG2 3.99Å; V257-V261 HydrophobicContact CG1-CG2 4.09Å; V257-V261 PolarHBondContact O-N 2.6Å; R258-V261 PolarHBondContact O-N 3.21Å; R258-V261 VanDerWaalsContact O-N 3.12Å; V261-S263 VanDerWaalsContact C-N 3.32Å; V261-S263 PolarHBondContact O-N 2.72Å; V261-F264 PolarHBondContact O-N 2.99Å; V261-G265 PolarHBondContact O-N 3.27Å; V261-A266 HydrophobicContact CG1-CB 3.73Å; V261-A266 PolarHBondContact O-N 3.44Å; V261-F268 HydrophobicContact CB-CD2 3.9Å; V261-F268 HydrophobicContact CG1-CB 4.07Å; V261-F268 HydrophobicContact CG1-CD2 4.06Å; V261-F268 HydrophobicContact CG2-CD2 3.95Å; V261-F268 HydrophobicContact CG2-CE2 4.43Å
262	E	88.2	Confident	85.5	Confident	104 Å²	104	61.6 Å²	61.6	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-29.1	179.6	-70.1	179.2	168.2	0	0	111.8	R258 F264 G265 F268	R258-E262 VanDerWaalsContact CD-OE1 3.27Å; R258-E262 WeakPolarHBondContact CD-OE1 3.1Å; R258-E262 HydrophobicContact CG-CG 3.95Å; R258-E262 WeakPolarHBondContact CG-OE1 3.24Å; R258-E262 WeakPolarHBondContact CG-OE2 3.39Å; R258-E262 WeakPolarHBondContact O-CB 3.29Å; R258-E262 WeakPolarHBondContact O-CG 3.48Å; R258-E262 PolarHBondContact O-N 3.48Å; E262-F264 VanDerWaalsContact C-N 3.26Å; E262-F264 PolarHBondContact O-N 2.87Å; E262-G265 WeakPolarHBondContact O-CA 3.22Å; E262-G265 PolarHBondContact O-N 3.31Å; E262-F268 HydrophobicContact CG-CB 4.37Å
263	S	81	Confident	84.8	Confident	92 Å²	92	63 Å²	63	64%	0.643	34%	0.337	S	S	*	.	H	α-helix	trans	-64.1	-28.9	172	79.5	0	0	0	0	113.4	E259 Q260 V261 G265	E259-S263 VanDerWaalsContact O-CB 3.27Å; E259-S263 WeakPolarHBondContact O-CB 3.21Å; E259-S263 PolarHBondContact O-N 2.89Å; Q260-S263 PolarHBondContact O-N 3.43Å; Q260-S263 PolarHBondContact O-OG 2.92Å; V261-S263 VanDerWaalsContact C-N 3.32Å; V261-S263 PolarHBondContact O-N 2.72Å; S263-G265 PolarHBondContact O-N 3.22Å
264	F	82.6	Confident	83.8	Confident	83 Å²	83	72 Å²	72	36%	0.364	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	4.4	168.7	-64.8	-63.7	0	0	0	112.8	L235 V238 K242 Q260 V261 E262 A266	L235-F264 HydrophobicContact CB-CE2 4.49Å; L235-F264 HydrophobicContact CD2-CE2 4.45Å; V238-F264 HydrophobicContact CG1-CB 3.97Å; V238-F264 HydrophobicContact CG1-CD2 4.38Å; V238-F264 HydrophobicContact CG1-CG 4.49Å; K242-F264 WeakPolarHBondContact CG-O 3.32Å; Q260-F264 WeakPolarHBondContact O-CD2 3.35Å; Q260-F264 PolarHBondContact O-N 3.31Å; V261-F264 PolarHBondContact O-N 2.99Å; E262-F264 VanDerWaalsContact C-N 3.26Å; E262-F264 PolarHBondContact O-N 2.87Å; F264-A266 VanDerWaalsContact C-N 3.32Å; F264-A266 PolarHBondContact O-N 3.14Å
265	G	81.4	Confident	83.5	Confident	42 Å²	42	72.3 Å²	72.3	43%	0.433	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	28.2	-179.4	0	0	0	0	0	114	K242 V261 E262 S263	K242-G265 WeakPolarHBondContact CE-O 3.13Å; K242-G265 PolarHBondContact NZ-O 3.5Å; V261-G265 PolarHBondContact O-N 3.27Å; E262-G265 WeakPolarHBondContact O-CA 3.22Å; E262-G265 PolarHBondContact O-N 3.31Å; S263-G265 PolarHBondContact O-N 3.22Å
266	A	91.7	Very high	82.9	Confident	8 Å²	8	70.3 Å²	70.3	7%	0.066	38%	0.379	C	S	.	.			trans	-96.7	154.9	173.6	0	0	0	0	0	111.7	V238 V248 V261 F264 F268	V238-A266 HydrophobicContact CG1-CB 3.62Å; V248-A266 HydrophobicContact CB-CB 3.89Å; V248-A266 HydrophobicContact CG1-CB 3.96Å; V248-A266 WeakPolarHBondContact O-CA 3.41Å; V248-A266 WeakPolarHBondContact O-CB 3.23Å; V261-A266 HydrophobicContact CG1-CB 3.73Å; V261-A266 PolarHBondContact O-N 3.44Å; F264-A266 VanDerWaalsContact C-N 3.32Å; F264-A266 PolarHBondContact O-N 3.14Å; A266-F268 PolarHBondContact O-N 2.87Å
267	E	94.8	Very high	82.3	Confident	85 Å²	85	67.4 Å²	67.4	40%	0.397	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	111.3	179.7	178.9	-174.3	169.9	0	0	109.6	V248 R249 A250 L269	V248-E267 PolarHBondContact O-N 3.3Å; R249-E267 CarbonylContact C-O 3.46Å; R249-E267 WeakPolarHBondContact CA-O 3.26Å; R249-E267 HydrophobicContact CG-CB 4.04Å; R249-E267 HydrophobicContact CG-CG 4.26Å; R249-E267 VanDerWaalsContact CG-OE2 3.31Å; R249-E267 WeakPolarHBondContact CG-OE2 3.4Å; R249-E267 IonicContact CZ-OE2 3.66Å; R249-E267 IonicContact NE-OE1 3.61Å; R249-E267 IonicContact NE-OE2 2.71Å; R249-E267 PolarHBondContact NE-OE2 3.35Å; R249-E267 IonicContact NH2-OE1 2.92Å; R249-E267 IonicContact NH2-OE2 2.94Å; A250-E267 PolarHBondContact N-O 2.84Å; E267-L269 HydrophobicContact CG-CD2 4.17Å; E267-L269 PolarHBondContact O-N 3.29Å
268	F	93.5	Very high	81.5	Confident	18 Å²	18	72.4 Å²	72.4	8%	0.079	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	115.7	174.9	-168.4	-85.9	0	0	0	110.6	A250 D252 V257 R258 V261 E262 A266 T270	A250-F268 WeakPolarHBondContact O-CA 3.31Å; D252-F268 HydrophobicContact CB-CE2 4.29Å; D252-F268 HydrophobicContact CB-CZ 4.38Å; D252-F268 WeakPolarHBondContact O-CZ 3.4Å; V257-F268 HydrophobicContact CB-CE2 4.28Å; V257-F268 HydrophobicContact CG1-CE2 4.47Å; R258-F268 HydrophobicContact CB-CB 4.39Å; R258-F268 HydrophobicContact CB-CD1 4Å; R258-F268 HydrophobicContact CB-CD2 4.04Å; R258-F268 HydrophobicContact CB-CE1 4.25Å; R258-F268 HydrophobicContact CB-CE2 4.28Å; R258-F268 HydrophobicContact CB-CG 3.87Å; R258-F268 HydrophobicContact CB-CZ 4.37Å; R258-F268 HydrophobicContact CG-CB 3.89Å; R258-F268 HydrophobicContact CG-CD1 4.14Å; R258-F268 HydrophobicContact CG-CD2 4.46Å; R258-F268 HydrophobicContact CG-CG 3.9Å; V261-F268 HydrophobicContact CB-CD2 3.9Å; V261-F268 HydrophobicContact CG1-CB 4.07Å; V261-F268 HydrophobicContact CG1-CD2 4.06Å; V261-F268 HydrophobicContact CG2-CD2 3.95Å; V261-F268 HydrophobicContact CG2-CE2 4.43Å; E262-F268 HydrophobicContact CG-CB 4.37Å; A266-F268 PolarHBondContact O-N 2.87Å; F268-T270 HydrophobicContact CD1-CG2 4.06Å; F268-T270 HydrophobicContact CE1-CG2 4.16Å
269	L	93.2	Very high	80.5	Confident	12 Å²	12	70.9 Å²	70.9	6%	0.063	38%	0.381	C	S	.	.			trans	-82.9	149.7	179.9	-58.8	178.4	0	0	0	111.4	L226 R249 A250 F251 E267 L298 Q302	L226-L269 HydrophobicContact CD1-CD1 3.67Å; R249-L269 HydrophobicContact CB-CD1 4.06Å; R249-L269 HydrophobicContact CB-CG 4.26Å; R249-L269 HydrophobicContact CG-CD2 4.44Å; A250-L269 PolarHBondContact O-N 2.84Å; F251-L269 HydrophobicContact CB-CB 4.43Å; F251-L269 HydrophobicContact CD2-CB 4.28Å; F251-L269 WeakPolarHBondContact CD2-O 3.38Å; E267-L269 HydrophobicContact CG-CD2 4.17Å; E267-L269 PolarHBondContact O-N 3.29Å; L269-L298 HydrophobicContact CB-CD2 4.16Å; L269-L298 HydrophobicContact CD1-CD1 4.45Å; L269-Q302 HydrophobicContact CD1-CG 3.81Å
270	T	85.8	Confident	79.4	Confident	77 Å²	77	65.8 Å²	65.8	47%	0.472	37%	0.372	S	S	.	.			trans	-134.8	158.6	178.2	54.6	0	0	0	0	111.5	F268	F268-T270 HydrophobicContact CD1-CG2 4.06Å; F268-T270 HydrophobicContact CE1-CG2 4.16Å
271	V	85.4	Confident	78.3	Confident	21 Å²	21	63.2 Å²	63.2	13%	0.127	37%	0.371	C	S	.	.			trans	-101.7	152.8	166	-67.2	0	0	0	0	109.8	F251 I273 Y291 A294 E295 L298	F251-V271 HydrophobicContact CE2-CG1 4.21Å; V271-I273 HydrophobicContact CG2-CB 4.49Å; V271-I273 PolarHBondContact O-N 2.93Å; V271-Y291 HydrophobicContact CG2-CD2 3.91Å; V271-Y291 HydrophobicContact CG2-CE1 4.16Å; V271-Y291 HydrophobicContact CG2-CE2 3.41Å; V271-Y291 VanDerWaalsContact CG2-CE2 3.41Å; V271-Y291 HydrophobicContact CG2-CG 4.49Å; V271-A294 HydrophobicContact CB-CB 4.13Å; V271-A294 HydrophobicContact CG1-CB 4.12Å; V271-E295 HydrophobicContact CG1-CB 4.48Å; V271-L298 HydrophobicContact CG1-CB 4.36Å; V271-L298 HydrophobicContact CG1-CD2 3.95Å
272	N	75.3	Confident	77	Confident	172 Å²	172	65.6 Å²	65.6	92%	0.92	40%	0.396	S	S	*	.	S	Bend	trans	-74	23.2	-178.2	-70.3	-25	0	0	0	114.2
273	I	76.5	Confident	75.9	Confident	46 Å²	46	64.6 Å²	64.6	24%	0.236	39%	0.389	C	S	.	.			trans	-124.2	110	-176.5	-60.9	176.8	0	0	0	108.2	V271 E275 K290 Y291 A294	V271-I273 HydrophobicContact CG2-CB 4.49Å; V271-I273 PolarHBondContact O-N 2.93Å; I273-E275 VanDerWaalsContact C-N 3.33Å; I273-E275 HydrophobicContact CG2-CB 4.45Å; I273-E275 PolarHBondContact O-N 2.9Å; I273-K290 HydrophobicContact CD1-CD 4.38Å; I273-K290 HydrophobicContact CD1-CG 3.94Å; I273-K290 WeakPolarHBondContact CD1-O 3.32Å; I273-Y291 HydrophobicContact CB-CD2 4.28Å; I273-Y291 HydrophobicContact CG2-CD2 4.15Å; I273-A294 HydrophobicContact CD1-CB 3.81Å
274	Q	67.7	Low	75.4	Confident	209 Å²	209	61.8 Å²	61.8	98%	0.977	37%	0.371	S	S	*	.			trans	-78.6	81.3	176.9	-70.6	-172.7	-13.1	0	0	110.9
275	E	75.4	Confident	75	Confident	55 Å²	55	61.5 Å²	61.5	26%	0.257	37%	0.37	S	S	.	.			trans	-119.1	127.5	166.7	-166.4	-171	159	0	0	109.1	I273 G277 K285 M287 S288 Y291	I273-E275 VanDerWaalsContact C-N 3.33Å; I273-E275 HydrophobicContact CG2-CB 4.45Å; I273-E275 PolarHBondContact O-N 2.9Å; E275-G277 PolarHBondContact O-N 3.47Å; E275-K285 VanDerWaalsContact OE1-CE 3.25Å; E275-K285 WeakPolarHBondContact OE1-CE 3.39Å; E275-K285 IonicContact OE1-NZ 2.7Å; E275-K285 PolarHBondContact OE1-NZ 3.42Å; E275-M287 HydrophobicContact CB-CE 3.83Å; E275-M287 HydrophobicContact CG-CE 3.85Å; E275-S288 WeakPolarHBondContact OE2-CB 3.35Å; E275-S288 PolarHBondContact OE2-N 2.68Å; E275-S288 PolarHBondContact OE2-OG 3.3Å; E275-Y291 HydrophobicContact CB-CD2 3.95Å; E275-Y291 HydrophobicContact CB-CE2 4.41Å
276	S	68.4	Low	74.6	Confident	66 Å²	66	65.7 Å²	65.7	46%	0.462	38%	0.378	S	S	.	.			trans	-74.2	123.1	175.7	-179.9	0	0	0	0	110.8	E278 K285	S276-E278 VanDerWaalsContact C-N 3.35Å; S276-E278 PolarHBondContact OG-N 2.9Å; S276-K285 WeakPolarHBondContact O-CE 3.36Å; S276-K285 PolarHBondContact O-NZ 2.98Å
277	G	65.6	Low	74.1	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.379	C	S	.	.			trans	-86.4	4.6	172.3	0	0	0	0	0	115.2	T253 E275 G279 A284 K285 M287	T253-G277 WeakPolarHBondContact O-CA 3.32Å; T253-G277 PolarHBondContact O-N 3.18Å; E275-G277 PolarHBondContact O-N 3.47Å; G277-G279 PolarHBondContact O-N 3.46Å; G277-A284 CarbonylContact O-C 3.56Å; G277-A284 WeakPolarHBondContact O-CA 3.26Å; G277-K285 PolarHBondContact O-N 2.64Å; G277-M287 WeakPolarHBondContact CA-SD 3.33Å
278	E	67.6	Low	73.5	Confident	110 Å²	110	64.4 Å²	64.4	51%	0.514	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-67.1	125.7	179.5	-65	-176.5	155.7	0	0	112	R254 S276	R254-E278 HydrophobicContact CB-CG 4.46Å; S276-E278 VanDerWaalsContact C-N 3.35Å; S276-E278 PolarHBondContact OG-N 2.9Å
279	G	64.9	Low	73.1	Confident	28 Å²	28	70.4 Å²	70.4	29%	0.289	40%	0.404	S	S	.	.			trans	-116.4	173.7	173	0	0	0	0	0	112.7	G277 G282 Y283	G277-G279 PolarHBondContact O-N 3.46Å; G279-G282 PolarHBondContact O-N 3.19Å; G279-Y283 VanDerWaalsContact CA-O 3.3Å; G279-Y283 WeakPolarHBondContact CA-O 3.4Å; G279-Y283 PolarHBondContact N-O 3.07Å
280	G	58.5	Low	72.7	Confident	55 Å²	55	76.8 Å²	76.8	57%	0.567	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-59.4	143.2	179.6	0	0	0	0	0	112.9	G282	G280-G282 PolarHBondContact O-N 2.92Å
281	G	58.4	Low	72.7	Confident	43 Å²	43	73.7 Å²	73.7	44%	0.443	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	66.7	17.2	179.4	0	0	0	0	0	115.7	Y283	G281-Y283 VanDerWaalsContact C-N 3.33Å; G281-Y283 PolarHBondContact O-N 3.06Å
282	G	60.5	Low	72.7	Confident	51 Å²	51	75.2 Å²	75.2	53%	0.526	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	82.3	4.8	176.9	0	0	0	0	0	115.4	R254 G279 G280	R254-G282 WeakPolarHBondContact CD-O 3.43Å; R254-G282 PolarHBondContact NH1-O 3.29Å; G279-G282 PolarHBondContact O-N 3.19Å; G280-G282 PolarHBondContact O-N 2.92Å
283	Y	66.3	Low	73.2	Confident	84 Å²	84	73.2 Å²	73.2	33%	0.329	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-76.9	163.2	171	-68.1	-77.3	0	0	0	111.7	R177 G279 G281 P316	R177-Y283 VanDerWaalsContact CZ-OH 3.27Å; R177-Y283 VanDerWaalsContact NH1-CZ 3.26Å; R177-Y283 PolarHBondContact NH1-OH 2.73Å; R177-Y283 VanDerWaalsContact NH1-OH 3.13Å; G279-Y283 VanDerWaalsContact CA-O 3.3Å; G279-Y283 WeakPolarHBondContact CA-O 3.4Å; G279-Y283 PolarHBondContact N-O 3.07Å; G281-Y283 VanDerWaalsContact C-N 3.33Å; G281-Y283 PolarHBondContact O-N 3.06Å; Y283-P316 HydrophobicContact CD1-CG 3.67Å; Y283-P316 HydrophobicContact CE1-CG 3.25Å; Y283-P316 HydrophobicContact CE2-CG 4.33Å; Y283-P316 HydrophobicContact CG-CG 4.36Å
284	A	70.2	Confident	73.9	Confident	33 Å²	33	72 Å²	72	27%	0.273	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-77.2	145.7	168	0	0	0	0	0	110.5	T253 R254 G277	T253-A284 WeakPolarHBondContact OG1-CB 3.42Å; R254-A284 HydrophobicContact CG-CB 4.31Å; G277-A284 CarbonylContact O-C 3.56Å; G277-A284 WeakPolarHBondContact O-CA 3.26Å
285	K	74.1	Confident	75	Confident	76 Å²	76	62.6 Å²	62.6	33%	0.33	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-84.3	172.5	165.1	76.6	175.9	-150.6	-159.9	0	110.8	E275 S276 G277 M287	E275-K285 VanDerWaalsContact OE1-CE 3.25Å; E275-K285 WeakPolarHBondContact OE1-CE 3.39Å; E275-K285 IonicContact OE1-NZ 2.7Å; E275-K285 PolarHBondContact OE1-NZ 3.42Å; S276-K285 WeakPolarHBondContact O-CE 3.36Å; S276-K285 PolarHBondContact O-NZ 2.98Å; G277-K285 PolarHBondContact O-N 2.64Å; K285-M287 HydrophobicContact CD-SD 4.45Å; K285-M287 HydrophobicContact CG-SD 3.96Å
286	E	73.3	Confident	75.7	Confident	130 Å²	130	62.3 Å²	62.3	61%	0.607	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-79.3	131.6	168.4	-160.7	156	-132.2	0	0	109.9	K318	E286-K318 IonicContact OE1-NZ 2.66Å; E286-K318 PolarHBondContact OE1-NZ 2.74Å; E286-K318 IonicContact OE2-NZ 3.65Å; E286-K318 PolarHBondContact OE2-NZ 3.3Å
287	M	80.5	Confident	76.9	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.089	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-94.2	162.5	-171	-59.1	-56.7	-73.2	0	0	112.6	T253 E275 G277 K285 Y291 L292	T253-M287 HydrophobicContact CG2-CG 4.15Å; E275-M287 HydrophobicContact CB-CE 3.83Å; E275-M287 HydrophobicContact CG-CE 3.85Å; G277-M287 WeakPolarHBondContact CA-SD 3.33Å; K285-M287 HydrophobicContact CD-SD 4.45Å; K285-M287 HydrophobicContact CG-SD 3.96Å; M287-Y291 HydrophobicContact CB-CD1 3.78Å; M287-Y291 HydrophobicContact CB-CG 4.05Å; M287-Y291 HydrophobicContact CE-CD1 3.93Å; M287-Y291 HydrophobicContact CE-CD2 3.53Å; M287-Y291 HydrophobicContact CE-CE1 3.95Å; M287-Y291 HydrophobicContact CE-CE2 3.53Å; M287-Y291 HydrophobicContact CE-CG 3.73Å; M287-Y291 HydrophobicContact CG-CD1 3.85Å; M287-Y291 HydrophobicContact CG-CE1 4.07Å; M287-Y291 HydrophobicContact CG-CG 4.37Å; M287-L292 HydrophobicContact CB-CD2 4.33Å; M287-L292 HydrophobicContact CB-CG 4.49Å
288	S	83	Confident	78.2	Confident	49 Å²	49	67.4 Å²	67.4	34%	0.343	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-64	150.3	173.8	66.9	0	0	0	0	112.3	E275 K290 Y291 L292	E275-S288 WeakPolarHBondContact OE2-CB 3.35Å; E275-S288 PolarHBondContact OE2-N 2.68Å; E275-S288 PolarHBondContact OE2-OG 3.3Å; S288-K290 PolarHBondContact O-N 3.36Å; S288-Y291 WeakPolarHBondContact O-CA 3.34Å; S288-Y291 WeakPolarHBondContact O-CB 3.46Å; S288-Y291 PolarHBondContact O-N 2.9Å; S288-Y291 PolarHBondContact OG-N 2.82Å; S288-L292 PolarHBondContact O-N 2.87Å
289	Q	84.3	Confident	79.6	Confident	143 Å²	143	62.2 Å²	62.2	67%	0.668	35%	0.349	S	S	*	.	H	α-helix	trans	-54	-38.8	178.6	-75.8	-69.1	-0.8	0	0	112.7	Y291 L292 E293	Q289-Y291 VanDerWaalsContact C-N 3.3Å; Q289-Y291 PolarHBondContact O-N 2.8Å; Q289-L292 WeakPolarHBondContact O-CB 3.34Å; Q289-L292 PolarHBondContact O-N 3.19Å; Q289-L292 VanDerWaalsContact O-N 3.16Å; Q289-E293 WeakPolarHBondContact O-CG 3.44Å; Q289-E293 PolarHBondContact O-N 2.74Å
290	K	84.8	Confident	81	Confident	146 Å²	146	62.3 Å²	62.3	64%	0.635	35%	0.347	S	S	*	.	H	α-helix	trans	-66	-31.4	177.3	-162.7	-176.6	179.8	179.6	0	113.1	I273 S288 A294	I273-K290 HydrophobicContact CD1-CD 4.38Å; I273-K290 HydrophobicContact CD1-CG 3.94Å; I273-K290 WeakPolarHBondContact CD1-O 3.32Å; S288-K290 PolarHBondContact O-N 3.36Å; K290-A294 PolarHBondContact O-N 3.39Å
291	Y	85.5	Confident	82.8	Confident	12 Å²	12	66.5 Å²	66.5	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-69.5	-45.1	171.5	-171.2	-76.2	0	0	0	110.5	F251 T253 V271 I273 E275 M287 S288 Q289 E293 A294 E295	F251-Y291 HydrophobicContact CZ-CE1 4.18Å; T253-Y291 HydrophobicContact CG2-CE1 3.84Å; V271-Y291 HydrophobicContact CG2-CD2 3.91Å; V271-Y291 HydrophobicContact CG2-CE1 4.16Å; V271-Y291 HydrophobicContact CG2-CE2 3.41Å; V271-Y291 VanDerWaalsContact CG2-CE2 3.41Å; V271-Y291 HydrophobicContact CG2-CG 4.49Å; I273-Y291 HydrophobicContact CB-CD2 4.28Å; I273-Y291 HydrophobicContact CG2-CD2 4.15Å; E275-Y291 HydrophobicContact CB-CD2 3.95Å; E275-Y291 HydrophobicContact CB-CE2 4.41Å; M287-Y291 HydrophobicContact CB-CD1 3.78Å; M287-Y291 HydrophobicContact CB-CG 4.05Å; M287-Y291 HydrophobicContact CE-CD1 3.93Å; M287-Y291 HydrophobicContact CE-CD2 3.53Å; M287-Y291 HydrophobicContact CE-CE1 3.95Å; M287-Y291 HydrophobicContact CE-CE2 3.53Å; M287-Y291 HydrophobicContact CE-CG 3.73Å; M287-Y291 HydrophobicContact CG-CD1 3.85Å; M287-Y291 HydrophobicContact CG-CE1 4.07Å; M287-Y291 HydrophobicContact CG-CG 4.37Å; S288-Y291 WeakPolarHBondContact O-CA 3.34Å; S288-Y291 WeakPolarHBondContact O-CB 3.46Å; S288-Y291 PolarHBondContact O-N 2.9Å; S288-Y291 PolarHBondContact OG-N 2.82Å; Q289-Y291 VanDerWaalsContact C-N 3.3Å; Q289-Y291 PolarHBondContact O-N 2.8Å; Y291-E293 VanDerWaalsContact C-N 3.35Å; Y291-E293 PolarHBondContact O-N 3.34Å; Y291-A294 PolarHBondContact O-N 2.87Å; Y291-E295 HydrophobicContact CD1-CB 4.48Å; Y291-E295 WeakPolarHBondContact O-CB 3.42Å; Y291-E295 PolarHBondContact O-N 2.98Å
292	L	84.8	Confident	84.5	Confident	54 Å²	54	65.2 Å²	65.2	28%	0.283	33%	0.332	S	S	.	.	H	α-helix	trans	-60.4	-41	176.7	-62.6	173.6	0	0	0	112	M287 S288 Q289 A294 E295 M296	M287-L292 HydrophobicContact CB-CD2 4.33Å; M287-L292 HydrophobicContact CB-CG 4.49Å; S288-L292 PolarHBondContact O-N 2.87Å; Q289-L292 WeakPolarHBondContact O-CB 3.34Å; Q289-L292 PolarHBondContact O-N 3.19Å; Q289-L292 VanDerWaalsContact O-N 3.16Å; L292-A294 PolarHBondContact O-N 2.73Å; L292-E295 PolarHBondContact O-N 2.8Å; L292-M296 WeakPolarHBondContact O-CB 3.37Å; L292-M296 WeakPolarHBondContact O-CG 3.49Å; L292-M296 PolarHBondContact O-N 3.33Å
293	E	87.8	Confident	86.2	Confident	130 Å²	130	62.8 Å²	62.8	61%	0.607	31%	0.307	S	S	*	.	H	α-helix	trans	-57	-47	173.5	-74.1	169	169.7	0	0	111.9	Q289 Y291 M296 E297	Q289-E293 WeakPolarHBondContact O-CG 3.44Å; Q289-E293 PolarHBondContact O-N 2.74Å; Y291-E293 VanDerWaalsContact C-N 3.35Å; Y291-E293 PolarHBondContact O-N 3.34Å; E293-M296 PolarHBondContact O-N 2.85Å; E293-E297 PolarHBondContact O-N 3.48Å
294	A	89.8	Confident	87.6	Confident	21 Å²	21	65.1 Å²	65.1	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-70.9	-33.6	178.9	0	0	0	0	0	113.2	V271 I273 K290 Y291 L292 L298	V271-A294 HydrophobicContact CB-CB 4.13Å; V271-A294 HydrophobicContact CG1-CB 4.12Å; I273-A294 HydrophobicContact CD1-CB 3.81Å; K290-A294 PolarHBondContact O-N 3.39Å; Y291-A294 PolarHBondContact O-N 2.87Å; L292-A294 PolarHBondContact O-N 2.73Å; A294-L298 WeakPolarHBondContact O-CB 3.44Å; A294-L298 PolarHBondContact O-N 3.19Å
295	E	90.4	Very high	88.9	Confident	11 Å²	11	67.2 Å²	67.2	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-44.4	172.8	176.4	174.8	-175.8	0	0	110.7	F251 V271 Y291 L292 L298 F299	F251-E295 HydrophobicContact CE1-CG 3.88Å; F251-E295 WeakPolarHBondContact CE1-OE1 3.48Å; F251-E295 HydrophobicContact CZ-CG 4.03Å; V271-E295 HydrophobicContact CG1-CB 4.48Å; Y291-E295 HydrophobicContact CD1-CB 4.48Å; Y291-E295 WeakPolarHBondContact O-CB 3.42Å; Y291-E295 PolarHBondContact O-N 2.98Å; L292-E295 PolarHBondContact O-N 2.8Å; E295-L298 WeakPolarHBondContact O-CB 3.17Å; E295-L298 PolarHBondContact O-N 3.06Å; E295-F299 HydrophobicContact CG-CD2 4.03Å; E295-F299 HydrophobicContact CG-CE1 4.37Å; E295-F299 HydrophobicContact CG-CE2 3.3Å; E295-F299 HydrophobicContact CG-CZ 3.49Å; E295-F299 VanDerWaalsContact CG-CZ 3.49Å; E295-F299 WeakPolarHBondContact O-CD2 3.45Å; E295-F299 VanDerWaalsContact O-CG 3.31Å; E295-F299 WeakPolarHBondContact O-CG 3.5Å; E295-F299 PolarHBondContact O-N 3.27Å; E295-F299 WeakPolarHBondContact OE1-CE2 3.35Å; E295-F299 WeakPolarHBondContact OE1-CZ 3.4Å
296	M	91.7	Very high	90	Very high	49 Å²	49	63.6 Å²	63.6	24%	0.241	31%	0.308	C	S	.	.	H	α-helix	trans	-68.7	-35.6	176.5	-65	-65.4	-90.4	0	0	112.4	L292 E293 F299 A300 T325 M328	L292-M296 WeakPolarHBondContact O-CB 3.37Å; L292-M296 WeakPolarHBondContact O-CG 3.49Å; L292-M296 PolarHBondContact O-N 3.33Å; E293-M296 PolarHBondContact O-N 2.85Å; M296-F299 PolarHBondContact O-N 2.85Å; M296-F299 HydrophobicContact SD-CD2 4.4Å; M296-A300 WeakPolarHBondContact O-CB 3.23Å; M296-A300 PolarHBondContact O-N 2.93Å; M296-T325 HydrophobicContact CE-CG2 3.55Å; M296-M328 HydrophobicContact CB-CE 4.09Å; M296-M328 HydrophobicContact CE-CE 3.79Å; M296-M328 WeakPolarHBondContact O-CE 3.43Å; M296-M328 HydrophobicContact SD-CE 3.99Å
297	E	92.7	Very high	91.1	Very high	146 Å²	146	57.6 Å²	57.6	68%	0.682	28%	0.279	S	S	*	.	H	α-helix	trans	-63	-44.9	171.2	-166.7	-167.2	162.8	0	0	111.3	E293 F299 A300 K301	E293-E297 PolarHBondContact O-N 3.48Å; E297-F299 PolarHBondContact O-N 3.06Å; E297-A300 PolarHBondContact O-N 3.35Å; E297-K301 WeakPolarHBondContact O-CB 3.35Å; E297-K301 PolarHBondContact O-N 3.21Å
298	L	93.9	Very high	92	Very high	27 Å²	27	56.7 Å²	56.7	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-46.6	175.8	174.7	62.9	0	0	0	111.2	F251 L269 V271 A294 E295 K301 Q302	F251-L298 HydrophobicContact CD2-CD2 3.71Å; F251-L298 HydrophobicContact CE2-CD2 3.84Å; L269-L298 HydrophobicContact CB-CD2 4.16Å; L269-L298 HydrophobicContact CD1-CD1 4.45Å; V271-L298 HydrophobicContact CG1-CB 4.36Å; V271-L298 HydrophobicContact CG1-CD2 3.95Å; A294-L298 WeakPolarHBondContact O-CB 3.44Å; A294-L298 PolarHBondContact O-N 3.19Å; E295-L298 WeakPolarHBondContact O-CB 3.17Å; E295-L298 PolarHBondContact O-N 3.06Å; L298-K301 PolarHBondContact O-N 2.72Å; L298-Q302 HydrophobicContact CD1-CG 4.19Å; L298-Q302 VanDerWaalsContact O-CG 3.31Å; L298-Q302 WeakPolarHBondContact O-CG 3.29Å; L298-Q302 PolarHBondContact O-N 2.89Å
299	F	95.7	Very high	92.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-41	177.6	-61	-25.3	0	0	0	112.7	I228 F251 E295 M296 E297 K301 Q302 A303 L323 I324 M328	I228-F299 HydrophobicContact CB-CZ 4.49Å; I228-F299 HydrophobicContact CD1-CD1 3.73Å; I228-F299 HydrophobicContact CD1-CD2 4.09Å; I228-F299 HydrophobicContact CD1-CE1 3.71Å; I228-F299 HydrophobicContact CD1-CE2 4.05Å; I228-F299 HydrophobicContact CD1-CG 3.95Å; I228-F299 HydrophobicContact CD1-CZ 3.88Å; I228-F299 HydrophobicContact CG1-CD1 4.33Å; I228-F299 HydrophobicContact CG1-CE1 3.9Å; I228-F299 HydrophobicContact CG1-CZ 4.12Å; I228-F299 HydrophobicContact CG2-CE1 4.2Å; I228-F299 HydrophobicContact CG2-CE2 4.05Å; I228-F299 HydrophobicContact CG2-CZ 3.58Å; F251-F299 HydrophobicContact CB-CE1 4.14Å; F251-F299 AromaticContact CD1-CE1 3.84Å; F251-F299 HydrophobicContact CD1-CE1 3.84Å; F251-F299 AromaticContact CD1-CZ 3.58Å; F251-F299 HydrophobicContact CD1-CZ 3.58Å; F251-F299 HydrophobicContact CE1-CE1 4.41Å; F251-F299 AromaticContact CE1-CZ 3.9Å; F251-F299 HydrophobicContact CE1-CZ 3.9Å; F251-F299 AromaticContact CG-CE1 3.95Å; F251-F299 HydrophobicContact CG-CE1 3.95Å; F251-F299 HydrophobicContact CG-CZ 4.18Å; E295-F299 HydrophobicContact CG-CD2 4.03Å; E295-F299 HydrophobicContact CG-CE1 4.37Å; E295-F299 HydrophobicContact CG-CE2 3.3Å; E295-F299 HydrophobicContact CG-CZ 3.49Å; E295-F299 VanDerWaalsContact CG-CZ 3.49Å; E295-F299 WeakPolarHBondContact O-CD2 3.45Å; E295-F299 VanDerWaalsContact O-CG 3.31Å; E295-F299 WeakPolarHBondContact O-CG 3.5Å; E295-F299 PolarHBondContact O-N 3.27Å; E295-F299 WeakPolarHBondContact OE1-CE2 3.35Å; E295-F299 WeakPolarHBondContact OE1-CZ 3.4Å; M296-F299 PolarHBondContact O-N 2.85Å; M296-F299 HydrophobicContact SD-CD2 4.4Å; E297-F299 PolarHBondContact O-N 3.06Å; F299-K301 PolarHBondContact O-N 3.43Å; F299-Q302 PolarHBondContact O-N 3.32Å; F299-A303 VanDerWaalsContact O-CB 3.32Å; F299-A303 WeakPolarHBondContact O-CB 3.45Å; F299-A303 PolarHBondContact O-N 3.08Å; F299-L323 HydrophobicContact CD2-CB 4.1Å; F299-L323 WeakPolarHBondContact CD2-O 3.26Å; F299-L323 HydrophobicContact CE2-CB 3.88Å; F299-L323 HydrophobicContact CE2-CD1 4.16Å; F299-L323 HydrophobicContact CE2-CD2 4.34Å; F299-L323 HydrophobicContact CE2-CG 4.34Å; F299-I324 HydrophobicContact CB-CD1 4.08Å; F299-I324 HydrophobicContact CG-CD1 4.42Å; F299-M328 HydrophobicContact CB-CE 4.44Å; F299-M328 HydrophobicContact CB-SD 4.07Å
300	A	95	Very high	93.4	Very high	31 Å²	31	47.6 Å²	47.6	26%	0.256	23%	0.227	S	C	.	.	H	α-helix	trans	-62	-30.8	174	0	0	0	0	0	113.2	M296 E297 M328	M296-A300 WeakPolarHBondContact O-CB 3.23Å; M296-A300 PolarHBondContact O-N 2.93Å; E297-A300 PolarHBondContact O-N 3.35Å; A300-M328 HydrophobicContact CB-CE 4.15Å; A300-M328 HydrophobicContact CB-CG 4.14Å; A300-M328 HydrophobicContact CB-SD 4.5Å
301	K	95.3	Very high	94	Very high	143 Å²	143	40.7 Å²	40.7	62%	0.622	20%	0.197	S	C	*	.	H	α-helix	trans	-74.6	-43.9	173.7	-173.8	176.2	179.9	178.6	0	111.9	E297 L298 F299	E297-K301 WeakPolarHBondContact O-CB 3.35Å; E297-K301 PolarHBondContact O-N 3.21Å; L298-K301 PolarHBondContact O-N 2.72Å; F299-K301 PolarHBondContact O-N 3.43Å
302	Q	95.9	Very high	94.4	Very high	16 Å²	16	41 Å²	41	8%	0.075	20%	0.202	C	C	.	.	H	α-helix	trans	-70	-39.6	179.9	-67.2	-68.3	-15.5	0	0	112.6	L226 L269 L298 F299 K304 E305 V306	L226-Q302 HydrophobicContact CD2-CB 3.89Å; L269-Q302 HydrophobicContact CD1-CG 3.81Å; L298-Q302 HydrophobicContact CD1-CG 4.19Å; L298-Q302 VanDerWaalsContact O-CG 3.31Å; L298-Q302 WeakPolarHBondContact O-CG 3.29Å; L298-Q302 PolarHBondContact O-N 2.89Å; F299-Q302 PolarHBondContact O-N 3.32Å; Q302-K304 PolarHBondContact O-N 3.2Å; Q302-K304 VanDerWaalsContact O-N 3.16Å; Q302-E305 WeakPolarHBondContact O-CA 3.44Å; Q302-E305 PolarHBondContact O-N 3.43Å; Q302-V306 WeakPolarHBondContact O-CG2 3.41Å; Q302-V306 PolarHBondContact O-N 3.23Å
303	A	96.2	Very high	94.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55.4	-35.4	-177.7	0	0	0	0	0	113.5	F299 E305 I309 M328 M332	F299-A303 VanDerWaalsContact O-CB 3.32Å; F299-A303 WeakPolarHBondContact O-CB 3.45Å; F299-A303 PolarHBondContact O-N 3.08Å; A303-E305 VanDerWaalsContact C-N 3.31Å; A303-E305 PolarHBondContact O-N 2.73Å; A303-I309 HydrophobicContact CB-CD1 4.26Å; A303-M328 HydrophobicContact CB-CB 4.23Å; A303-M332 HydrophobicContact CB-CG 4.28Å
304	K	95.8	Very high	94.6	Very high	132 Å²	132	37.8 Å²	37.8	57%	0.574	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-28.3	176.1	-64.3	172	-174.8	176.1	0	113.2	Q302	Q302-K304 PolarHBondContact O-N 3.2Å; Q302-K304 VanDerWaalsContact O-N 3.16Å
305	E	95.6	Very high	94	Very high	78 Å²	78	39 Å²	39	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-39.6	-179.6	-87.7	-163.2	-155	0	0	113.8	K224 R249 Q302 A303 R333	K224-E305 HydrophobicContact CD-CB 4.48Å; K224-E305 WeakPolarHBondContact CD-O 3.2Å; K224-E305 IonicContact NZ-OE2 2.71Å; K224-E305 PolarHBondContact NZ-OE2 3.37Å; R249-E305 IonicContact CZ-OE2 2.67Å; R249-E305 IonicContact NH1-OE2 2.96Å; R249-E305 PolarHBondContact NH1-OE2 2.96Å; R249-E305 IonicContact NH2-OE2 3.77Å; Q302-E305 WeakPolarHBondContact O-CA 3.44Å; Q302-E305 PolarHBondContact O-N 3.43Å; A303-E305 VanDerWaalsContact C-N 3.31Å; A303-E305 PolarHBondContact O-N 2.73Å; E305-R333 PolarHBondContact O-NH2 2.95Å
306	V	97.4	Very high	93.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.			trans	-80.8	155.8	-169.1	-56.4	0	0	0	0	112.5	K224 L226 Q302 I309 M332	K224-V306 HydrophobicContact CB-CB 4.11Å; K224-V306 HydrophobicContact CB-CG1 4.08Å; L226-V306 HydrophobicContact CB-CB 4.42Å; L226-V306 HydrophobicContact CB-CG1 4.15Å; L226-V306 HydrophobicContact CB-CG2 4.03Å; Q302-V306 WeakPolarHBondContact O-CG2 3.41Å; Q302-V306 PolarHBondContact O-N 3.23Å; V306-I309 HydrophobicContact CG2-CD1 4.17Å; V306-I309 HydrophobicContact CG2-CG1 3.65Å; V306-M332 HydrophobicContact CG2-CE 4.07Å
307	D	97.7	Very high	92.1	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.016	25%	0.246	C	C	.	.	S	Bend	trans	-96.7	-28.3	-179.8	-62.1	-81.7	0	0	0	111.8	F206 R208 K224 R333 S336 V337	F206-D307 HydrophobicContact CE1-CB 4.49Å; F206-D307 HydrophobicContact CE2-CB 3.73Å; F206-D307 HydrophobicContact CZ-CB 3.55Å; R208-D307 IonicContact CZ-OD1 3.19Å; R208-D307 IonicContact NH1-OD1 3.67Å; R208-D307 PolarHBondContact NH1-OD1 3.3Å; R208-D307 IonicContact NH2-OD1 3.15Å; R208-D307 PolarHBondContact NH2-OD1 3.15Å; K224-D307 PolarHBondContact N-OD2 2.71Å; K224-D307 PolarHBondContact O-N 3.44Å; D307-R333 IonicContact OD1-CZ 2.68Å; D307-R333 IonicContact OD1-NE 2.83Å; D307-R333 IonicContact OD1-NH1 2.71Å; D307-R333 PolarHBondContact OD1-NH1 3.01Å; D307-R333 IonicContact OD1-NH2 3.02Å; D307-R333 PolarHBondContact OD1-NH2 3.35Å; D307-R333 IonicContact OD2-NH2 3.12Å; D307-R333 PolarHBondContact OD2-NH2 2.64Å; D307-S336 WeakPolarHBondContact O-CA 3.33Å; D307-S336 WeakPolarHBondContact O-CB 3.27Å; D307-S336 PolarHBondContact O-OG 3.2Å; D307-V337 PolarHBondContact O-N 2.9Å
308	I	98.4	Very high	91.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	138.8	-178.9	-57.3	177.1	0	0	0	109.4	A202 F206 F210 K224 V225 L226 I310 V337	A202-I308 HydrophobicContact CB-CD1 4.31Å; A202-I308 HydrophobicContact CB-CG2 4.06Å; F206-I308 HydrophobicContact CB-CD1 4.09Å; F206-I308 HydrophobicContact CD1-CD1 4.08Å; F206-I308 HydrophobicContact CD2-CD1 4.33Å; F206-I308 HydrophobicContact CD2-CG1 4.2Å; F206-I308 HydrophobicContact CG-CD1 3.91Å; F206-I308 HydrophobicContact CG-CG1 4.29Å; F210-I308 HydrophobicContact CD2-CD1 4.46Å; F210-I308 HydrophobicContact CE1-CD1 4.26Å; F210-I308 HydrophobicContact CE2-CD1 3.41Å; F210-I308 VanDerWaalsContact CE2-CD1 3.41Å; F210-I308 HydrophobicContact CZ-CD1 3.29Å; K224-I308 PolarHBondContact O-N 2.95Å; K224-I308 VanDerWaalsContact O-N 3.1Å; V225-I308 WeakPolarHBondContact CA-O 3.45Å; V225-I308 HydrophobicContact CG1-CB 4.36Å; V225-I308 HydrophobicContact CG1-CG2 4.29Å; V225-I308 HydrophobicContact CG2-CB 4.21Å; V225-I308 HydrophobicContact CG2-CD1 4.44Å; L226-I308 PolarHBondContact N-O 3.41Å; I308-I310 HydrophobicContact CG2-CG1 4.12Å; I308-V337 CarbonylContact C-O 3.24Å; I308-V337 WeakPolarHBondContact CA-O 3.21Å; I308-V337 HydrophobicContact CG1-CB 4.38Å; I308-V337 WeakPolarHBondContact CG2-O 3.46Å
309	I	98.4	Very high	91.1	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.8	170.5	-54.3	178	0	0	0	109.1	L226 I228 A303 V306 T311 I324 M332 V337 I338 V339	L226-I309 HydrophobicContact CB-CG1 4.36Å; L226-I309 HydrophobicContact CD2-CG1 4.49Å; L226-I309 HydrophobicContact CD2-CG2 4.37Å; L226-I309 CarbonylContact O-C 3.5Å; L226-I309 WeakPolarHBondContact O-CA 3.48Å; I228-I309 HydrophobicContact CD1-CG2 4.16Å; A303-I309 HydrophobicContact CB-CD1 4.26Å; V306-I309 HydrophobicContact CG2-CD1 4.17Å; V306-I309 HydrophobicContact CG2-CG1 3.65Å; I309-T311 HydrophobicContact CG2-CG2 3.85Å; I309-I324 HydrophobicContact CD1-CD1 4.19Å; I309-I324 HydrophobicContact CG2-CD1 4.46Å; I309-I324 HydrophobicContact CG2-CG1 4.46Å; I309-M332 HydrophobicContact CD1-CE 3.82Å; I309-M332 HydrophobicContact CD1-SD 3.68Å; I309-M332 HydrophobicContact CG1-CE 3.79Å; I309-M332 HydrophobicContact CG1-SD 4.18Å; I309-V337 PolarHBondContact N-O 3.14Å; I309-I338 HydrophobicContact CB-CG1 4.37Å; I309-I338 CarbonylContact O-C 3.51Å; I309-I338 WeakPolarHBondContact O-CA 3.46Å; I309-V339 PolarHBondContact O-N 2.98Å
310	I	98.2	Very high	90.8	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	116.4	175.4	-55.7	-177.2	0	0	0	107.8	V199 V225 L226 V227 I228 A237 I308 V339 L341	V199-I310 HydrophobicContact CB-CD1 4.5Å; V199-I310 HydrophobicContact CG2-CD1 3.5Å; V225-I310 HydrophobicContact CG1-CD1 4.11Å; V225-I310 HydrophobicContact CG1-CG1 4.33Å; L226-I310 PolarHBondContact O-N 3.48Å; V227-I310 CarbonylContact C-O 3.57Å; V227-I310 WeakPolarHBondContact CA-O 3.36Å; V227-I310 HydrophobicContact CG2-CB 4.44Å; I228-I310 PolarHBondContact N-O 2.84Å; A237-I310 HydrophobicContact CB-CD1 4.11Å; A237-I310 HydrophobicContact CB-CG2 4.07Å; I308-I310 HydrophobicContact CG2-CG1 4.12Å; I310-V339 WeakPolarHBondContact CA-O 3.33Å; I310-V339 HydrophobicContact CB-CB 4.4Å; I310-V339 HydrophobicContact CG1-CB 4.08Å; I310-V339 HydrophobicContact CG1-CG2 4.04Å; I310-V339 HydrophobicContact CG2-CB 4.2Å; I310-V339 HydrophobicContact CG2-CG1 4.49Å; I310-L341 HydrophobicContact CG2-CD1 3.75Å; I310-L341 HydrophobicContact CG2-CG 4.12Å
311	T	97.4	Very high	90.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.8	-176.7	60.5	0	0	0	0	111.1	I228 I309 I324 V339 D340 L341 N348 V349	I228-T311 HydrophobicContact CB-CG2 4.29Å; I228-T311 HydrophobicContact CD1-CG2 4.23Å; I309-T311 HydrophobicContact CG2-CG2 3.85Å; T311-I324 HydrophobicContact CG2-CG1 4.16Å; T311-V339 PolarHBondContact N-O 3.41Å; T311-V339 PolarHBondContact OG1-O 2.81Å; T311-D340 PolarHBondContact OG1-OD1 2.97Å; T311-L341 WeakPolarHBondContact O-CA 3.33Å; T311-L341 VanDerWaalsContact O-CB 3.26Å; T311-L341 WeakPolarHBondContact O-CB 3.45Å; T311-L341 PolarHBondContact O-N 3.37Å; T311-N348 WeakPolarHBondContact CB-OD1 3.34Å; T311-N348 HydrophobicContact CG2-CB 4.1Å; T311-V349 HydrophobicContact CG2-CG2 4.22Å
312	S	94.6	Very high	90.5	Very high	20 Å²	20	43.6 Å²	43.6	14%	0.14	25%	0.253	C	S	.	.			trans	-134.4	29.4	177.3	88.1	0	0	0	0	112.5	I228 G229 L314	I228-S312 PolarHBondContact O-N 2.83Å; G229-S312 PolarHBondContact O-OG 3.48Å; S312-L314 PolarHBondContact O-N 3.49Å
313	A	90.7	Very high	90.3	Very high	21 Å²	21	43.3 Å²	43.3	17%	0.174	25%	0.252	C	S	.	.			trans	-81.8	104	-178.8	0	0	0	0	0	109.8	P321 L323 N348	A313-P321 HydrophobicContact CB-CG 4.4Å; A313-P321 WeakPolarHBondContact O-CD 3.28Å; A313-L323 HydrophobicContact CB-CD1 3.54Å; A313-N348 PolarHBondContact N-OD1 3.29Å; A313-N348 PolarHBondContact O-ND2 3.1Å; A313-N348 PolarHBondContact O-OD1 3.03Å
314	L	86.4	Confident	90.3	Very high	94 Å²	94	43.3 Å²	43.3	49%	0.492	25%	0.252	S	S	.	.			trans	-138	125.4	-176.7	-179.3	59.6	0	0	0	111.2	S312 A345	S312-L314 PolarHBondContact O-N 3.49Å; L314-A345 HydrophobicContact CD1-CB 3.45Å; L314-A345 VanDerWaalsContact CD1-CB 3.45Å
315	I	77.6	Confident	90.4	Very high	48 Å²	48	38.5 Å²	38.5	25%	0.246	23%	0.234	C	C	.	.			trans	-99.3	125.1	172.1	-60.3	176.4	0	0	0	107.8	G317 K318	I315-G317 PolarHBondContact O-N 3.49Å; I315-K318 HydrophobicContact CB-CB 4.3Å; I315-K318 HydrophobicContact CG2-CB 4.39Å; I315-K318 HydrophobicContact CG2-CD 4.33Å; I315-K318 HydrophobicContact CG2-CG 4.35Å; I315-K318 PolarHBondContact O-N 3.21Å
316	P	70.2	Confident	90.4	Very high	74 Å²	74	39.2 Å²	39.2	48%	0.481	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	135.8	179.7	-25.9	33.3	0	0	0	112.9	Y283 K318	Y283-P316 HydrophobicContact CD1-CG 3.67Å; Y283-P316 HydrophobicContact CE1-CG 3.25Å; Y283-P316 HydrophobicContact CE2-CG 4.33Å; Y283-P316 HydrophobicContact CG-CG 4.36Å; P316-K318 PolarHBondContact O-N 3.46Å; P316-K318 VanDerWaalsContact O-N 3.14Å
317	G	71.9	Confident	90.3	Very high	87 Å²	87	42.5 Å²	42.5	90%	0.897	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	-16	178.7	0	0	0	0	0	115.9	I315	I315-G317 PolarHBondContact O-N 3.49Å
318	K	79.9	Confident	90.3	Very high	91 Å²	91	43 Å²	43	40%	0.396	27%	0.265	S	S	.	.	S	Bend	trans	-97.1	158.9	174.2	-70.9	-163.1	175.8	-160.6	0	112	E286 I315 P316	E286-K318 IonicContact OE1-NZ 2.66Å; E286-K318 PolarHBondContact OE1-NZ 2.74Å; E286-K318 IonicContact OE2-NZ 3.65Å; E286-K318 PolarHBondContact OE2-NZ 3.3Å; I315-K318 HydrophobicContact CB-CB 4.3Å; I315-K318 HydrophobicContact CG2-CB 4.39Å; I315-K318 HydrophobicContact CG2-CD 4.33Å; I315-K318 HydrophobicContact CG2-CG 4.35Å; I315-K318 PolarHBondContact O-N 3.21Å; P316-K318 PolarHBondContact O-N 3.46Å; P316-K318 VanDerWaalsContact O-N 3.14Å
319	P	85.2	Confident	90.2	Very high	105 Å²	105	43 Å²	43	68%	0.682	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-59.1	155.6	162	-20.4	33.3	0	0	0	111.7	A345	P319-A345 WeakPolarHBondContact CA-O 3.42Å
320	A	89.3	Confident	90.1	Very high	10 Å²	10	46.5 Å²	46.5	8%	0.083	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-66.1	131.6	173.5	0	0	0	0	0	111	A342 A345	A320-A342 HydrophobicContact CB-CB 3.78Å; A320-A345 HydrophobicContact CB-CB 4.22Å; A320-A345 PolarHBondContact N-O 3.4Å
321	P	90.2	Very high	90	Very high	50 Å²	50	48.3 Å²	48.3	33%	0.325	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-66.7	139.1	176.5	27.5	-34.8	0	0	0	110.9	A313 L323 N348	A313-P321 HydrophobicContact CB-CG 4.4Å; A313-P321 WeakPolarHBondContact O-CD 3.28Å; P321-L323 HydrophobicContact CB-CD2 4.11Å; P321-L323 HydrophobicContact CB-CG 4.28Å; P321-L323 HydrophobicContact CG-CD1 4.3Å; P321-L323 HydrophobicContact CG-CD2 4.37Å; P321-L323 HydrophobicContact CG-CG 4.2Å; P321-L323 PolarHBondContact O-N 3.34Å; P321-N348 VanDerWaalsContact O-CA 3.28Å; P321-N348 WeakPolarHBondContact O-CA 3.39Å; P321-N348 PolarHBondContact O-ND2 3.36Å
322	K	93.1	Very high	90	Very high	85 Å²	85	48.7 Å²	48.7	37%	0.37	30%	0.296	S	S	.	.			trans	-80.1	98.4	175	-67.2	-58.8	-174.5	-170.4	0	110.1	G346 G347 N348 V349 E350	K322-G346 PolarHBondContact NZ-O 3.04Å; K322-G347 WeakPolarHBondContact CD-O 3.17Å; K322-G347 WeakPolarHBondContact CE-O 3.42Å; K322-G347 PolarHBondContact NZ-O 3.01Å; K322-N348 CarbonylContact C-O 3.55Å; K322-N348 WeakPolarHBondContact CA-O 3.5Å; K322-V349 PolarHBondContact NZ-O 2.8Å; K322-E350 HydrophobicContact CB-CG 4.36Å; K322-E350 HydrophobicContact CD-CG 4.25Å; K322-E350 HydrophobicContact CG-CG 4.37Å
323	L	93.1	Very high	90	Very high	11 Å²	11	52.2 Å²	52.2	6%	0.058	31%	0.306	C	S	.	.			trans	-102.3	-22.1	-175.9	-59.9	-178.6	0	0	0	113	I228 F299 A313 P321 N348	I228-L323 HydrophobicContact CG2-CD1 3.68Å; F299-L323 HydrophobicContact CD2-CB 4.1Å; F299-L323 WeakPolarHBondContact CD2-O 3.26Å; F299-L323 HydrophobicContact CE2-CB 3.88Å; F299-L323 HydrophobicContact CE2-CD1 4.16Å; F299-L323 HydrophobicContact CE2-CD2 4.34Å; F299-L323 HydrophobicContact CE2-CG 4.34Å; A313-L323 HydrophobicContact CB-CD1 3.54Å; P321-L323 HydrophobicContact CB-CD2 4.11Å; P321-L323 HydrophobicContact CB-CG 4.28Å; P321-L323 HydrophobicContact CG-CD1 4.3Å; P321-L323 HydrophobicContact CG-CD2 4.37Å; P321-L323 HydrophobicContact CG-CG 4.2Å; P321-L323 PolarHBondContact O-N 3.34Å; L323-N348 PolarHBondContact N-O 3.32Å
324	I	96.4	Very high	90.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-117.5	108.5	174.6	-56.1	-63.9	0	0	0	108.6	I228 F299 I309 T311 M328 V329 N348 V349 E350	I228-I324 HydrophobicContact CD1-CD1 3.74Å; I228-I324 HydrophobicContact CD1-CG1 4.27Å; F299-I324 HydrophobicContact CB-CD1 4.08Å; F299-I324 HydrophobicContact CG-CD1 4.42Å; I309-I324 HydrophobicContact CD1-CD1 4.19Å; I309-I324 HydrophobicContact CG2-CD1 4.46Å; I309-I324 HydrophobicContact CG2-CG1 4.46Å; T311-I324 HydrophobicContact CG2-CG1 4.16Å; I324-M328 HydrophobicContact CD1-SD 4.19Å; I324-M328 HydrophobicContact CG2-CB 4.06Å; I324-V329 HydrophobicContact CG2-CG2 3.65Å; I324-N348 PolarHBondContact N-O 3.17Å; I324-V349 HydrophobicContact CB-CB 4.21Å; I324-V349 HydrophobicContact CB-CG1 3.99Å; I324-V349 HydrophobicContact CB-CG2 3.77Å; I324-V349 HydrophobicContact CG1-CG2 4.09Å; I324-V349 HydrophobicContact CG2-CG1 3.9Å; I324-V349 HydrophobicContact CG2-CG2 4.33Å; I324-V349 WeakPolarHBondContact O-CA 3.38Å; I324-E350 PolarHBondContact O-N 2.89Å
325	T	96.3	Very high	90.6	Very high	30 Å²	30	52.4 Å²	52.4	18%	0.184	32%	0.316	C	S	.	.			trans	-80.4	160.2	178.7	71.3	0	0	0	0	111.7	M296 A327 M328 V329 E350	M296-T325 HydrophobicContact CE-CG2 3.55Å; T325-A327 PolarHBondContact O-N 2.96Å; T325-M328 HydrophobicContact CG2-CE 4.19Å; T325-M328 WeakPolarHBondContact O-CA 3.43Å; T325-M328 WeakPolarHBondContact O-CB 3.22Å; T325-M328 PolarHBondContact O-N 2.71Å; T325-M328 WeakPolarHBondContact OG1-CG 3.46Å; T325-M328 PolarHBondContact OG1-N 3.29Å; T325-V329 PolarHBondContact O-N 3.28Å; T325-V329 VanDerWaalsContact O-N 3.07Å; T325-E350 VanDerWaalsContact CA-OE2 3.25Å; T325-E350 WeakPolarHBondContact CA-OE2 3.39Å; T325-E350 WeakPolarHBondContact CB-OE2 3.27Å
326	K	96.3	Very high	91.6	Very high	94 Å²	94	50.1 Å²	50.1	41%	0.409	30%	0.304	S	S	.	.	H	α-helix	trans	-51	-41.1	174.7	178.3	179	167.7	176.8	0	111.9	M328 V329 E330 E350 T351 H360	K326-M328 VanDerWaalsContact C-N 3.34Å; K326-M328 PolarHBondContact O-N 3.04Å; K326-V329 WeakPolarHBondContact O-CB 3.26Å; K326-V329 PolarHBondContact O-N 2.99Å; K326-E330 VanDerWaalsContact CE-CD 3.42Å; K326-E330 WeakPolarHBondContact CE-OE1 3.3Å; K326-E330 HydrophobicContact CG-CG 4.4Å; K326-E330 IonicContact NZ-OE1 2.67Å; K326-E330 WeakPolarHBondContact O-CG 3.16Å; K326-E330 PolarHBondContact O-N 3.33Å; K326-E350 PolarHBondContact N-OE2 3.27Å; K326-T351 HydrophobicContact CB-CG2 4.18Å; K326-T351 HydrophobicContact CG-CG2 4.06Å; K326-H360 WeakPolarHBondContact CE-NE2 3.41Å
327	A	95.6	Very high	92.9	Very high	68 Å²	68	46.6 Å²	46.6	56%	0.562	28%	0.282	S	S	*	.	H	α-helix	trans	-67.3	-31	178.2	0	0	0	0	0	113.2	T325 S331	T325-A327 PolarHBondContact O-N 2.96Å; A327-S331 WeakPolarHBondContact O-CB 3.36Å; A327-S331 PolarHBondContact O-N 2.91Å
328	M	97.2	Very high	94.2	Very high	13 Å²	13	42.5 Å²	42.5	6%	0.064	24%	0.239	C	C	.	.	H	α-helix	trans	-68.5	-43.7	171.3	-61.5	177.3	-169	0	0	110.7	M296 F299 A300 A303 I324 T325 K326 S331 M332	M296-M328 HydrophobicContact CB-CE 4.09Å; M296-M328 HydrophobicContact CE-CE 3.79Å; M296-M328 WeakPolarHBondContact O-CE 3.43Å; M296-M328 HydrophobicContact SD-CE 3.99Å; F299-M328 HydrophobicContact CB-CE 4.44Å; F299-M328 HydrophobicContact CB-SD 4.07Å; A300-M328 HydrophobicContact CB-CE 4.15Å; A300-M328 HydrophobicContact CB-CG 4.14Å; A300-M328 HydrophobicContact CB-SD 4.5Å; A303-M328 HydrophobicContact CB-CB 4.23Å; I324-M328 HydrophobicContact CD1-SD 4.19Å; I324-M328 HydrophobicContact CG2-CB 4.06Å; T325-M328 HydrophobicContact CG2-CE 4.19Å; T325-M328 WeakPolarHBondContact O-CA 3.43Å; T325-M328 WeakPolarHBondContact O-CB 3.22Å; T325-M328 PolarHBondContact O-N 2.71Å; T325-M328 WeakPolarHBondContact OG1-CG 3.46Å; T325-M328 PolarHBondContact OG1-N 3.29Å; K326-M328 VanDerWaalsContact C-N 3.34Å; K326-M328 PolarHBondContact O-N 3.04Å; M328-S331 PolarHBondContact O-N 3.46Å; M328-S331 VanDerWaalsContact O-N 3.1Å; M328-S331 PolarHBondContact O-OG 2.87Å; M328-M332 PolarHBondContact O-N 2.81Å
329	V	96.4	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-46.6	176.1	178.2	0	0	0	0	111.7	I324 T325 K326 S331 M332 I338 V349 V363 H365	I324-V329 HydrophobicContact CG2-CG2 3.65Å; T325-V329 PolarHBondContact O-N 3.28Å; T325-V329 VanDerWaalsContact O-N 3.07Å; K326-V329 WeakPolarHBondContact O-CB 3.26Å; K326-V329 PolarHBondContact O-N 2.99Å; V329-S331 PolarHBondContact O-N 2.74Å; V329-M332 WeakPolarHBondContact O-CB 3.45Å; V329-M332 PolarHBondContact O-N 3.47Å; V329-I338 HydrophobicContact CG1-CD1 4.23Å; V329-I338 HydrophobicContact CG2-CD1 3.75Å; V329-V349 HydrophobicContact CG2-CG1 3.77Å; V329-V363 HydrophobicContact CG1-CB 4.13Å; V329-V363 HydrophobicContact CG1-CG1 4.34Å; V329-V363 HydrophobicContact CG1-CG2 4.23Å; V329-H365 VanDerWaalsContact CG1-CE1 3.42Å; V329-H365 WeakPolarHBondContact CG1-CE1 3.48Å
330	E	96.5	Very high	95.6	Very high	75 Å²	75	33.2 Å²	33.2	35%	0.35	19%	0.188	S	C	.	.	H	α-helix	trans	-66	-14.2	176.7	-70.2	175.4	150.6	0	0	113.1	K326 H360 H361	K326-E330 VanDerWaalsContact CE-CD 3.42Å; K326-E330 WeakPolarHBondContact CE-OE1 3.3Å; K326-E330 HydrophobicContact CG-CG 4.4Å; K326-E330 IonicContact NZ-OE1 2.67Å; K326-E330 WeakPolarHBondContact O-CG 3.16Å; K326-E330 PolarHBondContact O-N 3.33Å; E330-H360 IonicContact OE1-CE1 3.3Å; E330-H360 PolarHBondContact OE1-CE1 3.41Å; E330-H360 VanDerWaalsContact OE1-CE1 3.3Å; E330-H360 IonicContact OE1-NE2 3.92Å; E330-H361 HydrophobicContact CG-CB 3.96Å
331	S	96.6	Very high	95.9	Very high	39 Å²	39	34.3 Å²	34.3	27%	0.273	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-5.5	173.1	81.5	0	0	0	0	114.7	A327 M328 V329	A327-S331 WeakPolarHBondContact O-CB 3.36Å; A327-S331 PolarHBondContact O-N 2.91Å; M328-S331 PolarHBondContact O-N 3.46Å; M328-S331 VanDerWaalsContact O-N 3.1Å; M328-S331 PolarHBondContact O-OG 2.87Å; V329-S331 PolarHBondContact O-N 2.74Å
332	M	97.1	Very high	96.1	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.039	18%	0.178	C	C	.	.	S	Bend	trans	-74.6	160.8	175.5	-63.7	-159.9	75.6	0	0	111.9	A303 V306 I309 M328 V329 I338 V363	A303-M332 HydrophobicContact CB-CG 4.28Å; V306-M332 HydrophobicContact CG2-CE 4.07Å; I309-M332 HydrophobicContact CD1-CE 3.82Å; I309-M332 HydrophobicContact CD1-SD 3.68Å; I309-M332 HydrophobicContact CG1-CE 3.79Å; I309-M332 HydrophobicContact CG1-SD 4.18Å; M328-M332 PolarHBondContact O-N 2.81Å; V329-M332 WeakPolarHBondContact O-CB 3.45Å; V329-M332 PolarHBondContact O-N 3.47Å; M332-I338 HydrophobicContact SD-CD1 3.88Å; M332-I338 HydrophobicContact SD-CG1 4.01Å; M332-V363 HydrophobicContact CB-CG2 3.92Å; M332-V363 HydrophobicContact SD-CG1 4.27Å
333	R	94.8	Very high	96.1	Very high	93 Å²	93	28.2 Å²	28.2	35%	0.351	16%	0.162	S	C	.	.	P	Polyproline II helix	trans	-73.5	137.9	177.6	-66.7	-176.5	-83.1	148.4	-1.4	110.6	E305 D307 G335 S336	E305-R333 PolarHBondContact O-NH2 2.95Å; D307-R333 IonicContact OD1-CZ 2.68Å; D307-R333 IonicContact OD1-NE 2.83Å; D307-R333 IonicContact OD1-NH1 2.71Å; D307-R333 PolarHBondContact OD1-NH1 3.01Å; D307-R333 IonicContact OD1-NH2 3.02Å; D307-R333 PolarHBondContact OD1-NH2 3.35Å; D307-R333 IonicContact OD2-NH2 3.12Å; D307-R333 PolarHBondContact OD2-NH2 2.64Å; R333-G335 PolarHBondContact O-N 2.98Å; R333-S336 WeakPolarHBondContact O-CB 2.86Å; R333-S336 PolarHBondContact O-N 3.1Å; R333-S336 PolarHBondContact O-OG 3.36Å
334	P	94.8	Very high	95.8	Very high	93 Å²	93	33.9 Å²	33.9	60%	0.604	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	137.8	175.9	-28.5	36	0	0	0	112.6	S336 N362	P334-S336 VanDerWaalsContact C-N 3.31Å; P334-N362 HydrophobicContact CB-CB 4.11Å
335	G	94.4	Very high	95.3	Very high	26 Å²	26	35.1 Å²	35.1	27%	0.268	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	9.6	-172.5	0	0	0	0	0	114.8	F206 R333 N362	F206-G335 WeakPolarHBondContact CD2-O 3.48Å; R333-G335 PolarHBondContact O-N 2.98Å; G335-N362 PolarHBondContact N-O 3.4Å
336	S	97.7	Very high	94.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.209	C	C	.	.			trans	-68.5	160	165.6	-63.1	0	0	0	0	111.4	D307 R333 P334 V363 A364	D307-S336 WeakPolarHBondContact O-CA 3.33Å; D307-S336 WeakPolarHBondContact O-CB 3.27Å; D307-S336 PolarHBondContact O-OG 3.2Å; R333-S336 WeakPolarHBondContact O-CB 2.86Å; R333-S336 PolarHBondContact O-N 3.1Å; R333-S336 PolarHBondContact O-OG 3.36Å; P334-S336 VanDerWaalsContact C-N 3.31Å; S336-V363 WeakPolarHBondContact O-CA 3.45Å; S336-V363 WeakPolarHBondContact O-CG1 3.2Å; S336-A364 PolarHBondContact O-N 3.24Å
337	V	98.3	Very high	94.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.2	-178.7	-172.2	0	0	0	0	111.4	A202 L205 F206 D307 I308 I309 A364 I366	A202-V337 HydrophobicContact CB-CG1 4.07Å; L205-V337 HydrophobicContact CB-CG2 4.28Å; F206-V337 HydrophobicContact CB-CG2 3.92Å; F206-V337 HydrophobicContact CD2-CG2 4.23Å; D307-V337 PolarHBondContact O-N 2.9Å; I308-V337 CarbonylContact C-O 3.24Å; I308-V337 WeakPolarHBondContact CA-O 3.21Å; I308-V337 HydrophobicContact CG1-CB 4.38Å; I308-V337 WeakPolarHBondContact CG2-O 3.46Å; I309-V337 PolarHBondContact N-O 3.14Å; V337-A364 CarbonylContact C-O 3.58Å; V337-A364 WeakPolarHBondContact CA-O 3.39Å; V337-A364 HydrophobicContact CG1-CB 4.25Å; V337-A364 HydrophobicContact CG2-CB 4.25Å; V337-I366 HydrophobicContact CG1-CD1 3.47Å; V337-I366 VanDerWaalsContact CG1-CD1 3.47Å; V337-I366 HydrophobicContact CG1-CG1 4.22Å
338	I	98.2	Very high	94.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.5	174.6	-63.9	-179.1	0	0	0	108.7	I309 V329 M332 V349 V363 A364 I366	I309-I338 HydrophobicContact CB-CG1 4.37Å; I309-I338 CarbonylContact O-C 3.51Å; I309-I338 WeakPolarHBondContact O-CA 3.46Å; V329-I338 HydrophobicContact CG1-CD1 4.23Å; V329-I338 HydrophobicContact CG2-CD1 3.75Å; M332-I338 HydrophobicContact SD-CD1 3.88Å; M332-I338 HydrophobicContact SD-CG1 4.01Å; I338-V349 HydrophobicContact CD1-CG1 4.41Å; I338-V349 HydrophobicContact CG2-CG2 3.68Å; I338-V363 HydrophobicContact CD1-CG1 3.85Å; I338-V363 HydrophobicContact CG1-CG1 3.79Å; I338-A364 PolarHBondContact N-O 3.39Å; I338-I366 PolarHBondContact O-N 2.67Å
339	V	98.2	Very high	94.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115	173.4	-172.6	0	0	0	0	109	G198 A202 I309 I310 T311 L341 I366	G198-V339 WeakPolarHBondContact O-CG2 3.39Å; A202-V339 HydrophobicContact CB-CG2 3.74Å; I309-V339 PolarHBondContact O-N 2.98Å; I310-V339 WeakPolarHBondContact CA-O 3.33Å; I310-V339 HydrophobicContact CB-CB 4.4Å; I310-V339 HydrophobicContact CG1-CB 4.08Å; I310-V339 HydrophobicContact CG1-CG2 4.04Å; I310-V339 HydrophobicContact CG2-CB 4.2Å; I310-V339 HydrophobicContact CG2-CG1 4.49Å; T311-V339 PolarHBondContact N-O 3.41Å; T311-V339 PolarHBondContact OG1-O 2.81Å; V339-L341 HydrophobicContact CG1-CD2 3.52Å; V339-L341 HydrophobicContact CG1-CG 4.08Å; V339-I366 HydrophobicContact CG1-CG2 4.46Å; V339-I366 HydrophobicContact CG2-CD1 3.85Å
340	D	97.5	Very high	94.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	85.5	-178.4	-161	-21.1	0	0	0	110.9	T311 A342 S343 G347 N348 V349 T352 I366	T311-D340 PolarHBondContact OG1-OD1 2.97Å; D340-A342 PolarHBondContact O-N 3.37Å; D340-A342 PolarHBondContact OD1-N 3Å; D340-S343 WeakPolarHBondContact O-CB 3.32Å; D340-S343 PolarHBondContact O-N 3.33Å; D340-S343 VanDerWaalsContact O-N 3.11Å; D340-S343 PolarHBondContact O-OG 3.43Å; D340-S343 PolarHBondContact OD1-N 3.01Å; D340-G347 VanDerWaalsContact OD1-CA 3.29Å; D340-G347 WeakPolarHBondContact OD1-CA 3.47Å; D340-G347 VanDerWaalsContact OD2-C 3.29Å; D340-G347 WeakPolarHBondContact OD2-CA 3.16Å; D340-N348 VanDerWaalsContact CG-N 3.3Å; D340-N348 PolarHBondContact OD1-N 2.64Å; D340-N348 PolarHBondContact OD2-N 2.83Å; D340-V349 PolarHBondContact OD2-N 3.39Å; D340-T352 HydrophobicContact CB-CG2 3.91Å; D340-T352 WeakPolarHBondContact CB-OG1 3.39Å; D340-T352 VanDerWaalsContact OD2-CB 3.28Å; D340-T352 WeakPolarHBondContact OD2-CB 3.49Å; D340-T352 WeakPolarHBondContact OD2-CG2 3.38Å; D340-T352 PolarHBondContact OD2-OG1 2.92Å; D340-I366 PolarHBondContact N-O 2.88Å
341	L	95.7	Very high	94.5	Very high	34 Å²	34	29.5 Å²	29.5	18%	0.178	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.7	-179.7	-53.4	-178.9	0	0	0	112.4	A233 I310 T311 V339 L371	A233-L341 HydrophobicContact CB-CD1 4.08Å; I310-L341 HydrophobicContact CG2-CD1 3.75Å; I310-L341 HydrophobicContact CG2-CG 4.12Å; T311-L341 WeakPolarHBondContact O-CA 3.33Å; T311-L341 VanDerWaalsContact O-CB 3.26Å; T311-L341 WeakPolarHBondContact O-CB 3.45Å; T311-L341 PolarHBondContact O-N 3.37Å; V339-L341 HydrophobicContact CG1-CD2 3.52Å; V339-L341 HydrophobicContact CG1-CG 4.08Å; L341-L371 HydrophobicContact CD2-CD1 3.26Å
342	A	93.9	Very high	94.4	Very high	3 Å²	3	28.2 Å²	28.2	3%	0.025	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.6	174.6	0	0	0	0	0	113.3	A320 D340 E344 A345 G347 N348	A320-A342 HydrophobicContact CB-CB 3.78Å; D340-A342 PolarHBondContact O-N 3.37Å; D340-A342 PolarHBondContact OD1-N 3Å; A342-E344 VanDerWaalsContact C-N 3.27Å; A342-E344 PolarHBondContact O-N 3.26Å; A342-E344 VanDerWaalsContact O-N 3.16Å; A342-A345 WeakPolarHBondContact O-CA 3.31Å; A342-A345 PolarHBondContact O-N 3.32Å; A342-G347 WeakPolarHBondContact O-CA 3.28Å; A342-G347 PolarHBondContact O-N 3.21Å; A342-N348 VanDerWaalsContact CB-OD1 3.29Å; A342-N348 WeakPolarHBondContact CB-OD1 3.22Å
343	S	92.7	Very high	94.3	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.021	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-51.8	-36.1	-176.3	48.2	0	0	0	0	115	D340 A345 G346 P354 G367	D340-S343 WeakPolarHBondContact O-CB 3.32Å; D340-S343 PolarHBondContact O-N 3.33Å; D340-S343 VanDerWaalsContact O-N 3.11Å; D340-S343 PolarHBondContact O-OG 3.43Å; D340-S343 PolarHBondContact OD1-N 3.01Å; S343-A345 VanDerWaalsContact C-N 3.25Å; S343-A345 PolarHBondContact O-N 2.9Å; S343-G346 PolarHBondContact O-N 2.91Å; S343-G346 VanDerWaalsContact O-N 3.11Å; S343-P354 WeakPolarHBondContact O-CG 3.44Å; S343-G367 PolarHBondContact OG-O 3.49Å
344	E	87.3	Confident	94.2	Very high	130 Å²	130	29.5 Å²	29.5	61%	0.607	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-64.9	-28.2	176.8	-172.3	175.3	-150.1	0	0	112.8	A342 G346 T369	A342-E344 VanDerWaalsContact C-N 3.27Å; A342-E344 PolarHBondContact O-N 3.26Å; A342-E344 VanDerWaalsContact O-N 3.16Å; E344-G346 VanDerWaalsContact C-N 3.34Å; E344-T369 HydrophobicContact CB-CG2 3.88Å
345	A	86.2	Confident	94	Very high	27 Å²	27	26.8 Å²	26.8	22%	0.223	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-94.7	16.1	175.8	0	0	0	0	0	113.2	L314 P319 A320 A342 S343	L314-A345 HydrophobicContact CD1-CB 3.45Å; L314-A345 VanDerWaalsContact CD1-CB 3.45Å; P319-A345 WeakPolarHBondContact CA-O 3.42Å; A320-A345 HydrophobicContact CB-CB 4.22Å; A320-A345 PolarHBondContact N-O 3.4Å; A342-A345 WeakPolarHBondContact O-CA 3.31Å; A342-A345 PolarHBondContact O-N 3.32Å; S343-A345 VanDerWaalsContact C-N 3.25Å; S343-A345 PolarHBondContact O-N 2.9Å
346	G	86.5	Confident	94	Very high	39 Å²	39	31.6 Å²	31.6	40%	0.402	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	104	-9.1	-178.9	0	0	0	0	0	114.9	K322 S343 E344	K322-G346 PolarHBondContact NZ-O 3.04Å; S343-G346 PolarHBondContact O-N 2.91Å; S343-G346 VanDerWaalsContact O-N 3.11Å; E344-G346 VanDerWaalsContact C-N 3.34Å
347	G	91.9	Very high	93.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.198	C	C	.	.			trans	77.5	146.1	177.2	0	0	0	0	0	114.9	K322 D340 A342 V349	K322-G347 WeakPolarHBondContact CD-O 3.17Å; K322-G347 WeakPolarHBondContact CE-O 3.42Å; K322-G347 PolarHBondContact NZ-O 3.01Å; D340-G347 VanDerWaalsContact OD1-CA 3.29Å; D340-G347 WeakPolarHBondContact OD1-CA 3.47Å; D340-G347 VanDerWaalsContact OD2-C 3.29Å; D340-G347 WeakPolarHBondContact OD2-CA 3.16Å; A342-G347 WeakPolarHBondContact O-CA 3.28Å; A342-G347 PolarHBondContact O-N 3.21Å; G347-V349 VanDerWaalsContact C-N 3.32Å
348	N	95.7	Very high	93.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-78.5	-14.2	175	-64.1	128	0	0	0	114	T311 A313 P321 K322 L323 I324 D340 A342	T311-N348 WeakPolarHBondContact CB-OD1 3.34Å; T311-N348 HydrophobicContact CG2-CB 4.1Å; A313-N348 PolarHBondContact N-OD1 3.29Å; A313-N348 PolarHBondContact O-ND2 3.1Å; A313-N348 PolarHBondContact O-OD1 3.03Å; P321-N348 VanDerWaalsContact O-CA 3.28Å; P321-N348 WeakPolarHBondContact O-CA 3.39Å; P321-N348 PolarHBondContact O-ND2 3.36Å; K322-N348 CarbonylContact C-O 3.55Å; K322-N348 WeakPolarHBondContact CA-O 3.5Å; L323-N348 PolarHBondContact N-O 3.32Å; I324-N348 PolarHBondContact N-O 3.17Å; D340-N348 VanDerWaalsContact CG-N 3.3Å; D340-N348 PolarHBondContact OD1-N 2.64Å; D340-N348 PolarHBondContact OD2-N 2.83Å; A342-N348 VanDerWaalsContact CB-OD1 3.29Å; A342-N348 WeakPolarHBondContact CB-OD1 3.22Å
349	V	96.3	Very high	93.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-106.7	138.9	-177.4	-173.8	0	0	0	0	110.4	T311 K322 I324 V329 I338 D340 G347 T351 T352	T311-V349 HydrophobicContact CG2-CG2 4.22Å; K322-V349 PolarHBondContact NZ-O 2.8Å; I324-V349 HydrophobicContact CB-CB 4.21Å; I324-V349 HydrophobicContact CB-CG1 3.99Å; I324-V349 HydrophobicContact CB-CG2 3.77Å; I324-V349 HydrophobicContact CG1-CG2 4.09Å; I324-V349 HydrophobicContact CG2-CG1 3.9Å; I324-V349 HydrophobicContact CG2-CG2 4.33Å; I324-V349 WeakPolarHBondContact O-CA 3.38Å; V329-V349 HydrophobicContact CG2-CG1 3.77Å; I338-V349 HydrophobicContact CD1-CG1 4.41Å; I338-V349 HydrophobicContact CG2-CG2 3.68Å; D340-V349 PolarHBondContact OD2-N 3.39Å; G347-V349 VanDerWaalsContact C-N 3.32Å; V349-T351 VanDerWaalsContact C-N 3.29Å; V349-T351 PolarHBondContact O-N 2.8Å; V349-T352 PolarHBondContact O-N 3.38Å
350	E	95.4	Very high	93.5	Very high	99 Å²	99	44.9 Å²	44.9	46%	0.463	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.5	-178.4	-73.8	-179.6	168.8	0	0	113.3	K322 I324 T325 K326	K322-E350 HydrophobicContact CB-CG 4.36Å; K322-E350 HydrophobicContact CD-CG 4.25Å; K322-E350 HydrophobicContact CG-CG 4.37Å; I324-E350 PolarHBondContact O-N 2.89Å; T325-E350 VanDerWaalsContact CA-OE2 3.25Å; T325-E350 WeakPolarHBondContact CA-OE2 3.39Å; T325-E350 WeakPolarHBondContact CB-OE2 3.27Å; K326-E350 PolarHBondContact N-OE2 3.27Å
351	T	95.5	Very high	93.3	Very high	23 Å²	23	49.9 Å²	49.9	14%	0.141	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	2.5	-177.2	41.7	0	0	0	0	114.3	K326 V349 H360 H365	K326-T351 HydrophobicContact CB-CG2 4.18Å; K326-T351 HydrophobicContact CG-CG2 4.06Å; V349-T351 VanDerWaalsContact C-N 3.29Å; V349-T351 PolarHBondContact O-N 2.8Å; T351-H360 HydrophobicContact CG2-CB 4.4Å; T351-H365 PolarHBondContact OG1-CD2 3.03Å; T351-H365 PolarHBondContact OG1-NE2 3.42Å
352	T	95	Very high	93.2	Very high	12 Å²	12	53.9 Å²	53.9	7%	0.074	29%	0.289	C	S	.	.			trans	-67.8	129.8	172.7	-72.1	0	0	0	0	111	D340 V349	D340-T352 HydrophobicContact CB-CG2 3.91Å; D340-T352 WeakPolarHBondContact CB-OG1 3.39Å; D340-T352 VanDerWaalsContact OD2-CB 3.28Å; D340-T352 WeakPolarHBondContact OD2-CB 3.49Å; D340-T352 WeakPolarHBondContact OD2-CG2 3.38Å; D340-T352 PolarHBondContact OD2-OG1 2.92Å; V349-T352 PolarHBondContact O-N 3.38Å
353	V	94.9	Very high	93.4	Very high	62 Å²	62	53.7 Å²	53.7	38%	0.376	29%	0.288	S	S	.	.			trans	-105.4	109.7	166.2	-176.8	0	0	0	0	109	K356 T358	V353-K356 HydrophobicContact CG1-CB 4.4Å; V353-K356 HydrophobicContact CG1-CD 3.96Å; V353-K356 HydrophobicContact CG1-CG 4.41Å; V353-K356 PolarHBondContact O-N 2.88Å; V353-T358 HydrophobicContact CB-CG2 3.92Å; V353-T358 HydrophobicContact CG2-CG2 3.99Å
354	P	92.7	Very high	93.6	Very high	66 Å²	66	53.8 Å²	53.8	43%	0.429	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	141.9	-177.4	-28.3	36.4	0	0	0	113.9	S343 K356 G367 T369	S343-P354 WeakPolarHBondContact O-CG 3.44Å; P354-K356 VanDerWaalsContact C-N 3.25Å; P354-K356 PolarHBondContact O-N 3.11Å; P354-G367 CarbonylContact C-O 3.55Å; P354-T369 HydrophobicContact CB-CG2 4.19Å
355	G	90.6	Very high	94.1	Very high	36 Å²	36	47.6 Å²	47.6	37%	0.371	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-2.7	-177.2	0	0	0	0	0	115.1	G367	G355-G367 PolarHBondContact N-O 3.15Å
356	K	93	Very high	94.6	Very high	128 Å²	128	46.4 Å²	46.4	56%	0.557	25%	0.25	S	C	*	.	S	Bend	trans	-126.3	152.2	-171.3	-62	-174.3	-176	176.7	0	113.3	V353 P354 T358 G367	V353-K356 HydrophobicContact CG1-CB 4.4Å; V353-K356 HydrophobicContact CG1-CD 3.96Å; V353-K356 HydrophobicContact CG1-CG 4.41Å; V353-K356 PolarHBondContact O-N 2.88Å; P354-K356 VanDerWaalsContact C-N 3.25Å; P354-K356 PolarHBondContact O-N 3.11Å; K356-T358 HydrophobicContact CB-CG2 4.1Å; K356-G367 WeakPolarHBondContact O-CA 3.4Å; K356-G367 PolarHBondContact O-N 3.19Å
357	L	95.8	Very high	95.1	Very high	53 Å²	53	44.5 Å²	44.5	28%	0.277	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.8	156	173.6	61.5	0	0	0	107.3	L205 Y359 A364 H365 I366 Y368	L205-L357 HydrophobicContact CD1-CD1 3.75Å; L205-L357 HydrophobicContact CD1-CD2 3.89Å; L205-L357 HydrophobicContact CD2-CD2 4.17Å; L357-Y359 HydrophobicContact CD2-CE2 4.41Å; L357-Y359 HydrophobicContact CG-CE2 4.24Å; L357-A364 HydrophobicContact CD1-CB 4.42Å; L357-H365 WeakPolarHBondContact CA-O 3.43Å; L357-I366 HydrophobicContact CD1-CG1 4.08Å; L357-Y368 HydrophobicContact CB-CE1 4.05Å
358	T	96.6	Very high	95.2	Very high	33 Å²	33	46.2 Å²	46.2	20%	0.202	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	164.8	177.1	51.3	0	0	0	0	110.7	V353 K356 H365	V353-T358 HydrophobicContact CB-CG2 3.92Å; V353-T358 HydrophobicContact CG2-CG2 3.99Å; K356-T358 HydrophobicContact CB-CG2 4.1Å; T358-H365 PolarHBondContact N-O 2.78Å; T358-H365 PolarHBondContact O-N 2.92Å
359	Y	95.9	Very high	95	Very high	147 Å²	147	49 Å²	49	58%	0.576	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.1	176.8	-68.1	-93.1	0	0	0	109.1	L357 V363 A364	L357-Y359 HydrophobicContact CD2-CE2 4.41Å; L357-Y359 HydrophobicContact CG-CE2 4.24Å; Y359-V363 WeakPolarHBondContact CA-O 3.4Å; Y359-A364 HydrophobicContact CD1-CB 4Å; Y359-A364 HydrophobicContact CE1-CB 3.59Å
360	H	94.5	Very high	94.8	Very high	47 Å²	47	50.7 Å²	50.7	22%	0.218	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125.6	175.6	-175.6	-83.4	0	0	0	108.4	K326 E330 T351 N362 V363	K326-H360 WeakPolarHBondContact CE-NE2 3.41Å; E330-H360 IonicContact OE1-CE1 3.3Å; E330-H360 PolarHBondContact OE1-CE1 3.41Å; E330-H360 VanDerWaalsContact OE1-CE1 3.3Å; E330-H360 IonicContact OE1-NE2 3.92Å; T351-H360 HydrophobicContact CG2-CB 4.4Å; H360-N362 PolarHBondContact O-N 3.34Å; H360-V363 PolarHBondContact N-O 2.79Å; H360-V363 WeakPolarHBondContact O-CB 3.45Å; H360-V363 PolarHBondContact O-N 3.15Å
361	H	93.5	Very high	94.8	Very high	106 Å²	106	46.2 Å²	46.2	49%	0.491	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	41.5	-175.3	-150.9	95.5	0	0	0	114	E330 V363	E330-H361 HydrophobicContact CG-CB 3.96Å; H361-V363 PolarHBondContact O-N 2.65Å; H361-V363 VanDerWaalsContact O-N 3.16Å
362	N	94.1	Very high	94.7	Very high	117 Å²	117	45.8 Å²	45.8	63%	0.626	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	18.1	-174.1	-58.1	-37.5	0	0	0	115.5	P334 G335 H360	P334-N362 HydrophobicContact CB-CB 4.11Å; G335-N362 PolarHBondContact N-O 3.4Å; H360-N362 PolarHBondContact O-N 3.34Å
363	V	97.1	Very high	94.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.1	169.5	-177.6	0	0	0	0	109	V329 M332 S336 I338 Y359 H360 H361 H365	V329-V363 HydrophobicContact CG1-CB 4.13Å; V329-V363 HydrophobicContact CG1-CG1 4.34Å; V329-V363 HydrophobicContact CG1-CG2 4.23Å; M332-V363 HydrophobicContact CB-CG2 3.92Å; M332-V363 HydrophobicContact SD-CG1 4.27Å; S336-V363 WeakPolarHBondContact O-CA 3.45Å; S336-V363 WeakPolarHBondContact O-CG1 3.2Å; I338-V363 HydrophobicContact CD1-CG1 3.85Å; I338-V363 HydrophobicContact CG1-CG1 3.79Å; Y359-V363 WeakPolarHBondContact CA-O 3.4Å; H360-V363 PolarHBondContact N-O 2.79Å; H360-V363 WeakPolarHBondContact O-CB 3.45Å; H360-V363 PolarHBondContact O-N 3.15Å; H361-V363 PolarHBondContact O-N 2.65Å; H361-V363 VanDerWaalsContact O-N 3.16Å; V363-H365 PolarHBondContact O-CE1 3.19Å; V363-H365 PolarHBondContact O-ND1 3.27Å
364	A	97.3	Very high	94.7	Very high	5 Å²	5	45.9 Å²	45.9	4%	0.041	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.3	177.9	0	0	0	0	0	110.6	S336 V337 I338 L357 Y359	S336-A364 PolarHBondContact O-N 3.24Å; V337-A364 CarbonylContact C-O 3.58Å; V337-A364 WeakPolarHBondContact CA-O 3.39Å; V337-A364 HydrophobicContact CG1-CB 4.25Å; V337-A364 HydrophobicContact CG2-CB 4.25Å; I338-A364 PolarHBondContact N-O 3.39Å; L357-A364 HydrophobicContact CD1-CB 4.42Å; Y359-A364 HydrophobicContact CD1-CB 4Å; Y359-A364 HydrophobicContact CE1-CB 3.59Å
365	H	97.4	Very high	94.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	105.1	-178.8	-69.7	61	0	0	0	110	V329 T351 L357 T358 V363 G367	V329-H365 VanDerWaalsContact CG1-CE1 3.42Å; V329-H365 WeakPolarHBondContact CG1-CE1 3.48Å; T351-H365 PolarHBondContact OG1-CD2 3.03Å; T351-H365 PolarHBondContact OG1-NE2 3.42Å; L357-H365 WeakPolarHBondContact CA-O 3.43Å; T358-H365 PolarHBondContact N-O 2.78Å; T358-H365 PolarHBondContact O-N 2.92Å; V363-H365 PolarHBondContact O-CE1 3.19Å; V363-H365 PolarHBondContact O-ND1 3.27Å; H365-G367 PolarHBondContact O-N 3.15Å
366	I	97.1	Very high	95.1	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	88.6	175.9	-59.4	157.3	0	0	0	107.8	E201 A202 L205 V337 I338 V339 D340 L357 Y368	E201-I366 HydrophobicContact CB-CD1 4.02Å; E201-I366 HydrophobicContact CB-CG2 4.36Å; A202-I366 HydrophobicContact CB-CD1 4.32Å; L205-I366 HydrophobicContact CD1-CD1 3.9Å; L205-I366 HydrophobicContact CD1-CG1 3.79Å; V337-I366 HydrophobicContact CG1-CD1 3.47Å; V337-I366 VanDerWaalsContact CG1-CD1 3.47Å; V337-I366 HydrophobicContact CG1-CG1 4.22Å; I338-I366 PolarHBondContact O-N 2.67Å; V339-I366 HydrophobicContact CG1-CG2 4.46Å; V339-I366 HydrophobicContact CG2-CD1 3.85Å; D340-I366 PolarHBondContact N-O 2.88Å; L357-I366 HydrophobicContact CD1-CG1 4.08Å; I366-Y368 VanDerWaalsContact C-N 3.34Å; I366-Y368 HydrophobicContact CG2-CD2 3.47Å; I366-Y368 VanDerWaalsContact CG2-CD2 3.47Å; I366-Y368 HydrophobicContact CG2-CE2 3.94Å; I366-Y368 HydrophobicContact CG2-CG 4.06Å
367	G	95.9	Very high	95.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.			trans	-93.1	25.8	177.2	0	0	0	0	0	114	S343 P354 G355 K356 H365 T369	S343-G367 PolarHBondContact OG-O 3.49Å; P354-G367 CarbonylContact C-O 3.55Å; G355-G367 PolarHBondContact N-O 3.15Å; K356-G367 WeakPolarHBondContact O-CA 3.4Å; K356-G367 PolarHBondContact O-N 3.19Å; H365-G367 PolarHBondContact O-N 3.15Å; G367-T369 PolarHBondContact O-N 3.36Å
368	Y	94.8	Very high	95.2	Very high	36 Å²	36	41.6 Å²	41.6	14%	0.141	21%	0.207	C	C	.	.			trans	-67.7	121.9	-174.2	-65.8	-34.8	0	0	0	112.7	L357 I366 D370 L371 R374	L357-Y368 HydrophobicContact CB-CE1 4.05Å; I366-Y368 VanDerWaalsContact C-N 3.34Å; I366-Y368 HydrophobicContact CG2-CD2 3.47Å; I366-Y368 VanDerWaalsContact CG2-CD2 3.47Å; I366-Y368 HydrophobicContact CG2-CE2 3.94Å; I366-Y368 HydrophobicContact CG2-CG 4.06Å; Y368-D370 VanDerWaalsContact C-N 3.33Å; Y368-L371 HydrophobicContact CD2-CD2 4.28Å; Y368-R374 VanDerWaalsContact CZ-NH1 3.26Å
369	T	92	Very high	95.3	Very high	59 Å²	59	40 Å²	40	36%	0.362	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.7	176.8	52.9	0	0	0	0	113.6	E344 P354 G367	E344-T369 HydrophobicContact CB-CG2 3.88Å; P354-T369 HydrophobicContact CB-CG2 4.19Å; G367-T369 PolarHBondContact O-N 3.36Å
370	D	92.1	Very high	95.3	Very high	34 Å²	34	33 Å²	33	18%	0.182	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	21.1	-172.2	67.5	-25.1	0	0	0	113.3	Y368 S373 R374	Y368-D370 VanDerWaalsContact C-N 3.33Å; D370-S373 WeakPolarHBondContact O-CA 3.44Å; D370-S373 WeakPolarHBondContact O-CB 3.13Å; D370-S373 PolarHBondContact O-N 3.02Å; D370-R374 VanDerWaalsContact CG-NH2 3.35Å; D370-R374 PolarHBondContact O-N 3.01Å; D370-R374 IonicContact OD1-CZ 3.92Å; D370-R374 VanDerWaalsContact OD1-CZ 3.27Å; D370-R374 IonicContact OD1-NE 3.5Å; D370-R374 PolarHBondContact OD1-NE 3.11Å; D370-R374 IonicContact OD1-NH2 2.78Å; D370-R374 PolarHBondContact OD1-NH2 2.71Å; D370-R374 IonicContact OD2-CZ 3.53Å; D370-R374 IonicContact OD2-NE 2.78Å; D370-R374 PolarHBondContact OD2-NE 3.4Å; D370-R374 IonicContact OD2-NH2 3.99Å; D370-R374 PolarHBondContact OD2-NH2 3.02Å
371	L	94.4	Very high	95.4	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-50.6	-41.8	-173	-72.3	167.2	0	0	0	115.2	K197 E201 L341 Y368 S373 R374	K197-L371 HydrophobicContact CG-CD2 4.27Å; E201-L371 HydrophobicContact CG-CD2 4.13Å; L341-L371 HydrophobicContact CD2-CD1 3.26Å; Y368-L371 HydrophobicContact CD2-CD2 4.28Å; L371-S373 VanDerWaalsContact C-N 3.31Å; L371-S373 PolarHBondContact O-N 3.27Å; L371-R374 WeakPolarHBondContact O-CB 3.33Å; L371-R374 PolarHBondContact O-N 3.26Å
372	P	94.6	Very high	95.5	Very high	14 Å²	14	29.9 Å²	29.9	9%	0.091	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-64.9	-30.7	173.4	-23.5	35.6	0	0	0	114	M190 I193 S194 R374 L375 A379	M190-P372 HydrophobicContact CB-CG 4.21Å; M190-P372 HydrophobicContact SD-CB 3.78Å; M190-P372 HydrophobicContact SD-CG 4.32Å; I193-P372 HydrophobicContact CG2-CB 4.34Å; S194-P372 WeakPolarHBondContact OG-CD 3.27Å; S194-P372 WeakPolarHBondContact OG-CG 3.39Å; P372-R374 PolarHBondContact O-N 3.35Å; P372-L375 CarbonylContact O-C 3.59Å; P372-L375 PolarHBondContact O-N 2.75Å; P372-A379 HydrophobicContact CB-CB 4.17Å; P372-A379 WeakPolarHBondContact O-CB 3.22Å
373	S	95	Very high	95.7	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.021	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-68.4	-18.9	173	-163.2	0	0	0	0	112.2	N59 K61 D370 L371 L375 P376	N59-S373 PolarHBondContact O-OG 3.19Å; K61-S373 WeakPolarHBondContact CB-OG 3.39Å; K61-S373 PolarHBondContact N-OG 3.11Å; D370-S373 WeakPolarHBondContact O-CA 3.44Å; D370-S373 WeakPolarHBondContact O-CB 3.13Å; D370-S373 PolarHBondContact O-N 3.02Å; L371-S373 VanDerWaalsContact C-N 3.31Å; L371-S373 PolarHBondContact O-N 3.27Å; S373-L375 VanDerWaalsContact C-N 3.34Å; S373-P376 WeakPolarHBondContact O-CD 3.41Å
374	R	94.7	Very high	95.7	Very high	73 Å²	73	24.3 Å²	24.3	28%	0.275	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	-85.5	-1.5	173.7	-56.6	179.5	-176.7	-103	-20.3	113.8	K197 Y368 D370 L371 P372	K197-R374 WeakPolarHBondContact CE-O 3.49Å; K197-R374 HydrophobicContact CG-CB 4.32Å; Y368-R374 VanDerWaalsContact CZ-NH1 3.26Å; D370-R374 VanDerWaalsContact CG-NH2 3.35Å; D370-R374 PolarHBondContact O-N 3.01Å; D370-R374 IonicContact OD1-CZ 3.92Å; D370-R374 VanDerWaalsContact OD1-CZ 3.27Å; D370-R374 IonicContact OD1-NE 3.5Å; D370-R374 PolarHBondContact OD1-NE 3.11Å; D370-R374 IonicContact OD1-NH2 2.78Å; D370-R374 PolarHBondContact OD1-NH2 2.71Å; D370-R374 IonicContact OD2-CZ 3.53Å; D370-R374 IonicContact OD2-NE 2.78Å; D370-R374 PolarHBondContact OD2-NE 3.4Å; D370-R374 IonicContact OD2-NH2 3.99Å; D370-R374 PolarHBondContact OD2-NH2 3.02Å; L371-R374 WeakPolarHBondContact O-CB 3.33Å; L371-R374 PolarHBondContact O-N 3.26Å; P372-R374 PolarHBondContact O-N 3.35Å
375	L	95.6	Very high	95.6	Very high	53 Å²	53	26.5 Å²	26.5	28%	0.277	14%	0.141	S	C	.	.	S	Bend	trans	-133.3	55.2	168.2	-162	72.8	0	0	0	110.3	I193 Y196 P372 S373 G377 Q378 A379	I193-L375 HydrophobicContact CG2-CB 4.07Å; I193-L375 HydrophobicContact CG2-CD2 4.06Å; Y196-L375 HydrophobicContact CD1-CD2 4.06Å; Y196-L375 HydrophobicContact CE1-CD2 4.14Å; P372-L375 CarbonylContact O-C 3.59Å; P372-L375 PolarHBondContact O-N 2.75Å; S373-L375 VanDerWaalsContact C-N 3.34Å; L375-G377 PolarHBondContact O-N 2.85Å; L375-Q378 HydrophobicContact CD2-CB 3.97Å; L375-Q378 HydrophobicContact CD2-CG 4.34Å; L375-Q378 HydrophobicContact CG-CB 4.07Å; L375-Q378 PolarHBondContact O-N 3.12Å; L375-A379 PolarHBondContact O-N 3.44Å
376	P	95.9	Very high	95.5	Very high	25 Å²	25	27 Å²	27	16%	0.162	14%	0.143	C	C	.	.	H	α-helix	trans	-68.1	-39.3	-154.9	26.6	-34	0	0	0	113.5	K61 R62 N89 S373 Q378 A379 S380	K61-P376 HydrophobicContact CB-CB 3.73Å; K61-P376 HydrophobicContact CB-CG 4.13Å; R62-P376 HydrophobicContact CG-CB 4.33Å; N89-P376 VanDerWaalsContact O-CG 3.26Å; N89-P376 WeakPolarHBondContact O-CG 3.34Å; S373-P376 WeakPolarHBondContact O-CD 3.41Å; P376-Q378 PolarHBondContact O-N 3.01Å; P376-A379 PolarHBondContact O-N 3.02Å; P376-S380 VanDerWaalsContact O-CB 3.26Å; P376-S380 WeakPolarHBondContact O-CB 3.49Å; P376-S380 PolarHBondContact O-N 3.28Å; P376-S380 PolarHBondContact O-OG 2.9Å
377	G	95.6	Very high	95.5	Very high	19 Å²	19	27 Å²	27	20%	0.196	14%	0.144	C	C	.	.	H	α-helix	trans	-59.3	-44	177.8	0	0	0	0	0	113.4	S90 L375 T381	S90-G377 WeakPolarHBondContact O-CA 3.46Å; L375-G377 PolarHBondContact O-N 2.85Å; G377-T381 WeakPolarHBondContact O-CB 3.34Å; G377-T381 PolarHBondContact O-N 3.1Å; G377-T381 PolarHBondContact O-OG1 3.45Å
378	Q	96.2	Very high	95.4	Very high	97 Å²	97	27 Å²	27	45%	0.453	14%	0.144	S	C	.	.	H	α-helix	trans	-71.4	-39.4	177.4	-170.6	62.5	54	0	0	111.7	I193 L375 P376 T381 L382	I193-Q378 HydrophobicContact CD1-CG 4.16Å; L375-Q378 HydrophobicContact CD2-CB 3.97Å; L375-Q378 HydrophobicContact CD2-CG 4.34Å; L375-Q378 HydrophobicContact CG-CB 4.07Å; L375-Q378 PolarHBondContact O-N 3.12Å; P376-Q378 PolarHBondContact O-N 3.01Å; Q378-T381 PolarHBondContact O-N 2.92Å; Q378-L382 PolarHBondContact O-N 3.11Å
379	A	96.8	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.8	-45	178.9	0	0	0	0	0	112.2	R62 M190 I193 P372 L375 P376 L382 F383	R62-A379 HydrophobicContact CG-CB 3.89Å; M190-A379 HydrophobicContact CE-CB 4.23Å; M190-A379 WeakPolarHBondContact CE-O 3.23Å; M190-A379 HydrophobicContact SD-CB 4.1Å; I193-A379 HydrophobicContact CD1-CB 3.75Å; P372-A379 HydrophobicContact CB-CB 4.17Å; P372-A379 WeakPolarHBondContact O-CB 3.22Å; L375-A379 PolarHBondContact O-N 3.44Å; P376-A379 PolarHBondContact O-N 3.02Å; A379-L382 PolarHBondContact O-N 2.65Å; A379-F383 WeakPolarHBondContact O-CB 3.43Å; A379-F383 PolarHBondContact O-N 2.82Å
380	S	97.6	Very high	95.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-56.3	-49.3	169.7	-61.7	0	0	0	0	110.6	R62 V63 S90 P376 L382 F383 S384	R62-S380 VanDerWaalsContact CA-OG 3.23Å; R62-S380 WeakPolarHBondContact CA-OG 3.37Å; V63-S380 PolarHBondContact N-OG 3.06Å; V63-S380 WeakPolarHBondContact O-CB 3.43Å; V63-S380 PolarHBondContact O-OG 3.16Å; S90-S380 PolarHBondContact OG-OG 3.46Å; P376-S380 VanDerWaalsContact O-CB 3.26Å; P376-S380 WeakPolarHBondContact O-CB 3.49Å; P376-S380 PolarHBondContact O-N 3.28Å; P376-S380 PolarHBondContact O-OG 2.9Å; S380-L382 PolarHBondContact O-N 2.67Å; S380-F383 PolarHBondContact O-N 3.23Å; S380-S384 WeakPolarHBondContact O-CA 3.41Å; S380-S384 WeakPolarHBondContact O-CB 3.34Å; S380-S384 PolarHBondContact O-N 2.9Å
381	T	96.3	Very high	95.6	Very high	41 Å²	41	24.3 Å²	24.3	25%	0.252	13%	0.129	S	C	.	.	H	α-helix	trans	-58.6	-46.4	-179.5	-56.2	0	0	0	0	113	G377 Q378 N385	G377-T381 WeakPolarHBondContact O-CB 3.34Å; G377-T381 PolarHBondContact O-N 3.1Å; G377-T381 PolarHBondContact O-OG1 3.45Å; Q378-T381 PolarHBondContact O-N 2.92Å; T381-N385 WeakPolarHBondContact O-CB 3.34Å; T381-N385 PolarHBondContact O-N 3.48Å; T381-N385 PolarHBondContact O-ND2 3.47Å; T381-N385 PolarHBondContact O-OD1 3.06Å
382	L	95	Very high	95.5	Very high	45 Å²	45	25.9 Å²	25.9	24%	0.236	14%	0.138	C	C	.	.	H	α-helix	trans	-68.9	-48.3	178.4	-64.3	-168.9	0	0	0	112.1	I193 Q378 A379 S380 S384 N385 N386	I193-L382 HydrophobicContact CD1-CD1 3.96Å; I193-L382 HydrophobicContact CD1-CG 4.43Å; I193-L382 HydrophobicContact CG1-CD1 4.32Å; Q378-L382 PolarHBondContact O-N 3.11Å; A379-L382 PolarHBondContact O-N 2.65Å; S380-L382 PolarHBondContact O-N 2.67Å; L382-S384 VanDerWaalsContact C-N 3.3Å; L382-S384 PolarHBondContact O-N 3.24Å; L382-N385 PolarHBondContact O-N 3.03Å; L382-N385 VanDerWaalsContact O-N 3.1Å; L382-N386 VanDerWaalsContact O-CG 3.31Å; L382-N386 PolarHBondContact O-N 2.88Å; L382-N386 PolarHBondContact O-OD1 3.44Å
383	F	97.6	Very high	95.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.4	-45.6	178.8	-172.7	-83	0	0	0	111.5	I122 L149 L172 V186 M190 A379 S380 N385 N386 V387	I122-F383 HydrophobicContact CB-CE1 4.33Å; I122-F383 HydrophobicContact CB-CZ 4.14Å; I122-F383 HydrophobicContact CG1-CD1 3.99Å; I122-F383 HydrophobicContact CG1-CE1 3.71Å; I122-F383 HydrophobicContact CG1-CZ 4.01Å; I122-F383 HydrophobicContact CG2-CE2 4.09Å; I122-F383 HydrophobicContact CG2-CZ 4.16Å; L149-F383 HydrophobicContact CD1-CE2 4.46Å; L149-F383 HydrophobicContact CG-CE2 4.49Å; L172-F383 HydrophobicContact CD1-CE1 4.11Å; L172-F383 HydrophobicContact CD1-CE2 4.14Å; L172-F383 HydrophobicContact CD1-CZ 3.45Å; L172-F383 VanDerWaalsContact CD1-CZ 3.45Å; V186-F383 HydrophobicContact CB-CD2 3.79Å; V186-F383 HydrophobicContact CB-CE2 3.84Å; V186-F383 HydrophobicContact CG1-CD2 3.62Å; V186-F383 HydrophobicContact CG1-CE2 3.7Å; V186-F383 HydrophobicContact CG1-CG 4.19Å; V186-F383 HydrophobicContact CG1-CZ 4.32Å; V186-F383 HydrophobicContact CG2-CE2 4.18Å; M190-F383 HydrophobicContact CE-CB 4.03Å; A379-F383 WeakPolarHBondContact O-CB 3.43Å; A379-F383 PolarHBondContact O-N 2.82Å; S380-F383 PolarHBondContact O-N 3.23Å; F383-N385 VanDerWaalsContact C-N 3.35Å; F383-N385 PolarHBondContact O-N 2.55Å; F383-N386 WeakPolarHBondContact O-CB 3.26Å; F383-N386 PolarHBondContact O-N 3.46Å; F383-V387 HydrophobicContact CD1-CG2 3.91Å; F383-V387 HydrophobicContact CE1-CG2 3.58Å; F383-V387 HydrophobicContact CZ-CG2 4.15Å; F383-V387 WeakPolarHBondContact O-CG2 3.36Å; F383-V387 PolarHBondContact O-N 2.94Å
384	S	97.2	Very high	95.1	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.3	-43.3	174.8	-179.3	0	0	0	0	112.4	S64 V65 T66 T69 S380 L382 A388	S64-S384 WeakPolarHBondContact O-CA 3.33Å; V65-S384 WeakPolarHBondContact CA-OG 3.28Å; T66-S384 PolarHBondContact N-OG 3.16Å; T66-S384 PolarHBondContact OG1-OG 2.85Å; T69-S384 WeakPolarHBondContact CG2-OG 3.47Å; T69-S384 PolarHBondContact OG1-OG 2.82Å; S380-S384 WeakPolarHBondContact O-CA 3.41Å; S380-S384 WeakPolarHBondContact O-CB 3.34Å; S380-S384 PolarHBondContact O-N 2.9Å; L382-S384 VanDerWaalsContact C-N 3.3Å; L382-S384 PolarHBondContact O-N 3.24Å; S384-A388 VanDerWaalsContact O-CB 3.26Å; S384-A388 WeakPolarHBondContact O-CB 3.38Å; S384-A388 PolarHBondContact O-N 2.92Å
385	N	95.5	Very high	94.8	Very high	52 Å²	52	25.5 Å²	25.5	28%	0.278	14%	0.144	S	C	.	.	H	α-helix	trans	-68.4	-41	175.5	-71.5	-9.8	0	0	0	111.8	T69 T381 L382 F383 A388 N389	T69-N385 VanDerWaalsContact CG2-OD1 3.23Å; T69-N385 WeakPolarHBondContact CG2-OD1 3.25Å; T381-N385 WeakPolarHBondContact O-CB 3.34Å; T381-N385 PolarHBondContact O-N 3.48Å; T381-N385 PolarHBondContact O-ND2 3.47Å; T381-N385 PolarHBondContact O-OD1 3.06Å; L382-N385 PolarHBondContact O-N 3.03Å; L382-N385 VanDerWaalsContact O-N 3.1Å; F383-N385 VanDerWaalsContact C-N 3.35Å; F383-N385 PolarHBondContact O-N 2.55Å; N385-A388 PolarHBondContact O-N 2.85Å; N385-N389 WeakPolarHBondContact O-CB 3.41Å; N385-N389 PolarHBondContact O-N 3.44Å; N385-N389 PolarHBondContact O-ND2 2.88Å
386	N	96.3	Very high	94.3	Very high	10 Å²	10	23.1 Å²	23.1	5%	0.053	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-49.3	175.4	-62.3	128.9	0	0	0	111.4	S183 V186 S189 L382 F383 N389 Y390	S183-N386 WeakPolarHBondContact O-CA 3.33Å; S183-N386 PolarHBondContact O-ND2 3.17Å; V186-N386 HydrophobicContact CG1-CB 3.55Å; S189-N386 WeakPolarHBondContact CB-OD1 3.43Å; S189-N386 PolarHBondContact OG-OD1 3.21Å; L382-N386 VanDerWaalsContact O-CG 3.31Å; L382-N386 PolarHBondContact O-N 2.88Å; L382-N386 PolarHBondContact O-OD1 3.44Å; F383-N386 WeakPolarHBondContact O-CB 3.26Å; F383-N386 PolarHBondContact O-N 3.46Å; N386-N389 PolarHBondContact O-N 2.95Å; N386-Y390 VanDerWaalsContact O-CB 3.25Å; N386-Y390 WeakPolarHBondContact O-CB 3.21Å; N386-Y390 PolarHBondContact O-N 3.25Å
387	V	96.4	Very high	93.3	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-66	-38.5	-180	173.4	0	0	0	0	111.6	L120 L172 V186 F383 Y390 L391	L120-V387 HydrophobicContact CD1-CG1 3.98Å; L120-V387 HydrophobicContact CD2-CG1 3.93Å; L120-V387 HydrophobicContact CG-CG1 4.38Å; L172-V387 HydrophobicContact CD1-CG2 3.69Å; L172-V387 HydrophobicContact CD2-CG2 4.19Å; V186-V387 HydrophobicContact CG1-CG2 4.4Å; F383-V387 HydrophobicContact CD1-CG2 3.91Å; F383-V387 HydrophobicContact CE1-CG2 3.58Å; F383-V387 HydrophobicContact CZ-CG2 4.15Å; F383-V387 WeakPolarHBondContact O-CG2 3.36Å; F383-V387 PolarHBondContact O-N 2.94Å; V387-Y390 PolarHBondContact O-N 2.85Å; V387-L391 WeakPolarHBondContact O-CB 3.37Å; V387-L391 PolarHBondContact O-N 2.65Å
388	A	95	Very high	92.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-46.7	175.4	0	0	0	0	0	112.5	T69 L72 F73 S384 N385 Y390 L391 L392	T69-A388 HydrophobicContact CG2-CB 3.88Å; L72-A388 HydrophobicContact CD2-CB 4.38Å; F73-A388 HydrophobicContact CE1-CB 3.83Å; F73-A388 HydrophobicContact CE2-CB 4.43Å; F73-A388 HydrophobicContact CZ-CB 3.6Å; S384-A388 VanDerWaalsContact O-CB 3.26Å; S384-A388 WeakPolarHBondContact O-CB 3.38Å; S384-A388 PolarHBondContact O-N 2.92Å; N385-A388 PolarHBondContact O-N 2.85Å; A388-Y390 VanDerWaalsContact C-N 3.28Å; A388-Y390 PolarHBondContact O-N 2.86Å; A388-L391 PolarHBondContact O-N 3.14Å; A388-L392 WeakPolarHBondContact O-CB 3.4Å; A388-L392 VanDerWaalsContact O-CG 3.28Å; A388-L392 WeakPolarHBondContact O-CG 3.33Å; A388-L392 PolarHBondContact O-N 3.45Å
389	N	93.1	Very high	91.6	Very high	72 Å²	72	28 Å²	28	39%	0.385	19%	0.186	S	C	.	.	H	α-helix	trans	-58.5	-42.6	174.4	-71.1	-24.2	0	0	0	111.3	S183 F184 N385 N386 S393	S183-N389 PolarHBondContact O-ND2 2.7Å; F184-N389 HydrophobicContact CD1-CB 3.7Å; F184-N389 VanDerWaalsContact CE1-C 3.47Å; F184-N389 HydrophobicContact CE1-CB 3.81Å; F184-N389 WeakPolarHBondContact CE1-O 3.34Å; N385-N389 WeakPolarHBondContact O-CB 3.41Å; N385-N389 PolarHBondContact O-N 3.44Å; N385-N389 PolarHBondContact O-ND2 2.88Å; N386-N389 PolarHBondContact O-N 2.95Å; N389-S393 WeakPolarHBondContact O-CB 3.46Å; N389-S393 PolarHBondContact O-N 2.79Å
390	Y	95.2	Very high	90.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.2	-49.4	-179.7	177.1	-122.2	0	0	0	112.4	I147 L170 L172 I175 F184 N386 V387 A388 L392 S393 M394 V411 S415	I147-Y390 HydrophobicContact CD1-CE1 4.5Å; I147-Y390 HydrophobicContact CG2-CD1 4.2Å; I147-Y390 HydrophobicContact CG2-CE1 4Å; L170-Y390 HydrophobicContact CB-CE1 4.44Å; L170-Y390 WeakPolarHBondContact CD2-OH 2.96Å; L172-Y390 HydrophobicContact CD2-CD1 3.8Å; L172-Y390 HydrophobicContact CD2-CE1 4Å; I175-Y390 HydrophobicContact CD1-CD1 4.43Å; I175-Y390 HydrophobicContact CD1-CD2 4.26Å; I175-Y390 HydrophobicContact CD1-CE2 4.36Å; I175-Y390 HydrophobicContact CD1-CG 4.3Å; F184-Y390 HydrophobicContact CB-CD2 4.34Å; F184-Y390 HydrophobicContact CB-CG 4.47Å; F184-Y390 HydrophobicContact CD2-CD2 4.13Å; F184-Y390 HydrophobicContact CG-CD2 4.17Å; N386-Y390 VanDerWaalsContact O-CB 3.25Å; N386-Y390 WeakPolarHBondContact O-CB 3.21Å; N386-Y390 PolarHBondContact O-N 3.25Å; V387-Y390 PolarHBondContact O-N 2.85Å; A388-Y390 VanDerWaalsContact C-N 3.28Å; A388-Y390 PolarHBondContact O-N 2.86Å; Y390-L392 PolarHBondContact O-N 2.81Å; Y390-S393 WeakPolarHBondContact O-CB 3.35Å; Y390-S393 PolarHBondContact O-N 2.74Å; Y390-S393 VanDerWaalsContact O-N 3.14Å; Y390-S393 PolarHBondContact O-OG 3.06Å; Y390-M394 HydrophobicContact CD1-CE 3.78Å; Y390-M394 HydrophobicContact CD2-CE 4.16Å; Y390-M394 HydrophobicContact CE1-CE 3.25Å; Y390-M394 HydrophobicContact CE2-CE 3.69Å; Y390-M394 HydrophobicContact CG-CE 4.19Å; Y390-M394 WeakPolarHBondContact OH-CE 3.28Å; Y390-V411 HydrophobicContact CD2-CG1 4.32Å; Y390-V411 HydrophobicContact CE2-CG1 3.99Å; Y390-S415 PolarHBondContact OH-OG 3.29Å
391	L	94.3	Very high	90.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-42.3	178.2	177.5	57.3	0	0	0	112	I50 F73 F78 I118 L120 I147 V387 A388 S393 M394 F403	I50-L391 HydrophobicContact CD1-CD2 3.83Å; F73-L391 HydrophobicContact CD1-CD2 4.46Å; F73-L391 HydrophobicContact CE1-CB 4.45Å; F73-L391 HydrophobicContact CE1-CD2 3.83Å; F73-L391 HydrophobicContact CE1-CG 4.47Å; F73-L391 HydrophobicContact CZ-CD2 4.14Å; F78-L391 HydrophobicContact CZ-CD2 4.41Å; F78-L391 HydrophobicContact CZ-CG 4.48Å; I118-L391 HydrophobicContact CD1-CD1 4.13Å; L120-L391 HydrophobicContact CD1-CD2 4.41Å; I147-L391 HydrophobicContact CD1-CD1 4.18Å; V387-L391 WeakPolarHBondContact O-CB 3.37Å; V387-L391 PolarHBondContact O-N 2.65Å; A388-L391 PolarHBondContact O-N 3.14Å; L391-S393 VanDerWaalsContact C-N 3.27Å; L391-S393 PolarHBondContact O-N 3.41Å; L391-M394 HydrophobicContact CD1-SD 4.27Å; L391-M394 WeakPolarHBondContact O-CB 3.43Å; L391-M394 PolarHBondContact O-N 3.02Å; L391-M394 VanDerWaalsContact O-N 3.15Å; L391-F403 HydrophobicContact CD1-CD2 3.8Å; L391-F403 HydrophobicContact CD1-CE2 3.57Å
392	L	91.6	Very high	90	Very high	38 Å²	38	40.7 Å²	40.7	20%	0.199	24%	0.241	C	C	.	.	H	α-helix	trans	-71.1	-21.5	177.5	-64.8	173.1	0	0	0	112.8	Y45 L72 C76 F78 A388 Y390 M394 T395	Y45-L392 HydrophobicContact CE2-CD2 4.19Å; L72-L392 HydrophobicContact CD2-CD1 3.86Å; L72-L392 HydrophobicContact CG-CD1 4.06Å; C76-L392 HydrophobicContact CB-CD2 4.1Å; F78-L392 HydrophobicContact CE2-CD2 4.15Å; A388-L392 WeakPolarHBondContact O-CB 3.4Å; A388-L392 VanDerWaalsContact O-CG 3.28Å; A388-L392 WeakPolarHBondContact O-CG 3.33Å; A388-L392 PolarHBondContact O-N 3.45Å; Y390-L392 PolarHBondContact O-N 2.81Å; L392-M394 PolarHBondContact O-N 3.49Å; L392-T395 PolarHBondContact O-N 2.87Å; L392-T395 PolarHBondContact O-OG1 3.4Å
393	S	90.6	Very high	89.9	Confident	38 Å²	38	39.5 Å²	39.5	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-67.9	-17.2	170.9	82.1	0	0	0	0	113.5	N389 Y390 L391 T395	N389-S393 WeakPolarHBondContact O-CB 3.46Å; N389-S393 PolarHBondContact O-N 2.79Å; Y390-S393 WeakPolarHBondContact O-CB 3.35Å; Y390-S393 PolarHBondContact O-N 2.74Å; Y390-S393 VanDerWaalsContact O-N 3.14Å; Y390-S393 PolarHBondContact O-OG 3.06Å; L391-S393 VanDerWaalsContact C-N 3.27Å; L391-S393 PolarHBondContact O-N 3.41Å; S393-T395 PolarHBondContact O-N 3.06Å
394	M	91.5	Very high	89.6	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	27.3	174.6	-49.9	-179.6	-173.2	0	0	112.9	I147 L170 Y390 L391 L392 F403 Y404 L405 I412	I147-M394 HydrophobicContact CD1-CE 4.29Å; L170-M394 HydrophobicContact CD2-CE 3.97Å; Y390-M394 HydrophobicContact CD1-CE 3.78Å; Y390-M394 HydrophobicContact CD2-CE 4.16Å; Y390-M394 HydrophobicContact CE1-CE 3.25Å; Y390-M394 HydrophobicContact CE2-CE 3.69Å; Y390-M394 HydrophobicContact CG-CE 4.19Å; Y390-M394 WeakPolarHBondContact OH-CE 3.28Å; L391-M394 HydrophobicContact CD1-SD 4.27Å; L391-M394 WeakPolarHBondContact O-CB 3.43Å; L391-M394 PolarHBondContact O-N 3.02Å; L391-M394 VanDerWaalsContact O-N 3.15Å; L392-M394 PolarHBondContact O-N 3.49Å; M394-F403 HydrophobicContact CB-CD2 4.21Å; M394-F403 HydrophobicContact CB-CE2 4.23Å; M394-F403 HydrophobicContact SD-CD2 4.43Å; M394-F403 HydrophobicContact SD-CE2 3.58Å; M394-F403 VanDerWaalsContact SD-CE2 3.58Å; M394-F403 HydrophobicContact SD-CZ 4.27Å; M394-Y404 PolarHBondContact O-N 3.15Å; M394-L405 HydrophobicContact SD-CD2 3.64Å; M394-I412 HydrophobicContact CB-CD1 4.24Å; M394-I412 HydrophobicContact CG-CD1 3.88Å; M394-I412 HydrophobicContact CG-CG1 4.3Å
395	T	88.2	Confident	89.3	Confident	41 Å²	41	43.4 Å²	43.4	25%	0.252	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-82.7	125.4	172.2	-54.4	0	0	0	0	109.2	Y45 L392 S393 S399 R402	Y45-T395 PolarHBondContact OH-OG1 2.85Å; L392-T395 PolarHBondContact O-N 2.87Å; L392-T395 PolarHBondContact O-OG1 3.4Å; S393-T395 PolarHBondContact O-N 3.06Å; T395-S399 WeakPolarHBondContact CG2-O 3.27Å; T395-R402 WeakPolarHBondContact CA-O 3.5Å
396	P	84.4	Confident	89	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.019	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-65.1	139.5	178.4	21.1	-24.8	0	0	0	110.8	L41 G398 S399 R402 Y404	L41-P396 HydrophobicContact CB-CB 4.12Å; L41-P396 HydrophobicContact CB-CG 4.45Å; L41-P396 WeakPolarHBondContact O-CG 2.98Å; P396-G398 PolarHBondContact O-N 2.97Å; P396-S399 WeakPolarHBondContact O-CB 3.36Å; P396-S399 PolarHBondContact O-N 2.95Å; P396-R402 WeakPolarHBondContact CD-O 3.38Å; P396-R402 HydrophobicContact CG-CB 3.97Å; P396-Y404 HydrophobicContact CB-CD1 3.91Å; P396-Y404 HydrophobicContact CB-CG 4.12Å; P396-Y404 HydrophobicContact CG-CG 4.49Å
397	P	74.8	Confident	88.6	Confident	119 Å²	119	45.3 Å²	45.3	77%	0.773	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	125.5	-176.5	-29.9	35.8	0	0	0	113.4
398	G	76.1	Confident	88.1	Confident	89 Å²	89	53.4 Å²	53.4	92%	0.918	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	-8.8	-177.8	0	0	0	0	0	115.7	P396	P396-G398 PolarHBondContact O-N 2.97Å
399	S	80.4	Confident	87.8	Confident	37 Å²	37	54.8 Å²	54.8	26%	0.259	30%	0.304	S	S	.	.			trans	-94.8	173.2	169.9	-55.9	0	0	0	0	111.7	T395 P396	T395-S399 WeakPolarHBondContact CG2-O 3.27Å; P396-S399 WeakPolarHBondContact O-CB 3.36Å; P396-S399 PolarHBondContact O-N 2.95Å
400	K	80.2	Confident	87.4	Confident	185 Å²	185	54.8 Å²	54.8	80%	0.804	31%	0.305	S	S	*	.	S	Bend	trans	-135.7	-5.8	174.3	-69.3	-171.4	176.1	-176.1	0	114.7
401	D	87.5	Confident	87.2	Confident	84 Å²	84	54.8 Å²	54.8	45%	0.449	31%	0.305	S	S	.	.	S	Bend	trans	-147.3	18.2	-154.2	58.3	-34	0	0	0	111.7	A44 Y45	A44-D401 WeakPolarHBondContact CA-O 3.37Å; Y45-D401 PolarHBondContact N-O 3.1Å
402	R	89.1	Confident	87.1	Confident	38 Å²	38	55 Å²	55	14%	0.143	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.6	-174.5	-53.2	-172.5	74.5	82.8	3.6	111.5	Q40 L41 G42 V43 Y45 T395 P396	Q40-R402 VanDerWaalsContact CB-CZ 3.48Å; Q40-R402 PolarHBondContact O-NE 2.79Å; Q40-R402 PolarHBondContact O-NH2 3.03Å; L41-R402 WeakPolarHBondContact O-CD 3.45Å; L41-R402 PolarHBondContact O-NE 3.4Å; G42-R402 PolarHBondContact O-NH2 2.71Å; V43-R402 CarbonylContact O-C 3.58Å; V43-R402 VanDerWaalsContact O-CA 3.25Å; V43-R402 WeakPolarHBondContact O-CA 3.46Å; Y45-R402 VanDerWaalsContact CE1-O 3.23Å; Y45-R402 WeakPolarHBondContact CE1-O 3.39Å; T395-R402 WeakPolarHBondContact CA-O 3.5Å; P396-R402 WeakPolarHBondContact CD-O 3.38Å; P396-R402 HydrophobicContact CG-CB 3.97Å
403	F	92.1	Very high	87.2	Confident	19 Å²	19	55.2 Å²	55.2	8%	0.083	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.8	176.9	174	-103.5	0	0	0	110.2	G42 V43 Y45 L48 I118 T145 L391 M394 L405	G42-F403 CarbonylContact C-O 3.36Å; G42-F403 WeakPolarHBondContact CA-O 3.25Å; V43-F403 PolarHBondContact N-O 3.33Å; V43-F403 PolarHBondContact O-N 3.48Å; Y45-F403 HydrophobicContact CD1-CB 4.04Å; Y45-F403 HydrophobicContact CE1-CB 3.82Å; L48-F403 HydrophobicContact CD1-CB 3.54Å; L48-F403 HydrophobicContact CD1-CD1 4.15Å; L48-F403 HydrophobicContact CD1-CG 4.05Å; I118-F403 HydrophobicContact CD1-CD2 4.16Å; I118-F403 HydrophobicContact CD1-CE2 4.1Å; I118-F403 HydrophobicContact CD1-CG 4.4Å; I118-F403 HydrophobicContact CD1-CZ 4.3Å; T145-F403 HydrophobicContact CG2-CZ 4.22Å; L391-F403 HydrophobicContact CD1-CD2 3.8Å; L391-F403 HydrophobicContact CD1-CE2 3.57Å; M394-F403 HydrophobicContact CB-CD2 4.21Å; M394-F403 HydrophobicContact CB-CE2 4.23Å; M394-F403 HydrophobicContact SD-CD2 4.43Å; M394-F403 HydrophobicContact SD-CE2 3.58Å; M394-F403 VanDerWaalsContact SD-CE2 3.58Å; M394-F403 HydrophobicContact SD-CZ 4.27Å; F403-L405 HydrophobicContact CE1-CG 4.21Å; F403-L405 HydrophobicContact CE2-CD2 4.29Å; F403-L405 HydrophobicContact CZ-CD2 3.79Å; F403-L405 HydrophobicContact CZ-CG 3.97Å
404	Y	91.9	Very high	87.1	Confident	71 Å²	71	54.2 Å²	54.2	28%	0.278	30%	0.295	S	S	.	.			trans	-143.7	120.2	-179.7	-178.6	-116.9	0	0	0	112	L41 M394 P396 N406	L41-Y404 HydrophobicContact CB-CD2 4.41Å; L41-Y404 HydrophobicContact CB-CG 4.48Å; L41-Y404 HydrophobicContact CD2-CE2 4.2Å; M394-Y404 PolarHBondContact O-N 3.15Å; P396-Y404 HydrophobicContact CB-CD1 3.91Å; P396-Y404 HydrophobicContact CB-CG 4.12Å; P396-Y404 HydrophobicContact CG-CG 4.49Å; Y404-N406 HydrophobicContact CD1-CB 3.84Å; Y404-N406 HydrophobicContact CE1-CB 3.71Å; Y404-N406 PolarHBondContact O-N 3.07Å
405	L	91.2	Very high	87.2	Confident	12 Å²	12	54.1 Å²	54.1	6%	0.063	30%	0.295	C	S	.	.			trans	-77.9	84.2	172.8	-64.5	-179.4	0	0	0	110	N168 L170 M394 F403 L407 I412 L416 Y419	N168-L405 HydrophobicContact CB-CD1 4.09Å; L170-L405 HydrophobicContact CD1-CD2 4.14Å; L170-L405 HydrophobicContact CD2-CD2 4.04Å; M394-L405 HydrophobicContact SD-CD2 3.64Å; F403-L405 HydrophobicContact CE1-CG 4.21Å; F403-L405 HydrophobicContact CE2-CD2 4.29Å; F403-L405 HydrophobicContact CZ-CD2 3.79Å; F403-L405 HydrophobicContact CZ-CG 3.97Å; L405-L407 PolarHBondContact O-N 2.9Å; L405-I412 HydrophobicContact CD2-CG2 4.13Å; L405-L416 HydrophobicContact CD1-CD1 4.4Å; L405-Y419 HydrophobicContact CB-CE2 4.31Å; L405-Y419 HydrophobicContact CD1-CD2 4.3Å; L405-Y419 HydrophobicContact CD1-CE2 4.19Å
406	N	89.2	Confident	87.6	Confident	32 Å²	32	52.2 Å²	52.2	17%	0.171	28%	0.283	C	S	.	.			trans	-72	112.5	176.6	-173.3	12.3	0	0	0	111.1	Y404 E408 D409 I412	Y404-N406 HydrophobicContact CD1-CB 3.84Å; Y404-N406 HydrophobicContact CE1-CB 3.71Å; Y404-N406 PolarHBondContact O-N 3.07Å; N406-E408 PolarHBondContact O-N 3.4Å; N406-E408 WeakPolarHBondContact OD1-CB 3.46Å; N406-E408 PolarHBondContact OD1-N 2.88Å; N406-D409 HydrophobicContact CB-CB 4.17Å; N406-D409 PolarHBondContact O-N 2.94Å; N406-D409 VanDerWaalsContact O-N 3.15Å; N406-I412 HydrophobicContact CB-CD1 4.36Å
407	L	88.3	Confident	88.1	Confident	69 Å²	69	52.1 Å²	52.1	36%	0.361	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.2	176.4	-61.1	179.6	0	0	0	113.6	L405 L416 Y419 M424	L405-L407 PolarHBondContact O-N 2.9Å; L407-L416 HydrophobicContact CD2-CD2 3.39Å; L407-Y419 HydrophobicContact CD1-CD1 4.46Å; L407-Y419 HydrophobicContact CD1-CE1 4.23Å; L407-M424 HydrophobicContact CD2-CE 4.41Å
408	E	86.4	Confident	89.1	Confident	173 Å²	173	46.4 Å²	46.4	81%	0.808	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.4	170.7	-55.9	-175.5	156.6	0	0	112.9	N406 D410	N406-E408 PolarHBondContact O-N 3.4Å; N406-E408 WeakPolarHBondContact OD1-CB 3.46Å; N406-E408 PolarHBondContact OD1-N 2.88Å; E408-D410 PolarHBondContact O-N 3.49Å
409	D	87.3	Confident	89.9	Confident	28 Å²	28	45.6 Å²	45.6	15%	0.15	22%	0.215	C	C	.	.	S	Bend	trans	-82.4	119.1	175.4	-172.2	-78.6	0	0	0	110.7	R180 N406 V411 I412 R413	R180-D409 IonicContact CZ-OD1 2.78Å; R180-D409 IonicContact CZ-OD2 3.48Å; R180-D409 IonicContact NH1-OD1 2.76Å; R180-D409 PolarHBondContact NH1-OD1 2.84Å; R180-D409 IonicContact NH1-OD2 3.46Å; R180-D409 PolarHBondContact NH1-OD2 2.64Å; R180-D409 VanDerWaalsContact NH2-CG 3.3Å; R180-D409 IonicContact NH2-OD1 3.16Å; R180-D409 PolarHBondContact NH2-OD1 3.43Å; R180-D409 IonicContact NH2-OD2 2.8Å; R180-D409 PolarHBondContact NH2-OD2 2.75Å; N406-D409 HydrophobicContact CB-CB 4.17Å; N406-D409 PolarHBondContact O-N 2.94Å; N406-D409 VanDerWaalsContact O-N 3.15Å; D409-V411 PolarHBondContact O-N 2.68Å; D409-V411 VanDerWaalsContact O-N 3.15Å; D409-V411 WeakPolarHBondContact OD1-CB 3.28Å; D409-V411 PolarHBondContact OD1-N 3.29Å; D409-I412 HydrophobicContact CB-CB 4.16Å; D409-I412 HydrophobicContact CB-CD1 3.94Å; D409-I412 HydrophobicContact CB-CG1 3.99Å; D409-I412 PolarHBondContact O-N 3.29Å; D409-I412 PolarHBondContact OD1-N 3.11Å; D409-R413 WeakPolarHBondContact O-CB 3.39Å; D409-R413 PolarHBondContact O-N 3.07Å
410	D	85.8	Confident	90.4	Very high	73 Å²	73	47.2 Å²	47.2	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-56.1	-33.6	-175.9	-75.8	-29.4	0	0	0	114.5	E408 D414 R430	E408-D410 PolarHBondContact O-N 3.49Å; D410-D414 WeakPolarHBondContact O-CB 3.35Å; D410-D414 VanDerWaalsContact O-CG 3.22Å; D410-D414 PolarHBondContact O-N 3.37Å; D410-R430 VanDerWaalsContact CA-NH2 3.29Å; D410-R430 PolarHBondContact O-NH2 2.95Å; D410-R430 IonicContact OD1-CZ 2.72Å; D410-R430 IonicContact OD1-NE 3.59Å; D410-R430 PolarHBondContact OD1-NE 3.05Å; D410-R430 IonicContact OD1-NH2 2.73Å; D410-R430 PolarHBondContact OD1-NH2 3.47Å; D410-R430 IonicContact OD2-NE 3.76Å
411	V	90.5	Very high	90.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-77.5	-43.2	-178.3	-173.8	0	0	0	0	110.2	I175 P176 I178 R180 A181 F184 Y390 D409 S415	I175-V411 HydrophobicContact CG2-CG1 4.27Å; P176-V411 HydrophobicContact CG-CG2 4.42Å; I178-V411 HydrophobicContact CD1-CG2 3.96Å; R180-V411 HydrophobicContact CG-CG2 4.43Å; A181-V411 HydrophobicContact CB-CG1 4.23Å; A181-V411 HydrophobicContact CB-CG2 4Å; F184-V411 HydrophobicContact CD2-CG1 3.85Å; F184-V411 HydrophobicContact CE2-CG1 4.14Å; Y390-V411 HydrophobicContact CD2-CG1 4.32Å; Y390-V411 HydrophobicContact CE2-CG1 3.99Å; D409-V411 PolarHBondContact O-N 2.68Å; D409-V411 VanDerWaalsContact O-N 3.15Å; D409-V411 WeakPolarHBondContact OD1-CB 3.28Å; D409-V411 PolarHBondContact OD1-N 3.29Å; V411-S415 PolarHBondContact O-N 2.95Å; V411-S415 PolarHBondContact O-OG 3.43Å
412	I	92.5	Very high	91.1	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-65.4	-49.1	177.3	-57.3	179	0	0	0	109.6	L170 M394 L405 N406 D409 D414 S415 L416	L170-I412 HydrophobicContact CD2-CG2 4.23Å; M394-I412 HydrophobicContact CB-CD1 4.24Å; M394-I412 HydrophobicContact CG-CD1 3.88Å; M394-I412 HydrophobicContact CG-CG1 4.3Å; L405-I412 HydrophobicContact CD2-CG2 4.13Å; N406-I412 HydrophobicContact CB-CD1 4.36Å; D409-I412 HydrophobicContact CB-CB 4.16Å; D409-I412 HydrophobicContact CB-CD1 3.94Å; D409-I412 HydrophobicContact CB-CG1 3.99Å; D409-I412 PolarHBondContact O-N 3.29Å; D409-I412 PolarHBondContact OD1-N 3.11Å; I412-D414 VanDerWaalsContact C-N 3.32Å; I412-D414 PolarHBondContact O-N 3.49Å; I412-S415 PolarHBondContact O-N 3.31Å; I412-S415 PolarHBondContact O-OG 2.82Å; I412-L416 WeakPolarHBondContact O-CB 3.14Å; I412-L416 PolarHBondContact O-N 3.48Å
413	R	92.3	Very high	91.2	Very high	44 Å²	44	44 Å²	44	17%	0.166	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-37.9	-177.7	177.3	57.5	-167.9	97.5	-9.2	112.9	D409 M424 P428	D409-R413 WeakPolarHBondContact O-CB 3.39Å; D409-R413 PolarHBondContact O-N 3.07Å; R413-M424 VanDerWaalsContact CZ-O 3.26Å; R413-M424 PolarHBondContact NH1-O 2.96Å; R413-M424 PolarHBondContact NH2-O 3.23Å; R413-P428 HydrophobicContact CG-CG 4.38Å
414	D	90.1	Very high	91.2	Very high	17 Å²	17	45.1 Å²	45.1	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-73.7	-32.1	-176.4	-78.8	18.7	0	0	0	113.4	P176 D410 I412 P427 R430	P176-D414 HydrophobicContact CB-CB 4.32Å; P176-D414 WeakPolarHBondContact CB-OD2 3.23Å; P176-D414 HydrophobicContact CG-CB 3.89Å; D410-D414 WeakPolarHBondContact O-CB 3.35Å; D410-D414 VanDerWaalsContact O-CG 3.22Å; D410-D414 PolarHBondContact O-N 3.37Å; I412-D414 VanDerWaalsContact C-N 3.32Å; I412-D414 PolarHBondContact O-N 3.49Å; D414-P427 HydrophobicContact CB-CB 4.28Å; D414-R430 IonicContact OD1-CZ 3.21Å; D414-R430 VanDerWaalsContact OD1-CZ 3.24Å; D414-R430 IonicContact OD1-NH1 3.65Å; D414-R430 PolarHBondContact OD1-NH1 3.13Å; D414-R430 IonicContact OD1-NH2 3.31Å; D414-R430 PolarHBondContact OD1-NH2 3.31Å; D414-R430 IonicContact OD2-CZ 2.77Å; D414-R430 IonicContact OD2-NH1 3.51Å; D414-R430 PolarHBondContact OD2-NH1 2.9Å; D414-R430 IonicContact OD2-NH2 3.62Å
415	S	93.8	Very high	91	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-92.3	-18.5	-178	51.4	0	0	0	0	113.8	L170 A171 Y390 V411 I412 I417	L170-S415 WeakPolarHBondContact CA-O 3.49Å; A171-S415 PolarHBondContact N-O 3.36Å; A171-S415 WeakPolarHBondContact O-CB 3.48Å; Y390-S415 PolarHBondContact OH-OG 3.29Å; V411-S415 PolarHBondContact O-N 2.95Å; V411-S415 PolarHBondContact O-OG 3.43Å; I412-S415 PolarHBondContact O-N 3.31Å; I412-S415 PolarHBondContact O-OG 2.82Å; S415-I417 PolarHBondContact O-N 3.41Å
416	L	94.9	Very high	90.8	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	109.1	176	-174	67.4	0	0	0	111.5	L170 L405 L407 I412 L418 Y419 M424	L170-L416 HydrophobicContact CD1-CD1 4.46Å; L170-L416 HydrophobicContact CD2-CB 4.24Å; L170-L416 HydrophobicContact CD2-CD1 3.95Å; L170-L416 HydrophobicContact CG-CD1 3.86Å; L405-L416 HydrophobicContact CD1-CD1 4.4Å; L407-L416 HydrophobicContact CD2-CD2 3.39Å; I412-L416 WeakPolarHBondContact O-CB 3.14Å; I412-L416 PolarHBondContact O-N 3.48Å; L416-L418 WeakPolarHBondContact CD1-O 3.4Å; L416-Y419 HydrophobicContact CD2-CD2 3.96Å; L416-Y419 HydrophobicContact CD2-CG 4.23Å; L416-M424 WeakPolarHBondContact O-CB 3.23Å
417	I	95.4	Very high	90.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-42.1	-179.4	-51.7	-53	0	0	0	111.7	P152 I159 L169 A171 C174 S415 L423 M424 W425	P152-I417 HydrophobicContact CB-CD1 4.34Å; P152-I417 HydrophobicContact CB-CG2 4.27Å; P152-I417 HydrophobicContact CG-CD1 3.94Å; I159-I417 HydrophobicContact CD1-CG2 4.06Å; I159-I417 HydrophobicContact CG1-CG2 4.38Å; I159-I417 HydrophobicContact CG2-CG2 4.32Å; L169-I417 HydrophobicContact CB-CB 4.34Å; L169-I417 HydrophobicContact CD2-CB 4.06Å; L169-I417 HydrophobicContact CD2-CG2 4.11Å; L169-I417 HydrophobicContact CG-CB 4.14Å; L169-I417 PolarHBondContact O-N 2.99Å; A171-I417 HydrophobicContact CB-CD1 3.85Å; A171-I417 HydrophobicContact CB-CG1 3.5Å; A171-I417 VanDerWaalsContact CB-CG1 3.5Å; C174-I417 HydrophobicContact CB-CD1 4.4Å; S415-I417 PolarHBondContact O-N 3.41Å; I417-L423 HydrophobicContact CG2-CD1 4.33Å; I417-M424 PolarHBondContact O-N 3.47Å; I417-W425 HydrophobicContact CD1-CB 3.92Å; I417-W425 HydrophobicContact CD1-CG 3.95Å; I417-W425 HydrophobicContact CG2-CB 3.97Å
418	L	95.5	Very high	90.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.1	175	-62	173.4	0	0	0	109.8	I159 L162 V167 N168 L169 L416 E422 L423	I159-L418 HydrophobicContact CG2-CD1 4.24Å; I159-L418 HydrophobicContact CG2-CD2 3.74Å; I159-L418 HydrophobicContact CG2-CG 4.1Å; L162-L418 HydrophobicContact CB-CD1 3.65Å; V167-L418 VanDerWaalsContact O-CB 3.3Å; V167-L418 WeakPolarHBondContact O-CB 3.45Å; N168-L418 CarbonylContact C-O 3.39Å; N168-L418 WeakPolarHBondContact CA-O 3.39Å; L169-L418 HydrophobicContact CB-CB 3.67Å; L169-L418 HydrophobicContact CB-CD1 4Å; L169-L418 HydrophobicContact CB-CG 3.93Å; L169-L418 HydrophobicContact CD2-CD1 3.92Å; L169-L418 HydrophobicContact CD2-CG 4.1Å; L169-L418 PolarHBondContact N-O 2.78Å; L169-L418 PolarHBondContact O-N 2.88Å; L416-L418 WeakPolarHBondContact CD1-O 3.4Å; L418-E422 CarbonylContact C-O 3.57Å; L418-E422 VanDerWaalsContact CA-O 3.25Å; L418-E422 WeakPolarHBondContact CA-O 3.31Å; L418-L423 HydrophobicContact CD2-CB 4.47Å; L418-L423 HydrophobicContact CD2-CD1 4.06Å
419	Y	93.8	Very high	89.6	Confident	72 Å²	72	48.6 Å²	48.6	28%	0.282	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	112.9	170.8	-173.1	-119.4	0	0	0	109.4	N168 L405 L407 L416 G421 E422	N168-Y419 WeakPolarHBondContact OD1-CA 3.39Å; N168-Y419 WeakPolarHBondContact OD1-CD2 3.49Å; L405-Y419 HydrophobicContact CB-CE2 4.31Å; L405-Y419 HydrophobicContact CD1-CD2 4.3Å; L405-Y419 HydrophobicContact CD1-CE2 4.19Å; L407-Y419 HydrophobicContact CD1-CD1 4.46Å; L407-Y419 HydrophobicContact CD1-CE1 4.23Å; L416-Y419 HydrophobicContact CD2-CD2 3.96Å; L416-Y419 HydrophobicContact CD2-CG 4.23Å; Y419-G421 PolarHBondContact O-N 3.18Å; Y419-E422 PolarHBondContact N-O 3.08Å; Y419-E422 PolarHBondContact O-N 3.38Å
420	N	90.9	Very high	88.4	Confident	71 Å²	71	51.5 Å²	51.5	38%	0.38	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	29.6	-171.2	-55	-52.2	0	0	0	114.2	K166 N168	K166-N420 WeakPolarHBondContact CB-O 3.31Å; K166-N420 CarbonylContact O-C 3Å; K166-N420 WeakPolarHBondContact O-CA 3.33Å; N168-N420 PolarHBondContact ND2-OD1 3.16Å; N168-N420 PolarHBondContact OD1-N 2.86Å; N168-N420 PolarHBondContact OD1-OD1 3.33Å
421	G	88.3	Confident	86.5	Confident	8 Å²	8	53.6 Å²	53.6	8%	0.082	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	94	-12.6	-175.7	0	0	0	0	0	116.5	S163 Y419	S163-G421 WeakPolarHBondContact CB-O 3.47Å; S163-G421 PolarHBondContact OG-O 3.38Å; Y419-G421 PolarHBondContact O-N 3.18Å
422	E	92.9	Very high	84.4	Confident	141 Å²	141	59.8 Å²	59.8	66%	0.659	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.9	176.4	-62	-172.1	163	0	0	111.3	L418 Y419 M424	L418-E422 CarbonylContact C-O 3.57Å; L418-E422 VanDerWaalsContact CA-O 3.25Å; L418-E422 WeakPolarHBondContact CA-O 3.31Å; Y419-E422 PolarHBondContact N-O 3.08Å; Y419-E422 PolarHBondContact O-N 3.38Å; E422-M424 PolarHBondContact O-N 3.21Å
423	L	92.9	Very high	81.8	Confident	91 Å²	91	65.4 Å²	65.4	48%	0.476	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	114.6	-175.9	-173.9	67.3	0	0	0	111.7	I159 I417 L418 W425	I159-L423 HydrophobicContact CG2-CD1 3.75Å; I417-L423 HydrophobicContact CG2-CD1 4.33Å; L418-L423 HydrophobicContact CD2-CB 4.47Å; L418-L423 HydrophobicContact CD2-CD1 4.06Å; L423-W425 HydrophobicContact CD1-CB 4.37Å
424	M	91.3	Very high	79	Confident	42 Å²	42	69.1 Å²	69.1	21%	0.207	38%	0.38	C	S	.	.			trans	-104.1	-3.3	-178.4	-63.9	-62.3	-78.2	0	0	113.3	L407 R413 L416 I417 E422	L407-M424 HydrophobicContact CD2-CE 4.41Å; R413-M424 VanDerWaalsContact CZ-O 3.26Å; R413-M424 PolarHBondContact NH1-O 2.96Å; R413-M424 PolarHBondContact NH2-O 3.23Å; L416-M424 WeakPolarHBondContact O-CB 3.23Å; I417-M424 PolarHBondContact O-N 3.47Å; E422-M424 PolarHBondContact O-N 3.21Å
425	W	88.3	Confident	76.3	Confident	77 Å²	77	73.8 Å²	73.8	29%	0.292	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-97.4	142.6	177	-177.7	89.6	0	0	0	111.3	P152 A153 I417 L423	P152-W425 HydrophobicContact CB-CD2 4.16Å; P152-W425 HydrophobicContact CB-CG 4.34Å; P152-W425 HydrophobicContact CG-CD2 4.27Å; P152-W425 HydrophobicContact CG-CG 4.3Å; P152-W425 HydrophobicContact CG-CZ2 4.4Å; A153-W425 HydrophobicContact CB-CH2 3.91Å; A153-W425 HydrophobicContact CB-CZ2 3.93Å; I417-W425 HydrophobicContact CD1-CB 3.92Å; I417-W425 HydrophobicContact CD1-CG 3.95Å; I417-W425 HydrophobicContact CG2-CB 3.97Å; L423-W425 HydrophobicContact CD1-CB 4.37Å
426	P	87.1	Confident	73.4	Confident	92 Å²	92	78 Å²	78	60%	0.597	45%	0.45	S	S	*	.	S	Bend	cis	-73.6	158.4	1.4	30.9	-36.5	0	0	0	114.1
427	P	84.2	Confident	70.1	Confident	43 Å²	43	82.7 Å²	82.7	28%	0.279	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-69.9	157.2	177.3	31.9	-37.5	0	0	0	112.3	D414	D414-P427 HydrophobicContact CB-CB 4.28Å
428	P	82.5	Confident	67.2	Low	67 Å²	67	91.7 Å²	91.7	44%	0.435	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-65.5	135.6	-178.2	27.5	-34.8	0	0	0	111.9	R413 R430	R413-P428 HydrophobicContact CG-CG 4.38Å; P428-R430 PolarHBondContact O-N 3.19Å
429	V	70.7	Confident	64.2	Low	151 Å²	151	97.3 Å²	97.3	92%	0.915	55%	0.548	S	S	*	.			trans	-71.9	93.8	178.8	-175.8	0	0	0	0	109.9
430	R	63.1	Low	61.3	Low	89 Å²	89	100.3 Å²	100.3	34%	0.336	57%	0.57	S	S	.	*			trans	-66.6	139.6	168.6	-65	-172.2	-161.6	70.4	8.6	110.3	D410 D414 P428 Q432	D410-R430 VanDerWaalsContact CA-NH2 3.29Å; D410-R430 PolarHBondContact O-NH2 2.95Å; D410-R430 IonicContact OD1-CZ 2.72Å; D410-R430 IonicContact OD1-NE 3.59Å; D410-R430 PolarHBondContact OD1-NE 3.05Å; D410-R430 IonicContact OD1-NH2 2.73Å; D410-R430 PolarHBondContact OD1-NH2 3.47Å; D410-R430 IonicContact OD2-NE 3.76Å; D414-R430 IonicContact OD1-CZ 3.21Å; D414-R430 VanDerWaalsContact OD1-CZ 3.24Å; D414-R430 IonicContact OD1-NH1 3.65Å; D414-R430 PolarHBondContact OD1-NH1 3.13Å; D414-R430 IonicContact OD1-NH2 3.31Å; D414-R430 PolarHBondContact OD1-NH2 3.31Å; D414-R430 IonicContact OD2-CZ 2.77Å; D414-R430 IonicContact OD2-NH1 3.51Å; D414-R430 PolarHBondContact OD2-NH1 2.9Å; D414-R430 IonicContact OD2-NH2 3.62Å; P428-R430 PolarHBondContact O-N 3.19Å; R430-Q432 PolarHBondContact O-N 2.87Å; R430-Q432 VanDerWaalsContact O-N 3.09Å
431	S	45.8	Very low	58.6	Low	116 Å²	116	103.1 Å²	103.1	81%	0.811	59%	0.585	S	S	*	*			trans	-58	112.5	156.3	37.5	0	0	0	0	108.1
432	Q	45.5	Very low	55.9	Low	131 Å²	131	107.1 Å²	107.1	61%	0.612	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-57.6	136.4	176.2	-66.7	-172.7	0.7	0	0	108.6	R430 T434	R430-Q432 PolarHBondContact O-N 2.87Å; R430-Q432 VanDerWaalsContact O-N 3.09Å; Q432-T434 PolarHBondContact O-N 3.42Å
433	P	39.2	Very low	53.3	Low	121 Å²	121	109.1 Å²	109.1	79%	0.786	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-57.1	120.7	165.8	25.9	-32.3	0	0	0	106.7	S435	P433-S435 PolarHBondContact O-N 3.18Å
434	T	32.3	Very low	50.8	Low	121 Å²	121	111 Å²	111	74%	0.742	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-52.1	128.5	175.4	37.9	0	0	0	0	108	Q432 A436	Q432-T434 PolarHBondContact O-N 3.42Å; T434-A436 WeakPolarHBondContact O-CA 3.45Å; T434-A436 PolarHBondContact O-N 3.14Å
435	S	34.7	Very low	48.6	Very low	115 Å²	115	112.4 Å²	112.4	80%	0.804	63%	0.632	S	S	*	*			trans	-49	113	-179.9	39.9	0	0	0	0	108.2	P433 P437	P433-S435 PolarHBondContact O-N 3.18Å; S435-P437 WeakPolarHBondContact O-CA 3.42Å
436	A	31.6	Very low	46.1	Very low	90 Å²	90	110.5 Å²	110.5	74%	0.744	63%	0.63	S	S	*	*			trans	-47.8	116.9	-152.6	0	0	0	0	0	110.1	T434 K438	T434-A436 WeakPolarHBondContact O-CA 3.45Å; T434-A436 PolarHBondContact O-N 3.14Å; A436-K438 PolarHBondContact O-N 3.47Å
437	P	26.5	Very low	43.7	Very low	98 Å²	98	112.1 Å²	112.1	64%	0.636	63%	0.628	S	S	*	*			trans	-55.3	117.6	-155.5	19.4	-33.2	0	0	0	109.1	S435 L439	S435-P437 WeakPolarHBondContact O-CA 3.42Å; P437-L439 VanDerWaalsContact O-CA 3.22Å; P437-L439 WeakPolarHBondContact O-CA 3.12Å; P437-L439 WeakPolarHBondContact O-CB 3.49Å; P437-L439 PolarHBondContact O-N 2.95Å
438	K	34.3	Very low	41.2	Very low	190 Å²	190	115 Å²	115	83%	0.826	66%	0.656	S	S	*	*			trans	-41.2	102.9	-166.9	-82.7	-172.2	177.4	178.9	0	109.4	A436 N440	A436-K438 PolarHBondContact O-N 3.47Å; K438-N440 PolarHBondContact O-N 3.03Å; K438-N440 PolarHBondContact O-OD1 3.34Å
439	L	32.9	Very low	38.6	Very low	117 Å²	117	115.3 Å²	115.3	61%	0.613	67%	0.671	S	S	*	*			trans	-84.6	77.2	-157.9	-143.5	170.1	0	0	0	107.3	P437 N441 S442	P437-L439 VanDerWaalsContact O-CA 3.22Å; P437-L439 WeakPolarHBondContact O-CA 3.12Å; P437-L439 WeakPolarHBondContact O-CB 3.49Å; P437-L439 PolarHBondContact O-N 2.95Å; L439-N441 HydrophobicContact CD2-CB 3.76Å; L439-N441 PolarHBondContact O-N 3.45Å; L439-S442 PolarHBondContact O-N 2.77Å; L439-S442 PolarHBondContact O-OG 3.17Å; L439-S442 VanDerWaalsContact O-OG 3.06Å
440	N	33	Very low	36.5	Very low	136 Å²	136	112.2 Å²	112.2	73%	0.727	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	0.3	-170.8	-73	-20.2	0	0	0	115	K438 S442	K438-N440 PolarHBondContact O-N 3.03Å; K438-N440 PolarHBondContact O-OD1 3.34Å; N440-S442 VanDerWaalsContact C-N 3.25Å
441	N	32.8	Very low	34.9	Very low	130 Å²	130	115.5 Å²	115.5	70%	0.695	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-13.8	164.4	-58	-13.7	0	0	0	112.4	L439 K443	L439-N441 HydrophobicContact CD2-CB 3.76Å; L439-N441 PolarHBondContact O-N 3.45Å; N441-K443 PolarHBondContact O-N 2.87Å
442	S	32.5	Very low	34.2	Very low	91 Å²	91	115.5 Å²	115.5	64%	0.636	67%	0.669	S	S	*	*			trans	-73.5	49.5	168	62.3	0	0	0	0	112.6	L439 N440 Q444	L439-S442 PolarHBondContact O-N 2.77Å; L439-S442 PolarHBondContact O-OG 3.17Å; L439-S442 VanDerWaalsContact O-OG 3.06Å; N440-S442 VanDerWaalsContact C-N 3.25Å; S442-Q444 PolarHBondContact O-N 2.93Å
443	K	38.4	Very low	33.6	Very low	183 Å²	183	115.7 Å²	115.7	80%	0.796	68%	0.679	S	S	*	*			trans	-62.5	85.4	146	-79.7	-171.8	175.1	-177.5	0	107.2	N441 L445	N441-K443 PolarHBondContact O-N 2.87Å; K443-L445 PolarHBondContact O-N 3.28Å
444	Q	40.2	Very low	33.4	Very low	130 Å²	130	115.7 Å²	115.7	61%	0.607	68%	0.676	S	S	*	*			trans	-48	116.1	168.1	-84.9	178	-36.8	0	0	108.7	S442 S446 K447	S442-Q444 PolarHBondContact O-N 2.93Å; Q444-S446 PolarHBondContact O-N 3.14Å; Q444-S446 VanDerWaalsContact O-N 3.13Å; Q444-K447 PolarHBondContact O-N 3.1Å
445	L	44.9	Very low	33.8	Very low	72 Å²	72	118.1 Å²	118.1	38%	0.377	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.7	-21.8	177.2	-76.8	158.7	0	0	0	111.4	K443 K447 P1026 A1031	K443-L445 PolarHBondContact O-N 3.28Å; L445-K447 VanDerWaalsContact C-N 3.32Å; L445-K447 PolarHBondContact O-N 3.3Å; L445-P1026 HydrophobicContact CD1-CB 4.39Å; L445-A1031 HydrophobicContact CD1-CB 4.39Å
446	S	36.3	Very low	34.2	Very low	37 Å²	37	118.3 Å²	118.3	26%	0.259	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	3.9	177.3	53.2	0	0	0	0	115.9	Q444 A448 G449	Q444-S446 PolarHBondContact O-N 3.14Å; Q444-S446 VanDerWaalsContact O-N 3.13Å; S446-A448 PolarHBondContact O-N 2.96Å; S446-G449 PolarHBondContact O-N 3.24Å
447	K	36.5	Very low	35.1	Very low	126 Å²	126	121.3 Å²	121.3	55%	0.548	68%	0.676	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.1	10	-177.9	-145.3	175.1	-173.1	179.8	0	115.5	Q444 L445 G449 M452	Q444-K447 PolarHBondContact O-N 3.1Å; L445-K447 VanDerWaalsContact C-N 3.32Å; L445-K447 PolarHBondContact O-N 3.3Å; K447-G449 VanDerWaalsContact C-N 3.34Å; K447-M452 HydrophobicContact CB-CE 4.06Å; K447-M452 HydrophobicContact CD-CE 4.21Å; K447-M452 HydrophobicContact CG-CE 4.02Å; K447-M452 WeakPolarHBondContact O-CE 3.4Å
448	A	32.3	Very low	36.9	Very low	105 Å²	105	120.9 Å²	120.9	87%	0.868	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-7.6	172.1	0	0	0	0	0	114.5	S446	S446-A448 PolarHBondContact O-N 2.96Å
449	G	27.7	Very low	38.4	Very low	72 Å²	72	116.4 Å²	116.4	74%	0.742	66%	0.662	S	S	*	*	S	Bend	trans	-114.8	-6.4	-166.6	0	0	0	0	0	118.4	S446 K447	S446-G449 PolarHBondContact O-N 3.24Å; K447-G449 VanDerWaalsContact C-N 3.34Å
450	S	26.8	Very low	40.5	Very low	87 Å²	87	112.9 Å²	112.9	61%	0.608	65%	0.646	S	S	*	*	S	Bend	trans	-154.9	129.9	-179.2	-175	0	0	0	0	112.9	M452	S450-M452 PolarHBondContact O-N 2.78Å; S450-M452 VanDerWaalsContact O-N 3.11Å
451	N	28.1	Very low	42.7	Very low	157 Å²	157	108.3 Å²	108.3	84%	0.84	63%	0.625	S	S	*	*			trans	32.6	60.4	164.1	-66.6	-5.7	0	0	0	116.5	T453	N451-T453 PolarHBondContact O-N 2.88Å
452	M	31.8	Very low	45.1	Very low	117 Å²	117	104.1 Å²	104.1	58%	0.576	60%	0.604	S	S	*	*			trans	-69.2	118.7	155	-78.4	-160.3	175.4	0	0	109.3	K447 S450 V454	K447-M452 HydrophobicContact CB-CE 4.06Å; K447-M452 HydrophobicContact CD-CE 4.21Å; K447-M452 HydrophobicContact CG-CE 4.02Å; K447-M452 WeakPolarHBondContact O-CE 3.4Å; S450-M452 PolarHBondContact O-N 2.78Å; S450-M452 VanDerWaalsContact O-N 3.11Å; M452-V454 PolarHBondContact O-N 2.96Å; M452-V454 VanDerWaalsContact O-N 3.11Å
453	T	32	Very low	47.9	Very low	134 Å²	134	106.2 Å²	106.2	82%	0.822	60%	0.602	S	S	*	*			trans	-56.1	111.5	142.6	32.7	0	0	0	0	107	N451 Q455	N451-T453 PolarHBondContact O-N 2.88Å; T453-Q455 PolarHBondContact O-N 3.02Å
454	V	35	Very low	50.4	Low	121 Å²	121	103.4 Å²	103.4	73%	0.733	59%	0.59	S	S	*	*			trans	-61	108.2	-176.9	176.9	0	0	0	0	108.4	M452	M452-V454 PolarHBondContact O-N 2.96Å; M452-V454 VanDerWaalsContact O-N 3.11Å
455	Q	42.4	Very low	52.7	Low	173 Å²	173	102.4 Å²	102.4	81%	0.808	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-62	123.5	159.4	-70.9	-170.8	-22.5	0	0	106	T453 E457	T453-Q455 PolarHBondContact O-N 3.02Å; Q455-E457 PolarHBondContact O-N 2.96Å
456	P	43	Very low	54.9	Low	119 Å²	119	106.2 Å²	106.2	77%	0.773	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-58.8	126.7	-177.7	23.8	-33	0	0	0	108.7	D458	P456-D458 PolarHBondContact O-N 2.77Å
457	E	50.7	Low	57.7	Low	152 Å²	152	108.2 Å²	108.2	71%	0.71	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-55.2	128.1	178.3	-65.2	-169	137.6	0	0	109.2	Q455 S459 V462	Q455-E457 PolarHBondContact O-N 2.96Å; E457-S459 PolarHBondContact O-N 2.83Å; E457-V462 HydrophobicContact CB-CG2 3.74Å; E457-V462 WeakPolarHBondContact OE2-CG2 3.48Å
458	D	62.9	Low	60.4	Low	89 Å²	89	111.7 Å²	111.7	48%	0.476	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-53.2	120.1	175.3	162.2	33.3	0	0	0	108.8	P456 S460 S461 V462	P456-D458 PolarHBondContact O-N 2.77Å; D458-S460 PolarHBondContact O-N 2.87Å; D458-S460 VanDerWaalsContact O-N 3.11Å; D458-S460 WeakPolarHBondContact OD1-CB 3.46Å; D458-S460 PolarHBondContact OD1-N 3.34Å; D458-S460 VanDerWaalsContact OD2-CB 3.28Å; D458-S460 WeakPolarHBondContact OD2-CB 3.21Å; D458-S460 PolarHBondContact OD2-OG 3.4Å; D458-S461 WeakPolarHBondContact O-CA 3.34Å; D458-S461 WeakPolarHBondContact O-CB 3.25Å; D458-S461 PolarHBondContact O-N 3.44Å; D458-S461 PolarHBondContact O-OG 2.9Å; D458-S461 PolarHBondContact OD2-N 2.91Å; D458-V462 PolarHBondContact O-N 3.18Å; D458-V462 VanDerWaalsContact O-N 3.16Å
459	S	66.7	Low	63.3	Low	97 Å²	97	110 Å²	110	68%	0.678	60%	0.602	S	S	*	*	H	α-helix	trans	-58.6	-27.4	-178.2	60.2	0	0	0	0	112.1	E457 S461 F463	E457-S459 PolarHBondContact O-N 2.83Å; S459-S461 VanDerWaalsContact C-N 3.34Å; S459-F463 WeakPolarHBondContact O-CB 3.3Å; S459-F463 PolarHBondContact O-N 2.75Å
460	S	77.5	Confident	66.5	Low	42 Å²	42	109 Å²	109	29%	0.294	59%	0.586	S	S	.	*	H	α-helix	trans	-64.7	-38	172.3	108.6	0	0	0	0	111.8	D458 K464	D458-S460 PolarHBondContact O-N 2.87Å; D458-S460 VanDerWaalsContact O-N 3.11Å; D458-S460 WeakPolarHBondContact OD1-CB 3.46Å; D458-S460 PolarHBondContact OD1-N 3.34Å; D458-S460 VanDerWaalsContact OD2-CB 3.28Å; D458-S460 WeakPolarHBondContact OD2-CB 3.21Å; D458-S460 PolarHBondContact OD2-OG 3.4Å; S460-K464 WeakPolarHBondContact O-CB 3.43Å; S460-K464 VanDerWaalsContact O-CD 3.22Å; S460-K464 WeakPolarHBondContact O-CD 3.38Å; S460-K464 WeakPolarHBondContact O-CG 3.48Å; S460-K464 PolarHBondContact O-N 3.34Å; S460-K464 PolarHBondContact OG-NZ 2.72Å
461	S	78	Confident	69.8	Low	41 Å²	41	109.5 Å²	109.5	29%	0.287	58%	0.581	S	S	.	*	H	α-helix	trans	-70.7	-42.8	177.7	78.4	0	0	0	0	112	D458 S459 F463 K464 N465	D458-S461 WeakPolarHBondContact O-CA 3.34Å; D458-S461 WeakPolarHBondContact O-CB 3.25Å; D458-S461 PolarHBondContact O-N 3.44Å; D458-S461 PolarHBondContact O-OG 2.9Å; D458-S461 PolarHBondContact OD2-N 2.91Å; S459-S461 VanDerWaalsContact C-N 3.34Å; S461-F463 PolarHBondContact O-N 2.98Å; S461-K464 PolarHBondContact O-N 2.89Å; S461-N465 WeakPolarHBondContact O-CB 3.29Å; S461-N465 VanDerWaalsContact O-CG 3.27Å; S461-N465 PolarHBondContact O-N 2.82Å; S461-N465 PolarHBondContact O-ND2 3.28Å
462	V	83	Confident	72.9	Confident	42 Å²	42	105.3 Å²	105.3	26%	0.255	56%	0.564	S	S	.	*	H	α-helix	trans	-62.6	-43.8	176.7	-177.7	0	0	0	0	110.7	E457 D458 N465 K466	E457-V462 HydrophobicContact CB-CG2 3.74Å; E457-V462 WeakPolarHBondContact OE2-CG2 3.48Å; D458-V462 PolarHBondContact O-N 3.18Å; D458-V462 VanDerWaalsContact O-N 3.16Å; V462-N465 PolarHBondContact O-N 3.48Å; V462-K466 HydrophobicContact CG1-CD 4.45Å; V462-K466 WeakPolarHBondContact O-CB 3.45Å; V462-K466 WeakPolarHBondContact O-CG 3.18Å; V462-K466 PolarHBondContact O-N 3.46Å
463	F	91.6	Very high	75.9	Confident	135 Å²	135	103.1 Å²	103.1	59%	0.592	56%	0.558	S	S	*	*	H	α-helix	trans	-62.7	-48.6	174.7	178.5	-100.2	0	0	0	112	S459 S461 N465 K466 L467	S459-F463 WeakPolarHBondContact O-CB 3.3Å; S459-F463 PolarHBondContact O-N 2.75Å; S461-F463 PolarHBondContact O-N 2.98Å; F463-N465 VanDerWaalsContact C-N 3.31Å; F463-N465 PolarHBondContact O-N 3.06Å; F463-K466 PolarHBondContact O-N 2.68Å; F463-L467 HydrophobicContact CE1-CB 4.49Å; F463-L467 HydrophobicContact CE1-CD2 3.85Å; F463-L467 HydrophobicContact CZ-CD2 4.15Å; F463-L467 VanDerWaalsContact O-CB 3.28Å; F463-L467 WeakPolarHBondContact O-CB 3.48Å; F463-L467 PolarHBondContact O-N 2.98Å
464	K	91.7	Very high	78.9	Confident	123 Å²	123	100 Å²	100	54%	0.535	54%	0.541	S	S	.	.	H	α-helix	trans	-58.7	-41.2	178	-73.5	160.8	-170.2	158.5	0	112.1	S460 S461 R468	S460-K464 WeakPolarHBondContact O-CB 3.43Å; S460-K464 VanDerWaalsContact O-CD 3.22Å; S460-K464 WeakPolarHBondContact O-CD 3.38Å; S460-K464 WeakPolarHBondContact O-CG 3.48Å; S460-K464 PolarHBondContact O-N 3.34Å; S460-K464 PolarHBondContact OG-NZ 2.72Å; S461-K464 PolarHBondContact O-N 2.89Å; K464-R468 VanDerWaalsContact O-CB 3.3Å; K464-R468 WeakPolarHBondContact O-CB 3.19Å; K464-R468 PolarHBondContact O-N 3Å
465	N	87.7	Confident	81.7	Confident	110 Å²	110	99 Å²	99	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-67.2	-45.7	177.8	-72.9	-19.1	0	0	0	111.9	S461 V462 F463 R468 S469	S461-N465 WeakPolarHBondContact O-CB 3.29Å; S461-N465 VanDerWaalsContact O-CG 3.27Å; S461-N465 PolarHBondContact O-N 2.82Å; S461-N465 PolarHBondContact O-ND2 3.28Å; V462-N465 PolarHBondContact O-N 3.48Å; F463-N465 VanDerWaalsContact C-N 3.31Å; F463-N465 PolarHBondContact O-N 3.06Å; N465-R468 PolarHBondContact O-N 3.4Å; N465-S469 WeakPolarHBondContact O-CB 3.49Å; N465-S469 PolarHBondContact O-N 2.92Å
466	K	92.3	Very high	84.1	Confident	151 Å²	151	94.8 Å²	94.8	66%	0.657	52%	0.524	S	S	*	.	H	α-helix	trans	-62.7	-43.3	174.8	-75.2	-174.9	177.4	-176.9	0	112.2	V462 F463 S469 A470	V462-K466 HydrophobicContact CG1-CD 4.45Å; V462-K466 WeakPolarHBondContact O-CB 3.45Å; V462-K466 WeakPolarHBondContact O-CG 3.18Å; V462-K466 PolarHBondContact O-N 3.46Å; F463-K466 PolarHBondContact O-N 2.68Å; K466-S469 PolarHBondContact O-N 2.68Å; K466-A470 WeakPolarHBondContact O-CB 3.28Å; K466-A470 PolarHBondContact O-N 3.37Å
467	L	94.9	Very high	86.4	Confident	80 Å²	80	94.1 Å²	94.1	42%	0.419	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-45.1	177.2	179.7	61	0	0	0	111.6	F463 S469 A470 I471	F463-L467 HydrophobicContact CE1-CB 4.49Å; F463-L467 HydrophobicContact CE1-CD2 3.85Å; F463-L467 HydrophobicContact CZ-CD2 4.15Å; F463-L467 VanDerWaalsContact O-CB 3.28Å; F463-L467 WeakPolarHBondContact O-CB 3.48Å; F463-L467 PolarHBondContact O-N 2.98Å; L467-S469 VanDerWaalsContact C-N 3.33Å; L467-S469 PolarHBondContact O-N 3.15Å; L467-A470 PolarHBondContact O-N 3.35Å; L467-I471 HydrophobicContact CD1-CD1 3.89Å; L467-I471 HydrophobicContact CD1-CG1 4.2Å; L467-I471 HydrophobicContact CG-CD1 3.87Å; L467-I471 WeakPolarHBondContact O-CB 3.3Å; L467-I471 VanDerWaalsContact O-CG1 3.29Å; L467-I471 WeakPolarHBondContact O-CG1 3.35Å; L467-I471 PolarHBondContact O-N 3.16Å
468	R	92.8	Very high	88.4	Confident	198 Å²	198	90.8 Å²	90.8	75%	0.747	51%	0.507	S	S	*	.	H	α-helix	trans	-62.1	-40.6	176.1	-173.2	178	-176.6	178.7	2.3	112	K464 N465 S472	K464-R468 VanDerWaalsContact O-CB 3.3Å; K464-R468 WeakPolarHBondContact O-CB 3.19Å; K464-R468 PolarHBondContact O-N 3Å; N465-R468 PolarHBondContact O-N 3.4Å; R468-S472 WeakPolarHBondContact O-CB 3.33Å; R468-S472 PolarHBondContact O-N 2.88Å
469	S	92.5	Very high	89.7	Confident	71 Å²	71	88.5 Å²	88.5	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-50.6	174.5	-167.7	0	0	0	0	111.2	N465 K466 L467 I471 S472 T473	N465-S469 WeakPolarHBondContact O-CB 3.49Å; N465-S469 PolarHBondContact O-N 2.92Å; K466-S469 PolarHBondContact O-N 2.68Å; L467-S469 VanDerWaalsContact C-N 3.33Å; L467-S469 PolarHBondContact O-N 3.15Å; S469-I471 PolarHBondContact O-N 3.17Å; S469-S472 WeakPolarHBondContact O-CB 3.25Å; S469-S472 PolarHBondContact O-N 3.44Å; S469-S472 VanDerWaalsContact O-N 3.11Å; S469-T473 PolarHBondContact O-N 2.58Å; S469-T473 PolarHBondContact O-OG1 2.75Å
470	A	95.5	Very high	90.7	Very high	51 Å²	51	88.7 Å²	88.7	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-58.1	-46.7	178.9	0	0	0	0	0	112.3	K466 L467 S472 T473 S474	K466-A470 WeakPolarHBondContact O-CB 3.28Å; K466-A470 PolarHBondContact O-N 3.37Å; L467-A470 PolarHBondContact O-N 3.35Å; A470-S472 PolarHBondContact O-N 3.04Å; A470-T473 PolarHBondContact O-N 3.18Å; A470-S474 WeakPolarHBondContact O-CB 3.49Å; A470-S474 PolarHBondContact O-N 3.38Å; A470-S474 PolarHBondContact O-OG 3.22Å; A470-S474 VanDerWaalsContact O-OG 3.09Å
471	I	96.6	Very high	91.2	Very high	96 Å²	96	91.7 Å²	91.7	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-59.4	-46.1	174.8	-68.6	166.9	0	0	0	110.6	L467 S469 T473 S474 V475	L467-I471 HydrophobicContact CD1-CD1 3.89Å; L467-I471 HydrophobicContact CD1-CG1 4.2Å; L467-I471 HydrophobicContact CG-CD1 3.87Å; L467-I471 WeakPolarHBondContact O-CB 3.3Å; L467-I471 VanDerWaalsContact O-CG1 3.29Å; L467-I471 WeakPolarHBondContact O-CG1 3.35Å; L467-I471 PolarHBondContact O-N 3.16Å; S469-I471 PolarHBondContact O-N 3.17Å; I471-T473 PolarHBondContact O-N 3.38Å; I471-S474 PolarHBondContact O-N 3.2Å; I471-V475 HydrophobicContact CG2-CG2 4.41Å; I471-V475 WeakPolarHBondContact O-CB 3.35Å; I471-V475 VanDerWaalsContact O-CG2 3.32Å; I471-V475 WeakPolarHBondContact O-CG2 3.23Å; I471-V475 PolarHBondContact O-N 2.87Å
472	S	92.8	Very high	91.7	Very high	70 Å²	70	90.8 Å²	90.8	49%	0.49	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-44.7	178.8	-163.8	0	0	0	0	112	R468 S469 A470 V475 C476	R468-S472 WeakPolarHBondContact O-CB 3.33Å; R468-S472 PolarHBondContact O-N 2.88Å; S469-S472 WeakPolarHBondContact O-CB 3.25Å; S469-S472 PolarHBondContact O-N 3.44Å; S469-S472 VanDerWaalsContact O-N 3.11Å; A470-S472 PolarHBondContact O-N 3.04Å; S472-V475 PolarHBondContact O-N 2.85Å; S472-C476 PolarHBondContact O-N 3.34Å; S472-C476 PolarHBondContact O-SG 3.4Å
473	T	93.9	Very high	91.9	Very high	71 Å²	71	92.7 Å²	92.7	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-44.7	176.4	-58.6	0	0	0	0	111.5	S469 A470 I471 V475 C476 L477	S469-T473 PolarHBondContact O-N 2.58Å; S469-T473 PolarHBondContact O-OG1 2.75Å; A470-T473 PolarHBondContact O-N 3.18Å; I471-T473 PolarHBondContact O-N 3.38Å; T473-V475 VanDerWaalsContact C-N 3.34Å; T473-V475 PolarHBondContact O-N 3.09Å; T473-C476 PolarHBondContact O-N 3.07Å; T473-L477 HydrophobicContact CG2-CD1 3.83Å; T473-L477 HydrophobicContact CG2-CG 4.28Å; T473-L477 WeakPolarHBondContact O-CB 3.37Å; T473-L477 WeakPolarHBondContact O-CG 3.41Å; T473-L477 PolarHBondContact O-N 3.29Å
474	S	95.1	Very high	91.6	Very high	69 Å²	69	88.6 Å²	88.6	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-40.1	176.7	-66.9	0	0	0	0	112.3	A470 I471 S478	A470-S474 WeakPolarHBondContact O-CB 3.49Å; A470-S474 PolarHBondContact O-N 3.38Å; A470-S474 PolarHBondContact O-OG 3.22Å; A470-S474 VanDerWaalsContact O-OG 3.09Å; I471-S474 PolarHBondContact O-N 3.2Å; S474-S478 WeakPolarHBondContact O-CB 3.44Å; S474-S478 PolarHBondContact O-N 3.15Å; S474-S478 PolarHBondContact O-OG 3.47Å
475	V	95.2	Very high	91.2	Very high	98 Å²	98	89.4 Å²	89.4	59%	0.594	52%	0.524	S	S	*	.	H	α-helix	trans	-65.6	-46.1	175.7	169.1	0	0	0	0	111	I471 S472 T473 S478 G479	I471-V475 HydrophobicContact CG2-CG2 4.41Å; I471-V475 WeakPolarHBondContact O-CB 3.35Å; I471-V475 VanDerWaalsContact O-CG2 3.32Å; I471-V475 WeakPolarHBondContact O-CG2 3.23Å; I471-V475 PolarHBondContact O-N 2.87Å; S472-V475 PolarHBondContact O-N 2.85Å; T473-V475 VanDerWaalsContact C-N 3.34Å; T473-V475 PolarHBondContact O-N 3.09Å; V475-S478 PolarHBondContact O-N 2.82Å; V475-G479 PolarHBondContact O-N 2.79Å
476	C	91	Very high	90.9	Very high	86 Å²	86	93.7 Å²	93.7	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-63	-44.1	177.8	-68.6	0	0	0	0	112.8	S472 T473 G479 L480	S472-C476 PolarHBondContact O-N 3.34Å; S472-C476 PolarHBondContact O-SG 3.4Å; T473-C476 PolarHBondContact O-N 3.07Å; C476-G479 PolarHBondContact O-N 3.2Å; C476-L480 PolarHBondContact O-N 3.03Å
477	L	92	Very high	90.6	Very high	105 Å²	105	88.2 Å²	88.2	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-42.4	177.9	-68.9	175.2	0	0	0	111.9	T473 G479 L480 V481	T473-L477 HydrophobicContact CG2-CD1 3.83Å; T473-L477 HydrophobicContact CG2-CG 4.28Å; T473-L477 WeakPolarHBondContact O-CB 3.37Å; T473-L477 WeakPolarHBondContact O-CG 3.41Å; T473-L477 PolarHBondContact O-N 3.29Å; L477-G479 VanDerWaalsContact C-N 3.31Å; L477-G479 PolarHBondContact O-N 3.2Å; L477-L480 PolarHBondContact O-N 2.99Å; L477-V481 WeakPolarHBondContact O-CG2 3.2Å; L477-V481 PolarHBondContact O-N 3.02Å
478	S	93.6	Very high	90.1	Very high	82 Å²	82	86.7 Å²	86.7	57%	0.573	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-38.3	175.4	-56	0	0	0	0	111.7	S474 V475 V481 G482	S474-S478 WeakPolarHBondContact O-CB 3.44Å; S474-S478 PolarHBondContact O-N 3.15Å; S474-S478 PolarHBondContact O-OG 3.47Å; V475-S478 PolarHBondContact O-N 2.82Å; S478-V481 PolarHBondContact O-N 2.9Å; S478-G482 PolarHBondContact O-N 2.98Å
479	G	89.9	Confident	89.8	Confident	41 Å²	41	79.5 Å²	79.5	42%	0.423	49%	0.489	S	S	.	.	H	α-helix	trans	-64.1	-41.4	174.3	0	0	0	0	0	112.8	V475 C476 L477 G482 L483	V475-G479 PolarHBondContact O-N 2.79Å; C476-G479 PolarHBondContact O-N 3.2Å; L477-G479 VanDerWaalsContact C-N 3.31Å; L477-G479 PolarHBondContact O-N 3.2Å; G479-G482 WeakPolarHBondContact O-CA 3.5Å; G479-G482 PolarHBondContact O-N 2.67Å; G479-L483 PolarHBondContact O-N 2.7Å
480	L	87.4	Confident	89.5	Confident	100 Å²	100	81.3 Å²	81.3	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176.4	-175.3	63.7	0	0	0	112.2	C476 L477 G482 L483 L496	C476-L480 PolarHBondContact O-N 3.03Å; L477-L480 PolarHBondContact O-N 2.99Å; L480-G482 VanDerWaalsContact C-N 3.32Å; L480-L483 PolarHBondContact O-N 3.25Å; L480-L496 HydrophobicContact CD1-CD2 4.24Å
481	V	88.7	Confident	89.1	Confident	105 Å²	105	80.5 Å²	80.5	64%	0.636	49%	0.493	S	S	*	.	H	α-helix	trans	-65.1	-38.3	171.8	175	0	0	0	0	110.9	L477 S478 L483 G484 L485	L477-V481 WeakPolarHBondContact O-CG2 3.2Å; L477-V481 PolarHBondContact O-N 3.02Å; S478-V481 PolarHBondContact O-N 2.9Å; V481-L483 VanDerWaalsContact C-N 3.35Å; V481-L483 PolarHBondContact O-N 3.11Å; V481-G484 WeakPolarHBondContact O-CA 3.47Å; V481-G484 PolarHBondContact O-N 2.84Å; V481-L485 PolarHBondContact O-N 3.4Å
482	G	88	Confident	88.8	Confident	22 Å²	22	77.3 Å²	77.3	23%	0.227	48%	0.475	C	S	.	.	H	α-helix	trans	-60.1	-38.3	175.2	0	0	0	0	0	113.7	S478 G479 L480 G484 L485 Y486	S478-G482 PolarHBondContact O-N 2.98Å; G479-G482 WeakPolarHBondContact O-CA 3.5Å; G479-G482 PolarHBondContact O-N 2.67Å; L480-G482 VanDerWaalsContact C-N 3.32Å; G482-G484 PolarHBondContact O-N 2.85Å; G482-L485 WeakPolarHBondContact O-CB 3.42Å; G482-L485 PolarHBondContact O-N 3.46Å; G482-L485 VanDerWaalsContact O-N 3.11Å; G482-Y486 WeakPolarHBondContact O-CD2 3.39Å
483	L	86.9	Confident	88.7	Confident	82 Å²	82	77 Å²	77	43%	0.429	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-28.8	172	-70	174.1	0	0	0	112.5	G479 L480 V481 Y486 S487 L496	G479-L483 PolarHBondContact O-N 2.7Å; L480-L483 PolarHBondContact O-N 3.25Å; V481-L483 VanDerWaalsContact C-N 3.35Å; V481-L483 PolarHBondContact O-N 3.11Å; L483-Y486 PolarHBondContact O-N 3.09Å; L483-S487 PolarHBondContact O-N 3.34Å; L483-L496 HydrophobicContact CB-CD2 4.14Å; L483-L496 HydrophobicContact CD1-CD1 4.39Å; L483-L496 HydrophobicContact CD1-CD2 4.09Å
484	G	84.7	Confident	88.7	Confident	49 Å²	49	78 Å²	78	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-67	-35	173.2	0	0	0	0	0	113.4	V481 G482 Y486 S487	V481-G484 WeakPolarHBondContact O-CA 3.47Å; V481-G484 PolarHBondContact O-N 2.84Å; G482-G484 PolarHBondContact O-N 2.85Å; G484-Y486 PolarHBondContact O-N 3.19Å; G484-S487 WeakPolarHBondContact O-CB 3.49Å; G484-S487 PolarHBondContact O-N 3.34Å
485	L	84.5	Confident	88.7	Confident	140 Å²	140	75.1 Å²	75.1	73%	0.733	46%	0.455	S	S	*	.	H	α-helix	trans	-67.9	-23.8	178.2	-60.8	176.4	0	0	0	113.3	V481 G482	V481-L485 PolarHBondContact O-N 3.4Å; G482-L485 WeakPolarHBondContact O-CB 3.42Å; G482-L485 PolarHBondContact O-N 3.46Å; G482-L485 VanDerWaalsContact O-N 3.11Å
486	Y	79.9	Confident	88.6	Confident	201 Å²	201	72.1 Å²	72.1	79%	0.788	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	18.2	178.6	-60.4	-74.8	0	0	0	112.6	G482 L483 G484 P488	G482-Y486 WeakPolarHBondContact O-CD2 3.39Å; L483-Y486 PolarHBondContact O-N 3.09Å; G484-Y486 PolarHBondContact O-N 3.19Å; Y486-P488 WeakPolarHBondContact O-CD 3.45Å
487	S	86.6	Confident	88.8	Confident	36 Å²	36	72 Å²	72	25%	0.252	43%	0.433	S	S	.	.			trans	-68.8	118.6	176.7	-175.3	0	0	0	0	110.2	L483 G484 S489 F492 T493	L483-S487 PolarHBondContact O-N 3.34Å; G484-S487 WeakPolarHBondContact O-CB 3.49Å; G484-S487 PolarHBondContact O-N 3.34Å; S487-S489 VanDerWaalsContact C-N 3.35Å; S487-S489 PolarHBondContact OG-O 2.9Å; S487-S489 VanDerWaalsContact OG-O 3.14Å; S487-F492 WeakPolarHBondContact OG-CD1 3.49Å; S487-T493 PolarHBondContact OG-OG1 3.02Å
488	P	85.1	Confident	88.9	Confident	47 Å²	47	68.9 Å²	68.9	31%	0.305	42%	0.418	S	S	.	.			trans	-78.3	-20.2	-176.8	32.2	-36.6	0	0	0	113	Y486 F492 G736 L740	Y486-P488 WeakPolarHBondContact O-CD 3.45Å; P488-F492 HydrophobicContact CG-CB 4.12Å; P488-F492 HydrophobicContact CG-CG 4.43Å; P488-G736 WeakPolarHBondContact CB-O 3.48Å; P488-L740 HydrophobicContact CG-CB 4.15Å; P488-L740 HydrophobicContact CG-CD2 3.92Å
489	S	85	Confident	89.1	Confident	47 Å²	47	67.6 Å²	67.6	33%	0.329	40%	0.402	S	S	.	.	S	Bend	trans	-163	158.8	179.7	71.9	0	0	0	0	111.3	S487 A491 F492	S487-S489 VanDerWaalsContact C-N 3.35Å; S487-S489 PolarHBondContact OG-O 2.9Å; S487-S489 VanDerWaalsContact OG-O 3.14Å; S489-A491 PolarHBondContact O-N 3.11Å; S489-A491 VanDerWaalsContact O-N 3.13Å; S489-A491 PolarHBondContact OG-N 2.97Å; S489-F492 PolarHBondContact O-N 3.47Å; S489-F492 VanDerWaalsContact O-N 3.1Å
490	P	87	Confident	89.3	Confident	109 Å²	109	67.2 Å²	67.2	71%	0.708	40%	0.398	S	S	*	.	H	α-helix	trans	-56.1	-28.6	173.6	-26.5	35.7	0	0	0	113.8	F492 T493 T494	P490-F492 PolarHBondContact O-N 2.96Å; P490-T493 PolarHBondContact O-N 2.87Å; P490-T494 PolarHBondContact O-N 2.91Å; P490-T494 PolarHBondContact O-OG1 3.05Å
491	A	87.9	Confident	89.8	Confident	35 Å²	35	67.6 Å²	67.6	29%	0.289	40%	0.4	S	S	.	.	H	α-helix	trans	-63.2	-39.7	177.2	0	0	0	0	0	112.3	S489 T493 T494 M495	S489-A491 PolarHBondContact O-N 3.11Å; S489-A491 VanDerWaalsContact O-N 3.13Å; S489-A491 PolarHBondContact OG-N 2.97Å; A491-T493 PolarHBondContact O-N 3.11Å; A491-T494 PolarHBondContact O-N 3.41Å; A491-M495 WeakPolarHBondContact O-CB 3.34Å; A491-M495 PolarHBondContact O-N 3.44Å
492	F	90.4	Very high	90.2	Very high	29 Å²	29	63 Å²	63	13%	0.127	37%	0.373	C	S	.	.	H	α-helix	trans	-61.4	-44.2	173.6	175	-101	0	0	0	111.5	S487 P488 S489 P490 T494 M495 L496 L740 F857	S487-F492 WeakPolarHBondContact OG-CD1 3.49Å; P488-F492 HydrophobicContact CG-CB 4.12Å; P488-F492 HydrophobicContact CG-CG 4.43Å; S489-F492 PolarHBondContact O-N 3.47Å; S489-F492 VanDerWaalsContact O-N 3.1Å; P490-F492 PolarHBondContact O-N 2.96Å; F492-T494 PolarHBondContact O-N 2.96Å; F492-M495 PolarHBondContact O-N 2.88Å; F492-L496 HydrophobicContact CE1-CD2 4.19Å; F492-L496 HydrophobicContact CZ-CD2 4.49Å; F492-L496 WeakPolarHBondContact O-CB 3.26Å; F492-L496 PolarHBondContact O-N 3.1Å; F492-L740 HydrophobicContact CB-CD2 4.27Å; F492-L740 HydrophobicContact CD2-CD1 3.67Å; F492-L740 HydrophobicContact CD2-CD2 3.78Å; F492-L740 HydrophobicContact CD2-CG 4.42Å; F492-L740 HydrophobicContact CE2-CD1 3.7Å; F492-L740 HydrophobicContact CG-CD2 4.36Å; F492-F857 HydrophobicContact CD2-CD1 4.05Å; F492-F857 HydrophobicContact CD2-CE1 4.07Å; F492-F857 HydrophobicContact CE2-CD1 4.06Å; F492-F857 AromaticContact CE2-CE1 3.9Å; F492-F857 HydrophobicContact CE2-CE1 3.9Å
493	T	90.9	Very high	90.5	Very high	64 Å²	64	63 Å²	63	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-43.8	177	-50.7	0	0	0	0	111.6	S487 P490 A491 L496 T497	S487-T493 PolarHBondContact OG-OG1 3.02Å; P490-T493 PolarHBondContact O-N 2.87Å; A491-T493 PolarHBondContact O-N 3.11Å; T493-L496 PolarHBondContact O-N 3.16Å; T493-T497 PolarHBondContact O-N 2.88Å; T493-T497 PolarHBondContact O-OG1 3.47Å; T493-T497 VanDerWaalsContact O-OG1 3.08Å
494	T	93.2	Very high	91	Very high	90 Å²	90	63.9 Å²	63.9	55%	0.552	37%	0.373	S	S	*	.	H	α-helix	trans	-62.6	-41.4	175.1	-61.5	0	0	0	0	112.2	P490 A491 F492 T497 T498	P490-T494 PolarHBondContact O-N 2.91Å; P490-T494 PolarHBondContact O-OG1 3.05Å; A491-T494 PolarHBondContact O-N 3.41Å; F492-T494 PolarHBondContact O-N 2.96Å; T494-T497 PolarHBondContact O-N 3.46Å; T494-T498 WeakPolarHBondContact O-CB 3.35Å; T494-T498 PolarHBondContact O-N 3.09Å; T494-T498 PolarHBondContact O-OG1 2.86Å
495	M	94.1	Very high	91.5	Very high	9 Å²	9	64.2 Å²	64.2	4%	0.044	37%	0.366	C	S	.	.	H	α-helix	trans	-68.4	-38.4	177	-162.2	61.4	67.7	0	0	111.7	A491 F492 T498 F499 F857 N860 T865	A491-M495 WeakPolarHBondContact O-CB 3.34Å; A491-M495 PolarHBondContact O-N 3.44Å; F492-M495 PolarHBondContact O-N 2.88Å; M495-T498 WeakPolarHBondContact O-CB 3.24Å; M495-T498 PolarHBondContact O-N 2.97Å; M495-F499 VanDerWaalsContact O-CB 3.32Å; M495-F499 WeakPolarHBondContact O-CB 3.39Å; M495-F499 PolarHBondContact O-N 2.82Å; M495-F857 HydrophobicContact CB-CD1 3.91Å; M495-F857 HydrophobicContact CB-CE1 3.7Å; M495-F857 HydrophobicContact CB-CZ 4.43Å; M495-F857 HydrophobicContact CG-CD1 3.57Å; M495-F857 HydrophobicContact CG-CD2 4.43Å; M495-F857 HydrophobicContact CG-CE1 3.62Å; M495-F857 HydrophobicContact CG-CE2 4.46Å; M495-F857 HydrophobicContact CG-CG 4.01Å; M495-F857 HydrophobicContact CG-CZ 4.08Å; M495-N860 WeakPolarHBondContact CE-OD1 3.32Å; M495-T865 HydrophobicContact CG-CG2 4.17Å; M495-T865 VanDerWaalsContact SD-CB 3.59Å; M495-T865 HydrophobicContact SD-CG2 3.82Å; M495-T865 PolarHBondContact SD-OG1 3.4Å
496	L	93.6	Very high	92.1	Very high	36 Å²	36	57.6 Å²	57.6	19%	0.188	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-40.1	174.3	-176.2	62.2	0	0	0	112.2	L480 L483 F492 T493 G500 F857	L480-L496 HydrophobicContact CD1-CD2 4.24Å; L483-L496 HydrophobicContact CB-CD2 4.14Å; L483-L496 HydrophobicContact CD1-CD1 4.39Å; L483-L496 HydrophobicContact CD1-CD2 4.09Å; F492-L496 HydrophobicContact CE1-CD2 4.19Å; F492-L496 HydrophobicContact CZ-CD2 4.49Å; F492-L496 WeakPolarHBondContact O-CB 3.26Å; F492-L496 PolarHBondContact O-N 3.1Å; T493-L496 PolarHBondContact O-N 3.16Å; L496-G500 PolarHBondContact O-N 3.01Å; L496-F857 HydrophobicContact CB-CE1 4.4Å; L496-F857 HydrophobicContact CB-CZ 4.48Å; L496-F857 HydrophobicContact CD1-CZ 4.42Å
497	T	94.8	Very high	92.8	Very high	83 Å²	83	53.7 Å²	53.7	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-44.8	171.1	-59.8	0	0	0	0	111.3	T493 T494 G500 L501	T493-T497 PolarHBondContact O-N 2.88Å; T493-T497 PolarHBondContact O-OG1 3.47Å; T493-T497 VanDerWaalsContact O-OG1 3.08Å; T494-T497 PolarHBondContact O-N 3.46Å; T497-G500 PolarHBondContact O-N 3.31Å; T497-L501 HydrophobicContact CG2-CD1 4.15Å; T497-L501 WeakPolarHBondContact O-CG 3.47Å; T497-L501 PolarHBondContact O-N 2.98Å
498	T	95.9	Very high	93.2	Very high	40 Å²	40	58 Å²	58	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-47.2	177.7	-58.3	0	0	0	0	111.3	T494 M495 L501 S502 V866	T494-T498 WeakPolarHBondContact O-CB 3.35Å; T494-T498 PolarHBondContact O-N 3.09Å; T494-T498 PolarHBondContact O-OG1 2.86Å; M495-T498 WeakPolarHBondContact O-CB 3.24Å; M495-T498 PolarHBondContact O-N 2.97Å; T498-L501 PolarHBondContact O-N 3.11Å; T498-S502 WeakPolarHBondContact O-CB 3.39Å; T498-S502 PolarHBondContact O-N 3.44Å; T498-S502 PolarHBondContact O-OG 2.9Å; T498-V866 HydrophobicContact CG2-CG2 3.59Å
499	F	96.2	Very high	93.7	Very high	54 Å²	54	56.7 Å²	56.7	24%	0.237	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-41.8	175.8	174.5	-101.7	0	0	0	113.2	M495 S502 S503 W850 C853 F857 T865 A869	M495-F499 VanDerWaalsContact O-CB 3.32Å; M495-F499 WeakPolarHBondContact O-CB 3.39Å; M495-F499 PolarHBondContact O-N 2.82Å; F499-S502 WeakPolarHBondContact CA-OG 3.15Å; F499-S502 PolarHBondContact O-OG 2.67Å; F499-S502 VanDerWaalsContact O-OG 3.1Å; F499-S503 VanDerWaalsContact O-CB 3.27Å; F499-S503 WeakPolarHBondContact O-CB 3.35Å; F499-S503 PolarHBondContact O-N 3.1Å; F499-S503 PolarHBondContact O-OG 2.91Å; F499-W850 HydrophobicContact CE2-CE3 4.09Å; F499-W850 AromaticContact CE2-CZ3 3.79Å; F499-W850 HydrophobicContact CE2-CZ3 3.79Å; F499-W850 HydrophobicContact CZ-CE3 4.31Å; F499-W850 AromaticContact CZ-CZ3 3.92Å; F499-W850 HydrophobicContact CZ-CZ3 3.92Å; F499-C853 HydrophobicContact CD2-CB 4.44Å; F499-C853 HydrophobicContact CE2-CB 4.18Å; F499-F857 HydrophobicContact CB-CE2 3.94Å; F499-F857 HydrophobicContact CB-CZ 3.87Å; F499-F857 HydrophobicContact CD2-CE2 4.07Å; F499-F857 AromaticContact CG-CE2 3.93Å; F499-F857 HydrophobicContact CG-CE2 3.93Å; F499-F857 HydrophobicContact CG-CZ 4.18Å; F499-T865 HydrophobicContact CB-CG2 3.71Å; F499-T865 HydrophobicContact CD2-CG2 4.18Å; F499-T865 HydrophobicContact CG-CG2 4.45Å; F499-A869 HydrophobicContact CD2-CB 4.19Å; F499-A869 HydrophobicContact CE2-CB 4.27Å
500	G	94.8	Very high	94.1	Very high	33 Å²	33	54.6 Å²	54.6	34%	0.34	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-46.8	176.8	0	0	0	0	0	112.1	L496 T497 S503 I504	L496-G500 PolarHBondContact O-N 3.01Å; T497-G500 PolarHBondContact O-N 3.31Å; G500-S503 PolarHBondContact O-N 2.8Å; G500-I504 WeakPolarHBondContact O-CG1 3.49Å; G500-I504 PolarHBondContact O-N 3.16Å
501	L	97.3	Very high	94.4	Very high	108 Å²	108	54.7 Å²	54.7	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-67.3	-43.5	178.2	-67.2	174	0	0	0	112.1	T497 T498 S503 I504 V505	T497-L501 HydrophobicContact CG2-CD1 4.15Å; T497-L501 WeakPolarHBondContact O-CG 3.47Å; T497-L501 PolarHBondContact O-N 2.98Å; T498-L501 PolarHBondContact O-N 3.11Å; L501-S503 VanDerWaalsContact C-N 3.32Å; L501-S503 PolarHBondContact O-N 3.15Å; L501-I504 PolarHBondContact O-N 3.38Å; L501-V505 WeakPolarHBondContact O-CG2 3.48Å; L501-V505 PolarHBondContact O-N 3.14Å
502	S	96.9	Very high	94.6	Very high	8 Å²	8	55 Å²	55	6%	0.056	30%	0.301	C	S	.	.	H	α-helix	trans	-66.2	-33.1	178	62.3	0	0	0	0	112.8	T498 F499 V505 G506 A869	T498-S502 WeakPolarHBondContact O-CB 3.39Å; T498-S502 PolarHBondContact O-N 3.44Å; T498-S502 PolarHBondContact O-OG 2.9Å; F499-S502 WeakPolarHBondContact CA-OG 3.15Å; F499-S502 PolarHBondContact O-OG 2.67Å; F499-S502 VanDerWaalsContact O-OG 3.1Å; S502-V505 PolarHBondContact O-N 3.34Å; S502-G506 PolarHBondContact O-N 3.07Å; S502-A869 WeakPolarHBondContact OG-CB 3.32Å
503	S	95.9	Very high	94.8	Very high	24 Å²	24	54 Å²	54	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-40.8	172.9	-62.6	0	0	0	0	112.3	F499 G500 L501 G506 Y507 S873	F499-S503 VanDerWaalsContact O-CB 3.27Å; F499-S503 WeakPolarHBondContact O-CB 3.35Å; F499-S503 PolarHBondContact O-N 3.1Å; F499-S503 PolarHBondContact O-OG 2.91Å; G500-S503 PolarHBondContact O-N 2.8Å; L501-S503 VanDerWaalsContact C-N 3.32Å; L501-S503 PolarHBondContact O-N 3.15Å; S503-G506 PolarHBondContact O-N 2.95Å; S503-Y507 WeakPolarHBondContact O-CB 3.38Å; S503-Y507 PolarHBondContact O-N 3.04Å; S503-S873 PolarHBondContact O-OG 2.7Å
504	I	96	Very high	94.9	Very high	99 Å²	99	53.1 Å²	53.1	51%	0.508	29%	0.292	S	S	.	.	H	α-helix	trans	-67.1	-45.3	175.9	-67.2	165.4	0	0	0	110.6	G500 L501 Y507 H508	G500-I504 WeakPolarHBondContact O-CG1 3.49Å; G500-I504 PolarHBondContact O-N 3.16Å; L501-I504 PolarHBondContact O-N 3.38Å; I504-Y507 PolarHBondContact O-N 3.29Å; I504-H508 PolarHBondContact O-CD2 2.95Å; I504-H508 VanDerWaalsContact O-CD2 3.31Å; I504-H508 PolarHBondContact O-N 3.47Å; I504-H508 VanDerWaalsContact O-N 3.13Å
505	V	96.6	Very high	94.7	Very high	57 Å²	57	51.5 Å²	51.5	35%	0.345	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-47.8	174.4	171.1	0	0	0	0	110.5	L501 S502 Y507 H508 T509 I631	L501-V505 WeakPolarHBondContact O-CG2 3.48Å; L501-V505 PolarHBondContact O-N 3.14Å; S502-V505 PolarHBondContact O-N 3.34Å; V505-Y507 VanDerWaalsContact C-N 3.33Å; V505-Y507 PolarHBondContact O-N 3.17Å; V505-H508 PolarHBondContact O-N 2.98Å; V505-T509 VanDerWaalsContact O-CB 3.28Å; V505-T509 WeakPolarHBondContact O-CB 3.48Å; V505-T509 PolarHBondContact O-N 3.07Å; V505-T509 PolarHBondContact O-OG1 3.23Å; V505-T509 VanDerWaalsContact O-OG1 3.09Å; V505-I631 HydrophobicContact CG1-CD1 4.03Å; V505-I631 HydrophobicContact CG1-CG1 4.14Å; V505-I631 HydrophobicContact CG1-CG2 3.67Å
506	G	95.6	Very high	94.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-40.1	177.8	0	0	0	0	0	113.3	S502 S503 V510	S502-G506 PolarHBondContact O-N 3.07Å; S503-G506 PolarHBondContact O-N 2.95Å; G506-V510 WeakPolarHBondContact O-CB 3.46Å; G506-V510 WeakPolarHBondContact O-CG2 3.19Å; G506-V510 PolarHBondContact O-N 3.38Å; G506-V510 VanDerWaalsContact O-N 3.1Å
507	Y	95.5	Very high	94.5	Very high	120 Å²	120	50.2 Å²	50.2	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-58.8	-52.8	174.6	177.8	-90.1	0	0	0	111.8	S503 I504 V505 W511 I877	S503-Y507 WeakPolarHBondContact O-CB 3.38Å; S503-Y507 PolarHBondContact O-N 3.04Å; I504-Y507 PolarHBondContact O-N 3.29Å; V505-Y507 VanDerWaalsContact C-N 3.33Å; V505-Y507 PolarHBondContact O-N 3.17Å; Y507-W511 AromaticContact CD2-NE1 3.92Å; Y507-W511 AromaticContact CE1-CD1 3.76Å; Y507-W511 AromaticContact CE2-CD1 3.74Å; Y507-W511 AromaticContact CE2-NE1 3.35Å; Y507-W511 VanDerWaalsContact CE2-NE1 3.35Å; Y507-W511 AromaticContact CZ-CD1 3.61Å; Y507-W511 AromaticContact CZ-NE1 3.44Å; Y507-W511 VanDerWaalsContact O-CD1 3.27Å; Y507-W511 PolarHBondContact O-N 3.11Å; Y507-I877 HydrophobicContact CD2-CD1 3.87Å; Y507-I877 HydrophobicContact CD2-CG1 4.47Å; Y507-I877 HydrophobicContact CE2-CD1 4.5Å; Y507-I877 HydrophobicContact CG-CD1 4.33Å
508	H	95.2	Very high	94.3	Very high	126 Å²	126	47.1 Å²	47.1	58%	0.583	26%	0.258	S	S	*	.	H	α-helix	trans	-70.6	-39	-178.3	-74.3	-69.3	0	0	0	113.2	I504 V505 V510 G512	I504-H508 PolarHBondContact O-CD2 2.95Å; I504-H508 VanDerWaalsContact O-CD2 3.31Å; I504-H508 PolarHBondContact O-N 3.47Å; I504-H508 VanDerWaalsContact O-N 3.13Å; V505-H508 PolarHBondContact O-N 2.98Å; H508-V510 VanDerWaalsContact C-N 3.35Å; H508-V510 PolarHBondContact O-N 3.31Å; H508-G512 PolarHBondContact O-N 3.12Å
509	T	94.5	Very high	94.1	Very high	19 Å²	19	45.3 Å²	45.3	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-42.8	177.4	-70.6	0	0	0	0	111.7	V505 G512 L634 T635 L870	V505-T509 VanDerWaalsContact O-CB 3.28Å; V505-T509 WeakPolarHBondContact O-CB 3.48Å; V505-T509 PolarHBondContact O-N 3.07Å; V505-T509 PolarHBondContact O-OG1 3.23Å; V505-T509 VanDerWaalsContact O-OG1 3.09Å; T509-G512 PolarHBondContact O-N 2.69Å; T509-L634 HydrophobicContact CG2-CB 3.59Å; T509-T635 WeakPolarHBondContact CG2-OG1 3.38Å; T509-L870 HydrophobicContact CG2-CD1 4.31Å
510	V	93.6	Very high	93.9	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-74.2	-42	-177.4	172.9	0	0	0	0	111.9	G506 H508 G512 V513 L521 L634 I877	G506-V510 WeakPolarHBondContact O-CB 3.46Å; G506-V510 WeakPolarHBondContact O-CG2 3.19Å; G506-V510 PolarHBondContact O-N 3.38Å; G506-V510 VanDerWaalsContact O-N 3.1Å; H508-V510 VanDerWaalsContact C-N 3.35Å; H508-V510 PolarHBondContact O-N 3.31Å; V510-G512 PolarHBondContact O-N 2.91Å; V510-G512 VanDerWaalsContact O-N 3.15Å; V510-V513 WeakPolarHBondContact O-CB 3.37Å; V510-V513 PolarHBondContact O-N 3.19Å; V510-L521 HydrophobicContact CG1-CD2 4.14Å; V510-L634 HydrophobicContact CG2-CD2 4.21Å; V510-I877 HydrophobicContact CB-CD1 3.93Å; V510-I877 HydrophobicContact CG1-CB 3.87Å; V510-I877 HydrophobicContact CG1-CD1 4.03Å; V510-I877 HydrophobicContact CG1-CG2 3.77Å
511	W	93.4	Very high	93.9	Very high	111 Å²	111	41.1 Å²	41.1	42%	0.42	22%	0.22	S	C	.	.	H	α-helix	trans	-62.4	-19.1	174.4	-83.3	115	0	0	0	113.5	Y507 I877 Y880 I881	Y507-W511 AromaticContact CD2-NE1 3.92Å; Y507-W511 AromaticContact CE1-CD1 3.76Å; Y507-W511 AromaticContact CE2-CD1 3.74Å; Y507-W511 AromaticContact CE2-NE1 3.35Å; Y507-W511 VanDerWaalsContact CE2-NE1 3.35Å; Y507-W511 AromaticContact CZ-CD1 3.61Å; Y507-W511 AromaticContact CZ-NE1 3.44Å; Y507-W511 VanDerWaalsContact O-CD1 3.27Å; Y507-W511 PolarHBondContact O-N 3.11Å; W511-I877 HydrophobicContact CD2-CG2 3.97Å; W511-I877 HydrophobicContact CE3-CG2 4.42Å; W511-I877 HydrophobicContact CG-CD1 4.42Å; W511-I877 HydrophobicContact CG-CG2 4.4Å; W511-I877 HydrophobicContact CH2-CG2 4.4Å; W511-I877 HydrophobicContact CZ2-CG2 3.95Å; W511-Y880 HydrophobicContact CH2-CD1 4.02Å; W511-Y880 HydrophobicContact CH2-CE1 4.12Å; W511-Y880 HydrophobicContact CZ2-CD1 4.01Å; W511-Y880 HydrophobicContact CZ2-CE1 4.24Å; W511-I881 HydrophobicContact CE3-CD1 4.37Å; W511-I881 HydrophobicContact CH2-CD1 4.11Å; W511-I881 HydrophobicContact CH2-CG1 3.79Å; W511-I881 HydrophobicContact CZ3-CD1 3.83Å; W511-I881 HydrophobicContact CZ3-CG1 3.93Å
512	G	92.7	Very high	93.6	Very high	42 Å²	42	36 Å²	36	43%	0.433	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.8	173.4	0	0	0	0	0	115.5	H508 T509 V510 S638	H508-G512 PolarHBondContact O-N 3.12Å; T509-G512 PolarHBondContact O-N 2.69Å; V510-G512 PolarHBondContact O-N 2.91Å; V510-G512 VanDerWaalsContact O-N 3.15Å; G512-S638 WeakPolarHBondContact O-CA 3.49Å; G512-S638 WeakPolarHBondContact O-CB 3.38Å
513	V	94	Very high	93.3	Very high	9 Å²	9	35.7 Å²	35.7	6%	0.055	19%	0.191	C	C	.	.	S	Bend	trans	-75.9	138.2	-179	170.5	0	0	0	0	111.3	V510 L517 L521 L637	V510-V513 WeakPolarHBondContact O-CB 3.37Å; V510-V513 PolarHBondContact O-N 3.19Å; V513-L517 HydrophobicContact CG1-CB 4.2Å; V513-L521 HydrophobicContact CB-CD2 4.34Å; V513-L521 HydrophobicContact CG1-CB 4.41Å; V513-L521 HydrophobicContact CG1-CD2 4.12Å; V513-L521 HydrophobicContact CG2-CD1 4.4Å; V513-L521 HydrophobicContact CG2-CD2 4.23Å; V513-L637 HydrophobicContact CG1-CB 4.02Å; V513-L637 HydrophobicContact CG2-CB 4.08Å
514	T	92.4	Very high	93.2	Very high	44 Å²	44	34.6 Å²	34.6	27%	0.27	18%	0.183	S	C	.	.			trans	-64.8	131.6	174.8	-46.7	0	0	0	0	110.2	A516 L517 L637 S638	T514-A516 VanDerWaalsContact C-N 3.28Å; T514-A516 HydrophobicContact CG2-CB 4.44Å; T514-A516 PolarHBondContact O-N 2.73Å; T514-L517 WeakPolarHBondContact O-CA 3.4Å; T514-L517 WeakPolarHBondContact O-CB 3.4Å; T514-L517 PolarHBondContact O-N 3.11Å; T514-L637 PolarHBondContact N-O 3.27Å; T514-L637 PolarHBondContact OG1-O 2.8Å; T514-S638 PolarHBondContact OG1-O 2.9Å
515	P	90.4	Very high	93.2	Very high	57 Å²	57	29.9 Å²	29.9	37%	0.37	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-56.9	-36.9	-175.6	-28.7	35.6	0	0	0	115	L517 H518 E995	P515-L517 PolarHBondContact O-N 3.47Å; P515-H518 WeakPolarHBondContact O-CB 3.4Å; P515-H518 PolarHBondContact O-N 3.36Å; P515-H518 PolarHBondContact O-ND1 2.76Å; P515-E995 HydrophobicContact CB-CG 3.97Å; P515-E995 HydrophobicContact CG-CG 4.36Å
516	A	88.8	Confident	93	Very high	17 Å²	17	27.1 Å²	27.1	14%	0.14	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-59.1	-16.4	173.1	0	0	0	0	0	114.5	T514 F579 N980	T514-A516 VanDerWaalsContact C-N 3.28Å; T514-A516 HydrophobicContact CG2-CB 4.44Å; T514-A516 PolarHBondContact O-N 2.73Å; A516-F579 WeakPolarHBondContact O-CZ 3.41Å; A516-N980 HydrophobicContact CB-CB 3.98Å; A516-N980 WeakPolarHBondContact CB-ND2 3.18Å
517	L	93.2	Very high	93	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-101.4	7.8	177.1	-66.6	175.1	0	0	0	113.6	V513 T514 P515 S519 P520 L521 L576 F579 L637 Q640	V513-L517 HydrophobicContact CG1-CB 4.2Å; T514-L517 WeakPolarHBondContact O-CA 3.4Å; T514-L517 WeakPolarHBondContact O-CB 3.4Å; T514-L517 PolarHBondContact O-N 3.11Å; P515-L517 PolarHBondContact O-N 3.47Å; L517-S519 VanDerWaalsContact C-N 3.32Å; L517-S519 PolarHBondContact O-N 2.93Å; L517-P520 HydrophobicContact CD2-CB 4.28Å; L517-P520 HydrophobicContact CD2-CG 3.87Å; L517-P520 WeakPolarHBondContact O-CB 3.12Å; L517-P520 VanDerWaalsContact O-CD 3.28Å; L517-P520 WeakPolarHBondContact O-CD 3.31Å; L517-L521 WeakPolarHBondContact O-CB 3.21Å; L517-L521 PolarHBondContact O-N 3.4Å; L517-L576 HydrophobicContact CD2-CD2 3.85Å; L517-F579 HydrophobicContact CD2-CD2 4.12Å; L517-F579 HydrophobicContact CD2-CE2 3.99Å; L517-L637 HydrophobicContact CB-CB 4.42Å; L517-L637 HydrophobicContact CB-CD2 4.38Å; L517-L637 HydrophobicContact CB-CG 4.48Å; L517-L637 HydrophobicContact CD1-CB 4.13Å; L517-L637 HydrophobicContact CD1-CG 4.31Å; L517-L637 VanDerWaalsContact CD1-O 3.28Å; L517-L637 WeakPolarHBondContact CD1-O 3.35Å; L517-Q640 VanDerWaalsContact CD1-OE1 3.29Å
518	H	92.4	Very high	93	Very high	18 Å²	18	21.4 Å²	21.4	8%	0.083	12%	0.12	C	C	.	.	H	α-helix	trans	-62	-31.7	178.2	-70.2	159.5	0	0	0	114.4	P515 L521 M522 L878 P976	P515-H518 WeakPolarHBondContact O-CB 3.4Å; P515-H518 PolarHBondContact O-N 3.36Å; P515-H518 PolarHBondContact O-ND1 2.76Å; H518-L521 PolarHBondContact O-N 2.74Å; H518-M522 WeakPolarHBondContact O-CG 3.25Å; H518-M522 PolarHBondContact O-N 3.26Å; H518-M522 VanDerWaalsContact O-N 3.14Å; H518-L878 HydrophobicContact CB-CD2 3.93Å; H518-P976 CarbonylContact C-O 3.33Å; H518-P976 HydrophobicContact CB-CB 3.6Å
519	S	90.4	Very high	93	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.014	9%	0.092	C	C	.	.	H	α-helix	trans	-68.5	-50.4	171.8	-85.3	0	0	0	0	111.9	L517 L521 M522 S523 P976 Q978	L517-S519 VanDerWaalsContact C-N 3.32Å; L517-S519 PolarHBondContact O-N 2.93Å; S519-L521 VanDerWaalsContact C-N 3.28Å; S519-L521 PolarHBondContact O-N 3.15Å; S519-M522 PolarHBondContact O-N 2.74Å; S519-S523 PolarHBondContact O-N 3.47Å; S519-S523 VanDerWaalsContact O-N 3.09Å; S519-P976 WeakPolarHBondContact CA-O 3.49Å; S519-P976 WeakPolarHBondContact CB-O 3.17Å; S519-P976 PolarHBondContact N-O 2.94Å; S519-P976 PolarHBondContact OG-O 3.49Å; S519-Q978 PolarHBondContact OG-N 2.82Å
520	P	92.2	Very high	93	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-51.7	-40.8	167.2	-31	34.2	0	0	0	114.5	L517 S523 V524 M575 L576 F579 L637	L517-P520 HydrophobicContact CD2-CB 4.28Å; L517-P520 HydrophobicContact CD2-CG 3.87Å; L517-P520 WeakPolarHBondContact O-CB 3.12Å; L517-P520 VanDerWaalsContact O-CD 3.28Å; L517-P520 WeakPolarHBondContact O-CD 3.31Å; P520-S523 CarbonylContact O-C 3.57Å; P520-S523 WeakPolarHBondContact O-CB 3.22Å; P520-S523 PolarHBondContact O-N 2.92Å; P520-S523 VanDerWaalsContact O-N 3.15Å; P520-V524 WeakPolarHBondContact O-CG2 3.28Å; P520-V524 PolarHBondContact O-N 3.3Å; P520-M575 VanDerWaalsContact CA-SD 3.6Å; P520-M575 HydrophobicContact CB-SD 4.34Å; P520-M575 HydrophobicContact CG-CB 4.09Å; P520-M575 HydrophobicContact CG-SD 3.99Å; P520-L576 HydrophobicContact CB-CD2 3.64Å; P520-L576 HydrophobicContact CB-CG 4.32Å; P520-L576 HydrophobicContact CG-CD2 3.87Å; P520-F579 HydrophobicContact CG-CE2 4.08Å; P520-L637 HydrophobicContact CB-CD2 3.95Å
521	L	94.2	Very high	93.2	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.5	-48.6	177.8	172.5	62	0	0	0	111.7	V510 V513 L517 H518 S519 S523 V524 T525 L634 L637 L878	V510-L521 HydrophobicContact CG1-CD2 4.14Å; V513-L521 HydrophobicContact CB-CD2 4.34Å; V513-L521 HydrophobicContact CG1-CB 4.41Å; V513-L521 HydrophobicContact CG1-CD2 4.12Å; V513-L521 HydrophobicContact CG2-CD1 4.4Å; V513-L521 HydrophobicContact CG2-CD2 4.23Å; L517-L521 WeakPolarHBondContact O-CB 3.21Å; L517-L521 PolarHBondContact O-N 3.4Å; H518-L521 PolarHBondContact O-N 2.74Å; S519-L521 VanDerWaalsContact C-N 3.28Å; S519-L521 PolarHBondContact O-N 3.15Å; L521-S523 VanDerWaalsContact C-N 3.26Å; L521-S523 PolarHBondContact O-N 3.14Å; L521-V524 PolarHBondContact O-N 3.43Å; L521-T525 HydrophobicContact CD1-CG2 4.22Å; L521-T525 WeakPolarHBondContact O-CG2 3.23Å; L521-T525 PolarHBondContact O-N 3.02Å; L521-T525 PolarHBondContact O-OG1 2.88Å; L521-L634 HydrophobicContact CD1-CB 4.38Å; L521-L634 HydrophobicContact CD1-CD2 3.6Å; L521-L634 HydrophobicContact CD1-CG 3.64Å; L521-L637 HydrophobicContact CB-CD2 3.94Å; L521-L878 HydrophobicContact CD2-CD1 4.02Å; L521-L878 HydrophobicContact CD2-CD2 4.26Å; L521-L878 HydrophobicContact CD2-CG 4.32Å; L521-L878 HydrophobicContact CG-CD1 4.43Å
522	M	91.8	Very high	93.3	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-59.8	-37.1	174.8	-69.2	-94.6	-79.5	0	0	112.1	H518 S519 T525 N526 I841 T842 N845 L878 M975	H518-M522 WeakPolarHBondContact O-CG 3.25Å; H518-M522 PolarHBondContact O-N 3.26Å; H518-M522 VanDerWaalsContact O-N 3.14Å; S519-M522 PolarHBondContact O-N 2.74Å; M522-T525 PolarHBondContact O-OG1 3.17Å; M522-T525 VanDerWaalsContact O-OG1 3.06Å; M522-N526 WeakPolarHBondContact O-CB 3.46Å; M522-N526 PolarHBondContact O-N 2.74Å; M522-I841 HydrophobicContact CE-CB 4.04Å; M522-I841 HydrophobicContact CE-CG2 3.57Å; M522-T842 HydrophobicContact CE-CG2 3.7Å; M522-T842 HydrophobicContact SD-CG2 3.76Å; M522-N845 HydrophobicContact SD-CB 4.17Å; M522-N845 PolarHBondContact SD-ND2 2.99Å; M522-L878 HydrophobicContact CG-CD1 3.68Å; M522-L878 HydrophobicContact SD-CD1 3.67Å; M522-M975 HydrophobicContact CB-CE 3.52Å; M522-M975 HydrophobicContact CE-CE 3.67Å; M522-M975 HydrophobicContact CG-CE 4.01Å
523	S	91.3	Very high	93.5	Very high	2 Å²	2	7.2 Å²	7.2	1%	0.014	5%	0.046	C	C	.	.	H	α-helix	trans	-69.1	-39.9	176.1	-173	0	0	0	0	112.4	S519 P520 L521 A527 G568 V571 T572	S519-S523 PolarHBondContact O-N 3.47Å; S519-S523 VanDerWaalsContact O-N 3.09Å; P520-S523 CarbonylContact O-C 3.57Å; P520-S523 WeakPolarHBondContact O-CB 3.22Å; P520-S523 PolarHBondContact O-N 2.92Å; P520-S523 VanDerWaalsContact O-N 3.15Å; L521-S523 VanDerWaalsContact C-N 3.26Å; L521-S523 PolarHBondContact O-N 3.14Å; S523-A527 WeakPolarHBondContact O-CB 3.36Å; S523-A527 PolarHBondContact O-N 3.43Å; S523-G568 PolarHBondContact OG-O 2.83Å; S523-V571 WeakPolarHBondContact OG-CG1 3.42Å; S523-T572 VanDerWaalsContact C-OG1 3.29Å; S523-T572 WeakPolarHBondContact CB-OG1 3.18Å; S523-T572 PolarHBondContact O-OG1 2.9Å; S523-T572 WeakPolarHBondContact OG-CA 3.44Å; S523-T572 PolarHBondContact OG-N 3.15Å; S523-T572 PolarHBondContact OG-OG1 3.38Å
524	V	93.4	Very high	93.7	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-64.7	-47.4	173.8	172.2	0	0	0	0	110.8	P520 L521 N526 A527 I528 T572 A633 L634 L637	P520-V524 WeakPolarHBondContact O-CG2 3.28Å; P520-V524 PolarHBondContact O-N 3.3Å; L521-V524 PolarHBondContact O-N 3.43Å; V524-N526 VanDerWaalsContact C-N 3.29Å; V524-N526 PolarHBondContact O-N 3.26Å; V524-A527 WeakPolarHBondContact O-CB 3.46Å; V524-A527 PolarHBondContact O-N 3.29Å; V524-A527 VanDerWaalsContact O-N 3.14Å; V524-I528 HydrophobicContact CG1-CD1 3.61Å; V524-I528 HydrophobicContact CG1-CG1 4.32Å; V524-I528 WeakPolarHBondContact O-CB 3.39Å; V524-I528 WeakPolarHBondContact O-CG1 3.37Å; V524-I528 PolarHBondContact O-N 3.01Å; V524-T572 HydrophobicContact CG2-CG2 3.46Å; V524-T572 VanDerWaalsContact CG2-CG2 3.46Å; V524-T572 PolarHBondContact N-OG1 3.1Å; V524-A633 HydrophobicContact CG1-CB 4.3Å; V524-L634 HydrophobicContact CG1-CD1 3.63Å; V524-L634 HydrophobicContact CG1-CG 4.35Å; V524-L637 HydrophobicContact CG2-CD1 4.31Å; V524-L637 HydrophobicContact CG2-CD2 4.26Å
525	T	95.1	Very high	93.8	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-62.8	-37.8	179.1	56.5	0	0	0	0	111.8	L521 M522 I528 S529 L634 N845 I871	L521-T525 HydrophobicContact CD1-CG2 4.22Å; L521-T525 WeakPolarHBondContact O-CG2 3.23Å; L521-T525 PolarHBondContact O-N 3.02Å; L521-T525 PolarHBondContact O-OG1 2.88Å; M522-T525 PolarHBondContact O-OG1 3.17Å; M522-T525 VanDerWaalsContact O-OG1 3.06Å; T525-I528 PolarHBondContact O-N 2.98Å; T525-S529 VanDerWaalsContact O-CB 3.28Å; T525-S529 WeakPolarHBondContact O-CB 3.48Å; T525-S529 PolarHBondContact O-N 2.89Å; T525-S529 PolarHBondContact O-OG 2.96Å; T525-L634 HydrophobicContact CG2-CD2 3.99Å; T525-N845 PolarHBondContact OG1-ND2 3.3Å; T525-N845 PolarHBondContact OG1-OD1 3.04Å; T525-I871 HydrophobicContact CG2-CG1 4.21Å
526	N	93	Very high	94.1	Very high	0 Å²	0	2 Å²	2	0%	0	1%	0.012	C	C	.	.	H	α-helix	trans	-68.7	-34.6	173.5	179.9	82.7	0	0	0	113.5	M522 V524 S529 F705 H706	M522-N526 WeakPolarHBondContact O-CB 3.46Å; M522-N526 PolarHBondContact O-N 2.74Å; V524-N526 VanDerWaalsContact C-N 3.29Å; V524-N526 PolarHBondContact O-N 3.26Å; N526-S529 WeakPolarHBondContact CA-OG 3.14Å; N526-S529 PolarHBondContact O-OG 2.67Å; N526-F705 VanDerWaalsContact ND2-CB 3.26Å; N526-F705 WeakPolarHBondContact ND2-CB 3.32Å; N526-F705 WeakPolarHBondContact ND2-CD2 3.16Å; N526-F705 WeakPolarHBondContact OD1-CB 3.31Å; N526-H706 PolarHBondContact OD1-CD2 2.97Å; N526-H706 VanDerWaalsContact OD1-CD2 3.24Å; N526-H706 PolarHBondContact OD1-N 2.88Å
527	A	94.5	Very high	94.5	Very high	0 Å²	0	1.1 Å²	1.1	0%	0	1%	0.006	C	C	.	.	H	α-helix	trans	-66	-43	174.8	0	0	0	0	0	111.6	S523 V524 G568 F569	S523-A527 WeakPolarHBondContact O-CB 3.36Å; S523-A527 PolarHBondContact O-N 3.43Å; V524-A527 WeakPolarHBondContact O-CB 3.46Å; V524-A527 PolarHBondContact O-N 3.29Å; V524-A527 VanDerWaalsContact O-N 3.14Å; A527-G568 VanDerWaalsContact CB-C 3.45Å; A527-F569 HydrophobicContact CB-CD1 3.71Å; A527-F569 HydrophobicContact CB-CD2 3.91Å; A527-F569 HydrophobicContact CB-CE1 3.74Å; A527-F569 HydrophobicContact CB-CE2 3.94Å; A527-F569 HydrophobicContact CB-CG 3.78Å; A527-F569 HydrophobicContact CB-CZ 3.85Å
528	I	96.9	Very high	94.7	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-77.2	-29.8	-178.5	-66	176.9	0	0	0	111.5	V524 T525 G530 I531 F569 C630 A633 L634 V654 V867 I871	V524-I528 HydrophobicContact CG1-CD1 3.61Å; V524-I528 HydrophobicContact CG1-CG1 4.32Å; V524-I528 WeakPolarHBondContact O-CB 3.39Å; V524-I528 WeakPolarHBondContact O-CG1 3.37Å; V524-I528 PolarHBondContact O-N 3.01Å; T525-I528 PolarHBondContact O-N 2.98Å; I528-G530 PolarHBondContact O-N 3.21Å; I528-G530 VanDerWaalsContact O-N 3.17Å; I528-I531 WeakPolarHBondContact O-CB 3.42Å; I528-I531 WeakPolarHBondContact O-CG2 3.3Å; I528-I531 PolarHBondContact O-N 3.43Å; I528-F569 HydrophobicContact CG1-CE1 4.32Å; I528-F569 HydrophobicContact CG1-CZ 3.97Å; I528-C630 HydrophobicContact CD1-CB 4.32Å; I528-C630 HydrophobicContact CG2-CB 4.18Å; I528-A633 HydrophobicContact CD1-CB 3.79Å; I528-L634 HydrophobicContact CD1-CD1 4.01Å; I528-V654 HydrophobicContact CB-CG2 4.41Å; I528-V654 HydrophobicContact CG1-CG2 4.22Å; I528-V654 HydrophobicContact CG2-CG2 4.43Å; I528-V867 HydrophobicContact CG2-CG1 3.4Å; I528-V867 HydrophobicContact CG2-CG2 4.4Å; I528-I871 HydrophobicContact CG2-CD1 4.34Å
529	S	95.5	Very high	94.9	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-61.3	-23.4	176.3	69.1	0	0	0	0	113.2	T525 N526 I531 T532 V709	T525-S529 VanDerWaalsContact O-CB 3.28Å; T525-S529 WeakPolarHBondContact O-CB 3.48Å; T525-S529 PolarHBondContact O-N 2.89Å; T525-S529 PolarHBondContact O-OG 2.96Å; N526-S529 WeakPolarHBondContact CA-OG 3.14Å; N526-S529 PolarHBondContact O-OG 2.67Å; S529-I531 PolarHBondContact O-N 2.96Å; S529-T532 PolarHBondContact O-N 2.85Å; S529-T532 VanDerWaalsContact O-N 3.14Å; S529-T532 PolarHBondContact O-OG1 2.82Å; S529-V709 WeakPolarHBondContact OG-CG2 3.44Å
530	G	94.7	Very high	95.2	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.021	C	C	.	.	G	3₁₀ helix	trans	-61	-1.4	170.4	0	0	0	0	0	114.8	I528 T532 A533 S561	I528-G530 PolarHBondContact O-N 3.21Å; I528-G530 VanDerWaalsContact O-N 3.17Å; G530-T532 PolarHBondContact O-N 3.44Å; G530-A533 VanDerWaalsContact O-CB 3.29Å; G530-A533 WeakPolarHBondContact O-CB 3.5Å; G530-A533 PolarHBondContact O-N 3.04Å; G530-S561 WeakPolarHBondContact O-CB 3.34Å
531	I	96.5	Very high	95.3	Very high	2 Å²	2	4.8 Å²	4.8	1%	0.01	3%	0.028	C	C	.	.	G	3₁₀ helix	trans	-64.4	-6.5	165.2	-153.8	66.2	0	0	0	113.2	I528 S529 A533 V534 V654 L658 L852 L863 V867	I528-I531 WeakPolarHBondContact O-CB 3.42Å; I528-I531 WeakPolarHBondContact O-CG2 3.3Å; I528-I531 PolarHBondContact O-N 3.43Å; S529-I531 PolarHBondContact O-N 2.96Å; I531-A533 PolarHBondContact O-N 3.1Å; I531-A533 VanDerWaalsContact O-N 3.08Å; I531-V534 HydrophobicContact CD1-CG2 3.58Å; I531-V534 HydrophobicContact CG1-CG2 3.69Å; I531-V534 VanDerWaalsContact O-CB 3.29Å; I531-V534 WeakPolarHBondContact O-CB 3.38Å; I531-V534 WeakPolarHBondContact O-CG2 3.46Å; I531-V534 PolarHBondContact O-N 3.19Å; I531-V654 HydrophobicContact CD1-CG1 4.25Å; I531-L658 HydrophobicContact CD1-CD2 4.35Å; I531-L658 HydrophobicContact CD1-CG 4.34Å; I531-L852 HydrophobicContact CG2-CD1 3.91Å; I531-L852 HydrophobicContact CG2-CD2 3.46Å; I531-L852 VanDerWaalsContact CG2-CD2 3.46Å; I531-L852 HydrophobicContact CG2-CG 4.31Å; I531-L863 HydrophobicContact CD1-CD2 3.99Å; I531-L863 HydrophobicContact CG1-CD2 3.97Å; I531-L863 HydrophobicContact CG1-CG 4.21Å; I531-V867 HydrophobicContact CG2-CB 4.2Å; I531-V867 HydrophobicContact CG2-CG1 3.75Å
532	T	96.1	Very high	95.2	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-51.7	-21.6	159	47.2	0	0	0	0	113	S529 G530 V534 G535 G536 S561 V709 L852 E855	S529-T532 PolarHBondContact O-N 2.85Å; S529-T532 VanDerWaalsContact O-N 3.14Å; S529-T532 PolarHBondContact O-OG1 2.82Å; G530-T532 PolarHBondContact O-N 3.44Å; T532-V534 PolarHBondContact O-N 3.24Å; T532-G535 PolarHBondContact O-N 3.24Å; T532-G535 VanDerWaalsContact O-N 3.11Å; T532-G536 PolarHBondContact O-N 3.25Å; T532-G536 VanDerWaalsContact O-N 3.12Å; T532-S561 WeakPolarHBondContact CB-OG 3.48Å; T532-S561 WeakPolarHBondContact OG1-CB 3.21Å; T532-S561 PolarHBondContact OG1-OG 3.29Å; T532-V709 HydrophobicContact CG2-CG1 3.76Å; T532-L852 HydrophobicContact CG2-CD1 3.84Å; T532-E855 WeakPolarHBondContact CG2-OE1 3.28Å
533	A	97.5	Very high	95.2	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-57.7	-25.6	168.5	0	0	0	0	0	113.4	G530 I531 L537 S561 L658 L679	G530-A533 VanDerWaalsContact O-CB 3.29Å; G530-A533 WeakPolarHBondContact O-CB 3.5Å; G530-A533 PolarHBondContact O-N 3.04Å; I531-A533 PolarHBondContact O-N 3.1Å; I531-A533 VanDerWaalsContact O-N 3.08Å; A533-L537 WeakPolarHBondContact O-CB 3.4Å; A533-L537 WeakPolarHBondContact O-CG 3.41Å; A533-L537 PolarHBondContact O-N 3.18Å; A533-S561 VanDerWaalsContact N-CB 3.29Å; A533-S561 PolarHBondContact N-OG 3.17Å; A533-L658 HydrophobicContact CB-CD2 3.72Å; A533-L679 HydrophobicContact CB-CD2 4.3Å
534	V	97.3	Very high	95.4	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64	-45.3	173.4	171.7	0	0	0	0	110.8	I531 T532 L537 L538 L658 T661 N861 M864	I531-V534 HydrophobicContact CD1-CG2 3.58Å; I531-V534 HydrophobicContact CG1-CG2 3.69Å; I531-V534 VanDerWaalsContact O-CB 3.29Å; I531-V534 WeakPolarHBondContact O-CB 3.38Å; I531-V534 WeakPolarHBondContact O-CG2 3.46Å; I531-V534 PolarHBondContact O-N 3.19Å; T532-V534 PolarHBondContact O-N 3.24Å; V534-L537 PolarHBondContact O-N 3.11Å; V534-L538 HydrophobicContact CG1-CD1 3.96Å; V534-L538 VanDerWaalsContact O-CG 3.3Å; V534-L538 WeakPolarHBondContact O-CG 3.21Å; V534-L538 PolarHBondContact O-N 3.41Å; V534-L658 HydrophobicContact CG2-CD2 3.92Å; V534-T661 HydrophobicContact CG1-CG2 3.96Å; V534-T661 WeakPolarHBondContact CG1-OG1 3.36Å; V534-T661 WeakPolarHBondContact CG2-OG1 3.5Å; V534-N861 WeakPolarHBondContact CG1-ND2 3.45Å; V534-M864 HydrophobicContact CB-CG 4.22Å; V534-M864 HydrophobicContact CB-SD 3.87Å; V534-M864 HydrophobicContact CG1-CG 4.16Å; V534-M864 HydrophobicContact CG1-SD 3.65Å
535	G	95.4	Very high	95.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.5	-38.5	176.6	0	0	0	0	0	112.9	T532 L539 L859	T532-G535 PolarHBondContact O-N 3.24Å; T532-G535 VanDerWaalsContact O-N 3.11Å; G535-L539 PolarHBondContact O-N 3.36Å; G535-L859 VanDerWaalsContact CA-CD1 3.41Å
536	G	96.5	Very high	95.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60	-48.9	170.3	0	0	0	0	0	112.5	T532 L538 L539 M540 T558	T532-G536 PolarHBondContact O-N 3.25Å; T532-G536 VanDerWaalsContact O-N 3.12Å; G536-L538 PolarHBondContact O-N 3.06Å; G536-L539 PolarHBondContact O-N 3.14Å; G536-M540 VanDerWaalsContact O-CG 3.3Å; G536-M540 WeakPolarHBondContact O-CG 3.32Å; G536-M540 PolarHBondContact O-N 3.29Å; G536-M540 VanDerWaalsContact O-N 3.16Å; G536-T558 VanDerWaalsContact CA-OG1 3.29Å; G536-T558 WeakPolarHBondContact CA-OG1 3.46Å
537	L	97.7	Very high	95.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-42	-179.7	-74.3	169.7	0	0	0	112.7	A533 V534 L539 M540 T558 L658 T661 L662 I665 M675 L679	A533-L537 WeakPolarHBondContact O-CB 3.4Å; A533-L537 WeakPolarHBondContact O-CG 3.41Å; A533-L537 PolarHBondContact O-N 3.18Å; V534-L537 PolarHBondContact O-N 3.11Å; L537-L539 PolarHBondContact O-N 2.85Å; L537-M540 HydrophobicContact CD2-SD 4.18Å; L537-M540 PolarHBondContact O-N 2.73Å; L537-T558 HydrophobicContact CD2-CG2 4.01Å; L537-T558 HydrophobicContact CG-CG2 4.19Å; L537-T558 PolarHBondContact N-OG1 2.86Å; L537-L658 HydrophobicContact CD1-CD2 3.84Å; L537-T661 HydrophobicContact CB-CG2 4.1Å; L537-L662 HydrophobicContact CD1-CD2 4.32Å; L537-L662 HydrophobicContact CD1-CG 4.39Å; L537-L662 HydrophobicContact CD2-CD2 4.08Å; L537-I665 HydrophobicContact CB-CD1 4.13Å; L537-I665 WeakPolarHBondContact O-CD1 3.48Å; L537-M675 HydrophobicContact CD2-CB 3.78Å; L537-M675 HydrophobicContact CD2-CE 4.33Å; L537-M675 HydrophobicContact CD2-CG 3.59Å; L537-M675 HydrophobicContact CD2-SD 3.92Å; L537-M675 WeakPolarHBondContact O-CE 3.28Å; L537-L679 HydrophobicContact CD1-CD1 4.3Å; L537-L679 HydrophobicContact CD2-CD1 4.26Å
538	L	96.4	Very high	95.7	Very high	56 Å²	56	29.4 Å²	29.4	29%	0.293	17%	0.166	S	C	.	.	H	α-helix	trans	-63.4	-20.2	178.9	-72.5	166.8	0	0	0	113.6	V534 G536 T661 L664 I665 L859	V534-L538 HydrophobicContact CG1-CD1 3.96Å; V534-L538 VanDerWaalsContact O-CG 3.3Å; V534-L538 WeakPolarHBondContact O-CG 3.21Å; V534-L538 PolarHBondContact O-N 3.41Å; G536-L538 PolarHBondContact O-N 3.06Å; L538-T661 HydrophobicContact CD1-CG2 4.5Å; L538-T661 HydrophobicContact CD2-CG2 4.01Å; L538-T661 HydrophobicContact CG-CG2 3.86Å; L538-L664 HydrophobicContact CD2-CD2 4.34Å; L538-I665 HydrophobicContact CD2-CD1 4.22Å; L538-I665 HydrophobicContact CD2-CG1 4.03Å; L538-L859 HydrophobicContact CD1-CD1 4.43Å
539	L	96	Very high	95.6	Very high	18 Å²	18	33.7 Å²	33.7	9%	0.094	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	4.7	179.9	-61.1	171.4	0	0	0	113	G535 G536 L537 A554 T716 A719 N720	G535-L539 PolarHBondContact O-N 3.36Å; G536-L539 PolarHBondContact O-N 3.14Å; L537-L539 PolarHBondContact O-N 2.85Å; L539-A554 VanDerWaalsContact C-CB 3.42Å; L539-A554 HydrophobicContact CB-CB 3.61Å; L539-A554 WeakPolarHBondContact O-CB 3.31Å; L539-T716 HydrophobicContact CD1-CG2 3.77Å; L539-T716 WeakPolarHBondContact CD1-O 3.46Å; L539-A719 HydrophobicContact CD1-CB 4.01Å; L539-N720 HydrophobicContact CD1-CB 3.88Å; L539-N720 HydrophobicContact CD2-CB 4.41Å
540	M	96.9	Very high	95.6	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.039	20%	0.196	C	C	.	.			trans	-86.3	122.1	174.8	-82.1	175.3	75.9	0	0	110.7	G536 L537 A554 A555 T558 L671 Q674 M675 C678	G536-M540 VanDerWaalsContact O-CG 3.3Å; G536-M540 WeakPolarHBondContact O-CG 3.32Å; G536-M540 PolarHBondContact O-N 3.29Å; G536-M540 VanDerWaalsContact O-N 3.16Å; L537-M540 HydrophobicContact CD2-SD 4.18Å; L537-M540 PolarHBondContact O-N 2.73Å; M540-A554 HydrophobicContact CG-CB 3.91Å; M540-A555 HydrophobicContact CE-CB 3.93Å; M540-A555 HydrophobicContact CG-CB 4.25Å; M540-A555 HydrophobicContact SD-CB 4.32Å; M540-T558 HydrophobicContact SD-CG2 3.93Å; M540-T558 PolarHBondContact SD-OG1 2.87Å; M540-L671 HydrophobicContact CB-CD1 4.4Å; M540-Q674 HydrophobicContact CE-CG 3.73Å; M540-M675 HydrophobicContact CB-CE 3.71Å; M540-M675 HydrophobicContact CB-CG 4.47Å; M540-M675 HydrophobicContact CE-CB 4.37Å; M540-M675 HydrophobicContact CE-CG 3.8Å; M540-M675 HydrophobicContact SD-CG 4.15Å; M540-C678 HydrophobicContact CE-CB 4.35Å
541	G	93.8	Very high	95.8	Very high	14 Å²	14	36 Å²	36	14%	0.144	20%	0.204	C	C	.	.			trans	-132.1	-163.6	174.8	0	0	0	0	0	112.6	E551 L671 Q674	G541-E551 WeakPolarHBondContact CA-OE1 3.22Å; G541-L671 WeakPolarHBondContact O-CD1 3.32Å; G541-Q674 PolarHBondContact O-NE2 2.93Å
542	G	92.4	Very high	95.8	Very high	26 Å²	26	38.2 Å²	38.2	27%	0.268	22%	0.22	S	C	.	.	S	Bend	trans	87.3	-145.3	-175.5	0	0	0	0	0	113.1	E551	G542-E551 PolarHBondContact N-OE1 3.17Å
543	G	93.2	Very high	95.9	Very high	12 Å²	12	40 Å²	40	12%	0.124	23%	0.229	C	C	.	.	S	Bend	trans	-120	-125	176.6	0	0	0	0	0	110.5	Y545 E670 L671	G543-Y545 PolarHBondContact N-O 2.86Å; G543-Y545 PolarHBondContact O-N 3.22Å; G543-E670 WeakPolarHBondContact CA-OE2 3.24Å; G543-E670 CarbonylContact O-C 3.48Å; G543-L671 WeakPolarHBondContact O-CA 3.38Å
544	F	95	Very high	95.9	Very high	102 Å²	102	40 Å²	40	45%	0.447	23%	0.229	S	C	.	.	S	Bend	trans	-65.2	-20.1	171.1	-68.1	-73.7	0	0	0	113.8	E670 T673	F544-E670 HydrophobicContact CD1-CB 4.15Å; F544-E670 HydrophobicContact CD2-CB 3.77Å; F544-E670 HydrophobicContact CD2-CG 3.82Å; F544-E670 WeakPolarHBondContact CD2-OE2 3.43Å; F544-E670 HydrophobicContact CE1-CB 4.18Å; F544-E670 HydrophobicContact CE1-CG 4.43Å; F544-E670 HydrophobicContact CE2-CB 3.8Å; F544-E670 HydrophobicContact CE2-CG 3.42Å; F544-E670 VanDerWaalsContact CE2-CG 3.42Å; F544-E670 WeakPolarHBondContact CE2-OE1 3.45Å; F544-E670 HydrophobicContact CG-CB 3.96Å; F544-E670 HydrophobicContact CG-CG 4.48Å; F544-E670 HydrophobicContact CZ-CB 4.01Å; F544-E670 HydrophobicContact CZ-CG 3.77Å; F544-T673 HydrophobicContact CD1-CG2 4.05Å; F544-T673 HydrophobicContact CE1-CG2 4.01Å
545	Y	95.5	Very high	96	Very high	186 Å²	186	40.6 Å²	40.6	73%	0.729	23%	0.234	S	C	*	.	S	Bend	trans	-134.3	151.3	178.6	-56.9	-75	0	0	0	110.6	G543 S547	G543-Y545 PolarHBondContact N-O 2.86Å; G543-Y545 PolarHBondContact O-N 3.22Å; Y545-S547 PolarHBondContact O-N 2.79Å
546	P	95.6	Very high	96.1	Very high	45 Å²	45	43.2 Å²	43.2	29%	0.292	25%	0.252	S	S	.	.			trans	-61	135.6	174.3	-24.6	36.4	0	0	0	110.4	E551 S552 A555	P546-E551 HydrophobicContact CB-CB 3.84Å; P546-S552 WeakPolarHBondContact CB-OG 3.45Å; P546-A555 HydrophobicContact CG-CB 4.27Å
547	S	94.1	Very high	96.2	Very high	99 Å²	99	43.2 Å²	43.2	69%	0.692	25%	0.252	S	S	*	.	S	Bend	trans	-90.7	-14.8	178.8	-61.9	0	0	0	0	112.4	Y545 E551	Y545-S547 PolarHBondContact O-N 2.79Å; S547-E551 WeakPolarHBondContact CA-OE2 3.35Å; S547-E551 WeakPolarHBondContact CB-OE2 3.47Å; S547-E551 PolarHBondContact N-OE2 3.31Å
548	S	95.9	Very high	96.2	Very high	50 Å²	50	43.2 Å²	43.2	35%	0.35	25%	0.252	S	S	.	.	S	Bend	trans	-143.9	170.1	-172.8	68.8	0	0	0	0	113.1	E551 S552	S548-E551 WeakPolarHBondContact CB-OE2 3.12Å; S548-E551 PolarHBondContact N-OE2 2.98Å; S548-E551 VanDerWaalsContact OG-CG 3.26Å; S548-E551 WeakPolarHBondContact OG-CG 3.26Å; S548-E551 PolarHBondContact OG-OE2 3.33Å; S548-S552 PolarHBondContact O-N 3.13Å; S548-S552 VanDerWaalsContact O-N 3.17Å; S548-S552 PolarHBondContact O-OG 2.93Å
549	V	96.3	Very high	96.3	Very high	89 Å²	89	43.5 Å²	43.5	54%	0.539	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-47.1	178	179	0	0	0	0	112.4	E551 S552 L553 M722	V549-E551 PolarHBondContact O-N 3.13Å; V549-S552 WeakPolarHBondContact O-CB 3.4Å; V549-S552 PolarHBondContact O-N 3.47Å; V549-S552 VanDerWaalsContact O-N 3.07Å; V549-L553 HydrophobicContact CG1-CD1 4.23Å; V549-L553 HydrophobicContact CG1-CG 4.32Å; V549-L553 WeakPolarHBondContact O-CG 3.46Å; V549-L553 PolarHBondContact O-N 2.9Å; V549-M722 HydrophobicContact CB-CE 4.19Å; V549-M722 HydrophobicContact CG1-CE 4.08Å
550	P	95.8	Very high	96.4	Very high	15 Å²	15	44.6 Å²	44.6	10%	0.097	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-43.4	179.2	-25.6	36.4	0	0	0	113.2	S552 L553 A554 A719 M722 V723	P550-S552 VanDerWaalsContact C-N 3.26Å; P550-S552 PolarHBondContact O-N 3.34Å; P550-L553 WeakPolarHBondContact O-CB 3.08Å; P550-L553 PolarHBondContact O-N 2.86Å; P550-L553 VanDerWaalsContact O-N 3.17Å; P550-A554 WeakPolarHBondContact O-CB 3.01Å; P550-A554 PolarHBondContact O-N 2.85Å; P550-A719 HydrophobicContact CB-CB 4.25Å; P550-M722 HydrophobicContact CB-CB 4.38Å; P550-M722 HydrophobicContact CG-CB 3.64Å; P550-M722 HydrophobicContact CG-CE 4.01Å; P550-M722 HydrophobicContact CG-SD 4.32Å; P550-V723 HydrophobicContact CB-CG2 3.63Å; P550-V723 HydrophobicContact CG-CG2 4.16Å
551	E	97	Very high	96.4	Very high	33 Å²	33	44.2 Å²	44.2	15%	0.154	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-33.2	176.6	-61.8	165.1	140.2	0	0	111.8	G541 G542 P546 S547 S548 V549 A554 A555	G541-E551 WeakPolarHBondContact CA-OE1 3.22Å; G542-E551 PolarHBondContact N-OE1 3.17Å; P546-E551 HydrophobicContact CB-CB 3.84Å; S547-E551 WeakPolarHBondContact CA-OE2 3.35Å; S547-E551 WeakPolarHBondContact CB-OE2 3.47Å; S547-E551 PolarHBondContact N-OE2 3.31Å; S548-E551 WeakPolarHBondContact CB-OE2 3.12Å; S548-E551 PolarHBondContact N-OE2 2.98Å; S548-E551 VanDerWaalsContact OG-CG 3.26Å; S548-E551 WeakPolarHBondContact OG-CG 3.26Å; S548-E551 PolarHBondContact OG-OE2 3.33Å; V549-E551 PolarHBondContact O-N 3.13Å; E551-A554 PolarHBondContact O-N 3.19Å; E551-A555 VanDerWaalsContact O-CB 3.29Å; E551-A555 WeakPolarHBondContact O-CB 3.32Å; E551-A555 PolarHBondContact O-N 3.03Å
552	S	97.9	Very high	96.6	Very high	50 Å²	50	43.6 Å²	43.6	35%	0.35	25%	0.251	S	S	.	.	H	α-helix	trans	-69.4	-39.5	174.9	-57	0	0	0	0	112.2	P546 S548 V549 P550 S556	P546-S552 WeakPolarHBondContact CB-OG 3.45Å; S548-S552 PolarHBondContact O-N 3.13Å; S548-S552 VanDerWaalsContact O-N 3.17Å; S548-S552 PolarHBondContact O-OG 2.93Å; V549-S552 WeakPolarHBondContact O-CB 3.4Å; V549-S552 PolarHBondContact O-N 3.47Å; V549-S552 VanDerWaalsContact O-N 3.07Å; P550-S552 VanDerWaalsContact C-N 3.26Å; P550-S552 PolarHBondContact O-N 3.34Å; S552-S556 WeakPolarHBondContact O-CB 3.12Å; S552-S556 PolarHBondContact O-N 2.93Å; S552-S556 VanDerWaalsContact O-N 3.1Å; S552-S556 PolarHBondContact O-OG 2.94Å
553	L	98	Very high	96.9	Very high	38 Å²	38	43.5 Å²	43.5	20%	0.199	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-41.7	173.4	-61.6	173.5	0	0	0	110.7	V549 P550 S556 A557 L715 I718 A719 M722	V549-L553 HydrophobicContact CG1-CD1 4.23Å; V549-L553 HydrophobicContact CG1-CG 4.32Å; V549-L553 WeakPolarHBondContact O-CG 3.46Å; V549-L553 PolarHBondContact O-N 2.9Å; P550-L553 WeakPolarHBondContact O-CB 3.08Å; P550-L553 PolarHBondContact O-N 2.86Å; P550-L553 VanDerWaalsContact O-N 3.17Å; L553-S556 WeakPolarHBondContact O-CB 3.39Å; L553-S556 PolarHBondContact O-N 2.79Å; L553-A557 PolarHBondContact O-N 2.96Å; L553-L715 HydrophobicContact CB-CD2 4.28Å; L553-L715 HydrophobicContact CD2-CD2 3.56Å; L553-L715 HydrophobicContact CG-CD2 4.48Å; L553-I718 HydrophobicContact CD1-CG2 3.86Å; L553-A719 HydrophobicContact CB-CB 4.06Å; L553-A719 HydrophobicContact CD1-CB 4.44Å; L553-M722 HydrophobicContact CD1-SD 4.22Å
554	A	97.8	Very high	97	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-46	177.8	0	0	0	0	0	112.7	L539 M540 P550 E551 S556 A557 T558	L539-A554 VanDerWaalsContact C-CB 3.42Å; L539-A554 HydrophobicContact CB-CB 3.61Å; L539-A554 WeakPolarHBondContact O-CB 3.31Å; M540-A554 HydrophobicContact CG-CB 3.91Å; P550-A554 WeakPolarHBondContact O-CB 3.01Å; P550-A554 PolarHBondContact O-N 2.85Å; E551-A554 PolarHBondContact O-N 3.19Å; A554-S556 VanDerWaalsContact C-N 3.25Å; A554-S556 PolarHBondContact O-N 2.99Å; A554-A557 WeakPolarHBondContact O-CB 3.4Å; A554-A557 PolarHBondContact O-N 3.44Å; A554-A557 VanDerWaalsContact O-N 3.15Å; A554-T558 PolarHBondContact O-N 3.41Å; A554-T558 PolarHBondContact O-OG1 3.47Å
555	A	98	Very high	97.1	Very high	11 Å²	11	38.7 Å²	38.7	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-37.3	172.8	0	0	0	0	0	112.1	M540 P546 E551 L559	M540-A555 HydrophobicContact CE-CB 3.93Å; M540-A555 HydrophobicContact CG-CB 4.25Å; M540-A555 HydrophobicContact SD-CB 4.32Å; P546-A555 HydrophobicContact CG-CB 4.27Å; E551-A555 VanDerWaalsContact O-CB 3.29Å; E551-A555 WeakPolarHBondContact O-CB 3.32Å; E551-A555 PolarHBondContact O-N 3.03Å; A555-L559 WeakPolarHBondContact O-CB 3.44Å; A555-L559 PolarHBondContact O-N 2.83Å
556	S	98.1	Very high	97.1	Very high	55 Å²	55	30 Å²	30	39%	0.385	19%	0.187	S	C	.	.	H	α-helix	trans	-66.7	-44.1	173.4	-58.5	0	0	0	0	111.9	S552 L553 A554 L559 L560	S552-S556 WeakPolarHBondContact O-CB 3.12Å; S552-S556 PolarHBondContact O-N 2.93Å; S552-S556 VanDerWaalsContact O-N 3.1Å; S552-S556 PolarHBondContact O-OG 2.94Å; L553-S556 WeakPolarHBondContact O-CB 3.39Å; L553-S556 PolarHBondContact O-N 2.79Å; A554-S556 VanDerWaalsContact C-N 3.25Å; A554-S556 PolarHBondContact O-N 2.99Å; S556-L559 PolarHBondContact O-N 2.9Å; S556-L560 WeakPolarHBondContact O-CG 3.49Å; S556-L560 PolarHBondContact O-N 2.87Å
557	A	98.1	Very high	97	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.3	-45.8	175.8	0	0	0	0	0	111.6	L553 A554 L559 L560 S561 A712 L715	L553-A557 PolarHBondContact O-N 2.96Å; A554-A557 WeakPolarHBondContact O-CB 3.4Å; A554-A557 PolarHBondContact O-N 3.44Å; A554-A557 VanDerWaalsContact O-N 3.15Å; A557-L559 PolarHBondContact O-N 2.8Å; A557-L560 PolarHBondContact O-N 3.27Å; A557-S561 WeakPolarHBondContact O-CB 3.46Å; A557-S561 PolarHBondContact O-N 2.99Å; A557-S561 PolarHBondContact O-OG 3.01Å; A557-A712 HydrophobicContact CB-CB 4.33Å; A557-L715 HydrophobicContact CB-CB 3.99Å; A557-L715 HydrophobicContact CB-CD1 4.49Å
558	T	98.4	Very high	96.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59	-45.5	175.1	-61.1	0	0	0	0	112	G536 L537 M540 A554 S561 A562 C678 L679	G536-T558 VanDerWaalsContact CA-OG1 3.29Å; G536-T558 WeakPolarHBondContact CA-OG1 3.46Å; L537-T558 HydrophobicContact CD2-CG2 4.01Å; L537-T558 HydrophobicContact CG-CG2 4.19Å; L537-T558 PolarHBondContact N-OG1 2.86Å; M540-T558 HydrophobicContact SD-CG2 3.93Å; M540-T558 PolarHBondContact SD-OG1 2.87Å; A554-T558 PolarHBondContact O-N 3.41Å; A554-T558 PolarHBondContact O-OG1 3.47Å; T558-S561 PolarHBondContact O-N 3.45Å; T558-A562 WeakPolarHBondContact O-CB 3.32Å; T558-A562 PolarHBondContact O-N 3.41Å; T558-C678 HydrophobicContact CG2-CB 3.88Å; T558-L679 HydrophobicContact CG2-CD2 3.68Å; T558-L679 HydrophobicContact CG2-CG 3.95Å
559	L	98.3	Very high	96.9	Very high	63 Å²	63	21.6 Å²	21.6	33%	0.33	13%	0.127	S	C	.	.	H	α-helix	trans	-61.9	-49.6	178	178.6	65.5	0	0	0	112.1	A555 S556 A557 S561 A562 I563 C678	A555-L559 WeakPolarHBondContact O-CB 3.44Å; A555-L559 PolarHBondContact O-N 2.83Å; S556-L559 PolarHBondContact O-N 2.9Å; A557-L559 PolarHBondContact O-N 2.8Å; L559-S561 VanDerWaalsContact C-N 3.33Å; L559-S561 PolarHBondContact O-N 2.97Å; L559-A562 PolarHBondContact O-N 2.96Å; L559-I563 WeakPolarHBondContact O-CG1 3.43Å; L559-I563 PolarHBondContact O-N 2.89Å; L559-I563 VanDerWaalsContact O-N 3.13Å; L559-C678 WeakPolarHBondContact CD1-O 3.47Å
560	L	97.9	Very high	96.8	Very high	41 Å²	41	18.8 Å²	18.8	22%	0.215	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-40	178.8	-67.7	-176.2	0	0	0	112	S556 A557 I563 N564 L708 A711 L715	S556-L560 WeakPolarHBondContact O-CG 3.49Å; S556-L560 PolarHBondContact O-N 2.87Å; A557-L560 PolarHBondContact O-N 3.27Å; L560-I563 HydrophobicContact CD2-CD1 4.36Å; L560-I563 WeakPolarHBondContact O-CB 3.29Å; L560-I563 PolarHBondContact O-N 3.37Å; L560-N564 PolarHBondContact O-N 3.46Å; L560-L708 HydrophobicContact CB-CB 4.44Å; L560-L708 HydrophobicContact CD2-CD2 4.34Å; L560-A711 HydrophobicContact CD1-CB 3.73Å; L560-L715 HydrophobicContact CD1-CD1 3.99Å
561	S	97.9	Very high	96.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.1	-41.6	176.8	-58.7	0	0	0	0	111.9	G530 T532 A533 A557 T558 L559 I563 N564 I565 A712	G530-S561 WeakPolarHBondContact O-CB 3.34Å; T532-S561 WeakPolarHBondContact CB-OG 3.48Å; T532-S561 WeakPolarHBondContact OG1-CB 3.21Å; T532-S561 PolarHBondContact OG1-OG 3.29Å; A533-S561 VanDerWaalsContact N-CB 3.29Å; A533-S561 PolarHBondContact N-OG 3.17Å; A557-S561 WeakPolarHBondContact O-CB 3.46Å; A557-S561 PolarHBondContact O-N 2.99Å; A557-S561 PolarHBondContact O-OG 3.01Å; T558-S561 PolarHBondContact O-N 3.45Å; L559-S561 VanDerWaalsContact C-N 3.33Å; L559-S561 PolarHBondContact O-N 2.97Å; S561-I563 VanDerWaalsContact C-N 3.33Å; S561-I563 PolarHBondContact O-N 3.25Å; S561-N564 WeakPolarHBondContact O-CB 3.42Å; S561-N564 PolarHBondContact O-N 3.33Å; S561-N564 VanDerWaalsContact O-N 3.1Å; S561-I565 PolarHBondContact O-N 3.49Å; S561-I565 VanDerWaalsContact O-N 3.07Å; S561-A712 WeakPolarHBondContact OG-CB 3.38Å
562	A	97.9	Very high	96.4	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-66.2	-31.1	176.2	0	0	0	0	0	113.3	T558 L559 N564 I565 G566 L679 G682 L683	T558-A562 WeakPolarHBondContact O-CB 3.32Å; T558-A562 PolarHBondContact O-N 3.41Å; L559-A562 PolarHBondContact O-N 2.96Å; A562-N564 VanDerWaalsContact C-N 3.3Å; A562-N564 PolarHBondContact O-N 3.31Å; A562-I565 PolarHBondContact O-N 3.42Å; A562-G566 PolarHBondContact O-N 2.93Å; A562-L679 HydrophobicContact CB-CD2 4.33Å; A562-L679 WeakPolarHBondContact CB-O 3.3Å; A562-G682 CarbonylContact O-C 3.51Å; A562-L683 WeakPolarHBondContact O-CA 3.47Å; A562-L683 PolarHBondContact O-N 2.89Å
563	I	97.4	Very high	96.2	Very high	23 Å²	23	16.9 Å²	16.9	12%	0.118	9%	0.094	C	C	.	.	H	α-helix	trans	-59.9	-41.5	169.9	-65.9	169.8	0	0	0	110.6	L559 L560 S561 G567 G682 I685 G686 F705 L708	L559-I563 WeakPolarHBondContact O-CG1 3.43Å; L559-I563 PolarHBondContact O-N 2.89Å; L559-I563 VanDerWaalsContact O-N 3.13Å; L560-I563 HydrophobicContact CD2-CD1 4.36Å; L560-I563 WeakPolarHBondContact O-CB 3.29Å; L560-I563 PolarHBondContact O-N 3.37Å; S561-I563 VanDerWaalsContact C-N 3.33Å; S561-I563 PolarHBondContact O-N 3.25Å; I563-G567 PolarHBondContact O-N 2.86Å; I563-G682 VanDerWaalsContact CA-O 3.32Å; I563-G682 WeakPolarHBondContact CA-O 3.33Å; I563-G682 WeakPolarHBondContact CG1-O 3.44Å; I563-I685 HydrophobicContact CD1-CG2 4.04Å; I563-I685 HydrophobicContact CG1-CB 4.18Å; I563-I685 HydrophobicContact CG1-CG2 4.07Å; I563-G686 WeakPolarHBondContact O-CA 3.26Å; I563-F705 HydrophobicContact CG2-CD1 4.44Å; I563-F705 HydrophobicContact CG2-CE1 4.03Å; I563-L708 HydrophobicContact CB-CD1 4.06Å; I563-L708 HydrophobicContact CG2-CD1 3.59Å
564	N	95.4	Very high	95.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-69.1	-38.4	177	-77.2	-6.2	0	0	0	113.3	L560 S561 A562 G568 F705 V709	L560-N564 PolarHBondContact O-N 3.46Å; S561-N564 WeakPolarHBondContact O-CB 3.42Å; S561-N564 PolarHBondContact O-N 3.33Å; S561-N564 VanDerWaalsContact O-N 3.1Å; A562-N564 VanDerWaalsContact C-N 3.3Å; A562-N564 PolarHBondContact O-N 3.31Å; N564-G568 WeakPolarHBondContact O-CA 3.41Å; N564-G568 PolarHBondContact O-N 2.84Å; N564-F705 PolarHBondContact ND2-O 3.17Å; N564-F705 WeakPolarHBondContact OD1-CA 3.08Å; N564-F705 VanDerWaalsContact OD1-CB 3.25Å; N564-F705 WeakPolarHBondContact OD1-CB 3.4Å; N564-F705 WeakPolarHBondContact OD1-CD1 3.46Å; N564-F705 PolarHBondContact OD1-O 3Å; N564-V709 WeakPolarHBondContact ND2-CG2 3.43Å; N564-V709 PolarHBondContact ND2-N 2.98Å
565	I	97	Very high	95.5	Very high	14 Å²	14	18.6 Å²	18.6	7%	0.072	10%	0.098	C	C	.	.	H	α-helix	trans	-58.2	-59.2	173.3	-65.3	173.4	0	0	0	110	S561 A562 G567 F569 V654 L658 L683	S561-I565 PolarHBondContact O-N 3.49Å; S561-I565 VanDerWaalsContact O-N 3.07Å; A562-I565 PolarHBondContact O-N 3.42Å; I565-G567 VanDerWaalsContact C-N 3.32Å; I565-G567 PolarHBondContact O-N 3.11Å; I565-F569 HydrophobicContact CG2-CD2 3.89Å; I565-F569 HydrophobicContact CG2-CE2 4.04Å; I565-F569 VanDerWaalsContact O-CD2 3.28Å; I565-F569 WeakPolarHBondContact O-CD2 3.38Å; I565-F569 PolarHBondContact O-N 2.82Å; I565-V654 HydrophobicContact CD1-CG1 3.67Å; I565-V654 HydrophobicContact CG1-CG1 4.04Å; I565-V654 HydrophobicContact CG2-CG1 4.32Å; I565-L658 HydrophobicContact CD1-CD1 3.82Å; I565-L683 HydrophobicContact CG2-CD1 4.15Å
566	G	95.2	Very high	95.2	Very high	4 Å²	4	18 Å²	18	4%	0.041	9%	0.094	C	C	.	.	H	α-helix	trans	-63.6	-37.7	-177.1	0	0	0	0	0	112.9	A562 V570 S687	A562-G566 PolarHBondContact O-N 2.93Å; G566-V570 WeakPolarHBondContact O-CB 3.44Å; G566-V570 WeakPolarHBondContact O-CG2 3.47Å; G566-S687 PolarHBondContact O-OG 2.7Å
567	G	93.5	Very high	94.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.5	-53.9	177.2	0	0	0	0	0	113.2	I563 I565 V570 V571 G686 A690 F705	I563-G567 PolarHBondContact O-N 2.86Å; I565-G567 VanDerWaalsContact C-N 3.32Å; I565-G567 PolarHBondContact O-N 3.11Å; G567-V570 PolarHBondContact O-N 3.48Å; G567-V571 WeakPolarHBondContact O-CG2 3.33Å; G567-V571 PolarHBondContact O-N 3.22Å; G567-G686 WeakPolarHBondContact CA-O 3.28Å; G567-A690 VanDerWaalsContact O-CB 3.28Å; G567-A690 WeakPolarHBondContact O-CB 3.44Å; G567-F705 VanDerWaalsContact CA-CZ 3.49Å
568	G	93.4	Very high	94.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.8	-45.4	-174	0	0	0	0	0	113.5	S523 A527 N564 V570 V571 T572	S523-G568 PolarHBondContact OG-O 2.83Å; A527-G568 VanDerWaalsContact CB-C 3.45Å; N564-G568 WeakPolarHBondContact O-CA 3.41Å; N564-G568 PolarHBondContact O-N 2.84Å; G568-V570 VanDerWaalsContact C-N 3.31Å; G568-V570 PolarHBondContact O-N 3.03Å; G568-V571 PolarHBondContact O-N 3.35Å; G568-T572 WeakPolarHBondContact O-CB 3.32Å; G568-T572 PolarHBondContact O-N 3.43Å; G568-T572 PolarHBondContact O-OG1 2.98Å
569	F	95.4	Very high	94.1	Very high	16 Å²	16	22 Å²	22	7%	0.07	11%	0.109	C	C	.	.	H	α-helix	trans	-67.1	-33	179.7	-74.3	-60	0	0	0	112.4	A527 I528 I565 Q573 N647 G650 M651 V654	A527-F569 HydrophobicContact CB-CD1 3.71Å; A527-F569 HydrophobicContact CB-CD2 3.91Å; A527-F569 HydrophobicContact CB-CE1 3.74Å; A527-F569 HydrophobicContact CB-CE2 3.94Å; A527-F569 HydrophobicContact CB-CG 3.78Å; A527-F569 HydrophobicContact CB-CZ 3.85Å; I528-F569 HydrophobicContact CG1-CE1 4.32Å; I528-F569 HydrophobicContact CG1-CZ 3.97Å; I565-F569 HydrophobicContact CG2-CD2 3.89Å; I565-F569 HydrophobicContact CG2-CE2 4.04Å; I565-F569 VanDerWaalsContact O-CD2 3.28Å; I565-F569 WeakPolarHBondContact O-CD2 3.38Å; I565-F569 PolarHBondContact O-N 2.82Å; F569-Q573 WeakPolarHBondContact O-CB 3.34Å; F569-Q573 PolarHBondContact O-N 3.08Å; F569-N647 WeakPolarHBondContact CD1-OD1 3.49Å; F569-G650 VanDerWaalsContact CZ-C 3.43Å; F569-G650 WeakPolarHBondContact CZ-O 3.48Å; F569-M651 HydrophobicContact CB-CG 4.12Å; F569-M651 HydrophobicContact CB-SD 4.21Å; F569-M651 HydrophobicContact CD1-CG 3.42Å; F569-M651 VanDerWaalsContact CD1-CG 3.42Å; F569-M651 HydrophobicContact CD1-SD 4.41Å; F569-M651 HydrophobicContact CD2-CG 3.96Å; F569-M651 HydrophobicContact CE1-CG 3.74Å; F569-M651 HydrophobicContact CE2-CG 4.24Å; F569-M651 HydrophobicContact CG-CG 3.56Å; F569-M651 HydrophobicContact CG-SD 4.3Å; F569-M651 HydrophobicContact CZ-CG 4.15Å; F569-V654 HydrophobicContact CE2-CB 4.15Å; F569-V654 HydrophobicContact CE2-CG1 4.46Å; F569-V654 HydrophobicContact CE2-CG2 3.95Å; F569-V654 HydrophobicContact CZ-CB 4.3Å; F569-V654 HydrophobicContact CZ-CG2 3.8Å
570	V	94.3	Very high	93.7	Very high	30 Å²	30	22.5 Å²	22.5	18%	0.182	11%	0.109	C	C	.	.	H	α-helix	trans	-70.8	-45.2	174.6	169.4	0	0	0	0	111.9	G566 G567 G568 T572 Q573 R574 A690 K691	G566-V570 WeakPolarHBondContact O-CB 3.44Å; G566-V570 WeakPolarHBondContact O-CG2 3.47Å; G567-V570 PolarHBondContact O-N 3.48Å; G568-V570 VanDerWaalsContact C-N 3.31Å; G568-V570 PolarHBondContact O-N 3.03Å; V570-T572 VanDerWaalsContact C-N 3.33Å; V570-T572 PolarHBondContact O-N 3.49Å; V570-Q573 PolarHBondContact O-N 3.26Å; V570-R574 WeakPolarHBondContact O-CG 3.36Å; V570-R574 PolarHBondContact O-N 3.29Å; V570-R574 VanDerWaalsContact O-N 3.13Å; V570-A690 HydrophobicContact CB-CB 3.77Å; V570-A690 HydrophobicContact CG1-CB 3.58Å; V570-K691 HydrophobicContact CG1-CG 3.85Å
571	V	91.6	Very high	93.2	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-45.9	174.1	171.8	0	0	0	0	110.5	S523 G567 G568 Q573 R574 M575 A690 L698 F705	S523-V571 WeakPolarHBondContact OG-CG1 3.42Å; G567-V571 WeakPolarHBondContact O-CG2 3.33Å; G567-V571 PolarHBondContact O-N 3.22Å; G568-V571 PolarHBondContact O-N 3.35Å; V571-Q573 PolarHBondContact O-N 2.81Å; V571-R574 WeakPolarHBondContact O-CB 3.45Å; V571-R574 PolarHBondContact O-N 3.04Å; V571-M575 HydrophobicContact CG1-CE 3.94Å; V571-M575 HydrophobicContact CG1-CG 4.36Å; V571-M575 HydrophobicContact CG1-SD 4.4Å; V571-M575 PolarHBondContact O-N 2.97Å; V571-A690 HydrophobicContact CG2-CB 3.76Å; V571-L698 HydrophobicContact CG1-CD1 4.44Å; V571-L698 HydrophobicContact CG1-CD2 3.66Å; V571-L698 HydrophobicContact CG2-CD2 4.23Å; V571-F705 HydrophobicContact CG2-CE2 4.44Å
572	T	92.7	Very high	92.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-49	-179.7	-55.6	0	0	0	0	111.3	S523 V524 G568 V570 R574 M575 L576 N647	S523-T572 VanDerWaalsContact C-OG1 3.29Å; S523-T572 WeakPolarHBondContact CB-OG1 3.18Å; S523-T572 PolarHBondContact O-OG1 2.9Å; S523-T572 WeakPolarHBondContact OG-CA 3.44Å; S523-T572 PolarHBondContact OG-N 3.15Å; S523-T572 PolarHBondContact OG-OG1 3.38Å; V524-T572 HydrophobicContact CG2-CG2 3.46Å; V524-T572 VanDerWaalsContact CG2-CG2 3.46Å; V524-T572 PolarHBondContact N-OG1 3.1Å; G568-T572 WeakPolarHBondContact O-CB 3.32Å; G568-T572 PolarHBondContact O-N 3.43Å; G568-T572 PolarHBondContact O-OG1 2.98Å; V570-T572 VanDerWaalsContact C-N 3.33Å; V570-T572 PolarHBondContact O-N 3.49Å; T572-R574 VanDerWaalsContact C-N 3.26Å; T572-R574 PolarHBondContact O-N 3.34Å; T572-M575 PolarHBondContact O-N 3.3Å; T572-L576 HydrophobicContact CG2-CD1 3.72Å; T572-L576 HydrophobicContact CG2-CG 4.16Å; T572-L576 WeakPolarHBondContact O-CB 3.49Å; T572-L576 WeakPolarHBondContact O-CG 3.37Å; T572-L576 PolarHBondContact O-N 2.77Å; T572-N647 VanDerWaalsContact CB-OD1 3.27Å; T572-N647 WeakPolarHBondContact CB-OD1 3.39Å; T572-N647 HydrophobicContact CG2-CB 4.13Å; T572-N647 WeakPolarHBondContact CG2-OD1 3.44Å
573	Q	92.9	Very high	92.2	Very high	56 Å²	56	36 Å²	36	26%	0.262	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-36	179.1	-165.5	63.4	62.4	0	0	112	F569 V570 V571 N577 N647	F569-Q573 WeakPolarHBondContact O-CB 3.34Å; F569-Q573 PolarHBondContact O-N 3.08Å; V570-Q573 PolarHBondContact O-N 3.26Å; V571-Q573 PolarHBondContact O-N 2.81Å; Q573-N577 PolarHBondContact NE2-OD1 2.95Å; Q573-N577 VanDerWaalsContact O-CB 3.31Å; Q573-N577 WeakPolarHBondContact O-CB 3.33Å; Q573-N577 PolarHBondContact O-N 3.14Å; Q573-N577 VanDerWaalsContact O-N 3.09Å; Q573-N577 PolarHBondContact O-ND2 3.49Å; Q573-N577 PolarHBondContact O-OD1 2.89Å; Q573-N647 PolarHBondContact OE1-ND2 2.96Å
574	R	91	Very high	91.7	Very high	72 Å²	72	36.2 Å²	36.2	27%	0.272	19%	0.19	S	C	.	.	H	α-helix	trans	-63.7	-52	174.6	-71.4	177.3	67.2	-157.9	-3	111.4	V570 V571 T572 L576 N577 M578 A690 I693	V570-R574 WeakPolarHBondContact O-CG 3.36Å; V570-R574 PolarHBondContact O-N 3.29Å; V570-R574 VanDerWaalsContact O-N 3.13Å; V571-R574 WeakPolarHBondContact O-CB 3.45Å; V571-R574 PolarHBondContact O-N 3.04Å; T572-R574 VanDerWaalsContact C-N 3.26Å; T572-R574 PolarHBondContact O-N 3.34Å; R574-L576 PolarHBondContact O-N 3.42Å; R574-N577 PolarHBondContact O-N 2.76Å; R574-M578 HydrophobicContact CB-CE 4.14Å; R574-M578 WeakPolarHBondContact O-CE 3.24Å; R574-M578 WeakPolarHBondContact O-CG 3.47Å; R574-M578 PolarHBondContact O-N 2.88Å; R574-A690 PolarHBondContact NH1-O 3.3Å; R574-I693 VanDerWaalsContact CZ-O 3.28Å; R574-I693 PolarHBondContact NH1-O 3.44Å; R574-I693 PolarHBondContact NH2-O 2.97Å
575	M	91.3	Very high	91.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-56.7	-48	177.6	-67.7	-178.5	171.9	0	0	111.9	P520 V571 T572 N577 M578 F579 L698 V981	P520-M575 VanDerWaalsContact CA-SD 3.6Å; P520-M575 HydrophobicContact CB-SD 4.34Å; P520-M575 HydrophobicContact CG-CB 4.09Å; P520-M575 HydrophobicContact CG-SD 3.99Å; V571-M575 HydrophobicContact CG1-CE 3.94Å; V571-M575 HydrophobicContact CG1-CG 4.36Å; V571-M575 HydrophobicContact CG1-SD 4.4Å; V571-M575 PolarHBondContact O-N 2.97Å; T572-M575 PolarHBondContact O-N 3.3Å; M575-N577 VanDerWaalsContact C-N 3.3Å; M575-N577 PolarHBondContact O-N 3.13Å; M575-M578 WeakPolarHBondContact O-CB 3.43Å; M575-M578 PolarHBondContact O-N 2.72Å; M575-F579 WeakPolarHBondContact O-CD2 3.39Å; M575-L698 HydrophobicContact CE-CB 4.11Å; M575-L698 HydrophobicContact CE-CD1 3.58Å; M575-L698 HydrophobicContact CE-CG 4.35Å; M575-L698 HydrophobicContact CG-CD1 3.99Å; M575-V981 HydrophobicContact CB-CG1 4.46Å; M575-V981 HydrophobicContact CG-CG1 4.28Å
576	L	92.3	Very high	91	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-72.1	-21.3	-175.5	-66.3	-178.4	0	0	0	114	L517 P520 T572 R574 S643 R644 N647	L517-L576 HydrophobicContact CD2-CD2 3.85Å; P520-L576 HydrophobicContact CB-CD2 3.64Å; P520-L576 HydrophobicContact CB-CG 4.32Å; P520-L576 HydrophobicContact CG-CD2 3.87Å; T572-L576 HydrophobicContact CG2-CD1 3.72Å; T572-L576 HydrophobicContact CG2-CG 4.16Å; T572-L576 WeakPolarHBondContact O-CB 3.49Å; T572-L576 WeakPolarHBondContact O-CG 3.37Å; T572-L576 PolarHBondContact O-N 2.77Å; R574-L576 PolarHBondContact O-N 3.42Å; L576-S643 WeakPolarHBondContact CD1-O 3.22Å; L576-R644 HydrophobicContact CB-CG 3.83Å; L576-R644 PolarHBondContact O-NH1 3.09Å; L576-N647 HydrophobicContact CD1-CB 3.99Å
577	N	91.1	Very high	90.6	Very high	84 Å²	84	49.1 Å²	49.1	45%	0.449	26%	0.261	S	S	.	.	H	α-helix	trans	-76.5	-30.7	172.6	-74.9	-0.1	0	0	0	112.4	Q573 R574 M575 F579 K580	Q573-N577 PolarHBondContact NE2-OD1 2.95Å; Q573-N577 VanDerWaalsContact O-CB 3.31Å; Q573-N577 WeakPolarHBondContact O-CB 3.33Å; Q573-N577 PolarHBondContact O-N 3.14Å; Q573-N577 VanDerWaalsContact O-N 3.09Å; Q573-N577 PolarHBondContact O-ND2 3.49Å; Q573-N577 PolarHBondContact O-OD1 2.89Å; R574-N577 PolarHBondContact O-N 2.76Å; M575-N577 VanDerWaalsContact C-N 3.3Å; M575-N577 PolarHBondContact O-N 3.13Å; N577-F579 PolarHBondContact O-N 3.01Å; N577-K580 WeakPolarHBondContact O-CB 3.43Å; N577-K580 PolarHBondContact O-N 2.89Å
578	M	89.7	Confident	90.5	Very high	44 Å²	44	56 Å²	56	22%	0.217	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-32.4	177.1	-65.6	152.9	-167	0	0	111.8	R574 M575 K580 V695 V981 A984 E985	R574-M578 HydrophobicContact CB-CE 4.14Å; R574-M578 WeakPolarHBondContact O-CE 3.24Å; R574-M578 WeakPolarHBondContact O-CG 3.47Å; R574-M578 PolarHBondContact O-N 2.88Å; M575-M578 WeakPolarHBondContact O-CB 3.43Å; M575-M578 PolarHBondContact O-N 2.72Å; M578-K580 VanDerWaalsContact C-N 3.27Å; M578-K580 PolarHBondContact O-N 3.44Å; M578-V695 HydrophobicContact CE-CG2 3.35Å; M578-V695 HydrophobicContact SD-CG1 4.21Å; M578-V695 HydrophobicContact SD-CG2 3.95Å; M578-V981 HydrophobicContact SD-CG1 3.98Å; M578-A984 HydrophobicContact CB-CB 4.15Å; M578-E985 HydrophobicContact SD-CB 4.35Å
579	F	90.1	Very high	90.1	Very high	9 Å²	9	58.4 Å²	58.4	4%	0.039	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	4.7	175.5	-65.2	-69.6	0	0	0	114.8	A516 L517 P520 M575 N577 Q640 N980 V981 A984	A516-F579 WeakPolarHBondContact O-CZ 3.41Å; L517-F579 HydrophobicContact CD2-CD2 4.12Å; L517-F579 HydrophobicContact CD2-CE2 3.99Å; P520-F579 HydrophobicContact CG-CE2 4.08Å; M575-F579 WeakPolarHBondContact O-CD2 3.39Å; N577-F579 PolarHBondContact O-N 3.01Å; F579-Q640 HydrophobicContact CB-CG 4.2Å; F579-N980 HydrophobicContact CE1-CB 4.33Å; F579-N980 WeakPolarHBondContact CE1-O 3.33Å; F579-N980 HydrophobicContact CZ-CB 4.29Å; F579-V981 HydrophobicContact CE2-CG2 3.91Å; F579-V981 HydrophobicContact CZ-CB 4.35Å; F579-V981 HydrophobicContact CZ-CG2 3.8Å; F579-A984 HydrophobicContact CD1-CB 3.37Å; F579-A984 HydrophobicContact CE1-CB 3.55Å; F579-A984 HydrophobicContact CG-CB 4.04Å; F579-A984 HydrophobicContact CZ-CB 4.34Å
580	K	90.4	Very high	89.7	Confident	75 Å²	75	65.2 Å²	65.2	33%	0.326	33%	0.327	S	S	.	.			trans	-84.3	119.8	172.6	-172.3	177.6	-179.1	172.9	0	109.5	N577 M578 D584 L585	N577-K580 WeakPolarHBondContact O-CB 3.43Å; N577-K580 PolarHBondContact O-N 2.89Å; M578-K580 VanDerWaalsContact C-N 3.27Å; M578-K580 PolarHBondContact O-N 3.44Å; K580-D584 HydrophobicContact CG-CB 4.08Å; K580-L585 WeakPolarHBondContact CE-O 3.32Å; K580-L585 PolarHBondContact NZ-O 2.92Å
581	R	87.6	Confident	89.7	Confident	60 Å²	60	67.1 Å²	67.1	23%	0.226	34%	0.339	C	S	.	.			trans	-73.9	147.5	176.3	-57.7	175	-61.3	168.6	10.7	109.7	T583 D584 Y990 D991	R581-T583 PolarHBondContact O-N 3.27Å; R581-T583 VanDerWaalsContact O-N 3.08Å; R581-D584 WeakPolarHBondContact CB-OD2 3.43Å; R581-D584 IonicContact CZ-OD1 2.68Å; R581-D584 VanDerWaalsContact CZ-OD1 3.25Å; R581-D584 PolarHBondContact N-OD2 3.13Å; R581-D584 IonicContact NE-OD1 3.24Å; R581-D584 PolarHBondContact NE-OD1 3.21Å; R581-D584 IonicContact NE-OD2 3.75Å; R581-D584 IonicContact NH2-OD1 3.73Å; R581-D584 PolarHBondContact NH2-OD1 3.26Å; R581-D584 WeakPolarHBondContact O-CB 3.49Å; R581-D584 PolarHBondContact O-N 2.76Å; R581-Y990 HydrophobicContact CG-CD1 4.08Å; R581-Y990 HydrophobicContact CG-CE1 3.82Å; R581-D991 IonicContact CZ-OD2 2.79Å; R581-D991 IonicContact NH1-OD2 2.68Å; R581-D991 PolarHBondContact NH1-OD2 3.01Å
582	P	86.7	Confident	89.7	Confident	143 Å²	143	68.9 Å²	68.9	93%	0.929	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.1	172.6	-25.3	35.1	0	0	0	114.1
583	T	87.7	Confident	89.6	Confident	121 Å²	121	72.7 Å²	72.7	74%	0.742	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-1.6	177.9	50.7	0	0	0	0	114.1	R581	R581-T583 PolarHBondContact O-N 3.27Å; R581-T583 VanDerWaalsContact O-N 3.08Å
584	D	87.2	Confident	89.7	Confident	28 Å²	28	75.4 Å²	75.4	15%	0.15	39%	0.386	C	S	.	.	S	Bend	trans	-73.3	142.2	172.5	-72.5	-33.3	0	0	0	110.5	K580 R581	K580-D584 HydrophobicContact CG-CB 4.08Å; R581-D584 WeakPolarHBondContact CB-OD2 3.43Å; R581-D584 IonicContact CZ-OD1 2.68Å; R581-D584 VanDerWaalsContact CZ-OD1 3.25Å; R581-D584 PolarHBondContact N-OD2 3.13Å; R581-D584 IonicContact NE-OD1 3.24Å; R581-D584 PolarHBondContact NE-OD1 3.21Å; R581-D584 IonicContact NE-OD2 3.75Å; R581-D584 IonicContact NH2-OD1 3.73Å; R581-D584 PolarHBondContact NH2-OD1 3.26Å; R581-D584 WeakPolarHBondContact O-CB 3.49Å; R581-D584 PolarHBondContact O-N 2.76Å
585	L	88.4	Confident	89.8	Confident	145 Å²	145	75.5 Å²	75.5	76%	0.759	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-55	157.2	180	-66.4	174.3	0	0	0	112.8	K580 E587	K580-L585 WeakPolarHBondContact CE-O 3.32Å; K580-L585 PolarHBondContact NZ-O 2.92Å; L585-E587 PolarHBondContact O-N 3.43Å
586	P	87.9	Confident	90	Very high	86 Å²	86	76.2 Å²	76.2	56%	0.558	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-53	134	167.2	-25.8	35.8	0	0	0	111.2	Y588	P586-Y588 HydrophobicContact CB-CE1 4.41Å; P586-Y588 HydrophobicContact CB-CE2 4.35Å
587	E	86.4	Confident	90	Very high	59 Å²	59	80.8 Å²	80.8	28%	0.276	43%	0.43	S	S	.	.			trans	-110.4	124.4	179.1	-72.3	-173.8	-177.8	0	0	110	L585 N589 R644	L585-E587 PolarHBondContact O-N 3.43Å; E587-N589 VanDerWaalsContact C-N 3.31Å; E587-N589 PolarHBondContact O-N 2.63Å; E587-N589 PolarHBondContact OE2-ND2 3.44Å; E587-R644 VanDerWaalsContact CD-NE 3.28Å; E587-R644 IonicContact OE1-CZ 2.94Å; E587-R644 VanDerWaalsContact OE1-CZ 3.23Å; E587-R644 IonicContact OE1-NE 2.69Å; E587-R644 PolarHBondContact OE1-NE 3.32Å; E587-R644 IonicContact OE1-NH2 2.88Å; E587-R644 PolarHBondContact OE1-NH2 3.19Å; E587-R644 WeakPolarHBondContact OE2-CD 3.36Å; E587-R644 IonicContact OE2-CZ 3.87Å; E587-R644 IonicContact OE2-NE 2.84Å; E587-R644 PolarHBondContact OE2-NE 2.76Å
588	Y	91.6	Very high	90.2	Very high	143 Å²	143	78.5 Å²	78.5	56%	0.561	43%	0.427	S	S	*	.			trans	-96.7	46.6	-178	-53	-73.4	0	0	0	111.2	P586 Y590 V591	P586-Y588 HydrophobicContact CB-CE1 4.41Å; P586-Y588 HydrophobicContact CB-CE2 4.35Å; Y588-Y590 AromaticContact CD1-CE1 3.85Å; Y588-Y590 HydrophobicContact CD1-CE1 3.85Å; Y588-Y590 AromaticContact CD1-CZ 3.89Å; Y588-Y590 WeakPolarHBondContact CD1-OH 3.45Å; Y588-Y590 HydrophobicContact CG-CE1 4.49Å; Y588-Y590 PolarHBondContact O-N 2.86Å; Y588-V591 VanDerWaalsContact O-CB 3.25Å; Y588-V591 WeakPolarHBondContact O-CB 3.49Å; Y588-V591 VanDerWaalsContact O-CG2 3.26Å; Y588-V591 WeakPolarHBondContact O-CG2 3.35Å; Y588-V591 PolarHBondContact O-N 2.95Å
589	N	85.4	Confident	90.5	Very high	51 Å²	51	78.5 Å²	78.5	27%	0.273	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-59.1	-21	-173.8	-65.7	-36	0	0	0	113.4	E587 V591 L592	E587-N589 VanDerWaalsContact C-N 3.31Å; E587-N589 PolarHBondContact O-N 2.63Å; E587-N589 PolarHBondContact OE2-ND2 3.44Å; N589-V591 PolarHBondContact O-N 2.84Å; N589-L592 WeakPolarHBondContact O-CB 3.44Å; N589-L592 PolarHBondContact O-N 3.46Å
590	Y	88.2	Confident	90.6	Very high	159 Å²	159	80.6 Å²	80.6	62%	0.624	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-63.7	-19.5	171.5	63.7	-99.8	0	0	0	113.7	Y588 L592 T593	Y588-Y590 AromaticContact CD1-CE1 3.85Å; Y588-Y590 HydrophobicContact CD1-CE1 3.85Å; Y588-Y590 AromaticContact CD1-CZ 3.89Å; Y588-Y590 WeakPolarHBondContact CD1-OH 3.45Å; Y588-Y590 HydrophobicContact CG-CE1 4.49Å; Y588-Y590 PolarHBondContact O-N 2.86Å; Y590-L592 PolarHBondContact O-N 3.26Å; Y590-T593 WeakPolarHBondContact O-CB 3.46Å; Y590-T593 VanDerWaalsContact O-CG2 3.31Å; Y590-T593 WeakPolarHBondContact O-CG2 3.35Å; Y590-T593 PolarHBondContact O-N 3.18Å; Y590-T593 PolarHBondContact O-OG1 3.24Å
591	V	93.1	Very high	90.8	Very high	70 Å²	70	79 Å²	79	42%	0.424	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-62.4	-23.5	174.3	174.8	0	0	0	0	111.4	Y588 N589 T593 I594	Y588-V591 VanDerWaalsContact O-CB 3.25Å; Y588-V591 WeakPolarHBondContact O-CB 3.49Å; Y588-V591 VanDerWaalsContact O-CG2 3.26Å; Y588-V591 WeakPolarHBondContact O-CG2 3.35Å; Y588-V591 PolarHBondContact O-N 2.95Å; N589-V591 PolarHBondContact O-N 2.84Å; V591-T593 PolarHBondContact O-N 3.47Å; V591-T593 VanDerWaalsContact O-N 3.14Å; V591-I594 HydrophobicContact CG1-CD1 4.15Å; V591-I594 WeakPolarHBondContact O-CB 3.43Å; V591-I594 WeakPolarHBondContact O-CG1 3.48Å; V591-I594 PolarHBondContact O-N 3.46Å
592	L	91.9	Very high	91.1	Very high	40 Å²	40	80.7 Å²	80.7	21%	0.209	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-67.6	-7.6	172.8	-60.3	169.7	0	0	0	113.2	N589 Y590 I594 P595 V645 A648 I652	N589-L592 WeakPolarHBondContact O-CB 3.44Å; N589-L592 PolarHBondContact O-N 3.46Å; Y590-L592 PolarHBondContact O-N 3.26Å; L592-I594 VanDerWaalsContact C-N 3.26Å; L592-I594 PolarHBondContact O-N 3.27Å; L592-P595 WeakPolarHBondContact O-CD 3.3Å; L592-P595 WeakPolarHBondContact O-CG 2.98Å; L592-V645 HydrophobicContact CD1-CB 4.31Å; L592-V645 HydrophobicContact CD1-CG1 3.87Å; L592-V645 HydrophobicContact CD1-CG2 4.32Å; L592-V645 HydrophobicContact CD2-CG1 4.48Å; L592-A648 HydrophobicContact CB-CB 4.36Å; L592-A648 HydrophobicContact CD1-CB 3.48Å; L592-A648 VanDerWaalsContact CD1-CB 3.48Å; L592-I652 HydrophobicContact CB-CD1 4.5Å
593	T	91.7	Very high	91.5	Very high	80 Å²	80	74.1 Å²	74.1	49%	0.491	42%	0.417	S	S	.	.	H	α-helix	trans	-65.7	-27.9	165.5	58.5	0	0	0	0	112.5	Y590 V591 A596 T597	Y590-T593 WeakPolarHBondContact O-CB 3.46Å; Y590-T593 VanDerWaalsContact O-CG2 3.31Å; Y590-T593 WeakPolarHBondContact O-CG2 3.35Å; Y590-T593 PolarHBondContact O-N 3.18Å; Y590-T593 PolarHBondContact O-OG1 3.24Å; V591-T593 PolarHBondContact O-N 3.47Å; V591-T593 VanDerWaalsContact O-N 3.14Å; T593-A596 WeakPolarHBondContact O-CB 3.45Å; T593-A596 PolarHBondContact O-N 3.4Å; T593-T597 WeakPolarHBondContact O-CG2 3.34Å; T593-T597 PolarHBondContact O-N 3.22Å; T593-T597 PolarHBondContact O-OG1 3.4Å; T593-T597 VanDerWaalsContact O-OG1 3.05Å
594	I	94.8	Very high	91.7	Very high	113 Å²	113	69.6 Å²	69.6	58%	0.579	40%	0.395	S	S	*	.	H	α-helix	trans	-63.4	-53	-179.3	-60.1	175.7	0	0	0	112.4	V591 L592 A596 T597 G598	V591-I594 HydrophobicContact CG1-CD1 4.15Å; V591-I594 WeakPolarHBondContact O-CB 3.43Å; V591-I594 WeakPolarHBondContact O-CG1 3.48Å; V591-I594 PolarHBondContact O-N 3.46Å; L592-I594 VanDerWaalsContact C-N 3.26Å; L592-I594 PolarHBondContact O-N 3.27Å; I594-A596 PolarHBondContact O-N 2.95Å; I594-T597 PolarHBondContact O-N 3.24Å; I594-T597 PolarHBondContact O-OG1 2.99Å; I594-G598 PolarHBondContact O-N 3.3Å
595	P	93	Very high	92	Very high	74 Å²	74	76.1 Å²	76.1	48%	0.481	42%	0.418	S	S	.	.	H	α-helix	trans	-65.5	-27.9	173.6	24.9	-34	0	0	0	112.6	L592 L599	L592-P595 WeakPolarHBondContact O-CD 3.3Å; L592-P595 WeakPolarHBondContact O-CG 2.98Å; P595-L599 WeakPolarHBondContact O-CB 3.38Å; P595-L599 PolarHBondContact O-N 3.05Å
596	A	94	Very high	92.2	Very high	17 Å²	17	69.5 Å²	69.5	14%	0.14	38%	0.384	C	S	.	.	H	α-helix	trans	-67.8	-48.5	176.2	0	0	0	0	0	112.4	T593 I594 G598 L599 L600 I652	T593-A596 WeakPolarHBondContact O-CB 3.45Å; T593-A596 PolarHBondContact O-N 3.4Å; I594-A596 PolarHBondContact O-N 2.95Å; A596-G598 VanDerWaalsContact C-N 3.34Å; A596-L599 PolarHBondContact O-N 3.5Å; A596-L600 WeakPolarHBondContact O-CB 3.26Å; A596-L600 VanDerWaalsContact O-CG 3.32Å; A596-L600 WeakPolarHBondContact O-CG 3.41Å; A596-L600 PolarHBondContact O-N 3.38Å; A596-I652 HydrophobicContact CB-CD1 3.93Å; A596-I652 HydrophobicContact CB-CG1 3.77Å; A596-I652 HydrophobicContact CB-CG2 4.39Å
597	T	94.2	Very high	92.4	Very high	95 Å²	95	68.2 Å²	68.2	58%	0.583	37%	0.372	S	S	*	.	H	α-helix	trans	-71.5	-29.9	176.3	55.8	0	0	0	0	111.9	T593 I594 G601	T593-T597 WeakPolarHBondContact O-CG2 3.34Å; T593-T597 PolarHBondContact O-N 3.22Å; T593-T597 PolarHBondContact O-OG1 3.4Å; T593-T597 VanDerWaalsContact O-OG1 3.05Å; I594-T597 PolarHBondContact O-N 3.24Å; I594-T597 PolarHBondContact O-OG1 2.99Å; T597-G601 WeakPolarHBondContact O-CA 3.41Å; T597-G601 PolarHBondContact O-N 3.32Å
598	G	94.9	Very high	92.6	Very high	37 Å²	37	72.7 Å²	72.7	38%	0.381	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-53.5	168.9	0	0	0	0	0	112.2	I594 A596 G601 V602	I594-G598 PolarHBondContact O-N 3.3Å; A596-G598 VanDerWaalsContact C-N 3.34Å; G598-G601 PolarHBondContact O-N 2.94Å; G598-V602 WeakPolarHBondContact O-CB 3.09Å; G598-V602 WeakPolarHBondContact O-CG2 3.3Å; G598-V602 PolarHBondContact O-N 3.47Å
599	L	94.9	Very high	92.6	Very high	44 Å²	44	69.3 Å²	69.3	23%	0.23	39%	0.392	C	S	.	.	H	α-helix	trans	-58.8	-52.5	178	176.2	61.8	0	0	0	111.9	P595 A596 G601 Y603 A625 I652	P595-L599 WeakPolarHBondContact O-CB 3.38Å; P595-L599 PolarHBondContact O-N 3.05Å; A596-L599 PolarHBondContact O-N 3.5Å; L599-G601 VanDerWaalsContact C-N 3.34Å; L599-G601 PolarHBondContact O-N 3.27Å; L599-Y603 WeakPolarHBondContact O-CB 3.35Å; L599-Y603 PolarHBondContact O-N 3.44Å; L599-A625 HydrophobicContact CD1-CB 4.05Å; L599-A625 HydrophobicContact CD2-CB 4.37Å; L599-I652 HydrophobicContact CD2-CG2 4.33Å
600	L	93.8	Very high	92.8	Very high	52 Å²	52	69.8 Å²	69.8	27%	0.272	39%	0.394	S	S	.	.	H	α-helix	trans	-70.2	-30.2	-178	-63.8	177.8	0	0	0	112.7	A596 G604 T655 I659	A596-L600 WeakPolarHBondContact O-CB 3.26Å; A596-L600 VanDerWaalsContact O-CG 3.32Å; A596-L600 WeakPolarHBondContact O-CG 3.41Å; A596-L600 PolarHBondContact O-N 3.38Å; L600-G604 PolarHBondContact O-N 3.1Å; L600-T655 HydrophobicContact CD1-CG2 4.35Å; L600-I659 HydrophobicContact CD1-CD1 3.85Å; L600-I659 HydrophobicContact CD2-CB 4.21Å; L600-I659 HydrophobicContact CD2-CD1 3.76Å; L600-I659 HydrophobicContact CD2-CG2 4.14Å; L600-I659 HydrophobicContact CG-CD1 4.42Å
601	G	93.8	Very high	92.8	Very high	41 Å²	41	65.5 Å²	65.5	42%	0.423	39%	0.386	S	S	.	.	H	α-helix	trans	-71.5	-43	176.1	0	0	0	0	0	112.7	T597 G598 L599 G604 Y605	T597-G601 WeakPolarHBondContact O-CA 3.41Å; T597-G601 PolarHBondContact O-N 3.32Å; G598-G601 PolarHBondContact O-N 2.94Å; L599-G601 VanDerWaalsContact C-N 3.34Å; L599-G601 PolarHBondContact O-N 3.27Å; G601-G604 PolarHBondContact O-N 3.23Å; G601-Y605 VanDerWaalsContact O-CB 3.29Å; G601-Y605 WeakPolarHBondContact O-CB 3.48Å; G601-Y605 PolarHBondContact O-N 3.03Å
602	V	93.9	Very high	92.3	Very high	97 Å²	97	66.9 Å²	66.9	59%	0.588	40%	0.396	S	S	*	.	H	α-helix	trans	-64.2	-44	172.7	170.8	0	0	0	0	110.6	G598 Y605 A606	G598-V602 WeakPolarHBondContact O-CB 3.09Å; G598-V602 WeakPolarHBondContact O-CG2 3.3Å; G598-V602 PolarHBondContact O-N 3.47Å; V602-Y605 PolarHBondContact O-N 3.13Å; V602-A606 WeakPolarHBondContact O-CB 3.42Å; V602-A606 PolarHBondContact O-N 3.48Å
603	Y	95	Very high	91.7	Very high	5 Å²	5	69.5 Å²	69.5	2%	0.02	42%	0.418	C	S	.	.	H	α-helix	trans	-61.5	-47	175.6	178.2	-102.1	0	0	0	112.5	L599 A606 L607 M618 H619 T622 I659 S660 G663	L599-Y603 WeakPolarHBondContact O-CB 3.35Å; L599-Y603 PolarHBondContact O-N 3.44Å; Y603-A606 WeakPolarHBondContact O-CB 3.44Å; Y603-A606 PolarHBondContact O-N 3.15Å; Y603-L607 WeakPolarHBondContact O-CB 3.17Å; Y603-L607 PolarHBondContact O-N 3.4Å; Y603-M618 HydrophobicContact CD2-CG 3.94Å; Y603-M618 HydrophobicContact CE2-CG 4.25Å; Y603-H619 AromaticContact CE2-ND1 3.75Å; Y603-H619 AromaticContact CZ-ND1 3.76Å; Y603-H619 PolarHBondContact OH-CE1 3.02Å; Y603-H619 PolarHBondContact OH-ND1 2.77Å; Y603-T622 HydrophobicContact CD2-CG2 4.12Å; Y603-T622 VanDerWaalsContact CD2-OG1 3.23Å; Y603-T622 WeakPolarHBondContact CD2-OG1 3.43Å; Y603-T622 HydrophobicContact CG-CG2 4.43Å; Y603-I659 HydrophobicContact CD1-CG2 3.86Å; Y603-I659 HydrophobicContact CE1-CG2 3.77Å; Y603-S660 WeakPolarHBondContact OH-CA 3.23Å; Y603-S660 PolarHBondContact OH-O 2.81Å; Y603-S660 VanDerWaalsContact OH-O 3.12Å; Y603-G663 WeakPolarHBondContact OH-CA 2.98Å
604	G	92.8	Very high	91.4	Very high	26 Å²	26	69.9 Å²	69.9	27%	0.268	42%	0.416	S	S	.	.	H	α-helix	trans	-65	-38.2	177.6	0	0	0	0	0	113.2	L600 G601 L607 L608	L600-G604 PolarHBondContact O-N 3.1Å; G601-G604 PolarHBondContact O-N 3.23Å; G604-L607 PolarHBondContact O-N 2.83Å; G604-L608 VanDerWaalsContact O-CG 3.31Å; G604-L608 WeakPolarHBondContact O-CG 3.32Å; G604-L608 PolarHBondContact O-N 2.95Å
605	Y	93.4	Very high	91	Very high	165 Å²	165	64.9 Å²	64.9	65%	0.647	39%	0.391	S	S	*	.	H	α-helix	trans	-63.1	-44.9	172.3	177.7	-97.2	0	0	0	111.4	G601 V602 L607 L608 T609	G601-Y605 VanDerWaalsContact O-CB 3.29Å; G601-Y605 WeakPolarHBondContact O-CB 3.48Å; G601-Y605 PolarHBondContact O-N 3.03Å; V602-Y605 PolarHBondContact O-N 3.13Å; Y605-L607 PolarHBondContact O-N 3.18Å; Y605-L608 PolarHBondContact O-N 3.47Å; Y605-T609 HydrophobicContact CD2-CG2 4.14Å; Y605-T609 HydrophobicContact CE1-CG2 4.33Å; Y605-T609 HydrophobicContact CE2-CG2 3.75Å; Y605-T609 WeakPolarHBondContact O-CB 3.46Å; Y605-T609 WeakPolarHBondContact O-CG2 3.31Å; Y605-T609 PolarHBondContact O-N 3.45Å; Y605-T609 VanDerWaalsContact O-N 3.13Å; Y605-T609 PolarHBondContact O-OG1 2.95Å
606	A	92.2	Very high	90.6	Very high	5 Å²	5	65.2 Å²	65.2	4%	0.041	39%	0.391	C	S	.	.	H	α-helix	trans	-60.1	-45.6	176.3	0	0	0	0	0	111.8	V602 Y603 L608 T609 L610 M618	V602-A606 WeakPolarHBondContact O-CB 3.42Å; V602-A606 PolarHBondContact O-N 3.48Å; Y603-A606 WeakPolarHBondContact O-CB 3.44Å; Y603-A606 PolarHBondContact O-N 3.15Å; A606-L608 PolarHBondContact O-N 3.39Å; A606-T609 PolarHBondContact O-N 3.3Å; A606-T609 VanDerWaalsContact O-N 3.17Å; A606-L610 HydrophobicContact CB-CD1 3.81Å; A606-L610 HydrophobicContact CB-CG 4.23Å; A606-L610 WeakPolarHBondContact O-CB 3.32Å; A606-L610 PolarHBondContact O-N 2.81Å; A606-M618 HydrophobicContact CB-CE 4.12Å; A606-M618 HydrophobicContact CB-CG 3.94Å; A606-M618 HydrophobicContact CB-SD 4.35Å
607	L	90.9	Very high	90.4	Very high	59 Å²	59	69.4 Å²	69.4	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-59	-28.8	177.1	-164.6	73.8	0	0	0	113.3	Y603 G604 Y605 L615	Y603-L607 WeakPolarHBondContact O-CB 3.17Å; Y603-L607 PolarHBondContact O-N 3.4Å; G604-L607 PolarHBondContact O-N 2.83Å; Y605-L607 PolarHBondContact O-N 3.18Å; L607-L615 HydrophobicContact CD1-CD1 4.28Å; L607-L615 HydrophobicContact CD1-CD2 4.45Å
608	L	90.7	Very high	90.2	Very high	154 Å²	154	67.3 Å²	67.3	81%	0.806	40%	0.396	S	S	*	.	H	α-helix	trans	-93.8	-9.8	-179.8	-68.4	172	0	0	0	114.5	G604 Y605 A606	G604-L608 VanDerWaalsContact O-CG 3.31Å; G604-L608 WeakPolarHBondContact O-CG 3.32Å; G604-L608 PolarHBondContact O-N 2.95Å; Y605-L608 PolarHBondContact O-N 3.47Å; A606-L608 PolarHBondContact O-N 3.39Å
609	T	93.1	Very high	90.1	Very high	72 Å²	72	65.9 Å²	65.9	44%	0.442	38%	0.379	S	S	.	.	H	α-helix	trans	-133.6	-22.1	-169.5	59.6	0	0	0	0	115.7	Y605 A606	Y605-T609 HydrophobicContact CD2-CG2 4.14Å; Y605-T609 HydrophobicContact CE1-CG2 4.33Å; Y605-T609 HydrophobicContact CE2-CG2 3.75Å; Y605-T609 WeakPolarHBondContact O-CB 3.46Å; Y605-T609 WeakPolarHBondContact O-CG2 3.31Å; Y605-T609 PolarHBondContact O-N 3.45Å; Y605-T609 VanDerWaalsContact O-N 3.13Å; Y605-T609 PolarHBondContact O-OG1 2.95Å; A606-T609 PolarHBondContact O-N 3.3Å; A606-T609 VanDerWaalsContact O-N 3.17Å
610	L	89.1	Confident	90	Very high	60 Å²	60	67.5 Å²	67.5	31%	0.314	39%	0.386	S	S	.	.	S	Bend	trans	-88	145.4	177.5	-61.7	-176.9	0	0	0	111.4	A606 L614 L615 M618	A606-L610 HydrophobicContact CB-CD1 3.81Å; A606-L610 HydrophobicContact CB-CG 4.23Å; A606-L610 WeakPolarHBondContact O-CB 3.32Å; A606-L610 PolarHBondContact O-N 2.81Å; L610-L614 HydrophobicContact CB-CB 4.21Å; L610-L614 HydrophobicContact CD1-CB 4.24Å; L610-L615 HydrophobicContact CB-CD2 3.93Å; L610-M618 HydrophobicContact CD1-CE 4.31Å
611	P	87	Confident	90	Very high	69 Å²	69	69 Å²	69	45%	0.448	40%	0.397	S	S	.	.			trans	-66.5	153.3	171.2	30.3	-35.7	0	0	0	110.7	S613 L614	P611-S613 PolarHBondContact O-N 2.78Å; P611-L614 HydrophobicContact CG-CD1 4.03Å; P611-L614 PolarHBondContact O-N 3.04Å
612	P	82.5	Confident	90.1	Very high	100 Å²	100	67.3 Å²	67.3	65%	0.649	38%	0.379	S	S	*	.	H	α-helix	trans	-52.8	-31.8	-174.5	-30.5	36.2	0	0	0	115.6	L614 L615	P612-L614 PolarHBondContact O-N 2.81Å; P612-L615 PolarHBondContact O-N 2.94Å; P612-L615 VanDerWaalsContact O-N 3.14Å
613	S	81.2	Confident	90.2	Very high	94 Å²	94	62.8 Å²	62.8	66%	0.657	35%	0.351	S	S	*	.	H	α-helix	trans	-62	-25.6	177	50.6	0	0	0	0	114.5	P611	P611-S613 PolarHBondContact O-N 2.78Å
614	L	83.6	Confident	90.3	Very high	88 Å²	88	67.4 Å²	67.4	46%	0.461	38%	0.375	S	S	.	.	H	α-helix	trans	-96.2	-11.1	176.5	-78.4	166.1	0	0	0	113.1	L610 P611 P612	L610-L614 HydrophobicContact CB-CB 4.21Å; L610-L614 HydrophobicContact CD1-CB 4.24Å; P611-L614 HydrophobicContact CG-CD1 4.03Å; P611-L614 PolarHBondContact O-N 3.04Å; P612-L614 PolarHBondContact O-N 2.81Å
615	L	87.8	Confident	90.5	Very high	8 Å²	8	67.5 Å²	67.5	4%	0.042	37%	0.373	C	S	.	.	H	α-helix	trans	-71.1	-36.3	177.4	-63.8	-178.2	0	0	0	111.6	L607 L610 P612 D617 M618 H619	L607-L615 HydrophobicContact CD1-CD1 4.28Å; L607-L615 HydrophobicContact CD1-CD2 4.45Å; L610-L615 HydrophobicContact CB-CD2 3.93Å; P612-L615 PolarHBondContact O-N 2.94Å; P612-L615 VanDerWaalsContact O-N 3.14Å; L615-D617 PolarHBondContact O-N 3.23Å; L615-M618 CarbonylContact O-C 3.57Å; L615-M618 WeakPolarHBondContact O-CA 3.38Å; L615-M618 WeakPolarHBondContact O-CB 3.45Å; L615-M618 PolarHBondContact O-N 3.46Å; L615-H619 VanDerWaalsContact C-CD2 3.42Å; L615-H619 PolarHBondContact O-CD2 3.11Å; L615-H619 VanDerWaalsContact O-CG 3.3Å; L615-H619 PolarHBondContact O-N 2.94Å
616	T	85	Confident	90.7	Very high	81 Å²	81	59.6 Å²	59.6	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-51.3	-50.1	177.5	-50.4	0	0	0	0	112.9	M618 H619 Q620	T616-M618 VanDerWaalsContact C-N 3.31Å; T616-M618 PolarHBondContact O-N 3.36Å; T616-H619 PolarHBondContact O-N 3.33Å; T616-Q620 PolarHBondContact O-N 3.3Å
617	D	88.4	Confident	91	Very high	106 Å²	106	59.6 Å²	59.6	57%	0.567	34%	0.342	S	S	*	.	H	α-helix	trans	-67.8	-32.5	178.3	-67.5	-25.8	0	0	0	112	L615 T621	L615-D617 PolarHBondContact O-N 3.23Å; D617-T621 VanDerWaalsContact O-CB 3.23Å; D617-T621 WeakPolarHBondContact O-CB 3.4Å; D617-T621 PolarHBondContact O-N 3.43Å; D617-T621 PolarHBondContact O-OG1 3.03Å
618	M	91.4	Very high	91.3	Very high	50 Å²	50	61.7 Å²	61.7	25%	0.246	35%	0.353	C	S	.	.	H	α-helix	trans	-70	-39.2	176.3	-169.6	58.4	61.9	0	0	112	Y603 A606 L610 L615 T616 T621 T622	Y603-M618 HydrophobicContact CD2-CG 3.94Å; Y603-M618 HydrophobicContact CE2-CG 4.25Å; A606-M618 HydrophobicContact CB-CE 4.12Å; A606-M618 HydrophobicContact CB-CG 3.94Å; A606-M618 HydrophobicContact CB-SD 4.35Å; L610-M618 HydrophobicContact CD1-CE 4.31Å; L615-M618 CarbonylContact O-C 3.57Å; L615-M618 WeakPolarHBondContact O-CA 3.38Å; L615-M618 WeakPolarHBondContact O-CB 3.45Å; L615-M618 PolarHBondContact O-N 3.46Å; T616-M618 VanDerWaalsContact C-N 3.31Å; T616-M618 PolarHBondContact O-N 3.36Å; M618-T621 PolarHBondContact O-N 2.96Å; M618-T622 VanDerWaalsContact O-CB 3.31Å; M618-T622 WeakPolarHBondContact O-CB 3.41Å; M618-T622 PolarHBondContact O-N 3.41Å; M618-T622 PolarHBondContact O-OG1 3.25Å
619	H	92.7	Very high	91.6	Very high	7 Å²	7	55.5 Å²	55.5	3%	0.032	32%	0.322	C	S	.	.	H	α-helix	trans	-62.2	-46.3	173.6	-59	-54.3	0	0	0	111.2	Y603 L615 T616 T622 Y623 S660 G663 L664	Y603-H619 AromaticContact CE2-ND1 3.75Å; Y603-H619 AromaticContact CZ-ND1 3.76Å; Y603-H619 PolarHBondContact OH-CE1 3.02Å; Y603-H619 PolarHBondContact OH-ND1 2.77Å; L615-H619 VanDerWaalsContact C-CD2 3.42Å; L615-H619 PolarHBondContact O-CD2 3.11Å; L615-H619 VanDerWaalsContact O-CG 3.3Å; L615-H619 PolarHBondContact O-N 2.94Å; T616-H619 PolarHBondContact O-N 3.33Å; H619-T622 PolarHBondContact O-N 3.47Å; H619-Y623 PolarHBondContact O-N 3.37Å; H619-S660 WeakPolarHBondContact CA-OG 3.2Å; H619-S660 PolarHBondContact O-OG 3.31Å; H619-S660 VanDerWaalsContact O-OG 3.06Å; H619-G663 PolarHBondContact CE1-O 3.27Å; H619-L664 PolarHBondContact CE1-N 3.03Å
620	Q	92.1	Very high	91.8	Very high	79 Å²	79	52.1 Å²	52.1	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-67.8	-39	178.5	-67.5	-65.2	-16.3	0	0	112.4	T616 T622 Y623 L624 S862	T616-Q620 PolarHBondContact O-N 3.3Å; Q620-T622 VanDerWaalsContact C-N 3.31Å; Q620-T622 PolarHBondContact O-N 3.41Å; Q620-Y623 WeakPolarHBondContact O-CB 3.41Å; Q620-Y623 PolarHBondContact O-N 2.73Å; Q620-L624 PolarHBondContact O-N 3.16Å; Q620-S862 PolarHBondContact OE1-OG 3.02Å
621	T	93.6	Very high	92.2	Very high	84 Å²	84	50.6 Å²	50.6	52%	0.515	29%	0.293	S	S	.	.	H	α-helix	trans	-65.1	-36.1	174.1	-60.8	0	0	0	0	111.4	D617 M618 L624 A625	D617-T621 VanDerWaalsContact O-CB 3.23Å; D617-T621 WeakPolarHBondContact O-CB 3.4Å; D617-T621 PolarHBondContact O-N 3.43Å; D617-T621 PolarHBondContact O-OG1 3.03Å; M618-T621 PolarHBondContact O-N 2.96Å; T621-L624 PolarHBondContact O-N 3.32Å; T621-A625 PolarHBondContact O-N 2.65Å
622	T	95.8	Very high	92.7	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-71.7	-34.9	174.8	-54.2	0	0	0	0	111.7	Y603 M618 H619 Q620 A625 S626	Y603-T622 HydrophobicContact CD2-CG2 4.12Å; Y603-T622 VanDerWaalsContact CD2-OG1 3.23Å; Y603-T622 WeakPolarHBondContact CD2-OG1 3.43Å; Y603-T622 HydrophobicContact CG-CG2 4.43Å; M618-T622 VanDerWaalsContact O-CB 3.31Å; M618-T622 WeakPolarHBondContact O-CB 3.41Å; M618-T622 PolarHBondContact O-N 3.41Å; M618-T622 PolarHBondContact O-OG1 3.25Å; H619-T622 PolarHBondContact O-N 3.47Å; Q620-T622 VanDerWaalsContact C-N 3.31Å; Q620-T622 PolarHBondContact O-N 3.41Å; T622-A625 PolarHBondContact O-N 2.99Å; T622-S626 WeakPolarHBondContact O-CB 3.43Å; T622-S626 PolarHBondContact O-N 2.83Å
623	Y	96.5	Very high	93.3	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-37.6	168.6	-73.5	-25.8	0	0	0	112.6	H619 Q620 S627 T661 L863	H619-Y623 PolarHBondContact O-N 3.37Å; Q620-Y623 WeakPolarHBondContact O-CB 3.41Å; Q620-Y623 PolarHBondContact O-N 2.73Å; Y623-S627 WeakPolarHBondContact O-CB 3.48Å; Y623-S627 PolarHBondContact O-N 2.71Å; Y623-S627 PolarHBondContact O-OG 3.15Å; Y623-T661 PolarHBondContact OH-OG1 3.14Å; Y623-L863 HydrophobicContact CD1-CB 3.99Å; Y623-L863 HydrophobicContact CD1-CD2 3.77Å; Y623-L863 HydrophobicContact CE1-CD2 4.23Å; Y623-L863 HydrophobicContact CG-CB 4.01Å
624	L	96.2	Very high	94.1	Very high	102 Å²	102	39 Å²	39	53%	0.534	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-46.3	172.4	178.1	60.4	0	0	0	111.6	Q620 T621 S626 S627 L628	Q620-L624 PolarHBondContact O-N 3.16Å; T621-L624 PolarHBondContact O-N 3.32Å; L624-S626 PolarHBondContact O-N 3.38Å; L624-S627 WeakPolarHBondContact O-CB 3.44Å; L624-S627 PolarHBondContact O-N 3.07Å; L624-L628 HydrophobicContact CD1-CD1 4.21Å; L624-L628 HydrophobicContact CD1-CG 4.23Å; L624-L628 HydrophobicContact CG-CD1 4.14Å; L624-L628 WeakPolarHBondContact O-CG 3.46Å; L624-L628 PolarHBondContact O-N 3.44Å
625	A	97.1	Very high	94.7	Very high	27 Å²	27	37.7 Å²	37.7	22%	0.223	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-45.9	175.7	0	0	0	0	0	111.8	L599 T621 T622 S627 L628 C629	L599-A625 HydrophobicContact CD1-CB 4.05Å; L599-A625 HydrophobicContact CD2-CB 4.37Å; T621-A625 PolarHBondContact O-N 2.65Å; T622-A625 PolarHBondContact O-N 2.99Å; A625-S627 PolarHBondContact O-N 3.4Å; A625-L628 PolarHBondContact O-N 2.78Å; A625-C629 PolarHBondContact O-N 2.87Å; A625-C629 PolarHBondContact O-SG 3.16Å
626	S	97.6	Very high	95	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.7	-47.3	173.2	172.2	0	0	0	0	111.9	T622 L624 C629 C630 G653 S656 G657 L863	T622-S626 WeakPolarHBondContact O-CB 3.43Å; T622-S626 PolarHBondContact O-N 2.83Å; L624-S626 PolarHBondContact O-N 3.38Å; S626-C629 WeakPolarHBondContact O-CB 3.46Å; S626-C629 PolarHBondContact O-N 3.15Å; S626-C630 PolarHBondContact O-N 3.29Å; S626-C630 PolarHBondContact O-SG 3.01Å; S626-C630 VanDerWaalsContact O-SG 3.42Å; S626-G653 WeakPolarHBondContact CB-O 3.32Å; S626-G653 WeakPolarHBondContact O-CA 3.4Å; S626-G653 PolarHBondContact OG-O 2.91Å; S626-S656 WeakPolarHBondContact CB-OG 3.47Å; S626-G657 WeakPolarHBondContact OG-CA 3.44Å; S626-G657 PolarHBondContact OG-N 2.82Å; S626-L863 VanDerWaalsContact OG-CD1 3.24Å; S626-L863 WeakPolarHBondContact OG-CD1 3.27Å; S626-L863 WeakPolarHBondContact OG-CD2 3.5Å
627	S	97.8	Very high	95.5	Very high	4 Å²	4	34 Å²	34	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-44.9	177.5	-61.4	0	0	0	0	112.4	Y623 L624 A625 C629 C630 I631 L863	Y623-S627 WeakPolarHBondContact O-CB 3.48Å; Y623-S627 PolarHBondContact O-N 2.71Å; Y623-S627 PolarHBondContact O-OG 3.15Å; L624-S627 WeakPolarHBondContact O-CB 3.44Å; L624-S627 PolarHBondContact O-N 3.07Å; A625-S627 PolarHBondContact O-N 3.4Å; S627-C629 VanDerWaalsContact C-N 3.34Å; S627-C629 PolarHBondContact O-N 3Å; S627-C630 WeakPolarHBondContact O-CB 3.35Å; S627-C630 PolarHBondContact O-N 3.06Å; S627-I631 WeakPolarHBondContact O-CG1 3.39Å; S627-I631 PolarHBondContact O-N 3.28Å; S627-L863 VanDerWaalsContact OG-CD1 3.3Å; S627-L863 WeakPolarHBondContact OG-CD1 3.38Å
628	L	97.6	Very high	95.7	Very high	103 Å²	103	31.3 Å²	31.3	54%	0.539	18%	0.184	S	C	.	.	H	α-helix	trans	-65.2	-36.7	177.4	-69.9	171.1	0	0	0	111.9	L624 A625 I631 G632	L624-L628 HydrophobicContact CD1-CD1 4.21Å; L624-L628 HydrophobicContact CD1-CG 4.23Å; L624-L628 HydrophobicContact CG-CD1 4.14Å; L624-L628 WeakPolarHBondContact O-CG 3.46Å; L624-L628 PolarHBondContact O-N 3.44Å; A625-L628 PolarHBondContact O-N 2.78Å; L628-I631 HydrophobicContact CD2-CD1 4.45Å; L628-I631 PolarHBondContact O-N 2.95Å; L628-G632 PolarHBondContact O-N 2.99Å
629	C	97.5	Very high	95.7	Very high	24 Å²	24	31 Å²	31	16%	0.162	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-40.8	170.9	-75.1	0	0	0	0	112.2	A625 S626 S627 G632 A633 L649	A625-C629 PolarHBondContact O-N 2.87Å; A625-C629 PolarHBondContact O-SG 3.16Å; S626-C629 WeakPolarHBondContact O-CB 3.46Å; S626-C629 PolarHBondContact O-N 3.15Å; S627-C629 VanDerWaalsContact C-N 3.34Å; S627-C629 PolarHBondContact O-N 3Å; C629-G632 PolarHBondContact O-N 3.06Å; C629-A633 PolarHBondContact O-N 3.41Å; C629-L649 WeakPolarHBondContact CB-O 3.27Å
630	C	97.7	Very high	95.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-39.1	174.4	-69.7	0	0	0	0	113.1	I528 S626 S627 A633 V867	I528-C630 HydrophobicContact CD1-CB 4.32Å; I528-C630 HydrophobicContact CG2-CB 4.18Å; S626-C630 PolarHBondContact O-N 3.29Å; S626-C630 PolarHBondContact O-SG 3.01Å; S626-C630 VanDerWaalsContact O-SG 3.42Å; S627-C630 WeakPolarHBondContact O-CB 3.35Å; S627-C630 PolarHBondContact O-N 3.06Å; C630-A633 VanDerWaalsContact O-CB 3.28Å; C630-A633 WeakPolarHBondContact O-CB 3.35Å; C630-A633 PolarHBondContact O-N 3.15Å; C630-V867 HydrophobicContact CB-CG2 3.98Å
631	I	97.2	Very high	95.3	Very high	28 Å²	28	34.5 Å²	34.5	14%	0.144	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-43.8	172.3	-67	158.1	0	0	0	110.4	V505 S627 L628 A633 L634 T635 V866 L870	V505-I631 HydrophobicContact CG1-CD1 4.03Å; V505-I631 HydrophobicContact CG1-CG1 4.14Å; V505-I631 HydrophobicContact CG1-CG2 3.67Å; S627-I631 WeakPolarHBondContact O-CG1 3.39Å; S627-I631 PolarHBondContact O-N 3.28Å; L628-I631 HydrophobicContact CD2-CD1 4.45Å; L628-I631 PolarHBondContact O-N 2.95Å; I631-A633 VanDerWaalsContact C-N 3.25Å; I631-A633 PolarHBondContact O-N 3.18Å; I631-L634 PolarHBondContact O-N 3.23Å; I631-T635 WeakPolarHBondContact O-CB 3.44Å; I631-T635 PolarHBondContact O-N 3.43Å; I631-T635 PolarHBondContact O-OG1 2.94Å; I631-V866 HydrophobicContact CD1-CG1 3.91Å; I631-V866 HydrophobicContact CG1-CG1 4.48Å; I631-L870 HydrophobicContact CG1-CD2 3.96Å
632	G	96.5	Very high	95.2	Very high	19 Å²	19	38.4 Å²	38.4	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-33.3	175.2	0	0	0	0	0	113	L628 C629 T635 A636	L628-G632 PolarHBondContact O-N 2.99Å; C629-G632 PolarHBondContact O-N 3.06Å; G632-T635 PolarHBondContact O-N 2.91Å; G632-A636 WeakPolarHBondContact O-CB 3.38Å; G632-A636 PolarHBondContact O-N 3.4Å
633	A	96.8	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.8	-51.5	176.4	0	0	0	0	0	111.9	V524 I528 C629 C630 I631 L637 G646 L649	V524-A633 HydrophobicContact CG1-CB 4.3Å; I528-A633 HydrophobicContact CD1-CB 3.79Å; C629-A633 PolarHBondContact O-N 3.41Å; C630-A633 VanDerWaalsContact O-CB 3.28Å; C630-A633 WeakPolarHBondContact O-CB 3.35Å; C630-A633 PolarHBondContact O-N 3.15Å; I631-A633 VanDerWaalsContact C-N 3.25Å; I631-A633 PolarHBondContact O-N 3.18Å; A633-L637 WeakPolarHBondContact O-CD1 3.48Å; A633-G646 VanDerWaalsContact CA-O 3.3Å; A633-G646 WeakPolarHBondContact CA-O 3.31Å; A633-G646 VanDerWaalsContact CB-O 3.23Å; A633-G646 WeakPolarHBondContact CB-O 3.43Å; A633-G646 WeakPolarHBondContact O-CA 3.35Å; A633-L649 HydrophobicContact CB-CB 4.41Å
634	L	96.4	Very high	94.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-71.7	-40.6	176.5	-80.2	72.9	0	0	0	111.7	T509 V510 L521 V524 T525 I528 I631 A636 L637 L870	T509-L634 HydrophobicContact CG2-CB 3.59Å; V510-L634 HydrophobicContact CG2-CD2 4.21Å; L521-L634 HydrophobicContact CD1-CB 4.38Å; L521-L634 HydrophobicContact CD1-CD2 3.6Å; L521-L634 HydrophobicContact CD1-CG 3.64Å; V524-L634 HydrophobicContact CG1-CD1 3.63Å; V524-L634 HydrophobicContact CG1-CG 4.35Å; T525-L634 HydrophobicContact CG2-CD2 3.99Å; I528-L634 HydrophobicContact CD1-CD1 4.01Å; I631-L634 PolarHBondContact O-N 3.23Å; L634-A636 PolarHBondContact O-N 2.9Å; L634-L637 WeakPolarHBondContact O-CB 3.43Å; L634-L637 PolarHBondContact O-N 2.84Å; L634-L870 HydrophobicContact CD1-CD2 4.14Å; L634-L870 HydrophobicContact CD2-CD1 3.85Å; L634-L870 HydrophobicContact CD2-CD2 4.39Å; L634-L870 HydrophobicContact CD2-CG 3.91Å
635	T	96	Very high	94.7	Very high	60 Å²	60	35.9 Å²	35.9	37%	0.368	19%	0.193	S	C	.	.	H	α-helix	trans	-59.4	-32.1	-179.2	-56.2	0	0	0	0	112.1	T509 I631 G632 L637 S638	T509-T635 WeakPolarHBondContact CG2-OG1 3.38Å; I631-T635 WeakPolarHBondContact O-CB 3.44Å; I631-T635 PolarHBondContact O-N 3.43Å; I631-T635 PolarHBondContact O-OG1 2.94Å; G632-T635 PolarHBondContact O-N 2.91Å; T635-L637 VanDerWaalsContact C-N 3.27Å; T635-L637 PolarHBondContact O-N 3.46Å; T635-S638 VanDerWaalsContact O-CB 3.3Å; T635-S638 WeakPolarHBondContact O-CB 3.38Å; T635-S638 PolarHBondContact O-N 3.44Å; T635-S638 PolarHBondContact O-OG 3Å
636	A	95.8	Very high	94.6	Very high	11 Å²	11	34.6 Å²	34.6	9%	0.091	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-70.1	-16.7	175.9	0	0	0	0	0	114.4	G632 L634 S638 R642 S643 G646	G632-A636 WeakPolarHBondContact O-CB 3.38Å; G632-A636 PolarHBondContact O-N 3.4Å; L634-A636 PolarHBondContact O-N 2.9Å; A636-S638 PolarHBondContact O-N 3.02Å; A636-R642 HydrophobicContact CB-CB 4.47Å; A636-R642 CarbonylContact O-C 3.59Å; A636-R642 WeakPolarHBondContact O-CB 3.44Å; A636-S643 WeakPolarHBondContact O-CA 3.35Å; A636-S643 PolarHBondContact O-N 3.42Å; A636-G646 VanDerWaalsContact CB-CA 3.45Å
637	L	94.7	Very high	94.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-78.4	6.4	171.2	-80.5	68.2	0	0	0	112.7	V513 T514 L517 P520 L521 V524 A633 L634 T635 S639	V513-L637 HydrophobicContact CG1-CB 4.02Å; V513-L637 HydrophobicContact CG2-CB 4.08Å; T514-L637 PolarHBondContact N-O 3.27Å; T514-L637 PolarHBondContact OG1-O 2.8Å; L517-L637 HydrophobicContact CB-CB 4.42Å; L517-L637 HydrophobicContact CB-CD2 4.38Å; L517-L637 HydrophobicContact CB-CG 4.48Å; L517-L637 HydrophobicContact CD1-CB 4.13Å; L517-L637 HydrophobicContact CD1-CG 4.31Å; L517-L637 VanDerWaalsContact CD1-O 3.28Å; L517-L637 WeakPolarHBondContact CD1-O 3.35Å; P520-L637 HydrophobicContact CB-CD2 3.95Å; L521-L637 HydrophobicContact CB-CD2 3.94Å; V524-L637 HydrophobicContact CG2-CD1 4.31Å; V524-L637 HydrophobicContact CG2-CD2 4.26Å; A633-L637 WeakPolarHBondContact O-CD1 3.48Å; L634-L637 WeakPolarHBondContact O-CB 3.43Å; L634-L637 PolarHBondContact O-N 2.84Å; T635-L637 VanDerWaalsContact C-N 3.27Å; T635-L637 PolarHBondContact O-N 3.46Å; L637-S639 PolarHBondContact O-N 3.29Å
638	S	93.1	Very high	94.3	Very high	51 Å²	51	35.1 Å²	35.1	36%	0.357	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-69	-8.2	164.7	57.9	0	0	0	0	114.4	G512 T514 T635 A636	G512-S638 WeakPolarHBondContact O-CA 3.49Å; G512-S638 WeakPolarHBondContact O-CB 3.38Å; T514-S638 PolarHBondContact OG1-O 2.9Å; T635-S638 VanDerWaalsContact O-CB 3.3Å; T635-S638 WeakPolarHBondContact O-CB 3.38Å; T635-S638 PolarHBondContact O-N 3.44Å; T635-S638 PolarHBondContact O-OG 3Å; A636-S638 PolarHBondContact O-N 3.02Å
639	S	90.9	Very high	94.3	Very high	43 Å²	43	32.3 Å²	32.3	30%	0.301	17%	0.172	S	C	.	.	S	Bend	trans	-154.6	135	175.6	-175.6	0	0	0	0	112.7	L637 K641 R642 S643	L637-S639 PolarHBondContact O-N 3.29Å; S639-K641 PolarHBondContact O-N 3.45Å; S639-K641 VanDerWaalsContact O-N 3.08Å; S639-R642 PolarHBondContact O-N 2.64Å; S639-S643 PolarHBondContact O-N 3.06Å
640	Q	89.2	Confident	94.2	Very high	14 Å²	14	31.1 Å²	31.1	7%	0.065	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-40.4	174.7	-136.1	67.7	1.6	0	0	113.3	L517 F579 R642 S643 Y990	L517-Q640 VanDerWaalsContact CD1-OE1 3.29Å; F579-Q640 HydrophobicContact CB-CG 4.2Å; Q640-R642 VanDerWaalsContact C-N 3.34Å; Q640-R642 PolarHBondContact O-N 3.46Å; Q640-S643 PolarHBondContact O-OG 2.73Å; Q640-Y990 HydrophobicContact CB-CD2 4.36Å; Q640-Y990 HydrophobicContact CB-CE1 4.47Å; Q640-Y990 HydrophobicContact CB-CE2 4.16Å; Q640-Y990 HydrophobicContact CG-CD1 3.92Å; Q640-Y990 HydrophobicContact CG-CD2 4.14Å; Q640-Y990 HydrophobicContact CG-CE1 4.11Å; Q640-Y990 HydrophobicContact CG-CE2 4.34Å; Q640-Y990 HydrophobicContact CG-CG 3.94Å
641	K	87.7	Confident	94.2	Very high	145 Å²	145	34.6 Å²	34.6	63%	0.63	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-22.9	-178.5	-62.4	179.4	-178.5	176	0	113.8	S639	S639-K641 PolarHBondContact O-N 3.45Å; S639-K641 VanDerWaalsContact O-N 3.08Å
642	R	90.7	Very high	94.1	Very high	166 Å²	166	34.3 Å²	34.3	63%	0.626	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103	-19.9	179.2	-68.4	-178.3	177.2	168.2	-1.6	113	A636 S639 Q640 R644 V645 G646	A636-R642 HydrophobicContact CB-CB 4.47Å; A636-R642 CarbonylContact O-C 3.59Å; A636-R642 WeakPolarHBondContact O-CB 3.44Å; S639-R642 PolarHBondContact O-N 2.64Å; Q640-R642 VanDerWaalsContact C-N 3.34Å; Q640-R642 PolarHBondContact O-N 3.46Å; R642-R644 VanDerWaalsContact C-N 3.26Å; R642-R644 PolarHBondContact O-N 2.92Å; R642-V645 WeakPolarHBondContact O-CA 3.49Å; R642-V645 VanDerWaalsContact O-CB 3.29Å; R642-V645 WeakPolarHBondContact O-CB 3.32Å; R642-V645 PolarHBondContact O-N 3.08Å; R642-G646 PolarHBondContact O-N 2.69Å
643	S	92.8	Very high	94.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-43.8	-44.6	-175.5	65.8	0	0	0	0	114.9	L576 A636 S639 Q640 V645 G646 N647	L576-S643 WeakPolarHBondContact CD1-O 3.22Å; A636-S643 WeakPolarHBondContact O-CA 3.35Å; A636-S643 PolarHBondContact O-N 3.42Å; S639-S643 PolarHBondContact O-N 3.06Å; Q640-S643 PolarHBondContact O-OG 2.73Å; S643-V645 PolarHBondContact O-N 2.99Å; S643-G646 WeakPolarHBondContact O-CA 3.3Å; S643-G646 PolarHBondContact O-N 2.95Å; S643-N647 PolarHBondContact O-N 2.94Å
644	R	92.7	Very high	94.2	Very high	9 Å²	9	33.5 Å²	33.5	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-67.2	-29.7	-179.9	-71.7	174.7	-72.4	-89.7	1.2	113.9	L576 E587 R642 G646 N647	L576-R644 HydrophobicContact CB-CG 3.83Å; L576-R644 PolarHBondContact O-NH1 3.09Å; E587-R644 VanDerWaalsContact CD-NE 3.28Å; E587-R644 IonicContact OE1-CZ 2.94Å; E587-R644 VanDerWaalsContact OE1-CZ 3.23Å; E587-R644 IonicContact OE1-NE 2.69Å; E587-R644 PolarHBondContact OE1-NE 3.32Å; E587-R644 IonicContact OE1-NH2 2.88Å; E587-R644 PolarHBondContact OE1-NH2 3.19Å; E587-R644 WeakPolarHBondContact OE2-CD 3.36Å; E587-R644 IonicContact OE2-CZ 3.87Å; E587-R644 IonicContact OE2-NE 2.84Å; E587-R644 PolarHBondContact OE2-NE 2.76Å; R642-R644 VanDerWaalsContact C-N 3.26Å; R642-R644 PolarHBondContact O-N 2.92Å; R644-G646 VanDerWaalsContact C-N 3.27Å; R644-N647 PolarHBondContact O-N 2.94Å
645	V	93.3	Very high	94.2	Very high	47 Å²	47	36.6 Å²	36.6	29%	0.285	19%	0.19	S	C	.	.	H	α-helix	trans	-65.5	-34.8	168.9	177.3	0	0	0	0	110.3	L592 R642 S643 N647 A648 L649	L592-V645 HydrophobicContact CD1-CB 4.31Å; L592-V645 HydrophobicContact CD1-CG1 3.87Å; L592-V645 HydrophobicContact CD1-CG2 4.32Å; L592-V645 HydrophobicContact CD2-CG1 4.48Å; R642-V645 WeakPolarHBondContact O-CA 3.49Å; R642-V645 VanDerWaalsContact O-CB 3.29Å; R642-V645 WeakPolarHBondContact O-CB 3.32Å; R642-V645 PolarHBondContact O-N 3.08Å; S643-V645 PolarHBondContact O-N 2.99Å; V645-N647 PolarHBondContact O-N 3.2Å; V645-A648 PolarHBondContact O-N 3.37Å; V645-L649 HydrophobicContact CG1-CD1 4.07Å; V645-L649 HydrophobicContact CG1-CG 4.21Å; V645-L649 WeakPolarHBondContact O-CG 3.46Å; V645-L649 PolarHBondContact O-N 3.38Å
646	G	94.4	Very high	94.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.1	-45.4	176.3	0	0	0	0	0	113.3	A633 A636 R642 S643 R644 A648 L649 G650	A633-G646 VanDerWaalsContact CA-O 3.3Å; A633-G646 WeakPolarHBondContact CA-O 3.31Å; A633-G646 VanDerWaalsContact CB-O 3.23Å; A633-G646 WeakPolarHBondContact CB-O 3.43Å; A633-G646 WeakPolarHBondContact O-CA 3.35Å; A636-G646 VanDerWaalsContact CB-CA 3.45Å; R642-G646 PolarHBondContact O-N 2.69Å; S643-G646 WeakPolarHBondContact O-CA 3.3Å; S643-G646 PolarHBondContact O-N 2.95Å; R644-G646 VanDerWaalsContact C-N 3.27Å; G646-A648 VanDerWaalsContact C-N 3.3Å; G646-A648 PolarHBondContact O-N 3.34Å; G646-L649 PolarHBondContact O-N 3.32Å; G646-G650 PolarHBondContact O-N 3.49Å
647	N	95.2	Very high	94.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-40	177	-164.3	51.6	0	0	0	112.1	F569 T572 Q573 L576 S643 R644 V645 G650 M651	F569-N647 WeakPolarHBondContact CD1-OD1 3.49Å; T572-N647 VanDerWaalsContact CB-OD1 3.27Å; T572-N647 WeakPolarHBondContact CB-OD1 3.39Å; T572-N647 HydrophobicContact CG2-CB 4.13Å; T572-N647 WeakPolarHBondContact CG2-OD1 3.44Å; Q573-N647 PolarHBondContact OE1-ND2 2.96Å; L576-N647 HydrophobicContact CD1-CB 3.99Å; S643-N647 PolarHBondContact O-N 2.94Å; R644-N647 PolarHBondContact O-N 2.94Å; V645-N647 PolarHBondContact O-N 3.2Å; N647-G650 PolarHBondContact O-N 3.28Å; N647-M651 WeakPolarHBondContact O-CG 3.47Å; N647-M651 PolarHBondContact O-N 2.92Å; N647-M651 VanDerWaalsContact O-N 3.09Å
648	A	95	Very high	94.4	Very high	14 Å²	14	34.2 Å²	34.2	12%	0.116	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-43.6	176	0	0	0	0	0	112.6	L592 V645 G646 G650 M651 I652	L592-A648 HydrophobicContact CB-CB 4.36Å; L592-A648 HydrophobicContact CD1-CB 3.48Å; L592-A648 VanDerWaalsContact CD1-CB 3.48Å; V645-A648 PolarHBondContact O-N 3.37Å; G646-A648 VanDerWaalsContact C-N 3.3Å; G646-A648 PolarHBondContact O-N 3.34Å; A648-G650 VanDerWaalsContact C-N 3.3Å; A648-G650 PolarHBondContact O-N 2.79Å; A648-M651 HydrophobicContact CB-CE 4.48Å; A648-M651 PolarHBondContact O-N 3.49Å; A648-I652 VanDerWaalsContact O-CG1 3.3Å; A648-I652 WeakPolarHBondContact O-CG1 3.24Å; A648-I652 PolarHBondContact O-N 3.43Å
649	L	96.2	Very high	94.5	Very high	44 Å²	44	34.7 Å²	34.7	23%	0.23	17%	0.172	C	C	.	.	H	α-helix	trans	-60.4	-39.6	173.6	-69.5	174.6	0	0	0	111.8	C629 A633 V645 G646 I652 G653	C629-L649 WeakPolarHBondContact CB-O 3.27Å; A633-L649 HydrophobicContact CB-CB 4.41Å; V645-L649 HydrophobicContact CG1-CD1 4.07Å; V645-L649 HydrophobicContact CG1-CG 4.21Å; V645-L649 WeakPolarHBondContact O-CG 3.46Å; V645-L649 PolarHBondContact O-N 3.38Å; G646-L649 PolarHBondContact O-N 3.32Å; L649-I652 PolarHBondContact O-N 3.04Å; L649-G653 PolarHBondContact O-N 3.19Å
650	G	96.6	Very high	94.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-43.1	175	0	0	0	0	0	112.8	F569 G646 N647 A648 G653 V654	F569-G650 VanDerWaalsContact CZ-C 3.43Å; F569-G650 WeakPolarHBondContact CZ-O 3.48Å; G646-G650 PolarHBondContact O-N 3.49Å; N647-G650 PolarHBondContact O-N 3.28Å; A648-G650 VanDerWaalsContact C-N 3.3Å; A648-G650 PolarHBondContact O-N 2.79Å; G650-G653 PolarHBondContact O-N 2.93Å; G650-V654 PolarHBondContact O-N 3.24Å
651	M	96.3	Very high	95.1	Very high	74 Å²	74	32 Å²	32	37%	0.365	16%	0.155	S	C	.	.	H	α-helix	trans	-63.9	-40.8	175.2	-71	-175.2	-68.4	0	0	112.1	F569 N647 A648 T655	F569-M651 HydrophobicContact CB-CG 4.12Å; F569-M651 HydrophobicContact CB-SD 4.21Å; F569-M651 HydrophobicContact CD1-CG 3.42Å; F569-M651 VanDerWaalsContact CD1-CG 3.42Å; F569-M651 HydrophobicContact CD1-SD 4.41Å; F569-M651 HydrophobicContact CD2-CG 3.96Å; F569-M651 HydrophobicContact CE1-CG 3.74Å; F569-M651 HydrophobicContact CE2-CG 4.24Å; F569-M651 HydrophobicContact CG-CG 3.56Å; F569-M651 HydrophobicContact CG-SD 4.3Å; F569-M651 HydrophobicContact CZ-CG 4.15Å; N647-M651 WeakPolarHBondContact O-CG 3.47Å; N647-M651 PolarHBondContact O-N 2.92Å; N647-M651 VanDerWaalsContact O-N 3.09Å; A648-M651 HydrophobicContact CB-CE 4.48Å; A648-M651 PolarHBondContact O-N 3.49Å; M651-T655 WeakPolarHBondContact O-CB 3.46Å; M651-T655 PolarHBondContact O-N 2.8Å; M651-T655 PolarHBondContact O-OG1 3.08Å
652	I	96.6	Very high	95.4	Very high	22 Å²	22	26.9 Å²	26.9	11%	0.113	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-43.5	175.2	-64.5	167.4	0	0	0	110.6	L592 A596 L599 A648 L649 S656	L592-I652 HydrophobicContact CB-CD1 4.5Å; A596-I652 HydrophobicContact CB-CD1 3.93Å; A596-I652 HydrophobicContact CB-CG1 3.77Å; A596-I652 HydrophobicContact CB-CG2 4.39Å; L599-I652 HydrophobicContact CD2-CG2 4.33Å; A648-I652 VanDerWaalsContact O-CG1 3.3Å; A648-I652 WeakPolarHBondContact O-CG1 3.24Å; A648-I652 PolarHBondContact O-N 3.43Å; L649-I652 PolarHBondContact O-N 3.04Å; I652-S656 WeakPolarHBondContact O-CB 3.35Å; I652-S656 PolarHBondContact O-N 3.33Å; I652-S656 PolarHBondContact O-OG 3.32Å
653	G	97.1	Very high	95.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-57.8	-58.9	176.8	0	0	0	0	0	112	S626 L649 G650 T655 S656 G657	S626-G653 WeakPolarHBondContact CB-O 3.32Å; S626-G653 WeakPolarHBondContact O-CA 3.4Å; S626-G653 PolarHBondContact OG-O 2.91Å; L649-G653 PolarHBondContact O-N 3.19Å; G650-G653 PolarHBondContact O-N 2.93Å; G653-T655 PolarHBondContact O-N 3.34Å; G653-S656 PolarHBondContact O-N 3.47Å; G653-S656 PolarHBondContact O-OG 2.97Å; G653-S656 VanDerWaalsContact O-OG 3.04Å; G653-G657 PolarHBondContact O-N 3.26Å
654	V	97.7	Very high	95.5	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-43.2	-179.6	174.5	0	0	0	0	111.8	I528 I531 I565 F569 G650 G657 L658	I528-V654 HydrophobicContact CB-CG2 4.41Å; I528-V654 HydrophobicContact CG1-CG2 4.22Å; I528-V654 HydrophobicContact CG2-CG2 4.43Å; I531-V654 HydrophobicContact CD1-CG1 4.25Å; I565-V654 HydrophobicContact CD1-CG1 3.67Å; I565-V654 HydrophobicContact CG1-CG1 4.04Å; I565-V654 HydrophobicContact CG2-CG1 4.32Å; F569-V654 HydrophobicContact CE2-CB 4.15Å; F569-V654 HydrophobicContact CE2-CG1 4.46Å; F569-V654 HydrophobicContact CE2-CG2 3.95Å; F569-V654 HydrophobicContact CZ-CB 4.3Å; F569-V654 HydrophobicContact CZ-CG2 3.8Å; G650-V654 PolarHBondContact O-N 3.24Å; V654-G657 PolarHBondContact O-N 2.98Å; V654-L658 HydrophobicContact CG1-CD1 4.03Å; V654-L658 HydrophobicContact CG1-CG 4.49Å; V654-L658 WeakPolarHBondContact O-CG 3.2Å; V654-L658 PolarHBondContact O-N 2.84Å
655	T	96.5	Very high	95.5	Very high	66 Å²	66	24.7 Å²	24.7	41%	0.405	14%	0.136	S	C	.	.	H	α-helix	trans	-65.4	-44	-178.6	-54.9	0	0	0	0	112.2	L600 M651 G653 L658 I659	L600-T655 HydrophobicContact CD1-CG2 4.35Å; M651-T655 WeakPolarHBondContact O-CB 3.46Å; M651-T655 PolarHBondContact O-N 2.8Å; M651-T655 PolarHBondContact O-OG1 3.08Å; G653-T655 PolarHBondContact O-N 3.34Å; T655-L658 PolarHBondContact O-N 2.93Å; T655-I659 HydrophobicContact CG2-CD1 3.8Å; T655-I659 WeakPolarHBondContact O-CB 3.44Å; T655-I659 WeakPolarHBondContact O-CG1 3.33Å; T655-I659 PolarHBondContact O-N 3.04Å
656	S	96.4	Very high	95.4	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-68.1	-33.3	176.7	54.6	0	0	0	0	112.8	S626 I652 G653 S660	S626-S656 WeakPolarHBondContact CB-OG 3.47Å; I652-S656 WeakPolarHBondContact O-CB 3.35Å; I652-S656 PolarHBondContact O-N 3.33Å; I652-S656 PolarHBondContact O-OG 3.32Å; G653-S656 PolarHBondContact O-N 3.47Å; G653-S656 PolarHBondContact O-OG 2.97Å; G653-S656 VanDerWaalsContact O-OG 3.04Å; S656-S660 VanDerWaalsContact O-CB 3.29Å; S656-S660 WeakPolarHBondContact O-CB 3.3Å; S656-S660 PolarHBondContact O-N 2.97Å
657	G	97	Very high	95.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-48.6	172.6	0	0	0	0	0	112.7	S626 G653 V654 S660 T661 L863	S626-G657 WeakPolarHBondContact OG-CA 3.44Å; S626-G657 PolarHBondContact OG-N 2.82Å; G653-G657 PolarHBondContact O-N 3.26Å; V654-G657 PolarHBondContact O-N 2.98Å; G657-S660 WeakPolarHBondContact O-CB 3.39Å; G657-S660 PolarHBondContact O-N 2.72Å; G657-T661 PolarHBondContact O-N 3.32Å; G657-T661 PolarHBondContact O-OG1 3.1Å; G657-L863 VanDerWaalsContact CA-CD2 3.5Å
658	L	97.1	Very high	95.3	Very high	20 Å²	20	33.5 Å²	33.5	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-65.7	-40.8	178.2	-64.9	172.9	0	0	0	112.5	I531 A533 V534 L537 I565 V654 T655 T661 L662 L679	I531-L658 HydrophobicContact CD1-CD2 4.35Å; I531-L658 HydrophobicContact CD1-CG 4.34Å; A533-L658 HydrophobicContact CB-CD2 3.72Å; V534-L658 HydrophobicContact CG2-CD2 3.92Å; L537-L658 HydrophobicContact CD1-CD2 3.84Å; I565-L658 HydrophobicContact CD1-CD1 3.82Å; V654-L658 HydrophobicContact CG1-CD1 4.03Å; V654-L658 HydrophobicContact CG1-CG 4.49Å; V654-L658 WeakPolarHBondContact O-CG 3.2Å; V654-L658 PolarHBondContact O-N 2.84Å; T655-L658 PolarHBondContact O-N 2.93Å; L658-T661 WeakPolarHBondContact O-CB 3.04Å; L658-T661 PolarHBondContact O-N 3.06Å; L658-L662 WeakPolarHBondContact O-CG 3.34Å; L658-L662 PolarHBondContact O-N 3.33Å; L658-L679 HydrophobicContact CD1-CD2 4.5Å
659	I	95.6	Very high	95.4	Very high	62 Å²	62	39.2 Å²	39.2	32%	0.318	21%	0.207	S	C	.	.	H	α-helix	trans	-68.6	-35.3	176.9	-69.3	171.4	0	0	0	111.6	L600 Y603 T655 T661 G663	L600-I659 HydrophobicContact CD1-CD1 3.85Å; L600-I659 HydrophobicContact CD2-CB 4.21Å; L600-I659 HydrophobicContact CD2-CD1 3.76Å; L600-I659 HydrophobicContact CD2-CG2 4.14Å; L600-I659 HydrophobicContact CG-CD1 4.42Å; Y603-I659 HydrophobicContact CD1-CG2 3.86Å; Y603-I659 HydrophobicContact CE1-CG2 3.77Å; T655-I659 HydrophobicContact CG2-CD1 3.8Å; T655-I659 WeakPolarHBondContact O-CB 3.44Å; T655-I659 WeakPolarHBondContact O-CG1 3.33Å; T655-I659 PolarHBondContact O-N 3.04Å; I659-T661 VanDerWaalsContact C-N 3.35Å; I659-G663 PolarHBondContact O-N 2.88Å
660	S	95.5	Very high	95.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-47.5	170.6	-169.3	0	0	0	0	111	Y603 H619 S656 G657 G663 L664	Y603-S660 WeakPolarHBondContact OH-CA 3.23Å; Y603-S660 PolarHBondContact OH-O 2.81Å; Y603-S660 VanDerWaalsContact OH-O 3.12Å; H619-S660 WeakPolarHBondContact CA-OG 3.2Å; H619-S660 PolarHBondContact O-OG 3.31Å; H619-S660 VanDerWaalsContact O-OG 3.06Å; S656-S660 VanDerWaalsContact O-CB 3.29Å; S656-S660 WeakPolarHBondContact O-CB 3.3Å; S656-S660 PolarHBondContact O-N 2.97Å; G657-S660 WeakPolarHBondContact O-CB 3.39Å; G657-S660 PolarHBondContact O-N 2.72Å; S660-G663 PolarHBondContact O-N 2.81Å; S660-L664 WeakPolarHBondContact O-CB 3.47Å; S660-L664 PolarHBondContact O-N 3.43Å
661	T	95.9	Very high	95.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-46.6	178.8	-49.2	0	0	0	0	112.2	V534 L537 L538 Y623 G657 L658 I659 G663 L664 I665	V534-T661 HydrophobicContact CG1-CG2 3.96Å; V534-T661 WeakPolarHBondContact CG1-OG1 3.36Å; V534-T661 WeakPolarHBondContact CG2-OG1 3.5Å; L537-T661 HydrophobicContact CB-CG2 4.1Å; L538-T661 HydrophobicContact CD1-CG2 4.5Å; L538-T661 HydrophobicContact CD2-CG2 4.01Å; L538-T661 HydrophobicContact CG-CG2 3.86Å; Y623-T661 PolarHBondContact OH-OG1 3.14Å; G657-T661 PolarHBondContact O-N 3.32Å; G657-T661 PolarHBondContact O-OG1 3.1Å; L658-T661 WeakPolarHBondContact O-CB 3.04Å; L658-T661 PolarHBondContact O-N 3.06Å; I659-T661 VanDerWaalsContact C-N 3.35Å; T661-G663 VanDerWaalsContact C-N 3.34Å; T661-G663 PolarHBondContact O-N 3.03Å; T661-L664 WeakPolarHBondContact O-CB 3.45Å; T661-L664 PolarHBondContact O-N 3.01Å; T661-I665 HydrophobicContact CG2-CD1 3.98Å; T661-I665 VanDerWaalsContact O-CG1 3.3Å; T661-I665 WeakPolarHBondContact O-CG1 3.41Å; T661-I665 PolarHBondContact O-N 2.95Å; T661-I665 VanDerWaalsContact O-N 3.08Å
662	L	95.1	Very high	95.4	Very high	37 Å²	37	42.2 Å²	42.2	19%	0.194	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-39.4	177.5	-71.5	169.4	0	0	0	112.3	L537 L658 L664 I665 Q666 P667 L672 M675	L537-L662 HydrophobicContact CD1-CD2 4.32Å; L537-L662 HydrophobicContact CD1-CG 4.39Å; L537-L662 HydrophobicContact CD2-CD2 4.08Å; L658-L662 WeakPolarHBondContact O-CG 3.34Å; L658-L662 PolarHBondContact O-N 3.33Å; L662-L664 VanDerWaalsContact C-N 3.34Å; L662-I665 PolarHBondContact O-N 3.14Å; L662-Q666 PolarHBondContact O-N 2.91Å; L662-Q666 VanDerWaalsContact O-N 3.1Å; L662-P667 VanDerWaalsContact O-CD 3.26Å; L662-P667 WeakPolarHBondContact O-CD 3.36Å; L662-L672 HydrophobicContact CD2-CD1 4.45Å; L662-M675 HydrophobicContact CD2-CB 4.34Å; L662-M675 HydrophobicContact CD2-SD 3.64Å
663	G	92.7	Very high	95.5	Very high	7 Å²	7	44.4 Å²	44.4	7%	0.072	24%	0.236	C	C	.	.	H	α-helix	trans	-73.2	-22.5	176.3	0	0	0	0	0	114.4	Y603 H619 I659 S660 T661 Q666	Y603-G663 WeakPolarHBondContact OH-CA 2.98Å; H619-G663 PolarHBondContact CE1-O 3.27Å; I659-G663 PolarHBondContact O-N 2.88Å; S660-G663 PolarHBondContact O-N 2.81Å; T661-G663 VanDerWaalsContact C-N 3.34Å; T661-G663 PolarHBondContact O-N 3.03Å; G663-Q666 WeakPolarHBondContact O-CG 3.38Å
664	L	92.7	Very high	95.5	Very high	73 Å²	73	45 Å²	45	38%	0.382	24%	0.238	S	C	.	.	H	α-helix	trans	-74.8	-39	171.9	173.9	65.7	0	0	0	111.8	L538 H619 S660 T661 L662	L538-L664 HydrophobicContact CD2-CD2 4.34Å; H619-L664 PolarHBondContact CE1-N 3.03Å; S660-L664 WeakPolarHBondContact O-CB 3.47Å; S660-L664 PolarHBondContact O-N 3.43Å; T661-L664 WeakPolarHBondContact O-CB 3.45Å; T661-L664 PolarHBondContact O-N 3.01Å; L662-L664 VanDerWaalsContact C-N 3.34Å
665	I	92.8	Very high	95.5	Very high	50 Å²	50	44.9 Å²	44.9	26%	0.256	24%	0.238	S	C	.	.	H	α-helix	trans	-73.7	-35.1	179.1	-63.7	164.3	0	0	0	111.5	L537 L538 T661 L662 P667 M675	L537-I665 HydrophobicContact CB-CD1 4.13Å; L537-I665 WeakPolarHBondContact O-CD1 3.48Å; L538-I665 HydrophobicContact CD2-CD1 4.22Å; L538-I665 HydrophobicContact CD2-CG1 4.03Å; T661-I665 HydrophobicContact CG2-CD1 3.98Å; T661-I665 VanDerWaalsContact O-CG1 3.3Å; T661-I665 WeakPolarHBondContact O-CG1 3.41Å; T661-I665 PolarHBondContact O-N 2.95Å; T661-I665 VanDerWaalsContact O-N 3.08Å; L662-I665 PolarHBondContact O-N 3.14Å; I665-P667 HydrophobicContact CG2-CB 4.14Å; I665-P667 HydrophobicContact CG2-CG 4.44Å; I665-M675 HydrophobicContact CD1-CE 4.07Å; I665-M675 HydrophobicContact CG2-CE 4.22Å
666	Q	90.4	Very high	95.5	Very high	123 Å²	123	43.1 Å²	43.1	58%	0.575	23%	0.233	S	C	*	.			trans	49.9	53.2	-172.1	-55.3	-167.1	-3.8	0	0	113.3	L662 G663	L662-Q666 PolarHBondContact O-N 2.91Å; L662-Q666 VanDerWaalsContact O-N 3.1Å; G663-Q666 WeakPolarHBondContact O-CG 3.38Å
667	P	93.7	Very high	95.6	Very high	24 Å²	24	45.9 Å²	45.9	16%	0.156	26%	0.255	C	S	.	.			trans	-63.2	146.4	-173	28.4	-36.3	0	0	0	112.4	L662 I665 L671 L672 M675	L662-P667 VanDerWaalsContact O-CD 3.26Å; L662-P667 WeakPolarHBondContact O-CD 3.36Å; I665-P667 HydrophobicContact CG2-CB 4.14Å; I665-P667 HydrophobicContact CG2-CG 4.44Å; P667-L671 HydrophobicContact CB-CB 4.15Å; P667-L671 HydrophobicContact CB-CD2 3.95Å; P667-L671 HydrophobicContact CB-CG 3.91Å; P667-L672 HydrophobicContact CB-CB 4.33Å; P667-L672 HydrophobicContact CG-CB 4.03Å; P667-L672 HydrophobicContact CG-CD1 4.01Å; P667-M675 HydrophobicContact CB-SD 4.05Å; P667-M675 HydrophobicContact CG-SD 4Å
668	N	94.8	Very high	95.6	Very high	86 Å²	86	46.9 Å²	46.9	46%	0.46	26%	0.262	S	S	.	.			trans	-62	163.9	168.9	73.3	53.6	0	0	0	111	E670 L671 L672	N668-E670 VanDerWaalsContact C-N 3.26Å; N668-E670 PolarHBondContact O-N 3.49Å; N668-E670 WeakPolarHBondContact OD1-CB 3.28Å; N668-E670 PolarHBondContact OD1-N 3.48Å; N668-L671 PolarHBondContact O-N 3.45Å; N668-L671 PolarHBondContact OD1-N 3.36Å; N668-L672 VanDerWaalsContact O-CB 3.28Å; N668-L672 WeakPolarHBondContact O-CB 3.16Å; N668-L672 PolarHBondContact O-N 2.79Å
669	L	96.1	Very high	95.6	Very high	134 Å²	134	47.2 Å²	47.2	70%	0.702	26%	0.264	S	S	*	.	H	α-helix	trans	-59.6	-33.2	-174.1	-177.8	60.6	0	0	0	113.8	T673	L669-T673 WeakPolarHBondContact O-CB 3.38Å; L669-T673 PolarHBondContact O-N 3.42Å; L669-T673 PolarHBondContact O-OG1 3.38Å
670	E	96.9	Very high	95.7	Very high	88 Å²	88	48.3 Å²	48.3	41%	0.411	27%	0.274	S	S	.	.	H	α-helix	trans	-71.8	-48.9	179.8	-46.1	-164.1	167.1	0	0	111	G543 F544 N668 L672 T673 Q674	G543-E670 WeakPolarHBondContact CA-OE2 3.24Å; G543-E670 CarbonylContact O-C 3.48Å; F544-E670 HydrophobicContact CD1-CB 4.15Å; F544-E670 HydrophobicContact CD2-CB 3.77Å; F544-E670 HydrophobicContact CD2-CG 3.82Å; F544-E670 WeakPolarHBondContact CD2-OE2 3.43Å; F544-E670 HydrophobicContact CE1-CB 4.18Å; F544-E670 HydrophobicContact CE1-CG 4.43Å; F544-E670 HydrophobicContact CE2-CB 3.8Å; F544-E670 HydrophobicContact CE2-CG 3.42Å; F544-E670 VanDerWaalsContact CE2-CG 3.42Å; F544-E670 WeakPolarHBondContact CE2-OE1 3.45Å; F544-E670 HydrophobicContact CG-CB 3.96Å; F544-E670 HydrophobicContact CG-CG 4.48Å; F544-E670 HydrophobicContact CZ-CB 4.01Å; F544-E670 HydrophobicContact CZ-CG 3.77Å; N668-E670 VanDerWaalsContact C-N 3.26Å; N668-E670 PolarHBondContact O-N 3.49Å; N668-E670 WeakPolarHBondContact OD1-CB 3.28Å; N668-E670 PolarHBondContact OD1-N 3.48Å; E670-L672 VanDerWaalsContact C-N 3.35Å; E670-L672 PolarHBondContact O-N 3.46Å; E670-T673 WeakPolarHBondContact O-CA 3.42Å; E670-T673 VanDerWaalsContact O-CB 3.29Å; E670-T673 WeakPolarHBondContact O-CB 3.28Å; E670-T673 PolarHBondContact O-N 3.05Å; E670-T673 VanDerWaalsContact O-N 3.07Å; E670-Q674 PolarHBondContact O-N 3.14Å
671	L	96.8	Very high	95.8	Very high	15 Å²	15	49.5 Å²	49.5	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-38.6	176.7	179.5	56.2	0	0	0	111.7	M540 G541 G543 P667 N668 T673 Q674 M675	M540-L671 HydrophobicContact CB-CD1 4.4Å; G541-L671 WeakPolarHBondContact O-CD1 3.32Å; G543-L671 WeakPolarHBondContact O-CA 3.38Å; P667-L671 HydrophobicContact CB-CB 4.15Å; P667-L671 HydrophobicContact CB-CD2 3.95Å; P667-L671 HydrophobicContact CB-CG 3.91Å; N668-L671 PolarHBondContact O-N 3.45Å; N668-L671 PolarHBondContact OD1-N 3.36Å; L671-T673 VanDerWaalsContact C-N 3.27Å; L671-T673 PolarHBondContact O-N 3.04Å; L671-Q674 VanDerWaalsContact CD1-NE2 3.33Å; L671-Q674 WeakPolarHBondContact O-CB 3.46Å; L671-Q674 PolarHBondContact O-N 3.1Å; L671-M675 HydrophobicContact CD1-CE 3.99Å; L671-M675 HydrophobicContact CD1-CG 4.39Å; L671-M675 HydrophobicContact CD2-CE 4.12Å; L671-M675 HydrophobicContact CG-CE 3.88Å; L671-M675 HydrophobicContact CG-SD 4.25Å; L671-M675 WeakPolarHBondContact O-CB 3.27Å; L671-M675 VanDerWaalsContact O-CG 3.27Å; L671-M675 WeakPolarHBondContact O-CG 3.43Å; L671-M675 PolarHBondContact O-N 3.11Å
672	L	96.7	Very high	95.9	Very high	78 Å²	78	49.5 Å²	49.5	41%	0.408	29%	0.286	S	S	.	.	H	α-helix	trans	-62.8	-35.5	172.4	-177.8	59.1	0	0	0	111.4	L662 P667 N668 E670 G676	L662-L672 HydrophobicContact CD2-CD1 4.45Å; P667-L672 HydrophobicContact CB-CB 4.33Å; P667-L672 HydrophobicContact CG-CB 4.03Å; P667-L672 HydrophobicContact CG-CD1 4.01Å; N668-L672 VanDerWaalsContact O-CB 3.28Å; N668-L672 WeakPolarHBondContact O-CB 3.16Å; N668-L672 PolarHBondContact O-N 2.79Å; E670-L672 VanDerWaalsContact C-N 3.35Å; E670-L672 PolarHBondContact O-N 3.46Å; L672-G676 PolarHBondContact O-N 2.97Å
673	T	97.4	Very high	95.9	Very high	67 Å²	67	51.4 Å²	51.4	41%	0.411	30%	0.296	S	S	.	.	H	α-helix	trans	-67.4	-42.5	173.4	-57.8	0	0	0	0	111	F544 L669 E670 L671 G676 A677	F544-T673 HydrophobicContact CD1-CG2 4.05Å; F544-T673 HydrophobicContact CE1-CG2 4.01Å; L669-T673 WeakPolarHBondContact O-CB 3.38Å; L669-T673 PolarHBondContact O-N 3.42Å; L669-T673 PolarHBondContact O-OG1 3.38Å; E670-T673 WeakPolarHBondContact O-CA 3.42Å; E670-T673 VanDerWaalsContact O-CB 3.29Å; E670-T673 WeakPolarHBondContact O-CB 3.28Å; E670-T673 PolarHBondContact O-N 3.05Å; E670-T673 VanDerWaalsContact O-N 3.07Å; L671-T673 VanDerWaalsContact C-N 3.27Å; L671-T673 PolarHBondContact O-N 3.04Å; T673-G676 PolarHBondContact O-N 3.31Å; T673-A677 WeakPolarHBondContact O-CB 3.38Å; T673-A677 PolarHBondContact O-N 3.47Å
674	Q	97.7	Very high	96.2	Very high	12 Å²	12	56 Å²	56	6%	0.056	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-50.3	173.7	-178.9	-178.7	-96.4	0	0	112	M540 G541 E670 L671 G676 A677 C678	M540-Q674 HydrophobicContact CE-CG 3.73Å; G541-Q674 PolarHBondContact O-NE2 2.93Å; E670-Q674 PolarHBondContact O-N 3.14Å; L671-Q674 VanDerWaalsContact CD1-NE2 3.33Å; L671-Q674 WeakPolarHBondContact O-CB 3.46Å; L671-Q674 PolarHBondContact O-N 3.1Å; Q674-G676 PolarHBondContact O-N 2.9Å; Q674-A677 PolarHBondContact O-N 3.28Å; Q674-C678 PolarHBondContact O-N 3.38Å; Q674-C678 PolarHBondContact O-SG 3.29Å
675	M	97.9	Very high	96.4	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.7	-46.3	175.8	-70.2	174.3	169.4	0	0	111.6	L537 M540 L662 I665 P667 L671 A677 C678 L679	L537-M675 HydrophobicContact CD2-CB 3.78Å; L537-M675 HydrophobicContact CD2-CE 4.33Å; L537-M675 HydrophobicContact CD2-CG 3.59Å; L537-M675 HydrophobicContact CD2-SD 3.92Å; L537-M675 WeakPolarHBondContact O-CE 3.28Å; M540-M675 HydrophobicContact CB-CE 3.71Å; M540-M675 HydrophobicContact CB-CG 4.47Å; M540-M675 HydrophobicContact CE-CB 4.37Å; M540-M675 HydrophobicContact CE-CG 3.8Å; M540-M675 HydrophobicContact SD-CG 4.15Å; L662-M675 HydrophobicContact CD2-CB 4.34Å; L662-M675 HydrophobicContact CD2-SD 3.64Å; I665-M675 HydrophobicContact CD1-CE 4.07Å; I665-M675 HydrophobicContact CG2-CE 4.22Å; P667-M675 HydrophobicContact CB-SD 4.05Å; P667-M675 HydrophobicContact CG-SD 4Å; L671-M675 HydrophobicContact CD1-CE 3.99Å; L671-M675 HydrophobicContact CD1-CG 4.39Å; L671-M675 HydrophobicContact CD2-CE 4.12Å; L671-M675 HydrophobicContact CG-CE 3.88Å; L671-M675 HydrophobicContact CG-SD 4.25Å; L671-M675 WeakPolarHBondContact O-CB 3.27Å; L671-M675 VanDerWaalsContact O-CG 3.27Å; L671-M675 WeakPolarHBondContact O-CG 3.43Å; L671-M675 PolarHBondContact O-N 3.11Å; M675-A677 PolarHBondContact O-N 3.49Å; M675-C678 PolarHBondContact O-N 3.26Å; M675-L679 WeakPolarHBondContact O-CB 3.46Å; M675-L679 VanDerWaalsContact O-CG 3.31Å; M675-L679 WeakPolarHBondContact O-CG 3.33Å; M675-L679 PolarHBondContact O-N 2.99Å
676	G	96.8	Very high	96.5	Very high	29 Å²	29	54.6 Å²	54.6	30%	0.299	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-41.3	176	0	0	0	0	0	112.9	L672 T673 Q674 T680	L672-G676 PolarHBondContact O-N 2.97Å; T673-G676 PolarHBondContact O-N 3.31Å; Q674-G676 PolarHBondContact O-N 2.9Å; G676-T680 WeakPolarHBondContact O-CB 3.29Å; G676-T680 VanDerWaalsContact O-CG2 3.32Å; G676-T680 WeakPolarHBondContact O-CG2 3.5Å; G676-T680 PolarHBondContact O-N 2.93Å; G676-T680 PolarHBondContact O-OG1 3.23Å
677	A	97.4	Very high	96.8	Very high	58 Å²	58	49.6 Å²	49.6	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-45.6	176.9	0	0	0	0	0	112.2	T673 Q674 M675 G681	T673-A677 WeakPolarHBondContact O-CB 3.38Å; T673-A677 PolarHBondContact O-N 3.47Å; Q674-A677 PolarHBondContact O-N 3.28Å; M675-A677 PolarHBondContact O-N 3.49Å; A677-G681 WeakPolarHBondContact O-CA 3.47Å; A677-G681 PolarHBondContact O-N 2.91Å
678	C	97.6	Very high	96.9	Very high	21 Å²	21	52.6 Å²	52.6	14%	0.142	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-48.3	175.6	-70.5	0	0	0	0	112	M540 T558 L559 Q674 M675 G682	M540-C678 HydrophobicContact CE-CB 4.35Å; T558-C678 HydrophobicContact CG2-CB 3.88Å; L559-C678 WeakPolarHBondContact CD1-O 3.47Å; Q674-C678 PolarHBondContact O-N 3.38Å; Q674-C678 PolarHBondContact O-SG 3.29Å; M675-C678 PolarHBondContact O-N 3.26Å; C678-G682 PolarHBondContact O-N 3.34Å; C678-G682 VanDerWaalsContact O-N 3.08Å
679	L	98	Very high	96.8	Very high	28 Å²	28	50.3 Å²	50.3	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-50.7	-179.4	-70.2	172.5	0	0	0	112.1	A533 L537 T558 A562 L658 M675 L683	A533-L679 HydrophobicContact CB-CD2 4.3Å; L537-L679 HydrophobicContact CD1-CD1 4.3Å; L537-L679 HydrophobicContact CD2-CD1 4.26Å; T558-L679 HydrophobicContact CG2-CD2 3.68Å; T558-L679 HydrophobicContact CG2-CG 3.95Å; A562-L679 HydrophobicContact CB-CD2 4.33Å; A562-L679 WeakPolarHBondContact CB-O 3.3Å; L658-L679 HydrophobicContact CD1-CD2 4.5Å; M675-L679 WeakPolarHBondContact O-CB 3.46Å; M675-L679 VanDerWaalsContact O-CG 3.31Å; M675-L679 WeakPolarHBondContact O-CG 3.33Å; M675-L679 PolarHBondContact O-N 2.99Å; L679-L683 WeakPolarHBondContact O-CB 3.35Å; L679-L683 PolarHBondContact O-N 3.18Å
680	T	97.4	Very high	96.6	Very high	85 Å²	85	44 Å²	44	52%	0.521	26%	0.263	S	S	.	.	H	α-helix	trans	-69.8	-41.6	-177.7	56.7	0	0	0	0	112.2	G676 L683 L684	G676-T680 WeakPolarHBondContact O-CB 3.29Å; G676-T680 VanDerWaalsContact O-CG2 3.32Å; G676-T680 WeakPolarHBondContact O-CG2 3.5Å; G676-T680 PolarHBondContact O-N 2.93Å; G676-T680 PolarHBondContact O-OG1 3.23Å; T680-L683 PolarHBondContact O-N 2.85Å; T680-L684 WeakPolarHBondContact O-CB 3.44Å; T680-L684 VanDerWaalsContact O-CG 3.26Å; T680-L684 WeakPolarHBondContact O-CG 3.37Å; T680-L684 PolarHBondContact O-N 3.37Å
681	G	97.3	Very high	96.4	Very high	24 Å²	24	46.8 Å²	46.8	25%	0.247	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-48.4	176.7	0	0	0	0	0	112.2	A677 L684 I685	A677-G681 WeakPolarHBondContact O-CA 3.47Å; A677-G681 PolarHBondContact O-N 2.91Å; G681-L684 PolarHBondContact O-N 3.23Å; G681-I685 WeakPolarHBondContact O-CD1 3.43Å; G681-I685 VanDerWaalsContact O-CG1 3.27Å; G681-I685 WeakPolarHBondContact O-CG1 3.25Å; G681-I685 PolarHBondContact O-N 3.31Å
682	G	97.1	Very high	96.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-48.1	177.1	0	0	0	0	0	112.3	A562 I563 C678 L684 I685 G686	A562-G682 CarbonylContact O-C 3.51Å; I563-G682 VanDerWaalsContact CA-O 3.32Å; I563-G682 WeakPolarHBondContact CA-O 3.33Å; I563-G682 WeakPolarHBondContact CG1-O 3.44Å; C678-G682 PolarHBondContact O-N 3.34Å; C678-G682 VanDerWaalsContact O-N 3.08Å; G682-L684 VanDerWaalsContact C-N 3.29Å; G682-L684 PolarHBondContact O-N 2.9Å; G682-I685 PolarHBondContact O-N 3.48Å; G682-I685 VanDerWaalsContact O-N 3.15Å; G682-G686 PolarHBondContact O-N 3Å
683	L	96.7	Very high	95.7	Very high	77 Å²	77	53.6 Å²	53.6	40%	0.403	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-37.9	-179.6	-166.1	156.4	0	0	0	111.8	A562 I565 L679 T680 S687	A562-L683 WeakPolarHBondContact O-CA 3.47Å; A562-L683 PolarHBondContact O-N 2.89Å; I565-L683 HydrophobicContact CG2-CD1 4.15Å; L679-L683 WeakPolarHBondContact O-CB 3.35Å; L679-L683 PolarHBondContact O-N 3.18Å; T680-L683 PolarHBondContact O-N 2.85Å; L683-S687 WeakPolarHBondContact O-CB 3.39Å; L683-S687 PolarHBondContact O-N 3.33Å; L683-S687 PolarHBondContact O-OG 3.14Å
684	L	97.5	Very high	95.2	Very high	103 Å²	103	55 Å²	55	54%	0.539	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-50	172.3	-76.1	168.9	0	0	0	112.3	T680 G681 G682 G686 S687 I688	T680-L684 WeakPolarHBondContact O-CB 3.44Å; T680-L684 VanDerWaalsContact O-CG 3.26Å; T680-L684 WeakPolarHBondContact O-CG 3.37Å; T680-L684 PolarHBondContact O-N 3.37Å; G681-L684 PolarHBondContact O-N 3.23Å; G682-L684 VanDerWaalsContact C-N 3.29Å; G682-L684 PolarHBondContact O-N 2.9Å; L684-G686 PolarHBondContact O-N 3.43Å; L684-S687 PolarHBondContact O-N 2.89Å; L684-I688 WeakPolarHBondContact O-CB 3.48Å; L684-I688 WeakPolarHBondContact O-CD1 3.38Å; L684-I688 VanDerWaalsContact O-CG1 3.24Å; L684-I688 WeakPolarHBondContact O-CG1 3.43Å; L684-I688 PolarHBondContact O-N 3.06Å
685	I	97.2	Very high	94.4	Very high	94 Å²	94	54.6 Å²	54.6	48%	0.482	30%	0.295	S	S	.	.	H	α-helix	trans	-57.3	-50.4	179.1	-70.7	163.7	0	0	0	110.6	I563 G681 G682 S687 I688 A689	I563-I685 HydrophobicContact CD1-CG2 4.04Å; I563-I685 HydrophobicContact CG1-CB 4.18Å; I563-I685 HydrophobicContact CG1-CG2 4.07Å; G681-I685 WeakPolarHBondContact O-CD1 3.43Å; G681-I685 VanDerWaalsContact O-CG1 3.27Å; G681-I685 WeakPolarHBondContact O-CG1 3.25Å; G681-I685 PolarHBondContact O-N 3.31Å; G682-I685 PolarHBondContact O-N 3.48Å; G682-I685 VanDerWaalsContact O-N 3.15Å; I685-S687 PolarHBondContact O-N 3.41Å; I685-I688 PolarHBondContact O-N 3.17Å; I685-A689 PolarHBondContact O-N 3.02Å
686	G	95.6	Very high	93.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-47.7	177	0	0	0	0	0	112.5	I563 G567 G682 L684 I688 A689 A690	I563-G686 WeakPolarHBondContact O-CA 3.26Å; G567-G686 WeakPolarHBondContact CA-O 3.28Å; G682-G686 PolarHBondContact O-N 3Å; L684-G686 PolarHBondContact O-N 3.43Å; G686-I688 VanDerWaalsContact C-N 3.34Å; G686-I688 PolarHBondContact O-N 3.49Å; G686-A689 PolarHBondContact O-N 3.02Å; G686-A690 VanDerWaalsContact O-CB 3.25Å; G686-A690 WeakPolarHBondContact O-CB 3.36Å; G686-A690 PolarHBondContact O-N 3.44Å
687	S	95.6	Very high	93	Very high	18 Å²	18	57 Å²	57	13%	0.126	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-38	178.8	-63.7	0	0	0	0	113.1	G566 L683 L684 I685 K691	G566-S687 PolarHBondContact O-OG 2.7Å; L683-S687 WeakPolarHBondContact O-CB 3.39Å; L683-S687 PolarHBondContact O-N 3.33Å; L683-S687 PolarHBondContact O-OG 3.14Å; L684-S687 PolarHBondContact O-N 2.89Å; I685-S687 PolarHBondContact O-N 3.41Å; S687-K691 WeakPolarHBondContact O-CB 3.49Å; S687-K691 VanDerWaalsContact O-CG 3.29Å; S687-K691 WeakPolarHBondContact O-CG 3.26Å; S687-K691 PolarHBondContact O-N 3.21Å
688	I	96.5	Very high	92.2	Very high	87 Å²	87	54.6 Å²	54.6	45%	0.446	28%	0.281	S	S	.	.	H	α-helix	trans	-70.8	-43.9	179.6	-69.9	164.7	0	0	0	110.5	L684 I685 G686 K691 R692	L684-I688 WeakPolarHBondContact O-CB 3.48Å; L684-I688 WeakPolarHBondContact O-CD1 3.38Å; L684-I688 VanDerWaalsContact O-CG1 3.24Å; L684-I688 WeakPolarHBondContact O-CG1 3.43Å; L684-I688 PolarHBondContact O-N 3.06Å; I685-I688 PolarHBondContact O-N 3.17Å; G686-I688 VanDerWaalsContact C-N 3.34Å; G686-I688 PolarHBondContact O-N 3.49Å; I688-K691 PolarHBondContact O-N 3.11Å; I688-R692 WeakPolarHBondContact O-CG 3.33Å; I688-R692 PolarHBondContact O-N 3.29Å
689	A	93.3	Very high	91.5	Very high	39 Å²	39	53.6 Å²	53.6	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-60.8	-49.5	174.3	0	0	0	0	0	111.3	I685 G686 K691 R692 I693 M701	I685-A689 PolarHBondContact O-N 3.02Å; G686-A689 PolarHBondContact O-N 3.02Å; A689-K691 VanDerWaalsContact C-N 3.28Å; A689-K691 PolarHBondContact O-N 3.43Å; A689-R692 PolarHBondContact O-N 2.61Å; A689-R692 VanDerWaalsContact O-N 3.09Å; A689-I693 PolarHBondContact O-N 3.28Å; A689-M701 HydrophobicContact CB-CE 4.03Å
690	A	91.5	Very high	91	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-23.3	-179.9	0	0	0	0	0	114.7	G567 V570 V571 R574 G686	G567-A690 VanDerWaalsContact O-CB 3.28Å; G567-A690 WeakPolarHBondContact O-CB 3.44Å; V570-A690 HydrophobicContact CB-CB 3.77Å; V570-A690 HydrophobicContact CG1-CB 3.58Å; V571-A690 HydrophobicContact CG2-CB 3.76Å; R574-A690 PolarHBondContact NH1-O 3.3Å; G686-A690 VanDerWaalsContact O-CB 3.25Å; G686-A690 WeakPolarHBondContact O-CB 3.36Å; G686-A690 PolarHBondContact O-N 3.44Å
691	K	92	Very high	90.6	Very high	148 Å²	148	49.4 Å²	49.4	64%	0.643	25%	0.249	S	C	*	.	H	α-helix	trans	-77.7	-30.5	171.4	-79	175.8	-176	177.6	0	113.4	V570 S687 I688 A689	V570-K691 HydrophobicContact CG1-CG 3.85Å; S687-K691 WeakPolarHBondContact O-CB 3.49Å; S687-K691 VanDerWaalsContact O-CG 3.29Å; S687-K691 WeakPolarHBondContact O-CG 3.26Å; S687-K691 PolarHBondContact O-N 3.21Å; I688-K691 PolarHBondContact O-N 3.11Å; A689-K691 VanDerWaalsContact C-N 3.28Å; A689-K691 PolarHBondContact O-N 3.43Å
692	R	91.5	Very high	90	Very high	205 Å²	205	48.3 Å²	48.3	77%	0.774	24%	0.237	S	C	*	.	H	α-helix	trans	-85.8	-23.9	-173.2	-71.8	179.3	177.3	-166.6	0.1	114.5	I688 A689	I688-R692 WeakPolarHBondContact O-CG 3.33Å; I688-R692 PolarHBondContact O-N 3.29Å; A689-R692 PolarHBondContact O-N 2.61Å; A689-R692 VanDerWaalsContact O-N 3.09Å
693	I	88.2	Confident	89.7	Confident	30 Å²	30	48.4 Å²	48.4	15%	0.154	24%	0.238	C	C	.	.	S	Bend	trans	-75.4	149.1	-172.9	-163.6	143.8	0	0	0	113.9	R574 A689 D697 L698 M701	R574-I693 VanDerWaalsContact CZ-O 3.28Å; R574-I693 PolarHBondContact NH1-O 3.44Å; R574-I693 PolarHBondContact NH2-O 2.97Å; A689-I693 PolarHBondContact O-N 3.28Å; I693-D697 HydrophobicContact CD1-CB 3.92Å; I693-D697 HydrophobicContact CG1-CB 3.6Å; I693-L698 HydrophobicContact CG2-CD2 4Å; I693-M701 HydrophobicContact CD1-CB 3.72Å; I693-M701 HydrophobicContact CD1-CG 3.88Å; I693-M701 HydrophobicContact CD1-SD 3.62Å
694	Q	86.2	Confident	89.5	Confident	96 Å²	96	47 Å²	47	45%	0.449	23%	0.23	S	C	.	.			trans	-82	159.1	175.3	-60.9	-69	-59.6	0	0	111.5	T696 D697	Q694-T696 VanDerWaalsContact C-N 3.28Å; Q694-T696 PolarHBondContact O-N 3.04Å; Q694-D697 PolarHBondContact O-N 3.09Å; Q694-D697 VanDerWaalsContact O-N 3.1Å
695	V	80.3	Confident	89.2	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.024	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-67.9	-30.1	-178.7	-174.8	0	0	0	0	112.1	M578 D697 L698 V981 L982 E985	M578-V695 HydrophobicContact CE-CG2 3.35Å; M578-V695 HydrophobicContact SD-CG1 4.21Å; M578-V695 HydrophobicContact SD-CG2 3.95Å; V695-D697 PolarHBondContact O-N 3.39Å; V695-L698 HydrophobicContact CB-CD1 4.29Å; V695-L698 HydrophobicContact CG1-CD1 3.84Å; V695-L698 WeakPolarHBondContact O-CG 3.36Å; V695-V981 HydrophobicContact CG1-CG1 3.77Å; V695-L982 HydrophobicContact CB-CD2 4.05Å; V695-L982 HydrophobicContact CG1-CD2 3.69Å; V695-L982 HydrophobicContact CG1-CG 4.41Å; V695-E985 WeakPolarHBondContact CB-OE1 3.4Å; V695-E985 HydrophobicContact CG2-CG 4.2Å; V695-E985 WeakPolarHBondContact CG2-OE1 3.5Å
696	T	80.3	Confident	88.9	Confident	27 Å²	27	37.7 Å²	37.7	17%	0.166	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-61	-26.6	172.2	51.7	0	0	0	0	113.4	Q694 P699 Q978 L982	Q694-T696 VanDerWaalsContact C-N 3.28Å; Q694-T696 PolarHBondContact O-N 3.04Å; T696-P699 WeakPolarHBondContact O-CD 3.18Å; T696-Q978 PolarHBondContact O-NE2 3.38Å; T696-L982 HydrophobicContact CG2-CD2 4.02Å
697	D	85.1	Confident	88.9	Confident	52 Å²	52	37.8 Å²	37.8	28%	0.278	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-101.6	4.4	-169.3	-58.1	-27.5	0	0	0	113.4	I693 Q694 V695 P699 Q700 M701	I693-D697 HydrophobicContact CD1-CB 3.92Å; I693-D697 HydrophobicContact CG1-CB 3.6Å; Q694-D697 PolarHBondContact O-N 3.09Å; Q694-D697 VanDerWaalsContact O-N 3.1Å; V695-D697 PolarHBondContact O-N 3.39Å; D697-P699 VanDerWaalsContact C-CD 3.42Å; D697-Q700 VanDerWaalsContact CA-CD 3.49Å; D697-Q700 WeakPolarHBondContact O-CG 3.28Å; D697-Q700 PolarHBondContact O-OE1 2.87Å; D697-Q700 VanDerWaalsContact O-OE1 3.14Å; D697-Q700 PolarHBondContact OD1-NE2 2.95Å; D697-M701 PolarHBondContact O-N 2.85Å
698	L	81.6	Confident	89	Confident	8 Å²	8	38.4 Å²	38.4	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-36	177.6	-62.9	176.7	0	0	0	114.5	V571 M575 I693 V695 Q700 M701 V702	V571-L698 HydrophobicContact CG1-CD1 4.44Å; V571-L698 HydrophobicContact CG1-CD2 3.66Å; V571-L698 HydrophobicContact CG2-CD2 4.23Å; M575-L698 HydrophobicContact CE-CB 4.11Å; M575-L698 HydrophobicContact CE-CD1 3.58Å; M575-L698 HydrophobicContact CE-CG 4.35Å; M575-L698 HydrophobicContact CG-CD1 3.99Å; I693-L698 HydrophobicContact CG2-CD2 4Å; V695-L698 HydrophobicContact CB-CD1 4.29Å; V695-L698 HydrophobicContact CG1-CD1 3.84Å; V695-L698 WeakPolarHBondContact O-CG 3.36Å; L698-Q700 PolarHBondContact O-N 2.83Å; L698-M701 PolarHBondContact O-N 3.08Å; L698-V702 WeakPolarHBondContact O-CG2 3.33Å; L698-V702 PolarHBondContact O-N 2.97Å
699	P	82.1	Confident	88.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-44.8	179.3	-24.7	35	0	0	0	113	T696 D697 A703 L766 I841 R974 M975 Q978	T696-P699 WeakPolarHBondContact O-CD 3.18Å; D697-P699 VanDerWaalsContact C-CD 3.42Å; P699-A703 PolarHBondContact O-N 3.27Å; P699-A703 VanDerWaalsContact O-N 3.14Å; P699-L766 HydrophobicContact CB-CD1 4.43Å; P699-I841 HydrophobicContact CB-CD1 4.32Å; P699-R974 HydrophobicContact CB-CB 4.31Å; P699-R974 HydrophobicContact CG-CB 4.14Å; P699-M975 HydrophobicContact CB-CB 4.1Å; P699-M975 HydrophobicContact CB-SD 4.34Å; P699-M975 HydrophobicContact CG-CB 3.87Å; P699-M975 HydrophobicContact CG-SD 4.26Å; P699-Q978 VanDerWaalsContact CG-NE2 3.33Å
700	Q	88.2	Confident	89.1	Confident	7 Å²	7	32.4 Å²	32.4	3%	0.033	15%	0.148	C	C	.	.	H	α-helix	trans	-72	-32.2	177	64.3	-93.6	37.6	0	0	112.2	D697 L698 A703 L704 F763 L766	D697-Q700 VanDerWaalsContact CA-CD 3.49Å; D697-Q700 WeakPolarHBondContact O-CG 3.28Å; D697-Q700 PolarHBondContact O-OE1 2.87Å; D697-Q700 VanDerWaalsContact O-OE1 3.14Å; D697-Q700 PolarHBondContact OD1-NE2 2.95Å; L698-Q700 PolarHBondContact O-N 2.83Å; Q700-A703 PolarHBondContact O-N 3.36Å; Q700-L704 WeakPolarHBondContact O-CB 3.2Å; Q700-L704 PolarHBondContact O-N 3.35Å; Q700-F763 HydrophobicContact CB-CD2 3.85Å; Q700-F763 HydrophobicContact CB-CE2 4.4Å; Q700-F763 HydrophobicContact CG-CD2 4.4Å; Q700-F763 HydrophobicContact CG-CE2 4.47Å; Q700-F763 WeakPolarHBondContact O-CD2 3.42Å; Q700-L766 HydrophobicContact CB-CB 3.76Å; Q700-L766 HydrophobicContact CB-CD1 4.35Å
701	M	88.9	Confident	89.3	Confident	19 Å²	19	33.1 Å²	33.1	9%	0.094	15%	0.154	C	C	.	.	H	α-helix	trans	-66.3	-40.4	176.2	-160.2	66.5	-155.1	0	0	112.5	A689 I693 D697 L698 L704 F705	A689-M701 HydrophobicContact CB-CE 4.03Å; I693-M701 HydrophobicContact CD1-CB 3.72Å; I693-M701 HydrophobicContact CD1-CG 3.88Å; I693-M701 HydrophobicContact CD1-SD 3.62Å; D697-M701 PolarHBondContact O-N 2.85Å; L698-M701 PolarHBondContact O-N 3.08Å; M701-L704 HydrophobicContact CE-CD2 4.16Å; M701-L704 PolarHBondContact O-N 2.95Å; M701-L704 HydrophobicContact SD-CD2 4.33Å; M701-F705 HydrophobicContact CE-CD1 4.15Å; M701-F705 HydrophobicContact CE-CD2 4.45Å; M701-F705 HydrophobicContact CE-CE1 3.46Å; M701-F705 VanDerWaalsContact CE-CE1 3.46Å; M701-F705 HydrophobicContact CE-CE2 3.82Å; M701-F705 HydrophobicContact CE-CZ 3.27Å; M701-F705 HydrophobicContact CG-CD2 4.13Å; M701-F705 HydrophobicContact CG-CE2 3.7Å; M701-F705 HydrophobicContact CG-CZ 4.15Å; M701-F705 WeakPolarHBondContact O-CD2 3.41Å; M701-F705 WeakPolarHBondContact O-CG 3.49Å; M701-F705 PolarHBondContact O-N 3.47Å
702	V	85.6	Confident	89.6	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-68	-38.4	176.1	170.2	0	0	0	0	111	L698 L704 F705 H706 I841 M975	L698-V702 WeakPolarHBondContact O-CG2 3.33Å; L698-V702 PolarHBondContact O-N 2.97Å; V702-L704 PolarHBondContact O-N 3.49Å; V702-F705 PolarHBondContact O-N 3.29Å; V702-H706 VanDerWaalsContact CG1-CE1 3.42Å; V702-H706 WeakPolarHBondContact CG1-CE1 3.43Å; V702-H706 WeakPolarHBondContact CG1-NE2 3.22Å; V702-H706 PolarHBondContact O-CD2 3.47Å; V702-H706 VanDerWaalsContact O-CG 3.24Å; V702-H706 PolarHBondContact O-N 3.27Å; V702-I841 HydrophobicContact CG1-CG2 4.37Å; V702-M975 HydrophobicContact CB-CE 3.88Å; V702-M975 HydrophobicContact CG1-CE 3.76Å; V702-M975 HydrophobicContact CG2-CE 3.96Å
703	A	89.4	Confident	89.9	Confident	1 Å²	1	16.3 Å²	16.3	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-60.5	-42.8	169.1	0	0	0	0	0	112.2	P699 Q700 F705 H706 S707 S759 A762 F763 L766	P699-A703 PolarHBondContact O-N 3.27Å; P699-A703 VanDerWaalsContact O-N 3.14Å; Q700-A703 PolarHBondContact O-N 3.36Å; A703-F705 PolarHBondContact O-N 2.97Å; A703-H706 PolarHBondContact O-N 2.96Å; A703-S707 PolarHBondContact O-N 3.09Å; A703-S759 WeakPolarHBondContact O-CB 3.38Å; A703-A762 HydrophobicContact CB-CB 4.28Å; A703-F763 HydrophobicContact CB-CB 4.3Å; A703-L766 HydrophobicContact CB-CD1 4.42Å
704	L	93.3	Very high	90.3	Very high	47 Å²	47	16 Å²	16	25%	0.246	9%	0.085	C	C	.	.	H	α-helix	trans	-62.7	-42.1	176.6	-177	60.8	0	0	0	112	Q700 M701 V702 S707 L760 F763	Q700-L704 WeakPolarHBondContact O-CB 3.2Å; Q700-L704 PolarHBondContact O-N 3.35Å; M701-L704 HydrophobicContact CE-CD2 4.16Å; M701-L704 PolarHBondContact O-N 2.95Å; M701-L704 HydrophobicContact SD-CD2 4.33Å; V702-L704 PolarHBondContact O-N 3.49Å; L704-S707 WeakPolarHBondContact O-CB 3.44Å; L704-S707 PolarHBondContact O-N 3.15Å; L704-S707 PolarHBondContact O-OG 2.91Å; L704-L760 HydrophobicContact CD1-CD2 4.06Å; L704-F763 HydrophobicContact CB-CD2 3.95Å; L704-F763 HydrophobicContact CB-CE2 4.48Å; L704-F763 HydrophobicContact CB-CG 4.4Å; L704-F763 HydrophobicContact CD2-CE2 4.27Å
705	F	91.3	Very high	90.9	Very high	3 Å²	3	13 Å²	13	1%	0.013	7%	0.072	C	C	.	.	H	α-helix	trans	-68.1	-38.4	177.1	-70.1	-43.1	0	0	0	113.1	N526 I563 N564 G567 V571 M701 V702 A703 S707 L708 V709	N526-F705 VanDerWaalsContact ND2-CB 3.26Å; N526-F705 WeakPolarHBondContact ND2-CB 3.32Å; N526-F705 WeakPolarHBondContact ND2-CD2 3.16Å; N526-F705 WeakPolarHBondContact OD1-CB 3.31Å; I563-F705 HydrophobicContact CG2-CD1 4.44Å; I563-F705 HydrophobicContact CG2-CE1 4.03Å; N564-F705 PolarHBondContact ND2-O 3.17Å; N564-F705 WeakPolarHBondContact OD1-CA 3.08Å; N564-F705 VanDerWaalsContact OD1-CB 3.25Å; N564-F705 WeakPolarHBondContact OD1-CB 3.4Å; N564-F705 WeakPolarHBondContact OD1-CD1 3.46Å; N564-F705 PolarHBondContact OD1-O 3Å; G567-F705 VanDerWaalsContact CA-CZ 3.49Å; V571-F705 HydrophobicContact CG2-CE2 4.44Å; M701-F705 HydrophobicContact CE-CD1 4.15Å; M701-F705 HydrophobicContact CE-CD2 4.45Å; M701-F705 HydrophobicContact CE-CE1 3.46Å; M701-F705 VanDerWaalsContact CE-CE1 3.46Å; M701-F705 HydrophobicContact CE-CE2 3.82Å; M701-F705 HydrophobicContact CE-CZ 3.27Å; M701-F705 HydrophobicContact CG-CD2 4.13Å; M701-F705 HydrophobicContact CG-CE2 3.7Å; M701-F705 HydrophobicContact CG-CZ 4.15Å; M701-F705 WeakPolarHBondContact O-CD2 3.41Å; M701-F705 WeakPolarHBondContact O-CG 3.49Å; M701-F705 PolarHBondContact O-N 3.47Å; V702-F705 PolarHBondContact O-N 3.29Å; A703-F705 PolarHBondContact O-N 2.97Å; F705-S707 PolarHBondContact O-N 3.3Å; F705-L708 HydrophobicContact CD1-CD1 4.3Å; F705-L708 WeakPolarHBondContact O-CB 3.44Å; F705-L708 PolarHBondContact O-N 3.41Å; F705-V709 PolarHBondContact O-N 3.34Å
706	H	91	Very high	91.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-56.8	-34.9	172.6	-66.1	165.8	0	0	0	112.2	N526 V702 A703 L708 V709 G710 N845	N526-H706 PolarHBondContact OD1-CD2 2.97Å; N526-H706 VanDerWaalsContact OD1-CD2 3.24Å; N526-H706 PolarHBondContact OD1-N 2.88Å; V702-H706 VanDerWaalsContact CG1-CE1 3.42Å; V702-H706 WeakPolarHBondContact CG1-CE1 3.43Å; V702-H706 WeakPolarHBondContact CG1-NE2 3.22Å; V702-H706 PolarHBondContact O-CD2 3.47Å; V702-H706 VanDerWaalsContact O-CG 3.24Å; V702-H706 PolarHBondContact O-N 3.27Å; A703-H706 PolarHBondContact O-N 2.96Å; H706-L708 VanDerWaalsContact C-N 3.28Å; H706-L708 PolarHBondContact O-N 3.11Å; H706-V709 PolarHBondContact O-N 3.31Å; H706-G710 PolarHBondContact O-N 3.3Å; H706-G710 VanDerWaalsContact O-N 3.11Å; H706-N845 VanDerWaalsContact CE1-CB 3.48Å; H706-N845 WeakPolarHBondContact CE1-CB 3.12Å; H706-N845 PolarHBondContact NE2-OD1 3.3Å
707	S	95.5	Very high	92.5	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.014	6%	0.063	C	C	.	.	H	α-helix	trans	-64.3	-33.5	176.7	90.9	0	0	0	0	112.5	A703 L704 F705 G710 A711 L756	A703-S707 PolarHBondContact O-N 3.09Å; L704-S707 WeakPolarHBondContact O-CB 3.44Å; L704-S707 PolarHBondContact O-N 3.15Å; L704-S707 PolarHBondContact O-OG 2.91Å; F705-S707 PolarHBondContact O-N 3.3Å; S707-G710 PolarHBondContact O-N 3.04Å; S707-A711 PolarHBondContact O-N 3.39Å; S707-L756 WeakPolarHBondContact CB-O 3.43Å
708	L	96.5	Very high	93.1	Very high	31 Å²	31	10 Å²	10	16%	0.162	6%	0.055	C	C	.	.	H	α-helix	trans	-70.6	-30.9	176.6	-50.2	-170	0	0	0	112.2	L560 I563 F705 H706 A712	L560-L708 HydrophobicContact CB-CB 4.44Å; L560-L708 HydrophobicContact CD2-CD2 4.34Å; I563-L708 HydrophobicContact CB-CD1 4.06Å; I563-L708 HydrophobicContact CG2-CD1 3.59Å; F705-L708 HydrophobicContact CD1-CD1 4.3Å; F705-L708 WeakPolarHBondContact O-CB 3.44Å; F705-L708 PolarHBondContact O-N 3.41Å; H706-L708 VanDerWaalsContact C-N 3.28Å; H706-L708 PolarHBondContact O-N 3.11Å; L708-A712 WeakPolarHBondContact O-CB 3.47Å; L708-A712 PolarHBondContact O-N 3.41Å
709	V	95.9	Very high	93.8	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66.4	-46.4	170.4	-162	0	0	0	0	110	S529 T532 N564 F705 H706 A711 A712 A713	S529-V709 WeakPolarHBondContact OG-CG2 3.44Å; T532-V709 HydrophobicContact CG2-CG1 3.76Å; N564-V709 WeakPolarHBondContact ND2-CG2 3.43Å; N564-V709 PolarHBondContact ND2-N 2.98Å; F705-V709 PolarHBondContact O-N 3.34Å; H706-V709 PolarHBondContact O-N 3.31Å; V709-A711 VanDerWaalsContact C-N 3.29Å; V709-A711 PolarHBondContact O-N 3.32Å; V709-A712 PolarHBondContact O-N 2.94Å; V709-A713 PolarHBondContact O-N 3.28Å
710	G	95.8	Very high	94.4	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-60.1	-39.2	177.8	0	0	0	0	0	112.8	H706 S707 V714 G752	H706-G710 PolarHBondContact O-N 3.3Å; H706-G710 VanDerWaalsContact O-N 3.11Å; S707-G710 PolarHBondContact O-N 3.04Å; G710-V714 VanDerWaalsContact O-CG2 3.31Å; G710-V714 WeakPolarHBondContact O-CG2 3.47Å; G710-V714 PolarHBondContact O-N 3.14Å; G710-G752 CarbonylContact C-O 3.5Å; G710-G752 VanDerWaalsContact CA-O 3.31Å; G710-G752 WeakPolarHBondContact CA-O 3.43Å; G710-G752 CarbonylContact O-C 3.58Å; G710-G752 WeakPolarHBondContact O-CA 3.46Å
711	A	97.4	Very high	94.8	Very high	15 Å²	15	9.5 Å²	9.5	12%	0.124	5%	0.053	C	C	.	.	H	α-helix	trans	-65.6	-47.9	172.1	0	0	0	0	0	112.3	L560 S707 V709 A713 V714 L715 L756	L560-A711 HydrophobicContact CD1-CB 3.73Å; S707-A711 PolarHBondContact O-N 3.39Å; V709-A711 VanDerWaalsContact C-N 3.29Å; V709-A711 PolarHBondContact O-N 3.32Å; A711-A713 PolarHBondContact O-N 3.33Å; A711-V714 PolarHBondContact O-N 2.89Å; A711-L715 WeakPolarHBondContact O-CB 3.49Å; A711-L715 WeakPolarHBondContact O-CG 3.35Å; A711-L715 PolarHBondContact O-N 3Å; A711-L756 HydrophobicContact CB-CD1 4.19Å; A711-L756 HydrophobicContact CB-CD2 4.23Å
712	A	97.6	Very high	95	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-56.9	-48.5	177.5	0	0	0	0	0	111.3	A557 S561 L708 V709 V714 L715 T716	A557-A712 HydrophobicContact CB-CB 4.33Å; S561-A712 WeakPolarHBondContact OG-CB 3.38Å; L708-A712 WeakPolarHBondContact O-CB 3.47Å; L708-A712 PolarHBondContact O-N 3.41Å; V709-A712 PolarHBondContact O-N 2.94Å; A712-V714 PolarHBondContact O-N 3.3Å; A712-L715 PolarHBondContact O-N 3.1Å; A712-L715 VanDerWaalsContact O-N 3.13Å; A712-T716 PolarHBondContact O-N 3.2Å; A712-T716 PolarHBondContact O-OG1 3.32Å
713	A	96.7	Very high	95.3	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.1	-42.9	178.4	0	0	0	0	0	113.3	V709 A711 C717 A851 E855	V709-A713 PolarHBondContact O-N 3.28Å; A711-A713 PolarHBondContact O-N 3.33Å; A713-C717 WeakPolarHBondContact O-CB 3.26Å; A713-C717 PolarHBondContact O-N 2.88Å; A713-C717 PolarHBondContact O-SG 3.46Å; A713-A851 HydrophobicContact CB-CB 3.89Å; A713-E855 WeakPolarHBondContact CA-OE1 3.39Å; A713-E855 VanDerWaalsContact CB-OE1 3.24Å; A713-E855 WeakPolarHBondContact CB-OE1 3.46Å
714	V	97.9	Very high	95.4	Very high	22 Å²	22	16.3 Å²	16.3	13%	0.133	9%	0.088	C	C	.	.	H	α-helix	trans	-61.1	-45.6	174.3	166.6	0	0	0	0	111.1	G710 A711 A712 I718 T749	G710-V714 VanDerWaalsContact O-CG2 3.31Å; G710-V714 WeakPolarHBondContact O-CG2 3.47Å; G710-V714 PolarHBondContact O-N 3.14Å; A711-V714 PolarHBondContact O-N 2.89Å; A712-V714 PolarHBondContact O-N 3.3Å; V714-I718 HydrophobicContact CG1-CD1 3.68Å; V714-I718 WeakPolarHBondContact O-CB 3.48Å; V714-I718 WeakPolarHBondContact O-CD1 3.43Å; V714-I718 VanDerWaalsContact O-CG1 3.26Å; V714-I718 WeakPolarHBondContact O-CG1 3.44Å; V714-I718 PolarHBondContact O-N 3.42Å; V714-I718 VanDerWaalsContact O-N 3.09Å; V714-T749 HydrophobicContact CG1-CG2 4.31Å; V714-T749 HydrophobicContact CG2-CG2 4.34Å; V714-T749 WeakPolarHBondContact CG2-O 3.5Å
715	L	97.9	Very high	95.1	Very high	34 Å²	34	14 Å²	14	18%	0.178	8%	0.076	C	C	.	.	H	α-helix	trans	-64.9	-47	179.5	-67.3	167.9	0	0	0	111.5	L553 A557 L560 A711 A712 I718 A719	L553-L715 HydrophobicContact CB-CD2 4.28Å; L553-L715 HydrophobicContact CD2-CD2 3.56Å; L553-L715 HydrophobicContact CG-CD2 4.48Å; A557-L715 HydrophobicContact CB-CB 3.99Å; A557-L715 HydrophobicContact CB-CD1 4.49Å; L560-L715 HydrophobicContact CD1-CD1 3.99Å; A711-L715 WeakPolarHBondContact O-CB 3.49Å; A711-L715 WeakPolarHBondContact O-CG 3.35Å; A711-L715 PolarHBondContact O-N 3Å; A712-L715 PolarHBondContact O-N 3.1Å; A712-L715 VanDerWaalsContact O-N 3.13Å; L715-I718 PolarHBondContact O-N 3.42Å; L715-A719 VanDerWaalsContact O-CB 3.23Å; L715-A719 WeakPolarHBondContact O-CB 3.14Å; L715-A719 PolarHBondContact O-N 2.71Å
716	T	97.7	Very high	94.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.9	-48	176.8	-50.8	0	0	0	0	111.2	L539 A712 I718 A719 N720 E855 M858 L859	L539-T716 HydrophobicContact CD1-CG2 3.77Å; L539-T716 WeakPolarHBondContact CD1-O 3.46Å; A712-T716 PolarHBondContact O-N 3.2Å; A712-T716 PolarHBondContact O-OG1 3.32Å; T716-I718 PolarHBondContact O-N 2.9Å; T716-A719 PolarHBondContact O-N 2.9Å; T716-N720 VanDerWaalsContact O-CB 3.32Å; T716-N720 WeakPolarHBondContact O-CB 3.46Å; T716-N720 PolarHBondContact O-N 3.05Å; T716-E855 WeakPolarHBondContact CB-OE2 3.43Å; T716-E855 HydrophobicContact CG2-CG 4.23Å; T716-E855 WeakPolarHBondContact CG2-OE2 3.49Å; T716-E855 PolarHBondContact OG1-OE2 3.22Å; T716-E855 VanDerWaalsContact OG1-OE2 3.09Å; T716-M858 HydrophobicContact CG2-CE 3.95Å; T716-L859 HydrophobicContact CG2-CD1 4.18Å
717	C	97.3	Very high	94.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.4	-40	-178.1	-67.6	0	0	0	0	112.8	A713 Y721 A745 T749 M858	A713-C717 WeakPolarHBondContact O-CB 3.26Å; A713-C717 PolarHBondContact O-N 2.88Å; A713-C717 PolarHBondContact O-SG 3.46Å; C717-Y721 WeakPolarHBondContact O-CB 3.48Å; C717-Y721 PolarHBondContact O-N 2.99Å; C717-Y721 VanDerWaalsContact O-N 3.1Å; C717-A745 HydrophobicContact CB-CB 4.25Å; C717-A745 WeakPolarHBondContact CB-O 3.11Å; C717-T749 WeakPolarHBondContact CB-OG1 3.27Å; C717-M858 HydrophobicContact CB-SD 4.36Å
718	I	97.2	Very high	93.9	Very high	19 Å²	19	23.5 Å²	23.5	10%	0.097	13%	0.125	C	C	.	.	H	α-helix	trans	-68.9	-44.1	175.9	-68	166.5	0	0	0	110.6	L553 V714 L715 T716 Y721 M722 T749 L810 L813 I814	L553-I718 HydrophobicContact CD1-CG2 3.86Å; V714-I718 HydrophobicContact CG1-CD1 3.68Å; V714-I718 WeakPolarHBondContact O-CB 3.48Å; V714-I718 WeakPolarHBondContact O-CD1 3.43Å; V714-I718 VanDerWaalsContact O-CG1 3.26Å; V714-I718 WeakPolarHBondContact O-CG1 3.44Å; V714-I718 PolarHBondContact O-N 3.42Å; V714-I718 VanDerWaalsContact O-N 3.09Å; L715-I718 PolarHBondContact O-N 3.42Å; T716-I718 PolarHBondContact O-N 2.9Å; I718-Y721 PolarHBondContact O-N 2.76Å; I718-M722 HydrophobicContact CG2-SD 4.02Å; I718-M722 VanDerWaalsContact O-CG 3.31Å; I718-M722 WeakPolarHBondContact O-CG 3.31Å; I718-M722 PolarHBondContact O-N 3.29Å; I718-T749 HydrophobicContact CD1-CG2 4.35Å; I718-T749 HydrophobicContact CG1-CG2 4.36Å; I718-L810 HydrophobicContact CG2-CD1 4.11Å; I718-L813 HydrophobicContact CG1-CD2 4.2Å; I718-L813 HydrophobicContact CG1-CG 4.41Å; I718-I814 HydrophobicContact CD1-CG1 4.01Å; I718-I814 HydrophobicContact CG1-CG1 4.32Å; I718-I814 HydrophobicContact CG2-CD1 4.45Å; I718-I814 HydrophobicContact CG2-CG1 4.5Å
719	A	96.8	Very high	93.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-47.7	176.9	0	0	0	0	0	111.6	L539 P550 L553 L715 T716 Y721 M722 V723	L539-A719 HydrophobicContact CD1-CB 4.01Å; P550-A719 HydrophobicContact CB-CB 4.25Å; L553-A719 HydrophobicContact CB-CB 4.06Å; L553-A719 HydrophobicContact CD1-CB 4.44Å; L715-A719 VanDerWaalsContact O-CB 3.23Å; L715-A719 WeakPolarHBondContact O-CB 3.14Å; L715-A719 PolarHBondContact O-N 2.71Å; T716-A719 PolarHBondContact O-N 2.9Å; A719-Y721 PolarHBondContact O-N 3.16Å; A719-M722 PolarHBondContact O-N 3.38Å; A719-M722 VanDerWaalsContact O-N 3.13Å; A719-V723 WeakPolarHBondContact O-CG2 3.33Å; A719-V723 PolarHBondContact O-N 2.89Å
720	N	95.4	Very high	92.4	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.027	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-46.1	178.1	-165.6	102.1	0	0	0	111.6	L539 T716 M722 V723 E724 M858 L859	L539-N720 HydrophobicContact CD1-CB 3.88Å; L539-N720 HydrophobicContact CD2-CB 4.41Å; T716-N720 VanDerWaalsContact O-CB 3.32Å; T716-N720 WeakPolarHBondContact O-CB 3.46Å; T716-N720 PolarHBondContact O-N 3.05Å; N720-M722 VanDerWaalsContact C-N 3.27Å; N720-M722 PolarHBondContact O-N 3.35Å; N720-V723 PolarHBondContact O-N 3.45Å; N720-E724 WeakPolarHBondContact ND2-CG 3.49Å; N720-E724 WeakPolarHBondContact O-CB 3.29Å; N720-E724 PolarHBondContact O-N 3.45Å; N720-M858 HydrophobicContact CB-CE 3.48Å; N720-M858 VanDerWaalsContact CB-CE 3.48Å; N720-M858 HydrophobicContact CB-CG 4.38Å; N720-M858 HydrophobicContact CB-SD 3.6Å; N720-M858 VanDerWaalsContact CB-SD 3.6Å; N720-L859 WeakPolarHBondContact OD1-CD2 3.46Å
721	Y	94.7	Very high	91.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-39.6	176.6	179.2	-81.6	0	0	0	111.8	C717 I718 A719 M725 M741 K742 L798 V806 G809 L810 L813	C717-Y721 WeakPolarHBondContact O-CB 3.48Å; C717-Y721 PolarHBondContact O-N 2.99Å; C717-Y721 VanDerWaalsContact O-N 3.1Å; I718-Y721 PolarHBondContact O-N 2.76Å; A719-Y721 PolarHBondContact O-N 3.16Å; Y721-M725 HydrophobicContact CD1-CG 3.94Å; Y721-M725 HydrophobicContact CD2-CG 3.79Å; Y721-M725 HydrophobicContact CD2-SD 4.35Å; Y721-M725 HydrophobicContact CE1-CG 3.66Å; Y721-M725 HydrophobicContact CE2-CE 4.36Å; Y721-M725 HydrophobicContact CE2-CG 3.52Å; Y721-M725 HydrophobicContact CE2-SD 3.69Å; Y721-M725 HydrophobicContact CG-CG 4Å; Y721-M725 VanDerWaalsContact CZ-CG 3.45Å; Y721-M725 WeakPolarHBondContact O-CB 3.43Å; Y721-M725 WeakPolarHBondContact O-CG 3.43Å; Y721-M725 PolarHBondContact O-N 2.78Å; Y721-M725 WeakPolarHBondContact OH-CE 3.37Å; Y721-M741 HydrophobicContact CD2-SD 4.09Å; Y721-K742 HydrophobicContact CE2-CG 4.29Å; Y721-L798 HydrophobicContact CE2-CD1 4.08Å; Y721-V806 PolarHBondContact OH-O 3.16Å; Y721-V806 VanDerWaalsContact OH-O 3.11Å; Y721-G809 VanDerWaalsContact OH-C 3.22Å; Y721-G809 VanDerWaalsContact OH-CA 3.23Å; Y721-G809 WeakPolarHBondContact OH-CA 3.47Å; Y721-L810 HydrophobicContact CD1-CB 4.3Å; Y721-L810 HydrophobicContact CD1-CD1 3.89Å; Y721-L810 HydrophobicContact CE1-CB 3.78Å; Y721-L810 HydrophobicContact CE1-CD1 4.25Å; Y721-L810 PolarHBondContact OH-N 3.39Å; Y721-L813 HydrophobicContact CD1-CD2 4.16Å; Y721-L813 HydrophobicContact CD2-CD2 3.98Å; Y721-L813 HydrophobicContact CG-CD2 3.63Å
722	M	94.2	Very high	90.7	Very high	53 Å²	53	38.2 Å²	38.2	26%	0.261	21%	0.207	S	C	.	.	H	α-helix	trans	-71.2	-30.3	178.9	-69.7	176.2	71.2	0	0	113.8	V549 P550 L553 I718 A719 N720 L810	V549-M722 HydrophobicContact CB-CE 4.19Å; V549-M722 HydrophobicContact CG1-CE 4.08Å; P550-M722 HydrophobicContact CB-CB 4.38Å; P550-M722 HydrophobicContact CG-CB 3.64Å; P550-M722 HydrophobicContact CG-CE 4.01Å; P550-M722 HydrophobicContact CG-SD 4.32Å; L553-M722 HydrophobicContact CD1-SD 4.22Å; I718-M722 HydrophobicContact CG2-SD 4.02Å; I718-M722 VanDerWaalsContact O-CG 3.31Å; I718-M722 WeakPolarHBondContact O-CG 3.31Å; I718-M722 PolarHBondContact O-N 3.29Å; A719-M722 PolarHBondContact O-N 3.38Å; A719-M722 VanDerWaalsContact O-N 3.13Å; N720-M722 VanDerWaalsContact C-N 3.27Å; N720-M722 PolarHBondContact O-N 3.35Å; M722-L810 HydrophobicContact CE-CD2 4.43Å; M722-L810 HydrophobicContact CG-CD1 3.85Å; M722-L810 HydrophobicContact CG-CD2 4.01Å; M722-L810 HydrophobicContact SD-CD1 4.3Å; M722-L810 HydrophobicContact SD-CD2 4.19Å
723	V	92.3	Very high	89.9	Confident	48 Å²	48	45.6 Å²	45.6	29%	0.291	25%	0.246	S	C	.	.	H	α-helix	trans	-82.1	-49.2	176.7	174.5	0	0	0	0	111.4	P550 A719 N720 P726 H727	P550-V723 HydrophobicContact CB-CG2 3.63Å; P550-V723 HydrophobicContact CG-CG2 4.16Å; A719-V723 WeakPolarHBondContact O-CG2 3.33Å; A719-V723 PolarHBondContact O-N 2.89Å; N720-V723 PolarHBondContact O-N 3.45Å; V723-P726 WeakPolarHBondContact O-CD 3.5Å; V723-H727 PolarHBondContact O-CD2 3.5Å
724	E	90.1	Very high	89.2	Confident	63 Å²	63	47.4 Å²	47.4	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-83.8	-28.6	-168.8	-68.1	-59.4	144.4	0	0	114.2	N720 H727 L728 M741	N720-E724 WeakPolarHBondContact ND2-CG 3.49Å; N720-E724 WeakPolarHBondContact O-CB 3.29Å; N720-E724 PolarHBondContact O-N 3.45Å; E724-H727 PolarHBondContact O-N 3.42Å; E724-L728 HydrophobicContact CB-CD1 3.96Å; E724-L728 WeakPolarHBondContact O-CB 3.32Å; E724-L728 WeakPolarHBondContact O-CG 3.28Å; E724-L728 PolarHBondContact O-N 3.14Å; E724-M741 HydrophobicContact CB-CE 4.06Å
725	M	88.3	Confident	88.5	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-53.9	-54.5	178.2	-84.5	-71.3	-71.5	0	0	112	Y721 H727 L728 I729 L738 M741 K742 P803 V806	Y721-M725 HydrophobicContact CD1-CG 3.94Å; Y721-M725 HydrophobicContact CD2-CG 3.79Å; Y721-M725 HydrophobicContact CD2-SD 4.35Å; Y721-M725 HydrophobicContact CE1-CG 3.66Å; Y721-M725 HydrophobicContact CE2-CE 4.36Å; Y721-M725 HydrophobicContact CE2-CG 3.52Å; Y721-M725 HydrophobicContact CE2-SD 3.69Å; Y721-M725 HydrophobicContact CG-CG 4Å; Y721-M725 VanDerWaalsContact CZ-CG 3.45Å; Y721-M725 WeakPolarHBondContact O-CB 3.43Å; Y721-M725 WeakPolarHBondContact O-CG 3.43Å; Y721-M725 PolarHBondContact O-N 2.78Å; Y721-M725 WeakPolarHBondContact OH-CE 3.37Å; M725-H727 PolarHBondContact O-N 2.76Å; M725-L728 PolarHBondContact O-N 3.36Å; M725-I729 HydrophobicContact CB-CD1 4.34Å; M725-I729 HydrophobicContact CE-CD1 3.92Å; M725-I729 HydrophobicContact CE-CG1 4.48Å; M725-I729 WeakPolarHBondContact O-CB 3.34Å; M725-I729 WeakPolarHBondContact O-CD1 3.45Å; M725-I729 WeakPolarHBondContact O-CG1 3.38Å; M725-I729 PolarHBondContact O-N 2.95Å; M725-I729 VanDerWaalsContact O-N 3.08Å; M725-L738 HydrophobicContact SD-CD1 3.48Å; M725-L738 WeakPolarHBondContact SD-CD1 3.48Å; M725-M741 HydrophobicContact CG-CE 3.87Å; M725-M741 HydrophobicContact SD-CE 3.93Å; M725-K742 HydrophobicContact SD-CG 4.28Å; M725-P803 WeakPolarHBondContact CE-O 3.28Å; M725-V806 HydrophobicContact CB-CG1 4.18Å; M725-V806 HydrophobicContact CB-CG2 4.42Å; M725-V806 HydrophobicContact CE-CG2 4.29Å
726	P	85.7	Confident	87.9	Confident	57 Å²	57	51.8 Å²	51.8	37%	0.37	28%	0.28	S	S	.	.	H	α-helix	trans	-55.6	-35	179.9	-26.8	35.5	0	0	0	114.5	V723 L730	V723-P726 WeakPolarHBondContact O-CD 3.5Å; P726-L730 WeakPolarHBondContact O-CD1 3.23Å; P726-L730 WeakPolarHBondContact O-CG 3.22Å
727	H	84	Confident	87.2	Confident	120 Å²	120	53.8 Å²	53.8	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-77.1	-49.4	-179.9	-63.9	-54.9	0	0	0	111.8	V723 E724 M725 I729 L730	V723-H727 PolarHBondContact O-CD2 3.5Å; E724-H727 PolarHBondContact O-N 3.42Å; M725-H727 PolarHBondContact O-N 2.76Å; H727-I729 PolarHBondContact O-N 3.5Å; H727-L730 PolarHBondContact O-N 2.83Å; H727-L730 VanDerWaalsContact O-N 3.12Å
728	L	82.2	Confident	86.8	Confident	27 Å²	27	53.9 Å²	53.9	14%	0.141	30%	0.297	C	S	.	.	H	α-helix	trans	-71.3	-9	-178.6	-64.3	172.5	0	0	0	114.1	E724 M725 C734 L738 M741	E724-L728 HydrophobicContact CB-CD1 3.96Å; E724-L728 WeakPolarHBondContact O-CB 3.32Å; E724-L728 WeakPolarHBondContact O-CG 3.28Å; E724-L728 PolarHBondContact O-N 3.14Å; M725-L728 PolarHBondContact O-N 3.36Å; L728-C734 HydrophobicContact CD2-CB 3.85Å; L728-L738 HydrophobicContact CB-CB 4.17Å; L728-L738 HydrophobicContact CB-CD1 3.9Å; L728-M741 HydrophobicContact CD1-CB 4.37Å; L728-M741 HydrophobicContact CD1-CE 3.85Å; L728-M741 HydrophobicContact CD1-CG 4.48Å
729	I	80.9	Confident	86.4	Confident	39 Å²	39	54.6 Å²	54.6	20%	0.2	30%	0.3	C	S	.	.	H	α-helix	trans	-80.5	-32.3	170.6	-73.2	162.9	0	0	0	112	M725 H727 D731 P803 E804 V806	M725-I729 HydrophobicContact CB-CD1 4.34Å; M725-I729 HydrophobicContact CE-CD1 3.92Å; M725-I729 HydrophobicContact CE-CG1 4.48Å; M725-I729 WeakPolarHBondContact O-CB 3.34Å; M725-I729 WeakPolarHBondContact O-CD1 3.45Å; M725-I729 WeakPolarHBondContact O-CG1 3.38Å; M725-I729 PolarHBondContact O-N 2.95Å; M725-I729 VanDerWaalsContact O-N 3.08Å; H727-I729 PolarHBondContact O-N 3.5Å; I729-D731 VanDerWaalsContact C-N 3.32Å; I729-P803 HydrophobicContact CB-CB 4.43Å; I729-P803 WeakPolarHBondContact CD1-O 3.42Å; I729-P803 HydrophobicContact CG1-CB 3.91Å; I729-P803 WeakPolarHBondContact CG1-O 3.4Å; I729-P803 HydrophobicContact CG2-CB 4.2Å; I729-E804 HydrophobicContact CG2-CG 4.44Å; I729-V806 HydrophobicContact CD1-CG2 3.4Å; I729-V806 VanDerWaalsContact CD1-CG2 3.4Å
730	L	79.6	Confident	86	Confident	142 Å²	142	56.4 Å²	56.4	74%	0.743	31%	0.31	S	S	*	.	H	α-helix	trans	-80.2	-15.3	-173	-67.8	168.3	0	0	0	113.2	P726 H727	P726-L730 WeakPolarHBondContact O-CD1 3.23Å; P726-L730 WeakPolarHBondContact O-CG 3.22Å; H727-L730 PolarHBondContact O-N 2.83Å; H727-L730 VanDerWaalsContact O-N 3.12Å
731	D	80.9	Confident	85.8	Confident	66 Å²	66	56.7 Å²	56.7	35%	0.353	31%	0.311	S	S	.	.			trans	-114	107.3	177.2	-179.8	3.6	0	0	0	110.9	I729 D733 C734	I729-D731 VanDerWaalsContact C-N 3.32Å; D731-D733 VanDerWaalsContact C-N 3.27Å; D731-D733 PolarHBondContact O-N 3.38Å; D731-D733 WeakPolarHBondContact OD1-CB 3.46Å; D731-D733 PolarHBondContact OD1-N 2.87Å; D731-C734 HydrophobicContact CB-CB 4.06Å; D731-C734 WeakPolarHBondContact O-CB 3.3Å; D731-C734 PolarHBondContact O-N 3.3Å; D731-C734 PolarHBondContact OD2-SG 2.74Å
732	P	77	Confident	85.7	Confident	107 Å²	107	56.8 Å²	56.8	70%	0.695	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-59.9	-31.2	176.4	-24.9	35.5	0	0	0	114.5	C734 Y735	P732-C734 PolarHBondContact O-N 2.84Å; P732-Y735 VanDerWaalsContact O-CB 3.32Å; P732-Y735 WeakPolarHBondContact O-CB 3.41Å; P732-Y735 PolarHBondContact O-N 3.12Å
733	D	80.8	Confident	85.7	Confident	155 Å²	155	56.2 Å²	56.2	83%	0.829	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-70.9	-24.8	-179.1	-68.7	-21.5	0	0	0	110.8	D731 Y735	D731-D733 VanDerWaalsContact C-N 3.27Å; D731-D733 PolarHBondContact O-N 3.38Å; D731-D733 WeakPolarHBondContact OD1-CB 3.46Å; D731-D733 PolarHBondContact OD1-N 2.87Å; D733-Y735 VanDerWaalsContact C-N 3.27Å; D733-Y735 PolarHBondContact O-N 2.79Å
734	C	81.8	Confident	85.8	Confident	38 Å²	38	54.6 Å²	54.6	26%	0.257	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-76.4	0.7	173.3	-80.1	0	0	0	0	115	L728 D731 P732 G736 A737 L738	L728-C734 HydrophobicContact CD2-CB 3.85Å; D731-C734 HydrophobicContact CB-CB 4.06Å; D731-C734 WeakPolarHBondContact O-CB 3.3Å; D731-C734 PolarHBondContact O-N 3.3Å; D731-C734 PolarHBondContact OD2-SG 2.74Å; P732-C734 PolarHBondContact O-N 2.84Å; C734-G736 PolarHBondContact O-N 3.3Å; C734-G736 VanDerWaalsContact O-N 3.11Å; C734-A737 WeakPolarHBondContact O-CA 3.33Å; C734-A737 WeakPolarHBondContact O-CB 3.4Å; C734-A737 PolarHBondContact O-N 2.84Å; C734-L738 PolarHBondContact O-N 3.46Å
735	Y	83.2	Confident	86	Confident	120 Å²	120	51.6 Å²	51.6	47%	0.471	29%	0.287	S	S	.	.	H	α-helix	trans	-55.3	-34.2	-176.4	-177.4	-95.4	0	0	0	114.3	P732 D733 L738 Q739	P732-Y735 VanDerWaalsContact O-CB 3.32Å; P732-Y735 WeakPolarHBondContact O-CB 3.41Å; P732-Y735 PolarHBondContact O-N 3.12Å; D733-Y735 VanDerWaalsContact C-N 3.27Å; D733-Y735 PolarHBondContact O-N 2.79Å; Y735-L738 HydrophobicContact CD2-CD2 4.32Å; Y735-L738 WeakPolarHBondContact O-CB 3.37Å; Y735-L738 PolarHBondContact O-N 3.39Å; Y735-Q739 HydrophobicContact CD1-CG 4.42Å; Y735-Q739 HydrophobicContact CE1-CG 3.92Å; Y735-Q739 HydrophobicContact CE2-CG 4.4Å; Y735-Q739 PolarHBondContact O-N 2.96Å; Y735-Q739 VanDerWaalsContact O-N 3.14Å; Y735-Q739 PolarHBondContact OH-NE2 2.83Å
736	G	85.2	Confident	86.4	Confident	29 Å²	29	51.8 Å²	51.8	30%	0.299	29%	0.288	S	S	.	.	H	α-helix	trans	-65.9	-42.1	174.1	0	0	0	0	0	112.9	P488 C734 Q739 L740	P488-G736 WeakPolarHBondContact CB-O 3.48Å; C734-G736 PolarHBondContact O-N 3.3Å; C734-G736 VanDerWaalsContact O-N 3.11Å; G736-Q739 PolarHBondContact O-N 3.42Å; G736-L740 PolarHBondContact O-N 3Å; G736-L740 VanDerWaalsContact O-N 3.1Å
737	A	83.7	Confident	87	Confident	42 Å²	42	52.6 Å²	52.6	35%	0.347	29%	0.289	S	S	.	.	H	α-helix	trans	-68.4	-38.2	176.2	0	0	0	0	0	111.6	C734 Q739 L740 M741	C734-A737 WeakPolarHBondContact O-CA 3.33Å; C734-A737 WeakPolarHBondContact O-CB 3.4Å; C734-A737 PolarHBondContact O-N 2.84Å; A737-Q739 PolarHBondContact O-N 3.44Å; A737-L740 PolarHBondContact O-N 3.08Å; A737-M741 WeakPolarHBondContact O-CB 3.34Å; A737-M741 PolarHBondContact O-N 2.89Å
738	L	88.7	Confident	87.6	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-56	-48.1	173.1	176.8	61.4	0	0	0	112.1	M725 L728 C734 Y735 M741 K742 P803	M725-L738 HydrophobicContact SD-CD1 3.48Å; M725-L738 WeakPolarHBondContact SD-CD1 3.48Å; L728-L738 HydrophobicContact CB-CB 4.17Å; L728-L738 HydrophobicContact CB-CD1 3.9Å; C734-L738 PolarHBondContact O-N 3.46Å; Y735-L738 HydrophobicContact CD2-CD2 4.32Å; Y735-L738 WeakPolarHBondContact O-CB 3.37Å; Y735-L738 PolarHBondContact O-N 3.39Å; L738-M741 HydrophobicContact CD1-CE 4.04Å; L738-M741 PolarHBondContact O-N 3.18Å; L738-K742 WeakPolarHBondContact O-CB 3.24Å; L738-K742 WeakPolarHBondContact O-CG 3.35Å; L738-K742 PolarHBondContact O-N 3.05Å; L738-P803 HydrophobicContact CD2-CB 4.08Å
739	Q	89	Confident	88.3	Confident	34 Å²	34	45.6 Å²	45.6	16%	0.159	26%	0.255	C	S	.	.	H	α-helix	trans	-72.1	-32.4	179.5	-67.6	-71.2	15.5	0	0	112.8	Y735 G736 A737 T743 L799	Y735-Q739 HydrophobicContact CD1-CG 4.42Å; Y735-Q739 HydrophobicContact CE1-CG 3.92Å; Y735-Q739 HydrophobicContact CE2-CG 4.4Å; Y735-Q739 PolarHBondContact O-N 2.96Å; Y735-Q739 VanDerWaalsContact O-N 3.14Å; Y735-Q739 PolarHBondContact OH-NE2 2.83Å; G736-Q739 PolarHBondContact O-N 3.42Å; A737-Q739 PolarHBondContact O-N 3.44Å; Q739-T743 WeakPolarHBondContact O-CB 3.37Å; Q739-T743 PolarHBondContact O-N 2.68Å; Q739-T743 PolarHBondContact O-OG1 2.94Å; Q739-L799 PolarHBondContact NE2-O 2.93Å; Q739-L799 VanDerWaalsContact OE1-CD2 3.24Å
740	L	89.3	Confident	89.1	Confident	38 Å²	38	45.6 Å²	45.6	20%	0.199	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-50.8	170	178	66.4	0	0	0	111.2	P488 F492 G736 A737 K742 T743 V744	P488-L740 HydrophobicContact CG-CB 4.15Å; P488-L740 HydrophobicContact CG-CD2 3.92Å; F492-L740 HydrophobicContact CB-CD2 4.27Å; F492-L740 HydrophobicContact CD2-CD1 3.67Å; F492-L740 HydrophobicContact CD2-CD2 3.78Å; F492-L740 HydrophobicContact CD2-CG 4.42Å; F492-L740 HydrophobicContact CE2-CD1 3.7Å; F492-L740 HydrophobicContact CG-CD2 4.36Å; G736-L740 PolarHBondContact O-N 3Å; G736-L740 VanDerWaalsContact O-N 3.1Å; A737-L740 PolarHBondContact O-N 3.08Å; L740-K742 PolarHBondContact O-N 3.16Å; L740-T743 PolarHBondContact O-N 3.33Å; L740-T743 VanDerWaalsContact O-N 3.16Å; L740-V744 HydrophobicContact CD1-CG2 3.69Å; L740-V744 HydrophobicContact CG-CG2 4.24Å; L740-V744 WeakPolarHBondContact O-CB 3.37Å; L740-V744 VanDerWaalsContact O-CG2 3.29Å; L740-V744 WeakPolarHBondContact O-CG2 3.27Å; L740-V744 PolarHBondContact O-N 2.99Å
741	M	91	Very high	90	Very high	10 Å²	10	40.7 Å²	40.7	5%	0.049	23%	0.227	C	C	.	.	H	α-helix	trans	-58	-48.4	178.8	179	-81.9	-74.1	0	0	111.1	Y721 E724 M725 L728 A737 L738 T743 V744 A745 M858	Y721-M741 HydrophobicContact CD2-SD 4.09Å; E724-M741 HydrophobicContact CB-CE 4.06Å; M725-M741 HydrophobicContact CG-CE 3.87Å; M725-M741 HydrophobicContact SD-CE 3.93Å; L728-M741 HydrophobicContact CD1-CB 4.37Å; L728-M741 HydrophobicContact CD1-CE 3.85Å; L728-M741 HydrophobicContact CD1-CG 4.48Å; A737-M741 WeakPolarHBondContact O-CB 3.34Å; A737-M741 PolarHBondContact O-N 2.89Å; L738-M741 HydrophobicContact CD1-CE 4.04Å; L738-M741 PolarHBondContact O-N 3.18Å; M741-T743 PolarHBondContact O-N 2.87Å; M741-V744 PolarHBondContact O-N 3.42Å; M741-A745 WeakPolarHBondContact O-CB 3.48Å; M741-A745 PolarHBondContact O-N 2.9Å; M741-M858 HydrophobicContact CG-CG 4.5Å
742	K	92.4	Very high	90.7	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-52.7	-50.4	172.5	-79.6	177.5	167.9	-165	0	112.3	Y721 M725 L738 L740 Y746 L798 L799 L801	Y721-K742 HydrophobicContact CE2-CG 4.29Å; M725-K742 HydrophobicContact SD-CG 4.28Å; L738-K742 WeakPolarHBondContact O-CB 3.24Å; L738-K742 WeakPolarHBondContact O-CG 3.35Å; L738-K742 PolarHBondContact O-N 3.05Å; L740-K742 PolarHBondContact O-N 3.16Å; K742-Y746 VanDerWaalsContact O-CB 3.31Å; K742-Y746 WeakPolarHBondContact O-CB 3.42Å; K742-Y746 PolarHBondContact O-N 3.36Å; K742-L798 HydrophobicContact CB-CD2 4.46Å; K742-L798 HydrophobicContact CB-CG 4.42Å; K742-L798 HydrophobicContact CD-CG 4.47Å; K742-L798 HydrophobicContact CG-CG 4.42Å; K742-L798 PolarHBondContact NZ-O 3.49Å; K742-L799 HydrophobicContact CB-CD2 3.87Å; K742-L799 HydrophobicContact CD-CD2 4.47Å; K742-L801 PolarHBondContact NZ-O 3.43Å
743	T	93.1	Very high	91.7	Very high	42 Å²	42	32.6 Å²	32.6	26%	0.258	18%	0.179	S	C	.	.	H	α-helix	trans	-62.5	-48.9	-177.9	-57.9	0	0	0	0	111.5	Q739 L740 M741 Y746 L747 L799	Q739-T743 WeakPolarHBondContact O-CB 3.37Å; Q739-T743 PolarHBondContact O-N 2.68Å; Q739-T743 PolarHBondContact O-OG1 2.94Å; L740-T743 PolarHBondContact O-N 3.33Å; L740-T743 VanDerWaalsContact O-N 3.16Å; M741-T743 PolarHBondContact O-N 2.87Å; T743-Y746 PolarHBondContact O-N 3.36Å; T743-L747 HydrophobicContact CG2-CD1 4.2Å; T743-L747 WeakPolarHBondContact O-CG 3.35Å; T743-L747 PolarHBondContact O-N 3.37Å; T743-L747 VanDerWaalsContact O-N 3.07Å; T743-L799 WeakPolarHBondContact OG1-CD2 3.38Å
744	V	94.1	Very high	92.5	Very high	13 Å²	13	26 Å²	26	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-75.5	-41.3	-171.9	178.7	0	0	0	0	111.4	L740 M741 Y746 L747 G748 A854 F857 M858	L740-V744 HydrophobicContact CD1-CG2 3.69Å; L740-V744 HydrophobicContact CG-CG2 4.24Å; L740-V744 WeakPolarHBondContact O-CB 3.37Å; L740-V744 VanDerWaalsContact O-CG2 3.29Å; L740-V744 WeakPolarHBondContact O-CG2 3.27Å; L740-V744 PolarHBondContact O-N 2.99Å; M741-V744 PolarHBondContact O-N 3.42Å; V744-Y746 VanDerWaalsContact C-N 3.26Å; V744-Y746 PolarHBondContact O-N 2.89Å; V744-L747 PolarHBondContact O-N 3.49Å; V744-G748 PolarHBondContact O-N 3.26Å; V744-A854 HydrophobicContact CG1-CB 3.83Å; V744-A854 WeakPolarHBondContact CG1-O 3.48Å; V744-F857 HydrophobicContact CG1-CB 3.83Å; V744-F857 HydrophobicContact CG2-CB 4.27Å; V744-M858 HydrophobicContact CG1-CB 3.95Å
745	A	95.6	Very high	93.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.4	-38.1	172.8	0	0	0	0	0	111.5	C717 M741 T749 M858	C717-A745 HydrophobicContact CB-CB 4.25Å; C717-A745 WeakPolarHBondContact CB-O 3.11Å; M741-A745 WeakPolarHBondContact O-CB 3.48Å; M741-A745 PolarHBondContact O-N 2.9Å; A745-T749 VanDerWaalsContact O-CB 3.27Å; A745-T749 WeakPolarHBondContact O-CB 3.29Å; A745-T749 PolarHBondContact O-N 2.76Å; A745-T749 PolarHBondContact O-OG1 3.06Å; A745-M858 HydrophobicContact CB-SD 3.78Å
746	Y	97.4	Very high	93.9	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-65.6	-46.1	175.8	-165.3	-84.9	0	0	0	112.6	K742 T743 V744 T749 Y750 S791 C794 L795 L798 L812 L813 G816 A817	K742-Y746 VanDerWaalsContact O-CB 3.31Å; K742-Y746 WeakPolarHBondContact O-CB 3.42Å; K742-Y746 PolarHBondContact O-N 3.36Å; T743-Y746 PolarHBondContact O-N 3.36Å; V744-Y746 VanDerWaalsContact C-N 3.26Å; V744-Y746 PolarHBondContact O-N 2.89Å; Y746-T749 PolarHBondContact O-N 2.95Å; Y746-Y750 WeakPolarHBondContact O-CB 3.35Å; Y746-Y750 PolarHBondContact O-N 3.36Å; Y746-S791 PolarHBondContact OH-O 2.86Å; Y746-S791 PolarHBondContact OH-OG 3.26Å; Y746-C794 HydrophobicContact CE2-CB 4.5Å; Y746-C794 WeakPolarHBondContact OH-CB 3.44Å; Y746-L795 HydrophobicContact CD1-CB 3.9Å; Y746-L795 HydrophobicContact CD1-CD1 3.82Å; Y746-L795 HydrophobicContact CD1-CD2 4.36Å; Y746-L795 HydrophobicContact CD1-CG 4.23Å; Y746-L795 HydrophobicContact CD2-CD1 4.48Å; Y746-L795 HydrophobicContact CE1-CB 3.62Å; Y746-L795 HydrophobicContact CE1-CD1 4.43Å; Y746-L795 HydrophobicContact CE1-CG 4.44Å; Y746-L795 HydrophobicContact CG-CB 4.48Å; Y746-L795 HydrophobicContact CG-CD1 3.84Å; Y746-L795 PolarHBondContact OH-N 3.1Å; Y746-L798 HydrophobicContact CD2-CD2 3.61Å; Y746-L798 HydrophobicContact CE2-CD2 4.42Å; Y746-L798 HydrophobicContact CG-CD2 4.32Å; Y746-L812 WeakPolarHBondContact CE2-O 3.33Å; Y746-L813 HydrophobicContact CD2-CD1 3.96Å; Y746-L813 HydrophobicContact CG-CD1 4.39Å; Y746-G816 WeakPolarHBondContact OH-CA 3.42Å; Y746-G816 PolarHBondContact OH-O 2.87Å; Y746-G816 VanDerWaalsContact OH-O 3.07Å; Y746-A817 HydrophobicContact CD1-CB 3.94Å; Y746-A817 HydrophobicContact CD2-CB 3.79Å; Y746-A817 HydrophobicContact CE1-CB 3.89Å; Y746-A817 HydrophobicContact CE2-CB 3.76Å; Y746-A817 HydrophobicContact CG-CB 3.9Å; Y746-A817 WeakPolarHBondContact O-CB 3.49Å
747	L	96.5	Very high	94.5	Very high	75 Å²	75	20.9 Å²	20.9	39%	0.393	12%	0.115	S	C	.	.	H	α-helix	trans	-63.6	-44.9	176.3	-68.6	172.8	0	0	0	111.8	T743 V744 T749 Y750 I751	T743-L747 HydrophobicContact CG2-CD1 4.2Å; T743-L747 WeakPolarHBondContact O-CG 3.35Å; T743-L747 PolarHBondContact O-N 3.37Å; T743-L747 VanDerWaalsContact O-N 3.07Å; V744-L747 PolarHBondContact O-N 3.49Å; L747-T749 PolarHBondContact O-N 3.13Å; L747-Y750 PolarHBondContact O-N 3.49Å; L747-I751 WeakPolarHBondContact O-CB 3.29Å; L747-I751 WeakPolarHBondContact O-CD1 3.33Å; L747-I751 WeakPolarHBondContact O-CG1 3.44Å; L747-I751 PolarHBondContact O-N 2.89Å
748	G	96.9	Very high	95	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.9	-45	175.8	0	0	0	0	0	112.5	V744 Y750 G752	V744-G748 PolarHBondContact O-N 3.26Å; G748-Y750 PolarHBondContact O-N 3.2Å; G748-G752 WeakPolarHBondContact O-CA 3.38Å; G748-G752 PolarHBondContact O-N 3.15Å
749	T	98.1	Very high	95.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.4	-41.1	176	-54.6	0	0	0	0	111.8	V714 C717 I718 A745 Y746 L747 G753 L813 A817	V714-T749 HydrophobicContact CG1-CG2 4.31Å; V714-T749 HydrophobicContact CG2-CG2 4.34Å; V714-T749 WeakPolarHBondContact CG2-O 3.5Å; C717-T749 WeakPolarHBondContact CB-OG1 3.27Å; I718-T749 HydrophobicContact CD1-CG2 4.35Å; I718-T749 HydrophobicContact CG1-CG2 4.36Å; A745-T749 VanDerWaalsContact O-CB 3.27Å; A745-T749 WeakPolarHBondContact O-CB 3.29Å; A745-T749 PolarHBondContact O-N 2.76Å; A745-T749 PolarHBondContact O-OG1 3.06Å; Y746-T749 PolarHBondContact O-N 2.95Å; L747-T749 PolarHBondContact O-N 3.13Å; T749-G753 PolarHBondContact O-N 3.32Å; T749-L813 HydrophobicContact CG2-CD1 4.33Å; T749-A817 HydrophobicContact CG2-CB 3.86Å
750	Y	97.7	Very high	95.8	Very high	39 Å²	39	20.7 Å²	20.7	15%	0.153	11%	0.11	C	C	.	.	H	α-helix	trans	-69.6	-47.4	-179.5	-177.8	-109.5	0	0	0	112	Y746 L747 G748 G753 I754 S791	Y746-Y750 WeakPolarHBondContact O-CB 3.35Å; Y746-Y750 PolarHBondContact O-N 3.36Å; L747-Y750 PolarHBondContact O-N 3.49Å; G748-Y750 PolarHBondContact O-N 3.2Å; Y750-G753 PolarHBondContact O-N 3.38Å; Y750-I754 HydrophobicContact CD1-CD1 3.98Å; Y750-I754 HydrophobicContact CE1-CD1 3.53Å; Y750-I754 HydrophobicContact CE2-CD1 4.28Å; Y750-I754 WeakPolarHBondContact O-CG1 3.38Å; Y750-I754 PolarHBondContact O-N 2.93Å; Y750-S791 WeakPolarHBondContact CD2-OG 3.42Å; Y750-S791 WeakPolarHBondContact CE2-OG 3.22Å
751	I	97.1	Very high	96.1	Very high	38 Å²	38	20.3 Å²	20.3	20%	0.195	11%	0.107	C	C	.	.	H	α-helix	trans	-66.1	-42.4	178.2	-61.2	165.9	0	0	0	110.2	L747 I754 T755 Y847 W850 A851	L747-I751 WeakPolarHBondContact O-CB 3.29Å; L747-I751 WeakPolarHBondContact O-CD1 3.33Å; L747-I751 WeakPolarHBondContact O-CG1 3.44Å; L747-I751 PolarHBondContact O-N 2.89Å; I751-I754 PolarHBondContact O-N 3.31Å; I751-T755 WeakPolarHBondContact O-CB 3.44Å; I751-T755 PolarHBondContact O-N 3.37Å; I751-T755 PolarHBondContact O-OG1 3.21Å; I751-Y847 HydrophobicContact CG2-CG 4.35Å; I751-Y847 WeakPolarHBondContact CG2-O 3.47Å; I751-W850 HydrophobicContact CD1-CB 4.42Å; I751-A851 HydrophobicContact CB-CB 4.33Å; I751-A851 HydrophobicContact CG2-CB 3.98Å
752	G	97	Very high	96.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-42.6	174.6	0	0	0	0	0	112.6	G710 G748 T755 L756	G710-G752 CarbonylContact C-O 3.5Å; G710-G752 VanDerWaalsContact CA-O 3.31Å; G710-G752 WeakPolarHBondContact CA-O 3.43Å; G710-G752 CarbonylContact O-C 3.58Å; G710-G752 WeakPolarHBondContact O-CA 3.46Å; G748-G752 WeakPolarHBondContact O-CA 3.38Å; G748-G752 PolarHBondContact O-N 3.15Å; G752-T755 PolarHBondContact O-N 2.69Å; G752-T755 VanDerWaalsContact O-N 3.17Å; G752-L756 WeakPolarHBondContact O-CB 2.93Å; G752-L756 PolarHBondContact O-N 3.37Å
753	G	97.4	Very high	96.3	Very high	3 Å²	3	22.1 Å²	22.1	3%	0.031	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-44.9	175.9	0	0	0	0	0	113.2	T749 Y750 T755 T757	T749-G753 PolarHBondContact O-N 3.32Å; Y750-G753 PolarHBondContact O-N 3.38Å; G753-T755 VanDerWaalsContact C-N 3.33Å; G753-T757 PolarHBondContact O-N 3.24Å; G753-T757 PolarHBondContact O-OG1 2.94Å
754	I	97	Very high	96.3	Very high	18 Å²	18	20.4 Å²	20.4	9%	0.092	11%	0.105	C	C	.	.	H	α-helix	trans	-60.8	-44.4	172.3	-68.4	169.4	0	0	0	110.7	Y750 I751 G758 G821 L844 Y847	Y750-I754 HydrophobicContact CD1-CD1 3.98Å; Y750-I754 HydrophobicContact CE1-CD1 3.53Å; Y750-I754 HydrophobicContact CE2-CD1 4.28Å; Y750-I754 WeakPolarHBondContact O-CG1 3.38Å; Y750-I754 PolarHBondContact O-N 2.93Å; I751-I754 PolarHBondContact O-N 3.31Å; I754-G758 WeakPolarHBondContact O-CA 3.48Å; I754-G758 PolarHBondContact O-N 3.19Å; I754-G821 WeakPolarHBondContact CA-O 3.38Å; I754-G821 WeakPolarHBondContact CG1-O 3.47Å; I754-G821 PolarHBondContact N-O 3.26Å; I754-L844 HydrophobicContact CG2-CD2 4.47Å; I754-Y847 HydrophobicContact CG2-CD2 3.8Å; I754-Y847 HydrophobicContact CG2-CE2 3.85Å
755	T	96.9	Very high	96.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.8	-44.6	-177	-57	0	0	0	0	111.4	I751 G752 G753 S759 Y847	I751-T755 WeakPolarHBondContact O-CB 3.44Å; I751-T755 PolarHBondContact O-N 3.37Å; I751-T755 PolarHBondContact O-OG1 3.21Å; G752-T755 PolarHBondContact O-N 2.69Å; G752-T755 VanDerWaalsContact O-N 3.17Å; G753-T755 VanDerWaalsContact C-N 3.33Å; T755-S759 WeakPolarHBondContact O-CB 3.48Å; T755-S759 PolarHBondContact O-N 3.19Å; T755-S759 VanDerWaalsContact O-N 3.11Å; T755-S759 PolarHBondContact O-OG 3.33Å; T755-Y847 VanDerWaalsContact OG1-CB 3.29Å; T755-Y847 WeakPolarHBondContact OG1-CB 3.49Å
756	L	97.3	Very high	95.9	Very high	49 Å²	49	20.9 Å²	20.9	26%	0.257	11%	0.107	S	C	.	.	H	α-helix	trans	-56.4	-62.2	175.2	169	53.9	0	0	0	111.4	S707 A711 G752 L760	S707-L756 WeakPolarHBondContact CB-O 3.43Å; A711-L756 HydrophobicContact CB-CD1 4.19Å; A711-L756 HydrophobicContact CB-CD2 4.23Å; G752-L756 WeakPolarHBondContact O-CB 2.93Å; G752-L756 PolarHBondContact O-N 3.37Å; L756-L760 HydrophobicContact CD1-CD1 3.73Å; L756-L760 HydrophobicContact CD1-CG 4.38Å; L756-L760 HydrophobicContact CG-CD1 4.48Å; L756-L760 WeakPolarHBondContact O-CG 3.42Å; L756-L760 PolarHBondContact O-N 3.1Å; L756-L760 VanDerWaalsContact O-N 3.15Å
757	T	97.5	Very high	95.5	Very high	29 Å²	29	25.2 Å²	25.2	18%	0.178	13%	0.127	C	C	.	.	H	α-helix	trans	-74.1	-39.3	-171.3	60.1	0	0	0	0	112.6	G753 S759 L760 I761 G822 G825 L826	G753-T757 PolarHBondContact O-N 3.24Å; G753-T757 PolarHBondContact O-OG1 2.94Å; T757-S759 VanDerWaalsContact C-N 3.34Å; T757-S759 PolarHBondContact O-N 3.2Å; T757-L760 PolarHBondContact O-N 3.01Å; T757-I761 WeakPolarHBondContact O-CG1 3.33Å; T757-I761 PolarHBondContact O-N 2.89Å; T757-G822 VanDerWaalsContact CB-O 3.24Å; T757-G822 WeakPolarHBondContact CB-O 3.48Å; T757-G822 WeakPolarHBondContact CG2-O 3.23Å; T757-G822 PolarHBondContact OG1-O 3.45Å; T757-G825 WeakPolarHBondContact OG1-CA 3.23Å; T757-L826 PolarHBondContact OG1-N 3.48Å
758	G	95.9	Very high	95	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-45.4	175.7	0	0	0	0	0	111.6	I754 L760 I761 A762 G825 T829	I754-G758 WeakPolarHBondContact O-CA 3.48Å; I754-G758 PolarHBondContact O-N 3.19Å; G758-L760 PolarHBondContact O-N 3.19Å; G758-I761 PolarHBondContact O-N 2.81Å; G758-A762 PolarHBondContact O-N 3.33Å; G758-G825 WeakPolarHBondContact CA-O 3.36Å; G758-T829 VanDerWaalsContact CA-OG1 3.3Å; G758-T829 WeakPolarHBondContact CA-OG1 3.43Å; G758-T829 WeakPolarHBondContact O-CG2 3.24Å
759	S	96.2	Very high	94.8	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-71.2	-30.3	-178.7	-46.4	0	0	0	0	112.7	A703 T755 T757 A762 F763	A703-S759 WeakPolarHBondContact O-CB 3.38Å; T755-S759 WeakPolarHBondContact O-CB 3.48Å; T755-S759 PolarHBondContact O-N 3.19Å; T755-S759 VanDerWaalsContact O-N 3.11Å; T755-S759 PolarHBondContact O-OG 3.33Å; T757-S759 VanDerWaalsContact C-N 3.34Å; T757-S759 PolarHBondContact O-N 3.2Å; S759-A762 PolarHBondContact O-N 2.91Å; S759-F763 WeakPolarHBondContact O-CB 3.39Å; S759-F763 PolarHBondContact O-N 3.48Å
760	L	96.9	Very high	94.5	Very high	74 Å²	74	33.6 Å²	33.6	39%	0.387	19%	0.185	S	C	.	.	H	α-helix	trans	-66.7	-40	170.4	-72.5	172.4	0	0	0	112.7	L704 L756 T757 G758 G764	L704-L760 HydrophobicContact CD1-CD2 4.06Å; L756-L760 HydrophobicContact CD1-CD1 3.73Å; L756-L760 HydrophobicContact CD1-CG 4.38Å; L756-L760 HydrophobicContact CG-CD1 4.48Å; L756-L760 WeakPolarHBondContact O-CG 3.42Å; L756-L760 PolarHBondContact O-N 3.1Å; L756-L760 VanDerWaalsContact O-N 3.15Å; T757-L760 PolarHBondContact O-N 3.01Å; G758-L760 PolarHBondContact O-N 3.19Å; L760-G764 PolarHBondContact O-N 3.5Å
761	I	95.7	Very high	94.1	Very high	30 Å²	30	40.2 Å²	40.2	15%	0.154	21%	0.214	C	C	.	.	H	α-helix	trans	-67.8	-39.1	173.9	-61.8	-60.5	0	0	0	110.9	T757 G758 G764 K765 L770 L826 T829 A830	T757-I761 WeakPolarHBondContact O-CG1 3.33Å; T757-I761 PolarHBondContact O-N 2.89Å; G758-I761 PolarHBondContact O-N 2.81Å; I761-G764 PolarHBondContact O-N 3.06Å; I761-K765 PolarHBondContact O-N 3.09Å; I761-L770 HydrophobicContact CB-CD1 4.5Å; I761-L770 HydrophobicContact CD1-CD1 3.85Å; I761-L770 HydrophobicContact CG2-CD1 4.05Å; I761-L826 HydrophobicContact CD1-CG 4.2Å; I761-L826 HydrophobicContact CG1-CG 4.19Å; I761-T829 HydrophobicContact CB-CG2 4.01Å; I761-T829 HydrophobicContact CG2-CG2 3.89Å; I761-A830 HydrophobicContact CG2-CB 4.44Å
762	A	93.6	Very high	93.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-49.4	174.2	0	0	0	0	0	111.6	A703 G758 S759 G764 K765 L766 T829 M837	A703-A762 HydrophobicContact CB-CB 4.28Å; G758-A762 PolarHBondContact O-N 3.33Å; S759-A762 PolarHBondContact O-N 2.91Å; A762-G764 PolarHBondContact O-N 3.17Å; A762-K765 PolarHBondContact O-N 2.87Å; A762-L766 WeakPolarHBondContact O-CB 3.39Å; A762-L766 WeakPolarHBondContact O-CD1 3.44Å; A762-L766 WeakPolarHBondContact O-CG 3.21Å; A762-L766 PolarHBondContact O-N 3.21Å; A762-T829 HydrophobicContact CB-CG2 4.29Å; A762-M837 HydrophobicContact CB-CG 4.43Å; A762-M837 HydrophobicContact CB-SD 3.86Å
763	F	94	Very high	92.8	Very high	50 Å²	50	46 Å²	46	22%	0.219	25%	0.254	C	S	.	.	H	α-helix	trans	-51.6	-52.3	171.2	164	-98.2	0	0	0	111.3	Q700 A703 L704 S759 K765 L766 Q767 I769	Q700-F763 HydrophobicContact CB-CD2 3.85Å; Q700-F763 HydrophobicContact CB-CE2 4.4Å; Q700-F763 HydrophobicContact CG-CD2 4.4Å; Q700-F763 HydrophobicContact CG-CE2 4.47Å; Q700-F763 WeakPolarHBondContact O-CD2 3.42Å; A703-F763 HydrophobicContact CB-CB 4.3Å; L704-F763 HydrophobicContact CB-CD2 3.95Å; L704-F763 HydrophobicContact CB-CE2 4.48Å; L704-F763 HydrophobicContact CB-CG 4.4Å; L704-F763 HydrophobicContact CD2-CE2 4.27Å; S759-F763 WeakPolarHBondContact O-CB 3.39Å; S759-F763 PolarHBondContact O-N 3.48Å; F763-K765 VanDerWaalsContact C-N 3.35Å; F763-K765 PolarHBondContact O-N 2.82Å; F763-L766 PolarHBondContact O-N 2.98Å; F763-Q767 HydrophobicContact CE2-CB 4.42Å; F763-Q767 HydrophobicContact CZ-CB 4.47Å; F763-Q767 HydrophobicContact CZ-CG 4.35Å; F763-Q767 VanDerWaalsContact O-CB 3.27Å; F763-Q767 WeakPolarHBondContact O-CB 3.49Å; F763-Q767 PolarHBondContact O-N 3.06Å; F763-I769 HydrophobicContact CE1-CD1 4Å; F763-I769 HydrophobicContact CZ-CD1 4.39Å
764	G	94.1	Very high	92.3	Very high	5 Å²	5	48.8 Å²	48.8	5%	0.052	27%	0.272	C	S	.	.	H	α-helix	trans	-60.3	-39.2	-178.6	0	0	0	0	0	113.6	L760 I761 A762 G768 I769 L770	L760-G764 PolarHBondContact O-N 3.5Å; I761-G764 PolarHBondContact O-N 3.06Å; A762-G764 PolarHBondContact O-N 3.17Å; G764-G768 PolarHBondContact O-N 3.28Å; G764-I769 PolarHBondContact O-N 3.37Å; G764-L770 PolarHBondContact O-N 3.15Å
765	K	91.8	Very high	91.9	Very high	15 Å²	15	53 Å²	53	7%	0.065	29%	0.294	C	S	.	.	H	α-helix	trans	-72.9	-36.3	176.2	-75.2	-166.2	178.9	-158.3	0	113.2	I761 A762 F763 G768 L770 T773 A830 I832 M837	I761-K765 PolarHBondContact O-N 3.09Å; A762-K765 PolarHBondContact O-N 2.87Å; F763-K765 VanDerWaalsContact C-N 3.35Å; F763-K765 PolarHBondContact O-N 2.82Å; K765-G768 PolarHBondContact O-N 3.34Å; K765-L770 HydrophobicContact CG-CB 3.76Å; K765-L770 HydrophobicContact CG-CD1 4.34Å; K765-T773 PolarHBondContact NZ-O 3.3Å; K765-A830 PolarHBondContact NZ-O 3.48Å; K765-I832 PolarHBondContact NZ-O 3.27Å; K765-M837 HydrophobicContact CD-CE 3.66Å
766	L	88.8	Confident	91.4	Very high	8 Å²	8	57.4 Å²	57.4	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-71.5	-42.7	178.2	-69.4	163.5	0	0	0	111.5	P699 Q700 A703 A762 F763 G768 M837 I841 R974	P699-L766 HydrophobicContact CB-CD1 4.43Å; Q700-L766 HydrophobicContact CB-CB 3.76Å; Q700-L766 HydrophobicContact CB-CD1 4.35Å; A703-L766 HydrophobicContact CB-CD1 4.42Å; A762-L766 WeakPolarHBondContact O-CB 3.39Å; A762-L766 WeakPolarHBondContact O-CD1 3.44Å; A762-L766 WeakPolarHBondContact O-CG 3.21Å; A762-L766 PolarHBondContact O-N 3.21Å; F763-L766 PolarHBondContact O-N 2.98Å; L766-G768 PolarHBondContact O-N 2.85Å; L766-M837 HydrophobicContact CD1-CG 4.32Å; L766-M837 HydrophobicContact CD2-CB 4.34Å; L766-M837 HydrophobicContact CD2-CG 4.03Å; L766-M837 HydrophobicContact CG-CG 3.97Å; L766-I841 HydrophobicContact CD1-CD1 3.72Å; L766-I841 HydrophobicContact CD1-CG1 4.28Å; L766-R974 HydrophobicContact CD2-CB 4.26Å; L766-R974 PolarHBondContact O-NH1 3.48Å
767	Q	88.9	Confident	90.9	Very high	96 Å²	96	58.5 Å²	58.5	45%	0.449	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-12	176.4	-169.6	61.1	19.3	0	0	113	F763 I769	F763-Q767 HydrophobicContact CE2-CB 4.42Å; F763-Q767 HydrophobicContact CZ-CB 4.47Å; F763-Q767 HydrophobicContact CZ-CG 4.35Å; F763-Q767 VanDerWaalsContact O-CB 3.27Å; F763-Q767 WeakPolarHBondContact O-CB 3.49Å; F763-Q767 PolarHBondContact O-N 3.06Å; Q767-I769 VanDerWaalsContact C-N 3.34Å; Q767-I769 HydrophobicContact CB-CD1 4.18Å; Q767-I769 HydrophobicContact CB-CG1 4.21Å; Q767-I769 HydrophobicContact CG-CD1 3.84Å; Q767-I769 HydrophobicContact CG-CG1 3.97Å
768	G	85.8	Confident	90.5	Very high	59 Å²	59	62.6 Å²	62.6	61%	0.608	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	8.3	179.6	0	0	0	0	0	115.1	G764 K765 L766 L770	G764-G768 PolarHBondContact O-N 3.28Å; K765-G768 PolarHBondContact O-N 3.34Å; L766-G768 PolarHBondContact O-N 2.85Å; G768-L770 VanDerWaalsContact C-N 3.32Å
769	I	92.7	Very high	90	Very high	121 Å²	121	69.5 Å²	69.5	62%	0.621	38%	0.384	S	S	*	.	S	Bend	trans	-67.5	-37.9	172.7	-57.5	169.7	0	0	0	109.8	F763 G764 Q767	F763-I769 HydrophobicContact CE1-CD1 4Å; F763-I769 HydrophobicContact CZ-CD1 4.39Å; G764-I769 PolarHBondContact O-N 3.37Å; Q767-I769 VanDerWaalsContact C-N 3.34Å; Q767-I769 HydrophobicContact CB-CD1 4.18Å; Q767-I769 HydrophobicContact CB-CG1 4.21Å; Q767-I769 HydrophobicContact CG-CD1 3.84Å; Q767-I769 HydrophobicContact CG-CG1 3.97Å
770	L	92.6	Very high	89.6	Confident	71 Å²	71	71.9 Å²	71.9	37%	0.372	39%	0.393	S	S	.	.	S	Bend	trans	-104	148	172.3	-64	172.5	0	0	0	110.1	I761 G764 K765 G768 S772	I761-L770 HydrophobicContact CB-CD1 4.5Å; I761-L770 HydrophobicContact CD1-CD1 3.85Å; I761-L770 HydrophobicContact CG2-CD1 4.05Å; G764-L770 PolarHBondContact O-N 3.15Å; K765-L770 HydrophobicContact CG-CB 3.76Å; K765-L770 HydrophobicContact CG-CD1 4.34Å; G768-L770 VanDerWaalsContact C-N 3.32Å; L770-S772 PolarHBondContact O-N 3.27Å
771	K	88.6	Confident	89.1	Confident	178 Å²	178	72.6 Å²	72.6	77%	0.774	40%	0.397	S	S	*	.			trans	-61.3	133.5	174.4	-66	-178.5	179.3	178	0	110.3	T773	K771-T773 PolarHBondContact O-N 3.1Å
772	S	83.4	Confident	88.8	Confident	72 Å²	72	75.1 Å²	75.1	50%	0.503	41%	0.414	S	S	.	.	S	Bend	trans	-70.1	-13.5	178.6	55.3	0	0	0	0	113.9	L770 G834	L770-S772 PolarHBondContact O-N 3.27Å; S772-G834 PolarHBondContact O-N 3.45Å
773	T	84	Confident	88.7	Confident	86 Å²	86	78.2 Å²	78.2	53%	0.528	43%	0.43	S	S	.	.	S	Bend	trans	-63.6	150.6	172.5	49.3	0	0	0	0	111.9	K765 K771	K765-T773 PolarHBondContact NZ-O 3.3Å; K771-T773 PolarHBondContact O-N 3.1Å
774	P	86.7	Confident	88.6	Confident	62 Å²	62	76.7 Å²	76.7	40%	0.403	42%	0.424	S	S	.	.			trans	-67.9	132.1	170.6	29.3	-34.6	0	0	0	110.8	L776 A831	P774-L776 HydrophobicContact CB-CD2 3.95Å; P774-L776 HydrophobicContact CB-CG 4.37Å; P774-L776 PolarHBondContact O-N 3.49Å; P774-A831 WeakPolarHBondContact CB-O 3.48Å
775	L	89.3	Confident	88.5	Confident	106 Å²	106	79.3 Å²	79.3	56%	0.555	45%	0.445	S	S	*	.			trans	-91.1	96.4	174.8	-178.9	64	0	0	0	109.2	L777 A830	L775-L777 PolarHBondContact O-N 3.1Å; L775-A830 HydrophobicContact CB-CB 4.28Å; L775-A830 WeakPolarHBondContact CB-O 3.3Å; L775-A830 HydrophobicContact CD2-CB 4.29Å; L775-A830 PolarHBondContact N-O 2.91Å
776	L	85.9	Confident	88.5	Confident	94 Å²	94	81.7 Å²	81.7	49%	0.492	46%	0.464	S	S	.	.			trans	-90	93.3	-175.6	-55.6	-172.9	0	0	0	111.1	P774 A831	P774-L776 HydrophobicContact CB-CD2 3.95Å; P774-L776 HydrophobicContact CB-CG 4.37Å; P774-L776 PolarHBondContact O-N 3.49Å; L776-A831 HydrophobicContact CD2-CB 4.48Å
777	L	87.7	Confident	88.7	Confident	71 Å²	71	82.1 Å²	82.1	37%	0.372	47%	0.466	S	S	.	.			trans	-62.6	142.6	172.1	-72.4	160.8	0	0	0	111.4	L775 M779 R780 T827	L775-L777 PolarHBondContact O-N 3.1Å; L777-M779 PolarHBondContact O-N 3.01Å; L777-R780 HydrophobicContact CB-CB 4.11Å; L777-R780 WeakPolarHBondContact O-CB 3.42Å; L777-R780 PolarHBondContact O-N 3.33Å; L777-T827 HydrophobicContact CD1-CG2 4.23Å
778	P	88.1	Confident	88.8	Confident	116 Å²	116	81.7 Å²	81.7	75%	0.753	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	136.9	166.5	-23.8	34.3	0	0	0	110.6	R780	P778-R780 PolarHBondContact O-N 3.39Å
779	M	86.2	Confident	89.2	Confident	144 Å²	144	82.1 Å²	82.1	71%	0.709	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	26	179.7	-59.1	176.5	64.8	0	0	115.3	L777 N781 T782 L783	L777-M779 PolarHBondContact O-N 3.01Å; M779-N781 PolarHBondContact O-N 3.33Å; M779-T782 HydrophobicContact CE-CG2 4.16Å; M779-T782 WeakPolarHBondContact O-CA 3.16Å; M779-T782 WeakPolarHBondContact O-CB 3.29Å; M779-T782 PolarHBondContact O-N 3.09Å; M779-L783 PolarHBondContact O-N 3.26Å
780	R	86.8	Confident	89.2	Confident	52 Å²	52	81.3 Å²	81.3	20%	0.196	46%	0.464	C	S	.	.	H	α-helix	trans	-47.9	-37.8	-175.8	75.7	-176.6	-169.6	-103.9	6	114.8	L777 P778 L783 N784 L895 G896	L777-R780 HydrophobicContact CB-CB 4.11Å; L777-R780 WeakPolarHBondContact O-CB 3.42Å; L777-R780 PolarHBondContact O-N 3.33Å; P778-R780 PolarHBondContact O-N 3.39Å; R780-L783 PolarHBondContact O-N 2.96Å; R780-N784 WeakPolarHBondContact O-CB 3.45Å; R780-N784 PolarHBondContact O-N 3.5Å; R780-N784 PolarHBondContact O-ND2 2.93Å; R780-L895 PolarHBondContact NE-O 3.21Å; R780-L895 PolarHBondContact NH2-O 3.43Å; R780-G896 PolarHBondContact NH2-O 2.91Å
781	N	86.1	Confident	89.3	Confident	89 Å²	89	78.2 Å²	78.2	48%	0.476	45%	0.449	S	S	.	.	H	α-helix	trans	-69.2	-40.3	-179.6	-66.8	0.8	0	0	0	111.3	M779 A785	M779-N781 PolarHBondContact O-N 3.33Å; N781-A785 VanDerWaalsContact O-CB 3.23Å; N781-A785 WeakPolarHBondContact O-CB 3.45Å; N781-A785 PolarHBondContact O-N 3.45Å
782	T	90.7	Very high	89.6	Confident	83 Å²	83	71.4 Å²	71.4	51%	0.509	43%	0.429	S	S	.	.	H	α-helix	trans	-65	-43.1	173.9	-45.6	0	0	0	0	110.8	M779 A785 S786	M779-T782 HydrophobicContact CE-CG2 4.16Å; M779-T782 WeakPolarHBondContact O-CA 3.16Å; M779-T782 WeakPolarHBondContact O-CB 3.29Å; M779-T782 PolarHBondContact O-N 3.09Å; T782-A785 PolarHBondContact O-N 3.24Å; T782-S786 WeakPolarHBondContact O-CB 3.34Å; T782-S786 PolarHBondContact O-N 3.05Å; T782-S786 PolarHBondContact O-OG 2.87Å
783	L	91.1	Very high	90.2	Very high	65 Å²	65	70.2 Å²	70.2	34%	0.34	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-50.1	177.3	-177.1	148.8	0	0	0	111.4	M779 R780 A785 S786 L787 T827	M779-L783 PolarHBondContact O-N 3.26Å; R780-L783 PolarHBondContact O-N 2.96Å; L783-A785 PolarHBondContact O-N 3.45Å; L783-S786 WeakPolarHBondContact CA-OG 3.4Å; L783-S786 PolarHBondContact O-N 2.74Å; L783-S786 PolarHBondContact O-OG 3.41Å; L783-L787 HydrophobicContact CD2-CD1 3.66Å; L783-L787 HydrophobicContact CD2-CG 4.43Å; L783-L787 WeakPolarHBondContact O-CG 3.46Å; L783-L787 PolarHBondContact O-N 3.03Å; L783-T827 HydrophobicContact CD2-CG2 3.91Å
784	N	91.1	Very high	90.7	Very high	17 Å²	17	67.2 Å²	67.2	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-64.6	-39.8	178.9	-66.7	-14.3	0	0	0	111.6	R780 L787 V788 T827 L828	R780-N784 WeakPolarHBondContact O-CB 3.45Å; R780-N784 PolarHBondContact O-N 3.5Å; R780-N784 PolarHBondContact O-ND2 2.93Å; N784-L787 PolarHBondContact O-N 2.87Å; N784-V788 WeakPolarHBondContact O-CG2 3.18Å; N784-V788 PolarHBondContact O-N 3.38Å; N784-V788 VanDerWaalsContact O-N 3.14Å; N784-T827 WeakPolarHBondContact OD1-CB 3.5Å; N784-T827 PolarHBondContact OD1-OG1 3.39Å; N784-L828 HydrophobicContact CB-CD2 4.49Å; N784-L828 VanDerWaalsContact ND2-CD2 3.34Å; N784-L828 WeakPolarHBondContact ND2-CD2 3.47Å
785	A	91.4	Very high	91.2	Very high	60 Å²	60	65.9 Å²	65.9	50%	0.496	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-39.3	173.1	0	0	0	0	0	112.3	N781 T782 L783 V788 A789	N781-A785 VanDerWaalsContact O-CB 3.23Å; N781-A785 WeakPolarHBondContact O-CB 3.45Å; N781-A785 PolarHBondContact O-N 3.45Å; T782-A785 PolarHBondContact O-N 3.24Å; L783-A785 PolarHBondContact O-N 3.45Å; A785-V788 PolarHBondContact O-N 3.26Å; A785-A789 WeakPolarHBondContact O-CB 3.4Å; A785-A789 PolarHBondContact O-N 3.23Å
786	S	92.8	Very high	91.4	Very high	65 Å²	65	65.2 Å²	65.2	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-68.3	-33.2	176.3	66.1	0	0	0	0	113.1	T782 L783 A789 L790	T782-S786 WeakPolarHBondContact O-CB 3.34Å; T782-S786 PolarHBondContact O-N 3.05Å; T782-S786 PolarHBondContact O-OG 2.87Å; L783-S786 WeakPolarHBondContact CA-OG 3.4Å; L783-S786 PolarHBondContact O-N 2.74Å; L783-S786 PolarHBondContact O-OG 3.41Å; S786-A789 PolarHBondContact O-N 3.42Å; S786-L790 WeakPolarHBondContact O-CB 3.34Å; S786-L790 PolarHBondContact O-N 3.07Å
787	L	92.6	Very high	91.8	Very high	18 Å²	18	61.9 Å²	61.9	9%	0.094	39%	0.388	C	S	.	.	H	α-helix	trans	-66.6	-43.7	174.1	-72.6	168.7	0	0	0	111.5	L783 N784 L790 S791 I823	L783-L787 HydrophobicContact CD2-CD1 3.66Å; L783-L787 HydrophobicContact CD2-CG 4.43Å; L783-L787 WeakPolarHBondContact O-CG 3.46Å; L783-L787 PolarHBondContact O-N 3.03Å; N784-L787 PolarHBondContact O-N 2.87Å; L787-L790 PolarHBondContact O-N 3.16Å; L787-S791 WeakPolarHBondContact O-CB 3.4Å; L787-S791 PolarHBondContact O-N 3.39Å; L787-I823 HydrophobicContact CD1-CB 4.34Å; L787-I823 HydrophobicContact CD1-CG2 3.66Å; L787-I823 HydrophobicContact CD2-CB 4.4Å; L787-I823 HydrophobicContact CD2-CG2 4.13Å
788	V	91.3	Very high	92.1	Very high	86 Å²	86	58.5 Å²	58.5	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-44	175	174.7	0	0	0	0	111.1	N784 A785 S791 G792	N784-V788 WeakPolarHBondContact O-CG2 3.18Å; N784-V788 PolarHBondContact O-N 3.38Å; N784-V788 VanDerWaalsContact O-N 3.14Å; A785-V788 PolarHBondContact O-N 3.26Å; V788-S791 PolarHBondContact O-N 3.46Å; V788-G792 PolarHBondContact O-N 3.35Å
789	A	94.1	Very high	92.2	Very high	69 Å²	69	55.5 Å²	55.5	57%	0.57	35%	0.348	S	S	*	.	H	α-helix	trans	-65.7	-41	178	0	0	0	0	0	112.5	A785 S786 G792 G793	A785-A789 WeakPolarHBondContact O-CB 3.4Å; A785-A789 PolarHBondContact O-N 3.23Å; S786-A789 PolarHBondContact O-N 3.42Å; A789-G792 PolarHBondContact O-N 3.49Å; A789-G793 PolarHBondContact O-N 2.7Å
790	L	93.2	Very high	92.5	Very high	104 Å²	104	53 Å²	53	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-46.8	174.2	178.4	63.2	0	0	0	111.1	S786 L787 G792 G793 C794	S786-L790 WeakPolarHBondContact O-CB 3.34Å; S786-L790 PolarHBondContact O-N 3.07Å; L787-L790 PolarHBondContact O-N 3.16Å; L790-G792 VanDerWaalsContact C-N 3.34Å; L790-G792 PolarHBondContact O-N 2.94Å; L790-G793 PolarHBondContact O-N 2.83Å; L790-C794 WeakPolarHBondContact O-CB 3.46Å; L790-C794 PolarHBondContact O-N 2.62Å; L790-C794 PolarHBondContact O-SG 3.34Å
791	S	95.1	Very high	92.5	Very high	6 Å²	6	52.7 Å²	52.7	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-38.2	177.3	-169.3	0	0	0	0	111.9	Y746 Y750 L787 V788 C794 L795 G816	Y746-S791 PolarHBondContact OH-O 2.86Å; Y746-S791 PolarHBondContact OH-OG 3.26Å; Y750-S791 WeakPolarHBondContact CD2-OG 3.42Å; Y750-S791 WeakPolarHBondContact CE2-OG 3.22Å; L787-S791 WeakPolarHBondContact O-CB 3.4Å; L787-S791 PolarHBondContact O-N 3.39Å; V788-S791 PolarHBondContact O-N 3.46Å; S791-C794 PolarHBondContact O-N 3.14Å; S791-L795 PolarHBondContact O-N 3.06Å; S791-G816 VanDerWaalsContact CB-O 3.29Å; S791-G816 WeakPolarHBondContact CB-O 3.38Å; S791-G816 PolarHBondContact OG-O 3.38Å
792	G	94.5	Very high	92.2	Very high	35 Å²	35	50.3 Å²	50.3	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-42.6	171.6	0	0	0	0	0	112.8	V788 A789 L790 L795 V796	V788-G792 PolarHBondContact O-N 3.35Å; A789-G792 PolarHBondContact O-N 3.49Å; L790-G792 VanDerWaalsContact C-N 3.34Å; L790-G792 PolarHBondContact O-N 2.94Å; G792-L795 PolarHBondContact O-N 3.28Å; G792-V796 WeakPolarHBondContact O-CG2 3.43Å; G792-V796 PolarHBondContact O-N 2.98Å
793	G	95.4	Very high	91.4	Very high	46 Å²	46	48.6 Å²	48.6	47%	0.474	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-40.5	174.7	0	0	0	0	0	113.1	A789 L790 V796 G797	A789-G793 PolarHBondContact O-N 2.7Å; L790-G793 PolarHBondContact O-N 2.83Å; G793-V796 PolarHBondContact O-N 3.48Å; G793-G797 PolarHBondContact O-N 2.67Å
794	C	95.5	Very high	90.8	Very high	23 Å²	23	53.7 Å²	53.7	16%	0.155	36%	0.355	C	S	.	.	H	α-helix	trans	-68.5	-31.8	175.1	-73.9	0	0	0	0	113	Y746 L790 S791 G797 L798 L812	Y746-C794 HydrophobicContact CE2-CB 4.5Å; Y746-C794 WeakPolarHBondContact OH-CB 3.44Å; L790-C794 WeakPolarHBondContact O-CB 3.46Å; L790-C794 PolarHBondContact O-N 2.62Å; L790-C794 PolarHBondContact O-SG 3.34Å; S791-C794 PolarHBondContact O-N 3.14Å; C794-G797 PolarHBondContact O-N 2.96Å; C794-L798 WeakPolarHBondContact O-CB 3.45Å; C794-L798 PolarHBondContact O-N 3.39Å; C794-L812 HydrophobicContact CB-CD2 4.14Å
795	L	95.3	Very high	90.5	Very high	34 Å²	34	54.7 Å²	54.7	18%	0.178	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-50.4	169.8	175.4	57	0	0	0	110.9	Y746 S791 G792 G797 L798 L799	Y746-L795 HydrophobicContact CD1-CB 3.9Å; Y746-L795 HydrophobicContact CD1-CD1 3.82Å; Y746-L795 HydrophobicContact CD1-CD2 4.36Å; Y746-L795 HydrophobicContact CD1-CG 4.23Å; Y746-L795 HydrophobicContact CD2-CD1 4.48Å; Y746-L795 HydrophobicContact CE1-CB 3.62Å; Y746-L795 HydrophobicContact CE1-CD1 4.43Å; Y746-L795 HydrophobicContact CE1-CG 4.44Å; Y746-L795 HydrophobicContact CG-CB 4.48Å; Y746-L795 HydrophobicContact CG-CD1 3.84Å; Y746-L795 PolarHBondContact OH-N 3.1Å; S791-L795 PolarHBondContact O-N 3.06Å; G792-L795 PolarHBondContact O-N 3.28Å; L795-G797 PolarHBondContact O-N 3.44Å; L795-L798 PolarHBondContact O-N 3.36Å; L795-L798 VanDerWaalsContact O-N 3.08Å; L795-L799 HydrophobicContact CD1-CD1 4.01Å; L795-L799 HydrophobicContact CD1-CD2 4.5Å; L795-L799 HydrophobicContact CD1-CG 4.09Å; L795-L799 HydrophobicContact CG-CD1 4.22Å; L795-L799 WeakPolarHBondContact O-CG 3.4Å; L795-L799 PolarHBondContact O-N 3.04Å
796	V	95.1	Very high	90.3	Very high	92 Å²	92	54 Å²	54	56%	0.558	35%	0.353	S	S	*	.	H	α-helix	trans	-57.7	-40.2	176	173.6	0	0	0	0	110.7	G792 G793 L799 S800	G792-V796 WeakPolarHBondContact O-CG2 3.43Å; G792-V796 PolarHBondContact O-N 2.98Å; G793-V796 PolarHBondContact O-N 3.48Å; V796-L799 PolarHBondContact O-N 3.08Å; V796-S800 VanDerWaalsContact O-CB 3.28Å; V796-S800 WeakPolarHBondContact O-CB 3.21Å; V796-S800 PolarHBondContact O-N 3.37Å; V796-S800 PolarHBondContact O-OG 3.17Å
797	G	93.3	Very high	90.2	Very high	25 Å²	25	57.2 Å²	57.2	26%	0.258	37%	0.365	S	S	.	.	H	α-helix	trans	-58.1	-49.2	171.9	0	0	0	0	0	113.2	G793 C794 L795 L799 S800 L801	G793-G797 PolarHBondContact O-N 2.67Å; C794-G797 PolarHBondContact O-N 2.96Å; L795-G797 PolarHBondContact O-N 3.44Å; G797-L799 VanDerWaalsContact C-N 3.33Å; G797-L799 PolarHBondContact O-N 3.31Å; G797-S800 CarbonylContact O-C 3.46Å; G797-S800 PolarHBondContact O-N 3.05Å; G797-L801 WeakPolarHBondContact O-CG 3.3Å; G797-L801 PolarHBondContact O-N 2.97Å
798	L	93.7	Very high	90.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-38.1	-179.2	178.1	60.8	0	0	0	112.9	Y721 K742 Y746 C794 L795 G809 L812	Y721-L798 HydrophobicContact CE2-CD1 4.08Å; K742-L798 HydrophobicContact CB-CD2 4.46Å; K742-L798 HydrophobicContact CB-CG 4.42Å; K742-L798 HydrophobicContact CD-CG 4.47Å; K742-L798 HydrophobicContact CG-CG 4.42Å; K742-L798 PolarHBondContact NZ-O 3.49Å; Y746-L798 HydrophobicContact CD2-CD2 3.61Å; Y746-L798 HydrophobicContact CE2-CD2 4.42Å; Y746-L798 HydrophobicContact CG-CD2 4.32Å; C794-L798 WeakPolarHBondContact O-CB 3.45Å; C794-L798 PolarHBondContact O-N 3.39Å; L795-L798 PolarHBondContact O-N 3.36Å; L795-L798 VanDerWaalsContact O-N 3.08Å; L798-G809 VanDerWaalsContact CD1-CA 3.44Å; L798-L812 HydrophobicContact CB-CB 4.37Å; L798-L812 HydrophobicContact CB-CD1 4.21Å
799	L	91.7	Very high	90.2	Very high	52 Å²	52	55.9 Å²	55.9	27%	0.272	36%	0.359	S	S	.	.	H	α-helix	trans	-74	-33.1	176.4	-58.8	176.7	0	0	0	112	Q739 K742 T743 L795 V796 G797	Q739-L799 PolarHBondContact NE2-O 2.93Å; Q739-L799 VanDerWaalsContact OE1-CD2 3.24Å; K742-L799 HydrophobicContact CB-CD2 3.87Å; K742-L799 HydrophobicContact CD-CD2 4.47Å; T743-L799 WeakPolarHBondContact OG1-CD2 3.38Å; L795-L799 HydrophobicContact CD1-CD1 4.01Å; L795-L799 HydrophobicContact CD1-CD2 4.5Å; L795-L799 HydrophobicContact CD1-CG 4.09Å; L795-L799 HydrophobicContact CG-CD1 4.22Å; L795-L799 WeakPolarHBondContact O-CG 3.4Å; L795-L799 PolarHBondContact O-N 3.04Å; V796-L799 PolarHBondContact O-N 3.08Å; G797-L799 VanDerWaalsContact C-N 3.33Å; G797-L799 PolarHBondContact O-N 3.31Å
800	S	91.2	Very high	90.2	Very high	93 Å²	93	53.8 Å²	53.8	65%	0.65	34%	0.338	S	S	*	.	H	α-helix	trans	-77.2	-21.6	176.5	-54.4	0	0	0	0	113.9	V796 G797 G802	V796-S800 VanDerWaalsContact O-CB 3.28Å; V796-S800 WeakPolarHBondContact O-CB 3.21Å; V796-S800 PolarHBondContact O-N 3.37Å; V796-S800 PolarHBondContact O-OG 3.17Å; G797-S800 CarbonylContact O-C 3.46Å; G797-S800 PolarHBondContact O-N 3.05Å; S800-G802 PolarHBondContact O-N 2.92Å
801	L	87.1	Confident	90.3	Very high	44 Å²	44	51 Å²	51	23%	0.23	33%	0.334	C	S	.	.	S	Bend	trans	-64.3	122.6	173.5	-81.2	179.5	0	0	0	110.4	K742 G797 P808 L812	K742-L801 PolarHBondContact NZ-O 3.43Å; G797-L801 WeakPolarHBondContact O-CG 3.3Å; G797-L801 PolarHBondContact O-N 2.97Å; L801-P808 HydrophobicContact CD1-CB 3.93Å; L801-L812 HydrophobicContact CD1-CD1 3.71Å; L801-L812 HydrophobicContact CG-CD1 4.38Å
802	G	80.6	Confident	90.3	Very high	39 Å²	39	52.9 Å²	52.9	40%	0.402	34%	0.344	S	S	.	.			trans	-56.2	155.4	173.5	0	0	0	0	0	112.3	S800 E804 S805	S800-G802 PolarHBondContact O-N 2.92Å; G802-E804 PolarHBondContact O-N 3.49Å; G802-S805 VanDerWaalsContact O-CB 3.31Å; G802-S805 WeakPolarHBondContact O-CB 3.41Å; G802-S805 PolarHBondContact O-N 3.11Å; G802-S805 PolarHBondContact O-OG 3.45Å
803	P	74.3	Confident	90.4	Very high	48 Å²	48	51.2 Å²	51.2	31%	0.312	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-48.8	-166.2	17.2	-30.8	0	0	0	113.3	M725 I729 L738 S805	M725-P803 WeakPolarHBondContact CE-O 3.28Å; I729-P803 HydrophobicContact CB-CB 4.43Å; I729-P803 WeakPolarHBondContact CD1-O 3.42Å; I729-P803 HydrophobicContact CG1-CB 3.91Å; I729-P803 WeakPolarHBondContact CG1-O 3.4Å; I729-P803 HydrophobicContact CG2-CB 4.2Å; L738-P803 HydrophobicContact CD2-CB 4.08Å; P803-S805 PolarHBondContact O-N 2.9Å
804	E	77.6	Confident	90.4	Very high	171 Å²	171	52.6 Å²	52.6	80%	0.799	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-12.3	-178.4	-63.3	177	-133.1	0	0	115.4	I729 G802 V806	I729-E804 HydrophobicContact CG2-CG 4.44Å; G802-E804 PolarHBondContact O-N 3.49Å; E804-V806 PolarHBondContact O-N 2.91Å
805	S	85	Confident	90.3	Very high	38 Å²	38	53 Å²	53	27%	0.266	33%	0.331	S	S	.	.			trans	-78.7	47.6	-177.5	-61.4	0	0	0	0	113.9	G802 P803 L807 P808 G809	G802-S805 VanDerWaalsContact O-CB 3.31Å; G802-S805 WeakPolarHBondContact O-CB 3.41Å; G802-S805 PolarHBondContact O-N 3.11Å; G802-S805 PolarHBondContact O-OG 3.45Å; P803-S805 PolarHBondContact O-N 2.9Å; S805-L807 PolarHBondContact O-N 3.44Å; S805-P808 WeakPolarHBondContact O-CD 3.49Å; S805-G809 PolarHBondContact O-N 3.25Å
806	V	86.4	Confident	90.1	Very high	45 Å²	45	51.6 Å²	51.6	27%	0.273	33%	0.325	S	S	.	.	H	α-helix	trans	-53.2	-55.8	-176.1	-176.3	0	0	0	0	111.9	Y721 M725 I729 E804 G809 L810	Y721-V806 PolarHBondContact OH-O 3.16Å; Y721-V806 VanDerWaalsContact OH-O 3.11Å; M725-V806 HydrophobicContact CB-CG1 4.18Å; M725-V806 HydrophobicContact CB-CG2 4.42Å; M725-V806 HydrophobicContact CE-CG2 4.29Å; I729-V806 HydrophobicContact CD1-CG2 3.4Å; I729-V806 VanDerWaalsContact CD1-CG2 3.4Å; E804-V806 PolarHBondContact O-N 2.91Å; V806-G809 PolarHBondContact O-N 2.87Å; V806-L810 PolarHBondContact O-N 3.45Å
807	L	90.3	Very high	90.2	Very high	133 Å²	133	47.2 Å²	47.2	70%	0.696	30%	0.298	S	S	*	.	H	α-helix	trans	-70.7	-44.6	-174.1	-178.2	65.7	0	0	0	113.4	S805 G809 L810 G811	S805-L807 PolarHBondContact O-N 3.44Å; L807-G809 VanDerWaalsContact C-N 3.28Å; L807-G809 PolarHBondContact O-N 3.42Å; L807-L810 HydrophobicContact CD1-CD2 4.48Å; L807-L810 PolarHBondContact O-N 3.29Å; L807-G811 PolarHBondContact O-N 2.94Å
808	P	92.4	Very high	90.3	Very high	75 Å²	75	46.8 Å²	46.8	49%	0.487	29%	0.294	S	S	.	.	H	α-helix	trans	-57.1	-40.5	170	-27	35.4	0	0	0	113	L801 S805 G811 L812	L801-P808 HydrophobicContact CD1-CB 3.93Å; S805-P808 WeakPolarHBondContact O-CD 3.49Å; P808-G811 PolarHBondContact O-N 2.77Å; P808-L812 PolarHBondContact O-N 3.23Å
809	G	92.9	Very high	90.4	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-36.5	177.5	0	0	0	0	0	113.3	Y721 L798 S805 V806 L807 G811 L812 L813	Y721-G809 VanDerWaalsContact OH-C 3.22Å; Y721-G809 VanDerWaalsContact OH-CA 3.23Å; Y721-G809 WeakPolarHBondContact OH-CA 3.47Å; L798-G809 VanDerWaalsContact CD1-CA 3.44Å; S805-G809 PolarHBondContact O-N 3.25Å; V806-G809 PolarHBondContact O-N 2.87Å; L807-G809 VanDerWaalsContact C-N 3.28Å; L807-G809 PolarHBondContact O-N 3.42Å; G809-G811 VanDerWaalsContact C-N 3.29Å; G809-G811 PolarHBondContact O-N 3.34Å; G809-L812 PolarHBondContact O-N 2.67Å; G809-L813 WeakPolarHBondContact O-CB 3.1Å; G809-L813 PolarHBondContact O-N 3.32Å
810	L	94.1	Very high	90.6	Very high	26 Å²	26	48.5 Å²	48.5	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-39.5	170.3	-176.6	60.2	0	0	0	111.1	I718 Y721 M722 V806 L807 L813 I814	I718-L810 HydrophobicContact CG2-CD1 4.11Å; Y721-L810 HydrophobicContact CD1-CB 4.3Å; Y721-L810 HydrophobicContact CD1-CD1 3.89Å; Y721-L810 HydrophobicContact CE1-CB 3.78Å; Y721-L810 HydrophobicContact CE1-CD1 4.25Å; Y721-L810 PolarHBondContact OH-N 3.39Å; M722-L810 HydrophobicContact CE-CD2 4.43Å; M722-L810 HydrophobicContact CG-CD1 3.85Å; M722-L810 HydrophobicContact CG-CD2 4.01Å; M722-L810 HydrophobicContact SD-CD1 4.3Å; M722-L810 HydrophobicContact SD-CD2 4.19Å; V806-L810 PolarHBondContact O-N 3.45Å; L807-L810 HydrophobicContact CD1-CD2 4.48Å; L807-L810 PolarHBondContact O-N 3.29Å; L810-L813 PolarHBondContact O-N 3.18Å; L810-I814 HydrophobicContact CD1-CD1 3.84Å; L810-I814 HydrophobicContact CD1-CG1 4.15Å; L810-I814 HydrophobicContact CG-CD1 3.88Å; L810-I814 HydrophobicContact CG-CG1 4.49Å; L810-I814 WeakPolarHBondContact O-CB 3.29Å; L810-I814 WeakPolarHBondContact O-CG1 3.31Å; L810-I814 PolarHBondContact O-N 2.91Å
811	G	94.9	Very high	90.8	Very high	45 Å²	45	44 Å²	44	46%	0.464	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-42.2	172.9	0	0	0	0	0	113	L807 P808 G809 G815	L807-G811 PolarHBondContact O-N 2.94Å; P808-G811 PolarHBondContact O-N 2.77Å; G809-G811 VanDerWaalsContact C-N 3.29Å; G809-G811 PolarHBondContact O-N 3.34Å; G811-G815 PolarHBondContact O-N 2.89Å
812	L	95.4	Very high	91.2	Very high	46 Å²	46	42.5 Å²	42.5	24%	0.241	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-37.9	173.9	-69.8	178.6	0	0	0	112.5	Y746 C794 L798 L801 P808 G809 G816	Y746-L812 WeakPolarHBondContact CE2-O 3.33Å; C794-L812 HydrophobicContact CB-CD2 4.14Å; L798-L812 HydrophobicContact CB-CB 4.37Å; L798-L812 HydrophobicContact CB-CD1 4.21Å; L801-L812 HydrophobicContact CD1-CD1 3.71Å; L801-L812 HydrophobicContact CG-CD1 4.38Å; P808-L812 PolarHBondContact O-N 3.23Å; G809-L812 PolarHBondContact O-N 2.67Å; L812-G816 WeakPolarHBondContact O-CA 3.45Å; L812-G816 PolarHBondContact O-N 3.44Å
813	L	95.5	Very high	92	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.269	C	S	.	.	I	π-helix	trans	-63.8	-53.4	175.2	-177.7	62.5	0	0	0	111.1	I718 Y721 Y746 T749 G809 L810 A817 G818	I718-L813 HydrophobicContact CG1-CD2 4.2Å; I718-L813 HydrophobicContact CG1-CG 4.41Å; Y721-L813 HydrophobicContact CD1-CD2 4.16Å; Y721-L813 HydrophobicContact CD2-CD2 3.98Å; Y721-L813 HydrophobicContact CG-CD2 3.63Å; Y746-L813 HydrophobicContact CD2-CD1 3.96Å; Y746-L813 HydrophobicContact CG-CD1 4.39Å; T749-L813 HydrophobicContact CG2-CD1 4.33Å; G809-L813 WeakPolarHBondContact O-CB 3.1Å; G809-L813 PolarHBondContact O-N 3.32Å; L810-L813 PolarHBondContact O-N 3.18Å; L813-A817 HydrophobicContact CD1-CB 4.35Å; L813-A817 WeakPolarHBondContact O-CA 3.41Å; L813-A817 VanDerWaalsContact O-CB 3.27Å; L813-A817 WeakPolarHBondContact O-CB 3.45Å; L813-A817 PolarHBondContact O-N 2.97Å; L813-A817 VanDerWaalsContact O-N 3.11Å; L813-G818 PolarHBondContact O-N 2.95Å; L813-G818 VanDerWaalsContact O-N 3.07Å
814	I	96	Very high	92.9	Very high	74 Å²	74	42 Å²	42	38%	0.379	26%	0.255	S	S	.	.	I	π-helix	trans	-66.5	-46.2	-178.1	-65	173.9	0	0	0	111	I718 L810 G818 V819	I718-I814 HydrophobicContact CD1-CG1 4.01Å; I718-I814 HydrophobicContact CG1-CG1 4.32Å; I718-I814 HydrophobicContact CG2-CD1 4.45Å; I718-I814 HydrophobicContact CG2-CG1 4.5Å; L810-I814 HydrophobicContact CD1-CD1 3.84Å; L810-I814 HydrophobicContact CD1-CG1 4.15Å; L810-I814 HydrophobicContact CG-CD1 3.88Å; L810-I814 HydrophobicContact CG-CG1 4.49Å; L810-I814 WeakPolarHBondContact O-CB 3.29Å; L810-I814 WeakPolarHBondContact O-CG1 3.31Å; L810-I814 PolarHBondContact O-N 2.91Å; I814-G818 CarbonylContact O-C 3.55Å; I814-G818 VanDerWaalsContact O-CA 3.27Å; I814-G818 WeakPolarHBondContact O-CA 3.36Å; I814-G818 PolarHBondContact O-N 3.31Å; I814-V819 PolarHBondContact O-N 3.41Å
815	G	93	Very high	93.8	Very high	33 Å²	33	33.9 Å²	33.9	34%	0.34	22%	0.217	S	C	.	.	I	π-helix	trans	-77.8	-53.4	-178	0	0	0	0	0	113.7	G811 A820	G811-G815 PolarHBondContact O-N 2.89Å; G815-A820 PolarHBondContact O-N 2.66Å
816	G	92.4	Very high	94.2	Very high	4 Å²	4	35.9 Å²	35.9	4%	0.041	22%	0.224	C	C	.	.	I	π-helix	trans	-76.2	-32.5	-173.3	0	0	0	0	0	114.3	Y746 S791 L812 A820	Y746-G816 WeakPolarHBondContact OH-CA 3.42Å; Y746-G816 PolarHBondContact OH-O 2.87Å; Y746-G816 VanDerWaalsContact OH-O 3.07Å; S791-G816 VanDerWaalsContact CB-O 3.29Å; S791-G816 WeakPolarHBondContact CB-O 3.38Å; S791-G816 PolarHBondContact OG-O 3.38Å; L812-G816 WeakPolarHBondContact O-CA 3.45Å; L812-G816 PolarHBondContact O-N 3.44Å; G816-A820 VanDerWaalsContact O-CB 3.31Å; G816-A820 WeakPolarHBondContact O-CB 3.35Å
817	A	95.7	Very high	94.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-98	-59.7	172	0	0	0	0	0	111.7	Y746 T749 L813 G821	Y746-A817 HydrophobicContact CD1-CB 3.94Å; Y746-A817 HydrophobicContact CD2-CB 3.79Å; Y746-A817 HydrophobicContact CE1-CB 3.89Å; Y746-A817 HydrophobicContact CE2-CB 3.76Å; Y746-A817 HydrophobicContact CG-CB 3.9Å; Y746-A817 WeakPolarHBondContact O-CB 3.49Å; T749-A817 HydrophobicContact CG2-CB 3.86Å; L813-A817 HydrophobicContact CD1-CB 4.35Å; L813-A817 WeakPolarHBondContact O-CA 3.41Å; L813-A817 VanDerWaalsContact O-CB 3.27Å; L813-A817 WeakPolarHBondContact O-CB 3.45Å; L813-A817 PolarHBondContact O-N 2.97Å; L813-A817 VanDerWaalsContact O-N 3.11Å; A817-G821 WeakPolarHBondContact O-CA 3.24Å; A817-G821 PolarHBondContact O-N 3.35Å
818	G	95.7	Very high	94.6	Very high	16 Å²	16	29.7 Å²	29.7	17%	0.165	19%	0.191	C	C	.	.	I	π-helix	trans	-62.6	-58.9	-172.4	0	0	0	0	0	114	L813 I814 G822	L813-G818 PolarHBondContact O-N 2.95Å; L813-G818 VanDerWaalsContact O-N 3.07Å; I814-G818 CarbonylContact O-C 3.55Å; I814-G818 VanDerWaalsContact O-CA 3.27Å; I814-G818 WeakPolarHBondContact O-CA 3.36Å; I814-G818 PolarHBondContact O-N 3.31Å; G818-G822 PolarHBondContact O-N 2.85Å
819	V	96.1	Very high	94.7	Very high	82 Å²	82	26.4 Å²	26.4	50%	0.497	17%	0.169	S	C	.	.	I	π-helix	trans	-71.1	-45.9	-177.8	176.2	0	0	0	0	111.3	I814 G821 G822 I823	I814-V819 PolarHBondContact O-N 3.41Å; V819-G821 PolarHBondContact O-N 2.66Å; V819-G822 PolarHBondContact O-N 2.87Å; V819-I823 HydrophobicContact CG1-CD1 3.83Å; V819-I823 HydrophobicContact CG1-CG1 4.36Å; V819-I823 WeakPolarHBondContact O-CG1 3.35Å; V819-I823 PolarHBondContact O-N 2.86Å
820	A	95.3	Very high	94.7	Very high	5 Å²	5	26.8 Å²	26.8	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-37.7	178.5	0	0	0	0	0	112.7	G815 G816 S824	G815-A820 PolarHBondContact O-N 2.66Å; G816-A820 VanDerWaalsContact O-CB 3.31Å; G816-A820 WeakPolarHBondContact O-CB 3.35Å; A820-S824 VanDerWaalsContact O-CB 3.31Å; A820-S824 WeakPolarHBondContact O-CB 3.41Å; A820-S824 PolarHBondContact O-N 3.07Å; A820-S824 PolarHBondContact O-OG 2.95Å
821	G	95.9	Very high	94.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-44.9	171.4	0	0	0	0	0	111.8	I754 A817 V819 I823 S824 G825	I754-G821 WeakPolarHBondContact CA-O 3.38Å; I754-G821 WeakPolarHBondContact CG1-O 3.47Å; I754-G821 PolarHBondContact N-O 3.26Å; A817-G821 WeakPolarHBondContact O-CA 3.24Å; A817-G821 PolarHBondContact O-N 3.35Å; V819-G821 PolarHBondContact O-N 2.66Å; G821-I823 PolarHBondContact O-N 3.17Å; G821-S824 PolarHBondContact O-N 2.85Å; G821-G825 PolarHBondContact O-N 3.34Å
822	G	96.5	Very high	94.3	Very high	11 Å²	11	23.8 Å²	23.8	11%	0.113	15%	0.147	C	C	.	.	H	α-helix	trans	-58.3	-44.9	174.5	0	0	0	0	0	113.6	T757 G818 V819 L826	T757-G822 VanDerWaalsContact CB-O 3.24Å; T757-G822 WeakPolarHBondContact CB-O 3.48Å; T757-G822 WeakPolarHBondContact CG2-O 3.23Å; T757-G822 PolarHBondContact OG1-O 3.45Å; G818-G822 PolarHBondContact O-N 2.85Å; V819-G822 PolarHBondContact O-N 2.87Å; G822-L826 WeakPolarHBondContact O-CB 3.43Å; G822-L826 PolarHBondContact O-N 2.94Å
823	I	96	Very high	93.7	Very high	74 Å²	74	22.3 Å²	22.3	38%	0.379	14%	0.142	S	C	.	.	H	α-helix	trans	-65.7	-42.2	174.9	-63	167.8	0	0	0	110.1	L787 V819 G821 L826 T827	L787-I823 HydrophobicContact CD1-CB 4.34Å; L787-I823 HydrophobicContact CD1-CG2 3.66Å; L787-I823 HydrophobicContact CD2-CB 4.4Å; L787-I823 HydrophobicContact CD2-CG2 4.13Å; V819-I823 HydrophobicContact CG1-CD1 3.83Å; V819-I823 HydrophobicContact CG1-CG1 4.36Å; V819-I823 WeakPolarHBondContact O-CG1 3.35Å; V819-I823 PolarHBondContact O-N 2.86Å; G821-I823 PolarHBondContact O-N 3.17Å; I823-L826 PolarHBondContact O-N 3.47Å; I823-T827 HydrophobicContact CG2-CG2 4.06Å; I823-T827 WeakPolarHBondContact O-CG2 3.42Å; I823-T827 PolarHBondContact O-N 3.46Å; I823-T827 PolarHBondContact O-OG1 2.91Å; I823-T827 VanDerWaalsContact O-OG1 3.12Å
824	S	94.6	Very high	92.9	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-44.2	179.6	-60.2	0	0	0	0	112.8	A820 G821 L826 T827 L828	A820-S824 VanDerWaalsContact O-CB 3.31Å; A820-S824 WeakPolarHBondContact O-CB 3.41Å; A820-S824 PolarHBondContact O-N 3.07Å; A820-S824 PolarHBondContact O-OG 2.95Å; G821-S824 PolarHBondContact O-N 2.85Å; S824-L826 VanDerWaalsContact C-N 3.32Å; S824-L826 PolarHBondContact O-N 3.2Å; S824-T827 PolarHBondContact O-N 2.64Å; S824-T827 PolarHBondContact O-OG1 3.31Å; S824-L828 VanDerWaalsContact O-CB 3.27Å; S824-L828 WeakPolarHBondContact O-CB 3.11Å; S824-L828 WeakPolarHBondContact O-CD1 3.34Å; S824-L828 VanDerWaalsContact O-CG 3.26Å; S824-L828 WeakPolarHBondContact O-CG 3.49Å; S824-L828 PolarHBondContact O-N 3.26Å
825	G	94.7	Very high	91.9	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-38.6	175.7	0	0	0	0	0	112.6	T757 G758 G821 T829	T757-G825 WeakPolarHBondContact OG1-CA 3.23Å; G758-G825 WeakPolarHBondContact CA-O 3.36Å; G821-G825 PolarHBondContact O-N 3.34Å; G825-T829 VanDerWaalsContact O-CB 3.23Å; G825-T829 WeakPolarHBondContact O-CB 3.43Å; G825-T829 PolarHBondContact O-N 2.87Å; G825-T829 VanDerWaalsContact O-N 3.16Å; G825-T829 PolarHBondContact O-OG1 3.39Å
826	L	94.7	Very high	91.6	Very high	79 Å²	79	21 Å²	21	41%	0.414	14%	0.139	S	C	.	.	H	α-helix	trans	-66.4	-52.3	174.9	-176.4	156.6	0	0	0	111.6	T757 I761 G822 I823 S824 A830	T757-L826 PolarHBondContact OG1-N 3.48Å; I761-L826 HydrophobicContact CD1-CG 4.2Å; I761-L826 HydrophobicContact CG1-CG 4.19Å; G822-L826 WeakPolarHBondContact O-CB 3.43Å; G822-L826 PolarHBondContact O-N 2.94Å; I823-L826 PolarHBondContact O-N 3.47Å; S824-L826 VanDerWaalsContact C-N 3.32Å; S824-L826 PolarHBondContact O-N 3.2Å; L826-A830 WeakPolarHBondContact O-CB 3.44Å; L826-A830 PolarHBondContact O-N 3.23Å
827	T	92.9	Very high	91.4	Very high	11 Å²	11	20.9 Å²	20.9	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-70.3	-38.7	-173.3	55.9	0	0	0	0	112.8	L777 L783 N784 I823 S824 A831	L777-T827 HydrophobicContact CD1-CG2 4.23Å; L783-T827 HydrophobicContact CD2-CG2 3.91Å; N784-T827 WeakPolarHBondContact OD1-CB 3.5Å; N784-T827 PolarHBondContact OD1-OG1 3.39Å; I823-T827 HydrophobicContact CG2-CG2 4.06Å; I823-T827 WeakPolarHBondContact O-CG2 3.42Å; I823-T827 PolarHBondContact O-N 3.46Å; I823-T827 PolarHBondContact O-OG1 2.91Å; I823-T827 VanDerWaalsContact O-OG1 3.12Å; S824-T827 PolarHBondContact O-N 2.64Å; S824-T827 PolarHBondContact O-OG1 3.31Å; T827-A831 PolarHBondContact O-N 2.86Å
828	L	92.7	Very high	91	Very high	38 Å²	38	21.1 Å²	21.1	20%	0.199	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-54	173	-69.8	166.3	0	0	0	110.5	N784 S824 A830 A831 I832 I894 L895	N784-L828 HydrophobicContact CB-CD2 4.49Å; N784-L828 VanDerWaalsContact ND2-CD2 3.34Å; N784-L828 WeakPolarHBondContact ND2-CD2 3.47Å; S824-L828 VanDerWaalsContact O-CB 3.27Å; S824-L828 WeakPolarHBondContact O-CB 3.11Å; S824-L828 WeakPolarHBondContact O-CD1 3.34Å; S824-L828 VanDerWaalsContact O-CG 3.26Å; S824-L828 WeakPolarHBondContact O-CG 3.49Å; S824-L828 PolarHBondContact O-N 3.26Å; L828-A830 PolarHBondContact O-N 2.75Å; L828-A831 PolarHBondContact O-N 3.49Å; L828-A831 VanDerWaalsContact O-N 3.16Å; L828-I832 WeakPolarHBondContact O-CG1 3.46Å; L828-I894 HydrophobicContact CD2-CG2 4.15Å; L828-L895 HydrophobicContact CD2-CD2 4.43Å
829	T	93.7	Very high	90.7	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-69.5	-32.2	-174.4	-48.3	0	0	0	0	112.8	G758 I761 A762 G825 A831 I832 M837 V840	G758-T829 VanDerWaalsContact CA-OG1 3.3Å; G758-T829 WeakPolarHBondContact CA-OG1 3.43Å; G758-T829 WeakPolarHBondContact O-CG2 3.24Å; I761-T829 HydrophobicContact CB-CG2 4.01Å; I761-T829 HydrophobicContact CG2-CG2 3.89Å; A762-T829 HydrophobicContact CB-CG2 4.29Å; G825-T829 VanDerWaalsContact O-CB 3.23Å; G825-T829 WeakPolarHBondContact O-CB 3.43Å; G825-T829 PolarHBondContact O-N 2.87Å; G825-T829 VanDerWaalsContact O-N 3.16Å; G825-T829 PolarHBondContact O-OG1 3.39Å; T829-A831 VanDerWaalsContact C-N 3.29Å; T829-A831 PolarHBondContact O-N 2.93Å; T829-I832 PolarHBondContact O-N 3.32Å; T829-M837 HydrophobicContact CG2-SD 4.18Å; T829-V840 HydrophobicContact CG2-CG1 3.96Å
830	A	92.4	Very high	90.4	Very high	10 Å²	10	16.9 Å²	16.9	8%	0.083	11%	0.11	C	C	.	.	H	α-helix	trans	-63.6	-34.6	174.2	0	0	0	0	0	112.3	I761 K765 L775 L826 L828 I832	I761-A830 HydrophobicContact CG2-CB 4.44Å; K765-A830 PolarHBondContact NZ-O 3.48Å; L775-A830 HydrophobicContact CB-CB 4.28Å; L775-A830 WeakPolarHBondContact CB-O 3.3Å; L775-A830 HydrophobicContact CD2-CB 4.29Å; L775-A830 PolarHBondContact N-O 2.91Å; L826-A830 WeakPolarHBondContact O-CB 3.44Å; L826-A830 PolarHBondContact O-N 3.23Å; L828-A830 PolarHBondContact O-N 2.75Å; A830-I832 VanDerWaalsContact C-N 3.27Å; A830-I832 PolarHBondContact O-N 2.95Å
831	A	91.2	Very high	90.3	Very high	5 Å²	5	16.7 Å²	16.7	4%	0.041	11%	0.109	C	C	.	.	H	α-helix	trans	-73.8	-11.9	178.9	0	0	0	0	0	114.3	P774 L776 T827 L828 T829	P774-A831 WeakPolarHBondContact CB-O 3.48Å; L776-A831 HydrophobicContact CD2-CB 4.48Å; T827-A831 PolarHBondContact O-N 2.86Å; L828-A831 PolarHBondContact O-N 3.49Å; L828-A831 VanDerWaalsContact O-N 3.16Å; T829-A831 VanDerWaalsContact C-N 3.29Å; T829-A831 PolarHBondContact O-N 2.93Å
832	I	89.4	Confident	90.1	Very high	3 Å²	3	16.7 Å²	16.7	2%	0.015	11%	0.109	C	C	.	.	S	Bend	trans	-91.9	140.8	-176.9	-59.4	167.9	0	0	0	111.1	K765 L828 T829 A830 D836 M837 V840	K765-I832 PolarHBondContact NZ-O 3.27Å; L828-I832 WeakPolarHBondContact O-CG1 3.46Å; T829-I832 PolarHBondContact O-N 3.32Å; A830-I832 VanDerWaalsContact C-N 3.27Å; A830-I832 PolarHBondContact O-N 2.95Å; I832-D836 HydrophobicContact CG2-CB 3.49Å; I832-D836 VanDerWaalsContact CG2-CB 3.49Å; I832-M837 HydrophobicContact CB-CE 4.31Å; I832-M837 HydrophobicContact CG2-CE 4.21Å; I832-V840 HydrophobicContact CB-CG2 4.2Å; I832-V840 HydrophobicContact CD1-CG1 4.29Å; I832-V840 HydrophobicContact CD1-CG2 3.57Å; I832-V840 HydrophobicContact CG1-CG2 4.45Å; I832-V840 HydrophobicContact CG2-CG2 3.65Å
833	G	83.3	Confident	90	Very high	14 Å²	14	16.7 Å²	16.7	14%	0.144	11%	0.106	C	C	.	.			trans	-79.1	155.4	-178.9	0	0	0	0	0	113.6	A835 D836 M837	G833-A835 PolarHBondContact O-N 3.49Å; G833-A835 VanDerWaalsContact O-N 3.15Å; G833-D836 PolarHBondContact O-N 3.3Å; G833-M837 PolarHBondContact O-N 3.46Å; G833-M837 VanDerWaalsContact O-N 3.1Å
834	G	79	Confident	90	Very high	24 Å²	24	13.4 Å²	13.4	25%	0.247	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.8	-176.9	0	0	0	0	0	115.6	S772	S772-G834 PolarHBondContact O-N 3.45Å
835	A	75.6	Confident	89.9	Confident	39 Å²	39	13.2 Å²	13.2	32%	0.322	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-34	172.5	0	0	0	0	0	112.5	G833 P838 Y1055	G833-A835 PolarHBondContact O-N 3.49Å; G833-A835 VanDerWaalsContact O-N 3.15Å; A835-P838 VanDerWaalsContact O-CD 3.24Å; A835-P838 WeakPolarHBondContact O-CD 3.44Å; A835-Y1055 HydrophobicContact CB-CD1 3.77Å; A835-Y1055 HydrophobicContact CB-CG 3.98Å
836	D	84.7	Confident	90	Very high	18 Å²	18	13.5 Å²	13.5	10%	0.096	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-15.2	-178.5	-68.4	-22.7	0	0	0	112.6	I832 G833 P838 V839 M886 R888 V893	I832-D836 HydrophobicContact CG2-CB 3.49Å; I832-D836 VanDerWaalsContact CG2-CB 3.49Å; G833-D836 PolarHBondContact O-N 3.3Å; D836-P838 VanDerWaalsContact C-N 3.28Å; D836-P838 WeakPolarHBondContact O-CD 3.44Å; D836-P838 VanDerWaalsContact O-N 3.13Å; D836-V839 WeakPolarHBondContact O-CB 3.42Å; D836-V839 PolarHBondContact O-N 2.91Å; D836-M886 WeakPolarHBondContact OD1-CE 3.31Å; D836-R888 IonicContact OD1-CZ 3.23Å; D836-R888 IonicContact OD1-NH1 3.59Å; D836-R888 PolarHBondContact OD1-NH1 2.96Å; D836-R888 IonicContact OD2-CZ 3.03Å; D836-R888 IonicContact OD2-NH1 2.79Å; D836-R888 PolarHBondContact OD2-NH1 3.47Å; D836-R888 IonicContact OD2-NH2 2.71Å; D836-V893 HydrophobicContact CB-CG1 3.98Å
837	M	88.3	Confident	90	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-46.6	-38.8	179.8	-152.7	57	41.4	0	0	115	A762 K765 L766 T829 I832 G833 V839 V840 I841	A762-M837 HydrophobicContact CB-CG 4.43Å; A762-M837 HydrophobicContact CB-SD 3.86Å; K765-M837 HydrophobicContact CD-CE 3.66Å; L766-M837 HydrophobicContact CD1-CG 4.32Å; L766-M837 HydrophobicContact CD2-CB 4.34Å; L766-M837 HydrophobicContact CD2-CG 4.03Å; L766-M837 HydrophobicContact CG-CG 3.97Å; T829-M837 HydrophobicContact CG2-SD 4.18Å; I832-M837 HydrophobicContact CB-CE 4.31Å; I832-M837 HydrophobicContact CG2-CE 4.21Å; G833-M837 PolarHBondContact O-N 3.46Å; G833-M837 VanDerWaalsContact O-N 3.1Å; M837-V839 VanDerWaalsContact C-N 3.28Å; M837-V839 PolarHBondContact O-N 3.2Å; M837-V840 WeakPolarHBondContact O-CA 3.46Å; M837-V840 WeakPolarHBondContact O-CB 3.46Å; M837-V840 PolarHBondContact O-N 3.45Å; M837-V840 HydrophobicContact SD-CB 4.37Å; M837-V840 HydrophobicContact SD-CG2 4.3Å; M837-I841 WeakPolarHBondContact O-CG1 3.36Å; M837-I841 PolarHBondContact O-N 2.82Å; M837-I841 VanDerWaalsContact O-N 3.11Å
838	P	87.1	Confident	90.1	Very high	6 Å²	6	13 Å²	13	4%	0.039	8%	0.082	C	C	.	.	H	α-helix	trans	-57.3	-38.1	177.6	-25.5	36.6	0	0	0	113.5	A835 D836 V840 I841 T842 M882 R974	A835-P838 VanDerWaalsContact O-CD 3.24Å; A835-P838 WeakPolarHBondContact O-CD 3.44Å; D836-P838 VanDerWaalsContact C-N 3.28Å; D836-P838 WeakPolarHBondContact O-CD 3.44Å; D836-P838 VanDerWaalsContact O-N 3.13Å; P838-V840 VanDerWaalsContact C-N 3.28Å; P838-V840 PolarHBondContact O-N 3.44Å; P838-I841 PolarHBondContact O-N 2.84Å; P838-T842 PolarHBondContact O-N 3.27Å; P838-M882 HydrophobicContact CB-CE 3.59Å; P838-M882 HydrophobicContact CB-SD 3.7Å; P838-M882 HydrophobicContact CG-CE 4.47Å; P838-R974 WeakPolarHBondContact CG-O 3.21Å
839	V	89.9	Confident	90.3	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.006	7%	0.073	C	C	.	.	H	α-helix	trans	-65.9	-34.7	175.7	-170.3	0	0	0	0	110.6	D836 M837 T842 V843 M882 M886 L890 V893	D836-V839 WeakPolarHBondContact O-CB 3.42Å; D836-V839 PolarHBondContact O-N 2.91Å; M837-V839 VanDerWaalsContact C-N 3.28Å; M837-V839 PolarHBondContact O-N 3.2Å; V839-T842 WeakPolarHBondContact CA-OG1 3.43Å; V839-T842 PolarHBondContact O-N 2.91Å; V839-T842 PolarHBondContact O-OG1 3.42Å; V839-V843 VanDerWaalsContact O-CG2 3.3Å; V839-V843 WeakPolarHBondContact O-CG2 3.38Å; V839-V843 PolarHBondContact O-N 2.98Å; V839-M882 HydrophobicContact CG2-CB 3.85Å; V839-M882 HydrophobicContact CG2-SD 4.16Å; V839-M886 HydrophobicContact CG2-SD 4.17Å; V839-L890 HydrophobicContact CG1-CD1 3.86Å; V839-V893 HydrophobicContact CB-CG1 4.12Å; V839-V893 HydrophobicContact CG1-CG1 4.17Å; V839-V893 HydrophobicContact CG2-CG1 4.43Å
840	V	91.2	Very high	90.4	Very high	8 Å²	8	14.2 Å²	14.2	5%	0.048	8%	0.083	C	C	.	.	H	α-helix	trans	-68.4	-38.7	177.8	-160.8	0	0	0	0	110.8	T829 I832 M837 P838 T842 V843 L844	T829-V840 HydrophobicContact CG2-CG1 3.96Å; I832-V840 HydrophobicContact CB-CG2 4.2Å; I832-V840 HydrophobicContact CD1-CG1 4.29Å; I832-V840 HydrophobicContact CD1-CG2 3.57Å; I832-V840 HydrophobicContact CG1-CG2 4.45Å; I832-V840 HydrophobicContact CG2-CG2 3.65Å; M837-V840 WeakPolarHBondContact O-CA 3.46Å; M837-V840 WeakPolarHBondContact O-CB 3.46Å; M837-V840 PolarHBondContact O-N 3.45Å; M837-V840 HydrophobicContact SD-CB 4.37Å; M837-V840 HydrophobicContact SD-CG2 4.3Å; P838-V840 VanDerWaalsContact C-N 3.28Å; P838-V840 PolarHBondContact O-N 3.44Å; V840-T842 VanDerWaalsContact C-N 3.3Å; V840-T842 PolarHBondContact O-N 2.71Å; V840-V843 PolarHBondContact O-N 2.85Å; V840-L844 HydrophobicContact CG1-CD1 3.77Å; V840-L844 HydrophobicContact CG1-CG 4.29Å; V840-L844 WeakPolarHBondContact O-CB 3.44Å; V840-L844 WeakPolarHBondContact O-CD1 3.34Å; V840-L844 VanDerWaalsContact O-CG 3.22Å; V840-L844 WeakPolarHBondContact O-CG 3.36Å; V840-L844 PolarHBondContact O-N 3.32Å
841	I	91.3	Very high	90.6	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-61.2	-40.5	175.1	-46.3	167.6	0	0	0	110.5	M522 P699 V702 L766 M837 P838 L844 N845	M522-I841 HydrophobicContact CE-CB 4.04Å; M522-I841 HydrophobicContact CE-CG2 3.57Å; P699-I841 HydrophobicContact CB-CD1 4.32Å; V702-I841 HydrophobicContact CG1-CG2 4.37Å; L766-I841 HydrophobicContact CD1-CD1 3.72Å; L766-I841 HydrophobicContact CD1-CG1 4.28Å; M837-I841 WeakPolarHBondContact O-CG1 3.36Å; M837-I841 PolarHBondContact O-N 2.82Å; M837-I841 VanDerWaalsContact O-N 3.11Å; P838-I841 PolarHBondContact O-N 2.84Å; I841-L844 PolarHBondContact O-N 2.86Å; I841-N845 WeakPolarHBondContact O-CB 3.27Å; I841-N845 PolarHBondContact O-N 2.91Å
842	T	93.3	Very high	90.8	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-71.4	-35.2	178.3	57	0	0	0	0	112.5	M522 P838 V839 V840 N845 S846 G875 L878 S879 M882 P976	M522-T842 HydrophobicContact CE-CG2 3.7Å; M522-T842 HydrophobicContact SD-CG2 3.76Å; P838-T842 PolarHBondContact O-N 3.27Å; V839-T842 WeakPolarHBondContact CA-OG1 3.43Å; V839-T842 PolarHBondContact O-N 2.91Å; V839-T842 PolarHBondContact O-OG1 3.42Å; V840-T842 VanDerWaalsContact C-N 3.3Å; V840-T842 PolarHBondContact O-N 2.71Å; T842-N845 PolarHBondContact O-N 2.9Å; T842-S846 PolarHBondContact O-N 3.42Å; T842-G875 CarbonylContact O-C 3.58Å; T842-G875 WeakPolarHBondContact O-CA 3.48Å; T842-L878 HydrophobicContact CG2-CB 3.69Å; T842-L878 HydrophobicContact CG2-CD1 4.44Å; T842-S879 VanDerWaalsContact C-OG 3.22Å; T842-S879 VanDerWaalsContact CB-OG 3.28Å; T842-S879 WeakPolarHBondContact CB-OG 3.47Å; T842-S879 WeakPolarHBondContact OG1-CA 3.31Å; T842-S879 PolarHBondContact OG1-OG 3.44Å; T842-M882 HydrophobicContact CG2-SD 4.49Å; T842-P976 HydrophobicContact CG2-CG 3.78Å
843	V	94.6	Very high	91.2	Very high	11 Å²	11	13.7 Å²	13.7	7%	0.067	8%	0.079	C	C	.	.	H	α-helix	trans	-64.9	-44	172.8	171	0	0	0	0	110.9	V839 V840 N845 S846 Y847 S879 L890 I894	V839-V843 VanDerWaalsContact O-CG2 3.3Å; V839-V843 WeakPolarHBondContact O-CG2 3.38Å; V839-V843 PolarHBondContact O-N 2.98Å; V840-V843 PolarHBondContact O-N 2.85Å; V843-N845 VanDerWaalsContact C-N 3.33Å; V843-N845 PolarHBondContact O-N 2.98Å; V843-S846 WeakPolarHBondContact O-CA 3.45Å; V843-S846 WeakPolarHBondContact O-CB 3.32Å; V843-S846 PolarHBondContact O-N 2.92Å; V843-Y847 HydrophobicContact CG1-CD1 4.34Å; V843-Y847 HydrophobicContact CG1-CD2 4.43Å; V843-Y847 HydrophobicContact CG1-CE1 3.88Å; V843-Y847 HydrophobicContact CG1-CE2 3.98Å; V843-Y847 WeakPolarHBondContact O-CD1 3.31Å; V843-Y847 PolarHBondContact O-N 3.49Å; V843-S879 WeakPolarHBondContact CG2-OG 3.45Å; V843-S879 PolarHBondContact N-OG 3.4Å; V843-S879 VanDerWaalsContact N-OG 3.16Å; V843-L890 HydrophobicContact CG2-CD1 3.77Å; V843-I894 HydrophobicContact CG1-CD1 4.32Å; V843-I894 HydrophobicContact CG2-CD1 4.23Å
844	L	94.4	Very high	91.8	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.021	8%	0.076	C	C	.	.	H	α-helix	trans	-69.7	-30.1	179	-65.1	163	0	0	0	112.1	I754 V840 I841 S846 Y847 S848	I754-L844 HydrophobicContact CG2-CD2 4.47Å; V840-L844 HydrophobicContact CG1-CD1 3.77Å; V840-L844 HydrophobicContact CG1-CG 4.29Å; V840-L844 WeakPolarHBondContact O-CB 3.44Å; V840-L844 WeakPolarHBondContact O-CD1 3.34Å; V840-L844 VanDerWaalsContact O-CG 3.22Å; V840-L844 WeakPolarHBondContact O-CG 3.36Å; V840-L844 PolarHBondContact O-N 3.32Å; I841-L844 PolarHBondContact O-N 2.86Å; L844-S846 VanDerWaalsContact C-N 3.32Å; L844-Y847 HydrophobicContact CD2-CD2 4.41Å; L844-Y847 PolarHBondContact O-N 2.85Å; L844-S848 PolarHBondContact O-N 3.3Å
845	N	93.5	Very high	92.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-66	-32.6	166.8	-166.4	25.3	0	0	0	112.3	M522 T525 H706 I841 T842 V843 S848 G849 I871	M522-N845 HydrophobicContact SD-CB 4.17Å; M522-N845 PolarHBondContact SD-ND2 2.99Å; T525-N845 PolarHBondContact OG1-ND2 3.3Å; T525-N845 PolarHBondContact OG1-OD1 3.04Å; H706-N845 VanDerWaalsContact CE1-CB 3.48Å; H706-N845 WeakPolarHBondContact CE1-CB 3.12Å; H706-N845 PolarHBondContact NE2-OD1 3.3Å; I841-N845 WeakPolarHBondContact O-CB 3.27Å; I841-N845 PolarHBondContact O-N 2.91Å; T842-N845 PolarHBondContact O-N 2.9Å; V843-N845 VanDerWaalsContact C-N 3.33Å; V843-N845 PolarHBondContact O-N 2.98Å; N845-S848 PolarHBondContact O-OG 3.33Å; N845-G849 PolarHBondContact O-N 3.16Å; N845-I871 WeakPolarHBondContact O-CG2 3.35Å
846	S	95.7	Very high	93.6	Very high	6 Å²	6	10.5 Å²	10.5	4%	0.042	5%	0.049	C	C	.	.	H	α-helix	trans	-67.3	-45.2	172.4	-164.4	0	0	0	0	110.1	T842 V843 L844 S848 G849 W850 G872 A876	T842-S846 PolarHBondContact O-N 3.42Å; V843-S846 WeakPolarHBondContact O-CA 3.45Å; V843-S846 WeakPolarHBondContact O-CB 3.32Å; V843-S846 PolarHBondContact O-N 2.92Å; L844-S846 VanDerWaalsContact C-N 3.32Å; S846-S848 PolarHBondContact O-N 3.42Å; S846-G849 PolarHBondContact O-N 3.28Å; S846-W850 PolarHBondContact O-N 3.38Å; S846-W850 PolarHBondContact O-NE1 2.8Å; S846-W850 PolarHBondContact OG-NE1 3.02Å; S846-G872 WeakPolarHBondContact O-CA 3.47Å; S846-G872 PolarHBondContact OG-O 3.09Å; S846-A876 PolarHBondContact OG-N 2.98Å
847	Y	96.1	Very high	94.1	Very high	81 Å²	81	11.2 Å²	11.2	32%	0.318	5%	0.051	S	C	.	.	H	α-helix	trans	-66.7	-35.9	-178.2	-69.3	2.4	0	0	0	113.2	I751 I754 T755 V843 L844 G849 W850 A851	I751-Y847 HydrophobicContact CG2-CG 4.35Å; I751-Y847 WeakPolarHBondContact CG2-O 3.47Å; I754-Y847 HydrophobicContact CG2-CD2 3.8Å; I754-Y847 HydrophobicContact CG2-CE2 3.85Å; T755-Y847 VanDerWaalsContact OG1-CB 3.29Å; T755-Y847 WeakPolarHBondContact OG1-CB 3.49Å; V843-Y847 HydrophobicContact CG1-CD1 4.34Å; V843-Y847 HydrophobicContact CG1-CD2 4.43Å; V843-Y847 HydrophobicContact CG1-CE1 3.88Å; V843-Y847 HydrophobicContact CG1-CE2 3.98Å; V843-Y847 WeakPolarHBondContact O-CD1 3.31Å; V843-Y847 PolarHBondContact O-N 3.49Å; L844-Y847 HydrophobicContact CD2-CD2 4.41Å; L844-Y847 PolarHBondContact O-N 2.85Å; Y847-G849 VanDerWaalsContact C-N 3.29Å; Y847-G849 PolarHBondContact O-N 3.19Å; Y847-W850 PolarHBondContact O-N 3.14Å; Y847-A851 WeakPolarHBondContact O-CB 3.39Å; Y847-A851 PolarHBondContact O-N 3.45Å
848	S	95	Very high	94.3	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.2	-37.9	172.1	64.5	0	0	0	0	112.1	L844 N845 S846 L852	L844-S848 PolarHBondContact O-N 3.3Å; N845-S848 PolarHBondContact O-OG 3.33Å; S846-S848 PolarHBondContact O-N 3.42Å; S848-L852 WeakPolarHBondContact O-CB 3.45Å; S848-L852 PolarHBondContact O-N 3.16Å; S848-L852 VanDerWaalsContact O-N 3.09Å
849	G	96	Very high	94.6	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.7	-43.7	172.2	0	0	0	0	0	113.7	N845 S846 Y847 L852 C853 G868	N845-G849 PolarHBondContact O-N 3.16Å; S846-G849 PolarHBondContact O-N 3.28Å; Y847-G849 VanDerWaalsContact C-N 3.29Å; Y847-G849 PolarHBondContact O-N 3.19Å; G849-L852 PolarHBondContact O-N 3.01Å; G849-C853 PolarHBondContact O-N 3.46Å; G849-C853 PolarHBondContact O-SG 3.25Å; G849-G868 CarbonylContact C-O 3.5Å; G849-G868 VanDerWaalsContact C-O 3.31Å; G849-G868 VanDerWaalsContact CA-O 3.27Å; G849-G868 WeakPolarHBondContact CA-O 3.26Å; G849-G868 CarbonylContact O-C 3.53Å; G849-G868 WeakPolarHBondContact O-CA 3.08Å
850	W	97	Very high	94.7	Very high	68 Å²	68	17.7 Å²	17.7	26%	0.258	9%	0.085	S	C	.	.	H	α-helix	trans	-71.6	-30.5	177.7	-53.5	125.5	0	0	0	113.3	F499 I751 S846 Y847 C853 A854 A869	F499-W850 HydrophobicContact CE2-CE3 4.09Å; F499-W850 AromaticContact CE2-CZ3 3.79Å; F499-W850 HydrophobicContact CE2-CZ3 3.79Å; F499-W850 HydrophobicContact CZ-CE3 4.31Å; F499-W850 AromaticContact CZ-CZ3 3.92Å; F499-W850 HydrophobicContact CZ-CZ3 3.92Å; I751-W850 HydrophobicContact CD1-CB 4.42Å; S846-W850 PolarHBondContact O-N 3.38Å; S846-W850 PolarHBondContact O-NE1 2.8Å; S846-W850 PolarHBondContact OG-NE1 3.02Å; Y847-W850 PolarHBondContact O-N 3.14Å; W850-C853 WeakPolarHBondContact O-CB 3.48Å; W850-C853 PolarHBondContact O-N 3.09Å; W850-A854 PolarHBondContact O-N 3.31Å; W850-A854 VanDerWaalsContact O-N 3.1Å; W850-A869 HydrophobicContact CZ3-CB 4.46Å
851	A	96.1	Very high	94.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64	-44	169.9	0	0	0	0	0	111.2	A713 I751 Y847 C853 A854 E855	A713-A851 HydrophobicContact CB-CB 3.89Å; I751-A851 HydrophobicContact CB-CB 4.33Å; I751-A851 HydrophobicContact CG2-CB 3.98Å; Y847-A851 WeakPolarHBondContact O-CB 3.39Å; Y847-A851 PolarHBondContact O-N 3.45Å; A851-C853 VanDerWaalsContact C-N 3.29Å; A851-C853 PolarHBondContact O-N 3.33Å; A851-A854 WeakPolarHBondContact O-CA 3.47Å; A851-A854 WeakPolarHBondContact O-CB 3.44Å; A851-A854 PolarHBondContact O-N 3.13Å; A851-E855 PolarHBondContact O-N 3.17Å
852	L	96.1	Very high	95.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.6	-30.9	174.3	178.8	64.8	0	0	0	112.7	I531 T532 S848 G849 E855 G856 M864 V867 I871	I531-L852 HydrophobicContact CG2-CD1 3.91Å; I531-L852 HydrophobicContact CG2-CD2 3.46Å; I531-L852 VanDerWaalsContact CG2-CD2 3.46Å; I531-L852 HydrophobicContact CG2-CG 4.31Å; T532-L852 HydrophobicContact CG2-CD1 3.84Å; S848-L852 WeakPolarHBondContact O-CB 3.45Å; S848-L852 PolarHBondContact O-N 3.16Å; S848-L852 VanDerWaalsContact O-N 3.09Å; G849-L852 PolarHBondContact O-N 3.01Å; L852-E855 PolarHBondContact O-N 3.47Å; L852-G856 PolarHBondContact O-N 2.9Å; L852-M864 HydrophobicContact CD1-CB 3.9Å; L852-M864 HydrophobicContact CD1-CE 3.6Å; L852-M864 HydrophobicContact CD1-CG 4.06Å; L852-M864 HydrophobicContact CG-CB 4.41Å; L852-V867 HydrophobicContact CD2-CB 4.21Å; L852-V867 HydrophobicContact CD2-CG1 3.75Å; L852-I871 HydrophobicContact CD2-CD1 4.35Å
853	C	97.2	Very high	95.3	Very high	7 Å²	7	18.6 Å²	18.6	5%	0.047	9%	0.091	C	C	.	.	H	α-helix	trans	-62.7	-42.5	168.5	-62.5	0	0	0	0	111.5	F499 G849 W850 A851 G856 F857 G868 A869	F499-C853 HydrophobicContact CD2-CB 4.44Å; F499-C853 HydrophobicContact CE2-CB 4.18Å; G849-C853 PolarHBondContact O-N 3.46Å; G849-C853 PolarHBondContact O-SG 3.25Å; W850-C853 WeakPolarHBondContact O-CB 3.48Å; W850-C853 PolarHBondContact O-N 3.09Å; A851-C853 VanDerWaalsContact C-N 3.29Å; A851-C853 PolarHBondContact O-N 3.33Å; C853-G856 PolarHBondContact O-N 2.93Å; C853-F857 WeakPolarHBondContact O-CD2 3.35Å; C853-F857 PolarHBondContact O-N 3.43Å; C853-G868 VanDerWaalsContact SG-CA 3.59Å; C853-A869 PolarHBondContact SG-N 2.97Å
854	A	96.1	Very high	95.5	Very high	10 Å²	10	18.1 Å²	18.1	8%	0.083	9%	0.088	C	C	.	.	H	α-helix	trans	-62.9	-46.4	177	0	0	0	0	0	110.9	V744 W850 A851 G856 F857 M858	V744-A854 HydrophobicContact CG1-CB 3.83Å; V744-A854 WeakPolarHBondContact CG1-O 3.48Å; W850-A854 PolarHBondContact O-N 3.31Å; W850-A854 VanDerWaalsContact O-N 3.1Å; A851-A854 WeakPolarHBondContact O-CA 3.47Å; A851-A854 WeakPolarHBondContact O-CB 3.44Å; A851-A854 PolarHBondContact O-N 3.13Å; A854-G856 VanDerWaalsContact C-N 3.26Å; A854-G856 PolarHBondContact O-N 3.22Å; A854-F857 PolarHBondContact O-N 3.3Å; A854-M858 VanDerWaalsContact O-CB 3.27Å; A854-M858 WeakPolarHBondContact O-CB 3.33Å; A854-M858 PolarHBondContact O-N 2.94Å
855	E	95.8	Very high	95.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-56.5	-40.6	171.9	-70.2	173.8	-102.8	0	0	112.1	T532 A713 T716 A851 L852 M858 L859 M864	T532-E855 WeakPolarHBondContact CG2-OE1 3.28Å; A713-E855 WeakPolarHBondContact CA-OE1 3.39Å; A713-E855 VanDerWaalsContact CB-OE1 3.24Å; A713-E855 WeakPolarHBondContact CB-OE1 3.46Å; T716-E855 WeakPolarHBondContact CB-OE2 3.43Å; T716-E855 HydrophobicContact CG2-CG 4.23Å; T716-E855 WeakPolarHBondContact CG2-OE2 3.49Å; T716-E855 PolarHBondContact OG1-OE2 3.22Å; T716-E855 VanDerWaalsContact OG1-OE2 3.09Å; A851-E855 PolarHBondContact O-N 3.17Å; L852-E855 PolarHBondContact O-N 3.47Å; E855-M858 PolarHBondContact O-N 3.35Å; E855-L859 WeakPolarHBondContact O-CB 3.32Å; E855-L859 WeakPolarHBondContact O-CG 3.43Å; E855-L859 PolarHBondContact O-N 3.31Å; E855-M864 HydrophobicContact CB-CE 3.53Å; E855-M864 HydrophobicContact CG-CE 4.41Å
856	G	95.7	Very high	95.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.1	-40.1	176	0	0	0	0	0	114.7	L852 C853 A854 N860 N861 T865	L852-G856 PolarHBondContact O-N 2.9Å; C853-G856 PolarHBondContact O-N 2.93Å; A854-G856 VanDerWaalsContact C-N 3.26Å; A854-G856 PolarHBondContact O-N 3.22Å; G856-N860 CarbonylContact O-C 3.49Å; G856-N860 WeakPolarHBondContact O-CA 3.04Å; G856-N860 PolarHBondContact O-N 3.49Å; G856-N861 PolarHBondContact O-N 3.14Å; G856-T865 WeakPolarHBondContact CA-OG1 3.35Å
857	F	95.2	Very high	95.9	Very high	33 Å²	33	18.5 Å²	18.5	15%	0.145	9%	0.09	C	C	.	.	H	α-helix	trans	-69.8	-37.1	171.9	-87.2	-81.4	0	0	0	112.5	F492 M495 L496 F499 V744 C853 A854 T865	F492-F857 HydrophobicContact CD2-CD1 4.05Å; F492-F857 HydrophobicContact CD2-CE1 4.07Å; F492-F857 HydrophobicContact CE2-CD1 4.06Å; F492-F857 AromaticContact CE2-CE1 3.9Å; F492-F857 HydrophobicContact CE2-CE1 3.9Å; M495-F857 HydrophobicContact CB-CD1 3.91Å; M495-F857 HydrophobicContact CB-CE1 3.7Å; M495-F857 HydrophobicContact CB-CZ 4.43Å; M495-F857 HydrophobicContact CG-CD1 3.57Å; M495-F857 HydrophobicContact CG-CD2 4.43Å; M495-F857 HydrophobicContact CG-CE1 3.62Å; M495-F857 HydrophobicContact CG-CE2 4.46Å; M495-F857 HydrophobicContact CG-CG 4.01Å; M495-F857 HydrophobicContact CG-CZ 4.08Å; L496-F857 HydrophobicContact CB-CE1 4.4Å; L496-F857 HydrophobicContact CB-CZ 4.48Å; L496-F857 HydrophobicContact CD1-CZ 4.42Å; F499-F857 HydrophobicContact CB-CE2 3.94Å; F499-F857 HydrophobicContact CB-CZ 3.87Å; F499-F857 HydrophobicContact CD2-CE2 4.07Å; F499-F857 AromaticContact CG-CE2 3.93Å; F499-F857 HydrophobicContact CG-CE2 3.93Å; F499-F857 HydrophobicContact CG-CZ 4.18Å; V744-F857 HydrophobicContact CG1-CB 3.83Å; V744-F857 HydrophobicContact CG2-CB 4.27Å; C853-F857 WeakPolarHBondContact O-CD2 3.35Å; C853-F857 PolarHBondContact O-N 3.43Å; A854-F857 PolarHBondContact O-N 3.3Å; F857-T865 HydrophobicContact CE2-CG2 4.3Å
858	M	93.4	Very high	96	Very high	21 Å²	21	14.6 Å²	14.6	10%	0.103	8%	0.075	C	C	.	.	H	α-helix	trans	-68.6	-41.9	-179.1	-176.9	-178.4	72.7	0	0	112.3	T716 C717 N720 M741 V744 A745 A854 E855	T716-M858 HydrophobicContact CG2-CE 3.95Å; C717-M858 HydrophobicContact CB-SD 4.36Å; N720-M858 HydrophobicContact CB-CE 3.48Å; N720-M858 VanDerWaalsContact CB-CE 3.48Å; N720-M858 HydrophobicContact CB-CG 4.38Å; N720-M858 HydrophobicContact CB-SD 3.6Å; N720-M858 VanDerWaalsContact CB-SD 3.6Å; M741-M858 HydrophobicContact CG-CG 4.5Å; V744-M858 HydrophobicContact CG1-CB 3.95Å; A745-M858 HydrophobicContact CB-SD 3.78Å; A854-M858 VanDerWaalsContact O-CB 3.27Å; A854-M858 WeakPolarHBondContact O-CB 3.33Å; A854-M858 PolarHBondContact O-N 2.94Å; E855-M858 PolarHBondContact O-N 3.35Å
859	L	93	Very high	96.1	Very high	33 Å²	33	14.6 Å²	14.6	17%	0.173	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	9.6	-177.4	-63.8	164.6	0	0	0	113.2	G535 L538 T716 N720 E855 N861 M864	G535-L859 VanDerWaalsContact CA-CD1 3.41Å; L538-L859 HydrophobicContact CD1-CD1 4.43Å; T716-L859 HydrophobicContact CG2-CD1 4.18Å; N720-L859 WeakPolarHBondContact OD1-CD2 3.46Å; E855-L859 WeakPolarHBondContact O-CB 3.32Å; E855-L859 WeakPolarHBondContact O-CG 3.43Å; E855-L859 PolarHBondContact O-N 3.31Å; L859-N861 HydrophobicContact CB-CB 4.26Å; L859-N861 PolarHBondContact O-N 2.96Å; L859-N861 VanDerWaalsContact O-N 3.14Å; L859-M864 HydrophobicContact CD1-CE 4.16Å; L859-M864 HydrophobicContact CD1-SD 4.01Å
860	N	92.7	Very high	96.1	Very high	88 Å²	88	14.7 Å²	14.7	47%	0.471	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	38.5	-173.1	-166.5	28.4	0	0	0	113.4	M495 G856	M495-N860 WeakPolarHBondContact CE-OD1 3.32Å; G856-N860 CarbonylContact O-C 3.49Å; G856-N860 WeakPolarHBondContact O-CA 3.04Å; G856-N860 PolarHBondContact O-N 3.49Å
861	N	95.2	Very high	96.1	Very high	5 Å²	5	11.5 Å²	11.5	3%	0.027	6%	0.064	C	C	.	.			trans	-104	110.6	-170.8	-167	-64.9	0	0	0	112	V534 G856 L859 L863 M864 T865	V534-N861 WeakPolarHBondContact CG1-ND2 3.45Å; G856-N861 PolarHBondContact O-N 3.14Å; L859-N861 HydrophobicContact CB-CB 4.26Å; L859-N861 PolarHBondContact O-N 2.96Å; L859-N861 VanDerWaalsContact O-N 3.14Å; N861-L863 WeakPolarHBondContact OD1-CB 3.36Å; N861-L863 PolarHBondContact OD1-N 3.49Å; N861-L863 VanDerWaalsContact OD1-N 3.16Å; N861-M864 HydrophobicContact CB-CB 4.18Å; N861-M864 HydrophobicContact CB-CG 4.1Å; N861-M864 HydrophobicContact CB-SD 3.88Å; N861-M864 WeakPolarHBondContact OD1-CG 3.47Å; N861-M864 PolarHBondContact OD1-N 3.5Å; N861-T865 PolarHBondContact O-N 3.32Å; N861-T865 PolarHBondContact O-OG1 2.82Å
862	S	95.9	Very high	96.1	Very high	24 Å²	24	11.5 Å²	11.5	17%	0.168	6%	0.064	C	C	.	.	H	α-helix	trans	-61.8	-43.9	-178.6	52.4	0	0	0	0	112.9	Q620 T865 V866	Q620-S862 PolarHBondContact OE1-OG 3.02Å; S862-T865 PolarHBondContact O-N 3.17Å; S862-V866 WeakPolarHBondContact O-CG2 3.22Å; S862-V866 PolarHBondContact O-N 2.87Å
863	L	97.2	Very high	96.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-48.2	179.2	170.6	62.6	0	0	0	112	I531 Y623 S626 S627 G657 N861 T865 V866 V867	I531-L863 HydrophobicContact CD1-CD2 3.99Å; I531-L863 HydrophobicContact CG1-CD2 3.97Å; I531-L863 HydrophobicContact CG1-CG 4.21Å; Y623-L863 HydrophobicContact CD1-CB 3.99Å; Y623-L863 HydrophobicContact CD1-CD2 3.77Å; Y623-L863 HydrophobicContact CE1-CD2 4.23Å; Y623-L863 HydrophobicContact CG-CB 4.01Å; S626-L863 VanDerWaalsContact OG-CD1 3.24Å; S626-L863 WeakPolarHBondContact OG-CD1 3.27Å; S626-L863 WeakPolarHBondContact OG-CD2 3.5Å; S627-L863 VanDerWaalsContact OG-CD1 3.3Å; S627-L863 WeakPolarHBondContact OG-CD1 3.38Å; G657-L863 VanDerWaalsContact CA-CD2 3.5Å; N861-L863 WeakPolarHBondContact OD1-CB 3.36Å; N861-L863 PolarHBondContact OD1-N 3.49Å; N861-L863 VanDerWaalsContact OD1-N 3.16Å; L863-T865 VanDerWaalsContact C-N 3.33Å; L863-T865 PolarHBondContact O-N 2.93Å; L863-V866 PolarHBondContact O-N 3.38Å; L863-V867 HydrophobicContact CD1-CG2 3.68Å; L863-V867 HydrophobicContact CG-CG2 4.49Å; L863-V867 WeakPolarHBondContact O-CB 3.27Å; L863-V867 WeakPolarHBondContact O-CG2 3.33Å; L863-V867 PolarHBondContact O-N 2.69Å
864	M	97.5	Very high	96	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.7	-42.1	179.3	-64.7	175.7	82.6	0	0	111	V534 L852 E855 L859 N861 G868	V534-M864 HydrophobicContact CB-CG 4.22Å; V534-M864 HydrophobicContact CB-SD 3.87Å; V534-M864 HydrophobicContact CG1-CG 4.16Å; V534-M864 HydrophobicContact CG1-SD 3.65Å; L852-M864 HydrophobicContact CD1-CB 3.9Å; L852-M864 HydrophobicContact CD1-CE 3.6Å; L852-M864 HydrophobicContact CD1-CG 4.06Å; L852-M864 HydrophobicContact CG-CB 4.41Å; E855-M864 HydrophobicContact CB-CE 3.53Å; E855-M864 HydrophobicContact CG-CE 4.41Å; L859-M864 HydrophobicContact CD1-CE 4.16Å; L859-M864 HydrophobicContact CD1-SD 4.01Å; N861-M864 HydrophobicContact CB-CB 4.18Å; N861-M864 HydrophobicContact CB-CG 4.1Å; N861-M864 HydrophobicContact CB-SD 3.88Å; N861-M864 WeakPolarHBondContact OD1-CG 3.47Å; N861-M864 PolarHBondContact OD1-N 3.5Å; M864-G868 WeakPolarHBondContact O-CA 3.24Å; M864-G868 PolarHBondContact O-N 3.14Å
865	T	97.6	Very high	95.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-65.6	-40.6	176.3	-61	0	0	0	0	113.3	M495 F499 G856 F857 N861 S862 L863 A869	M495-T865 HydrophobicContact CG-CG2 4.17Å; M495-T865 VanDerWaalsContact SD-CB 3.59Å; M495-T865 HydrophobicContact SD-CG2 3.82Å; M495-T865 PolarHBondContact SD-OG1 3.4Å; F499-T865 HydrophobicContact CB-CG2 3.71Å; F499-T865 HydrophobicContact CD2-CG2 4.18Å; F499-T865 HydrophobicContact CG-CG2 4.45Å; G856-T865 WeakPolarHBondContact CA-OG1 3.35Å; F857-T865 HydrophobicContact CE2-CG2 4.3Å; N861-T865 PolarHBondContact O-N 3.32Å; N861-T865 PolarHBondContact O-OG1 2.82Å; S862-T865 PolarHBondContact O-N 3.17Å; L863-T865 VanDerWaalsContact C-N 3.33Å; L863-T865 PolarHBondContact O-N 2.93Å; T865-A869 WeakPolarHBondContact O-CB 3.25Å; T865-A869 PolarHBondContact O-N 2.94Å
866	V	97.9	Very high	95.7	Very high	18 Å²	18	13.4 Å²	13.4	11%	0.109	8%	0.079	C	C	.	.	H	α-helix	trans	-68.3	-46	177.5	175	0	0	0	0	111.3	T498 I631 S862 L863 L870	T498-V866 HydrophobicContact CG2-CG2 3.59Å; I631-V866 HydrophobicContact CD1-CG1 3.91Å; I631-V866 HydrophobicContact CG1-CG1 4.48Å; S862-V866 WeakPolarHBondContact O-CG2 3.22Å; S862-V866 PolarHBondContact O-N 2.87Å; L863-V866 PolarHBondContact O-N 3.38Å; V866-L870 WeakPolarHBondContact O-CB 3.45Å; V866-L870 PolarHBondContact O-N 3.41Å; V866-L870 VanDerWaalsContact O-N 3.15Å
867	V	97.6	Very high	95.6	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-68.9	-40.5	-179.6	171.8	0	0	0	0	111.6	I528 I531 C630 L852 L863 A869 L870 I871	I528-V867 HydrophobicContact CG2-CG1 3.4Å; I528-V867 HydrophobicContact CG2-CG2 4.4Å; I531-V867 HydrophobicContact CG2-CB 4.2Å; I531-V867 HydrophobicContact CG2-CG1 3.75Å; C630-V867 HydrophobicContact CB-CG2 3.98Å; L852-V867 HydrophobicContact CD2-CB 4.21Å; L852-V867 HydrophobicContact CD2-CG1 3.75Å; L863-V867 HydrophobicContact CD1-CG2 3.68Å; L863-V867 HydrophobicContact CG-CG2 4.49Å; L863-V867 WeakPolarHBondContact O-CB 3.27Å; L863-V867 WeakPolarHBondContact O-CG2 3.33Å; L863-V867 PolarHBondContact O-N 2.69Å; V867-A869 PolarHBondContact O-N 2.72Å; V867-L870 WeakPolarHBondContact O-CB 3.5Å; V867-L870 PolarHBondContact O-N 2.9Å; V867-I871 HydrophobicContact CG1-CD1 3.59Å; V867-I871 HydrophobicContact CG1-CG1 4.4Å; V867-I871 VanDerWaalsContact O-CG1 3.29Å; V867-I871 WeakPolarHBondContact O-CG1 3.16Å; V867-I871 PolarHBondContact O-N 3.49Å
868	G	97.1	Very high	95.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-59	-47	175.8	0	0	0	0	0	112.2	G849 C853 M864 L870 I871 G872	G849-G868 CarbonylContact C-O 3.5Å; G849-G868 VanDerWaalsContact C-O 3.31Å; G849-G868 VanDerWaalsContact CA-O 3.27Å; G849-G868 WeakPolarHBondContact CA-O 3.26Å; G849-G868 CarbonylContact O-C 3.53Å; G849-G868 WeakPolarHBondContact O-CA 3.08Å; C853-G868 VanDerWaalsContact SG-CA 3.59Å; M864-G868 WeakPolarHBondContact O-CA 3.24Å; M864-G868 PolarHBondContact O-N 3.14Å; G868-L870 PolarHBondContact O-N 3.19Å; G868-I871 PolarHBondContact O-N 3.38Å; G868-G872 PolarHBondContact O-N 3.41Å
869	A	97.6	Very high	95.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-66.3	-38.6	179.6	0	0	0	0	0	112.2	F499 S502 W850 C853 T865 V867 G872 S873	F499-A869 HydrophobicContact CD2-CB 4.19Å; F499-A869 HydrophobicContact CE2-CB 4.27Å; S502-A869 WeakPolarHBondContact OG-CB 3.32Å; W850-A869 HydrophobicContact CZ3-CB 4.46Å; C853-A869 PolarHBondContact SG-N 2.97Å; T865-A869 WeakPolarHBondContact O-CB 3.25Å; T865-A869 PolarHBondContact O-N 2.94Å; V867-A869 PolarHBondContact O-N 2.72Å; A869-G872 PolarHBondContact O-N 3.34Å; A869-S873 WeakPolarHBondContact O-CB 3.46Å; A869-S873 PolarHBondContact O-N 2.94Å; A869-S873 PolarHBondContact O-OG 2.93Å
870	L	96.8	Very high	95.4	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-59.8	-45.4	174.6	179.6	62.5	0	0	0	112	T509 I631 L634 V866 V867 G868 S874	T509-L870 HydrophobicContact CG2-CD1 4.31Å; I631-L870 HydrophobicContact CG1-CD2 3.96Å; L634-L870 HydrophobicContact CD1-CD2 4.14Å; L634-L870 HydrophobicContact CD2-CD1 3.85Å; L634-L870 HydrophobicContact CD2-CD2 4.39Å; L634-L870 HydrophobicContact CD2-CG 3.91Å; V866-L870 WeakPolarHBondContact O-CB 3.45Å; V866-L870 PolarHBondContact O-N 3.41Å; V866-L870 VanDerWaalsContact O-N 3.15Å; V867-L870 WeakPolarHBondContact O-CB 3.5Å; V867-L870 PolarHBondContact O-N 2.9Å; G868-L870 PolarHBondContact O-N 3.19Å; L870-S874 WeakPolarHBondContact O-CB 3.37Å; L870-S874 PolarHBondContact O-N 3.11Å; L870-S874 VanDerWaalsContact O-N 3.11Å
871	I	96.6	Very high	95.3	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-71.7	-42.8	178	-66.3	166.3	0	0	0	111	T525 I528 N845 L852 V867 G868 S873 S874 G875	T525-I871 HydrophobicContact CG2-CG1 4.21Å; I528-I871 HydrophobicContact CG2-CD1 4.34Å; N845-I871 WeakPolarHBondContact O-CG2 3.35Å; L852-I871 HydrophobicContact CD2-CD1 4.35Å; V867-I871 HydrophobicContact CG1-CD1 3.59Å; V867-I871 HydrophobicContact CG1-CG1 4.4Å; V867-I871 VanDerWaalsContact O-CG1 3.29Å; V867-I871 WeakPolarHBondContact O-CG1 3.16Å; V867-I871 PolarHBondContact O-N 3.49Å; G868-I871 PolarHBondContact O-N 3.38Å; I871-S873 PolarHBondContact O-N 3.34Å; I871-S874 WeakPolarHBondContact O-CB 3.31Å; I871-S874 PolarHBondContact O-N 2.91Å; I871-S874 VanDerWaalsContact O-N 3.1Å; I871-G875 PolarHBondContact O-N 3.4Å
872	G	96.2	Very high	95.1	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-56.9	-50.9	177.3	0	0	0	0	0	111.9	S846 G868 A869 S874 A876	S846-G872 WeakPolarHBondContact O-CA 3.47Å; S846-G872 PolarHBondContact OG-O 3.09Å; G868-G872 PolarHBondContact O-N 3.41Å; A869-G872 PolarHBondContact O-N 3.34Å; G872-S874 VanDerWaalsContact C-N 3.33Å; G872-S874 PolarHBondContact O-N 3.19Å; G872-A876 WeakPolarHBondContact O-CB 3.15Å; G872-A876 PolarHBondContact O-N 3.5Å; G872-A876 VanDerWaalsContact O-N 3.07Å
873	S	95.6	Very high	94.8	Very high	15 Å²	15	13.1 Å²	13.1	11%	0.105	7%	0.069	C	C	.	.	H	α-helix	trans	-60.6	-39.3	173.3	-71.6	0	0	0	0	112.4	S503 A869 I871 A876 I877	S503-S873 PolarHBondContact O-OG 2.7Å; A869-S873 WeakPolarHBondContact O-CB 3.46Å; A869-S873 PolarHBondContact O-N 2.94Å; A869-S873 PolarHBondContact O-OG 2.93Å; I871-S873 PolarHBondContact O-N 3.34Å; S873-A876 PolarHBondContact O-N 3.19Å; S873-I877 WeakPolarHBondContact O-CB 3.33Å; S873-I877 WeakPolarHBondContact O-CG1 3.48Å; S873-I877 PolarHBondContact O-N 3.38Å
874	S	94.7	Very high	94.4	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.5	-53.3	177.9	-173.4	0	0	0	0	112.7	L870 I871 G872 A876 I877 L878	L870-S874 WeakPolarHBondContact O-CB 3.37Å; L870-S874 PolarHBondContact O-N 3.11Å; L870-S874 VanDerWaalsContact O-N 3.11Å; I871-S874 WeakPolarHBondContact O-CB 3.31Å; I871-S874 PolarHBondContact O-N 2.91Å; I871-S874 VanDerWaalsContact O-N 3.1Å; G872-S874 VanDerWaalsContact C-N 3.33Å; G872-S874 PolarHBondContact O-N 3.19Å; S874-A876 VanDerWaalsContact C-N 3.31Å; S874-A876 PolarHBondContact O-N 3.5Å; S874-I877 PolarHBondContact O-N 3.47Å; S874-L878 WeakPolarHBondContact O-CB 3.18Å; S874-L878 WeakPolarHBondContact O-CG 3.31Å; S874-L878 PolarHBondContact O-N 2.84Å
875	G	93	Very high	93.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.6	-37.8	176.6	0	0	0	0	0	113	T842 I871 S879	T842-G875 CarbonylContact O-C 3.58Å; T842-G875 WeakPolarHBondContact O-CA 3.48Å; I871-G875 PolarHBondContact O-N 3.4Å; G875-S879 WeakPolarHBondContact O-CB 3.27Å; G875-S879 PolarHBondContact O-N 3.47Å; G875-S879 PolarHBondContact O-OG 2.87Å
876	A	94	Very high	93.2	Very high	42 Å²	42	21.5 Å²	21.5	35%	0.347	11%	0.108	S	C	.	.	H	α-helix	trans	-66.5	-45.8	179	0	0	0	0	0	112.5	S846 G872 S873 S874 S879 Y880	S846-A876 PolarHBondContact OG-N 2.98Å; G872-A876 WeakPolarHBondContact O-CB 3.15Å; G872-A876 PolarHBondContact O-N 3.5Å; G872-A876 VanDerWaalsContact O-N 3.07Å; S873-A876 PolarHBondContact O-N 3.19Å; S874-A876 VanDerWaalsContact C-N 3.31Å; S874-A876 PolarHBondContact O-N 3.5Å; A876-S879 PolarHBondContact O-N 2.97Å; A876-Y880 PolarHBondContact O-N 3.1Å
877	I	93.9	Very high	92.6	Very high	12 Å²	12	22 Å²	22	6%	0.062	11%	0.11	C	C	.	.	H	α-helix	trans	-67.1	-44.1	179.1	-71.4	163.9	0	0	0	110.8	Y507 V510 W511 S873 S874 S879 Y880 I881	Y507-I877 HydrophobicContact CD2-CD1 3.87Å; Y507-I877 HydrophobicContact CD2-CG1 4.47Å; Y507-I877 HydrophobicContact CE2-CD1 4.5Å; Y507-I877 HydrophobicContact CG-CD1 4.33Å; V510-I877 HydrophobicContact CB-CD1 3.93Å; V510-I877 HydrophobicContact CG1-CB 3.87Å; V510-I877 HydrophobicContact CG1-CD1 4.03Å; V510-I877 HydrophobicContact CG1-CG2 3.77Å; W511-I877 HydrophobicContact CD2-CG2 3.97Å; W511-I877 HydrophobicContact CE3-CG2 4.42Å; W511-I877 HydrophobicContact CG-CD1 4.42Å; W511-I877 HydrophobicContact CG-CG2 4.4Å; W511-I877 HydrophobicContact CH2-CG2 4.4Å; W511-I877 HydrophobicContact CZ2-CG2 3.95Å; S873-I877 WeakPolarHBondContact O-CB 3.33Å; S873-I877 WeakPolarHBondContact O-CG1 3.48Å; S873-I877 PolarHBondContact O-N 3.38Å; S874-I877 PolarHBondContact O-N 3.47Å; I877-S879 VanDerWaalsContact C-N 3.32Å; I877-S879 PolarHBondContact O-N 3.22Å; I877-Y880 PolarHBondContact O-N 3.28Å; I877-I881 HydrophobicContact CG2-CD1 3.73Å; I877-I881 HydrophobicContact CG2-CG1 4.35Å; I877-I881 WeakPolarHBondContact O-CG1 3.45Å; I877-I881 PolarHBondContact O-N 2.88Å
878	L	91.9	Very high	92	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-59.7	-42.6	175	-71.2	173.8	0	0	0	111.7	H518 L521 M522 T842 S874 Y880 I881 M882	H518-L878 HydrophobicContact CB-CD2 3.93Å; L521-L878 HydrophobicContact CD2-CD1 4.02Å; L521-L878 HydrophobicContact CD2-CD2 4.26Å; L521-L878 HydrophobicContact CD2-CG 4.32Å; L521-L878 HydrophobicContact CG-CD1 4.43Å; M522-L878 HydrophobicContact CG-CD1 3.68Å; M522-L878 HydrophobicContact SD-CD1 3.67Å; T842-L878 HydrophobicContact CG2-CB 3.69Å; T842-L878 HydrophobicContact CG2-CD1 4.44Å; S874-L878 WeakPolarHBondContact O-CB 3.18Å; S874-L878 WeakPolarHBondContact O-CG 3.31Å; S874-L878 PolarHBondContact O-N 2.84Å; L878-Y880 VanDerWaalsContact C-N 3.35Å; L878-Y880 PolarHBondContact O-N 3.14Å; L878-I881 PolarHBondContact O-N 2.67Å; L878-M882 WeakPolarHBondContact O-CG 3.47Å; L878-M882 PolarHBondContact O-N 3.13Å
879	S	93.1	Very high	91.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.014	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-43.7	175	-56	0	0	0	0	111.9	T842 V843 G875 A876 I877 M882 C883	T842-S879 VanDerWaalsContact C-OG 3.22Å; T842-S879 VanDerWaalsContact CB-OG 3.28Å; T842-S879 WeakPolarHBondContact CB-OG 3.47Å; T842-S879 WeakPolarHBondContact OG1-CA 3.31Å; T842-S879 PolarHBondContact OG1-OG 3.44Å; V843-S879 WeakPolarHBondContact CG2-OG 3.45Å; V843-S879 PolarHBondContact N-OG 3.4Å; V843-S879 VanDerWaalsContact N-OG 3.16Å; G875-S879 WeakPolarHBondContact O-CB 3.27Å; G875-S879 PolarHBondContact O-N 3.47Å; G875-S879 PolarHBondContact O-OG 2.87Å; A876-S879 PolarHBondContact O-N 2.97Å; I877-S879 VanDerWaalsContact C-N 3.32Å; I877-S879 PolarHBondContact O-N 3.22Å; S879-M882 PolarHBondContact O-N 3.44Å; S879-C883 WeakPolarHBondContact O-CB 3.12Å; S879-C883 PolarHBondContact O-N 3.49Å
880	Y	92.4	Very high	91	Very high	130 Å²	130	29.2 Å²	29.2	51%	0.51	15%	0.149	S	C	.	.	H	α-helix	trans	-63.4	-44.2	176.3	174.6	-97.7	0	0	0	112.4	W511 A876 I877 L878 C883 K884	W511-Y880 HydrophobicContact CH2-CD1 4.02Å; W511-Y880 HydrophobicContact CH2-CE1 4.12Å; W511-Y880 HydrophobicContact CZ2-CD1 4.01Å; W511-Y880 HydrophobicContact CZ2-CE1 4.24Å; A876-Y880 PolarHBondContact O-N 3.1Å; I877-Y880 PolarHBondContact O-N 3.28Å; L878-Y880 VanDerWaalsContact C-N 3.35Å; L878-Y880 PolarHBondContact O-N 3.14Å; Y880-C883 PolarHBondContact O-N 2.96Å; Y880-K884 HydrophobicContact CE1-CD 4.24Å; Y880-K884 WeakPolarHBondContact O-CB 3.5Å; Y880-K884 PolarHBondContact O-N 3.19Å
881	I	89.7	Confident	90.5	Very high	38 Å²	38	33 Å²	33	20%	0.195	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-47	177.7	-69.6	167.2	0	0	0	110.6	W511 I877 L878 K884 A885	W511-I881 HydrophobicContact CE3-CD1 4.37Å; W511-I881 HydrophobicContact CH2-CD1 4.11Å; W511-I881 HydrophobicContact CH2-CG1 3.79Å; W511-I881 HydrophobicContact CZ3-CD1 3.83Å; W511-I881 HydrophobicContact CZ3-CG1 3.93Å; I877-I881 HydrophobicContact CG2-CD1 3.73Å; I877-I881 HydrophobicContact CG2-CG1 4.35Å; I877-I881 WeakPolarHBondContact O-CG1 3.45Å; I877-I881 PolarHBondContact O-N 2.88Å; L878-I881 PolarHBondContact O-N 2.67Å; I881-K884 PolarHBondContact O-N 2.92Å; I881-A885 WeakPolarHBondContact O-CB 3.43Å; I881-A885 PolarHBondContact O-N 2.9Å
882	M	89.9	Confident	89.8	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.039	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-48.2	176.5	-63.3	-152.1	83.2	0	0	112.1	P838 V839 T842 L878 S879 K884 A885 M886 V971 P976	P838-M882 HydrophobicContact CB-CE 3.59Å; P838-M882 HydrophobicContact CB-SD 3.7Å; P838-M882 HydrophobicContact CG-CE 4.47Å; V839-M882 HydrophobicContact CG2-CB 3.85Å; V839-M882 HydrophobicContact CG2-SD 4.16Å; T842-M882 HydrophobicContact CG2-SD 4.49Å; L878-M882 WeakPolarHBondContact O-CG 3.47Å; L878-M882 PolarHBondContact O-N 3.13Å; S879-M882 PolarHBondContact O-N 3.44Å; M882-K884 VanDerWaalsContact C-N 3.33Å; M882-K884 PolarHBondContact O-N 3.3Å; M882-A885 PolarHBondContact O-N 3.19Å; M882-M886 WeakPolarHBondContact O-CG 3.33Å; M882-M886 PolarHBondContact O-N 3.38Å; M882-M886 VanDerWaalsContact O-N 3.08Å; M882-V971 HydrophobicContact CB-CG1 4.32Å; M882-V971 HydrophobicContact CE-CB 3.91Å; M882-V971 HydrophobicContact CE-CG1 3.59Å; M882-P976 HydrophobicContact CE-CG 4.37Å; M882-P976 HydrophobicContact CG-CG 4.1Å; M882-P976 HydrophobicContact SD-CG 3.61Å
883	C	90.2	Very high	89.2	Confident	6 Å²	6	34.6 Å²	34.6	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-55.8	-45.4	177.1	-86.9	0	0	0	0	112.5	S879 Y880 M886 N887 R888	S879-C883 WeakPolarHBondContact O-CB 3.12Å; S879-C883 PolarHBondContact O-N 3.49Å; Y880-C883 PolarHBondContact O-N 2.96Å; C883-M886 PolarHBondContact O-N 3.2Å; C883-N887 PolarHBondContact O-N 3.22Å; C883-N887 VanDerWaalsContact O-N 3.17Å; C883-R888 CarbonylContact C-O 3.6Å; C883-R888 WeakPolarHBondContact CA-O 3.27Å; C883-R888 WeakPolarHBondContact CB-O 3.49Å; C883-R888 PolarHBondContact O-N 3.3Å; C883-R888 VanDerWaalsContact O-O 3.07Å
884	K	88.9	Confident	88.7	Confident	139 Å²	139	35.5 Å²	35.5	60%	0.604	19%	0.186	S	C	*	.	H	α-helix	trans	-62.5	-46	176.4	-173.5	-175.3	176.3	-168.2	0	111.5	Y880 I881 M882 M886 N887	Y880-K884 HydrophobicContact CE1-CD 4.24Å; Y880-K884 WeakPolarHBondContact O-CB 3.5Å; Y880-K884 PolarHBondContact O-N 3.19Å; I881-K884 PolarHBondContact O-N 2.92Å; M882-K884 VanDerWaalsContact C-N 3.33Å; M882-K884 PolarHBondContact O-N 3.3Å; K884-M886 PolarHBondContact O-N 3.11Å; K884-N887 PolarHBondContact O-N 3.28Å; K884-N887 VanDerWaalsContact O-N 3.1Å
885	A	85.8	Confident	88.1	Confident	9 Å²	9	39.3 Å²	39.3	7%	0.074	21%	0.206	C	C	.	.	H	α-helix	trans	-69.1	-7.8	178.1	0	0	0	0	0	114.4	I881 M882 P970 V971	I881-A885 WeakPolarHBondContact O-CB 3.43Å; I881-A885 PolarHBondContact O-N 2.9Å; M882-A885 PolarHBondContact O-N 3.19Å; A885-P970 HydrophobicContact CB-CB 3.96Å; A885-P970 HydrophobicContact CB-CG 4.42Å; A885-V971 HydrophobicContact CB-CG1 3.9Å
886	M	83.6	Confident	86.9	Confident	27 Å²	27	40.5 Å²	40.5	13%	0.133	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	0.2	172.5	-64.4	172.8	77	0	0	113.1	D836 V839 M882 C883 K884 R888 T900 V971	D836-M886 WeakPolarHBondContact OD1-CE 3.31Å; V839-M886 HydrophobicContact CG2-SD 4.17Å; M882-M886 WeakPolarHBondContact O-CG 3.33Å; M882-M886 PolarHBondContact O-N 3.38Å; M882-M886 VanDerWaalsContact O-N 3.08Å; C883-M886 PolarHBondContact O-N 3.2Å; K884-M886 PolarHBondContact O-N 3.11Å; M886-R888 PolarHBondContact O-N 2.99Å; M886-T900 WeakPolarHBondContact O-CG2 3.27Å; M886-V971 HydrophobicContact CG-CB 4.37Å; M886-V971 HydrophobicContact CG-CG1 3.9Å; M886-V971 HydrophobicContact CG-CG2 3.97Å; M886-V971 HydrophobicContact SD-CG1 4.28Å
887	N	85.3	Confident	85.6	Confident	29 Å²	29	39.8 Å²	39.8	16%	0.155	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.1	42.6	-168.1	-168.1	33.9	0	0	0	113.7	C883 K884 T900 T901 S902 A1031 G1032 M1033	C883-N887 PolarHBondContact O-N 3.22Å; C883-N887 VanDerWaalsContact O-N 3.17Å; K884-N887 PolarHBondContact O-N 3.28Å; K884-N887 VanDerWaalsContact O-N 3.1Å; N887-T900 HydrophobicContact CB-CG2 3.97Å; N887-T900 CarbonylContact O-C 3.6Å; N887-T900 VanDerWaalsContact O-CA 3.29Å; N887-T900 WeakPolarHBondContact O-CA 3.49Å; N887-T900 WeakPolarHBondContact O-CB 3.17Å; N887-T900 WeakPolarHBondContact O-CG2 3.33Å; N887-T901 PolarHBondContact O-N 3.15Å; N887-T901 PolarHBondContact O-OG1 3.32Å; N887-T901 VanDerWaalsContact O-OG1 3.1Å; N887-T901 PolarHBondContact OD1-OG1 3.39Å; N887-S902 WeakPolarHBondContact ND2-CB 3.49Å; N887-S902 PolarHBondContact ND2-OG 3.26Å; N887-A1031 PolarHBondContact ND2-O 3.21Å; N887-G1032 WeakPolarHBondContact CB-O 3.45Å; N887-G1032 WeakPolarHBondContact ND2-CA 3.45Å; N887-G1032 PolarHBondContact ND2-O 3.4Å; N887-M1033 HydrophobicContact CB-CB 4.46Å
888	R	85.1	Confident	84	Confident	35 Å²	35	47.6 Å²	47.6	13%	0.132	25%	0.245	C	C	.	.			trans	-129.1	132.9	176.6	-72.7	178.3	77.8	-154.1	1.4	110.2	D836 C883 M886 V893 G897 G899 T900	D836-R888 IonicContact OD1-CZ 3.23Å; D836-R888 IonicContact OD1-NH1 3.59Å; D836-R888 PolarHBondContact OD1-NH1 2.96Å; D836-R888 IonicContact OD2-CZ 3.03Å; D836-R888 IonicContact OD2-NH1 2.79Å; D836-R888 PolarHBondContact OD2-NH1 3.47Å; D836-R888 IonicContact OD2-NH2 2.71Å; C883-R888 CarbonylContact C-O 3.6Å; C883-R888 WeakPolarHBondContact CA-O 3.27Å; C883-R888 WeakPolarHBondContact CB-O 3.49Å; C883-R888 PolarHBondContact O-N 3.3Å; C883-R888 VanDerWaalsContact O-O 3.07Å; M886-R888 PolarHBondContact O-N 2.99Å; R888-V893 HydrophobicContact CB-CG2 4.02Å; R888-G897 PolarHBondContact NH2-O 3.17Å; R888-G899 PolarHBondContact NE-O 3.41Å; R888-T900 HydrophobicContact CG-CG2 4.23Å
889	S	87.6	Confident	82.6	Confident	52 Å²	52	47.7 Å²	47.7	36%	0.364	25%	0.247	S	C	.	.			trans	-71.9	149.6	174.9	63.8	0	0	0	0	111.5	N892 V893	S889-N892 WeakPolarHBondContact O-CA 3.41Å; S889-N892 VanDerWaalsContact O-CB 3.32Å; S889-N892 WeakPolarHBondContact O-CB 3.35Å; S889-N892 PolarHBondContact O-N 3.23Å; S889-N892 WeakPolarHBondContact OG-CB 3.37Å; S889-V893 PolarHBondContact O-N 3.14Å; S889-V893 VanDerWaalsContact O-N 3.13Å
890	L	86.6	Confident	81.2	Confident	64 Å²	64	48.2 Å²	48.2	34%	0.335	25%	0.25	S	C	.	.	H	α-helix	trans	-55.5	-40.6	-178.7	-173.2	63.8	0	0	0	113.8	V839 V843 N892 V893 I894	V839-L890 HydrophobicContact CG1-CD1 3.86Å; V843-L890 HydrophobicContact CG2-CD1 3.77Å; L890-N892 VanDerWaalsContact C-N 3.34Å; L890-N892 PolarHBondContact O-N 2.87Å; L890-V893 PolarHBondContact O-N 3.35Å; L890-I894 HydrophobicContact CD1-CD1 3.93Å; L890-I894 HydrophobicContact CD1-CG1 4.23Å; L890-I894 HydrophobicContact CD2-CD1 4.41Å; L890-I894 HydrophobicContact CG-CD1 3.82Å; L890-I894 HydrophobicContact CG-CG1 4.44Å; L890-I894 WeakPolarHBondContact O-CG1 3.45Å; L890-I894 PolarHBondContact O-N 2.93Å
891	P	85.7	Confident	80	Confident	82 Å²	82	46.1 Å²	46.1	53%	0.532	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-34	173.6	-22.5	35.2	0	0	0	113.6	V893 L895	P891-V893 VanDerWaalsContact C-N 3.32Å; P891-L895 VanDerWaalsContact O-CB 3.26Å; P891-L895 WeakPolarHBondContact O-CB 3.37Å; P891-L895 WeakPolarHBondContact O-CG 3.27Å; P891-L895 PolarHBondContact O-N 3.49Å
892	N	83.1	Confident	79	Confident	33 Å²	33	46.5 Å²	46.5	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-35.9	177.2	-172.6	28.2	0	0	0	111.4	S889 L890 G896 G897 G899	S889-N892 WeakPolarHBondContact O-CA 3.41Å; S889-N892 VanDerWaalsContact O-CB 3.32Å; S889-N892 WeakPolarHBondContact O-CB 3.35Å; S889-N892 PolarHBondContact O-N 3.23Å; S889-N892 WeakPolarHBondContact OG-CB 3.37Å; L890-N892 VanDerWaalsContact C-N 3.34Å; L890-N892 PolarHBondContact O-N 2.87Å; N892-G896 PolarHBondContact O-N 3.02Å; N892-G897 PolarHBondContact O-N 2.89Å; N892-G897 WeakPolarHBondContact OD1-CA 3.18Å; N892-G897 PolarHBondContact OD1-O 3.24Å; N892-G899 PolarHBondContact ND2-O 3.38Å
893	V	84.1	Confident	77.9	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-55.8	172.6	178.8	0	0	0	0	111	D836 V839 R888 S889 L890 P891 L895 G896	D836-V893 HydrophobicContact CB-CG1 3.98Å; V839-V893 HydrophobicContact CB-CG1 4.12Å; V839-V893 HydrophobicContact CG1-CG1 4.17Å; V839-V893 HydrophobicContact CG2-CG1 4.43Å; R888-V893 HydrophobicContact CB-CG2 4.02Å; S889-V893 PolarHBondContact O-N 3.14Å; S889-V893 VanDerWaalsContact O-N 3.13Å; L890-V893 PolarHBondContact O-N 3.35Å; P891-V893 VanDerWaalsContact C-N 3.32Å; V893-L895 PolarHBondContact O-N 3.27Å; V893-G896 PolarHBondContact O-N 2.83Å
894	I	84.4	Confident	76.7	Confident	34 Å²	34	52.8 Å²	52.8	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-37.7	-173	-66.7	175.1	0	0	0	112.6	L828 V843 L890 G896	L828-I894 HydrophobicContact CD2-CG2 4.15Å; V843-I894 HydrophobicContact CG1-CD1 4.32Å; V843-I894 HydrophobicContact CG2-CD1 4.23Å; L890-I894 HydrophobicContact CD1-CD1 3.93Å; L890-I894 HydrophobicContact CD1-CG1 4.23Å; L890-I894 HydrophobicContact CD2-CD1 4.41Å; L890-I894 HydrophobicContact CG-CD1 3.82Å; L890-I894 HydrophobicContact CG-CG1 4.44Å; L890-I894 WeakPolarHBondContact O-CG1 3.45Å; L890-I894 PolarHBondContact O-N 2.93Å; I894-G896 VanDerWaalsContact C-N 3.32Å
895	L	82	Confident	75.5	Confident	80 Å²	80	48.8 Å²	48.8	42%	0.419	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.7	-179.6	-58.8	175.5	0	0	0	113.3	R780 L828 P891 V893	R780-L895 PolarHBondContact NE-O 3.21Å; R780-L895 PolarHBondContact NH2-O 3.43Å; L828-L895 HydrophobicContact CD2-CD2 4.43Å; P891-L895 VanDerWaalsContact O-CB 3.26Å; P891-L895 WeakPolarHBondContact O-CB 3.37Å; P891-L895 WeakPolarHBondContact O-CG 3.27Å; P891-L895 PolarHBondContact O-N 3.49Å; V893-L895 PolarHBondContact O-N 3.27Å
896	G	68	Low	74.7	Confident	25 Å²	25	49.8 Å²	49.8	26%	0.258	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	46.5	-179.9	0	0	0	0	0	113.3	R780 N892 V893 I894	R780-G896 PolarHBondContact NH2-O 2.91Å; N892-G896 PolarHBondContact O-N 3.02Å; V893-G896 PolarHBondContact O-N 2.83Å; I894-G896 VanDerWaalsContact C-N 3.32Å
897	G	66.6	Low	74.1	Confident	27 Å²	27	58.1 Å²	58.1	28%	0.278	34%	0.335	S	S	.	.			trans	-84.2	161.4	173.3	0	0	0	0	0	112.7	R888 N892	R888-G897 PolarHBondContact NH2-O 3.17Å; N892-G897 PolarHBondContact O-N 2.89Å; N892-G897 WeakPolarHBondContact OD1-CA 3.18Å; N892-G897 PolarHBondContact OD1-O 3.24Å
898	Y	60.8	Low	73.3	Confident	176 Å²	176	59 Å²	59	69%	0.69	34%	0.344	S	S	*	.			trans	-101.8	134.4	-167.1	-166.7	-94.8	0	0	0	111.9	I1029	Y898-I1029 HydrophobicContact CE1-CD1 4.23Å; Y898-I1029 HydrophobicContact CE1-CG1 4.31Å; Y898-I1029 VanDerWaalsContact OH-CD1 3.28Å; Y898-I1029 WeakPolarHBondContact OH-CD1 3.42Å
899	G	60.8	Low	72.8	Confident	5 Å²	5	61.6 Å²	61.6	5%	0.052	36%	0.359	C	S	.	.	S	Bend	trans	80	175.3	178.4	0	0	0	0	0	115.7	R888 N892	R888-G899 PolarHBondContact NE-O 3.41Å; N892-G899 PolarHBondContact ND2-O 3.38Å
900	T	64.8	Low	72.1	Confident	12 Å²	12	64.9 Å²	64.9	7%	0.074	38%	0.376	C	S	.	.			trans	-78.7	168.5	170.3	52.3	0	0	0	0	112.8	M886 N887 R888 S902 Y903 I1029 A1031	M886-T900 WeakPolarHBondContact O-CG2 3.27Å; N887-T900 HydrophobicContact CB-CG2 3.97Å; N887-T900 CarbonylContact O-C 3.6Å; N887-T900 VanDerWaalsContact O-CA 3.29Å; N887-T900 WeakPolarHBondContact O-CA 3.49Å; N887-T900 WeakPolarHBondContact O-CB 3.17Å; N887-T900 WeakPolarHBondContact O-CG2 3.33Å; R888-T900 HydrophobicContact CG-CG2 4.23Å; T900-S902 PolarHBondContact O-N 3.36Å; T900-S902 VanDerWaalsContact O-N 3.16Å; T900-Y903 PolarHBondContact O-N 3.2Å; T900-I1029 WeakPolarHBondContact CG2-O 3.39Å; T900-I1029 PolarHBondContact N-O 2.9Å; T900-I1029 VanDerWaalsContact N-O 3.13Å; T900-A1031 VanDerWaalsContact CB-O 3.25Å; T900-A1031 WeakPolarHBondContact CB-O 3.39Å; T900-A1031 WeakPolarHBondContact CG2-O 3.37Å; T900-A1031 PolarHBondContact OG1-N 2.82Å; T900-A1031 PolarHBondContact OG1-O 3.37Å
901	T	67	Low	71.5	Confident	87 Å²	87	64 Å²	64	53%	0.534	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-5.3	172.8	37.8	0	0	0	0	114.5	N887	N887-T901 PolarHBondContact O-N 3.15Å; N887-T901 PolarHBondContact O-OG1 3.32Å; N887-T901 VanDerWaalsContact O-OG1 3.1Å; N887-T901 PolarHBondContact OD1-OG1 3.39Å
902	S	69.5	Low	70.6	Confident	46 Å²	46	68.9 Å²	68.9	32%	0.322	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-1.1	178.9	-53.9	0	0	0	0	114.1	N887 T900 S904	N887-S902 WeakPolarHBondContact ND2-CB 3.49Å; N887-S902 PolarHBondContact ND2-OG 3.26Å; T900-S902 PolarHBondContact O-N 3.36Å; T900-S902 VanDerWaalsContact O-N 3.16Å; S902-S904 PolarHBondContact O-N 2.88Å
903	Y	65.8	Low	70.1	Confident	73 Å²	73	69.9 Å²	69.9	29%	0.286	40%	0.403	S	S	.	.			trans	-66.8	119.7	-177.6	170.6	-116.1	0	0	0	112.1	T900 G905 G906 N1027 S1028	T900-Y903 PolarHBondContact O-N 3.2Å; Y903-G905 VanDerWaalsContact C-N 3.33Å; Y903-G905 PolarHBondContact O-N 2.86Å; Y903-G906 PolarHBondContact OH-O 2.97Å; Y903-N1027 WeakPolarHBondContact CE2-O 3.29Å; Y903-S1028 WeakPolarHBondContact CD2-O 3.34Å
904	S	64.5	Low	69.9	Low	73 Å²	73	75.2 Å²	75.2	51%	0.51	44%	0.435	S	S	.	.			trans	-84.4	7.8	-175.4	49.7	0	0	0	0	116	S902 G906 P1026 N1027	S902-S904 PolarHBondContact O-N 2.88Å; S904-G906 PolarHBondContact O-N 3.2Å; S904-P1026 PolarHBondContact N-O 3.43Å; S904-P1026 VanDerWaalsContact N-O 3.07Å; S904-P1026 PolarHBondContact OG-O 3.3Å; S904-P1026 VanDerWaalsContact OG-O 3.09Å; S904-N1027 PolarHBondContact OG-OD1 3.33Å
905	G	64.5	Low	70	Confident	54 Å²	54	76.1 Å²	76.1	56%	0.557	44%	0.438	S	S	*	.	S	Bend	trans	76.7	-3.9	172.6	0	0	0	0	0	116.6	Y903	Y903-G905 VanDerWaalsContact C-N 3.33Å; Y903-G905 PolarHBondContact O-N 2.86Å
906	G	68.9	Low	70.4	Confident	30 Å²	30	76.8 Å²	76.8	31%	0.309	44%	0.439	S	S	.	.	S	Bend	trans	-80	180	176.6	0	0	0	0	0	113.5	Y903 S904 N1027	Y903-G906 PolarHBondContact OH-O 2.97Å; S904-G906 PolarHBondContact O-N 3.2Å; G906-N1027 VanDerWaalsContact CA-OD1 3.25Å; G906-N1027 WeakPolarHBondContact CA-OD1 3.43Å; G906-N1027 PolarHBondContact N-OD1 2.97Å
907	K	71.4	Confident	71.5	Confident	202 Å²	202	81.6 Å²	81.6	88%	0.878	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-73.2	133.2	168.5	-68.8	-175.6	177.8	-178.5	0	109.5	N1027	K907-N1027 WeakPolarHBondContact O-CB 3.35Å
908	S	69.2	Low	72.8	Confident	49 Å²	49	81.2 Å²	81.2	34%	0.343	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-59.9	157.3	172.6	-40.6	0	0	0	0	112.2	D1025 N1027	S908-D1025 WeakPolarHBondContact CA-OD2 3.49Å; S908-D1025 WeakPolarHBondContact CB-OD2 3.48Å; S908-N1027 WeakPolarHBondContact CB-O 3.44Å; S908-N1027 PolarHBondContact OG-O 3.31Å
909	M	74.1	Confident	74.4	Confident	89 Å²	89	76.5 Å²	76.5	44%	0.438	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-60.5	137.2	-176.2	71.2	-178.7	-61.1	0	0	112.5	I911 D1025 P1061	M909-I911 PolarHBondContact O-N 3.11Å; M909-D1025 HydrophobicContact CB-CB 4.37Å; M909-D1025 HydrophobicContact CG-CB 4.09Å; M909-D1025 PolarHBondContact N-OD2 3.45Å; M909-D1025 HydrophobicContact SD-CB 3.96Å; M909-P1061 HydrophobicContact SD-CG 4.2Å
910	V	71.6	Confident	75.9	Confident	121 Å²	121	77.8 Å²	77.8	73%	0.733	44%	0.441	S	S	*	.			trans	-76.4	112.4	171	-179	0	0	0	0	108.4
911	I	73.7	Confident	77.2	Confident	46 Å²	46	81 Å²	81	24%	0.236	46%	0.464	C	S	.	.			trans	-62.6	135.4	174.4	-62.5	177.9	0	0	0	109.5	M909 D1059 P1061 F1064	M909-I911 PolarHBondContact O-N 3.11Å; I911-D1059 HydrophobicContact CD1-CB 3.51Å; I911-P1061 HydrophobicContact CD1-CG 4.14Å; I911-P1061 HydrophobicContact CG1-CG 4.23Å; I911-F1064 HydrophobicContact CD1-CE2 4.4Å; I911-F1064 HydrophobicContact CG2-CB 4.16Å; I911-F1064 HydrophobicContact CG2-CD1 4.23Å; I911-F1064 HydrophobicContact CG2-CD2 3.45Å; I911-F1064 VanDerWaalsContact CG2-CD2 3.45Å; I911-F1064 HydrophobicContact CG2-CE2 3.8Å; I911-F1064 HydrophobicContact CG2-CG 3.69Å; I911-F1064 HydrophobicContact CG2-CZ 4.32Å
912	K	68.1	Low	78.5	Confident	183 Å²	183	78.9 Å²	78.9	80%	0.796	45%	0.452	S	S	*	.			trans	-127.1	138.9	176.9	-63.7	-178.5	-178.2	-179.4	0	109
913	G	71.9	Confident	79.7	Confident	55 Å²	55	76.7 Å²	76.7	57%	0.567	44%	0.437	S	S	*	.	S	Bend	trans	134.4	176.9	-179.4	0	0	0	0	0	111.5
914	V	80.6	Confident	81	Confident	113 Å²	113	73.3 Å²	73.3	69%	0.685	43%	0.425	S	S	*	.			trans	-119.5	137	168.8	-175.5	0	0	0	0	106.5
915	H	86.4	Confident	82.3	Confident	52 Å²	52	74.3 Å²	74.3	24%	0.241	42%	0.424	C	S	.	.			trans	-71.5	140	176	69.6	-77.9	0	0	0	109.9	L1051 F1063 F1064 M1070	H915-L1051 HydrophobicContact CB-CD2 4.47Å; H915-F1063 WeakPolarHBondContact CA-O 3.43Å; H915-F1063 WeakPolarHBondContact CB-O 3.46Å; H915-F1064 HydrophobicContact CB-CD1 4.3Å; H915-F1064 HydrophobicContact CB-CE1 4.32Å; H915-M1070 HydrophobicContact CB-CG 4.07Å
916	H	89.9	Confident	83.7	Confident	95 Å²	95	74.4 Å²	74.4	44%	0.44	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.9	170.2	-62.1	-77.2	0	0	0	109	E1069 M1070	H916-E1069 HydrophobicContact CB-CG 4.14Å; H916-E1069 CarbonylContact O-C 3.29Å; H916-E1069 WeakPolarHBondContact O-CA 3.41Å; H916-M1070 PolarHBondContact O-N 3.03Å
917	Q	91.7	Very high	84.9	Confident	126 Å²	126	73 Å²	73	59%	0.589	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	140.8	175.8	-170.7	179.7	-12.2	0	0	110.4	M1070	Q917-M1070 WeakPolarHBondContact CA-O 3.39Å; Q917-M1070 WeakPolarHBondContact CG-O 3.24Å
918	T	93.6	Very high	85.8	Confident	18 Å²	18	65.7 Å²	65.7	11%	0.11	36%	0.364	C	S	.	.			trans	-127.1	178.1	-177.2	-159.1	0	0	0	0	111.9	V923 I1045 E1069 M1070 L1071	T918-V923 HydrophobicContact CG2-CG2 3.69Å; T918-I1045 HydrophobicContact CG2-CD1 4.47Å; T918-E1069 WeakPolarHBondContact CB-OE2 3.49Å; T918-E1069 HydrophobicContact CG2-CB 3.77Å; T918-E1069 PolarHBondContact OG1-OE2 3.08Å; T918-M1070 PolarHBondContact N-O 2.78Å; T918-L1071 HydrophobicContact CG2-CB 3.97Å; T918-L1071 HydrophobicContact CG2-CD1 4.32Å
919	N	93.9	Very high	86.9	Confident	77 Å²	77	68.9 Å²	68.9	41%	0.412	38%	0.377	S	S	.	.			trans	-130	165.1	-178.2	68.5	73.6	0	0	0	111.8	S921 S922 V923	N919-S921 VanDerWaalsContact C-N 3.32Å; N919-S921 PolarHBondContact O-N 3.07Å; N919-S921 WeakPolarHBondContact OD1-CA 3.25Å; N919-S921 WeakPolarHBondContact OD1-CB 3.4Å; N919-S921 PolarHBondContact OD1-N 3.04Å; N919-S922 PolarHBondContact ND2-OG 3.03Å; N919-S922 PolarHBondContact O-N 2.9Å; N919-S922 PolarHBondContact OD1-N 3.22Å; N919-S922 PolarHBondContact OD1-OG 2.93Å; N919-V923 PolarHBondContact O-N 2.92Å; N919-V923 VanDerWaalsContact O-N 3.15Å
920	V	93.5	Very high	87.9	Confident	32 Å²	32	66.1 Å²	66.1	19%	0.194	36%	0.363	C	S	.	.	H	α-helix	trans	-55.7	-44.4	-177.4	178.1	0	0	0	0	111.9	S922 V923 A924 L1071 D1081 L1082 A1085	V920-S922 PolarHBondContact O-N 2.89Å; V920-V923 PolarHBondContact O-N 2.95Å; V920-A924 WeakPolarHBondContact O-CB 3.26Å; V920-A924 PolarHBondContact O-N 3.46Å; V920-L1071 HydrophobicContact CG2-CD1 4.4Å; V920-D1081 HydrophobicContact CG1-CB 3.93Å; V920-D1081 HydrophobicContact CG2-CB 4.13Å; V920-L1082 HydrophobicContact CG1-CD2 3.83Å; V920-L1082 HydrophobicContact CG1-CG 4.13Å; V920-A1085 HydrophobicContact CG1-CB 4.33Å
921	S	91.7	Very high	89	Confident	81 Å²	81	64.8 Å²	64.8	57%	0.566	35%	0.351	S	S	*	.	H	α-helix	trans	-64.4	-41.6	-177.7	-46	0	0	0	0	112.4	N919 V923 A924 N925	N919-S921 VanDerWaalsContact C-N 3.32Å; N919-S921 PolarHBondContact O-N 3.07Å; N919-S921 WeakPolarHBondContact OD1-CA 3.25Å; N919-S921 WeakPolarHBondContact OD1-CB 3.4Å; N919-S921 PolarHBondContact OD1-N 3.04Å; S921-V923 VanDerWaalsContact C-N 3.33Å; S921-V923 PolarHBondContact O-N 3.23Å; S921-A924 PolarHBondContact O-N 2.95Å; S921-N925 PolarHBondContact O-N 3.37Å; S921-N925 PolarHBondContact O-OD1 2.83Å
922	S	93	Very high	90.1	Very high	41 Å²	41	65.1 Å²	65.1	29%	0.287	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-40.2	174.3	-64.8	0	0	0	0	112	N919 V920 N925 Y926	N919-S922 PolarHBondContact ND2-OG 3.03Å; N919-S922 PolarHBondContact O-N 2.9Å; N919-S922 PolarHBondContact OD1-N 3.22Å; N919-S922 PolarHBondContact OD1-OG 2.93Å; V920-S922 PolarHBondContact O-N 2.89Å; S922-N925 PolarHBondContact O-N 3.23Å; S922-Y926 WeakPolarHBondContact O-CD2 3.32Å; S922-Y926 PolarHBondContact O-N 3.23Å
923	V	94.8	Very high	91.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-74.4	-32.5	177.7	176.8	0	0	0	0	112.1	T918 N919 V920 S921 N925 Y926 L927 L1010 I1045 L1071 L1082	T918-V923 HydrophobicContact CG2-CG2 3.69Å; N919-V923 PolarHBondContact O-N 2.92Å; N919-V923 VanDerWaalsContact O-N 3.15Å; V920-V923 PolarHBondContact O-N 2.95Å; S921-V923 VanDerWaalsContact C-N 3.33Å; S921-V923 PolarHBondContact O-N 3.23Å; V923-N925 VanDerWaalsContact C-N 3.35Å; V923-Y926 PolarHBondContact O-N 3.5Å; V923-L927 HydrophobicContact CG1-CD1 4.46Å; V923-L927 WeakPolarHBondContact O-CG 3.31Å; V923-L927 PolarHBondContact O-N 3Å; V923-L1010 HydrophobicContact CG1-CD2 4.3Å; V923-I1045 HydrophobicContact CG1-CG1 4.39Å; V923-I1045 HydrophobicContact CG1-CG2 4.2Å; V923-I1045 HydrophobicContact CG2-CD1 4Å; V923-I1045 HydrophobicContact CG2-CG1 4.15Å; V923-I1045 HydrophobicContact CG2-CG2 3.81Å; V923-L1071 HydrophobicContact CB-CD2 4.43Å; V923-L1071 HydrophobicContact CG2-CD2 4.15Å; V923-L1082 HydrophobicContact CB-CD2 3.96Å; V923-L1082 HydrophobicContact CG1-CD1 4.33Å; V923-L1082 HydrophobicContact CG1-CD2 3.73Å
924	A	93.1	Very high	92.8	Very high	3 Å²	3	53.8 Å²	53.8	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-38.2	171.7	0	0	0	0	0	112	V920 S921 L927 N928 A1085	V920-A924 WeakPolarHBondContact O-CB 3.26Å; V920-A924 PolarHBondContact O-N 3.46Å; S921-A924 PolarHBondContact O-N 2.95Å; A924-L927 PolarHBondContact O-N 3.14Å; A924-N928 PolarHBondContact O-N 2.98Å; A924-N928 PolarHBondContact O-ND2 3.22Å; A924-A1085 HydrophobicContact CB-CB 3.64Å
925	N	92.8	Very high	93.6	Very high	93 Å²	93	48.4 Å²	48.4	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-47.5	171.5	-67.4	-8.5	0	0	0	111.1	S921 S922 V923 L927 N928 D929	S921-N925 PolarHBondContact O-N 3.37Å; S921-N925 PolarHBondContact O-OD1 2.83Å; S922-N925 PolarHBondContact O-N 3.23Å; V923-N925 VanDerWaalsContact C-N 3.35Å; N925-L927 VanDerWaalsContact C-N 3.25Å; N925-L927 PolarHBondContact O-N 3.24Å; N925-N928 PolarHBondContact O-N 2.91Å; N925-D929 PolarHBondContact O-N 2.87Å
926	Y	94.2	Very high	94.2	Very high	57 Å²	57	46 Å²	46	22%	0.224	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-36.3	174.2	-66.5	-32.7	0	0	0	113.2	S922 V923 F930 K1043 I1045 E1069	S922-Y926 WeakPolarHBondContact O-CD2 3.32Å; S922-Y926 PolarHBondContact O-N 3.23Å; V923-Y926 PolarHBondContact O-N 3.5Å; Y926-F930 HydrophobicContact CD1-CD2 4.37Å; Y926-F930 AromaticContact CD1-CE2 3.58Å; Y926-F930 HydrophobicContact CD1-CE2 3.58Å; Y926-F930 HydrophobicContact CD1-CZ 4.11Å; Y926-F930 HydrophobicContact CE1-CE2 4.35Å; Y926-F930 HydrophobicContact CG-CD2 4.33Å; Y926-F930 AromaticContact CG-CE2 3.8Å; Y926-F930 HydrophobicContact CG-CE2 3.8Å; Y926-F930 VanDerWaalsContact O-CB 3.26Å; Y926-F930 WeakPolarHBondContact O-CB 3.43Å; Y926-F930 WeakPolarHBondContact O-CD2 3.45Å; Y926-F930 WeakPolarHBondContact O-CG 3.37Å; Y926-F930 PolarHBondContact O-N 3.28Å; Y926-K1043 HydrophobicContact CE2-CG 4.32Å; Y926-I1045 HydrophobicContact CD2-CD1 4.08Å; Y926-I1045 HydrophobicContact CE2-CD1 4.16Å; Y926-E1069 PolarHBondContact OH-OE1 3.49Å
927	L	93.9	Very high	94.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-29.9	175.4	-72	169.9	0	0	0	113.6	V923 A924 N925 I933 L957 K962 L1008 L1010 L1082	V923-L927 HydrophobicContact CG1-CD1 4.46Å; V923-L927 WeakPolarHBondContact O-CG 3.31Å; V923-L927 PolarHBondContact O-N 3Å; A924-L927 PolarHBondContact O-N 3.14Å; N925-L927 VanDerWaalsContact C-N 3.25Å; N925-L927 PolarHBondContact O-N 3.24Å; L927-I933 HydrophobicContact CD2-CD1 3.9Å; L927-I933 HydrophobicContact CD2-CG2 4.36Å; L927-L957 HydrophobicContact CB-CD2 4.16Å; L927-L957 HydrophobicContact CD2-CD1 3.97Å; L927-L957 HydrophobicContact CD2-CD2 4.44Å; L927-K962 WeakPolarHBondContact O-CE 3.41Å; L927-L1008 HydrophobicContact CD2-CD2 3.62Å; L927-L1008 HydrophobicContact CG-CD2 4.12Å; L927-L1010 HydrophobicContact CD2-CD1 4.04Å; L927-L1082 HydrophobicContact CD1-CD2 4.18Å
928	N	90.6	Very high	94.5	Very high	49 Å²	49	35.7 Å²	35.7	26%	0.262	20%	0.196	S	C	.	.	H	α-helix	trans	-77.1	-37.5	173.1	-72.1	-35.7	0	0	0	111.8	A924 N925 K962 S1089	A924-N928 PolarHBondContact O-N 2.98Å; A924-N928 PolarHBondContact O-ND2 3.22Å; N925-N928 PolarHBondContact O-N 2.91Å; N928-K962 WeakPolarHBondContact O-CE 3.36Å; N928-K962 PolarHBondContact O-NZ 3.43Å; N928-S1089 WeakPolarHBondContact ND2-CB 3.31Å; N928-S1089 PolarHBondContact ND2-OG 3.2Å
929	D	91.9	Very high	94.1	Very high	115 Å²	115	36.5 Å²	36.5	62%	0.615	20%	0.197	S	C	*	.	H	α-helix	trans	-79.7	-47.3	-175.8	-68	-23.9	0	0	0	113.3	N925	N925-D929 PolarHBondContact O-N 2.87Å
930	F	94.8	Very high	93.8	Very high	31 Å²	31	34.3 Å²	34.3	14%	0.136	19%	0.193	C	C	.	.			trans	-83.9	151.3	-171.6	-66.7	-41.6	0	0	0	113.7	Y926 K962 D1007 L1008 K1042 K1043	Y926-F930 HydrophobicContact CD1-CD2 4.37Å; Y926-F930 AromaticContact CD1-CE2 3.58Å; Y926-F930 HydrophobicContact CD1-CE2 3.58Å; Y926-F930 HydrophobicContact CD1-CZ 4.11Å; Y926-F930 HydrophobicContact CE1-CE2 4.35Å; Y926-F930 HydrophobicContact CG-CD2 4.33Å; Y926-F930 AromaticContact CG-CE2 3.8Å; Y926-F930 HydrophobicContact CG-CE2 3.8Å; Y926-F930 VanDerWaalsContact O-CB 3.26Å; Y926-F930 WeakPolarHBondContact O-CB 3.43Å; Y926-F930 WeakPolarHBondContact O-CD2 3.45Å; Y926-F930 WeakPolarHBondContact O-CG 3.37Å; Y926-F930 PolarHBondContact O-N 3.28Å; F930-K962 VanDerWaalsContact O-CD 3.3Å; F930-K962 WeakPolarHBondContact O-CD 3.23Å; F930-K962 WeakPolarHBondContact O-CE 3.3Å; F930-K962 PolarHBondContact O-NZ 3.1Å; F930-D1007 HydrophobicContact CB-CB 3.49Å; F930-D1007 VanDerWaalsContact CB-CB 3.49Å; F930-D1007 HydrophobicContact CD1-CB 3.67Å; F930-D1007 HydrophobicContact CD2-CB 4.36Å; F930-D1007 HydrophobicContact CG-CB 3.6Å; F930-L1008 HydrophobicContact CB-CB 4.27Å; F930-L1008 HydrophobicContact CD2-CB 3.84Å; F930-L1008 HydrophobicContact CD2-CD1 4.21Å; F930-L1008 HydrophobicContact CD2-CD2 4.33Å; F930-L1008 HydrophobicContact CD2-CG 4.35Å; F930-L1008 HydrophobicContact CE2-CD1 4.41Å; F930-L1008 HydrophobicContact CG-CB 4.4Å; F930-K1042 HydrophobicContact CE1-CD 4.5Å; F930-K1043 HydrophobicContact CE2-CB 4.16Å
931	N	94.8	Very high	93.8	Very high	93 Å²	93	32.8 Å²	32.8	50%	0.497	18%	0.184	S	C	.	.	S	Bend	trans	-112.9	-37.1	-171.9	-70.8	-31.2	0	0	0	114.6	K962 H963 D1007	N931-K962 PolarHBondContact OD1-NZ 2.64Å; N931-H963 PolarHBondContact O-N 3.27Å; N931-D1007 PolarHBondContact N-OD2 3.08Å
932	E	97.2	Very high	93.5	Very high	53 Å²	53	29.1 Å²	29.1	25%	0.248	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	110.3	171.5	-79.2	-68.8	146.1	0	0	110.2	H963 R965 T1006 D1007 L1008	E932-H963 VanDerWaalsContact CD-ND1 3.27Å; E932-H963 IonicContact OE1-CE1 2.8Å; E932-H963 IonicContact OE1-CG 3.25Å; E932-H963 IonicContact OE1-ND1 2.87Å; E932-H963 PolarHBondContact OE1-ND1 3.34Å; E932-H963 IonicContact OE2-CE1 2.74Å; E932-H963 IonicContact OE2-ND1 3.67Å; E932-H963 PolarHBondContact OE2-ND1 3.37Å; E932-H963 VanDerWaalsContact OE2-ND1 3.11Å; E932-R965 IonicContact OE2-CZ 2.73Å; E932-R965 IonicContact OE2-NE 3.22Å; E932-R965 IonicContact OE2-NH2 2.67Å; E932-R965 PolarHBondContact OE2-NH2 3.22Å; E932-T1006 WeakPolarHBondContact O-CG2 3.5Å; E932-D1007 PolarHBondContact N-OD2 3.03Å; E932-D1007 WeakPolarHBondContact O-CB 3.29Å; E932-D1007 PolarHBondContact O-N 3.01Å; E932-D1007 VanDerWaalsContact O-N 3.14Å; E932-L1008 PolarHBondContact O-N 3.32Å; E932-L1008 VanDerWaalsContact O-N 3.15Å
933	I	98	Very high	93.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.4	-175.5	-54.9	168.8	0	0	0	109.4	L927 L957 K962 H963 V964 R965 L1008	L927-I933 HydrophobicContact CD2-CD1 3.9Å; L927-I933 HydrophobicContact CD2-CG2 4.36Å; I933-L957 HydrophobicContact CD1-CD1 4.46Å; I933-K962 HydrophobicContact CD1-CB 4.18Å; I933-K962 HydrophobicContact CD1-CG 4.46Å; I933-H963 PolarHBondContact N-O 3.33Å; I933-V964 HydrophobicContact CB-CG2 4.36Å; I933-V964 HydrophobicContact CD1-CG2 4.31Å; I933-V964 HydrophobicContact CG2-CG1 4.48Å; I933-V964 WeakPolarHBondContact O-CA 3.34Å; I933-R965 PolarHBondContact O-N 3.19Å; I933-L1008 WeakPolarHBondContact CA-O 3.46Å; I933-L1008 HydrophobicContact CG1-CB 4.43Å; I933-L1008 HydrophobicContact CG2-CD2 4.43Å
934	I	98.6	Very high	92.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.5	172.1	-61.8	177.3	0	0	0	110	T936 R965 A967 I999 F1003 T1006 L1008 V1009 L1010	I934-T936 HydrophobicContact CG2-CG2 4.14Å; I934-R965 CarbonylContact C-O 3.55Å; I934-R965 WeakPolarHBondContact CA-O 3.21Å; I934-A967 HydrophobicContact CG2-CB 3.8Å; I934-I999 HydrophobicContact CD1-CD1 3.91Å; I934-I999 HydrophobicContact CD1-CG1 3.91Å; I934-I999 HydrophobicContact CG1-CD1 4.26Å; I934-I999 HydrophobicContact CG2-CD1 4.21Å; I934-F1003 HydrophobicContact CB-CE1 4.19Å; I934-F1003 HydrophobicContact CD1-CD1 4.02Å; I934-F1003 HydrophobicContact CD1-CE1 4.02Å; I934-F1003 HydrophobicContact CG2-CE1 3.74Å; I934-F1003 HydrophobicContact CG2-CZ 4.18Å; I934-T1006 HydrophobicContact CB-CG2 4.09Å; I934-T1006 HydrophobicContact CD1-CG2 3.95Å; I934-T1006 WeakPolarHBondContact CD1-OG1 3.32Å; I934-T1006 HydrophobicContact CG1-CG2 3.77Å; I934-L1008 PolarHBondContact N-O 3.17Å; I934-V1009 HydrophobicContact CB-CG2 4.42Å; I934-V1009 CarbonylContact O-C 3.57Å; I934-V1009 VanDerWaalsContact O-CA 3.24Å; I934-V1009 WeakPolarHBondContact O-CA 3.34Å; I934-L1010 PolarHBondContact O-N 3.37Å
935	I	98.1	Very high	92.7	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	123.5	175	-56	166.9	0	0	0	108	P937 L950 V964 R965 F966 A967 L1010 I1012	I935-P937 WeakPolarHBondContact O-CD 3.38Å; I935-L950 HydrophobicContact CD1-CD1 4.1Å; I935-L950 HydrophobicContact CG2-CD1 4.4Å; I935-L950 HydrophobicContact CG2-CD2 4.09Å; I935-V964 HydrophobicContact CD1-CG1 3.56Å; I935-V964 HydrophobicContact CG1-CG1 4.2Å; I935-R965 PolarHBondContact N-O 3.18Å; I935-F966 HydrophobicContact CB-CD1 3.86Å; I935-F966 HydrophobicContact CB-CE1 3.93Å; I935-F966 HydrophobicContact CB-CG 4.35Å; I935-F966 HydrophobicContact CB-CZ 4.46Å; I935-F966 HydrophobicContact CD1-CE1 3.97Å; I935-F966 HydrophobicContact CD1-CE2 4.02Å; I935-F966 HydrophobicContact CD1-CZ 3.66Å; I935-F966 HydrophobicContact CG2-CD1 3.9Å; I935-F966 HydrophobicContact CG2-CE1 3.7Å; I935-F966 HydrophobicContact CG2-CZ 4.49Å; I935-F966 CarbonylContact O-C 3.39Å; I935-F966 VanDerWaalsContact O-CA 3.32Å; I935-F966 WeakPolarHBondContact O-CA 3.45Å; I935-A967 PolarHBondContact O-N 3.39Å; I935-L1010 CarbonylContact C-O 3.37Å; I935-L1010 WeakPolarHBondContact CA-O 3.24Å; I935-L1010 HydrophobicContact CG1-CB 4.24Å; I935-L1010 HydrophobicContact CG1-CD1 4.36Å; I935-L1010 HydrophobicContact CG2-CB 4.43Å; I935-I1012 HydrophobicContact CG2-CD1 4.07Å
936	T	97.8	Very high	92.8	Very high	1 Å²	1	33 Å²	33	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	87.4	175.4	73.6	0	0	0	0	109.7	I934 A967 F1003 V1009 L1010 V1011 I1012 L1036 V1038	I934-T936 HydrophobicContact CG2-CG2 4.14Å; T936-A967 HydrophobicContact CG2-CB 4.05Å; T936-F1003 HydrophobicContact CG2-CE1 4.12Å; T936-F1003 HydrophobicContact CG2-CZ 3.98Å; T936-V1009 HydrophobicContact CG2-CG1 3.83Å; T936-L1010 PolarHBondContact N-O 3.36Å; T936-V1011 WeakPolarHBondContact OG1-CA 3.2Å; T936-I1012 PolarHBondContact O-N 3.46Å; T936-I1012 VanDerWaalsContact O-N 3.11Å; T936-L1036 HydrophobicContact CG2-CD1 4.07Å; T936-V1038 HydrophobicContact CG2-CG1 3.62Å
937	P	96.1	Very high	92.8	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.013	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	149.7	180	31.3	-35.3	0	0	0	111.5	I935 L941 F966 I968 L979 L983 I1012	I935-P937 WeakPolarHBondContact O-CD 3.38Å; P937-L941 HydrophobicContact CB-CD2 3.87Å; P937-F966 HydrophobicContact CG-CD1 4.04Å; P937-I968 HydrophobicContact CG-CD1 3.76Å; P937-L979 HydrophobicContact CB-CD1 4.36Å; P937-L979 HydrophobicContact CB-CD2 4.02Å; P937-L979 HydrophobicContact CB-CG 4.47Å; P937-L979 HydrophobicContact CG-CD2 3.78Å; P937-L979 HydrophobicContact CG-CG 4.17Å; P937-L979 WeakPolarHBondContact O-CD2 3.44Å; P937-L983 HydrophobicContact CG-CD1 4.19Å; P937-I1012 CarbonylContact C-O 3.31Å; P937-I1012 WeakPolarHBondContact CA-O 3.4Å
938	G	92.5	Very high	92.8	Very high	2 Å²	2	35 Å²	35	2%	0.021	18%	0.184	C	C	.	.			trans	-129	175.5	166.8	0	0	0	0	0	111.3	G940 L941 I1012 G1013	G938-G940 PolarHBondContact O-N 2.72Å; G938-L941 VanDerWaalsContact O-CB 3.27Å; G938-L941 WeakPolarHBondContact O-CB 3.5Å; G938-L941 PolarHBondContact O-N 2.9Å; G938-I1012 PolarHBondContact N-O 2.84Å; G938-G1013 CarbonylContact C-O 3.6Å; G938-G1013 WeakPolarHBondContact CA-O 3.5Å
939	Y	85.9	Confident	93.1	Very high	35 Å²	35	33 Å²	33	14%	0.137	17%	0.174	C	C	.	.	H	α-helix	trans	-57.5	-23.7	-174.8	-172.8	-112.5	0	0	0	113.8	L941 C942 V943 R974	Y939-L941 VanDerWaalsContact C-N 3.25Å; Y939-L941 PolarHBondContact O-N 3.46Å; Y939-C942 HydrophobicContact CD2-CB 4.42Å; Y939-C942 PolarHBondContact O-N 3.41Å; Y939-C942 VanDerWaalsContact O-N 3.15Å; Y939-V943 HydrophobicContact CD1-CG2 3.65Å; Y939-V943 HydrophobicContact CE1-CG2 3.25Å; Y939-V943 HydrophobicContact CE2-CG2 4.48Å; Y939-V943 HydrophobicContact CG-CG2 4.4Å; Y939-V943 WeakPolarHBondContact O-CG2 3.46Å; Y939-V943 PolarHBondContact O-N 2.7Å; Y939-V943 VanDerWaalsContact O-N 3.09Å; Y939-R974 HydrophobicContact CD2-CG 4.43Å; Y939-R974 HydrophobicContact CE1-CG 4.09Å; Y939-R974 VanDerWaalsContact CE1-NE 3.29Å; Y939-R974 HydrophobicContact CE2-CG 3.97Å; Y939-R974 VanDerWaalsContact CZ-NE 3.33Å; Y939-R974 WeakPolarHBondContact OH-CD 3.47Å; Y939-R974 PolarHBondContact OH-NE 3Å; Y939-R974 VanDerWaalsContact OH-NE 3.1Å
940	G	87.2	Confident	93.3	Very high	32 Å²	32	27.6 Å²	27.6	33%	0.33	15%	0.145	S	C	.	.	H	α-helix	trans	-59.3	-30.6	173.3	0	0	0	0	0	114.5	G938 A944 G1013	G938-G940 PolarHBondContact O-N 2.72Å; G940-A944 PolarHBondContact O-N 3.29Å; G940-G1013 PolarHBondContact N-O 2.69Å; G940-G1013 VanDerWaalsContact N-O 3.15Å
941	L	91.9	Very high	93.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.7	-50.7	172.4	-178.8	83.5	0	0	0	110.7	P937 G938 Y939 A944 K945 A946 Q947 L950 L983 I1012	P937-L941 HydrophobicContact CB-CD2 3.87Å; G938-L941 VanDerWaalsContact O-CB 3.27Å; G938-L941 WeakPolarHBondContact O-CB 3.5Å; G938-L941 PolarHBondContact O-N 2.9Å; Y939-L941 VanDerWaalsContact C-N 3.25Å; Y939-L941 PolarHBondContact O-N 3.46Å; L941-A944 PolarHBondContact O-N 3.06Å; L941-K945 PolarHBondContact O-N 2.87Å; L941-A946 HydrophobicContact CD1-CB 3.58Å; L941-A946 HydrophobicContact CG-CB 4.11Å; L941-A946 WeakPolarHBondContact O-CB 3.47Å; L941-A946 PolarHBondContact O-N 3Å; L941-Q947 HydrophobicContact CD2-CB 3.96Å; L941-Q947 HydrophobicContact CG-CB 4.44Å; L941-L950 HydrophobicContact CD1-CB 4.49Å; L941-L950 HydrophobicContact CD1-CD2 3.51Å; L941-L950 HydrophobicContact CD2-CD2 3.85Å; L941-L950 HydrophobicContact CG-CD2 4.35Å; L941-L983 HydrophobicContact CD2-CD2 4.39Å; L941-I1012 HydrophobicContact CB-CG2 4.47Å; L941-I1012 HydrophobicContact CD1-CB 4.24Å; L941-I1012 HydrophobicContact CD1-CG2 3.48Å; L941-I1012 VanDerWaalsContact CD1-CG2 3.48Å
942	C	86.9	Confident	93.4	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.027	13%	0.131	C	C	.	.	H	α-helix	trans	-72.6	-34.3	-173.4	-55.8	0	0	0	0	112.3	Y939 A944 K945 L979 L982	Y939-C942 HydrophobicContact CD2-CB 4.42Å; Y939-C942 PolarHBondContact O-N 3.41Å; Y939-C942 VanDerWaalsContact O-N 3.15Å; C942-A944 VanDerWaalsContact C-N 3.28Å; C942-A944 PolarHBondContact O-N 3.34Å; C942-K945 PolarHBondContact O-N 3.04Å; C942-L979 WeakPolarHBondContact SG-CD1 3.22Å; C942-L982 HydrophobicContact CB-CD1 3.91Å
943	V	84.5	Confident	93.3	Very high	86 Å²	86	22.7 Å²	22.7	52%	0.521	12%	0.119	S	C	.	.	H	α-helix	trans	-61	-37.9	173	172.4	0	0	0	0	111.5	Y939 K945	Y939-V943 HydrophobicContact CD1-CG2 3.65Å; Y939-V943 HydrophobicContact CE1-CG2 3.25Å; Y939-V943 HydrophobicContact CE2-CG2 4.48Å; Y939-V943 HydrophobicContact CG-CG2 4.4Å; Y939-V943 WeakPolarHBondContact O-CG2 3.46Å; Y939-V943 PolarHBondContact O-N 2.7Å; Y939-V943 VanDerWaalsContact O-N 3.09Å; V943-K945 VanDerWaalsContact C-N 3.28Å; V943-K945 PolarHBondContact O-N 2.89Å
944	A	89.5	Confident	93.3	Very high	20 Å²	20	22.8 Å²	22.8	17%	0.165	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.4	175.1	0	0	0	0	0	114	G940 L941 C942 A946 D1074 A1075 K1076	G940-A944 PolarHBondContact O-N 3.29Å; L941-A944 PolarHBondContact O-N 3.06Å; C942-A944 VanDerWaalsContact C-N 3.28Å; C942-A944 PolarHBondContact O-N 3.34Å; A944-A946 HydrophobicContact CB-CB 4.12Å; A944-A946 PolarHBondContact O-N 3.41Å; A944-D1074 WeakPolarHBondContact CB-OD1 3.38Å; A944-A1075 HydrophobicContact CB-CB 4.09Å; A944-K1076 HydrophobicContact CB-CB 4.1Å; A944-K1076 WeakPolarHBondContact O-CB 3.28Å
945	K	89.4	Confident	93.1	Very high	112 Å²	112	27.1 Å²	27.1	49%	0.487	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	33.8	-165.8	-57.9	-171.1	177.1	-170.7	0	113.2	L941 C942 V943 Q947	L941-K945 PolarHBondContact O-N 2.87Å; C942-K945 PolarHBondContact O-N 3.04Å; V943-K945 VanDerWaalsContact C-N 3.28Å; V943-K945 PolarHBondContact O-N 2.89Å; K945-Q947 VanDerWaalsContact C-N 3.33Å; K945-Q947 VanDerWaalsContact C-OE1 3.26Å; K945-Q947 VanDerWaalsContact CA-OE1 3.28Å
946	A	94.4	Very high	92.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.3	-176.5	0	0	0	0	0	113.9	L941 A944 Y948 P949 L950 A1075 K1076	L941-A946 HydrophobicContact CD1-CB 3.58Å; L941-A946 HydrophobicContact CG-CB 4.11Å; L941-A946 WeakPolarHBondContact O-CB 3.47Å; L941-A946 PolarHBondContact O-N 3Å; A944-A946 HydrophobicContact CB-CB 4.12Å; A944-A946 PolarHBondContact O-N 3.41Å; A946-Y948 VanDerWaalsContact C-N 3.25Å; A946-Y948 PolarHBondContact O-N 2.94Å; A946-P949 VanDerWaalsContact O-CD 3.31Å; A946-P949 WeakPolarHBondContact O-CD 3.29Å; A946-P949 WeakPolarHBondContact O-CG 3.29Å; A946-L950 WeakPolarHBondContact O-CB 3.47Å; A946-L950 PolarHBondContact O-N 2.61Å; A946-A1075 HydrophobicContact CB-CB 4.12Å; A946-K1076 HydrophobicContact CB-CB 4.08Å
947	Q	94	Very high	92.8	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-31.8	179.3	66.9	-87.6	24	0	0	113.3	L941 K945 A951 A986	L941-Q947 HydrophobicContact CD2-CB 3.96Å; L941-Q947 HydrophobicContact CG-CB 4.44Å; K945-Q947 VanDerWaalsContact C-N 3.33Å; K945-Q947 VanDerWaalsContact C-OE1 3.26Å; K945-Q947 VanDerWaalsContact CA-OE1 3.28Å; Q947-A951 WeakPolarHBondContact O-CB 3.28Å; Q947-A951 PolarHBondContact O-N 2.98Å; Q947-A986 HydrophobicContact CB-CB 3.98Å; Q947-A986 HydrophobicContact CG-CB 3.77Å; Q947-A986 WeakPolarHBondContact O-CB 3.46Å
948	Y	95.3	Very high	92.7	Very high	97 Å²	97	31.8 Å²	31.8	38%	0.38	16%	0.162	S	C	.	.	H	α-helix	trans	-67.6	-56.3	-178.7	-57.9	-79.9	0	0	0	113.4	A946 L950 A951 E952 E985 A986	A946-Y948 VanDerWaalsContact C-N 3.25Å; A946-Y948 PolarHBondContact O-N 2.94Å; Y948-L950 VanDerWaalsContact C-N 3.26Å; Y948-L950 PolarHBondContact O-N 3.38Å; Y948-A951 PolarHBondContact O-N 3Å; Y948-E952 PolarHBondContact O-N 3.25Å; Y948-E952 VanDerWaalsContact O-N 3.14Å; Y948-E985 PolarHBondContact OH-OE1 3.39Å; Y948-E985 PolarHBondContact OH-OE2 2.89Å; Y948-A986 HydrophobicContact CD1-CB 4.13Å; Y948-A986 HydrophobicContact CE1-CB 4.48Å
949	P	96.3	Very high	92.8	Very high	8 Å²	8	39 Å²	39	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-29.9	174.7	25.1	-34.5	0	0	0	112.8	A946 E952 L953 C1079 D1080 L1083	A946-P949 VanDerWaalsContact O-CD 3.31Å; A946-P949 WeakPolarHBondContact O-CD 3.29Å; A946-P949 WeakPolarHBondContact O-CG 3.29Å; P949-E952 PolarHBondContact O-N 2.82Å; P949-L953 WeakPolarHBondContact O-CB 3.25Å; P949-L953 PolarHBondContact O-N 2.79Å; P949-C1079 HydrophobicContact CB-CB 4.01Å; P949-C1079 HydrophobicContact CG-CB 3.76Å; P949-D1080 VanDerWaalsContact CB-OD1 3.24Å; P949-D1080 WeakPolarHBondContact CB-OD1 3.49Å; P949-D1080 WeakPolarHBondContact CG-OD1 3.35Å; P949-L1083 HydrophobicContact CB-CD2 4.31Å
950	L	96.4	Very high	93	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-37.6	174.4	-175	60.4	0	0	0	112.6	I935 L941 A946 Y948 L953 T954 F966 I1012	I935-L950 HydrophobicContact CD1-CD1 4.1Å; I935-L950 HydrophobicContact CG2-CD1 4.4Å; I935-L950 HydrophobicContact CG2-CD2 4.09Å; L941-L950 HydrophobicContact CD1-CB 4.49Å; L941-L950 HydrophobicContact CD1-CD2 3.51Å; L941-L950 HydrophobicContact CD2-CD2 3.85Å; L941-L950 HydrophobicContact CG-CD2 4.35Å; A946-L950 WeakPolarHBondContact O-CB 3.47Å; A946-L950 PolarHBondContact O-N 2.61Å; Y948-L950 VanDerWaalsContact C-N 3.26Å; Y948-L950 PolarHBondContact O-N 3.38Å; L950-L953 HydrophobicContact CD1-CD2 4.4Å; L950-L953 PolarHBondContact O-N 3.05Å; L950-T954 WeakPolarHBondContact O-CB 3.38Å; L950-T954 PolarHBondContact O-N 3.21Å; L950-T954 PolarHBondContact O-OG1 3.26Å; L950-F966 HydrophobicContact CD2-CE1 3.97Å; L950-F966 HydrophobicContact CD2-CZ 4.47Å; L950-F966 HydrophobicContact CG-CE1 4.27Å; L950-F966 HydrophobicContact CG-CZ 4.28Å; L950-I1012 HydrophobicContact CD1-CD1 3.63Å; L950-I1012 HydrophobicContact CD2-CD1 3.87Å; L950-I1012 HydrophobicContact CG-CD1 4.41Å
951	A	95.7	Very high	93.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-38.2	173.5	0	0	0	0	0	112	Q947 Y948 T954 K955 A986 V988	Q947-A951 WeakPolarHBondContact O-CB 3.28Å; Q947-A951 PolarHBondContact O-N 2.98Å; Y948-A951 PolarHBondContact O-N 3Å; A951-T954 WeakPolarHBondContact O-CB 3.44Å; A951-T954 PolarHBondContact O-N 2.68Å; A951-K955 VanDerWaalsContact O-CG 3.29Å; A951-K955 WeakPolarHBondContact O-CG 3.47Å; A951-K955 PolarHBondContact O-N 3.2Å; A951-A986 HydrophobicContact CB-CB 3.83Å; A951-A986 VanDerWaalsContact CB-O 3.24Å; A951-A986 WeakPolarHBondContact CB-O 3.45Å; A951-V988 HydrophobicContact CB-CG2 3.59Å
952	E	96	Very high	93.5	Very high	71 Å²	71	43.4 Å²	43.4	33%	0.332	22%	0.221	S	C	.	.	H	α-helix	trans	-66.9	-40.6	173.5	-72.6	-63.1	113.3	0	0	112.7	Y948 P949 T954 K955 E956 L1083 R1087	Y948-E952 PolarHBondContact O-N 3.25Å; Y948-E952 VanDerWaalsContact O-N 3.14Å; P949-E952 PolarHBondContact O-N 2.82Å; E952-T954 VanDerWaalsContact C-N 3.35Å; E952-K955 PolarHBondContact O-N 3.17Å; E952-K955 WeakPolarHBondContact OE1-CD 3.39Å; E952-K955 IonicContact OE1-NZ 2.7Å; E952-K955 PolarHBondContact OE1-NZ 3.39Å; E952-E956 PolarHBondContact O-N 3.45Å; E952-L1083 HydrophobicContact CB-CD1 4.16Å; E952-L1083 HydrophobicContact CB-CD2 3.73Å; E952-R1087 IonicContact OE2-NH2 3.21Å; E952-R1087 PolarHBondContact OE2-NH2 3.21Å
953	L	95.8	Very high	94	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-44.1	172.9	175.1	60.1	0	0	0	111	P949 L950 K955 E956 L957 L1082 L1083 C1086	P949-L953 WeakPolarHBondContact O-CB 3.25Å; P949-L953 PolarHBondContact O-N 2.79Å; L950-L953 HydrophobicContact CD1-CD2 4.4Å; L950-L953 PolarHBondContact O-N 3.05Å; L953-K955 PolarHBondContact O-N 3.11Å; L953-E956 PolarHBondContact O-N 3.11Å; L953-L957 HydrophobicContact CD1-CD1 3.9Å; L953-L957 HydrophobicContact CD1-CG 4.06Å; L953-L957 HydrophobicContact CG-CD1 3.91Å; L953-L957 HydrophobicContact CG-CG 4.5Å; L953-L957 WeakPolarHBondContact O-CB 3.47Å; L953-L957 VanDerWaalsContact O-CG 3.27Å; L953-L957 WeakPolarHBondContact O-CG 3.43Å; L953-L957 PolarHBondContact O-N 2.86Å; L953-L1082 HydrophobicContact CD2-CB 4.01Å; L953-L1083 HydrophobicContact CB-CB 4.44Å; L953-L1083 HydrophobicContact CB-CD1 4.25Å; L953-C1086 HydrophobicContact CD1-CB 4.18Å
954	T	96.2	Very high	94.6	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-48	175	-58.7	0	0	0	0	111.3	L950 A951 E952 E956 L957 I958 V964 F966 I992	L950-T954 WeakPolarHBondContact O-CB 3.38Å; L950-T954 PolarHBondContact O-N 3.21Å; L950-T954 PolarHBondContact O-OG1 3.26Å; A951-T954 WeakPolarHBondContact O-CB 3.44Å; A951-T954 PolarHBondContact O-N 2.68Å; E952-T954 VanDerWaalsContact C-N 3.35Å; T954-E956 PolarHBondContact O-N 3.08Å; T954-L957 PolarHBondContact O-N 3.03Å; T954-I958 HydrophobicContact CG2-CD1 3.77Å; T954-I958 HydrophobicContact CG2-CG1 4.48Å; T954-I958 WeakPolarHBondContact O-CB 3.32Å; T954-I958 VanDerWaalsContact O-CG1 3.32Å; T954-I958 WeakPolarHBondContact O-CG1 3.42Å; T954-I958 PolarHBondContact O-N 2.88Å; T954-V964 HydrophobicContact CG2-CB 4.31Å; T954-V964 HydrophobicContact CG2-CG1 4.02Å; T954-F966 HydrophobicContact CG2-CE2 3.9Å; T954-F966 WeakPolarHBondContact OG1-CZ 3.17Å; T954-I992 HydrophobicContact CG2-CD1 3.74Å
955	K	94.8	Very high	95	Very high	90 Å²	90	43.5 Å²	43.5	39%	0.391	21%	0.211	S	C	.	.	H	α-helix	trans	-61.4	-43.4	178.6	-68.8	165.5	-157.6	168.5	0	112	A951 E952 L953 I958 K959	A951-K955 VanDerWaalsContact O-CG 3.29Å; A951-K955 WeakPolarHBondContact O-CG 3.47Å; A951-K955 PolarHBondContact O-N 3.2Å; E952-K955 PolarHBondContact O-N 3.17Å; E952-K955 WeakPolarHBondContact OE1-CD 3.39Å; E952-K955 IonicContact OE1-NZ 2.7Å; E952-K955 PolarHBondContact OE1-NZ 3.39Å; L953-K955 PolarHBondContact O-N 3.11Å; K955-I958 PolarHBondContact O-N 2.81Å; K955-K959 VanDerWaalsContact O-CB 3.24Å; K955-K959 WeakPolarHBondContact O-CB 3.36Å; K955-K959 PolarHBondContact O-N 3.07Å
956	E	94.7	Very high	95.4	Very high	27 Å²	27	38.2 Å²	38.2	13%	0.126	19%	0.187	C	C	.	.	H	α-helix	trans	-69.4	-35.1	-179.4	-174.1	55.2	-144.9	0	0	112.3	E952 L953 T954 K959 R960 R1087	E952-E956 PolarHBondContact O-N 3.45Å; L953-E956 PolarHBondContact O-N 3.11Å; T954-E956 PolarHBondContact O-N 3.08Å; E956-K959 IonicContact OE1-NZ 2.98Å; E956-K959 PolarHBondContact OE1-NZ 3.4Å; E956-K959 IonicContact OE2-NZ 2.68Å; E956-K959 PolarHBondContact OE2-NZ 2.75Å; E956-R960 WeakPolarHBondContact O-CD 3.41Å; E956-R960 WeakPolarHBondContact O-CG 3.37Å; E956-R960 PolarHBondContact O-N 2.77Å; E956-R960 IonicContact OE1-CZ 3.48Å; E956-R960 VanDerWaalsContact OE1-CZ 3.32Å; E956-R960 IonicContact OE1-NE 2.68Å; E956-R960 PolarHBondContact OE1-NE 3.37Å; E956-R960 IonicContact OE1-NH2 3.79Å; E956-R960 PolarHBondContact OE1-NH2 3.09Å; E956-R1087 HydrophobicContact CG-CG 4.39Å
957	L	95.3	Very high	95.6	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-68.5	-45.7	172.8	-69.4	168.5	0	0	0	112.1	L927 I933 L953 T954 K959 R960 G961 K962 V964	L927-L957 HydrophobicContact CB-CD2 4.16Å; L927-L957 HydrophobicContact CD2-CD1 3.97Å; L927-L957 HydrophobicContact CD2-CD2 4.44Å; I933-L957 HydrophobicContact CD1-CD1 4.46Å; L953-L957 HydrophobicContact CD1-CD1 3.9Å; L953-L957 HydrophobicContact CD1-CG 4.06Å; L953-L957 HydrophobicContact CG-CD1 3.91Å; L953-L957 HydrophobicContact CG-CG 4.5Å; L953-L957 WeakPolarHBondContact O-CB 3.47Å; L953-L957 VanDerWaalsContact O-CG 3.27Å; L953-L957 WeakPolarHBondContact O-CG 3.43Å; L953-L957 PolarHBondContact O-N 2.86Å; T954-L957 PolarHBondContact O-N 3.03Å; L957-K959 VanDerWaalsContact C-N 3.3Å; L957-K959 PolarHBondContact O-N 2.96Å; L957-R960 CarbonylContact O-C 3.59Å; L957-R960 WeakPolarHBondContact O-CA 3.37Å; L957-R960 WeakPolarHBondContact O-CB 3.45Å; L957-R960 PolarHBondContact O-N 2.85Å; L957-G961 PolarHBondContact O-N 2.64Å; L957-K962 HydrophobicContact CB-CB 4.2Å; L957-K962 HydrophobicContact CB-CG 4.42Å; L957-K962 HydrophobicContact CD2-CG 4.37Å; L957-K962 VanDerWaalsContact O-CB 3.31Å; L957-K962 WeakPolarHBondContact O-CB 3.33Å; L957-K962 WeakPolarHBondContact O-CG 3.17Å; L957-K962 PolarHBondContact O-N 3.43Å; L957-K962 VanDerWaalsContact O-N 3.13Å; L957-V964 HydrophobicContact CB-CG2 3.66Å; L957-V964 HydrophobicContact CD1-CG2 4.2Å
958	I	94.2	Very high	95.6	Very high	73 Å²	73	38.2 Å²	38.2	37%	0.374	19%	0.187	S	C	.	.	H	α-helix	trans	-61.5	-39.5	176.4	-70.3	173	0	0	0	111	T954 K955 R960 G961 V964 I992	T954-I958 HydrophobicContact CG2-CD1 3.77Å; T954-I958 HydrophobicContact CG2-CG1 4.48Å; T954-I958 WeakPolarHBondContact O-CB 3.32Å; T954-I958 VanDerWaalsContact O-CG1 3.32Å; T954-I958 WeakPolarHBondContact O-CG1 3.42Å; T954-I958 PolarHBondContact O-N 2.88Å; K955-I958 PolarHBondContact O-N 2.81Å; I958-R960 PolarHBondContact O-N 3.35Å; I958-G961 PolarHBondContact O-N 3.12Å; I958-V964 HydrophobicContact CD1-CB 4.39Å; I958-V964 HydrophobicContact CG1-CB 4.06Å; I958-V964 HydrophobicContact CG1-CG2 4.12Å; I958-I992 HydrophobicContact CD1-CD1 3.78Å
959	K	93.6	Very high	95.6	Very high	154 Å²	154	33.6 Å²	33.6	67%	0.67	17%	0.17	S	C	*	.	H	α-helix	trans	-61.2	-24.3	173.5	176.1	-178.5	153.4	-138.1	0	113.2	K955 E956 L957 G961	K955-K959 VanDerWaalsContact O-CB 3.24Å; K955-K959 WeakPolarHBondContact O-CB 3.36Å; K955-K959 PolarHBondContact O-N 3.07Å; E956-K959 IonicContact OE1-NZ 2.98Å; E956-K959 PolarHBondContact OE1-NZ 3.4Å; E956-K959 IonicContact OE2-NZ 2.68Å; E956-K959 PolarHBondContact OE2-NZ 2.75Å; L957-K959 VanDerWaalsContact C-N 3.3Å; L957-K959 PolarHBondContact O-N 2.96Å; K959-G961 VanDerWaalsContact C-N 3.31Å
960	R	91.8	Very high	95.2	Very high	70 Å²	70	35 Å²	35	26%	0.264	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	8.6	172.6	-65.6	166.7	-167	-136.1	-7.4	113.3	E956 L957 I958 K962 C1086 S1090	E956-R960 WeakPolarHBondContact O-CD 3.41Å; E956-R960 WeakPolarHBondContact O-CG 3.37Å; E956-R960 PolarHBondContact O-N 2.77Å; E956-R960 IonicContact OE1-CZ 3.48Å; E956-R960 VanDerWaalsContact OE1-CZ 3.32Å; E956-R960 IonicContact OE1-NE 2.68Å; E956-R960 PolarHBondContact OE1-NE 3.37Å; E956-R960 IonicContact OE1-NH2 3.79Å; E956-R960 PolarHBondContact OE1-NH2 3.09Å; L957-R960 CarbonylContact O-C 3.59Å; L957-R960 WeakPolarHBondContact O-CA 3.37Å; L957-R960 WeakPolarHBondContact O-CB 3.45Å; L957-R960 PolarHBondContact O-N 2.85Å; I958-R960 PolarHBondContact O-N 3.35Å; R960-K962 VanDerWaalsContact C-N 3.32Å; R960-K962 HydrophobicContact CB-CG 4.42Å; R960-C1086 VanDerWaalsContact CZ-O 3.28Å; R960-C1086 PolarHBondContact NH1-O 2.93Å; R960-C1086 PolarHBondContact NH2-O 2.97Å; R960-S1090 VanDerWaalsContact NH2-CB 3.31Å; R960-S1090 PolarHBondContact NH2-OG 2.68Å
961	G	94.1	Very high	94.8	Very high	67 Å²	67	36.3 Å²	36.3	69%	0.691	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	12.2	-179.2	0	0	0	0	0	114.6	L957 I958 K959	L957-G961 PolarHBondContact O-N 2.64Å; I958-G961 PolarHBondContact O-N 3.12Å; K959-G961 VanDerWaalsContact C-N 3.31Å
962	K	95.3	Very high	94.4	Very high	23 Å²	23	36.8 Å²	36.8	10%	0.1	19%	0.19	C	C	.	.			trans	-76.3	138.5	175.1	-55.8	-60.7	-169.8	167.1	0	110.4	L927 N928 F930 N931 I933 L957 R960 V964	L927-K962 WeakPolarHBondContact O-CE 3.41Å; N928-K962 WeakPolarHBondContact O-CE 3.36Å; N928-K962 PolarHBondContact O-NZ 3.43Å; F930-K962 VanDerWaalsContact O-CD 3.3Å; F930-K962 WeakPolarHBondContact O-CD 3.23Å; F930-K962 WeakPolarHBondContact O-CE 3.3Å; F930-K962 PolarHBondContact O-NZ 3.1Å; N931-K962 PolarHBondContact OD1-NZ 2.64Å; I933-K962 HydrophobicContact CD1-CB 4.18Å; I933-K962 HydrophobicContact CD1-CG 4.46Å; L957-K962 HydrophobicContact CB-CB 4.2Å; L957-K962 HydrophobicContact CB-CG 4.42Å; L957-K962 HydrophobicContact CD2-CG 4.37Å; L957-K962 VanDerWaalsContact O-CB 3.31Å; L957-K962 WeakPolarHBondContact O-CB 3.33Å; L957-K962 WeakPolarHBondContact O-CG 3.17Å; L957-K962 PolarHBondContact O-N 3.43Å; L957-K962 VanDerWaalsContact O-N 3.13Å; R960-K962 VanDerWaalsContact C-N 3.32Å; R960-K962 HydrophobicContact CB-CG 4.42Å; K962-V964 HydrophobicContact CB-CG2 4.12Å; K962-V964 PolarHBondContact O-N 2.84Å
963	H	97	Very high	93.9	Very high	86 Å²	86	34.2 Å²	34.2	40%	0.398	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	100.3	175.1	-171.4	-144.4	0	0	0	109.1	N931 E932 I933 R965	N931-H963 PolarHBondContact O-N 3.27Å; E932-H963 VanDerWaalsContact CD-ND1 3.27Å; E932-H963 IonicContact OE1-CE1 2.8Å; E932-H963 IonicContact OE1-CG 3.25Å; E932-H963 IonicContact OE1-ND1 2.87Å; E932-H963 PolarHBondContact OE1-ND1 3.34Å; E932-H963 IonicContact OE2-CE1 2.74Å; E932-H963 IonicContact OE2-ND1 3.67Å; E932-H963 PolarHBondContact OE2-ND1 3.37Å; E932-H963 VanDerWaalsContact OE2-ND1 3.11Å; I933-H963 PolarHBondContact N-O 3.33Å; H963-R965 PolarHBondContact CE1-NE 3.08Å
964	V	97.5	Very high	93.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.6	-177.3	-169.7	0	0	0	0	110.1	I933 I935 T954 L957 I958 K962	I933-V964 HydrophobicContact CB-CG2 4.36Å; I933-V964 HydrophobicContact CD1-CG2 4.31Å; I933-V964 HydrophobicContact CG2-CG1 4.48Å; I933-V964 WeakPolarHBondContact O-CA 3.34Å; I935-V964 HydrophobicContact CD1-CG1 3.56Å; I935-V964 HydrophobicContact CG1-CG1 4.2Å; T954-V964 HydrophobicContact CG2-CB 4.31Å; T954-V964 HydrophobicContact CG2-CG1 4.02Å; L957-V964 HydrophobicContact CB-CG2 3.66Å; L957-V964 HydrophobicContact CD1-CG2 4.2Å; I958-V964 HydrophobicContact CD1-CB 4.39Å; I958-V964 HydrophobicContact CG1-CB 4.06Å; I958-V964 HydrophobicContact CG1-CG2 4.12Å; K962-V964 HydrophobicContact CB-CG2 4.12Å; K962-V964 PolarHBondContact O-N 2.84Å
965	R	97.8	Very high	92.5	Very high	25 Å²	25	37.4 Å²	37.4	9%	0.094	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.7	-179.9	-69.9	-177.2	-74.2	162.2	-8.1	111.1	E932 I933 I934 I935 H963 I999 D1002	E932-R965 IonicContact OE2-CZ 2.73Å; E932-R965 IonicContact OE2-NE 3.22Å; E932-R965 IonicContact OE2-NH2 2.67Å; E932-R965 PolarHBondContact OE2-NH2 3.22Å; I933-R965 PolarHBondContact O-N 3.19Å; I934-R965 CarbonylContact C-O 3.55Å; I934-R965 WeakPolarHBondContact CA-O 3.21Å; I935-R965 PolarHBondContact N-O 3.18Å; H963-R965 PolarHBondContact CE1-NE 3.08Å; R965-I999 HydrophobicContact CB-CD1 4.1Å; R965-D1002 IonicContact CZ-OD2 2.69Å; R965-D1002 IonicContact NH1-OD2 3.58Å; R965-D1002 PolarHBondContact NH1-OD2 3.01Å; R965-D1002 IonicContact NH2-OD2 2.94Å; R965-D1002 PolarHBondContact NH2-OD2 3.27Å
966	F	97.9	Very high	92	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.8	171.4	-71.4	-101.3	0	0	0	110.1	I935 P937 L950 T954 I968 L983 V988 I992 V993 H994	I935-F966 HydrophobicContact CB-CD1 3.86Å; I935-F966 HydrophobicContact CB-CE1 3.93Å; I935-F966 HydrophobicContact CB-CG 4.35Å; I935-F966 HydrophobicContact CB-CZ 4.46Å; I935-F966 HydrophobicContact CD1-CE1 3.97Å; I935-F966 HydrophobicContact CD1-CE2 4.02Å; I935-F966 HydrophobicContact CD1-CZ 3.66Å; I935-F966 HydrophobicContact CG2-CD1 3.9Å; I935-F966 HydrophobicContact CG2-CE1 3.7Å; I935-F966 HydrophobicContact CG2-CZ 4.49Å; I935-F966 CarbonylContact O-C 3.39Å; I935-F966 VanDerWaalsContact O-CA 3.32Å; I935-F966 WeakPolarHBondContact O-CA 3.45Å; P937-F966 HydrophobicContact CG-CD1 4.04Å; L950-F966 HydrophobicContact CD2-CE1 3.97Å; L950-F966 HydrophobicContact CD2-CZ 4.47Å; L950-F966 HydrophobicContact CG-CE1 4.27Å; L950-F966 HydrophobicContact CG-CZ 4.28Å; T954-F966 HydrophobicContact CG2-CE2 3.9Å; T954-F966 WeakPolarHBondContact OG1-CZ 3.17Å; F966-I968 HydrophobicContact CB-CD1 4.37Å; F966-L983 HydrophobicContact CD1-CD1 4Å; F966-L983 HydrophobicContact CD1-CD2 4.11Å; F966-L983 HydrophobicContact CE1-CD1 4.49Å; F966-L983 HydrophobicContact CE1-CD2 3.76Å; F966-L983 HydrophobicContact CG-CD1 4.43Å; F966-L983 HydrophobicContact CZ-CD2 4.36Å; F966-V988 HydrophobicContact CD2-CG1 3.84Å; F966-V988 HydrophobicContact CE2-CG1 3.58Å; F966-V988 HydrophobicContact CE2-CG2 4.36Å; F966-V988 HydrophobicContact CZ-CG1 4.23Å; F966-V988 HydrophobicContact CZ-CG2 4.24Å; F966-I992 HydrophobicContact CD2-CD1 4.43Å; F966-I992 HydrophobicContact CE2-CD1 4.4Å; F966-I992 PolarHBondContact N-O 3.45Å; F966-V993 HydrophobicContact CB-CB 4.49Å; F966-V993 HydrophobicContact CB-CG1 4.48Å; F966-V993 HydrophobicContact CB-CG2 4.14Å; F966-V993 HydrophobicContact CD2-CG2 4.33Å; F966-V993 HydrophobicContact CG-CG2 4.41Å; F966-H994 PolarHBondContact O-N 3.44Å
967	A	97.4	Very high	91.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115.2	170.9	0	0	0	0	0	110.1	I934 I935 T936 I999 F1003 L1036	I934-A967 HydrophobicContact CG2-CB 3.8Å; I935-A967 PolarHBondContact O-N 3.39Å; T936-A967 HydrophobicContact CG2-CB 4.05Å; A967-I999 HydrophobicContact CB-CD1 4.11Å; A967-I999 HydrophobicContact CB-CG2 3.46Å; A967-I999 VanDerWaalsContact CB-CG2 3.46Å; A967-F1003 HydrophobicContact CB-CZ 4.13Å; A967-L1036 HydrophobicContact CB-CD1 4.11Å; A967-L1036 HydrophobicContact CB-CD2 3.74Å; A967-L1036 WeakPolarHBondContact O-CD1 3.5Å
968	I	95.6	Very high	91.3	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.6	-178.1	-51.1	-54.4	0	0	0	109.8	P937 F966 L979 L983 V993 H994 M996	P937-I968 HydrophobicContact CG-CD1 3.76Å; F966-I968 HydrophobicContact CB-CD1 4.37Å; I968-L979 HydrophobicContact CD1-CD2 4.31Å; I968-L979 HydrophobicContact CD1-CG 4.24Å; I968-L979 HydrophobicContact CG2-CB 4.45Å; I968-L983 HydrophobicContact CD1-CD1 3.58Å; I968-V993 HydrophobicContact CD1-CG1 4.01Å; I968-V993 HydrophobicContact CG1-CG1 3.5Å; I968-V993 VanDerWaalsContact CG1-CG1 3.5Å; I968-H994 PolarHBondContact N-O 2.96Å; I968-M996 WeakPolarHBondContact O-CB 3.49Å; I968-M996 PolarHBondContact O-N 3.42Å
969	H	94.2	Very high	91.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.159	C	C	.	.			trans	-92.3	133.7	171.6	-169.1	-86.1	0	0	0	109.6	V971 A972 M996 T1017 M1033 P1034 L1036	H969-V971 PolarHBondContact O-N 3.25Å; H969-A972 HydrophobicContact CB-CB 4.08Å; H969-A972 WeakPolarHBondContact O-CB 3.39Å; H969-A972 PolarHBondContact O-N 3.1Å; H969-M996 PolarHBondContact CD2-SD 2.8Å; H969-T1017 HydrophobicContact CB-CG2 3.89Å; H969-T1017 WeakPolarHBondContact ND1-CG2 3.38Å; H969-M1033 VanDerWaalsContact CE1-CE 3.47Å; H969-M1033 WeakPolarHBondContact CE1-CE 3.39Å; H969-P1034 PolarHBondContact NE2-O 2.83Å; H969-L1036 HydrophobicContact CB-CD1 4.15Å
970	P	88.3	Confident	91	Very high	37 Å²	37	22.1 Å²	22.1	24%	0.24	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.8	-170.3	-29.9	35.8	0	0	0	116.5	A885 M996	A885-P970 HydrophobicContact CB-CB 3.96Å; A885-P970 HydrophobicContact CB-CG 4.42Å; P970-M996 HydrophobicContact CG-CE 4.3Å
971	V	87.8	Confident	91	Very high	27 Å²	27	18.9 Å²	18.9	16%	0.164	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	14.6	175.4	-52.3	0	0	0	0	114.6	M882 A885 M886 H969 G973 M1033	M882-V971 HydrophobicContact CB-CG1 4.32Å; M882-V971 HydrophobicContact CE-CB 3.91Å; M882-V971 HydrophobicContact CE-CG1 3.59Å; A885-V971 HydrophobicContact CB-CG1 3.9Å; M886-V971 HydrophobicContact CG-CB 4.37Å; M886-V971 HydrophobicContact CG-CG1 3.9Å; M886-V971 HydrophobicContact CG-CG2 3.97Å; M886-V971 HydrophobicContact SD-CG1 4.28Å; H969-V971 PolarHBondContact O-N 3.25Å; V971-G973 PolarHBondContact O-N 3.35Å; V971-M1033 HydrophobicContact CG2-CE 4.36Å
972	A	87.9	Confident	90.9	Very high	11 Å²	11	15.8 Å²	15.8	9%	0.091	8%	0.084	C	C	.	.			trans	-74.4	95.2	174.9	0	0	0	0	0	111.3	H969 L979	H969-A972 HydrophobicContact CB-CB 4.08Å; H969-A972 WeakPolarHBondContact O-CB 3.39Å; H969-A972 PolarHBondContact O-N 3.1Å; A972-L979 HydrophobicContact CB-CD2 3.7Å; A972-L979 WeakPolarHBondContact O-CB 3.07Å
973	G	84.6	Confident	90.8	Very high	17 Å²	17	14.8 Å²	14.8	18%	0.175	8%	0.08	C	C	.	.	S	Bend	trans	151.9	-157	176.4	0	0	0	0	0	112.2	V971	V971-G973 PolarHBondContact O-N 3.35Å
974	R	83.3	Confident	90.6	Very high	68 Å²	68	11.1 Å²	11.1	26%	0.257	6%	0.064	S	C	.	.	S	Bend	trans	-112.8	8.7	168.2	-66.2	-174.3	178.3	-171.1	2.3	113.1	P699 L766 P838 Y939	P699-R974 HydrophobicContact CB-CB 4.31Å; P699-R974 HydrophobicContact CG-CB 4.14Å; L766-R974 HydrophobicContact CD2-CB 4.26Å; L766-R974 PolarHBondContact O-NH1 3.48Å; P838-R974 WeakPolarHBondContact CG-O 3.21Å; Y939-R974 HydrophobicContact CD2-CG 4.43Å; Y939-R974 HydrophobicContact CE1-CG 4.09Å; Y939-R974 VanDerWaalsContact CE1-NE 3.29Å; Y939-R974 HydrophobicContact CE2-CG 3.97Å; Y939-R974 VanDerWaalsContact CZ-NE 3.33Å; Y939-R974 WeakPolarHBondContact OH-CD 3.47Å; Y939-R974 PolarHBondContact OH-NE 3Å; Y939-R974 VanDerWaalsContact OH-NE 3.1Å
975	M	80.3	Confident	90.3	Very high	4 Å²	4	13.3 Å²	13.3	2%	0.02	8%	0.075	C	C	.	.	S	Bend	trans	-161.2	147.5	-178.9	-171.7	176.7	-157.1	0	0	109.6	M522 P699 V702 G977 Q978	M522-M975 HydrophobicContact CB-CE 3.52Å; M522-M975 HydrophobicContact CE-CE 3.67Å; M522-M975 HydrophobicContact CG-CE 4.01Å; P699-M975 HydrophobicContact CB-CB 4.1Å; P699-M975 HydrophobicContact CB-SD 4.34Å; P699-M975 HydrophobicContact CG-CB 3.87Å; P699-M975 HydrophobicContact CG-SD 4.26Å; V702-M975 HydrophobicContact CB-CE 3.88Å; V702-M975 HydrophobicContact CG1-CE 3.76Å; V702-M975 HydrophobicContact CG2-CE 3.96Å; M975-G977 PolarHBondContact O-N 3.09Å; M975-Q978 HydrophobicContact CB-CB 4.13Å; M975-Q978 WeakPolarHBondContact O-CB 3.42Å; M975-Q978 PolarHBondContact O-N 3.13Å; M975-Q978 VanDerWaalsContact O-N 3.11Å
976	P	84.2	Confident	90	Very high	4 Å²	4	12.6 Å²	12.6	3%	0.026	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	125.5	173.7	-30.7	35.6	0	0	0	113.1	H518 S519 T842 M882 Q978	H518-P976 CarbonylContact C-O 3.33Å; H518-P976 HydrophobicContact CB-CB 3.6Å; S519-P976 WeakPolarHBondContact CA-O 3.49Å; S519-P976 WeakPolarHBondContact CB-O 3.17Å; S519-P976 PolarHBondContact N-O 2.94Å; S519-P976 PolarHBondContact OG-O 3.49Å; T842-P976 HydrophobicContact CG2-CG 3.78Å; M882-P976 HydrophobicContact CE-CG 4.37Å; M882-P976 HydrophobicContact CG-CG 4.1Å; M882-P976 HydrophobicContact SD-CG 3.61Å; P976-Q978 PolarHBondContact O-N 2.97Å
977	G	85.6	Confident	89.7	Confident	9 Å²	9	14.4 Å²	14.4	9%	0.093	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	11.5	178.2	0	0	0	0	0	115.7	M975 L979 N980 V981	M975-G977 PolarHBondContact O-N 3.09Å; G977-L979 PolarHBondContact O-N 2.87Å; G977-N980 VanDerWaalsContact CA-OD1 3.31Å; G977-N980 WeakPolarHBondContact CA-OD1 3.43Å; G977-N980 PolarHBondContact O-N 3.37Å; G977-N980 PolarHBondContact O-OD1 2.91Å; G977-V981 PolarHBondContact O-N 2.96Å
978	Q	88.6	Confident	89.6	Confident	5 Å²	5	14.9 Å²	14.9	2%	0.023	10%	0.095	C	C	.	.	H	α-helix	trans	-59.9	-37.1	-176.8	-164.1	-172.1	7.2	0	0	112	S519 T696 P699 M975 P976 V981 L982	S519-Q978 PolarHBondContact OG-N 2.82Å; T696-Q978 PolarHBondContact O-NE2 3.38Å; P699-Q978 VanDerWaalsContact CG-NE2 3.33Å; M975-Q978 HydrophobicContact CB-CB 4.13Å; M975-Q978 WeakPolarHBondContact O-CB 3.42Å; M975-Q978 PolarHBondContact O-N 3.13Å; M975-Q978 VanDerWaalsContact O-N 3.11Å; P976-Q978 PolarHBondContact O-N 2.97Å; Q978-V981 PolarHBondContact O-N 2.87Å; Q978-L982 HydrophobicContact CG-CD1 3.85Å; Q978-L982 HydrophobicContact CG-CG 4.4Å; Q978-L982 WeakPolarHBondContact O-CG 3.48Å; Q978-L982 PolarHBondContact O-N 3.33Å
979	L	90.8	Very high	89.4	Confident	3 Å²	3	17.1 Å²	17.1	2%	0.016	11%	0.11	C	C	.	.	H	α-helix	trans	-69	-35.3	-176.4	-166	50.5	0	0	0	111.8	P937 C942 I968 A972 G977 V981 L982 L983	P937-L979 HydrophobicContact CB-CD1 4.36Å; P937-L979 HydrophobicContact CB-CD2 4.02Å; P937-L979 HydrophobicContact CB-CG 4.47Å; P937-L979 HydrophobicContact CG-CD2 3.78Å; P937-L979 HydrophobicContact CG-CG 4.17Å; P937-L979 WeakPolarHBondContact O-CD2 3.44Å; C942-L979 WeakPolarHBondContact SG-CD1 3.22Å; I968-L979 HydrophobicContact CD1-CD2 4.31Å; I968-L979 HydrophobicContact CD1-CG 4.24Å; I968-L979 HydrophobicContact CG2-CB 4.45Å; A972-L979 HydrophobicContact CB-CD2 3.7Å; A972-L979 WeakPolarHBondContact O-CB 3.07Å; G977-L979 PolarHBondContact O-N 2.87Å; L979-V981 VanDerWaalsContact C-N 3.34Å; L979-V981 PolarHBondContact O-N 2.96Å; L979-L982 PolarHBondContact O-N 3.3Å; L979-L983 HydrophobicContact CG-CD1 4.32Å; L979-L983 WeakPolarHBondContact O-CB 3.15Å; L979-L983 VanDerWaalsContact O-CG 3.25Å; L979-L983 WeakPolarHBondContact O-CG 3.22Å; L979-L983 PolarHBondContact O-N 3.44Å
980	N	92.1	Very high	89.2	Confident	5 Å²	5	19.6 Å²	19.6	3%	0.027	12%	0.12	C	C	.	.	H	α-helix	trans	-61.2	-43.2	172.6	-43.9	67	0	0	0	110.7	A516 F579 G977 A984 E995	A516-N980 HydrophobicContact CB-CB 3.98Å; A516-N980 WeakPolarHBondContact CB-ND2 3.18Å; F579-N980 HydrophobicContact CE1-CB 4.33Å; F579-N980 WeakPolarHBondContact CE1-O 3.33Å; F579-N980 HydrophobicContact CZ-CB 4.29Å; G977-N980 VanDerWaalsContact CA-OD1 3.31Å; G977-N980 WeakPolarHBondContact CA-OD1 3.43Å; G977-N980 PolarHBondContact O-N 3.37Å; G977-N980 PolarHBondContact O-OD1 2.91Å; N980-A984 WeakPolarHBondContact O-CB 3.5Å; N980-A984 PolarHBondContact O-N 2.92Å; N980-E995 PolarHBondContact ND2-OE1 3.48Å
981	V	90.9	Very high	89.4	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-65.4	-42	176.3	-176	0	0	0	0	111.6	M575 M578 F579 V695 G977 Q978 L979 A984 E985	M575-V981 HydrophobicContact CB-CG1 4.46Å; M575-V981 HydrophobicContact CG-CG1 4.28Å; M578-V981 HydrophobicContact SD-CG1 3.98Å; F579-V981 HydrophobicContact CE2-CG2 3.91Å; F579-V981 HydrophobicContact CZ-CB 4.35Å; F579-V981 HydrophobicContact CZ-CG2 3.8Å; V695-V981 HydrophobicContact CG1-CG1 3.77Å; G977-V981 PolarHBondContact O-N 2.96Å; Q978-V981 PolarHBondContact O-N 2.87Å; L979-V981 VanDerWaalsContact C-N 3.34Å; L979-V981 PolarHBondContact O-N 2.96Å; V981-A984 PolarHBondContact O-N 3.37Å; V981-E985 WeakPolarHBondContact O-CB 3.26Å; V981-E985 PolarHBondContact O-N 3.11Å
982	L	91.8	Very high	89.7	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-72.1	-29.7	-179.5	-69.7	166.5	0	0	0	113	V695 T696 C942 Q978 L979 E985 A986	V695-L982 HydrophobicContact CB-CD2 4.05Å; V695-L982 HydrophobicContact CG1-CD2 3.69Å; V695-L982 HydrophobicContact CG1-CG 4.41Å; T696-L982 HydrophobicContact CG2-CD2 4.02Å; C942-L982 HydrophobicContact CB-CD1 3.91Å; Q978-L982 HydrophobicContact CG-CD1 3.85Å; Q978-L982 HydrophobicContact CG-CG 4.4Å; Q978-L982 WeakPolarHBondContact O-CG 3.48Å; Q978-L982 PolarHBondContact O-N 3.33Å; L979-L982 PolarHBondContact O-N 3.3Å; L982-E985 WeakPolarHBondContact CD2-OE2 3.43Å; L982-A986 PolarHBondContact O-N 3.43Å
983	L	93.7	Very high	90.1	Very high	2 Å²	2	22 Å²	22	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-72.6	-39.4	170.3	-69.8	168.4	0	0	0	111.3	P937 L941 F966 I968 L979 A986 G987 V988 V993	P937-L983 HydrophobicContact CG-CD1 4.19Å; L941-L983 HydrophobicContact CD2-CD2 4.39Å; F966-L983 HydrophobicContact CD1-CD1 4Å; F966-L983 HydrophobicContact CD1-CD2 4.11Å; F966-L983 HydrophobicContact CE1-CD1 4.49Å; F966-L983 HydrophobicContact CE1-CD2 3.76Å; F966-L983 HydrophobicContact CG-CD1 4.43Å; F966-L983 HydrophobicContact CZ-CD2 4.36Å; I968-L983 HydrophobicContact CD1-CD1 3.58Å; L979-L983 HydrophobicContact CG-CD1 4.32Å; L979-L983 WeakPolarHBondContact O-CB 3.15Å; L979-L983 VanDerWaalsContact O-CG 3.25Å; L979-L983 WeakPolarHBondContact O-CG 3.22Å; L979-L983 PolarHBondContact O-N 3.44Å; L983-A986 WeakPolarHBondContact O-CB 3.22Å; L983-A986 PolarHBondContact O-N 2.87Å; L983-G987 PolarHBondContact O-N 3.44Å; L983-V988 HydrophobicContact CB-CB 4.07Å; L983-V988 HydrophobicContact CB-CG2 4.17Å; L983-V988 HydrophobicContact CD2-CG2 4.12Å; L983-V988 WeakPolarHBondContact O-CB 3.43Å; L983-V988 WeakPolarHBondContact O-CG2 3.49Å; L983-V988 PolarHBondContact O-N 3.28Å; L983-V993 HydrophobicContact CD1-CG1 4.4Å
984	A	92	Very high	90.6	Very high	9 Å²	9	23.4 Å²	23.4	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-64.9	-38.6	173.3	0	0	0	0	0	112.4	M578 F579 N980 V981 A986 G987	M578-A984 HydrophobicContact CB-CB 4.15Å; F579-A984 HydrophobicContact CD1-CB 3.37Å; F579-A984 HydrophobicContact CE1-CB 3.55Å; F579-A984 HydrophobicContact CG-CB 4.04Å; F579-A984 HydrophobicContact CZ-CB 4.34Å; N980-A984 WeakPolarHBondContact O-CB 3.5Å; N980-A984 PolarHBondContact O-N 2.92Å; V981-A984 PolarHBondContact O-N 3.37Å; A984-A986 VanDerWaalsContact C-N 3.26Å; A984-A986 PolarHBondContact O-N 3Å; A984-G987 WeakPolarHBondContact O-CA 3.04Å; A984-G987 PolarHBondContact O-N 3.23Å
985	E	91.2	Very high	91.1	Very high	48 Å²	48	21.2 Å²	21.2	22%	0.224	12%	0.123	C	C	.	.	H	α-helix	trans	-56.8	-39.5	170.5	-176.4	-169.7	-147.1	0	0	111.8	M578 V695 Y948 V981 L982 G987	M578-E985 HydrophobicContact SD-CB 4.35Å; V695-E985 WeakPolarHBondContact CB-OE1 3.4Å; V695-E985 HydrophobicContact CG2-CG 4.2Å; V695-E985 WeakPolarHBondContact CG2-OE1 3.5Å; Y948-E985 PolarHBondContact OH-OE1 3.39Å; Y948-E985 PolarHBondContact OH-OE2 2.89Å; V981-E985 WeakPolarHBondContact O-CB 3.26Å; V981-E985 PolarHBondContact O-N 3.11Å; L982-E985 WeakPolarHBondContact CD2-OE2 3.43Å; E985-G987 PolarHBondContact O-N 2.98Å
986	A	92.6	Very high	91.7	Very high	10 Å²	10	21.3 Å²	21.3	8%	0.083	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.2	174.9	0	0	0	0	0	114.2	Q947 Y948 A951 L982 L983 A984	Q947-A986 HydrophobicContact CB-CB 3.98Å; Q947-A986 HydrophobicContact CG-CB 3.77Å; Q947-A986 WeakPolarHBondContact O-CB 3.46Å; Y948-A986 HydrophobicContact CD1-CB 4.13Å; Y948-A986 HydrophobicContact CE1-CB 4.48Å; A951-A986 HydrophobicContact CB-CB 3.83Å; A951-A986 VanDerWaalsContact CB-O 3.24Å; A951-A986 WeakPolarHBondContact CB-O 3.45Å; L982-A986 PolarHBondContact O-N 3.43Å; L983-A986 WeakPolarHBondContact O-CB 3.22Å; L983-A986 PolarHBondContact O-N 2.87Å; A984-A986 VanDerWaalsContact C-N 3.26Å; A984-A986 PolarHBondContact O-N 3Å
987	G	91.6	Very high	92.1	Very high	38 Å²	38	27.6 Å²	27.6	39%	0.392	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	28	-177.7	0	0	0	0	0	114.2	L983 A984 E985	L983-G987 PolarHBondContact O-N 3.44Å; A984-G987 WeakPolarHBondContact O-CA 3.04Å; A984-G987 PolarHBondContact O-N 3.23Å; E985-G987 PolarHBondContact O-N 2.98Å
988	V	94.5	Very high	92.5	Very high	9 Å²	9	33.1 Å²	33.1	6%	0.055	18%	0.18	C	C	.	.			trans	-77.2	124.4	166.4	-176.3	0	0	0	0	108.9	A951 F966 L983 I992 V993	A951-V988 HydrophobicContact CB-CG2 3.59Å; F966-V988 HydrophobicContact CD2-CG1 3.84Å; F966-V988 HydrophobicContact CE2-CG1 3.58Å; F966-V988 HydrophobicContact CE2-CG2 4.36Å; F966-V988 HydrophobicContact CZ-CG1 4.23Å; F966-V988 HydrophobicContact CZ-CG2 4.24Å; L983-V988 HydrophobicContact CB-CB 4.07Å; L983-V988 HydrophobicContact CB-CG2 4.17Å; L983-V988 HydrophobicContact CD2-CG2 4.12Å; L983-V988 WeakPolarHBondContact O-CB 3.43Å; L983-V988 WeakPolarHBondContact O-CG2 3.49Å; L983-V988 PolarHBondContact O-N 3.28Å; V988-I992 HydrophobicContact CG1-CD1 4.07Å; V988-I992 HydrophobicContact CG1-CG1 4.11Å; V988-V993 HydrophobicContact CG1-CG2 3.69Å
989	P	92.3	Very high	92.8	Very high	49 Å²	49	33 Å²	33	32%	0.318	18%	0.18	S	C	.	.			trans	-61.2	139.7	175.7	-25.7	37	0	0	0	112.9	D991 I992 V993	P989-D991 WeakPolarHBondContact CB-OD1 3.23Å; P989-D991 PolarHBondContact O-N 2.9Å; P989-I992 HydrophobicContact CB-CG1 4.43Å; P989-I992 WeakPolarHBondContact O-CG1 3.46Å; P989-I992 PolarHBondContact O-N 2.93Å; P989-V993 WeakPolarHBondContact O-CG2 3.36Å
990	Y	90.1	Very high	93	Very high	53 Å²	53	34 Å²	34	21%	0.208	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-71.7	-13.5	-175.5	64.1	-101.9	0	0	0	114.3	R581 Q640	R581-Y990 HydrophobicContact CG-CD1 4.08Å; R581-Y990 HydrophobicContact CG-CE1 3.82Å; Q640-Y990 HydrophobicContact CB-CD2 4.36Å; Q640-Y990 HydrophobicContact CB-CE1 4.47Å; Q640-Y990 HydrophobicContact CB-CE2 4.16Å; Q640-Y990 HydrophobicContact CG-CD1 3.92Å; Q640-Y990 HydrophobicContact CG-CD2 4.14Å; Q640-Y990 HydrophobicContact CG-CE1 4.11Å; Q640-Y990 HydrophobicContact CG-CE2 4.34Å; Q640-Y990 HydrophobicContact CG-CG 3.94Å
991	D	91.2	Very high	93.2	Very high	77 Å²	77	37.2 Å²	37.2	41%	0.412	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-85.8	-13.4	-178.3	39.3	13.9	0	0	0	113.6	R581 P989	R581-D991 IonicContact CZ-OD2 2.79Å; R581-D991 IonicContact NH1-OD2 2.68Å; R581-D991 PolarHBondContact NH1-OD2 3.01Å; P989-D991 WeakPolarHBondContact CB-OD1 3.23Å; P989-D991 PolarHBondContact O-N 2.9Å
992	I	94.7	Very high	93.4	Very high	29 Å²	29	38.7 Å²	38.7	15%	0.149	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-102.8	10	167.8	64.6	169.6	0	0	0	112.7	T954 I958 F966 V988 P989	T954-I992 HydrophobicContact CG2-CD1 3.74Å; I958-I992 HydrophobicContact CD1-CD1 3.78Å; F966-I992 HydrophobicContact CD2-CD1 4.43Å; F966-I992 HydrophobicContact CE2-CD1 4.4Å; F966-I992 PolarHBondContact N-O 3.45Å; V988-I992 HydrophobicContact CG1-CD1 4.07Å; V988-I992 HydrophobicContact CG1-CG1 4.11Å; P989-I992 HydrophobicContact CB-CG1 4.43Å; P989-I992 WeakPolarHBondContact O-CG1 3.46Å; P989-I992 PolarHBondContact O-N 2.93Å
993	V	95.6	Very high	93.7	Very high	19 Å²	19	38.7 Å²	38.7	12%	0.115	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	101.6	-179.1	179.2	0	0	0	0	109	F966 I968 L983 V988 P989	F966-V993 HydrophobicContact CB-CB 4.49Å; F966-V993 HydrophobicContact CB-CG1 4.48Å; F966-V993 HydrophobicContact CB-CG2 4.14Å; F966-V993 HydrophobicContact CD2-CG2 4.33Å; F966-V993 HydrophobicContact CG-CG2 4.41Å; I968-V993 HydrophobicContact CD1-CG1 4.01Å; I968-V993 HydrophobicContact CG1-CG1 3.5Å; I968-V993 VanDerWaalsContact CG1-CG1 3.5Å; L983-V993 HydrophobicContact CD1-CG1 4.4Å; V988-V993 HydrophobicContact CG1-CG2 3.69Å; P989-V993 WeakPolarHBondContact O-CG2 3.36Å
994	H	95.7	Very high	93.8	Very high	47 Å²	47	42.4 Å²	42.4	22%	0.218	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.4	-174.7	-59.5	-73.6	0	0	0	112	F966 I968 E998 I999	F966-H994 PolarHBondContact O-N 3.44Å; I968-H994 PolarHBondContact N-O 2.96Å; H994-E998 WeakPolarHBondContact CA-OE2 3.46Å; H994-E998 HydrophobicContact CB-CB 4.41Å; H994-E998 IonicContact ND1-OE2 3.28Å; H994-I999 HydrophobicContact CB-CB 3.92Å; H994-I999 HydrophobicContact CB-CD1 3.99Å; H994-I999 HydrophobicContact CB-CG2 4.2Å
995	E	93.7	Very high	93.9	Very high	22 Å²	22	48.9 Å²	48.9	10%	0.103	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	153.1	171.2	-62.9	-63.2	156	0	0	110.9	P515 N980 D997 E998 I999	P515-E995 HydrophobicContact CB-CG 3.97Å; P515-E995 HydrophobicContact CG-CG 4.36Å; N980-E995 PolarHBondContact ND2-OE1 3.48Å; E995-D997 VanDerWaalsContact C-N 3.27Å; E995-D997 PolarHBondContact O-N 3Å; E995-D997 VanDerWaalsContact O-N 3.1Å; E995-E998 HydrophobicContact CB-CG 4.34Å; E995-E998 PolarHBondContact N-OE2 3.14Å; E995-E998 WeakPolarHBondContact O-CB 3.34Å; E995-E998 PolarHBondContact O-N 3.05Å; E995-I999 WeakPolarHBondContact O-CG2 3.49Å; E995-I999 PolarHBondContact O-N 3.26Å
996	M	94	Very high	94.1	Very high	7 Å²	7	46.7 Å²	46.7	3%	0.034	26%	0.261	C	S	.	.	H	α-helix	trans	-44.8	-45.5	-176.2	172.6	-173.9	74.6	0	0	114.4	I968 H969 P970 E998 I999 N1000 P1034 L1036	I968-M996 WeakPolarHBondContact O-CB 3.49Å; I968-M996 PolarHBondContact O-N 3.42Å; H969-M996 PolarHBondContact CD2-SD 2.8Å; P970-M996 HydrophobicContact CG-CE 4.3Å; M996-E998 VanDerWaalsContact C-N 3.28Å; M996-E998 PolarHBondContact O-N 2.82Å; M996-I999 PolarHBondContact O-N 2.98Å; M996-N1000 VanDerWaalsContact CG-ND2 3.34Å; M996-N1000 WeakPolarHBondContact CG-ND2 3.49Å; M996-N1000 VanDerWaalsContact O-CB 3.24Å; M996-N1000 WeakPolarHBondContact O-CB 3.38Å; M996-N1000 PolarHBondContact O-N 3.43Å; M996-P1034 HydrophobicContact CE-CB 3.56Å; M996-P1034 HydrophobicContact SD-CB 3.96Å; M996-L1036 HydrophobicContact CB-CD2 3.89Å; M996-L1036 HydrophobicContact CG-CD2 3.86Å; M996-L1036 HydrophobicContact CG-CG 4.37Å
997	D	91.1	Very high	94.4	Very high	136 Å²	136	47.8 Å²	47.8	73%	0.727	27%	0.265	S	S	*	.	H	α-helix	trans	-71.2	-22.4	-176.3	-67.3	-23.1	0	0	0	112.8	E995	E995-D997 VanDerWaalsContact C-N 3.27Å; E995-D997 PolarHBondContact O-N 3Å; E995-D997 VanDerWaalsContact O-N 3.1Å
998	E	93.6	Very high	94.7	Very high	124 Å²	124	46 Å²	46	58%	0.579	25%	0.247	S	C	*	.	H	α-helix	trans	-80.1	-36.9	178.2	-53.8	177.5	147.1	0	0	111.8	H994 E995 M996	H994-E998 WeakPolarHBondContact CA-OE2 3.46Å; H994-E998 HydrophobicContact CB-CB 4.41Å; H994-E998 IonicContact ND1-OE2 3.28Å; E995-E998 HydrophobicContact CB-CG 4.34Å; E995-E998 PolarHBondContact N-OE2 3.14Å; E995-E998 WeakPolarHBondContact O-CB 3.34Å; E995-E998 PolarHBondContact O-N 3.05Å; M996-E998 VanDerWaalsContact C-N 3.28Å; M996-E998 PolarHBondContact O-N 2.82Å
999	I	95.9	Very high	94.9	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-108.3	-14.3	-166.9	-164.9	160.6	0	0	0	114.5	I934 R965 A967 H994 E995 M996 A1001 D1002 L1036	I934-I999 HydrophobicContact CD1-CD1 3.91Å; I934-I999 HydrophobicContact CD1-CG1 3.91Å; I934-I999 HydrophobicContact CG1-CD1 4.26Å; I934-I999 HydrophobicContact CG2-CD1 4.21Å; R965-I999 HydrophobicContact CB-CD1 4.1Å; A967-I999 HydrophobicContact CB-CD1 4.11Å; A967-I999 HydrophobicContact CB-CG2 3.46Å; A967-I999 VanDerWaalsContact CB-CG2 3.46Å; H994-I999 HydrophobicContact CB-CB 3.92Å; H994-I999 HydrophobicContact CB-CD1 3.99Å; H994-I999 HydrophobicContact CB-CG2 4.2Å; E995-I999 WeakPolarHBondContact O-CG2 3.49Å; E995-I999 PolarHBondContact O-N 3.26Å; M996-I999 PolarHBondContact O-N 2.98Å; I999-A1001 PolarHBondContact O-N 3.32Å; I999-D1002 PolarHBondContact O-N 3.21Å; I999-L1036 HydrophobicContact CG2-CD2 4.37Å
1000	N	95.1	Very high	95.1	Very high	25 Å²	25	43.2 Å²	43.2	13%	0.134	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.7	-179.8	-110.3	-23.3	0	0	0	114.2	M996 F1003 V1035 L1036 R1037	M996-N1000 VanDerWaalsContact CG-ND2 3.34Å; M996-N1000 WeakPolarHBondContact CG-ND2 3.49Å; M996-N1000 VanDerWaalsContact O-CB 3.24Å; M996-N1000 WeakPolarHBondContact O-CB 3.38Å; M996-N1000 PolarHBondContact O-N 3.43Å; N1000-F1003 WeakPolarHBondContact OD1-CE2 3.32Å; N1000-V1035 PolarHBondContact ND2-O 3.21Å; N1000-L1036 WeakPolarHBondContact OD1-CA 3.38Å; N1000-R1037 PolarHBondContact OD1-N 2.95Å
1001	A	95.1	Very high	95.5	Very high	72 Å²	72	40.7 Å²	40.7	60%	0.595	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.9	177.2	0	0	0	0	0	114.4	I999	I999-A1001 PolarHBondContact O-N 3.32Å
1002	D	96.2	Very high	95.7	Very high	34 Å²	34	37.1 Å²	37.1	18%	0.182	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-13.9	-175.5	-86.2	-6.5	0	0	0	114.3	R965 I999 P1004 K1005 T1006	R965-D1002 IonicContact CZ-OD2 2.69Å; R965-D1002 IonicContact NH1-OD2 3.58Å; R965-D1002 PolarHBondContact NH1-OD2 3.01Å; R965-D1002 IonicContact NH2-OD2 2.94Å; R965-D1002 PolarHBondContact NH2-OD2 3.27Å; I999-D1002 PolarHBondContact O-N 3.21Å; D1002-P1004 VanDerWaalsContact C-CD 3.43Å; D1002-P1004 VanDerWaalsContact C-N 3.32Å; D1002-K1005 WeakPolarHBondContact O-CA 3.47Å; D1002-K1005 WeakPolarHBondContact O-CB 3.41Å; D1002-K1005 PolarHBondContact O-N 3.12Å; D1002-K1005 IonicContact OD1-NZ 3.11Å; D1002-K1005 PolarHBondContact OD1-NZ 3.36Å; D1002-T1006 PolarHBondContact O-N 3.04Å; D1002-T1006 PolarHBondContact O-OG1 2.89Å
1003	F	97.3	Very high	95.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-50.3	-42.7	174.6	-73.9	-62.2	0	0	0	113.7	I934 T936 A967 N1000 K1005 T1006 V1009 L1036 R1037 V1038 L1040 A1041	I934-F1003 HydrophobicContact CB-CE1 4.19Å; I934-F1003 HydrophobicContact CD1-CD1 4.02Å; I934-F1003 HydrophobicContact CD1-CE1 4.02Å; I934-F1003 HydrophobicContact CG2-CE1 3.74Å; I934-F1003 HydrophobicContact CG2-CZ 4.18Å; T936-F1003 HydrophobicContact CG2-CE1 4.12Å; T936-F1003 HydrophobicContact CG2-CZ 3.98Å; A967-F1003 HydrophobicContact CB-CZ 4.13Å; N1000-F1003 WeakPolarHBondContact OD1-CE2 3.32Å; F1003-K1005 PolarHBondContact O-N 3.28Å; F1003-K1005 VanDerWaalsContact O-N 3.11Å; F1003-T1006 WeakPolarHBondContact O-CB 3.37Å; F1003-T1006 PolarHBondContact O-N 3.01Å; F1003-V1009 HydrophobicContact CD1-CG2 3.73Å; F1003-V1009 HydrophobicContact CE1-CG1 4.23Å; F1003-V1009 HydrophobicContact CE1-CG2 3.87Å; F1003-L1036 HydrophobicContact CE2-CB 4.14Å; F1003-L1036 HydrophobicContact CE2-CD2 3.98Å; F1003-L1036 HydrophobicContact CZ-CB 4.16Å; F1003-L1036 HydrophobicContact CZ-CD2 4.12Å; F1003-R1037 HydrophobicContact CD2-CB 4.29Å; F1003-V1038 HydrophobicContact CE1-CB 4.49Å; F1003-V1038 HydrophobicContact CE1-CG1 3.94Å; F1003-V1038 HydrophobicContact CZ-CG1 3.98Å; F1003-L1040 HydrophobicContact CB-CB 4.18Å; F1003-A1041 VanDerWaalsContact O-CA 3.26Å; F1003-A1041 WeakPolarHBondContact O-CA 3.35Å
1004	P	95.9	Very high	95.5	Very high	81 Å²	81	36.4 Å²	36.4	53%	0.526	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-62	-17.2	175.9	-23.1	34.3	0	0	0	115.7	D1002 L1040	D1002-P1004 VanDerWaalsContact C-CD 3.43Å; D1002-P1004 VanDerWaalsContact C-N 3.32Å; P1004-L1040 HydrophobicContact CG-CB 4.12Å; P1004-L1040 HydrophobicContact CG-CD1 4.13Å
1005	K	94.1	Very high	95.3	Very high	145 Å²	145	35 Å²	35	63%	0.63	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-100.8	-4.7	177.6	-51	171.8	-161.6	152.1	0	112.4	D1002 F1003	D1002-K1005 WeakPolarHBondContact O-CA 3.47Å; D1002-K1005 WeakPolarHBondContact O-CB 3.41Å; D1002-K1005 PolarHBondContact O-N 3.12Å; D1002-K1005 IonicContact OD1-NZ 3.11Å; D1002-K1005 PolarHBondContact OD1-NZ 3.36Å; F1003-K1005 PolarHBondContact O-N 3.28Å; F1003-K1005 VanDerWaalsContact O-N 3.11Å
1006	T	96.8	Very high	95.2	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	20%	0.197	C	C	.	.			trans	-87.4	129.3	-171.2	-58.5	0	0	0	0	110.3	E932 I934 D1002 F1003 L1008 V1009 A1041 K1042	E932-T1006 WeakPolarHBondContact O-CG2 3.5Å; I934-T1006 HydrophobicContact CB-CG2 4.09Å; I934-T1006 HydrophobicContact CD1-CG2 3.95Å; I934-T1006 WeakPolarHBondContact CD1-OG1 3.32Å; I934-T1006 HydrophobicContact CG1-CG2 3.77Å; D1002-T1006 PolarHBondContact O-N 3.04Å; D1002-T1006 PolarHBondContact O-OG1 2.89Å; F1003-T1006 WeakPolarHBondContact O-CB 3.37Å; F1003-T1006 PolarHBondContact O-N 3.01Å; T1006-L1008 WeakPolarHBondContact CG2-O 3.46Å; T1006-V1009 HydrophobicContact CG2-CG2 3.93Å; T1006-A1041 HydrophobicContact CG2-CB 4.44Å; T1006-K1042 PolarHBondContact O-N 2.93Å; T1006-K1042 VanDerWaalsContact O-N 3.11Å
1007	D	97.2	Very high	95.1	Very high	32 Å²	32	35.3 Å²	35.3	17%	0.171	20%	0.2	C	C	.	.	S	Bend	trans	-68.7	-48	176.2	-80.4	-52.6	0	0	0	111.4	F930 N931 E932 K1042 K1043	F930-D1007 HydrophobicContact CB-CB 3.49Å; F930-D1007 VanDerWaalsContact CB-CB 3.49Å; F930-D1007 HydrophobicContact CD1-CB 3.67Å; F930-D1007 HydrophobicContact CD2-CB 4.36Å; F930-D1007 HydrophobicContact CG-CB 3.6Å; N931-D1007 PolarHBondContact N-OD2 3.08Å; E932-D1007 PolarHBondContact N-OD2 3.03Å; E932-D1007 WeakPolarHBondContact O-CB 3.29Å; E932-D1007 PolarHBondContact O-N 3.01Å; E932-D1007 VanDerWaalsContact O-N 3.14Å; D1007-K1042 WeakPolarHBondContact O-CB 3.46Å; D1007-K1042 WeakPolarHBondContact OD1-CD 3.44Å; D1007-K1042 IonicContact OD1-NZ 2.94Å; D1007-K1042 PolarHBondContact OD1-NZ 2.92Å; D1007-K1043 PolarHBondContact O-N 3.45Å
1008	L	98	Very high	95.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	130	-169.7	-175.1	66.1	0	0	0	112.2	L927 F930 E932 I933 I934 T1006 K1043 I1045	L927-L1008 HydrophobicContact CD2-CD2 3.62Å; L927-L1008 HydrophobicContact CG-CD2 4.12Å; F930-L1008 HydrophobicContact CB-CB 4.27Å; F930-L1008 HydrophobicContact CD2-CB 3.84Å; F930-L1008 HydrophobicContact CD2-CD1 4.21Å; F930-L1008 HydrophobicContact CD2-CD2 4.33Å; F930-L1008 HydrophobicContact CD2-CG 4.35Å; F930-L1008 HydrophobicContact CE2-CD1 4.41Å; F930-L1008 HydrophobicContact CG-CB 4.4Å; E932-L1008 PolarHBondContact O-N 3.32Å; E932-L1008 VanDerWaalsContact O-N 3.15Å; I933-L1008 WeakPolarHBondContact CA-O 3.46Å; I933-L1008 HydrophobicContact CG1-CB 4.43Å; I933-L1008 HydrophobicContact CG2-CD2 4.43Å; I934-L1008 PolarHBondContact N-O 3.17Å; T1006-L1008 WeakPolarHBondContact CG2-O 3.46Å; L1008-K1043 CarbonylContact C-O 3.41Å; L1008-K1043 WeakPolarHBondContact CA-O 3.47Å; L1008-K1043 HydrophobicContact CD1-CB 4.08Å; L1008-K1043 HydrophobicContact CD1-CG 4.18Å; L1008-I1045 HydrophobicContact CD1-CG1 3.76Å
1009	V	98.5	Very high	95.4	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123	169.8	-177.7	0	0	0	0	111.4	I934 T936 F1003 T1006 V1011 V1038 A1041 K1043 V1044 I1045	I934-V1009 HydrophobicContact CB-CG2 4.42Å; I934-V1009 CarbonylContact O-C 3.57Å; I934-V1009 VanDerWaalsContact O-CA 3.24Å; I934-V1009 WeakPolarHBondContact O-CA 3.34Å; T936-V1009 HydrophobicContact CG2-CG1 3.83Å; F1003-V1009 HydrophobicContact CD1-CG2 3.73Å; F1003-V1009 HydrophobicContact CE1-CG1 4.23Å; F1003-V1009 HydrophobicContact CE1-CG2 3.87Å; T1006-V1009 HydrophobicContact CG2-CG2 3.93Å; V1009-V1011 HydrophobicContact CG1-CG2 4.01Å; V1009-V1038 HydrophobicContact CG1-CB 3.89Å; V1009-V1038 HydrophobicContact CG1-CG1 3.78Å; V1009-A1041 HydrophobicContact CB-CB 4.4Å; V1009-A1041 HydrophobicContact CG2-CB 3.35Å; V1009-K1043 PolarHBondContact N-O 3.01Å; V1009-V1044 HydrophobicContact CB-CG1 4.43Å; V1009-V1044 HydrophobicContact CB-CG2 4.44Å; V1009-I1045 PolarHBondContact O-N 3.46Å
1010	L	97.9	Very high	95.3	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	101.4	172.9	-83.4	168.6	0	0	0	110.5	V923 L927 I934 I935 T936 I1012 I1045	V923-L1010 HydrophobicContact CG1-CD2 4.3Å; L927-L1010 HydrophobicContact CD2-CD1 4.04Å; I934-L1010 PolarHBondContact O-N 3.37Å; I935-L1010 CarbonylContact C-O 3.37Å; I935-L1010 WeakPolarHBondContact CA-O 3.24Å; I935-L1010 HydrophobicContact CG1-CB 4.24Å; I935-L1010 HydrophobicContact CG1-CD1 4.36Å; I935-L1010 HydrophobicContact CG2-CB 4.43Å; T936-L1010 PolarHBondContact N-O 3.36Å; L1010-I1012 HydrophobicContact CB-CD1 4.27Å; L1010-I1012 HydrophobicContact CB-CG1 4.3Å; L1010-I1045 HydrophobicContact CD2-CB 4.05Å; L1010-I1045 HydrophobicContact CD2-CG2 4.11Å
1011	V	98	Very high	95.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.2	176.5	-175.9	0	0	0	0	109.2	T936 V1009 A1014 V1018 V1038 V1044 I1045 V1046 V1047	T936-V1011 WeakPolarHBondContact OG1-CA 3.2Å; V1009-V1011 HydrophobicContact CG1-CG2 4.01Å; V1011-A1014 HydrophobicContact CG1-CB 3.98Å; V1011-V1018 HydrophobicContact CG1-CG1 4.28Å; V1011-V1018 HydrophobicContact CG1-CG2 3.92Å; V1011-V1038 HydrophobicContact CG2-CB 4.35Å; V1011-V1038 HydrophobicContact CG2-CG1 4.28Å; V1011-V1038 HydrophobicContact CG2-CG2 4.21Å; V1011-V1044 HydrophobicContact CG2-CG1 3.72Å; V1011-I1045 PolarHBondContact N-O 3.28Å; V1011-V1046 HydrophobicContact CB-CB 4.43Å; V1011-V1046 HydrophobicContact CB-CG1 4.4Å; V1011-V1046 HydrophobicContact CB-CG2 4.08Å; V1011-V1046 HydrophobicContact CG1-CG1 4.32Å; V1011-V1046 HydrophobicContact CG2-CG2 4.24Å; V1011-V1047 PolarHBondContact O-N 2.85Å
1012	I	96.3	Very high	94.8	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	104.6	-171.3	-50.6	176.8	0	0	0	111.4	I935 T936 P937 G938 L941 L950 L1010 A1014 V1047 A1075	I935-I1012 HydrophobicContact CG2-CD1 4.07Å; T936-I1012 PolarHBondContact O-N 3.46Å; T936-I1012 VanDerWaalsContact O-N 3.11Å; P937-I1012 CarbonylContact C-O 3.31Å; P937-I1012 WeakPolarHBondContact CA-O 3.4Å; G938-I1012 PolarHBondContact N-O 2.84Å; L941-I1012 HydrophobicContact CB-CG2 4.47Å; L941-I1012 HydrophobicContact CD1-CB 4.24Å; L941-I1012 HydrophobicContact CD1-CG2 3.48Å; L941-I1012 VanDerWaalsContact CD1-CG2 3.48Å; L950-I1012 HydrophobicContact CD1-CD1 3.63Å; L950-I1012 HydrophobicContact CD2-CD1 3.87Å; L950-I1012 HydrophobicContact CG-CD1 4.41Å; L1010-I1012 HydrophobicContact CB-CD1 4.27Å; L1010-I1012 HydrophobicContact CB-CG1 4.3Å; I1012-A1014 PolarHBondContact O-N 2.98Å; I1012-V1047 HydrophobicContact CB-CB 4.43Å; I1012-V1047 HydrophobicContact CG1-CB 4.23Å; I1012-V1047 HydrophobicContact CG1-CG2 4.26Å; I1012-V1047 HydrophobicContact CG2-CB 4.18Å; I1012-V1047 HydrophobicContact CG2-CG1 4.08Å; I1012-A1075 HydrophobicContact CG2-CB 4.13Å
1013	G	91.6	Very high	94.5	Very high	23 Å²	23	18.6 Å²	18.6	24%	0.237	10%	0.104	C	C	.	.	S	Bend	trans	69	15.7	177.6	0	0	0	0	0	115.3	G938 G940 V1047	G938-G1013 CarbonylContact C-O 3.6Å; G938-G1013 WeakPolarHBondContact CA-O 3.5Å; G940-G1013 PolarHBondContact N-O 2.69Å; G940-G1013 VanDerWaalsContact N-O 3.15Å; G1013-V1047 PolarHBondContact N-O 3.17Å; G1013-V1047 VanDerWaalsContact N-O 3.15Å
1014	A	93.3	Very high	94	Very high	9 Å²	9	22.9 Å²	22.9	7%	0.074	12%	0.124	C	C	.	.			trans	-97.8	159.4	169.6	0	0	0	0	0	111.2	V1011 I1012 V1018	V1011-A1014 HydrophobicContact CG1-CB 3.98Å; I1012-A1014 PolarHBondContact O-N 2.98Å; A1014-V1018 HydrophobicContact CB-CG1 4.45Å; A1014-V1018 HydrophobicContact CB-CG2 4.49Å
1015	N	91.9	Very high	93.5	Very high	18 Å²	18	19.5 Å²	19.5	10%	0.096	10%	0.101	C	C	.	.			trans	-149.7	-70.8	169.9	-169.4	7.9	0	0	0	111.5	T1017 V1018 N1019 G1054 N1060 F1063	N1015-T1017 VanDerWaalsContact C-N 3.28Å; N1015-T1017 PolarHBondContact O-N 3.43Å; N1015-V1018 WeakPolarHBondContact O-CG2 3.4Å; N1015-V1018 PolarHBondContact O-N 3.29Å; N1015-V1018 VanDerWaalsContact O-N 3.11Å; N1015-N1019 PolarHBondContact O-N 3.05Å; N1015-G1054 WeakPolarHBondContact ND2-CA 3.39Å; N1015-G1054 PolarHBondContact ND2-N 3.01Å; N1015-N1060 PolarHBondContact O-ND2 2.85Å; N1015-N1060 VanDerWaalsContact OD1-CB 3.3Å; N1015-N1060 WeakPolarHBondContact OD1-CB 3.37Å; N1015-N1060 PolarHBondContact OD1-ND2 3.48Å; N1015-F1063 VanDerWaalsContact OD1-CZ 3.26Å; N1015-F1063 WeakPolarHBondContact OD1-CZ 3.45Å
1016	D	90.6	Very high	92.9	Very high	20 Å²	20	14.7 Å²	14.7	11%	0.107	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-63.9	-34.9	-172.6	-51.3	-36.6	0	0	0	112	V1018 N1019 G1054 Y1055 A1056	D1016-V1018 PolarHBondContact O-N 3.49Å; D1016-N1019 WeakPolarHBondContact O-CB 3.35Å; D1016-N1019 PolarHBondContact O-N 3.28Å; D1016-G1054 WeakPolarHBondContact OD1-CA 3.47Å; D1016-Y1055 WeakPolarHBondContact OD2-CA 3.3Å; D1016-Y1055 WeakPolarHBondContact OD2-CB 3.47Å; D1016-Y1055 PolarHBondContact OD2-N 3.43Å; D1016-A1056 PolarHBondContact OD2-N 3.47Å; D1016-A1056 VanDerWaalsContact OD2-N 3.14Å
1017	T	93.2	Very high	92.3	Very high	16 Å²	16	16.4 Å²	16.4	10%	0.098	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-71	-3.5	178.4	58.2	0	0	0	0	115.3	H969 N1015 M1033 L1036	H969-T1017 HydrophobicContact CB-CG2 3.89Å; H969-T1017 WeakPolarHBondContact ND1-CG2 3.38Å; N1015-T1017 VanDerWaalsContact C-N 3.28Å; N1015-T1017 PolarHBondContact O-N 3.43Å; T1017-M1033 HydrophobicContact CG2-CE 4.31Å; T1017-L1036 PolarHBondContact O-N 3.09Å
1018	V	95.7	Very high	91.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-127.7	7.9	176.3	-64.7	0	0	0	0	111.9	V1011 A1014 N1015 D1016 S1020 L1036 V1038 I1062	V1011-V1018 HydrophobicContact CG1-CG1 4.28Å; V1011-V1018 HydrophobicContact CG1-CG2 3.92Å; A1014-V1018 HydrophobicContact CB-CG1 4.45Å; A1014-V1018 HydrophobicContact CB-CG2 4.49Å; N1015-V1018 WeakPolarHBondContact O-CG2 3.4Å; N1015-V1018 PolarHBondContact O-N 3.29Å; N1015-V1018 VanDerWaalsContact O-N 3.11Å; D1016-V1018 PolarHBondContact O-N 3.49Å; V1018-S1020 PolarHBondContact O-N 3.22Å; V1018-L1036 HydrophobicContact CG1-CB 4.12Å; V1018-V1038 HydrophobicContact CB-CG1 4.31Å; V1018-V1038 HydrophobicContact CB-CG2 3.9Å; V1018-V1038 HydrophobicContact CG1-CG1 3.75Å; V1018-V1038 HydrophobicContact CG1-CG2 4.25Å; V1018-I1062 HydrophobicContact CB-CD1 4.12Å; V1018-I1062 HydrophobicContact CG2-CD1 3.66Å
1019	N	94.4	Very high	90.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.			trans	-82.4	112.8	-169.3	-172.8	-19.7	0	0	0	111.6	N1015 D1016 A1021 A1022 I1030 D1059 N1060 P1061	N1015-N1019 PolarHBondContact O-N 3.05Å; D1016-N1019 WeakPolarHBondContact O-CB 3.35Å; D1016-N1019 PolarHBondContact O-N 3.28Å; N1019-A1021 PolarHBondContact O-N 3.42Å; N1019-A1021 VanDerWaalsContact O-N 3.15Å; N1019-A1021 VanDerWaalsContact OD1-CB 3.23Å; N1019-A1021 WeakPolarHBondContact OD1-CB 3.37Å; N1019-A1021 PolarHBondContact OD1-N 3.47Å; N1019-A1022 WeakPolarHBondContact O-CB 3.19Å; N1019-A1022 PolarHBondContact O-N 3.12Å; N1019-A1022 VanDerWaalsContact O-N 3.11Å; N1019-I1030 HydrophobicContact CB-CD1 3.72Å; N1019-D1059 PolarHBondContact ND2-O 3.2Å; N1019-N1060 WeakPolarHBondContact CA-ND2 3.3Å; N1019-N1060 WeakPolarHBondContact CA-OD1 3.15Å; N1019-N1060 HydrophobicContact CB-CB 4.47Å; N1019-N1060 VanDerWaalsContact CG-CG 3.45Å; N1019-N1060 PolarHBondContact OD1-OD1 3.2Å; N1019-P1061 WeakPolarHBondContact OD1-CD 3.33Å
1020	S	94.1	Very high	90.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.1	-176.6	67.9	0	0	0	0	113.7	V1018 A1022 E1023 E1024 K1065	V1018-S1020 PolarHBondContact O-N 3.22Å; S1020-A1022 PolarHBondContact O-N 3.35Å; S1020-E1023 PolarHBondContact O-N 3.16Å; S1020-E1024 WeakPolarHBondContact CB-OE2 3.42Å; S1020-E1024 WeakPolarHBondContact O-CB 3.19Å; S1020-E1024 WeakPolarHBondContact O-CG 3.29Å; S1020-E1024 PolarHBondContact O-N 3.16Å; S1020-E1024 PolarHBondContact OG-OE2 3.03Å; S1020-K1065 WeakPolarHBondContact OG-CE 3.26Å; S1020-K1065 PolarHBondContact OG-NZ 3.38Å
1021	A	90.5	Very high	89.6	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.033	10%	0.097	C	C	.	.	H	α-helix	trans	-59.5	-18.2	172.8	0	0	0	0	0	113.3	N1019 E1023 D1025 S1028 P1061	N1019-A1021 PolarHBondContact O-N 3.42Å; N1019-A1021 VanDerWaalsContact O-N 3.15Å; N1019-A1021 VanDerWaalsContact OD1-CB 3.23Å; N1019-A1021 WeakPolarHBondContact OD1-CB 3.37Å; N1019-A1021 PolarHBondContact OD1-N 3.47Å; A1021-E1023 VanDerWaalsContact C-N 3.32Å; A1021-D1025 PolarHBondContact O-N 3.31Å; A1021-S1028 VanDerWaalsContact O-CB 3.28Å; A1021-S1028 WeakPolarHBondContact O-CB 3.2Å; A1021-P1061 HydrophobicContact CB-CG 4.03Å
1022	A	89.6	Confident	89	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.3	-31	172.4	0	0	0	0	0	113.2	N1019 S1020 I1030 G1032 M1033 V1035	N1019-A1022 WeakPolarHBondContact O-CB 3.19Å; N1019-A1022 PolarHBondContact O-N 3.12Å; N1019-A1022 VanDerWaalsContact O-N 3.11Å; S1020-A1022 PolarHBondContact O-N 3.35Å; A1022-I1030 HydrophobicContact CB-CD1 4.22Å; A1022-I1030 HydrophobicContact CB-CG1 4.23Å; A1022-I1030 WeakPolarHBondContact CB-O 3.36Å; A1022-G1032 PolarHBondContact O-N 3.15Å; A1022-M1033 HydrophobicContact CB-CB 4.14Å; A1022-M1033 WeakPolarHBondContact CB-O 3.39Å; A1022-V1035 HydrophobicContact CB-CG1 3.93Å; A1022-V1035 HydrophobicContact CB-CG2 4.3Å
1023	E	89.8	Confident	88.7	Confident	38 Å²	38	18.8 Å²	18.8	18%	0.178	11%	0.112	C	C	.	.	H	α-helix	trans	-104.1	-28.7	176.2	-59.1	-163.6	149.6	0	0	113	S1020 A1021 V1035 R1037	S1020-E1023 PolarHBondContact O-N 3.16Å; A1021-E1023 VanDerWaalsContact C-N 3.32Å; E1023-V1035 HydrophobicContact CG-CG2 4.45Å; E1023-R1037 IonicContact OE1-CZ 3.81Å; E1023-R1037 VanDerWaalsContact OE1-CZ 3.24Å; E1023-R1037 IonicContact OE1-NE 3.24Å; E1023-R1037 PolarHBondContact OE1-NE 3.13Å; E1023-R1037 IonicContact OE1-NH2 3.95Å; E1023-R1037 PolarHBondContact OE1-NH2 3.06Å; E1023-R1037 IonicContact OE2-CZ 3.69Å; E1023-R1037 IonicContact OE2-NE 3.32Å; E1023-R1037 PolarHBondContact OE2-NE 2.9Å; E1023-R1037 IonicContact OE2-NH2 3.65Å
1024	E	87.1	Confident	88.7	Confident	89 Å²	89	20 Å²	20	42%	0.416	12%	0.115	S	C	.	.	H	α-helix	trans	-89.2	-25.7	-173.1	-65.2	178.4	152.1	0	0	114.2	S1020 K1065	S1020-E1024 WeakPolarHBondContact CB-OE2 3.42Å; S1020-E1024 WeakPolarHBondContact O-CB 3.19Å; S1020-E1024 WeakPolarHBondContact O-CG 3.29Å; S1020-E1024 PolarHBondContact O-N 3.16Å; S1020-E1024 PolarHBondContact OG-OE2 3.03Å; E1024-K1065 IonicContact OE1-NZ 2.78Å; E1024-K1065 PolarHBondContact OE1-NZ 3.48Å; E1024-K1065 IonicContact OE2-NZ 2.73Å; E1024-K1065 PolarHBondContact OE2-NZ 2.97Å
1025	D	84.6	Confident	88.8	Confident	11 Å²	11	19.6 Å²	19.6	6%	0.059	11%	0.112	C	C	.	.			trans	-130.2	110.6	-177.4	179.7	19.2	0	0	0	113.4	S908 M909 A1021 N1027 S1028	S908-D1025 WeakPolarHBondContact CA-OD2 3.49Å; S908-D1025 WeakPolarHBondContact CB-OD2 3.48Å; M909-D1025 HydrophobicContact CB-CB 4.37Å; M909-D1025 HydrophobicContact CG-CB 4.09Å; M909-D1025 PolarHBondContact N-OD2 3.45Å; M909-D1025 HydrophobicContact SD-CB 3.96Å; A1021-D1025 PolarHBondContact O-N 3.31Å; D1025-N1027 PolarHBondContact O-N 3.21Å; D1025-N1027 WeakPolarHBondContact OD1-CA 3.21Å; D1025-N1027 WeakPolarHBondContact OD1-CB 3.3Å; D1025-N1027 PolarHBondContact OD1-N 3.13Å; D1025-N1027 PolarHBondContact OD1-ND2 3.46Å; D1025-S1028 VanDerWaalsContact O-CB 3.23Å; D1025-S1028 WeakPolarHBondContact O-CB 3.44Å; D1025-S1028 PolarHBondContact O-N 2.95Å; D1025-S1028 PolarHBondContact OD2-N 2.92Å
1026	P	81.9	Confident	89	Confident	43 Å²	43	18.8 Å²	18.8	28%	0.279	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.7	175.8	29.4	-35.1	0	0	0	113.7	L445 S904 A1031	L445-P1026 HydrophobicContact CD1-CB 4.39Å; S904-P1026 PolarHBondContact N-O 3.43Å; S904-P1026 VanDerWaalsContact N-O 3.07Å; S904-P1026 PolarHBondContact OG-O 3.3Å; S904-P1026 VanDerWaalsContact OG-O 3.09Å; P1026-A1031 WeakPolarHBondContact O-CB 3.39Å
1027	N	83.2	Confident	89.3	Confident	38 Å²	38	21.5 Å²	21.5	20%	0.203	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	10.6	174	-48.2	-81.5	0	0	0	112.5	Y903 S904 G906 K907 S908 D1025	Y903-N1027 WeakPolarHBondContact CE2-O 3.29Å; S904-N1027 PolarHBondContact OG-OD1 3.33Å; G906-N1027 VanDerWaalsContact CA-OD1 3.25Å; G906-N1027 WeakPolarHBondContact CA-OD1 3.43Å; G906-N1027 PolarHBondContact N-OD1 2.97Å; K907-N1027 WeakPolarHBondContact O-CB 3.35Å; S908-N1027 WeakPolarHBondContact CB-O 3.44Å; S908-N1027 PolarHBondContact OG-O 3.31Å; D1025-N1027 PolarHBondContact O-N 3.21Å; D1025-N1027 WeakPolarHBondContact OD1-CA 3.21Å; D1025-N1027 WeakPolarHBondContact OD1-CB 3.3Å; D1025-N1027 PolarHBondContact OD1-N 3.13Å; D1025-N1027 PolarHBondContact OD1-ND2 3.46Å
1028	S	83.9	Confident	89.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-71.9	142.4	167.7	-177.6	0	0	0	0	110.5	Y903 A1021 D1025 I1030 A1031	Y903-S1028 WeakPolarHBondContact CD2-O 3.34Å; A1021-S1028 VanDerWaalsContact O-CB 3.28Å; A1021-S1028 WeakPolarHBondContact O-CB 3.2Å; D1025-S1028 VanDerWaalsContact O-CB 3.23Å; D1025-S1028 WeakPolarHBondContact O-CB 3.44Å; D1025-S1028 PolarHBondContact O-N 2.95Å; D1025-S1028 PolarHBondContact OD2-N 2.92Å; S1028-I1030 PolarHBondContact O-N 3.46Å; S1028-I1030 VanDerWaalsContact O-N 3.14Å; S1028-I1030 WeakPolarHBondContact OG-CG1 3.32Å; S1028-I1030 PolarHBondContact OG-N 3.15Å; S1028-A1031 VanDerWaalsContact O-CB 3.22Å; S1028-A1031 WeakPolarHBondContact O-CB 3.44Å; S1028-A1031 PolarHBondContact O-N 2.91Å
1029	I	81.3	Confident	89.5	Confident	36 Å²	36	22.1 Å²	22.1	19%	0.185	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.8	173.5	-62.2	176.9	0	0	0	111	Y898 T900 V1058	Y898-I1029 HydrophobicContact CE1-CD1 4.23Å; Y898-I1029 HydrophobicContact CE1-CG1 4.31Å; Y898-I1029 VanDerWaalsContact OH-CD1 3.28Å; Y898-I1029 WeakPolarHBondContact OH-CD1 3.42Å; T900-I1029 WeakPolarHBondContact CG2-O 3.39Å; T900-I1029 PolarHBondContact N-O 2.9Å; T900-I1029 VanDerWaalsContact N-O 3.13Å; I1029-V1058 HydrophobicContact CB-CG2 3.83Å; I1029-V1058 HydrophobicContact CD1-CG2 4.09Å; I1029-V1058 HydrophobicContact CG1-CG2 4.18Å
1030	I	84.9	Confident	89.6	Confident	12 Å²	12	25.9 Å²	25.9	6%	0.062	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	18.4	176.6	60.2	170.6	0	0	0	113.3	N1019 A1022 S1028 G1032 M1033 A1056	N1019-I1030 HydrophobicContact CB-CD1 3.72Å; A1022-I1030 HydrophobicContact CB-CD1 4.22Å; A1022-I1030 HydrophobicContact CB-CG1 4.23Å; A1022-I1030 WeakPolarHBondContact CB-O 3.36Å; S1028-I1030 PolarHBondContact O-N 3.46Å; S1028-I1030 VanDerWaalsContact O-N 3.14Å; S1028-I1030 WeakPolarHBondContact OG-CG1 3.32Å; S1028-I1030 PolarHBondContact OG-N 3.15Å; I1030-G1032 PolarHBondContact O-N 3.06Å; I1030-M1033 HydrophobicContact CB-CB 4.23Å; I1030-M1033 HydrophobicContact CB-SD 4.23Å; I1030-M1033 HydrophobicContact CG2-SD 4.27Å; I1030-M1033 WeakPolarHBondContact O-CB 3.31Å; I1030-M1033 PolarHBondContact O-N 3.32Å; I1030-A1056 HydrophobicContact CG2-CB 3.65Å
1031	A	84.8	Confident	89.8	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	132.4	179.4	0	0	0	0	0	111.8	L445 N887 T900 P1026 S1028 M1033	L445-A1031 HydrophobicContact CD1-CB 4.39Å; N887-A1031 PolarHBondContact ND2-O 3.21Å; T900-A1031 VanDerWaalsContact CB-O 3.25Å; T900-A1031 WeakPolarHBondContact CB-O 3.39Å; T900-A1031 WeakPolarHBondContact CG2-O 3.37Å; T900-A1031 PolarHBondContact OG1-N 2.82Å; T900-A1031 PolarHBondContact OG1-O 3.37Å; P1026-A1031 WeakPolarHBondContact O-CB 3.39Å; S1028-A1031 VanDerWaalsContact O-CB 3.22Å; S1028-A1031 WeakPolarHBondContact O-CB 3.44Å; S1028-A1031 PolarHBondContact O-N 2.91Å; A1031-M1033 PolarHBondContact O-N 2.91Å
1032	G	85.6	Confident	90	Very high	24 Å²	24	32 Å²	32	25%	0.247	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	3.8	-177.9	0	0	0	0	0	115.5	N887 A1022 I1030 P1034	N887-G1032 WeakPolarHBondContact CB-O 3.45Å; N887-G1032 WeakPolarHBondContact ND2-CA 3.45Å; N887-G1032 PolarHBondContact ND2-O 3.4Å; A1022-G1032 PolarHBondContact O-N 3.15Å; I1030-G1032 PolarHBondContact O-N 3.06Å; G1032-P1034 WeakPolarHBondContact O-CD 3.23Å
1033	M	89.9	Confident	90.4	Very high	14 Å²	14	33.4 Å²	33.4	7%	0.069	17%	0.169	C	C	.	.			trans	-64	126.2	168.4	177.3	173.4	166.5	0	0	109.4	N887 H969 V971 T1017 A1022 I1030 A1031 V1035	N887-M1033 HydrophobicContact CB-CB 4.46Å; H969-M1033 VanDerWaalsContact CE1-CE 3.47Å; H969-M1033 WeakPolarHBondContact CE1-CE 3.39Å; V971-M1033 HydrophobicContact CG2-CE 4.36Å; T1017-M1033 HydrophobicContact CG2-CE 4.31Å; A1022-M1033 HydrophobicContact CB-CB 4.14Å; A1022-M1033 WeakPolarHBondContact CB-O 3.39Å; I1030-M1033 HydrophobicContact CB-CB 4.23Å; I1030-M1033 HydrophobicContact CB-SD 4.23Å; I1030-M1033 HydrophobicContact CG2-SD 4.27Å; I1030-M1033 WeakPolarHBondContact O-CB 3.31Å; I1030-M1033 PolarHBondContact O-N 3.32Å; A1031-M1033 PolarHBondContact O-N 2.91Å; M1033-V1035 HydrophobicContact CG-CG1 4.3Å
1034	P	92.2	Very high	90.8	Very high	47 Å²	47	31.6 Å²	31.6	31%	0.305	16%	0.161	S	C	.	.			trans	-57.4	139.2	166.7	-22.5	34.6	0	0	0	109.8	H969 M996 G1032	H969-P1034 PolarHBondContact NE2-O 2.83Å; M996-P1034 HydrophobicContact CE-CB 3.56Å; M996-P1034 HydrophobicContact SD-CB 3.96Å; G1032-P1034 WeakPolarHBondContact O-CD 3.23Å
1035	V	94.9	Very high	91.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	14%	0.141	C	C	.	.			trans	-142.4	162.3	-179.5	-71.6	0	0	0	0	110.8	N1000 A1022 E1023 M1033 R1037 W1039	N1000-V1035 PolarHBondContact ND2-O 3.21Å; A1022-V1035 HydrophobicContact CB-CG1 3.93Å; A1022-V1035 HydrophobicContact CB-CG2 4.3Å; E1023-V1035 HydrophobicContact CG-CG2 4.45Å; M1033-V1035 HydrophobicContact CG-CG1 4.3Å; V1035-R1037 PolarHBondContact O-N 3.34Å; V1035-W1039 HydrophobicContact CG2-CH2 3.65Å; V1035-W1039 HydrophobicContact CG2-CZ3 3.97Å
1036	L	97.4	Very high	91.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	14%	0.138	C	C	.	.			trans	-74.5	117.6	169.1	-70.6	169	0	0	0	109.2	T936 A967 H969 M996 I999 N1000 F1003 T1017 V1018 V1038	T936-L1036 HydrophobicContact CG2-CD1 4.07Å; A967-L1036 HydrophobicContact CB-CD1 4.11Å; A967-L1036 HydrophobicContact CB-CD2 3.74Å; A967-L1036 WeakPolarHBondContact O-CD1 3.5Å; H969-L1036 HydrophobicContact CB-CD1 4.15Å; M996-L1036 HydrophobicContact CB-CD2 3.89Å; M996-L1036 HydrophobicContact CG-CD2 3.86Å; M996-L1036 HydrophobicContact CG-CG 4.37Å; I999-L1036 HydrophobicContact CG2-CD2 4.37Å; N1000-L1036 WeakPolarHBondContact OD1-CA 3.38Å; F1003-L1036 HydrophobicContact CE2-CB 4.14Å; F1003-L1036 HydrophobicContact CE2-CD2 3.98Å; F1003-L1036 HydrophobicContact CZ-CB 4.16Å; F1003-L1036 HydrophobicContact CZ-CD2 4.12Å; T1017-L1036 PolarHBondContact O-N 3.09Å; V1018-L1036 HydrophobicContact CG1-CB 4.12Å; L1036-V1038 HydrophobicContact CB-CG1 4.15Å; L1036-V1038 PolarHBondContact O-N 2.9Å
1037	R	96.8	Very high	92.6	Very high	78 Å²	78	24.9 Å²	24.9	29%	0.294	13%	0.125	S	C	.	.			trans	-79.1	49.6	-173.3	-63.2	-170.6	177.5	132.3	3.7	113.5	N1000 F1003 E1023 V1035 W1039 L1040	N1000-R1037 PolarHBondContact OD1-N 2.95Å; F1003-R1037 HydrophobicContact CD2-CB 4.29Å; E1023-R1037 IonicContact OE1-CZ 3.81Å; E1023-R1037 VanDerWaalsContact OE1-CZ 3.24Å; E1023-R1037 IonicContact OE1-NE 3.24Å; E1023-R1037 PolarHBondContact OE1-NE 3.13Å; E1023-R1037 IonicContact OE1-NH2 3.95Å; E1023-R1037 PolarHBondContact OE1-NH2 3.06Å; E1023-R1037 IonicContact OE2-CZ 3.69Å; E1023-R1037 IonicContact OE2-NE 3.32Å; E1023-R1037 PolarHBondContact OE2-NE 2.9Å; E1023-R1037 IonicContact OE2-NH2 3.65Å; V1035-R1037 PolarHBondContact O-N 3.34Å; R1037-W1039 HydrophobicContact CB-CH2 4.25Å; R1037-W1039 HydrophobicContact CB-CZ2 4.17Å; R1037-W1039 HydrophobicContact CG-CH2 3.95Å; R1037-W1039 HydrophobicContact CG-CZ2 3.95Å; R1037-W1039 PolarHBondContact O-N 3.48Å; R1037-W1039 VanDerWaalsContact O-N 3.09Å; R1037-L1040 HydrophobicContact CB-CD1 3.78Å; R1037-L1040 HydrophobicContact CB-CG 4.14Å; R1037-L1040 HydrophobicContact CG-CD1 4.5Å; R1037-L1040 WeakPolarHBondContact O-CB 3.48Å; R1037-L1040 PolarHBondContact O-N 3Å
1038	V	97.8	Very high	93.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-55.1	-32.1	-173.5	-59.1	0	0	0	0	113.6	T936 F1003 V1009 V1011 V1018 L1036 L1040 A1041 V1044 I1062	T936-V1038 HydrophobicContact CG2-CG1 3.62Å; F1003-V1038 HydrophobicContact CE1-CB 4.49Å; F1003-V1038 HydrophobicContact CE1-CG1 3.94Å; F1003-V1038 HydrophobicContact CZ-CG1 3.98Å; V1009-V1038 HydrophobicContact CG1-CB 3.89Å; V1009-V1038 HydrophobicContact CG1-CG1 3.78Å; V1011-V1038 HydrophobicContact CG2-CB 4.35Å; V1011-V1038 HydrophobicContact CG2-CG1 4.28Å; V1011-V1038 HydrophobicContact CG2-CG2 4.21Å; V1018-V1038 HydrophobicContact CB-CG1 4.31Å; V1018-V1038 HydrophobicContact CB-CG2 3.9Å; V1018-V1038 HydrophobicContact CG1-CG1 3.75Å; V1018-V1038 HydrophobicContact CG1-CG2 4.25Å; L1036-V1038 HydrophobicContact CB-CG1 4.15Å; L1036-V1038 PolarHBondContact O-N 2.9Å; V1038-L1040 PolarHBondContact O-N 3.3Å; V1038-L1040 VanDerWaalsContact O-N 3.16Å; V1038-A1041 WeakPolarHBondContact O-CB 3.39Å; V1038-A1041 PolarHBondContact O-N 2.85Å; V1038-A1041 VanDerWaalsContact O-N 3.1Å; V1038-V1044 HydrophobicContact CB-CG1 4.5Å; V1038-V1044 HydrophobicContact CG2-CG1 4.32Å; V1038-V1044 WeakPolarHBondContact O-CG2 3.45Å; V1038-I1062 HydrophobicContact CG2-CD1 4.05Å
1039	W	95.6	Very high	93.2	Very high	28 Å²	28	33 Å²	33	11%	0.106	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-68.7	-8.1	-179	64.9	85.1	0	0	0	114.3	V1035 R1037 A1041 I1062 K1065 N1067	V1035-W1039 HydrophobicContact CG2-CH2 3.65Å; V1035-W1039 HydrophobicContact CG2-CZ3 3.97Å; R1037-W1039 HydrophobicContact CB-CH2 4.25Å; R1037-W1039 HydrophobicContact CB-CZ2 4.17Å; R1037-W1039 HydrophobicContact CG-CH2 3.95Å; R1037-W1039 HydrophobicContact CG-CZ2 3.95Å; R1037-W1039 PolarHBondContact O-N 3.48Å; R1037-W1039 VanDerWaalsContact O-N 3.09Å; W1039-A1041 VanDerWaalsContact C-N 3.33Å; W1039-I1062 HydrophobicContact CB-CG2 4.25Å; W1039-I1062 HydrophobicContact CD2-CG2 4.49Å; W1039-I1062 HydrophobicContact CE3-CG2 3.95Å; W1039-K1065 HydrophobicContact CB-CD 3.82Å; W1039-K1065 HydrophobicContact CG-CD 4.35Å; W1039-N1067 PolarHBondContact O-ND2 2.85Å
1040	L	96.1	Very high	93.4	Very high	79 Å²	79	35.9 Å²	35.9	41%	0.414	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-81.7	-12	172.1	-60.1	-180	0	0	0	113	F1003 P1004 R1037 V1038	F1003-L1040 HydrophobicContact CB-CB 4.18Å; P1004-L1040 HydrophobicContact CG-CB 4.12Å; P1004-L1040 HydrophobicContact CG-CD1 4.13Å; R1037-L1040 HydrophobicContact CB-CD1 3.78Å; R1037-L1040 HydrophobicContact CB-CG 4.14Å; R1037-L1040 HydrophobicContact CG-CD1 4.5Å; R1037-L1040 WeakPolarHBondContact O-CB 3.48Å; R1037-L1040 PolarHBondContact O-N 3Å; V1038-L1040 PolarHBondContact O-N 3.3Å; V1038-L1040 VanDerWaalsContact O-N 3.16Å
1041	A	97.1	Very high	93.4	Very high	3 Å²	3	38.1 Å²	38.1	3%	0.025	19%	0.185	C	C	.	.	S	Bend	trans	-77.1	157.6	176.5	0	0	0	0	0	112.7	F1003 T1006 V1009 V1038 W1039 K1043 N1067	F1003-A1041 VanDerWaalsContact O-CA 3.26Å; F1003-A1041 WeakPolarHBondContact O-CA 3.35Å; T1006-A1041 HydrophobicContact CG2-CB 4.44Å; V1009-A1041 HydrophobicContact CB-CB 4.4Å; V1009-A1041 HydrophobicContact CG2-CB 3.35Å; V1038-A1041 WeakPolarHBondContact O-CB 3.39Å; V1038-A1041 PolarHBondContact O-N 2.85Å; V1038-A1041 VanDerWaalsContact O-N 3.1Å; W1039-A1041 VanDerWaalsContact C-N 3.33Å; A1041-K1043 VanDerWaalsContact C-N 3.34Å; A1041-K1043 PolarHBondContact O-N 2.68Å; A1041-N1067 PolarHBondContact O-ND2 2.9Å
1042	K	96.2	Very high	93	Very high	129 Å²	129	39.9 Å²	39.9	56%	0.561	20%	0.203	S	C	*	.	S	Bend	trans	-62.9	-35.7	-177.1	172	-178.6	168.4	-169.9	0	113.1	F930 T1006 D1007	F930-K1042 HydrophobicContact CE1-CD 4.5Å; T1006-K1042 PolarHBondContact O-N 2.93Å; T1006-K1042 VanDerWaalsContact O-N 3.11Å; D1007-K1042 WeakPolarHBondContact O-CB 3.46Å; D1007-K1042 WeakPolarHBondContact OD1-CD 3.44Å; D1007-K1042 IonicContact OD1-NZ 2.94Å; D1007-K1042 PolarHBondContact OD1-NZ 2.92Å
1043	K	97.5	Very high	92.6	Very high	31 Å²	31	42.3 Å²	42.3	14%	0.135	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.8	172	-162.8	71	177.6	179.5	0	110.9	Y926 F930 D1007 L1008 V1009 A1041 I1045 E1069	Y926-K1043 HydrophobicContact CE2-CG 4.32Å; F930-K1043 HydrophobicContact CE2-CB 4.16Å; D1007-K1043 PolarHBondContact O-N 3.45Å; L1008-K1043 CarbonylContact C-O 3.41Å; L1008-K1043 WeakPolarHBondContact CA-O 3.47Å; L1008-K1043 HydrophobicContact CD1-CB 4.08Å; L1008-K1043 HydrophobicContact CD1-CG 4.18Å; V1009-K1043 PolarHBondContact N-O 3.01Å; A1041-K1043 VanDerWaalsContact C-N 3.34Å; A1041-K1043 PolarHBondContact O-N 2.68Å; K1043-I1045 HydrophobicContact CG-CD1 4.3Å; K1043-E1069 VanDerWaalsContact CE-CD 3.47Å; K1043-E1069 WeakPolarHBondContact CE-OE1 3.27Å; K1043-E1069 VanDerWaalsContact NZ-CD 3.34Å; K1043-E1069 IonicContact NZ-OE1 3.97Å; K1043-E1069 PolarHBondContact NZ-OE1 2.86Å
1044	V	98.2	Very high	91.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.2	176.6	-173.1	0	0	0	0	109.5	V1009 V1011 V1038 V1046 N1067 T1068 E1069	V1009-V1044 HydrophobicContact CB-CG1 4.43Å; V1009-V1044 HydrophobicContact CB-CG2 4.44Å; V1011-V1044 HydrophobicContact CG2-CG1 3.72Å; V1038-V1044 HydrophobicContact CB-CG1 4.5Å; V1038-V1044 HydrophobicContact CG2-CG1 4.32Å; V1038-V1044 WeakPolarHBondContact O-CG2 3.45Å; V1044-V1046 HydrophobicContact CG1-CG2 4.25Å; V1044-N1067 PolarHBondContact N-O 2.9Å; V1044-T1068 HydrophobicContact CB-CG2 4.18Å; V1044-T1068 HydrophobicContact CG1-CG2 4.2Å; V1044-T1068 CarbonylContact O-C 3.52Å; V1044-T1068 VanDerWaalsContact O-CA 3.31Å; V1044-T1068 WeakPolarHBondContact O-CA 3.36Å; V1044-E1069 PolarHBondContact O-N 3.32Å
1045	I	98	Very high	90.8	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.5	176.4	-54.8	-59.3	0	0	0	108.4	T918 V923 Y926 L1008 V1009 L1010 V1011 K1043 E1069 L1071	T918-I1045 HydrophobicContact CG2-CD1 4.47Å; V923-I1045 HydrophobicContact CG1-CG1 4.39Å; V923-I1045 HydrophobicContact CG1-CG2 4.2Å; V923-I1045 HydrophobicContact CG2-CD1 4Å; V923-I1045 HydrophobicContact CG2-CG1 4.15Å; V923-I1045 HydrophobicContact CG2-CG2 3.81Å; Y926-I1045 HydrophobicContact CD2-CD1 4.08Å; Y926-I1045 HydrophobicContact CE2-CD1 4.16Å; L1008-I1045 HydrophobicContact CD1-CG1 3.76Å; V1009-I1045 PolarHBondContact O-N 3.46Å; L1010-I1045 HydrophobicContact CD2-CB 4.05Å; L1010-I1045 HydrophobicContact CD2-CG2 4.11Å; V1011-I1045 PolarHBondContact N-O 3.28Å; K1043-I1045 HydrophobicContact CG-CD1 4.3Å; I1045-E1069 CarbonylContact C-O 3.6Å; I1045-E1069 WeakPolarHBondContact CA-O 3.46Å; I1045-E1069 HydrophobicContact CD1-CB 3.9Å; I1045-L1071 HydrophobicContact CG2-CB 4.02Å
1046	V	97.3	Very high	89.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113.5	-178.5	-175.8	0	0	0	0	111.3	V1011 V1044 K1048 F1063 T1068 E1069 M1070 L1071	V1011-V1046 HydrophobicContact CB-CB 4.43Å; V1011-V1046 HydrophobicContact CB-CG1 4.4Å; V1011-V1046 HydrophobicContact CB-CG2 4.08Å; V1011-V1046 HydrophobicContact CG1-CG1 4.32Å; V1011-V1046 HydrophobicContact CG2-CG2 4.24Å; V1044-V1046 HydrophobicContact CG1-CG2 4.25Å; V1046-K1048 HydrophobicContact CG1-CD 4.12Å; V1046-K1048 HydrophobicContact CG1-CG 4.38Å; V1046-F1063 HydrophobicContact CG1-CD1 4.22Å; V1046-F1063 HydrophobicContact CG1-CE1 3.78Å; V1046-F1063 HydrophobicContact CG2-CD1 4.21Å; V1046-F1063 HydrophobicContact CG2-CE1 4.34Å; V1046-T1068 HydrophobicContact CG2-CG2 3.74Å; V1046-E1069 PolarHBondContact N-O 3.46Å; V1046-M1070 HydrophobicContact CB-CE 3.68Å; V1046-M1070 HydrophobicContact CB-SD 3.85Å; V1046-M1070 HydrophobicContact CG1-CE 3.66Å; V1046-M1070 HydrophobicContact CG1-SD 4.39Å; V1046-M1070 HydrophobicContact CG2-SD 4.24Å; V1046-L1071 PolarHBondContact O-N 3.38Å
1047	V	96.1	Very high	88.2	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	108.3	177.8	175.7	0	0	0	0	110.2	V1011 I1012 G1013 L1071 A1075 I1078	V1011-V1047 PolarHBondContact O-N 2.85Å; I1012-V1047 HydrophobicContact CB-CB 4.43Å; I1012-V1047 HydrophobicContact CG1-CB 4.23Å; I1012-V1047 HydrophobicContact CG1-CG2 4.26Å; I1012-V1047 HydrophobicContact CG2-CB 4.18Å; I1012-V1047 HydrophobicContact CG2-CG1 4.08Å; G1013-V1047 PolarHBondContact N-O 3.17Å; G1013-V1047 VanDerWaalsContact N-O 3.15Å; V1047-L1071 WeakPolarHBondContact CA-O 3.4Å; V1047-L1071 HydrophobicContact CG2-CB 4.27Å; V1047-L1071 HydrophobicContact CG2-CD2 4.26Å; V1047-A1075 HydrophobicContact CG1-CB 4.23Å; V1047-I1078 HydrophobicContact CG1-CB 4.14Å; V1047-I1078 HydrophobicContact CG1-CD1 3.84Å; V1047-I1078 HydrophobicContact CG1-CG2 3.85Å; V1047-I1078 HydrophobicContact CG2-CG2 3.87Å
1048	K	92.6	Very high	87.3	Confident	25 Å²	25	48.6 Å²	48.6	11%	0.109	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	155.5	177	68.1	-174.9	-48.2	-156.1	0	112.2	V1046 T1050 L1051 G1052 F1063 M1070 L1071 L1072 G1073	V1046-K1048 HydrophobicContact CG1-CD 4.12Å; V1046-K1048 HydrophobicContact CG1-CG 4.38Å; K1048-T1050 VanDerWaalsContact CD-O 3.3Å; K1048-T1050 WeakPolarHBondContact CD-O 3.16Å; K1048-T1050 WeakPolarHBondContact CE-O 3.36Å; K1048-T1050 WeakPolarHBondContact CG-O 3.31Å; K1048-T1050 PolarHBondContact NZ-O 3.21Å; K1048-L1051 VanDerWaalsContact NZ-C 3.32Å; K1048-L1051 PolarHBondContact NZ-O 3.2Å; K1048-G1052 PolarHBondContact NZ-O 2.91Å; K1048-F1063 HydrophobicContact CD-CE1 4.4Å; K1048-F1063 HydrophobicContact CD-CE2 4.31Å; K1048-F1063 HydrophobicContact CD-CZ 4.02Å; K1048-F1063 VanDerWaalsContact NZ-CZ 3.3Å; K1048-M1070 HydrophobicContact CD-CE 3.47Å; K1048-M1070 VanDerWaalsContact CD-CE 3.47Å; K1048-M1070 HydrophobicContact CG-CE 3.86Å; K1048-L1071 PolarHBondContact N-O 3.17Å; K1048-L1072 HydrophobicContact CG-CD2 3.98Å; K1048-L1072 VanDerWaalsContact O-CA 3.3Å; K1048-L1072 WeakPolarHBondContact O-CA 3.46Å; K1048-L1072 WeakPolarHBondContact O-CD2 3.29Å; K1048-G1073 CarbonylContact C-O 3.46Å; K1048-G1073 VanDerWaalsContact C-O 3.29Å; K1048-G1073 PolarHBondContact O-N 3.34Å
1049	R	87	Confident	86.6	Confident	182 Å²	182	53 Å²	53	69%	0.687	28%	0.284	S	S	*	.	S	Bend	trans	-66.7	-39.7	-176.1	-67.1	176.7	-63	172.3	2.6	114.5	G1073	R1049-G1073 WeakPolarHBondContact CA-O 3.39Å; R1049-G1073 WeakPolarHBondContact CG-O 3.33Å; R1049-G1073 PolarHBondContact N-O 3.13Å
1050	T	86.2	Confident	86.4	Confident	97 Å²	97	51.7 Å²	51.7	60%	0.595	28%	0.279	S	S	*	.	S	Bend	trans	-149.7	169.8	178.6	66	0	0	0	0	109.3	K1048 G1052	K1048-T1050 VanDerWaalsContact CD-O 3.3Å; K1048-T1050 WeakPolarHBondContact CD-O 3.16Å; K1048-T1050 WeakPolarHBondContact CE-O 3.36Å; K1048-T1050 WeakPolarHBondContact CG-O 3.31Å; K1048-T1050 PolarHBondContact NZ-O 3.21Å; T1050-G1052 PolarHBondContact O-N 3.2Å; T1050-G1052 VanDerWaalsContact O-N 3.13Å
1051	L	83.9	Confident	86.2	Confident	59 Å²	59	48.5 Å²	48.5	31%	0.309	26%	0.263	S	S	.	.	S	Bend	trans	-66.1	-10.5	178.2	-74.1	166.1	0	0	0	115	H915 K1048 M1070	H915-L1051 HydrophobicContact CB-CD2 4.47Å; K1048-L1051 VanDerWaalsContact NZ-C 3.32Å; K1048-L1051 PolarHBondContact NZ-O 3.2Å; L1051-M1070 HydrophobicContact CD2-CE 4.11Å; L1051-M1070 HydrophobicContact CD2-CG 4.26Å
1052	G	77.5	Confident	86.1	Confident	38 Å²	38	48.3 Å²	48.3	39%	0.392	26%	0.262	S	S	.	.			trans	-53.4	158.1	-172.4	0	0	0	0	0	117.1	K1048 T1050	K1048-G1052 PolarHBondContact NZ-O 2.91Å; T1050-G1052 PolarHBondContact O-N 3.2Å; T1050-G1052 VanDerWaalsContact O-N 3.13Å
1053	V	77.3	Confident	86	Confident	74 Å²	74	42.4 Å²	42.4	45%	0.448	24%	0.236	S	C	.	.			trans	-62.1	165.2	-173.3	-61.7	0	0	0	0	115	A1057 D1059	V1053-A1057 HydrophobicContact CG2-CB 4.32Å; V1053-D1059 WeakPolarHBondContact CG1-OD1 3.26Å
1054	G	73.2	Confident	85.7	Confident	23 Å²	23	43.8 Å²	43.8	24%	0.237	24%	0.242	C	C	.	.			trans	-85.9	-159.4	176.3	0	0	0	0	0	113.8	N1015 D1016 A1056 A1057	N1015-G1054 WeakPolarHBondContact ND2-CA 3.39Å; N1015-G1054 PolarHBondContact ND2-N 3.01Å; D1016-G1054 WeakPolarHBondContact OD1-CA 3.47Å; G1054-A1056 VanDerWaalsContact C-N 3.32Å; G1054-A1057 PolarHBondContact O-N 3.45Å
1055	Y	70.8	Confident	85.3	Confident	137 Å²	137	46 Å²	46	54%	0.537	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-33.9	175.2	-80.7	-75.8	0	0	0	112.1	A835 D1016 A1057	A835-Y1055 HydrophobicContact CB-CD1 3.77Å; A835-Y1055 HydrophobicContact CB-CG 3.98Å; D1016-Y1055 WeakPolarHBondContact OD2-CA 3.3Å; D1016-Y1055 WeakPolarHBondContact OD2-CB 3.47Å; D1016-Y1055 PolarHBondContact OD2-N 3.43Å; Y1055-A1057 PolarHBondContact O-N 3.49Å
1056	A	64.9	Low	85	Confident	25 Å²	25	54.5 Å²	54.5	21%	0.207	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-6.9	176.1	0	0	0	0	0	113.9	D1016 I1030 G1054 V1058	D1016-A1056 PolarHBondContact OD2-N 3.47Å; D1016-A1056 VanDerWaalsContact OD2-N 3.14Å; I1030-A1056 HydrophobicContact CG2-CB 3.65Å; G1054-A1056 VanDerWaalsContact C-N 3.32Å; A1056-V1058 HydrophobicContact CB-CG2 4.01Å; A1056-V1058 PolarHBondContact O-N 3.27Å
1057	A	72.9	Confident	84.9	Confident	70 Å²	70	56.3 Å²	56.3	58%	0.579	30%	0.301	S	S	*	.			trans	56.9	20.3	-174.1	0	0	0	0	0	115.4	V1053 G1054 Y1055	V1053-A1057 HydrophobicContact CG2-CB 4.32Å; G1054-A1057 PolarHBondContact O-N 3.45Å; Y1055-A1057 PolarHBondContact O-N 3.49Å
1058	V	76.7	Confident	84.9	Confident	19 Å²	19	56.3 Å²	56.3	12%	0.115	30%	0.301	C	S	.	.			trans	-95.6	145.4	173.1	-161	0	0	0	0	109.5	I1029 A1056	I1029-V1058 HydrophobicContact CB-CG2 3.83Å; I1029-V1058 HydrophobicContact CD1-CG2 4.09Å; I1029-V1058 HydrophobicContact CG1-CG2 4.18Å; A1056-V1058 HydrophobicContact CB-CG2 4.01Å; A1056-V1058 PolarHBondContact O-N 3.27Å
1059	D	83.7	Confident	85.1	Confident	92 Å²	92	56.5 Å²	56.5	49%	0.492	30%	0.302	S	S	.	.			trans	-69	166.6	164.4	-68.2	-53	0	0	0	111.3	I911 N1019 V1053	I911-D1059 HydrophobicContact CD1-CB 3.51Å; N1019-D1059 PolarHBondContact ND2-O 3.2Å; V1053-D1059 WeakPolarHBondContact CG1-OD1 3.26Å
1060	N	91.6	Very high	85.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.			trans	-125	114.5	-174.5	-170.7	-20.1	0	0	0	111	N1015 N1019 I1062 F1063	N1015-N1060 PolarHBondContact O-ND2 2.85Å; N1015-N1060 VanDerWaalsContact OD1-CB 3.3Å; N1015-N1060 WeakPolarHBondContact OD1-CB 3.37Å; N1015-N1060 PolarHBondContact OD1-ND2 3.48Å; N1019-N1060 WeakPolarHBondContact CA-ND2 3.3Å; N1019-N1060 WeakPolarHBondContact CA-OD1 3.15Å; N1019-N1060 HydrophobicContact CB-CB 4.47Å; N1019-N1060 VanDerWaalsContact CG-CG 3.45Å; N1019-N1060 PolarHBondContact OD1-OD1 3.2Å; N1060-I1062 PolarHBondContact O-N 3.44Å; N1060-I1062 WeakPolarHBondContact OD1-CG1 3.27Å; N1060-I1062 WeakPolarHBondContact OD1-CG2 3.31Å; N1060-I1062 PolarHBondContact OD1-N 3.1Å; N1060-I1062 VanDerWaalsContact OD1-N 3.11Å; N1060-F1063 HydrophobicContact CB-CD1 4.46Å; N1060-F1063 HydrophobicContact CB-CD2 3.97Å; N1060-F1063 HydrophobicContact CB-CE1 4.1Å; N1060-F1063 HydrophobicContact CB-CE2 3.58Å; N1060-F1063 HydrophobicContact CB-CG 4.39Å; N1060-F1063 HydrophobicContact CB-CZ 3.66Å; N1060-F1063 PolarHBondContact O-N 2.88Å
1061	P	92.2	Very high	86	Confident	12 Å²	12	43.5 Å²	43.5	8%	0.078	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-61.3	-23.2	-178.7	-22.6	33.6	0	0	0	114	M909 I911 N1019 A1021 F1063 F1064	M909-P1061 HydrophobicContact SD-CG 4.2Å; I911-P1061 HydrophobicContact CD1-CG 4.14Å; I911-P1061 HydrophobicContact CG1-CG 4.23Å; N1019-P1061 WeakPolarHBondContact OD1-CD 3.33Å; A1021-P1061 HydrophobicContact CB-CG 4.03Å; P1061-F1063 PolarHBondContact O-N 3.48Å; P1061-F1064 PolarHBondContact O-N 3.2Å; P1061-F1064 VanDerWaalsContact O-N 3.07Å
1062	I	94.1	Very high	86.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-60.3	-32.6	-179.5	80.5	-172.3	0	0	0	112	V1018 V1038 W1039 N1060 F1064 K1065 T1068	V1018-I1062 HydrophobicContact CB-CD1 4.12Å; V1018-I1062 HydrophobicContact CG2-CD1 3.66Å; V1038-I1062 HydrophobicContact CG2-CD1 4.05Å; W1039-I1062 HydrophobicContact CB-CG2 4.25Å; W1039-I1062 HydrophobicContact CD2-CG2 4.49Å; W1039-I1062 HydrophobicContact CE3-CG2 3.95Å; N1060-I1062 PolarHBondContact O-N 3.44Å; N1060-I1062 WeakPolarHBondContact OD1-CG1 3.27Å; N1060-I1062 WeakPolarHBondContact OD1-CG2 3.31Å; N1060-I1062 PolarHBondContact OD1-N 3.1Å; N1060-I1062 VanDerWaalsContact OD1-N 3.11Å; I1062-F1064 PolarHBondContact O-N 3.2Å; I1062-K1065 HydrophobicContact CG2-CD 4.47Å; I1062-K1065 PolarHBondContact O-N 3.46Å; I1062-K1065 VanDerWaalsContact O-N 3.12Å; I1062-T1068 WeakPolarHBondContact O-CB 3.26Å; I1062-T1068 VanDerWaalsContact O-CG2 3.31Å; I1062-T1068 WeakPolarHBondContact O-CG2 3.41Å; I1062-T1068 PolarHBondContact O-OG1 3.45Å
1063	F	93.3	Very high	87.1	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-63.3	-9.2	179.5	-52.9	-24	0	0	0	113.4	H915 N1015 V1046 K1048 N1060 P1061 M1070	H915-F1063 WeakPolarHBondContact CA-O 3.43Å; H915-F1063 WeakPolarHBondContact CB-O 3.46Å; N1015-F1063 VanDerWaalsContact OD1-CZ 3.26Å; N1015-F1063 WeakPolarHBondContact OD1-CZ 3.45Å; V1046-F1063 HydrophobicContact CG1-CD1 4.22Å; V1046-F1063 HydrophobicContact CG1-CE1 3.78Å; V1046-F1063 HydrophobicContact CG2-CD1 4.21Å; V1046-F1063 HydrophobicContact CG2-CE1 4.34Å; K1048-F1063 HydrophobicContact CD-CE1 4.4Å; K1048-F1063 HydrophobicContact CD-CE2 4.31Å; K1048-F1063 HydrophobicContact CD-CZ 4.02Å; K1048-F1063 VanDerWaalsContact NZ-CZ 3.3Å; N1060-F1063 HydrophobicContact CB-CD1 4.46Å; N1060-F1063 HydrophobicContact CB-CD2 3.97Å; N1060-F1063 HydrophobicContact CB-CE1 4.1Å; N1060-F1063 HydrophobicContact CB-CE2 3.58Å; N1060-F1063 HydrophobicContact CB-CG 4.39Å; N1060-F1063 HydrophobicContact CB-CZ 3.66Å; N1060-F1063 PolarHBondContact O-N 2.88Å; P1061-F1063 PolarHBondContact O-N 3.48Å; F1063-M1070 HydrophobicContact CB-CE 4.44Å; F1063-M1070 HydrophobicContact CB-SD 3.68Å; F1063-M1070 HydrophobicContact CD1-CE 3.84Å; F1063-M1070 HydrophobicContact CD1-SD 3.7Å; F1063-M1070 HydrophobicContact CE1-CE 4.26Å; F1063-M1070 HydrophobicContact CG-CE 4.03Å; F1063-M1070 HydrophobicContact CG-SD 3.83Å
1064	F	91.2	Very high	87.8	Confident	61 Å²	61	41.9 Å²	41.9	27%	0.268	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-124.4	9.2	-176.6	-52.7	-96.4	0	0	0	112.4	I911 H915 P1061 I1062	I911-F1064 HydrophobicContact CD1-CE2 4.4Å; I911-F1064 HydrophobicContact CG2-CB 4.16Å; I911-F1064 HydrophobicContact CG2-CD1 4.23Å; I911-F1064 HydrophobicContact CG2-CD2 3.45Å; I911-F1064 VanDerWaalsContact CG2-CD2 3.45Å; I911-F1064 HydrophobicContact CG2-CE2 3.8Å; I911-F1064 HydrophobicContact CG2-CG 3.69Å; I911-F1064 HydrophobicContact CG2-CZ 4.32Å; H915-F1064 HydrophobicContact CB-CD1 4.3Å; H915-F1064 HydrophobicContact CB-CE1 4.32Å; P1061-F1064 PolarHBondContact O-N 3.2Å; P1061-F1064 VanDerWaalsContact O-N 3.07Å; I1062-F1064 PolarHBondContact O-N 3.2Å
1065	K	91.3	Very high	88.8	Confident	47 Å²	47	41.2 Å²	41.2	20%	0.204	22%	0.22	C	C	.	.	S	Bend	trans	-85.4	141.3	171.7	-65.4	179.3	-165.4	-75.8	0	109.8	S1020 E1024 W1039 I1062 N1067 T1068	S1020-K1065 WeakPolarHBondContact OG-CE 3.26Å; S1020-K1065 PolarHBondContact OG-NZ 3.38Å; E1024-K1065 IonicContact OE1-NZ 2.78Å; E1024-K1065 PolarHBondContact OE1-NZ 3.48Å; E1024-K1065 IonicContact OE2-NZ 2.73Å; E1024-K1065 PolarHBondContact OE2-NZ 2.97Å; W1039-K1065 HydrophobicContact CB-CD 3.82Å; W1039-K1065 HydrophobicContact CG-CD 4.35Å; I1062-K1065 HydrophobicContact CG2-CD 4.47Å; I1062-K1065 PolarHBondContact O-N 3.46Å; I1062-K1065 VanDerWaalsContact O-N 3.12Å; K1065-N1067 VanDerWaalsContact C-N 3.26Å; K1065-N1067 PolarHBondContact O-N 2.91Å; K1065-N1067 VanDerWaalsContact O-N 3.15Å; K1065-T1068 WeakPolarHBondContact O-CB 3.29Å; K1065-T1068 PolarHBondContact O-N 3.02Å
1066	E	91.1	Very high	89.9	Confident	177 Å²	177	38.3 Å²	38.3	83%	0.827	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.1	-171.5	-60.1	178.5	165.5	0	0	114.6	T1068	E1066-T1068 VanDerWaalsContact C-N 3.26Å; E1066-T1068 PolarHBondContact O-N 2.95Å
1067	N	94.7	Very high	91.3	Very high	40 Å²	40	40.7 Å²	40.7	21%	0.214	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.9	175.3	65.1	-22.6	0	0	0	114	W1039 A1041 V1044 K1065	W1039-N1067 PolarHBondContact O-ND2 2.85Å; A1041-N1067 PolarHBondContact O-ND2 2.9Å; V1044-N1067 PolarHBondContact N-O 2.9Å; K1065-N1067 VanDerWaalsContact C-N 3.26Å; K1065-N1067 PolarHBondContact O-N 2.91Å; K1065-N1067 VanDerWaalsContact O-N 3.15Å
1068	T	96.3	Very high	92.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.1	-174.8	-55.5	0	0	0	0	112.4	V1044 V1046 I1062 K1065 E1066	V1044-T1068 HydrophobicContact CB-CG2 4.18Å; V1044-T1068 HydrophobicContact CG1-CG2 4.2Å; V1044-T1068 CarbonylContact O-C 3.52Å; V1044-T1068 VanDerWaalsContact O-CA 3.31Å; V1044-T1068 WeakPolarHBondContact O-CA 3.36Å; V1046-T1068 HydrophobicContact CG2-CG2 3.74Å; I1062-T1068 WeakPolarHBondContact O-CB 3.26Å; I1062-T1068 VanDerWaalsContact O-CG2 3.31Å; I1062-T1068 WeakPolarHBondContact O-CG2 3.41Å; I1062-T1068 PolarHBondContact O-OG1 3.45Å; K1065-T1068 WeakPolarHBondContact O-CB 3.29Å; K1065-T1068 PolarHBondContact O-N 3.02Å; E1066-T1068 VanDerWaalsContact C-N 3.26Å; E1066-T1068 PolarHBondContact O-N 2.95Å
1069	E	96.7	Very high	93.3	Very high	29 Å²	29	36.9 Å²	36.9	14%	0.136	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.2	170.8	-70.4	175.8	-169.9	0	0	111.9	H916 T918 Y926 K1043 V1044 I1045 V1046	H916-E1069 HydrophobicContact CB-CG 4.14Å; H916-E1069 CarbonylContact O-C 3.29Å; H916-E1069 WeakPolarHBondContact O-CA 3.41Å; T918-E1069 WeakPolarHBondContact CB-OE2 3.49Å; T918-E1069 HydrophobicContact CG2-CB 3.77Å; T918-E1069 PolarHBondContact OG1-OE2 3.08Å; Y926-E1069 PolarHBondContact OH-OE1 3.49Å; K1043-E1069 VanDerWaalsContact CE-CD 3.47Å; K1043-E1069 WeakPolarHBondContact CE-OE1 3.27Å; K1043-E1069 VanDerWaalsContact NZ-CD 3.34Å; K1043-E1069 IonicContact NZ-OE1 3.97Å; K1043-E1069 PolarHBondContact NZ-OE1 2.86Å; V1044-E1069 PolarHBondContact O-N 3.32Å; I1045-E1069 CarbonylContact C-O 3.6Å; I1045-E1069 WeakPolarHBondContact CA-O 3.46Å; I1045-E1069 HydrophobicContact CD1-CB 3.9Å; V1046-E1069 PolarHBondContact N-O 3.46Å
1070	M	96	Very high	93.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.5	178.6	-55.1	-55.4	-54.8	0	0	110	H915 H916 Q917 T918 V1046 K1048 L1051 F1063 L1072	H915-M1070 HydrophobicContact CB-CG 4.07Å; H916-M1070 PolarHBondContact O-N 3.03Å; Q917-M1070 WeakPolarHBondContact CA-O 3.39Å; Q917-M1070 WeakPolarHBondContact CG-O 3.24Å; T918-M1070 PolarHBondContact N-O 2.78Å; V1046-M1070 HydrophobicContact CB-CE 3.68Å; V1046-M1070 HydrophobicContact CB-SD 3.85Å; V1046-M1070 HydrophobicContact CG1-CE 3.66Å; V1046-M1070 HydrophobicContact CG1-SD 4.39Å; V1046-M1070 HydrophobicContact CG2-SD 4.24Å; K1048-M1070 HydrophobicContact CD-CE 3.47Å; K1048-M1070 VanDerWaalsContact CD-CE 3.47Å; K1048-M1070 HydrophobicContact CG-CE 3.86Å; L1051-M1070 HydrophobicContact CD2-CE 4.11Å; L1051-M1070 HydrophobicContact CD2-CG 4.26Å; F1063-M1070 HydrophobicContact CB-CE 4.44Å; F1063-M1070 HydrophobicContact CB-SD 3.68Å; F1063-M1070 HydrophobicContact CD1-CE 3.84Å; F1063-M1070 HydrophobicContact CD1-SD 3.7Å; F1063-M1070 HydrophobicContact CE1-CE 4.26Å; F1063-M1070 HydrophobicContact CG-CE 4.03Å; F1063-M1070 HydrophobicContact CG-SD 3.83Å; M1070-L1072 HydrophobicContact CB-CD2 4.22Å; M1070-L1072 HydrophobicContact CB-CG 4.29Å; M1070-L1072 HydrophobicContact CE-CD2 4.36Å
1071	L	96.2	Very high	94.1	Very high	6 Å²	6	37.9 Å²	37.9	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	94.7	169.8	-176.3	58	0	0	0	108.2	T918 V920 V923 I1045 V1046 V1047 K1048 I1078 L1082	T918-L1071 HydrophobicContact CG2-CB 3.97Å; T918-L1071 HydrophobicContact CG2-CD1 4.32Å; V920-L1071 HydrophobicContact CG2-CD1 4.4Å; V923-L1071 HydrophobicContact CB-CD2 4.43Å; V923-L1071 HydrophobicContact CG2-CD2 4.15Å; I1045-L1071 HydrophobicContact CG2-CB 4.02Å; V1046-L1071 PolarHBondContact O-N 3.38Å; V1047-L1071 WeakPolarHBondContact CA-O 3.4Å; V1047-L1071 HydrophobicContact CG2-CB 4.27Å; V1047-L1071 HydrophobicContact CG2-CD2 4.26Å; K1048-L1071 PolarHBondContact N-O 3.17Å; L1071-I1078 HydrophobicContact CD2-CG2 3.57Å; L1071-I1078 HydrophobicContact CG-CD1 4.01Å; L1071-I1078 HydrophobicContact CG-CG1 4.38Å; L1071-I1078 HydrophobicContact CG-CG2 4.19Å; L1071-L1082 HydrophobicContact CD2-CD1 4.39Å
1072	L	93.9	Very high	94.2	Very high	52 Å²	52	37.4 Å²	37.4	27%	0.272	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	128.1	-171	-62.6	-178.6	0	0	0	112.5	K1048 M1070	K1048-L1072 HydrophobicContact CG-CD2 3.98Å; K1048-L1072 VanDerWaalsContact O-CA 3.3Å; K1048-L1072 WeakPolarHBondContact O-CA 3.46Å; K1048-L1072 WeakPolarHBondContact O-CD2 3.29Å; M1070-L1072 HydrophobicContact CB-CD2 4.22Å; M1070-L1072 HydrophobicContact CB-CG 4.29Å; M1070-L1072 HydrophobicContact CE-CD2 4.36Å
1073	G	91.7	Very high	94.3	Very high	24 Å²	24	37.9 Å²	37.9	25%	0.247	20%	0.196	C	C	.	.	S	Bend	trans	160.8	-172.7	178.4	0	0	0	0	0	113.1	K1048 R1049	K1048-G1073 CarbonylContact C-O 3.46Å; K1048-G1073 VanDerWaalsContact C-O 3.29Å; K1048-G1073 PolarHBondContact O-N 3.34Å; R1049-G1073 WeakPolarHBondContact CA-O 3.39Å; R1049-G1073 WeakPolarHBondContact CG-O 3.33Å; R1049-G1073 PolarHBondContact N-O 3.13Å
1074	D	91.9	Very high	94.3	Very high	62 Å²	62	41.4 Å²	41.4	33%	0.332	22%	0.216	S	C	.	.			trans	-74.6	137.8	170.9	-165.3	-83.7	0	0	0	110.9	A944 K1076 T1077 I1078	A944-D1074 WeakPolarHBondContact CB-OD1 3.38Å; D1074-K1076 VanDerWaalsContact C-N 3.25Å; D1074-K1076 PolarHBondContact O-N 2.98Å; D1074-K1076 PolarHBondContact OD1-N 2.75Å; D1074-T1077 PolarHBondContact O-N 3.17Å; D1074-I1078 WeakPolarHBondContact O-CB 3.28Å; D1074-I1078 WeakPolarHBondContact O-CG1 3.32Å; D1074-I1078 PolarHBondContact O-N 3.07Å
1075	A	92.8	Very high	94.3	Very high	9 Å²	9	39.6 Å²	39.6	7%	0.074	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-30.6	-176.2	0	0	0	0	0	112.6	A944 A946 I1012 V1047 C1079	A944-A1075 HydrophobicContact CB-CB 4.09Å; A946-A1075 HydrophobicContact CB-CB 4.12Å; I1012-A1075 HydrophobicContact CG2-CB 4.13Å; V1047-A1075 HydrophobicContact CG1-CB 4.23Å; A1075-C1079 WeakPolarHBondContact O-CB 3.45Å; A1075-C1079 PolarHBondContact O-N 2.86Å; A1075-C1079 VanDerWaalsContact O-N 3.14Å; A1075-C1079 PolarHBondContact O-SG 3.22Å
1076	K	94	Very high	94.1	Very high	76 Å²	76	37.4 Å²	37.4	33%	0.33	20%	0.202	S	C	.	.	H	α-helix	trans	-70.9	-53.9	177	172.1	161.3	171.3	48.3	0	111	A944 A946 D1074 I1078 C1079 D1080	A944-K1076 HydrophobicContact CB-CB 4.1Å; A944-K1076 WeakPolarHBondContact O-CB 3.28Å; A946-K1076 HydrophobicContact CB-CB 4.08Å; D1074-K1076 VanDerWaalsContact C-N 3.25Å; D1074-K1076 PolarHBondContact O-N 2.98Å; D1074-K1076 PolarHBondContact OD1-N 2.75Å; K1076-I1078 VanDerWaalsContact C-N 3.29Å; K1076-I1078 PolarHBondContact O-N 3.1Å; K1076-C1079 PolarHBondContact O-N 3.48Å; K1076-D1080 WeakPolarHBondContact CE-OD2 3.48Å; K1076-D1080 WeakPolarHBondContact CG-OD2 3.33Å; K1076-D1080 VanDerWaalsContact NZ-CG 3.29Å; K1076-D1080 IonicContact NZ-OD1 3.05Å; K1076-D1080 PolarHBondContact NZ-OD1 3.01Å; K1076-D1080 IonicContact NZ-OD2 2.67Å; K1076-D1080 PolarHBondContact NZ-OD2 3.26Å; K1076-D1080 PolarHBondContact O-N 3.42Å
1077	T	95.4	Very high	93.9	Very high	75 Å²	75	33.8 Å²	33.8	46%	0.46	18%	0.181	S	C	.	.	H	α-helix	trans	-54.2	-46.6	178.2	-53.5	0	0	0	0	111.1	D1074 C1079 D1080 D1081	D1074-T1077 PolarHBondContact O-N 3.17Å; T1077-C1079 PolarHBondContact O-N 2.84Å; T1077-D1080 PolarHBondContact O-N 3.47Å; T1077-D1081 WeakPolarHBondContact CG2-OD2 3.39Å; T1077-D1081 WeakPolarHBondContact O-CB 3.18Å; T1077-D1081 PolarHBondContact O-N 2.92Å
1078	I	95.6	Very high	93.3	Very high	8 Å²	8	38.4 Å²	38.4	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-62.2	-38.9	177.2	-74.6	165.1	0	0	0	112.6	V1047 L1071 D1074 K1076 L1082	V1047-I1078 HydrophobicContact CG1-CB 4.14Å; V1047-I1078 HydrophobicContact CG1-CD1 3.84Å; V1047-I1078 HydrophobicContact CG1-CG2 3.85Å; V1047-I1078 HydrophobicContact CG2-CG2 3.87Å; L1071-I1078 HydrophobicContact CD2-CG2 3.57Å; L1071-I1078 HydrophobicContact CG-CD1 4.01Å; L1071-I1078 HydrophobicContact CG-CG1 4.38Å; L1071-I1078 HydrophobicContact CG-CG2 4.19Å; D1074-I1078 WeakPolarHBondContact O-CB 3.28Å; D1074-I1078 WeakPolarHBondContact O-CG1 3.32Å; D1074-I1078 PolarHBondContact O-N 3.07Å; K1076-I1078 VanDerWaalsContact C-N 3.29Å; K1076-I1078 PolarHBondContact O-N 3.1Å; I1078-L1082 HydrophobicContact CG2-CD1 3.8Å; I1078-L1082 HydrophobicContact CG2-CG 4.4Å; I1078-L1082 VanDerWaalsContact O-CB 3.32Å; I1078-L1082 WeakPolarHBondContact O-CB 3.36Å; I1078-L1082 WeakPolarHBondContact O-CG 3.37Å; I1078-L1082 PolarHBondContact O-N 2.87Å
1079	C	95.9	Very high	92.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-71.2	-38.8	176.5	-67.7	0	0	0	0	112.5	P949 A1075 K1076 T1077 L1083	P949-C1079 HydrophobicContact CB-CB 4.01Å; P949-C1079 HydrophobicContact CG-CB 3.76Å; A1075-C1079 WeakPolarHBondContact O-CB 3.45Å; A1075-C1079 PolarHBondContact O-N 2.86Å; A1075-C1079 VanDerWaalsContact O-N 3.14Å; A1075-C1079 PolarHBondContact O-SG 3.22Å; K1076-C1079 PolarHBondContact O-N 3.48Å; T1077-C1079 PolarHBondContact O-N 2.84Å; C1079-L1083 VanDerWaalsContact O-CB 3.26Å; C1079-L1083 WeakPolarHBondContact O-CB 3.42Å; C1079-L1083 PolarHBondContact O-N 2.89Å
1080	D	96	Very high	90.1	Very high	45 Å²	45	46 Å²	46	24%	0.241	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-44.1	174.1	-65.1	-49.3	0	0	0	110.6	P949 K1076 T1077 L1083 N1084	P949-D1080 VanDerWaalsContact CB-OD1 3.24Å; P949-D1080 WeakPolarHBondContact CB-OD1 3.49Å; P949-D1080 WeakPolarHBondContact CG-OD1 3.35Å; K1076-D1080 WeakPolarHBondContact CE-OD2 3.48Å; K1076-D1080 WeakPolarHBondContact CG-OD2 3.33Å; K1076-D1080 VanDerWaalsContact NZ-CG 3.29Å; K1076-D1080 IonicContact NZ-OD1 3.05Å; K1076-D1080 PolarHBondContact NZ-OD1 3.01Å; K1076-D1080 IonicContact NZ-OD2 2.67Å; K1076-D1080 PolarHBondContact NZ-OD2 3.26Å; K1076-D1080 PolarHBondContact O-N 3.42Å; T1077-D1080 PolarHBondContact O-N 3.47Å; D1080-L1083 WeakPolarHBondContact O-CB 3.43Å; D1080-L1083 PolarHBondContact O-N 2.96Å; D1080-N1084 WeakPolarHBondContact O-CB 3.43Å; D1080-N1084 PolarHBondContact O-N 3.42Å; D1080-N1084 PolarHBondContact O-ND2 3.48Å; D1080-N1084 VanDerWaalsContact O-ND2 3.08Å
1081	D	95.7	Very high	89.8	Confident	68 Å²	68	48.4 Å²	48.4	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-68.2	-41.2	179.8	-68.3	-23.1	0	0	0	112.4	V920 T1077 N1084 A1085	V920-D1081 HydrophobicContact CG1-CB 3.93Å; V920-D1081 HydrophobicContact CG2-CB 4.13Å; T1077-D1081 WeakPolarHBondContact CG2-OD2 3.39Å; T1077-D1081 WeakPolarHBondContact O-CB 3.18Å; T1077-D1081 PolarHBondContact O-N 2.92Å; D1081-N1084 PolarHBondContact O-N 2.66Å; D1081-A1085 WeakPolarHBondContact O-CB 3.44Å; D1081-A1085 PolarHBondContact O-N 2.86Å
1082	L	95.3	Very high	89.4	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-39.1	174.1	-75	169.6	0	0	0	112	V920 V923 L927 L953 L1071 I1078 A1085 C1086	V920-L1082 HydrophobicContact CG1-CD2 3.83Å; V920-L1082 HydrophobicContact CG1-CG 4.13Å; V923-L1082 HydrophobicContact CB-CD2 3.96Å; V923-L1082 HydrophobicContact CG1-CD1 4.33Å; V923-L1082 HydrophobicContact CG1-CD2 3.73Å; L927-L1082 HydrophobicContact CD1-CD2 4.18Å; L953-L1082 HydrophobicContact CD2-CB 4.01Å; L1071-L1082 HydrophobicContact CD2-CD1 4.39Å; I1078-L1082 HydrophobicContact CG2-CD1 3.8Å; I1078-L1082 HydrophobicContact CG2-CG 4.4Å; I1078-L1082 VanDerWaalsContact O-CB 3.32Å; I1078-L1082 WeakPolarHBondContact O-CB 3.36Å; I1078-L1082 WeakPolarHBondContact O-CG 3.37Å; I1078-L1082 PolarHBondContact O-N 2.87Å; L1082-A1085 PolarHBondContact O-N 3.07Å; L1082-C1086 WeakPolarHBondContact O-CB 3.46Å; L1082-C1086 PolarHBondContact O-N 2.68Å; L1082-C1086 PolarHBondContact O-SG 2.91Å
1083	L	94.4	Very high	89.2	Confident	10 Å²	10	50.5 Å²	50.5	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-45.2	173.7	176.1	59.5	0	0	0	111.4	P949 E952 L953 C1079 D1080 R1087	P949-L1083 HydrophobicContact CB-CD2 4.31Å; E952-L1083 HydrophobicContact CB-CD1 4.16Å; E952-L1083 HydrophobicContact CB-CD2 3.73Å; L953-L1083 HydrophobicContact CB-CB 4.44Å; L953-L1083 HydrophobicContact CB-CD1 4.25Å; C1079-L1083 VanDerWaalsContact O-CB 3.26Å; C1079-L1083 WeakPolarHBondContact O-CB 3.42Å; C1079-L1083 PolarHBondContact O-N 2.89Å; D1080-L1083 WeakPolarHBondContact O-CB 3.43Å; D1080-L1083 PolarHBondContact O-N 2.96Å; L1083-R1087 HydrophobicContact CD1-CG 4.35Å; L1083-R1087 WeakPolarHBondContact O-CB 3.47Å; L1083-R1087 WeakPolarHBondContact O-CG 3.49Å; L1083-R1087 PolarHBondContact O-N 3.01Å
1084	N	94.4	Very high	89	Confident	79 Å²	79	52.1 Å²	52.1	42%	0.422	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.6	-68.3	-30.2	0	0	0	111.8	D1080 D1081 C1086 R1087 N1088	D1080-N1084 WeakPolarHBondContact O-CB 3.43Å; D1080-N1084 PolarHBondContact O-N 3.42Å; D1080-N1084 PolarHBondContact O-ND2 3.48Å; D1080-N1084 VanDerWaalsContact O-ND2 3.08Å; D1081-N1084 PolarHBondContact O-N 2.66Å; N1084-C1086 PolarHBondContact O-N 3.29Å; N1084-R1087 PolarHBondContact O-N 3.35Å; N1084-N1088 WeakPolarHBondContact O-CB 3.29Å; N1084-N1088 PolarHBondContact O-N 3.47Å; N1084-N1088 PolarHBondContact O-ND2 2.79Å
1085	A	91.4	Very high	88.8	Confident	23 Å²	23	51.4 Å²	51.4	19%	0.19	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-42.8	177.1	0	0	0	0	0	112.2	V920 A924 D1081 L1082 N1088 S1089	V920-A1085 HydrophobicContact CG1-CB 4.33Å; A924-A1085 HydrophobicContact CB-CB 3.64Å; D1081-A1085 WeakPolarHBondContact O-CB 3.44Å; D1081-A1085 PolarHBondContact O-N 2.86Å; L1082-A1085 PolarHBondContact O-N 3.07Å; A1085-N1088 PolarHBondContact O-N 2.79Å; A1085-S1089 PolarHBondContact O-N 2.71Å; A1085-S1089 VanDerWaalsContact O-N 3.14Å; A1085-S1089 PolarHBondContact O-OG 3.03Å
1086	C	86.2	Confident	88.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-47.9	174.7	-66	0	0	0	0	111.3	L953 R960 L1082 N1084 N1088 S1089	L953-C1086 HydrophobicContact CD1-CB 4.18Å; R960-C1086 VanDerWaalsContact CZ-O 3.28Å; R960-C1086 PolarHBondContact NH1-O 2.93Å; R960-C1086 PolarHBondContact NH2-O 2.97Å; L1082-C1086 WeakPolarHBondContact O-CB 3.46Å; L1082-C1086 PolarHBondContact O-N 2.68Å; L1082-C1086 PolarHBondContact O-SG 2.91Å; N1084-C1086 PolarHBondContact O-N 3.29Å; C1086-N1088 VanDerWaalsContact C-N 3.26Å; C1086-N1088 PolarHBondContact O-N 3.21Å; C1086-S1089 WeakPolarHBondContact O-CB 3.46Å; C1086-S1089 PolarHBondContact O-N 2.83Å
1087	R	87.3	Confident	88.2	Confident	102 Å²	102	52.7 Å²	52.7	39%	0.385	30%	0.301	S	S	.	.	H	α-helix	trans	-62.7	-28.3	178.3	-75.7	175.9	173.3	171.3	0.2	113.8	E952 E956 L1083 N1084 S1090	E952-R1087 IonicContact OE2-NH2 3.21Å; E952-R1087 PolarHBondContact OE2-NH2 3.21Å; E956-R1087 HydrophobicContact CG-CG 4.39Å; L1083-R1087 HydrophobicContact CD1-CG 4.35Å; L1083-R1087 WeakPolarHBondContact O-CB 3.47Å; L1083-R1087 WeakPolarHBondContact O-CG 3.49Å; L1083-R1087 PolarHBondContact O-N 3.01Å; N1084-R1087 PolarHBondContact O-N 3.35Å; R1087-S1090 PolarHBondContact O-OG 3.31Å
1088	N	82.6	Confident	87.6	Confident	137 Å²	137	51 Å²	51	73%	0.733	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-6	175.1	-65.1	-11.7	0	0	0	113.3	N1084 A1085 C1086 S1090	N1084-N1088 WeakPolarHBondContact O-CB 3.29Å; N1084-N1088 PolarHBondContact O-N 3.47Å; N1084-N1088 PolarHBondContact O-ND2 2.79Å; A1085-N1088 PolarHBondContact O-N 2.79Å; C1086-N1088 VanDerWaalsContact C-N 3.26Å; C1086-N1088 PolarHBondContact O-N 3.21Å; N1088-S1090 VanDerWaalsContact C-N 3.29Å
1089	S	70.9	Confident	87	Confident	62 Å²	62	54.6 Å²	54.6	43%	0.434	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	15.4	175.2	-55.9	0	0	0	0	112.9	N928 A1085 C1086	N928-S1089 WeakPolarHBondContact ND2-CB 3.31Å; N928-S1089 PolarHBondContact ND2-OG 3.2Å; A1085-S1089 PolarHBondContact O-N 2.71Å; A1085-S1089 VanDerWaalsContact O-N 3.14Å; A1085-S1089 PolarHBondContact O-OG 3.03Å; C1086-S1089 WeakPolarHBondContact O-CB 3.46Å; C1086-S1089 PolarHBondContact O-N 2.83Å
1090	S	53.6	Low	86.2	Confident	127 Å²	127	59.5 Å²	59.5	89%	0.888	34%	0.338	S	S	*	.			trans	-146.6	0	-173	54.7	0	0	0	0	111.3	R960 R1087 N1088	R960-S1090 VanDerWaalsContact NH2-CB 3.31Å; R960-S1090 PolarHBondContact NH2-OG 2.68Å; R1087-S1090 PolarHBondContact O-OG 3.31Å; N1088-S1090 VanDerWaalsContact C-N 3.29Å

Retrieved 1,090 of 1,090 residues in 245 ms (Link to these results)

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