A0A061ACM2_CAEEL Loading...

SH3 domain-containing protein

AlphaFold DB , UniProt , Accession A0A061ACM2, Species CAEEL (Caenorhabditis elegans), Gene eps-8, Length 870 aa.

						>A0A061ACM2_CAEEL|A0A061ACM2|eps-8
MTPRSDHRGPSMGYGNGGSVDQRVDDVTPSYYVEHLATFAVGRQFGLTFPADGIRKLKQMEKNSAIWAQPLILRFRHNAVTVEDDNGELVEQFPLELIEQPTAHVSNDSRETYNNVLLFVVREDRKRMSTPTEMHIFQCIRVSATDVAEDLKNYVQGQFRRVRNGRRTAAPTHLQAQQQQMPFYPPDDASISSETSEMFERDVNTLNRCFDDIERFVARIQSAALAQREIEQQNHRYRTANRRDKKNQQPPDPNGILFMRAQLPLESEFVDILKKFKLSFNLLAKLKNHIHEPNAPELLHFLFTPLAVILEACHWGLGRNVAPTVASPLLSLEARELMQNCLTSHESDIWMSLGEAWRTPPEDWTKPLPPPYRPIFNDGFAPYGVADRAMATPNQIHRGHSAPPEHFRQPPPRERNMVDTAPNTPQSMQRTPKSRPPHRNMSVDNLEFDRLTLERERLEFEKAKIMERESRLRHEEKQIEDEKRRMHAEKDLITKETTQPVPPPAAVVTHQPITKRYDPPISISPPPQRNNYSHVKVTVDSDTSPRQQAFIDDIVAKGGKLAVVTYDRGGQNTKELTVHKGEYLEVIFDERNWWECKNMHQRVGYVPHTILSMVPFEQQQYASPNHHNNSSSTGGYNNGHHQGPAQNVYRPPPPPLVSDAGVQVEIRREHVAPPPPPVVIPPPPPPVRTPTMEELLRMQQQQQQKQRKPPVEEPVYQPQPAQRAGLEIWRRNQNPQLIQEVTETVGQHSGDILRPAMQRATRVAINEKSSPEDVTRWLQEKGFSPRVIDLLDGQDGANLFSLSKLHLQQACGRDEGGYLYSQLLVQKKRSGFRTHTGDELKAILNHRRTHVELSNEAAADEPVFTINPIL
					

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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	33.2	Very low	34	Very low	243 Å²	243	154.1 Å²	154.1	100%	1.197	84%	0.84	S	S	*	*				0	160	0	-78.8	157.3	148.6	0	0	108.7
2	T	45.1	Very low	33.4	Very low	133 Å²	133	157.1 Å²	157.1	82%	0.816	85%	0.848	S	S	*	*			trans	-65	155.7	177	43.3	0	0	0	0	112
3	P	42	Very low	32.9	Very low	131 Å²	131	149.3 Å²	149.3	85%	0.851	83%	0.827	S	S	*	*				-125.2	-178.3	103	9.1	11.4	0	0	0	113
4	R	31.7	Very low	32.9	Very low	237 Å²	237	156.6 Å²	156.6	89%	0.894	84%	0.838	S	S	*	*			trans	-137	176.4	-176.1	-145.7	-179.8	-173	-175.9	1.8	109.4
5	S	34	Very low	32.4	Very low	95 Å²	95	151.3 Å²	151.3	66%	0.664	84%	0.835	S	S	*	*			trans	63.4	93.8	160.9	46.1	0	0	0	0	119.2
6	D	30.9	Very low	32.7	Very low	134 Å²	134	152.9 Å²	152.9	72%	0.717	84%	0.842	S	S	*	*				114.9	132.9	99.6	-80.6	-52.3	0	0	0	123.5
7	H	31	Very low	32.3	Very low	157 Å²	157	148.1 Å²	148.1	73%	0.727	84%	0.836	S	S	*	*			trans	70	99.4	139.2	-79.3	53.4	0	0	0	122.2
8	R	26.3	Very low	32.1	Very low	239 Å²	239	142.9 Å²	142.9	90%	0.902	82%	0.821	S	S	*	*				151.6	108.5	114.1	-83.3	173.8	-179.2	-166.9	0.8	116.4
9	G	31.7	Very low	32.5	Very low	78 Å²	78	141.9 Å²	141.9	80%	0.804	82%	0.824	S	S	*	*			trans	63.2	-173.5	149.5	0	0	0	0	0	119.2
10	P	34.9	Very low	32.4	Very low	134 Å²	134	142 Å²	142	87%	0.87	83%	0.826	S	S	*	*			cis	-125.1	-170	-5.1	42.5	-27.9	0	0	0	114.6
11	S	33.5	Very low	32.4	Very low	114 Å²	114	142.8 Å²	142.8	80%	0.797	83%	0.827	S	S	*	*			trans	-71.1	136.7	-173.5	179.8	0	0	0	0	116.8
12	M	27	Very low	32.3	Very low	190 Å²	190	140.2 Å²	140.2	94%	0.936	81%	0.812	S	S	*	*			trans	-162.1	157.2	133.5	-79.7	-148.8	-173.8	0	0	108
13	G	26.3	Very low	31.8	Very low	56 Å²	56	145.1 Å²	145.1	58%	0.577	82%	0.816	S	S	*	*			cis	164.5	111.1	-6.2	0	0	0	0	0	111.6
14	Y	32.4	Very low	31.4	Very low	251 Å²	251	145.1 Å²	145.1	98%	0.984	81%	0.813	S	S	*	*			trans	59.2	114.2	168.1	-56.3	-79.3	0	0	0	119.6
15	G	26	Very low	31.8	Very low	77 Å²	77	139 Å²	139	79%	0.794	80%	0.798	S	S	*	*			trans	-140.7	127.2	158.9	0	0	0	0	0	109.2
16	N	36.5	Very low	32.4	Very low	177 Å²	177	140.4 Å²	140.4	95%	0.947	80%	0.798	S	S	*	*			trans	-73.9	134.3	-172.9	-174.4	21.3	0	0	0	111.9
17	G	26.4	Very low	33.6	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	79%	0.789	S	S	*	*			trans	-160.7	104.2	179	0	0	0	0	0	111.9
18	G	28.9	Very low	35.4	Very low	55 Å²	55	131.1 Å²	131.1	57%	0.567	76%	0.757	S	S	*	*			trans	-88.1	168.3	177.5	0	0	0	0	0	114.1
19	S	39.2	Very low	38	Very low	125 Å²	125	119.8 Å²	119.8	87%	0.874	71%	0.714	S	S	*	*			trans	60.5	58.9	157	54.8	0	0	0	0	118.5
20	V	31.5	Very low	40.6	Very low	142 Å²	142	117.2 Å²	117.2	86%	0.861	68%	0.684	S	S	*	*			trans	-140.3	60.6	160.2	-162.7	0	0	0	0	112
21	D	31.2	Very low	43	Very low	159 Å²	159	111 Å²	111	85%	0.85	64%	0.643	S	S	*	*	S	Bend	trans	-151	48.2	174	-154.7	14.4	0	0	0	113.8
22	Q	31.8	Very low	45.5	Very low	189 Å²	189	110.2 Å²	110.2	88%	0.883	62%	0.623	S	S	*	*	S	Bend	trans	-155.2	26.5	-177	-133.7	168.7	38.4	0	0	114.7
23	R	33.9	Very low	48.4	Very low	237 Å²	237	101.1 Å²	101.1	89%	0.894	58%	0.579	S	S	*	*	S	Bend	trans	-146	39.7	-176.1	-68.7	-168.1	174.3	-178.3	-1.9	114.5
24	V	35.2	Very low	51.3	Low	130 Å²	130	101.2 Å²	101.2	79%	0.788	56%	0.564	S	S	*	*	S	Bend	trans	-132.7	-14.4	-178.6	-166.8	0	0	0	0	114.4	D26	V24-D26 PolarHBondContact O-N 3.37Å
25	D	39.9	Very low	54	Low	109 Å²	109	89.5 Å²	89.5	58%	0.583	52%	0.518	S	S	*	.			trans	-73.3	-2.5	-179.4	-82.7	-47.8	0	0	0	115.9	V27	D25-V27 VanDerWaalsContact C-N 3.34Å; D25-V27 PolarHBondContact O-N 3.18Å; D25-V27 VanDerWaalsContact O-N 3.13Å
26	D	46.3	Very low	56.8	Low	124 Å²	124	86.3 Å²	86.3	66%	0.663	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-20.7	-149.3	-130.9	-26.8	0	0	0	116	V24 R167	V24-D26 PolarHBondContact O-N 3.37Å; D26-R167 PolarHBondContact O-NH1 2.54Å; D26-R167 PolarHBondContact O-NH2 3.31Å; D26-R167 VanDerWaalsContact O-NH2 3.09Å
27	V	56.3	Low	59.2	Low	90 Å²	90	78.3 Å²	78.3	55%	0.545	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	64.8	-178.7	-149.8	0	0	0	0	112.8	D25 N164	D25-V27 VanDerWaalsContact C-N 3.34Å; D25-V27 PolarHBondContact O-N 3.18Å; D25-V27 VanDerWaalsContact O-N 3.13Å; V27-N164 HydrophobicContact CG1-CB 3.84Å; V27-N164 WeakPolarHBondContact CG1-ND2 3.46Å; V27-N164 PolarHBondContact O-OD1 2.79Å
28	T	67.9	Low	62	Low	7 Å²	7	75.7 Å²	75.7	4%	0.043	41%	0.411	C	S	.	.			trans	-86.5	145.2	163.6	35.8	0	0	0	0	111.5	F75 R167	T28-F75 WeakPolarHBondContact CB-O 3.07Å; T28-F75 VanDerWaalsContact CG2-O 3.26Å; T28-F75 WeakPolarHBondContact CG2-O 3.15Å; T28-R167 PolarHBondContact O-NH2 3.46Å
29	P	81.8	Confident	64.8	Low	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.385	C	S	.	.			trans	-60.3	145.7	172.5	-20.9	30.7	0	0	0	112.9	Y31 R74 F75 Y154 V162	P29-Y31 HydrophobicContact CB-CE2 3.71Å; P29-R74 WeakPolarHBondContact O-CA 3.37Å; P29-F75 HydrophobicContact CB-CB 4.24Å; P29-F75 HydrophobicContact CB-CD2 4.38Å; P29-F75 HydrophobicContact CG-CB 4.3Å; P29-F75 PolarHBondContact O-N 3.09Å; P29-Y154 WeakPolarHBondContact CD-OH 3.39Å; P29-Y154 HydrophobicContact CG-CE2 4Å; P29-V162 HydrophobicContact CB-CG1 4.38Å; P29-V162 HydrophobicContact CG-CG1 3.65Å
30	S	85.3	Confident	66.9	Low	25 Å²	25	67.4 Å²	67.4	18%	0.175	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.2	176.9	-52.6	0	0	0	0	110.4	L73	S30-L73 CarbonylContact C-O 3.01Å; S30-L73 VanDerWaalsContact CA-O 3.3Å; S30-L73 WeakPolarHBondContact CA-O 3.47Å
31	Y	86.3	Confident	69.6	Low	4 Å²	4	62 Å²	62	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133.1	-173.8	-48.5	-94.4	0	0	0	109.5	P29 L73 F75 V142 V147 D150	P29-Y31 HydrophobicContact CB-CE2 3.71Å; Y31-L73 PolarHBondContact N-O 3.31Å; Y31-L73 PolarHBondContact O-N 3.23Å; Y31-F75 HydrophobicContact CD2-CE1 4.27Å; Y31-F75 HydrophobicContact CD2-CE2 4.33Å; Y31-F75 HydrophobicContact CD2-CZ 4.13Å; Y31-F75 HydrophobicContact CE2-CD1 4.25Å; Y31-F75 AromaticContact CE2-CD2 3.64Å; Y31-F75 HydrophobicContact CE2-CD2 3.64Å; Y31-F75 HydrophobicContact CE2-CE1 4.11Å; Y31-F75 AromaticContact CE2-CE2 3.46Å; Y31-F75 HydrophobicContact CE2-CE2 3.46Å; Y31-F75 VanDerWaalsContact CE2-CE2 3.46Å; Y31-F75 HydrophobicContact CE2-CG 4.03Å; Y31-F75 AromaticContact CE2-CZ 3.7Å; Y31-F75 HydrophobicContact CE2-CZ 3.7Å; Y31-F75 AromaticContact CZ-CE2 3.93Å; Y31-V142 HydrophobicContact CD1-CB 4.45Å; Y31-V142 HydrophobicContact CD1-CG1 4.27Å; Y31-V142 HydrophobicContact CD1-CG2 4.23Å; Y31-V147 HydrophobicContact CD1-CB 4.33Å; Y31-V147 HydrophobicContact CD1-CG1 4.05Å; Y31-V147 HydrophobicContact CD1-CG2 3.47Å; Y31-V147 VanDerWaalsContact CD1-CG2 3.47Å; Y31-V147 HydrophobicContact CD2-CG1 3.99Å; Y31-V147 HydrophobicContact CE1-CB 4.44Å; Y31-V147 HydrophobicContact CE1-CG1 4.24Å; Y31-V147 HydrophobicContact CE1-CG2 3.85Å; Y31-V147 HydrophobicContact CE2-CG1 4.23Å; Y31-V147 HydrophobicContact CG-CG1 3.91Å; Y31-V147 HydrophobicContact CG-CG2 4.02Å; Y31-D150 VanDerWaalsContact OH-CB 3.3Å; Y31-D150 WeakPolarHBondContact OH-CB 3.37Å; Y31-D150 VanDerWaalsContact OH-CG 3.3Å; Y31-D150 PolarHBondContact OH-OD2 3.16Å
32	Y	85.9	Confident	72	Confident	96 Å²	96	55 Å²	55	38%	0.376	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.9	174.6	-70.9	-82	0	0	0	109.8	I72 I140	Y32-I72 HydrophobicContact CD1-CG1 4.05Å; Y32-I72 HydrophobicContact CE1-CD1 3.84Å; Y32-I72 HydrophobicContact CE1-CG1 3.88Å; Y32-I140 PolarHBondContact O-N 3.32Å; Y32-I140 VanDerWaalsContact O-N 3.16Å
33	V	87.9	Confident	74.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	164.3	-174.7	-61.3	0	0	0	0	110.9	L71 L73 F137 Q138	V33-L71 HydrophobicContact CG2-CB 4.24Å; V33-L71 PolarHBondContact N-O 3.45Å; V33-L71 PolarHBondContact O-N 3.19Å; V33-L73 HydrophobicContact CG1-CB 4.36Å; V33-L73 HydrophobicContact CG2-CB 4.04Å; V33-F137 HydrophobicContact CB-CB 4.2Å; V33-F137 HydrophobicContact CB-CD1 4.39Å; V33-F137 HydrophobicContact CG2-CD1 3.84Å; V33-F137 HydrophobicContact CG2-CE1 4.49Å; V33-F137 HydrophobicContact CG2-CG 4.47Å; V33-Q138 CarbonylContact C-O 3.4Å; V33-Q138 WeakPolarHBondContact CA-O 3.22Å; V33-Q138 WeakPolarHBondContact CB-O 3.34Å
34	E	87.3	Confident	76.4	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.3	163.6	-44.5	-178.9	128	0	0	108.6	L36 A68 Q69 F137 Q138 I140	E34-L36 PolarHBondContact O-N 3.42Å; E34-A68 HydrophobicContact CB-CB 4.05Å; E34-Q69 CarbonylContact C-O 3.53Å; E34-Q69 VanDerWaalsContact CA-O 3.23Å; E34-Q69 WeakPolarHBondContact CA-O 3.43Å; E34-F137 CarbonylContact O-C 3.54Å; E34-F137 WeakPolarHBondContact O-CA 3.37Å; E34-Q138 HydrophobicContact CB-CB 4.1Å; E34-Q138 PolarHBondContact N-O 2.9Å; E34-Q138 PolarHBondContact O-N 3.42Å; E34-I140 HydrophobicContact CG-CD1 3.6Å; E34-I140 HydrophobicContact CG-CG1 3.89Å
35	H	87.9	Confident	78.4	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.019	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	131.2	169.8	177.9	-106.9	0	0	0	109.2	A37 T38 A68 Q69 L71 F137	H35-A37 PolarHBondContact NE2-O 3.32Å; H35-T38 PolarHBondContact CE1-OG1 3.44Å; H35-T38 PolarHBondContact NE2-OG1 3.06Å; H35-A68 WeakPolarHBondContact O-CA 3.41Å; H35-Q69 HydrophobicContact CB-CB 4.26Å; H35-Q69 PolarHBondContact N-O 3.25Å; H35-Q69 PolarHBondContact O-N 2.9Å; H35-L71 HydrophobicContact CB-CD1 3.75Å; H35-F137 HydrophobicContact CB-CD1 3.96Å; H35-F137 HydrophobicContact CB-CE1 3.89Å; H35-F137 AromaticContact CD2-CE1 3.73Å
36	L	86.3	Confident	80.3	Confident	10 Å²	10	46.1 Å²	46.1	5%	0.052	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-42.6	-179.7	-60.2	-177.2	0	0	0	112	E34 L57 I66 A68 Y113 V116 I136 Q138	E34-L36 PolarHBondContact O-N 3.42Å; L36-L57 HydrophobicContact CB-CD1 4.2Å; L36-L57 HydrophobicContact CD1-CD2 4.1Å; L36-I66 HydrophobicContact CB-CG2 4.23Å; L36-I66 HydrophobicContact CD2-CG2 4.34Å; L36-A68 HydrophobicContact CD2-CB 3.87Å; L36-Y113 HydrophobicContact CD1-CD1 3.54Å; L36-Y113 HydrophobicContact CD1-CE1 4.1Å; L36-Y113 HydrophobicContact CD1-CG 4.01Å; L36-Y113 HydrophobicContact CD2-CD1 3.89Å; L36-Y113 HydrophobicContact CD2-CE1 3.63Å; L36-Y113 HydrophobicContact CG-CD1 4.38Å; L36-Y113 HydrophobicContact CG-CE1 4.5Å; L36-V116 HydrophobicContact CD1-CG2 4.39Å; L36-I136 HydrophobicContact CB-CG2 4.48Å; L36-I136 HydrophobicContact CD1-CG2 4.41Å; L36-I136 PolarHBondContact N-O 3.43Å; L36-Q138 HydrophobicContact CD1-CB 4.09Å; L36-Q138 HydrophobicContact CD2-CB 4.07Å; L36-Q138 HydrophobicContact CG-CB 4.1Å
37	A	85.6	Confident	82.1	Confident	9 Å²	9	40.5 Å²	40.5	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	153.3	-175.8	0	0	0	0	0	112.2	H35 F39 L57 I136	H35-A37 PolarHBondContact NE2-O 3.32Å; A37-F39 HydrophobicContact CB-CD1 4.47Å; A37-F39 HydrophobicContact CB-CE1 3.82Å; A37-F39 HydrophobicContact CB-CE2 4.17Å; A37-F39 HydrophobicContact CB-CZ 3.65Å; A37-L57 HydrophobicContact CB-CD1 4.06Å; A37-I136 HydrophobicContact CB-CB 4.42Å; A37-I136 PolarHBondContact N-O 3.37Å; A37-I136 PolarHBondContact O-N 3.19Å
38	T	85.8	Confident	83.3	Confident	16 Å²	16	38.8 Å²	38.8	10%	0.098	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134.9	159.8	-57.2	0	0	0	0	107.4	H35 E133 M134 H135 V851	H35-T38 PolarHBondContact CE1-OG1 3.44Å; H35-T38 PolarHBondContact NE2-OG1 3.06Å; T38-E133 HydrophobicContact CG2-CB 3.95Å; T38-E133 HydrophobicContact CG2-CG 4.13Å; T38-E133 WeakPolarHBondContact CG2-OE2 3.45Å; T38-M134 CarbonylContact C-O 3.59Å; T38-M134 VanDerWaalsContact CA-O 3.29Å; T38-M134 WeakPolarHBondContact CA-O 3.03Å; T38-H135 PolarHBondContact OG1-ND1 3.27Å; T38-V851 VanDerWaalsContact O-CG2 3.3Å; T38-V851 WeakPolarHBondContact O-CG2 3.26Å
39	F	86.4	Confident	84.2	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.4	178.9	-60.2	-42.8	0	0	0	111.9	A37 V41 L47 K56 M60 E133 M134 I136 N855	A37-F39 HydrophobicContact CB-CD1 4.47Å; A37-F39 HydrophobicContact CB-CE1 3.82Å; A37-F39 HydrophobicContact CB-CE2 4.17Å; A37-F39 HydrophobicContact CB-CZ 3.65Å; F39-V41 PolarHBondContact O-N 2.97Å; F39-L47 HydrophobicContact CB-CD1 3.65Å; F39-L47 HydrophobicContact CD2-CD1 4.22Å; F39-L47 HydrophobicContact CG-CD1 4.01Å; F39-K56 HydrophobicContact CD2-CG 4.43Å; F39-K56 HydrophobicContact CE1-CG 4.2Å; F39-K56 HydrophobicContact CE2-CB 4.12Å; F39-K56 HydrophobicContact CE2-CG 3.89Å; F39-K56 HydrophobicContact CZ-CB 4.4Å; F39-K56 HydrophobicContact CZ-CG 3.77Å; F39-M60 HydrophobicContact CE1-CE 4.09Å; F39-M60 HydrophobicContact CE1-SD 3.5Å; F39-M60 WeakPolarHBondContact CE1-SD 3.38Å; F39-M60 HydrophobicContact CZ-SD 3.65Å; F39-E133 CarbonylContact O-C 3.54Å; F39-E133 WeakPolarHBondContact O-CA 3.28Å; F39-M134 PolarHBondContact N-O 3.09Å; F39-M134 PolarHBondContact O-N 3.2Å; F39-I136 HydrophobicContact CD2-CD1 3.85Å; F39-I136 HydrophobicContact CE2-CD1 3.53Å; F39-I136 HydrophobicContact CZ-CD1 4.5Å; F39-N855 WeakPolarHBondContact CA-OD1 3.47Å; F39-N855 WeakPolarHBondContact CB-OD1 3.22Å
40	A	85.3	Confident	84.4	Confident	3 Å²	3	45.6 Å²	45.6	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.2	170.6	0	0	0	0	0	109.7	F45 V851 N855	A40-F45 HydrophobicContact CB-CD2 4.01Å; A40-F45 HydrophobicContact CB-CE2 3.59Å; A40-F45 HydrophobicContact CB-CZ 4.14Å; A40-F45 WeakPolarHBondContact O-CD2 3.41Å; A40-V851 HydrophobicContact CB-CG1 3.93Å; A40-N855 PolarHBondContact N-OD1 3.23Å; A40-N855 PolarHBondContact O-ND2 2.79Å
41	V	86.7	Confident	84.4	Confident	28 Å²	28	47.7 Å²	47.7	17%	0.17	25%	0.245	C	C	.	.			trans	-92.7	131	-175.7	-176.7	0	0	0	0	109.9	F39 L47 V120 T132 M134	F39-V41 PolarHBondContact O-N 2.97Å; V41-L47 WeakPolarHBondContact CG1-O 3.49Å; V41-V120 HydrophobicContact CG2-CG1 4.34Å; V41-T132 HydrophobicContact CB-CG2 3.93Å; V41-T132 HydrophobicContact CG1-CG2 4.36Å; V41-T132 HydrophobicContact CG2-CG2 4.4Å; V41-T132 PolarHBondContact N-O 3.27Å; V41-M134 HydrophobicContact CG2-CB 3.53Å; V41-M134 HydrophobicContact CG2-CE 4.38Å
42	G	83.1	Confident	84.6	Confident	13 Å²	13	48.4 Å²	48.4	13%	0.134	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	169.7	153.8	-179.8	0	0	0	0	0	112.7	Q44 F45 G46 L47	G42-Q44 PolarHBondContact O-N 3.41Å; G42-F45 PolarHBondContact O-N 2.82Å; G42-G46 PolarHBondContact O-N 2.84Å; G42-L47 CarbonylContact C-O 3.55Å; G42-L47 PolarHBondContact N-O 3.45Å
43	R	81.8	Confident	84.7	Confident	222 Å²	222	43.9 Å²	43.9	84%	0.838	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-60.3	-33.5	178.8	-66	-173.4	179.8	-160	0	112	F45 G46	R43-F45 PolarHBondContact O-N 2.9Å; R43-G46 PolarHBondContact O-N 3.31Å
44	Q	76.1	Confident	84.7	Confident	144 Å²	144	44.5 Å²	44.5	67%	0.673	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-63.2	-21.3	175.7	69.2	-79.4	11.5	0	0	113.9	G42	G42-Q44 PolarHBondContact O-N 3.41Å
45	F	77.3	Confident	84.7	Confident	68 Å²	68	48.6 Å²	48.6	30%	0.298	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-102.8	-3.8	179.8	-56.9	-56.7	0	0	0	113.5	A40 G42 R43 L47 N855	A40-F45 HydrophobicContact CB-CD2 4.01Å; A40-F45 HydrophobicContact CB-CE2 3.59Å; A40-F45 HydrophobicContact CB-CZ 4.14Å; A40-F45 WeakPolarHBondContact O-CD2 3.41Å; G42-F45 PolarHBondContact O-N 2.82Å; R43-F45 PolarHBondContact O-N 2.9Å; F45-L47 HydrophobicContact CB-CB 4.48Å; F45-L47 HydrophobicContact CB-CG 4.45Å; F45-L47 PolarHBondContact O-N 2.97Å; F45-N855 WeakPolarHBondContact CD1-ND2 3.22Å; F45-N855 WeakPolarHBondContact CG-ND2 3.28Å
46	G	78.9	Confident	84.6	Confident	43 Å²	43	50.4 Å²	50.4	44%	0.443	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	13.6	-172.3	0	0	0	0	0	114.3	G42 R43	G42-G46 PolarHBondContact O-N 2.84Å; R43-G46 PolarHBondContact O-N 3.31Å
47	L	84.2	Confident	84.6	Confident	7 Å²	7	50 Å²	50	4%	0.037	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-113.2	100.2	178.7	-61.2	-179.9	0	0	0	108.4	F39 V41 G42 F45 D52 K56	F39-L47 HydrophobicContact CB-CD1 3.65Å; F39-L47 HydrophobicContact CD2-CD1 4.22Å; F39-L47 HydrophobicContact CG-CD1 4.01Å; V41-L47 WeakPolarHBondContact CG1-O 3.49Å; G42-L47 CarbonylContact C-O 3.55Å; G42-L47 PolarHBondContact N-O 3.45Å; F45-L47 HydrophobicContact CB-CB 4.48Å; F45-L47 HydrophobicContact CB-CG 4.45Å; F45-L47 PolarHBondContact O-N 2.97Å; L47-D52 HydrophobicContact CD2-CB 3.78Å; L47-K56 HydrophobicContact CD2-CB 3.94Å; L47-K56 HydrophobicContact CD2-CG 4.37Å
48	T	81.4	Confident	84.5	Confident	53 Å²	53	51.6 Å²	51.6	33%	0.325	26%	0.258	S	S	.	.			trans	-129.8	-24.5	-178.9	-49.7	0	0	0	0	112.8	D52	T48-D52 PolarHBondContact N-OD2 3.18Å
49	F	86.3	Confident	84.3	Confident	130 Å²	130	56.3 Å²	56.3	57%	0.57	28%	0.279	S	S	*	.	S	Bend	trans	-122.7	156.3	179	-56.2	-79.4	0	0	0	111.2	A51 D52	F49-A51 PolarHBondContact O-N 3.26Å; F49-A51 VanDerWaalsContact O-N 3.16Å; F49-D52 PolarHBondContact N-OD2 2.88Å; F49-D52 VanDerWaalsContact O-CB 3.27Å; F49-D52 WeakPolarHBondContact O-CB 3.5Å; F49-D52 PolarHBondContact O-N 3.48Å
50	P	86.2	Confident	83.8	Confident	20 Å²	20	57.3 Å²	57.3	13%	0.13	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-32.9	180	-27	37.3	0	0	0	113.5	D52 G53 I54 Q100 T102 L118	P50-D52 PolarHBondContact O-N 3.27Å; P50-G53 PolarHBondContact O-N 3.18Å; P50-I54 PolarHBondContact O-N 3.49Å; P50-Q100 VanDerWaalsContact CD-OE1 3.3Å; P50-Q100 HydrophobicContact CG-CB 4.21Å; P50-T102 HydrophobicContact CB-CG2 3.91Å; P50-T102 HydrophobicContact CG-CG2 4.48Å; P50-T102 WeakPolarHBondContact CG-OG1 3.13Å; P50-L118 HydrophobicContact CB-CD1 3.85Å; P50-L118 HydrophobicContact CB-CG 4.35Å
51	A	86.8	Confident	83.2	Confident	69 Å²	69	59.4 Å²	59.4	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-64.5	-23.7	174.6	0	0	0	0	0	113.7	F49 R55	F49-A51 PolarHBondContact O-N 3.26Å; F49-A51 VanDerWaalsContact O-N 3.16Å; A51-R55 WeakPolarHBondContact O-CB 3.3Å; A51-R55 PolarHBondContact O-N 2.92Å; A51-R55 VanDerWaalsContact O-N 3.17Å
52	D	89	Confident	82.4	Confident	20 Å²	20	66.5 Å²	66.5	11%	0.107	32%	0.322	C	S	.	.	H	α-helix	trans	-72.4	-40	173.7	-55.1	-39	0	0	0	111.2	L47 T48 F49 P50 R55 K56	L47-D52 HydrophobicContact CD2-CB 3.78Å; T48-D52 PolarHBondContact N-OD2 3.18Å; F49-D52 PolarHBondContact N-OD2 2.88Å; F49-D52 VanDerWaalsContact O-CB 3.27Å; F49-D52 WeakPolarHBondContact O-CB 3.5Å; F49-D52 PolarHBondContact O-N 3.48Å; P50-D52 PolarHBondContact O-N 3.27Å; D52-R55 PolarHBondContact O-N 3.37Å; D52-R55 IonicContact OD1-CZ 2.74Å; D52-R55 IonicContact OD1-NH1 2.62Å; D52-R55 PolarHBondContact OD1-NH1 3.3Å; D52-R55 IonicContact OD1-NH2 2.76Å; D52-R55 PolarHBondContact OD1-NH2 3Å; D52-K56 WeakPolarHBondContact O-CB 3.45Å; D52-K56 PolarHBondContact O-N 3.43Å
53	G	87.7	Confident	81.4	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-61.1	-47.2	175.8	0	0	0	0	0	112.4	P50 R55 K56 L57	P50-G53 PolarHBondContact O-N 3.18Å; G53-R55 VanDerWaalsContact C-N 3.33Å; G53-R55 PolarHBondContact O-N 3.48Å; G53-K56 PolarHBondContact O-N 3.24Å; G53-L57 WeakPolarHBondContact O-CB 3.44Å; G53-L57 PolarHBondContact O-N 2.96Å
54	I	89.6	Confident	80.1	Confident	14 Å²	14	67 Å²	67	7%	0.072	35%	0.347	C	S	.	.	H	α-helix	trans	-61.9	-40.3	174.8	-64	-62.8	0	0	0	111.7	P50 L57 K58 H104 V116 L118	P50-I54 PolarHBondContact O-N 3.49Å; I54-L57 PolarHBondContact O-N 3.48Å; I54-K58 HydrophobicContact CG2-CD 4.17Å; I54-K58 WeakPolarHBondContact O-CG 3.31Å; I54-K58 PolarHBondContact O-N 3.45Å; I54-H104 HydrophobicContact CD1-CB 3.65Å; I54-H104 HydrophobicContact CG1-CB 3.9Å; I54-V116 HydrophobicContact CD1-CB 4.48Å; I54-V116 HydrophobicContact CD1-CG1 4Å; I54-L118 HydrophobicContact CD1-CD2 3.92Å; I54-L118 HydrophobicContact CG1-CD1 4.48Å; I54-L118 HydrophobicContact CG1-CD2 4.15Å
55	R	86.9	Confident	79.3	Confident	143 Å²	143	61.7 Å²	61.7	54%	0.54	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-38.8	176.9	-174.3	176.2	66.8	-108.4	1.3	112.2	A51 D52 G53 Q59	A51-R55 WeakPolarHBondContact O-CB 3.3Å; A51-R55 PolarHBondContact O-N 2.92Å; A51-R55 VanDerWaalsContact O-N 3.17Å; D52-R55 PolarHBondContact O-N 3.37Å; D52-R55 IonicContact OD1-CZ 2.74Å; D52-R55 IonicContact OD1-NH1 2.62Å; D52-R55 PolarHBondContact OD1-NH1 3.3Å; D52-R55 IonicContact OD1-NH2 2.76Å; D52-R55 PolarHBondContact OD1-NH2 3Å; G53-R55 VanDerWaalsContact C-N 3.33Å; G53-R55 PolarHBondContact O-N 3.48Å; R55-Q59 PolarHBondContact O-N 2.93Å
56	K	84.9	Confident	78.7	Confident	42 Å²	42	59.8 Å²	59.8	18%	0.183	32%	0.321	C	S	.	.	H	α-helix	trans	-70.2	-39.9	175.2	178.4	68.6	177.4	-169.4	0	112	F39 L47 D52 G53 Q59 M60 N855	F39-K56 HydrophobicContact CD2-CG 4.43Å; F39-K56 HydrophobicContact CE1-CG 4.2Å; F39-K56 HydrophobicContact CE2-CB 4.12Å; F39-K56 HydrophobicContact CE2-CG 3.89Å; F39-K56 HydrophobicContact CZ-CB 4.4Å; F39-K56 HydrophobicContact CZ-CG 3.77Å; L47-K56 HydrophobicContact CD2-CB 3.94Å; L47-K56 HydrophobicContact CD2-CG 4.37Å; D52-K56 WeakPolarHBondContact O-CB 3.45Å; D52-K56 PolarHBondContact O-N 3.43Å; G53-K56 PolarHBondContact O-N 3.24Å; K56-Q59 WeakPolarHBondContact O-CB 3.35Å; K56-Q59 PolarHBondContact O-N 3.27Å; K56-Q59 VanDerWaalsContact O-N 3.12Å; K56-M60 HydrophobicContact CD-SD 4.38Å; K56-M60 HydrophobicContact CG-SD 4.17Å; K56-M60 WeakPolarHBondContact O-CG 3.45Å; K56-M60 PolarHBondContact O-N 2.87Å; K56-N855 WeakPolarHBondContact CE-O 3.33Å; K56-N855 PolarHBondContact NZ-O 3.26Å
57	L	86.8	Confident	78.2	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-57.1	-53.9	173.2	-169.9	78.2	0	0	0	110.6	L36 A37 G53 I54 Q59 M60 E61 I66 Y113 I136	L36-L57 HydrophobicContact CB-CD1 4.2Å; L36-L57 HydrophobicContact CD1-CD2 4.1Å; A37-L57 HydrophobicContact CB-CD1 4.06Å; G53-L57 WeakPolarHBondContact O-CB 3.44Å; G53-L57 PolarHBondContact O-N 2.96Å; I54-L57 PolarHBondContact O-N 3.48Å; L57-Q59 PolarHBondContact O-N 2.97Å; L57-Q59 VanDerWaalsContact O-N 3.07Å; L57-M60 PolarHBondContact O-N 2.75Å; L57-E61 PolarHBondContact O-N 2.9Å; L57-I66 HydrophobicContact CD1-CD1 3.66Å; L57-I66 HydrophobicContact CD1-CG1 4.32Å; L57-I66 HydrophobicContact CG-CD1 3.89Å; L57-I66 WeakPolarHBondContact O-CD1 3.48Å; L57-Y113 HydrophobicContact CD2-CD2 4.46Å; L57-Y113 HydrophobicContact CD2-CG 4.4Å; L57-I136 HydrophobicContact CD2-CG2 4.19Å
58	K	83.9	Confident	77.8	Confident	42 Å²	42	65.4 Å²	65.4	18%	0.183	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-10.3	176.8	-68.5	177.8	174.9	-179.5	0	114.4	I54 H104 E111	I54-K58 HydrophobicContact CG2-CD 4.17Å; I54-K58 WeakPolarHBondContact O-CG 3.31Å; I54-K58 PolarHBondContact O-N 3.45Å; K58-H104 PolarHBondContact NZ-NE2 2.84Å; K58-E111 WeakPolarHBondContact CE-OE1 3.43Å; K58-E111 IonicContact NZ-OE1 3.83Å; K58-E111 PolarHBondContact NZ-OE1 2.99Å; K58-E111 IonicContact NZ-OE2 2.67Å; K58-E111 PolarHBondContact NZ-OE2 2.94Å
59	Q	80.6	Confident	77.5	Confident	115 Å²	115	63 Å²	63	54%	0.537	32%	0.32	S	S	.	.	H	α-helix	trans	-86.7	-41.2	168.3	-174.1	-176.6	-0.6	0	0	111.5	R55 K56 L57 K62	R55-Q59 PolarHBondContact O-N 2.93Å; K56-Q59 WeakPolarHBondContact O-CB 3.35Å; K56-Q59 PolarHBondContact O-N 3.27Å; K56-Q59 VanDerWaalsContact O-N 3.12Å; L57-Q59 PolarHBondContact O-N 2.97Å; L57-Q59 VanDerWaalsContact O-N 3.07Å; Q59-K62 PolarHBondContact O-N 3.02Å
60	M	76.8	Confident	77.1	Confident	25 Å²	25	60.1 Å²	60.1	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-71.8	-32.1	179.2	-70	171.6	58.8	0	0	112.8	F39 K56 L57 K62 N63 S64 A65 I66 A857	F39-M60 HydrophobicContact CE1-CE 4.09Å; F39-M60 HydrophobicContact CE1-SD 3.5Å; F39-M60 WeakPolarHBondContact CE1-SD 3.38Å; F39-M60 HydrophobicContact CZ-SD 3.65Å; K56-M60 HydrophobicContact CD-SD 4.38Å; K56-M60 HydrophobicContact CG-SD 4.17Å; K56-M60 WeakPolarHBondContact O-CG 3.45Å; K56-M60 PolarHBondContact O-N 2.87Å; L57-M60 PolarHBondContact O-N 2.75Å; M60-K62 PolarHBondContact O-N 3.34Å; M60-N63 PolarHBondContact O-N 3.42Å; M60-S64 PolarHBondContact O-N 2.86Å; M60-A65 HydrophobicContact CB-CB 4.49Å; M60-A65 PolarHBondContact O-N 3.44Å; M60-A65 VanDerWaalsContact O-N 3.13Å; M60-I66 HydrophobicContact CB-CD1 4.25Å; M60-I66 HydrophobicContact CB-CG1 4.06Å; M60-A857 HydrophobicContact CE-CB 4.21Å
61	E	73.5	Confident	77.1	Confident	48 Å²	48	59.3 Å²	59.3	22%	0.224	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-50.4	-43.9	170.9	-178.2	-179.6	-180	0	0	112.2	L57 N63 S64 I66 T112 Y113	L57-E61 PolarHBondContact O-N 2.9Å; E61-N63 PolarHBondContact O-N 3.11Å; E61-S64 PolarHBondContact O-N 3.26Å; E61-I66 HydrophobicContact CB-CD1 3.91Å; E61-T112 WeakPolarHBondContact OE1-CB 3.36Å; E61-T112 PolarHBondContact OE1-OG1 3.43Å; E61-Y113 HydrophobicContact CB-CE2 4.37Å; E61-Y113 HydrophobicContact CG-CD2 4.41Å; E61-Y113 HydrophobicContact CG-CE2 4.05Å
62	K	68.1	Low	77.1	Confident	177 Å²	177	57.2 Å²	57.2	77%	0.77	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-68.8	-13.9	-179.2	-62.5	-179.5	-177.2	-178.2	0	114.1	Q59 M60	Q59-K62 PolarHBondContact O-N 3.02Å; M60-K62 PolarHBondContact O-N 3.34Å
63	N	63.7	Low	77.2	Confident	125 Å²	125	56.2 Å²	56.2	67%	0.668	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-104.6	12.4	175.9	-63.6	6.1	0	0	0	111.5	M60 E61 A65	M60-N63 PolarHBondContact O-N 3.42Å; E61-N63 PolarHBondContact O-N 3.11Å; N63-A65 HydrophobicContact CB-CB 4.15Å; N63-A65 PolarHBondContact O-N 2.83Å
64	S	53.5	Low	77.2	Confident	119 Å²	119	59.1 Å²	59.1	83%	0.832	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	26.5	-174.9	-55.8	0	0	0	0	114.2	M60 E61	M60-S64 PolarHBondContact O-N 2.86Å; E61-S64 PolarHBondContact O-N 3.26Å
65	A	58.6	Low	77.2	Confident	34 Å²	34	58.5 Å²	58.5	28%	0.281	29%	0.291	S	S	.	.			trans	-105.3	32.7	-161.2	0	0	0	0	0	113.9	M60 N63 A857	M60-A65 HydrophobicContact CB-CB 4.49Å; M60-A65 PolarHBondContact O-N 3.44Å; M60-A65 VanDerWaalsContact O-N 3.13Å; N63-A65 HydrophobicContact CB-CB 4.15Å; N63-A65 PolarHBondContact O-N 2.83Å; A65-A857 HydrophobicContact CB-CB 3.58Å
66	I	66.5	Low	77.1	Confident	27 Å²	27	55.1 Å²	55.1	14%	0.138	28%	0.278	C	S	.	.			trans	-129	133.5	179.3	-60.6	170.2	0	0	0	108.1	L36 L57 M60 E61 Y113	L36-I66 HydrophobicContact CB-CG2 4.23Å; L36-I66 HydrophobicContact CD2-CG2 4.34Å; L57-I66 HydrophobicContact CD1-CD1 3.66Å; L57-I66 HydrophobicContact CD1-CG1 4.32Å; L57-I66 HydrophobicContact CG-CD1 3.89Å; L57-I66 WeakPolarHBondContact O-CD1 3.48Å; M60-I66 HydrophobicContact CB-CD1 4.25Å; M60-I66 HydrophobicContact CB-CG1 4.06Å; E61-I66 HydrophobicContact CB-CD1 3.91Å; I66-Y113 HydrophobicContact CB-CE2 4.42Å; I66-Y113 HydrophobicContact CD1-CD2 4.25Å; I66-Y113 HydrophobicContact CD1-CE2 3.63Å; I66-Y113 HydrophobicContact CG2-CE1 4.33Å; I66-Y113 HydrophobicContact CG2-CE2 4.23Å; I66-Y113 WeakPolarHBondContact CG2-OH 3.45Å
67	W	67.6	Low	76.8	Confident	137 Å²	137	57.8 Å²	57.8	52%	0.519	29%	0.291	S	S	.	.			trans	-125.5	117.3	177.1	-176.6	83.7	0	0	0	109.3	Q69	W67-Q69 HydrophobicContact CE3-CB 3.81Å; W67-Q69 HydrophobicContact CE3-CG 4.39Å; W67-Q69 HydrophobicContact CH2-CB 4.31Å; W67-Q69 HydrophobicContact CH2-CG 4.11Å; W67-Q69 HydrophobicContact CZ3-CB 3.47Å; W67-Q69 VanDerWaalsContact CZ3-CB 3.47Å; W67-Q69 HydrophobicContact CZ3-CG 3.55Å
68	A	76.6	Confident	76.7	Confident	31 Å²	31	64.3 Å²	64.3	26%	0.256	33%	0.326	S	S	.	.			trans	-81.1	126.8	-178.8	0	0	0	0	0	110.7	E34 H35 L36	E34-A68 HydrophobicContact CB-CB 4.05Å; H35-A68 WeakPolarHBondContact O-CA 3.41Å; L36-A68 HydrophobicContact CD2-CB 3.87Å
69	Q	74.1	Confident	77	Confident	3 Å²	3	62.5 Å²	62.5	1%	0.014	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	104.6	-176	-174.6	-173.5	-47.8	0	0	111.1	E34 H35 W67 L71 L840	E34-Q69 CarbonylContact C-O 3.53Å; E34-Q69 VanDerWaalsContact CA-O 3.23Å; E34-Q69 WeakPolarHBondContact CA-O 3.43Å; H35-Q69 HydrophobicContact CB-CB 4.26Å; H35-Q69 PolarHBondContact N-O 3.25Å; H35-Q69 PolarHBondContact O-N 2.9Å; W67-Q69 HydrophobicContact CE3-CB 3.81Å; W67-Q69 HydrophobicContact CE3-CG 4.39Å; W67-Q69 HydrophobicContact CH2-CB 4.31Å; W67-Q69 HydrophobicContact CH2-CG 4.11Å; W67-Q69 HydrophobicContact CZ3-CB 3.47Å; W67-Q69 VanDerWaalsContact CZ3-CB 3.47Å; W67-Q69 HydrophobicContact CZ3-CG 3.55Å; Q69-L71 HydrophobicContact CG-CD1 4.42Å; Q69-L71 HydrophobicContact CG-CG 4.33Å; Q69-L71 PolarHBondContact O-N 2.92Å; Q69-L840 HydrophobicContact CG-CD1 4.23Å; Q69-L840 VanDerWaalsContact NE2-CG 3.3Å
70	P	78	Confident	77.5	Confident	70 Å²	70	57 Å²	57	46%	0.455	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	129.3	177.2	-27	36	0	0	0	113
71	L	85.9	Confident	78.1	Confident	3 Å²	3	56 Å²	56	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	161.8	-174.5	-73.1	172.5	0	0	0	111.3	V33 H35 Q69 V82 V90 L840	V33-L71 HydrophobicContact CG2-CB 4.24Å; V33-L71 PolarHBondContact N-O 3.45Å; V33-L71 PolarHBondContact O-N 3.19Å; H35-L71 HydrophobicContact CB-CD1 3.75Å; Q69-L71 HydrophobicContact CG-CD1 4.42Å; Q69-L71 HydrophobicContact CG-CG 4.33Å; Q69-L71 PolarHBondContact O-N 2.92Å; L71-V82 HydrophobicContact CB-CG1 3.99Å; L71-V82 HydrophobicContact CD1-CG1 3.48Å; L71-V82 VanDerWaalsContact CD1-CG1 3.48Å; L71-V82 HydrophobicContact CD2-CG1 4.05Å; L71-V82 HydrophobicContact CG-CG1 4.03Å; L71-V90 HydrophobicContact CD2-CG2 4.19Å; L71-L840 HydrophobicContact CD2-CD2 3.79Å
72	I	87.1	Confident	78.8	Confident	24 Å²	24	53.7 Å²	53.7	12%	0.123	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118	174.6	-54.9	-179.3	0	0	0	109.1	Y32 E83	Y32-I72 HydrophobicContact CD1-CG1 4.05Å; Y32-I72 HydrophobicContact CE1-CD1 3.84Å; Y32-I72 HydrophobicContact CE1-CG1 3.88Å; I72-E83 HydrophobicContact CB-CB 4.46Å; I72-E83 PolarHBondContact N-O 3.47Å; I72-E83 PolarHBondContact O-N 2.88Å
73	L	90.3	Very high	79.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	114.7	175.5	-164.1	70	0	0	0	109.3	S30 Y31 V33 F75 V80 V82 L117	S30-L73 CarbonylContact C-O 3.01Å; S30-L73 VanDerWaalsContact CA-O 3.3Å; S30-L73 WeakPolarHBondContact CA-O 3.47Å; Y31-L73 PolarHBondContact N-O 3.31Å; Y31-L73 PolarHBondContact O-N 3.23Å; V33-L73 HydrophobicContact CG1-CB 4.36Å; V33-L73 HydrophobicContact CG2-CB 4.04Å; L73-F75 HydrophobicContact CD2-CE1 3.81Å; L73-F75 HydrophobicContact CD2-CZ 4.42Å; L73-F75 HydrophobicContact CG-CE1 3.96Å; L73-V80 HydrophobicContact CD1-CG1 3.42Å; L73-V80 VanDerWaalsContact CD1-CG1 3.42Å; L73-V80 HydrophobicContact CG-CG1 3.82Å; L73-V82 HydrophobicContact CD1-CG2 3.87Å; L73-L117 HydrophobicContact CD2-CD2 3.78Å
74	R	88.1	Confident	80.1	Confident	61 Å²	61	40 Å²	40	23%	0.23	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.2	-175.7	172.4	146.8	66.3	162.5	-9.5	111.7	P29 R76 T81 E83	P29-R74 WeakPolarHBondContact O-CA 3.37Å; R74-R76 HydrophobicContact CG-CG 4.24Å; R74-T81 PolarHBondContact N-O 2.88Å; R74-T81 PolarHBondContact O-N 2.88Å; R74-T81 PolarHBondContact O-OG1 3.47Å; R74-E83 IonicContact CZ-OE1 2.78Å; R74-E83 IonicContact CZ-OE2 3.23Å; R74-E83 VanDerWaalsContact NE-CD 3.34Å; R74-E83 IonicContact NE-OE1 2.72Å; R74-E83 PolarHBondContact NE-OE1 3.27Å; R74-E83 IonicContact NE-OE2 3.64Å; R74-E83 PolarHBondContact NE-OE2 2.97Å; R74-E83 IonicContact NH2-OE1 3.85Å; R74-E83 PolarHBondContact NH2-OE1 3.36Å; R74-E83 IonicContact NH2-OE2 2.76Å; R74-E83 PolarHBondContact NH2-OE2 2.77Å
75	F	89.4	Confident	80.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	110.7	-176.9	-66.5	-4.2	0	0	0	110.8	T28 P29 Y31 L73 V80 V147 D150 L151 Y154	T28-F75 WeakPolarHBondContact CB-O 3.07Å; T28-F75 VanDerWaalsContact CG2-O 3.26Å; T28-F75 WeakPolarHBondContact CG2-O 3.15Å; P29-F75 HydrophobicContact CB-CB 4.24Å; P29-F75 HydrophobicContact CB-CD2 4.38Å; P29-F75 HydrophobicContact CG-CB 4.3Å; P29-F75 PolarHBondContact O-N 3.09Å; Y31-F75 HydrophobicContact CD2-CE1 4.27Å; Y31-F75 HydrophobicContact CD2-CE2 4.33Å; Y31-F75 HydrophobicContact CD2-CZ 4.13Å; Y31-F75 HydrophobicContact CE2-CD1 4.25Å; Y31-F75 AromaticContact CE2-CD2 3.64Å; Y31-F75 HydrophobicContact CE2-CD2 3.64Å; Y31-F75 HydrophobicContact CE2-CE1 4.11Å; Y31-F75 AromaticContact CE2-CE2 3.46Å; Y31-F75 HydrophobicContact CE2-CE2 3.46Å; Y31-F75 VanDerWaalsContact CE2-CE2 3.46Å; Y31-F75 HydrophobicContact CE2-CG 4.03Å; Y31-F75 AromaticContact CE2-CZ 3.7Å; Y31-F75 HydrophobicContact CE2-CZ 3.7Å; Y31-F75 AromaticContact CZ-CE2 3.93Å; L73-F75 HydrophobicContact CD2-CE1 3.81Å; L73-F75 HydrophobicContact CD2-CZ 4.42Å; L73-F75 HydrophobicContact CG-CE1 3.96Å; F75-V80 HydrophobicContact CD1-CB 4.42Å; F75-V80 HydrophobicContact CD1-CG1 3.96Å; F75-V80 HydrophobicContact CD1-CG2 3.77Å; F75-V80 HydrophobicContact CE1-CG1 4.06Å; F75-V80 HydrophobicContact CE1-CG2 4.04Å; F75-V147 HydrophobicContact CE2-CG1 4.42Å; F75-V147 HydrophobicContact CZ-CG1 3.76Å; F75-D150 HydrophobicContact CD2-CB 4.44Å; F75-D150 HydrophobicContact CE2-CB 3.87Å; F75-L151 HydrophobicContact CE1-CD1 4.19Å; F75-L151 HydrophobicContact CE2-CB 3.94Å; F75-L151 HydrophobicContact CE2-CD1 4.47Å; F75-L151 HydrophobicContact CZ-CB 3.74Å; F75-L151 HydrophobicContact CZ-CD1 4.11Å; F75-L151 HydrophobicContact CZ-CD2 4.45Å; F75-L151 HydrophobicContact CZ-CG 4.31Å; F75-Y154 HydrophobicContact CB-CD1 3.81Å; F75-Y154 HydrophobicContact CB-CD2 4.36Å; F75-Y154 HydrophobicContact CB-CE1 3.63Å; F75-Y154 HydrophobicContact CB-CE2 4.21Å; F75-Y154 HydrophobicContact CB-CG 4.18Å; F75-Y154 HydrophobicContact CD2-CD2 4.02Å; F75-Y154 HydrophobicContact CD2-CE2 4.34Å; F75-Y154 HydrophobicContact CD2-CG 4.21Å
76	R	85.3	Confident	81	Confident	73 Å²	73	44.2 Å²	44.2	28%	0.275	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	160.5	177.4	-50.1	-175	-175.5	-127.6	8.6	110.4	R74 N78 A79 T81 E83	R74-R76 HydrophobicContact CG-CG 4.24Å; R76-N78 PolarHBondContact O-N 2.88Å; R76-A79 CarbonylContact C-O 3.54Å; R76-A79 WeakPolarHBondContact CA-O 3.22Å; R76-A79 WeakPolarHBondContact CB-O 3.5Å; R76-A79 PolarHBondContact N-O 2.95Å; R76-A79 PolarHBondContact O-N 3.45Å; R76-T81 PolarHBondContact NE-OG1 3.04Å; R76-E83 IonicContact CZ-OE1 3.19Å; R76-E83 IonicContact NE-OE1 3.15Å; R76-E83 IonicContact NH2-OE1 2.72Å; R76-E83 PolarHBondContact NH2-OE1 3.42Å
77	H	79.1	Confident	80.7	Confident	98 Å²	98	44.8 Å²	44.8	45%	0.454	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-35	-173.3	-63.3	106.9	0	0	0	115.2	F159	H77-F159 VanDerWaalsContact O-CZ 3.3Å; H77-F159 WeakPolarHBondContact O-CZ 3.33Å
78	N	84.4	Confident	81	Confident	139 Å²	139	41.8 Å²	41.8	74%	0.743	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-3.9	-176	-61.8	-4	0	0	0	113.7	R76 L95	R76-N78 PolarHBondContact O-N 2.88Å; N78-L95 WeakPolarHBondContact O-CB 3.27Å; N78-L95 PolarHBondContact O-N 3.28Å
79	A	90	Very high	81.1	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.025	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	152.4	-173.5	0	0	0	0	0	112.6	R76 Q92 F93	R76-A79 CarbonylContact C-O 3.54Å; R76-A79 WeakPolarHBondContact CA-O 3.22Å; R76-A79 WeakPolarHBondContact CB-O 3.5Å; R76-A79 PolarHBondContact N-O 2.95Å; R76-A79 PolarHBondContact O-N 3.45Å; A79-Q92 HydrophobicContact CB-CG 3.76Å; A79-F93 CarbonylContact C-O 3.24Å; A79-F93 WeakPolarHBondContact CA-O 3.42Å; A79-F93 WeakPolarHBondContact CB-O 3.38Å
80	V	91.4	Very high	81.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.8	160.3	175.9	0	0	0	0	108	L73 F75 Q92 F93 L95 I98 L151	L73-V80 HydrophobicContact CD1-CG1 3.42Å; L73-V80 VanDerWaalsContact CD1-CG1 3.42Å; L73-V80 HydrophobicContact CG-CG1 3.82Å; F75-V80 HydrophobicContact CD1-CB 4.42Å; F75-V80 HydrophobicContact CD1-CG1 3.96Å; F75-V80 HydrophobicContact CD1-CG2 3.77Å; F75-V80 HydrophobicContact CE1-CG1 4.06Å; F75-V80 HydrophobicContact CE1-CG2 4.04Å; V80-Q92 WeakPolarHBondContact O-CA 3.41Å; V80-F93 HydrophobicContact CB-CB 4.48Å; V80-F93 HydrophobicContact CB-CD2 4.4Å; V80-F93 HydrophobicContact CG1-CD2 4.35Å; V80-F93 PolarHBondContact N-O 2.96Å; V80-F93 PolarHBondContact O-N 3.43Å; V80-L95 HydrophobicContact CG2-CD1 4.42Å; V80-I98 HydrophobicContact CB-CD1 3.93Å; V80-I98 HydrophobicContact CG2-CD1 3.52Å; V80-L151 HydrophobicContact CG2-CD1 3.55Å
81	T	89.5	Confident	81.6	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.1	173.4	49.7	0	0	0	0	110.5	R74 R76 E83 L89 Q92	R74-T81 PolarHBondContact N-O 2.88Å; R74-T81 PolarHBondContact O-N 2.88Å; R74-T81 PolarHBondContact O-OG1 3.47Å; R76-T81 PolarHBondContact NE-OG1 3.04Å; T81-E83 WeakPolarHBondContact CB-OE1 3.29Å; T81-E83 PolarHBondContact OG1-OE1 3.15Å; T81-L89 HydrophobicContact CG2-CD1 3.55Å; T81-Q92 HydrophobicContact CG2-CB 4.28Å; T81-Q92 HydrophobicContact CG2-CG 3.92Å
82	V	87.9	Confident	81.8	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.6	168.8	-172	0	0	0	0	106.8	L71 L73 V90 E91 F93 F137	L71-V82 HydrophobicContact CB-CG1 3.99Å; L71-V82 HydrophobicContact CD1-CG1 3.48Å; L71-V82 VanDerWaalsContact CD1-CG1 3.48Å; L71-V82 HydrophobicContact CD2-CG1 4.05Å; L71-V82 HydrophobicContact CG-CG1 4.03Å; L73-V82 HydrophobicContact CD1-CG2 3.87Å; V82-V90 WeakPolarHBondContact O-CA 3.46Å; V82-V90 WeakPolarHBondContact O-CB 3.34Å; V82-V90 PolarHBondContact O-N 3.49Å; V82-E91 HydrophobicContact CB-CB 4.06Å; V82-E91 HydrophobicContact CG2-CB 4.2Å; V82-E91 PolarHBondContact N-O 2.87Å; V82-E91 PolarHBondContact O-N 3.02Å; V82-E91 VanDerWaalsContact O-N 3.12Å; V82-F93 HydrophobicContact CG2-CD2 4.24Å; V82-F93 HydrophobicContact CG2-CE2 3.47Å; V82-F93 VanDerWaalsContact CG2-CE2 3.47Å; V82-F93 HydrophobicContact CG2-CZ 4.15Å; V82-F137 HydrophobicContact CG2-CZ 4.44Å
83	E	83.3	Confident	82	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.019	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	153.5	-171.1	-65.3	165.9	-161.3	0	0	109.9	I72 R74 R76 T81 E88 L89	I72-E83 HydrophobicContact CB-CB 4.46Å; I72-E83 PolarHBondContact N-O 3.47Å; I72-E83 PolarHBondContact O-N 2.88Å; R74-E83 IonicContact CZ-OE1 2.78Å; R74-E83 IonicContact CZ-OE2 3.23Å; R74-E83 VanDerWaalsContact NE-CD 3.34Å; R74-E83 IonicContact NE-OE1 2.72Å; R74-E83 PolarHBondContact NE-OE1 3.27Å; R74-E83 IonicContact NE-OE2 3.64Å; R74-E83 PolarHBondContact NE-OE2 2.97Å; R74-E83 IonicContact NH2-OE1 3.85Å; R74-E83 PolarHBondContact NH2-OE1 3.36Å; R74-E83 IonicContact NH2-OE2 2.76Å; R74-E83 PolarHBondContact NH2-OE2 2.77Å; R76-E83 IonicContact CZ-OE1 3.19Å; R76-E83 IonicContact NE-OE1 3.15Å; R76-E83 IonicContact NH2-OE1 2.72Å; R76-E83 PolarHBondContact NH2-OE1 3.42Å; T81-E83 WeakPolarHBondContact CB-OE1 3.29Å; T81-E83 PolarHBondContact OG1-OE1 3.15Å; E83-E88 WeakPolarHBondContact CA-O 3.42Å; E83-L89 HydrophobicContact CG-CD1 4.24Å
84	D	75.1	Confident	82	Confident	11 Å²	11	48.2 Å²	48.2	6%	0.059	25%	0.249	C	C	.	.			trans	-84.6	179	177.4	84.9	-25.7	0	0	0	112.1	N86 G87 E88 V90 L840	D84-N86 PolarHBondContact O-N 2.93Å; D84-N86 VanDerWaalsContact O-N 3.13Å; D84-N86 WeakPolarHBondContact OD1-CA 3.39Å; D84-N86 WeakPolarHBondContact OD1-CB 3.46Å; D84-N86 PolarHBondContact OD1-N 3.12Å; D84-N86 PolarHBondContact OD2-ND2 3.18Å; D84-G87 PolarHBondContact O-N 3.41Å; D84-G87 PolarHBondContact OD1-N 3.41Å; D84-E88 PolarHBondContact N-O 3.33Å; D84-E88 VanDerWaalsContact N-O 3.12Å; D84-E88 PolarHBondContact OD1-N 3.23Å; D84-V90 HydrophobicContact CB-CG2 4.01Å; D84-L840 HydrophobicContact CB-CD2 4.2Å
85	D	67.9	Low	82	Confident	120 Å²	120	46.1 Å²	46.1	64%	0.642	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.1	176.8	-78.3	-27.9	0	0	0	113.8
86	N	62.8	Low	82	Confident	121 Å²	121	51.8 Å²	51.8	65%	0.647	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.4	175.5	-53.8	-75.7	0	0	0	112.6	D84 E88	D84-N86 PolarHBondContact O-N 2.93Å; D84-N86 VanDerWaalsContact O-N 3.13Å; D84-N86 WeakPolarHBondContact OD1-CA 3.39Å; D84-N86 WeakPolarHBondContact OD1-CB 3.46Å; D84-N86 PolarHBondContact OD1-N 3.12Å; D84-N86 PolarHBondContact OD2-ND2 3.18Å; N86-E88 HydrophobicContact CB-CG 4.41Å
87	G	61.8	Low	82.2	Confident	39 Å²	39	49 Å²	49	40%	0.402	26%	0.259	S	S	.	.			trans	82.3	15.7	-174.6	0	0	0	0	0	114.6	D84	D84-G87 PolarHBondContact O-N 3.41Å; D84-G87 PolarHBondContact OD1-N 3.41Å
88	E	72.8	Confident	82.9	Confident	73 Å²	73	44.5 Å²	44.5	34%	0.341	24%	0.238	S	C	.	.			trans	-72.2	142.2	171.2	-60	-159	125.6	0	0	110.4	E83 D84 N86 V90 T836 G837	E83-E88 WeakPolarHBondContact CA-O 3.42Å; D84-E88 PolarHBondContact N-O 3.33Å; D84-E88 VanDerWaalsContact N-O 3.12Å; D84-E88 PolarHBondContact OD1-N 3.23Å; N86-E88 HydrophobicContact CB-CG 4.41Å; E88-V90 PolarHBondContact O-N 3.38Å; E88-T836 PolarHBondContact OE2-OG1 3.32Å; E88-G837 PolarHBondContact OE2-N 2.84Å
89	L	79.3	Confident	83.1	Confident	83 Å²	83	41.3 Å²	41.3	44%	0.435	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	111.2	-178.3	-179.2	64.7	0	0	0	110.9	T81 E83 E91 Q92	T81-L89 HydrophobicContact CG2-CD1 3.55Å; E83-L89 HydrophobicContact CG-CD1 4.24Å; L89-E91 WeakPolarHBondContact CD1-O 3.32Å; L89-Q92 HydrophobicContact CD1-CB 4.45Å
90	V	78.9	Confident	83	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-52.4	-179.5	-177.1	0	0	0	0	110.3	L71 V82 D84 E88 L840 L844	L71-V90 HydrophobicContact CD2-CG2 4.19Å; V82-V90 WeakPolarHBondContact O-CA 3.46Å; V82-V90 WeakPolarHBondContact O-CB 3.34Å; V82-V90 PolarHBondContact O-N 3.49Å; D84-V90 HydrophobicContact CB-CG2 4.01Å; E88-V90 PolarHBondContact O-N 3.38Å; V90-L840 HydrophobicContact CG1-CB 4.49Å; V90-L840 HydrophobicContact CG1-CD2 4.21Å; V90-L840 HydrophobicContact CG1-CG 4.32Å; V90-L840 HydrophobicContact CG2-CD2 3.87Å; V90-L844 HydrophobicContact CG1-CD1 3.49Å; V90-L844 VanDerWaalsContact CG1-CD1 3.49Å
91	E	84.2	Confident	83.1	Confident	27 Å²	27	46 Å²	46	13%	0.126	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	155.6	-178.4	-168.1	157.7	-133	0	0	111.5	V82 L89 F93 R848	V82-E91 HydrophobicContact CB-CB 4.06Å; V82-E91 HydrophobicContact CG2-CB 4.2Å; V82-E91 PolarHBondContact N-O 2.87Å; V82-E91 PolarHBondContact O-N 3.02Å; V82-E91 VanDerWaalsContact O-N 3.12Å; L89-E91 WeakPolarHBondContact CD1-O 3.32Å; E91-F93 HydrophobicContact CB-CZ 4.47Å; E91-F93 HydrophobicContact CG-CD1 4.38Å; E91-F93 HydrophobicContact CG-CE1 3.66Å; E91-F93 HydrophobicContact CG-CZ 3.76Å; E91-F93 VanDerWaalsContact OE2-CZ 3.24Å; E91-F93 WeakPolarHBondContact OE2-CZ 3.44Å; E91-R848 IonicContact OE1-CZ 2.92Å; E91-R848 IonicContact OE1-NH1 3.18Å; E91-R848 PolarHBondContact OE1-NH1 3.08Å; E91-R848 IonicContact OE1-NH2 2.71Å; E91-R848 PolarHBondContact OE1-NH2 2.88Å
92	Q	88.4	Confident	83.3	Confident	109 Å²	109	48 Å²	48	51%	0.509	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	117.9	-178.6	-177.4	175.4	13.3	0	0	111.1	A79 V80 T81 L89 P94	A79-Q92 HydrophobicContact CB-CG 3.76Å; V80-Q92 WeakPolarHBondContact O-CA 3.41Å; T81-Q92 HydrophobicContact CG2-CB 4.28Å; T81-Q92 HydrophobicContact CG2-CG 3.92Å; L89-Q92 HydrophobicContact CD1-CB 4.45Å; Q92-P94 WeakPolarHBondContact O-CD 3.5Å
93	F	91.4	Very high	83.5	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	113.4	177.9	-51.7	-59.1	0	0	0	110	A79 V80 V82 E91 L95 I98 F119 V121 H135 F137	A79-F93 CarbonylContact C-O 3.24Å; A79-F93 WeakPolarHBondContact CA-O 3.42Å; A79-F93 WeakPolarHBondContact CB-O 3.38Å; V80-F93 HydrophobicContact CB-CB 4.48Å; V80-F93 HydrophobicContact CB-CD2 4.4Å; V80-F93 HydrophobicContact CG1-CD2 4.35Å; V80-F93 PolarHBondContact N-O 2.96Å; V80-F93 PolarHBondContact O-N 3.43Å; V82-F93 HydrophobicContact CG2-CD2 4.24Å; V82-F93 HydrophobicContact CG2-CE2 3.47Å; V82-F93 VanDerWaalsContact CG2-CE2 3.47Å; V82-F93 HydrophobicContact CG2-CZ 4.15Å; E91-F93 HydrophobicContact CB-CZ 4.47Å; E91-F93 HydrophobicContact CG-CD1 4.38Å; E91-F93 HydrophobicContact CG-CE1 3.66Å; E91-F93 HydrophobicContact CG-CZ 3.76Å; E91-F93 VanDerWaalsContact OE2-CZ 3.24Å; E91-F93 WeakPolarHBondContact OE2-CZ 3.44Å; F93-L95 PolarHBondContact O-N 2.81Å; F93-I98 HydrophobicContact CB-CD1 3.86Å; F93-I98 HydrophobicContact CB-CG1 4.08Å; F93-F119 AromaticContact CD2-CE2 3.74Å; F93-F119 HydrophobicContact CD2-CE2 3.74Å; F93-F119 AromaticContact CD2-CZ 3.68Å; F93-F119 HydrophobicContact CD2-CZ 3.68Å; F93-F119 AromaticContact CE2-CE2 3.96Å; F93-F119 HydrophobicContact CE2-CE2 3.96Å; F93-F119 AromaticContact CE2-CZ 3.68Å; F93-F119 HydrophobicContact CE2-CZ 3.68Å; F93-F119 HydrophobicContact CG-CE2 4.14Å; F93-V121 HydrophobicContact CB-CG2 4.23Å; F93-V121 HydrophobicContact CD1-CG1 4.36Å; F93-V121 HydrophobicContact CD1-CG2 3.75Å; F93-V121 HydrophobicContact CE1-CG2 4.33Å; F93-V121 HydrophobicContact CG-CG2 4.03Å; F93-H135 AromaticContact CE1-CE1 3.36Å; F93-H135 WeakPolarHBondContact CE1-CE1 3.34Å; F93-H135 AromaticContact CE1-ND1 3.82Å; F93-H135 AromaticContact CE1-NE2 3.47Å; F93-H135 WeakPolarHBondContact CE1-NE2 3.49Å; F93-H135 AromaticContact CZ-CE1 3.64Å; F93-H135 AromaticContact CZ-CG 3.92Å; F93-H135 AromaticContact CZ-ND1 3.59Å; F93-H135 AromaticContact CZ-NE2 3.96Å; F93-F137 HydrophobicContact CE2-CZ 4.45Å
94	P	90.5	Very high	83.9	Confident	35 Å²	35	51.4 Å²	51.4	23%	0.227	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	130.5	174.2	-22.8	34	0	0	0	110.7	Q92 E96 L97	Q92-P94 WeakPolarHBondContact O-CD 3.5Å; P94-E96 HydrophobicContact CB-CG 4.3Å; P94-E96 PolarHBondContact O-N 2.98Å; P94-E96 VanDerWaalsContact O-N 3.13Å; P94-L97 HydrophobicContact CB-CD1 4.03Å; P94-L97 HydrophobicContact CB-CG 4.17Å; P94-L97 HydrophobicContact CG-CD1 3.87Å; P94-L97 PolarHBondContact O-N 3.32Å
95	L	88.8	Confident	84.5	Confident	17 Å²	17	54.4 Å²	54.4	9%	0.089	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.3	-170.7	-166.9	60.4	0	0	0	112.8	N78 V80 F93 L97 I98 L151 Y154 V155 F159	N78-L95 WeakPolarHBondContact O-CB 3.27Å; N78-L95 PolarHBondContact O-N 3.28Å; V80-L95 HydrophobicContact CG2-CD1 4.42Å; F93-L95 PolarHBondContact O-N 2.81Å; L95-L97 VanDerWaalsContact C-N 3.26Å; L95-L97 PolarHBondContact O-N 3.22Å; L95-I98 HydrophobicContact CD1-CD1 4.15Å; L95-L151 HydrophobicContact CD1-CD1 4.36Å; L95-Y154 HydrophobicContact CD2-CD1 4.34Å; L95-Y154 WeakPolarHBondContact CD2-O 3.35Å; L95-V155 HydrophobicContact CD1-CB 4.45Å; L95-V155 HydrophobicContact CD1-CG2 3.6Å; L95-V155 HydrophobicContact CG-CG2 4.34Å; L95-F159 HydrophobicContact CD2-CE1 3.96Å; L95-F159 HydrophobicContact CD2-CZ 4.33Å
96	E	88.6	Confident	85	Confident	118 Å²	118	49.8 Å²	49.8	55%	0.551	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-12.3	172.6	66.2	176.2	-175.7	0	0	114.4	P94 R122 K126	P94-E96 HydrophobicContact CB-CG 4.3Å; P94-E96 PolarHBondContact O-N 2.98Å; P94-E96 VanDerWaalsContact O-N 3.13Å; E96-R122 PolarHBondContact O-NH2 3.02Å; E96-K126 IonicContact OE1-NZ 2.64Å; E96-K126 PolarHBondContact OE1-NZ 2.72Å; E96-K126 IonicContact OE2-NZ 3.64Å
97	L	91	Very high	85.2	Confident	15 Å²	15	52 Å²	52	8%	0.079	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-15	-179.4	-58.3	178	0	0	0	113.2	P94 L95 V121 R122 D124	P94-L97 HydrophobicContact CB-CD1 4.03Å; P94-L97 HydrophobicContact CB-CG 4.17Å; P94-L97 HydrophobicContact CG-CD1 3.87Å; P94-L97 PolarHBondContact O-N 3.32Å; L95-L97 VanDerWaalsContact C-N 3.26Å; L95-L97 PolarHBondContact O-N 3.22Å; L97-V121 HydrophobicContact CB-CG1 4.07Å; L97-V121 WeakPolarHBondContact O-CA 3.48Å; L97-R122 HydrophobicContact CD2-CB 4.45Å; L97-R122 PolarHBondContact O-N 2.93Å; L97-D124 HydrophobicContact CD1-CB 3.72Å
98	I	92.9	Very high	85.6	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.7	-179.1	-58.1	179.9	0	0	0	110.3	V80 F93 L95 P101 F119 V120 V121 L151 V155	V80-I98 HydrophobicContact CB-CD1 3.93Å; V80-I98 HydrophobicContact CG2-CD1 3.52Å; F93-I98 HydrophobicContact CB-CD1 3.86Å; F93-I98 HydrophobicContact CB-CG1 4.08Å; L95-I98 HydrophobicContact CD1-CD1 4.15Å; I98-P101 HydrophobicContact CG2-CG 4.3Å; I98-F119 HydrophobicContact CG2-CB 4.06Å; I98-F119 HydrophobicContact CG2-CD2 3.93Å; I98-F119 HydrophobicContact CG2-CG 4.15Å; I98-V120 CarbonylContact C-O 3.44Å; I98-V120 WeakPolarHBondContact CA-O 3.29Å; I98-V121 HydrophobicContact CG1-CG2 4.39Å; I98-L151 HydrophobicContact CD1-CD1 4.3Å; I98-L151 HydrophobicContact CG2-CD1 4.48Å; I98-L151 HydrophobicContact CG2-CD2 4.29Å; I98-L151 HydrophobicContact CG2-CG 4.45Å; I98-V155 HydrophobicContact CB-CG2 4.07Å; I98-V155 HydrophobicContact CG2-CG2 4.06Å
99	E	89	Confident	85	Confident	73 Å²	73	56 Å²	56	34%	0.341	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160.1	175.6	-67.5	-169.3	169	0	0	111.5	P101 V120 R122	E99-P101 VanDerWaalsContact C-CD 3.45Å; E99-V120 PolarHBondContact N-O 3.43Å; E99-V120 PolarHBondContact O-N 3.36Å; E99-R122 HydrophobicContact CG-CG 4.36Å; E99-R122 VanDerWaalsContact OE1-CD 3.24Å; E99-R122 WeakPolarHBondContact OE1-CD 3.42Å; E99-R122 IonicContact OE1-CZ 2.84Å; E99-R122 IonicContact OE1-NE 2.73Å; E99-R122 PolarHBondContact OE1-NE 2.88Å; E99-R122 VanDerWaalsContact OE1-NE 3.15Å; E99-R122 IonicContact OE1-NH1 2.85Å; E99-R122 PolarHBondContact OE1-NH1 3.37Å; E99-R122 IonicContact OE1-NH2 2.58Å
100	Q	87.3	Confident	84.2	Confident	87 Å²	87	62.1 Å²	62.1	41%	0.407	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50	46.3	174.7	-53	-177.2	1.7	0	0	117.4	P50 T102	P50-Q100 VanDerWaalsContact CD-OE1 3.3Å; P50-Q100 HydrophobicContact CG-CB 4.21Å; Q100-T102 PolarHBondContact O-N 3.11Å; Q100-T102 VanDerWaalsContact O-N 3.1Å; Q100-T102 PolarHBondContact O-OG1 2.85Å
101	P	93.9	Very high	83.8	Confident	13 Å²	13	64.5 Å²	64.5	8%	0.084	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	120.6	171.5	-20.3	32.4	0	0	0	111.2	I98 E99 F119 L151 K152	I98-P101 HydrophobicContact CG2-CG 4.3Å; E99-P101 VanDerWaalsContact C-CD 3.45Å; P101-F119 HydrophobicContact CB-CB 4.48Å; P101-L151 HydrophobicContact CB-CB 4.13Å; P101-L151 HydrophobicContact CB-CD2 4.01Å; P101-L151 HydrophobicContact CB-CG 4.01Å; P101-L151 HydrophobicContact CG-CB 4.3Å; P101-L151 HydrophobicContact CG-CD2 4.06Å; P101-L151 HydrophobicContact CG-CG 3.79Å; P101-K152 HydrophobicContact CB-CG 4.13Å; P101-K152 HydrophobicContact CG-CG 4.17Å; P101-K152 WeakPolarHBondContact O-CE 3.46Å
102	T	92.8	Very high	83.1	Confident	45 Å²	45	67.9 Å²	67.9	28%	0.276	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.4	-169.5	-56.6	0	0	0	0	109.3	P50 Q100 L118	P50-T102 HydrophobicContact CB-CG2 3.91Å; P50-T102 HydrophobicContact CG-CG2 4.48Å; P50-T102 WeakPolarHBondContact CG-OG1 3.13Å; Q100-T102 PolarHBondContact O-N 3.11Å; Q100-T102 VanDerWaalsContact O-N 3.1Å; Q100-T102 PolarHBondContact O-OG1 2.85Å; T102-L118 HydrophobicContact CG2-CD2 4.43Å; T102-L118 PolarHBondContact N-O 3.24Å; T102-L118 PolarHBondContact O-N 2.68Å
103	A	93.8	Very high	82.5	Confident	31 Å²	31	64.4 Å²	64.4	26%	0.256	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	141.9	171	0	0	0	0	0	109.5	V116 A144 A148	A103-V116 CarbonylContact C-O 3.52Å; A103-V116 WeakPolarHBondContact CA-O 3.43Å; A103-A144 HydrophobicContact CB-CB 4.04Å; A103-A148 HydrophobicContact CB-CB 4.16Å
104	H	90.8	Very high	82	Confident	46 Å²	46	66.6 Å²	66.6	21%	0.213	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.9	166.4	-177.8	62.7	0	0	0	109.1	I54 K58 N115 V116	I54-H104 HydrophobicContact CD1-CB 3.65Å; I54-H104 HydrophobicContact CG1-CB 3.9Å; K58-H104 PolarHBondContact NZ-NE2 2.84Å; H104-N115 PolarHBondContact O-N 2.85Å; H104-V116 HydrophobicContact CB-CB 4.38Å; H104-V116 PolarHBondContact N-O 3.38Å; H104-V116 PolarHBondContact O-N 3.2Å
105	V	87.8	Confident	82	Confident	75 Å²	75	66.6 Å²	66.6	46%	0.455	35%	0.35	S	S	.	.			trans	-120.8	142.6	173	-174.8	0	0	0	0	107.1	N114	V105-N114 WeakPolarHBondContact CA-OD1 3.36Å
106	S	78.6	Confident	82.2	Confident	23 Å²	23	65.8 Å²	65.8	16%	0.161	35%	0.346	C	S	.	.			trans	-130.4	151.1	-176.9	-168.5	0	0	0	0	110.6	D108 E111 N114	S106-D108 PolarHBondContact OG-N 2.93Å; S106-E111 WeakPolarHBondContact CB-OE2 3.39Å; S106-E111 PolarHBondContact OG-OE2 3.43Å; S106-N114 PolarHBondContact N-OD1 3.04Å; S106-N114 PolarHBondContact O-ND2 2.96Å; S106-N114 PolarHBondContact O-OD1 2.87Å
107	N	67.1	Low	82.5	Confident	167 Å²	167	60.2 Å²	60.2	89%	0.893	32%	0.319	S	S	*	.	S	Bend	trans	-104	0.6	177.5	-64.3	0.8	0	0	0	112.2
108	D	70	Confident	82.7	Confident	71 Å²	71	59.6 Å²	59.6	38%	0.38	32%	0.316	S	S	.	.			trans	-89.2	117.6	173.6	-170	-13.8	0	0	0	109.8	S106 R110 E111	S106-D108 PolarHBondContact OG-N 2.93Å; D108-R110 PolarHBondContact O-N 2.91Å; D108-R110 VanDerWaalsContact O-N 3.14Å; D108-R110 VanDerWaalsContact OD1-CB 3.26Å; D108-R110 WeakPolarHBondContact OD1-CB 3.25Å; D108-R110 WeakPolarHBondContact OD1-CG 3.4Å; D108-R110 PolarHBondContact OD1-N 2.98Å; D108-E111 HydrophobicContact CB-CG 4.26Å; D108-E111 PolarHBondContact O-N 3.23Å
109	S	60	Low	82.8	Confident	124 Å²	124	59.5 Å²	59.5	87%	0.867	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-0.4	178.5	56.1	0	0	0	0	114.1
110	R	62.1	Low	82.9	Confident	213 Å²	213	56.5 Å²	56.5	80%	0.804	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-5.9	175.8	-60.6	168.8	173.6	167.2	-0.9	114	D108	D108-R110 PolarHBondContact O-N 2.91Å; D108-R110 VanDerWaalsContact O-N 3.14Å; D108-R110 VanDerWaalsContact OD1-CB 3.26Å; D108-R110 WeakPolarHBondContact OD1-CB 3.25Å; D108-R110 WeakPolarHBondContact OD1-CG 3.4Å; D108-R110 PolarHBondContact OD1-N 2.98Å
111	E	71	Confident	83.1	Confident	56 Å²	56	53 Å²	53	26%	0.262	29%	0.287	S	S	.	.			trans	-91.2	113.8	178.7	-61.7	-165.8	137.3	0	0	110.7	K58 S106 D108 Y113	K58-E111 WeakPolarHBondContact CE-OE1 3.43Å; K58-E111 IonicContact NZ-OE1 3.83Å; K58-E111 PolarHBondContact NZ-OE1 2.99Å; K58-E111 IonicContact NZ-OE2 2.67Å; K58-E111 PolarHBondContact NZ-OE2 2.94Å; S106-E111 WeakPolarHBondContact CB-OE2 3.39Å; S106-E111 PolarHBondContact OG-OE2 3.43Å; D108-E111 HydrophobicContact CB-CG 4.26Å; D108-E111 PolarHBondContact O-N 3.23Å; E111-Y113 PolarHBondContact O-N 3.33Å
112	T	68.4	Low	82.8	Confident	99 Å²	99	57.3 Å²	57.3	61%	0.607	30%	0.302	S	S	*	.	S	Bend	trans	-61.7	-31.2	-174.6	-42.2	0	0	0	0	112.8	E61	E61-T112 WeakPolarHBondContact OE1-CB 3.36Å; E61-T112 PolarHBondContact OE1-OG1 3.43Å
113	Y	77.4	Confident	82.3	Confident	36 Å²	36	59.5 Å²	59.5	14%	0.141	31%	0.309	C	S	.	.			trans	-111.5	101.3	179.7	-56.9	-69	0	0	0	110.6	L36 L57 E61 I66 E111	L36-Y113 HydrophobicContact CD1-CD1 3.54Å; L36-Y113 HydrophobicContact CD1-CE1 4.1Å; L36-Y113 HydrophobicContact CD1-CG 4.01Å; L36-Y113 HydrophobicContact CD2-CD1 3.89Å; L36-Y113 HydrophobicContact CD2-CE1 3.63Å; L36-Y113 HydrophobicContact CG-CD1 4.38Å; L36-Y113 HydrophobicContact CG-CE1 4.5Å; L57-Y113 HydrophobicContact CD2-CD2 4.46Å; L57-Y113 HydrophobicContact CD2-CG 4.4Å; E61-Y113 HydrophobicContact CB-CE2 4.37Å; E61-Y113 HydrophobicContact CG-CD2 4.41Å; E61-Y113 HydrophobicContact CG-CE2 4.05Å; I66-Y113 HydrophobicContact CB-CE2 4.42Å; I66-Y113 HydrophobicContact CD1-CD2 4.25Å; I66-Y113 HydrophobicContact CD1-CE2 3.63Å; I66-Y113 HydrophobicContact CG2-CE1 4.33Å; I66-Y113 HydrophobicContact CG2-CE2 4.23Å; I66-Y113 WeakPolarHBondContact CG2-OH 3.45Å; E111-Y113 PolarHBondContact O-N 3.33Å
114	N	81.1	Confident	81.6	Confident	51 Å²	51	58.6 Å²	58.6	27%	0.273	30%	0.3	S	S	.	.			trans	-135.9	148.1	-179.7	-174.6	7.2	0	0	0	108.4	V105 S106 Q138	V105-N114 WeakPolarHBondContact CA-OD1 3.36Å; S106-N114 PolarHBondContact N-OD1 3.04Å; S106-N114 PolarHBondContact O-ND2 2.96Å; S106-N114 PolarHBondContact O-OD1 2.87Å; N114-Q138 PolarHBondContact O-NE2 3.27Å; N114-Q138 PolarHBondContact O-OE1 3.02Å
115	N	89.5	Confident	80.4	Confident	36 Å²	36	67 Å²	67	19%	0.193	33%	0.329	C	S	.	.	S	Bend	trans	67.9	48.5	-166.4	-163.6	48.5	0	0	0	112.7	H104 Q138 C139 V142 S143 A144	H104-N115 PolarHBondContact O-N 2.85Å; N115-Q138 PolarHBondContact O-NE2 3.41Å; N115-C139 WeakPolarHBondContact ND2-CB 3.44Å; N115-C139 PolarHBondContact ND2-O 3.31Å; N115-C139 WeakPolarHBondContact O-CB 3.22Å; N115-C139 PolarHBondContact O-N 3.04Å; N115-V142 PolarHBondContact ND2-O 2.99Å; N115-S143 WeakPolarHBondContact OD1-CA 3.49Å; N115-A144 PolarHBondContact OD1-N 3.02Å
116	V	92.9	Very high	79.2	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.3	-175.6	177.3	0	0	0	0	111.1	L36 I54 A103 H104 I136 F137 A144	L36-V116 HydrophobicContact CD1-CG2 4.39Å; I54-V116 HydrophobicContact CD1-CB 4.48Å; I54-V116 HydrophobicContact CD1-CG1 4Å; A103-V116 CarbonylContact C-O 3.52Å; A103-V116 WeakPolarHBondContact CA-O 3.43Å; H104-V116 HydrophobicContact CB-CB 4.38Å; H104-V116 PolarHBondContact N-O 3.38Å; H104-V116 PolarHBondContact O-N 3.2Å; V116-I136 HydrophobicContact CG1-CG2 3.44Å; V116-I136 VanDerWaalsContact CG1-CG2 3.44Å; V116-F137 CarbonylContact C-O 3.55Å; V116-F137 WeakPolarHBondContact CA-O 3.44Å; V116-A144 WeakPolarHBondContact O-CB 3.5Å
117	L	94.9	Very high	78.3	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140	168.6	172.4	69.3	0	0	0	109.7	L73 F137 A144 V147 A148	L73-L117 HydrophobicContact CD2-CD2 3.78Å; L117-F137 HydrophobicContact CB-CB 4.5Å; L117-F137 PolarHBondContact N-O 2.95Å; L117-F137 PolarHBondContact O-N 3.33Å; L117-A144 HydrophobicContact CB-CB 4.26Å; L117-V147 HydrophobicContact CD2-CB 4.25Å; L117-V147 HydrophobicContact CD2-CG1 3.66Å; L117-A148 HydrophobicContact CD1-CB 3.74Å
118	L	94.9	Very high	77.6	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153.1	165.1	63.7	161	0	0	0	112.7	P50 I54 T102 M134 H135 I136	P50-L118 HydrophobicContact CB-CD1 3.85Å; P50-L118 HydrophobicContact CB-CG 4.35Å; I54-L118 HydrophobicContact CD1-CD2 3.92Å; I54-L118 HydrophobicContact CG1-CD1 4.48Å; I54-L118 HydrophobicContact CG1-CD2 4.15Å; T102-L118 HydrophobicContact CG2-CD2 4.43Å; T102-L118 PolarHBondContact N-O 3.24Å; T102-L118 PolarHBondContact O-N 2.68Å; L118-M134 HydrophobicContact CD1-CG 4.15Å; L118-M134 HydrophobicContact CD1-SD 3.67Å; L118-H135 WeakPolarHBondContact CA-O 3.26Å; L118-H135 VanDerWaalsContact CB-O 3.3Å; L118-H135 WeakPolarHBondContact CB-O 3.3Å; L118-I136 HydrophobicContact CB-CB 4.45Å; L118-I136 HydrophobicContact CB-CG1 4.02Å; L118-I136 HydrophobicContact CD1-CG1 4.46Å
119	F	94.8	Very high	77	Confident	1 Å²	1	79.4 Å²	79.4	0%	0.004	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	159.1	172.6	55.5	-93.9	0	0	0	110.4	F93 I98 P101 V121 M134 H135 F137 L151	F93-F119 AromaticContact CD2-CE2 3.74Å; F93-F119 HydrophobicContact CD2-CE2 3.74Å; F93-F119 AromaticContact CD2-CZ 3.68Å; F93-F119 HydrophobicContact CD2-CZ 3.68Å; F93-F119 AromaticContact CE2-CE2 3.96Å; F93-F119 HydrophobicContact CE2-CE2 3.96Å; F93-F119 AromaticContact CE2-CZ 3.68Å; F93-F119 HydrophobicContact CE2-CZ 3.68Å; F93-F119 HydrophobicContact CG-CE2 4.14Å; I98-F119 HydrophobicContact CG2-CB 4.06Å; I98-F119 HydrophobicContact CG2-CD2 3.93Å; I98-F119 HydrophobicContact CG2-CG 4.15Å; P101-F119 HydrophobicContact CB-CB 4.48Å; F119-V121 HydrophobicContact CD2-CG2 3.82Å; F119-V121 HydrophobicContact CE2-CG2 3.69Å; F119-M134 WeakPolarHBondContact O-CA 3.38Å; F119-H135 HydrophobicContact CE2-CB 4.26Å; F119-H135 HydrophobicContact CZ-CB 4.29Å; F119-H135 PolarHBondContact N-O 2.66Å; F119-H135 PolarHBondContact O-N 2.84Å; F119-F137 HydrophobicContact CE1-CD2 4.01Å; F119-F137 AromaticContact CE1-CE2 3.58Å; F119-F137 HydrophobicContact CE1-CE2 3.58Å; F119-F137 AromaticContact CZ-CE2 3.7Å; F119-F137 HydrophobicContact CZ-CE2 3.7Å; F119-F137 HydrophobicContact CZ-CZ 4.43Å; F119-L151 HydrophobicContact CB-CD2 4.31Å; F119-L151 HydrophobicContact CD1-CD2 3.66Å; F119-L151 HydrophobicContact CE1-CD2 4.16Å; F119-L151 HydrophobicContact CG-CD2 4.05Å
120	V	91.9	Very high	77.1	Confident	10 Å²	10	75.8 Å²	75.8	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	138.3	176.4	178	0	0	0	0	108.9	V41 I98 E99 T132 E133 M134	V41-V120 HydrophobicContact CG2-CG1 4.34Å; I98-V120 CarbonylContact C-O 3.44Å; I98-V120 WeakPolarHBondContact CA-O 3.29Å; E99-V120 PolarHBondContact N-O 3.43Å; E99-V120 PolarHBondContact O-N 3.36Å; V120-T132 HydrophobicContact CG1-CG2 3.53Å; V120-E133 CarbonylContact C-O 3.55Å; V120-E133 VanDerWaalsContact CA-O 3.25Å; V120-E133 WeakPolarHBondContact CA-O 3.22Å; V120-M134 HydrophobicContact CG2-CB 4.38Å; V120-M134 HydrophobicContact CG2-CE 3.95Å; V120-M134 HydrophobicContact CG2-CG 4.45Å
121	V	90.9	Very high	77.7	Confident	15 Å²	15	67.6 Å²	67.6	9%	0.091	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.2	171.7	179.8	0	0	0	0	107.7	F93 L97 I98 F119 T132 E133	F93-V121 HydrophobicContact CB-CG2 4.23Å; F93-V121 HydrophobicContact CD1-CG1 4.36Å; F93-V121 HydrophobicContact CD1-CG2 3.75Å; F93-V121 HydrophobicContact CE1-CG2 4.33Å; F93-V121 HydrophobicContact CG-CG2 4.03Å; L97-V121 HydrophobicContact CB-CG1 4.07Å; L97-V121 WeakPolarHBondContact O-CA 3.48Å; I98-V121 HydrophobicContact CG1-CG2 4.39Å; F119-V121 HydrophobicContact CD2-CG2 3.82Å; F119-V121 HydrophobicContact CE2-CG2 3.69Å; V121-T132 CarbonylContact O-C 3.54Å; V121-T132 VanDerWaalsContact O-CA 3.31Å; V121-T132 WeakPolarHBondContact O-CA 3.48Å; V121-T132 WeakPolarHBondContact O-CG2 3.47Å; V121-E133 PolarHBondContact N-O 2.92Å; V121-E133 PolarHBondContact O-N 3.36Å
122	R	88.6	Confident	78.5	Confident	103 Å²	103	67 Å²	67	39%	0.389	32%	0.324	S	S	.	.			trans	-75.8	152.8	177.6	-64.7	-176.9	-62.7	178.5	11.6	112.4	E96 L97 E99 D124	E96-R122 PolarHBondContact O-NH2 3.02Å; L97-R122 HydrophobicContact CD2-CB 4.45Å; L97-R122 PolarHBondContact O-N 2.93Å; E99-R122 HydrophobicContact CG-CG 4.36Å; E99-R122 VanDerWaalsContact OE1-CD 3.24Å; E99-R122 WeakPolarHBondContact OE1-CD 3.42Å; E99-R122 IonicContact OE1-CZ 2.84Å; E99-R122 IonicContact OE1-NE 2.73Å; E99-R122 PolarHBondContact OE1-NE 2.88Å; E99-R122 VanDerWaalsContact OE1-NE 3.15Å; E99-R122 IonicContact OE1-NH1 2.85Å; E99-R122 PolarHBondContact OE1-NH1 3.37Å; E99-R122 IonicContact OE1-NH2 2.58Å; R122-D124 PolarHBondContact O-N 2.87Å
123	E	82.5	Confident	79.4	Confident	90 Å²	90	62.7 Å²	62.7	42%	0.421	30%	0.297	S	S	.	.			trans	-47	122.3	166.9	169.7	175.6	-141.5	0	0	112.2	R125 T130 T132	E123-R125 PolarHBondContact O-N 3.24Å; E123-R125 VanDerWaalsContact O-N 3.13Å; E123-T130 WeakPolarHBondContact CA-O 3.32Å; E123-T130 WeakPolarHBondContact CB-O 3.44Å; E123-T130 VanDerWaalsContact CG-O 3.26Å; E123-T130 WeakPolarHBondContact CG-O 3.35Å; E123-T132 PolarHBondContact N-OG1 3.13Å
124	D	77.8	Confident	80	Confident	13 Å²	13	61 Å²	61	7%	0.07	29%	0.29	C	S	.	.			trans	-73.9	99.6	169.4	-176.6	-1.8	0	0	0	109.2	L97 R122 K126 R127 T130	L97-D124 HydrophobicContact CD1-CB 3.72Å; R122-D124 PolarHBondContact O-N 2.87Å; D124-K126 PolarHBondContact O-N 3.49Å; D124-K126 WeakPolarHBondContact OD1-CB 3.45Å; D124-K126 WeakPolarHBondContact OD1-CD 3.33Å; D124-K126 WeakPolarHBondContact OD1-CG 3.28Å; D124-K126 PolarHBondContact OD1-N 2.83Å; D124-R127 HydrophobicContact CB-CB 4.2Å; D124-R127 HydrophobicContact CB-CG 4.43Å; D124-R127 CarbonylContact O-C 3.5Å; D124-R127 VanDerWaalsContact O-C 3.22Å; D124-R127 WeakPolarHBondContact O-CA 3.48Å; D124-R127 PolarHBondContact O-N 2.72Å; D124-R127 WeakPolarHBondContact OD2-CD 3.43Å; D124-R127 WeakPolarHBondContact OD2-CG 3.48Å; D124-R127 IonicContact OD2-CZ 3.64Å; D124-R127 IonicContact OD2-NE 2.85Å; D124-R127 PolarHBondContact OD2-NE 2.97Å; D124-T130 PolarHBondContact N-OG1 3.34Å
125	R	65.5	Low	80.5	Confident	221 Å²	221	58.6 Å²	58.6	83%	0.834	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-10.5	177.1	-67.3	-176.1	176.5	-179.7	-0.7	114.7	E123	E123-R125 PolarHBondContact O-N 3.24Å; E123-R125 VanDerWaalsContact O-N 3.13Å
126	K	62.8	Low	80.7	Confident	152 Å²	152	56.9 Å²	56.9	66%	0.661	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-18.9	172.6	-50.8	155.6	-169.4	164.5	0	111.6	E96 D124	E96-K126 IonicContact OE1-NZ 2.64Å; E96-K126 PolarHBondContact OE1-NZ 2.72Å; E96-K126 IonicContact OE2-NZ 3.64Å; D124-K126 PolarHBondContact O-N 3.49Å; D124-K126 WeakPolarHBondContact OD1-CB 3.45Å; D124-K126 WeakPolarHBondContact OD1-CD 3.33Å; D124-K126 WeakPolarHBondContact OD1-CG 3.28Å; D124-K126 PolarHBondContact OD1-N 2.83Å
127	R	60.1	Low	80.7	Confident	163 Å²	163	57 Å²	57	62%	0.615	27%	0.268	S	S	*	.	S	Bend	trans	-123.2	90.9	177.5	-57.9	177.7	-149.8	-129.8	3.6	109.2	D124 S129	D124-R127 HydrophobicContact CB-CB 4.2Å; D124-R127 HydrophobicContact CB-CG 4.43Å; D124-R127 CarbonylContact O-C 3.5Å; D124-R127 VanDerWaalsContact O-C 3.22Å; D124-R127 WeakPolarHBondContact O-CA 3.48Å; D124-R127 PolarHBondContact O-N 2.72Å; D124-R127 WeakPolarHBondContact OD2-CD 3.43Å; D124-R127 WeakPolarHBondContact OD2-CG 3.48Å; D124-R127 IonicContact OD2-CZ 3.64Å; D124-R127 IonicContact OD2-NE 2.85Å; D124-R127 PolarHBondContact OD2-NE 2.97Å; R127-S129 PolarHBondContact O-N 3.13Å
128	M	51.9	Low	80.5	Confident	179 Å²	179	58.1 Å²	58.1	88%	0.882	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	34.2	-167.1	-124.2	178.6	-61	0	0	116.7
129	S	58.1	Low	80.2	Confident	104 Å²	104	58.2 Å²	58.2	73%	0.727	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.6	17.5	-168.3	-169.2	0	0	0	0	114.5	R127	R127-S129 PolarHBondContact O-N 3.13Å
130	T	62.3	Low	79.4	Confident	48 Å²	48	62 Å²	62	29%	0.294	29%	0.294	S	S	.	.			trans	-117.8	115.4	177.4	50.4	0	0	0	0	109.9	E123 D124	E123-T130 WeakPolarHBondContact CA-O 3.32Å; E123-T130 WeakPolarHBondContact CB-O 3.44Å; E123-T130 VanDerWaalsContact CG-O 3.26Å; E123-T130 WeakPolarHBondContact CG-O 3.35Å; D124-T130 PolarHBondContact N-OG1 3.34Å
131	P	75	Confident	78.4	Confident	40 Å²	40	69 Å²	69	26%	0.26	32%	0.319	S	S	.	.			trans	-67.1	172.3	177.4	29.8	-35	0	0	0	111.6	E133 E852	P131-E133 HydrophobicContact CG-CG 4.15Å; P131-E852 WeakPolarHBondContact CD-OE1 3.3Å; P131-E852 HydrophobicContact CG-CG 4.09Å
132	T	86.3	Confident	77.8	Confident	43 Å²	43	69.1 Å²	69.1	26%	0.264	32%	0.32	S	S	.	.			trans	-78.5	123.4	167.3	-60.9	0	0	0	0	108.8	V41 V120 V121 E123	V41-T132 HydrophobicContact CB-CG2 3.93Å; V41-T132 HydrophobicContact CG1-CG2 4.36Å; V41-T132 HydrophobicContact CG2-CG2 4.4Å; V41-T132 PolarHBondContact N-O 3.27Å; V120-T132 HydrophobicContact CG1-CG2 3.53Å; V121-T132 CarbonylContact O-C 3.54Å; V121-T132 VanDerWaalsContact O-CA 3.31Å; V121-T132 WeakPolarHBondContact O-CA 3.48Å; V121-T132 WeakPolarHBondContact O-CG2 3.47Å; E123-T132 PolarHBondContact N-OG1 3.13Å
133	E	88.6	Confident	77.7	Confident	9 Å²	9	66.2 Å²	66.2	4%	0.042	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	150.7	-171.3	-73.2	173.8	-153.2	0	0	111.5	T38 F39 V120 V121 P131 H135 R848	T38-E133 HydrophobicContact CG2-CB 3.95Å; T38-E133 HydrophobicContact CG2-CG 4.13Å; T38-E133 WeakPolarHBondContact CG2-OE2 3.45Å; F39-E133 CarbonylContact O-C 3.54Å; F39-E133 WeakPolarHBondContact O-CA 3.28Å; V120-E133 CarbonylContact C-O 3.55Å; V120-E133 VanDerWaalsContact CA-O 3.25Å; V120-E133 WeakPolarHBondContact CA-O 3.22Å; V121-E133 PolarHBondContact N-O 2.92Å; V121-E133 PolarHBondContact O-N 3.36Å; P131-E133 HydrophobicContact CG-CG 4.15Å; E133-H135 WeakPolarHBondContact CB-NE2 3.43Å; E133-H135 IonicContact OE2-CE1 2.77Å; E133-H135 PolarHBondContact OE2-CE1 2.96Å; E133-H135 IonicContact OE2-NE2 3.65Å; E133-R848 IonicContact OE1-CZ 3.66Å; E133-R848 IonicContact OE1-NE 2.84Å; E133-R848 PolarHBondContact OE1-NE 2.81Å; E133-R848 IonicContact OE1-NH2 3.85Å; E133-R848 IonicContact OE2-CZ 2.67Å; E133-R848 IonicContact OE2-NE 2.73Å; E133-R848 PolarHBondContact OE2-NE 2.91Å; E133-R848 IonicContact OE2-NH2 2.69Å; E133-R848 PolarHBondContact OE2-NH2 3.13Å
134	M	90.3	Very high	78	Confident	1 Å²	1	62 Å²	62	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.7	171.2	177.3	-177.4	-66.3	0	0	108.3	T38 F39 V41 L118 F119 V120 I136	T38-M134 CarbonylContact C-O 3.59Å; T38-M134 VanDerWaalsContact CA-O 3.29Å; T38-M134 WeakPolarHBondContact CA-O 3.03Å; F39-M134 PolarHBondContact N-O 3.09Å; F39-M134 PolarHBondContact O-N 3.2Å; V41-M134 HydrophobicContact CG2-CB 3.53Å; V41-M134 HydrophobicContact CG2-CE 4.38Å; L118-M134 HydrophobicContact CD1-CG 4.15Å; L118-M134 HydrophobicContact CD1-SD 3.67Å; F119-M134 WeakPolarHBondContact O-CA 3.38Å; V120-M134 HydrophobicContact CG2-CB 4.38Å; V120-M134 HydrophobicContact CG2-CE 3.95Å; V120-M134 HydrophobicContact CG2-CG 4.45Å; M134-I136 HydrophobicContact CG-CG1 4.34Å
135	H	91.2	Very high	78.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.9	-179	-53	-95.5	0	0	0	109.3	T38 F93 L118 F119 E133 F137	T38-H135 PolarHBondContact OG1-ND1 3.27Å; F93-H135 AromaticContact CE1-CE1 3.36Å; F93-H135 WeakPolarHBondContact CE1-CE1 3.34Å; F93-H135 AromaticContact CE1-ND1 3.82Å; F93-H135 AromaticContact CE1-NE2 3.47Å; F93-H135 WeakPolarHBondContact CE1-NE2 3.49Å; F93-H135 AromaticContact CZ-CE1 3.64Å; F93-H135 AromaticContact CZ-CG 3.92Å; F93-H135 AromaticContact CZ-ND1 3.59Å; F93-H135 AromaticContact CZ-NE2 3.96Å; L118-H135 WeakPolarHBondContact CA-O 3.26Å; L118-H135 VanDerWaalsContact CB-O 3.3Å; L118-H135 WeakPolarHBondContact CB-O 3.3Å; F119-H135 HydrophobicContact CE2-CB 4.26Å; F119-H135 HydrophobicContact CZ-CB 4.29Å; F119-H135 PolarHBondContact N-O 2.66Å; F119-H135 PolarHBondContact O-N 2.84Å; E133-H135 WeakPolarHBondContact CB-NE2 3.43Å; E133-H135 IonicContact OE2-CE1 2.77Å; E133-H135 PolarHBondContact OE2-CE1 2.96Å; E133-H135 IonicContact OE2-NE2 3.65Å; H135-F137 HydrophobicContact CB-CD2 4.35Å; H135-F137 HydrophobicContact CB-CE2 3.51Å; H135-F137 HydrophobicContact CB-CZ 4.07Å
136	I	92.5	Very high	79.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.5	-174.5	-51.8	-173.5	0	0	0	109.3	L36 A37 F39 L57 V116 L118 M134	L36-I136 HydrophobicContact CB-CG2 4.48Å; L36-I136 HydrophobicContact CD1-CG2 4.41Å; L36-I136 PolarHBondContact N-O 3.43Å; A37-I136 HydrophobicContact CB-CB 4.42Å; A37-I136 PolarHBondContact N-O 3.37Å; A37-I136 PolarHBondContact O-N 3.19Å; F39-I136 HydrophobicContact CD2-CD1 3.85Å; F39-I136 HydrophobicContact CE2-CD1 3.53Å; F39-I136 HydrophobicContact CZ-CD1 4.5Å; L57-I136 HydrophobicContact CD2-CG2 4.19Å; V116-I136 HydrophobicContact CG1-CG2 3.44Å; V116-I136 VanDerWaalsContact CG1-CG2 3.44Å; L118-I136 HydrophobicContact CB-CB 4.45Å; L118-I136 HydrophobicContact CB-CG1 4.02Å; L118-I136 HydrophobicContact CD1-CG1 4.46Å; M134-I136 HydrophobicContact CG-CG1 4.34Å
137	F	93.8	Very high	81	Confident	2 Å²	2	49 Å²	49	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.1	-173.3	-61.5	-88.4	0	0	0	111.8	V33 E34 H35 V82 F93 V116 L117 F119 H135	V33-F137 HydrophobicContact CB-CB 4.2Å; V33-F137 HydrophobicContact CB-CD1 4.39Å; V33-F137 HydrophobicContact CG2-CD1 3.84Å; V33-F137 HydrophobicContact CG2-CE1 4.49Å; V33-F137 HydrophobicContact CG2-CG 4.47Å; E34-F137 CarbonylContact O-C 3.54Å; E34-F137 WeakPolarHBondContact O-CA 3.37Å; H35-F137 HydrophobicContact CB-CD1 3.96Å; H35-F137 HydrophobicContact CB-CE1 3.89Å; H35-F137 AromaticContact CD2-CE1 3.73Å; V82-F137 HydrophobicContact CG2-CZ 4.44Å; F93-F137 HydrophobicContact CE2-CZ 4.45Å; V116-F137 CarbonylContact C-O 3.55Å; V116-F137 WeakPolarHBondContact CA-O 3.44Å; L117-F137 HydrophobicContact CB-CB 4.5Å; L117-F137 PolarHBondContact N-O 2.95Å; L117-F137 PolarHBondContact O-N 3.33Å; F119-F137 HydrophobicContact CE1-CD2 4.01Å; F119-F137 AromaticContact CE1-CE2 3.58Å; F119-F137 HydrophobicContact CE1-CE2 3.58Å; F119-F137 AromaticContact CZ-CE2 3.7Å; F119-F137 HydrophobicContact CZ-CE2 3.7Å; F119-F137 HydrophobicContact CZ-CZ 4.43Å; H135-F137 HydrophobicContact CB-CD2 4.35Å; H135-F137 HydrophobicContact CB-CE2 3.51Å; H135-F137 HydrophobicContact CB-CZ 4.07Å
138	Q	90.6	Very high	82.5	Confident	25 Å²	25	41.2 Å²	41.2	12%	0.117	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	128.2	165.7	-179.3	52.8	53.3	0	0	109.4	V33 E34 L36 N114 N115	V33-Q138 CarbonylContact C-O 3.4Å; V33-Q138 WeakPolarHBondContact CA-O 3.22Å; V33-Q138 WeakPolarHBondContact CB-O 3.34Å; E34-Q138 HydrophobicContact CB-CB 4.1Å; E34-Q138 PolarHBondContact N-O 2.9Å; E34-Q138 PolarHBondContact O-N 3.42Å; L36-Q138 HydrophobicContact CD1-CB 4.09Å; L36-Q138 HydrophobicContact CD2-CB 4.07Å; L36-Q138 HydrophobicContact CG-CB 4.1Å; N114-Q138 PolarHBondContact O-NE2 3.27Å; N114-Q138 PolarHBondContact O-OE1 3.02Å; N115-Q138 PolarHBondContact O-NE2 3.41Å
139	C	88.3	Confident	84.3	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.02	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.9	173.6	-68	0	0	0	0	110.2	N115 V142 A144	N115-C139 WeakPolarHBondContact ND2-CB 3.44Å; N115-C139 PolarHBondContact ND2-O 3.31Å; N115-C139 WeakPolarHBondContact O-CB 3.22Å; N115-C139 PolarHBondContact O-N 3.04Å; C139-V142 WeakPolarHBondContact CB-O 3.4Å; C139-A144 HydrophobicContact CB-CB 4.18Å
140	I	78.2	Confident	85.8	Confident	82 Å²	82	33.8 Å²	33.8	42%	0.421	18%	0.176	S	C	.	.	S	Bend	trans	-94.1	-39.8	-168.6	-50.7	171.7	0	0	0	112.7	Y32 E34	Y32-I140 PolarHBondContact O-N 3.32Å; Y32-I140 VanDerWaalsContact O-N 3.16Å; E34-I140 HydrophobicContact CG-CD1 3.6Å; E34-I140 HydrophobicContact CG-CG1 3.89Å
141	R	70.8	Confident	87.1	Confident	155 Å²	155	31.5 Å²	31.5	59%	0.585	16%	0.162	S	C	*	.	S	Bend	trans	-130	7.4	-168.1	-59.9	-176.2	-179.1	159.5	1.2	114.7
142	V	78.4	Confident	87.9	Confident	18 Å²	18	33.4 Å²	33.4	11%	0.109	17%	0.166	C	C	.	.	S	Bend	trans	-147.8	144.4	-175.6	-174.2	0	0	0	0	107.4	Y31 N115 C139 A144 D146 V147	Y31-V142 HydrophobicContact CD1-CB 4.45Å; Y31-V142 HydrophobicContact CD1-CG1 4.27Å; Y31-V142 HydrophobicContact CD1-CG2 4.23Å; N115-V142 PolarHBondContact ND2-O 2.99Å; C139-V142 WeakPolarHBondContact CB-O 3.4Å; V142-A144 PolarHBondContact O-N 2.95Å; V142-D146 HydrophobicContact CG1-CB 3.99Å; V142-V147 HydrophobicContact CB-CG2 4.13Å; V142-V147 HydrophobicContact CG1-CG2 3.78Å
143	S	86.7	Confident	88	Confident	43 Å²	43	32.4 Å²	32.4	30%	0.301	16%	0.159	S	C	.	.			trans	-56.6	126.6	169.6	164.5	0	0	0	0	110.7	N115 T145 D146 V147	N115-S143 WeakPolarHBondContact OD1-CA 3.49Å; S143-T145 PolarHBondContact O-N 3.3Å; S143-T145 WeakPolarHBondContact OG-CB 3.23Å; S143-T145 PolarHBondContact OG-N 3.07Å; S143-D146 VanDerWaalsContact CB-OD1 3.3Å; S143-D146 WeakPolarHBondContact CB-OD1 3.36Å; S143-D146 WeakPolarHBondContact O-CB 3.47Å; S143-D146 PolarHBondContact O-N 3.14Å; S143-D146 PolarHBondContact OG-N 3.3Å; S143-D146 PolarHBondContact OG-OD1 3.22Å; S143-V147 WeakPolarHBondContact O-CG2 3.47Å; S143-V147 PolarHBondContact O-N 2.87Å; S143-V147 VanDerWaalsContact O-N 3.16Å
144	A	89.3	Confident	88	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-25.2	174.6	0	0	0	0	0	111.8	A103 N115 V116 L117 C139 V142 V147 A148	A103-A144 HydrophobicContact CB-CB 4.04Å; N115-A144 PolarHBondContact OD1-N 3.02Å; V116-A144 WeakPolarHBondContact O-CB 3.5Å; L117-A144 HydrophobicContact CB-CB 4.26Å; C139-A144 HydrophobicContact CB-CB 4.18Å; V142-A144 PolarHBondContact O-N 2.95Å; A144-V147 PolarHBondContact O-N 3.33Å; A144-A148 WeakPolarHBondContact O-CB 3.42Å; A144-A148 PolarHBondContact O-N 3.29Å
145	T	90.6	Very high	87.9	Confident	59 Å²	59	35 Å²	35	36%	0.362	17%	0.174	S	C	.	.	H	α-helix	trans	-63.7	-48.8	171.9	-50	0	0	0	0	110.8	S143 V147 A148 E149	S143-T145 PolarHBondContact O-N 3.3Å; S143-T145 WeakPolarHBondContact OG-CB 3.23Å; S143-T145 PolarHBondContact OG-N 3.07Å; T145-V147 VanDerWaalsContact C-N 3.34Å; T145-V147 PolarHBondContact O-N 3.38Å; T145-A148 PolarHBondContact O-N 3.14Å; T145-E149 WeakPolarHBondContact O-CG 3.12Å; T145-E149 PolarHBondContact O-N 3.14Å
146	D	88.2	Confident	87.7	Confident	54 Å²	54	40.6 Å²	40.6	29%	0.289	20%	0.201	S	C	.	.	H	α-helix	trans	-55.6	-49.5	173.9	-64.1	26.5	0	0	0	110.3	V142 S143 A148 E149 D150 R166	V142-D146 HydrophobicContact CG1-CB 3.99Å; S143-D146 VanDerWaalsContact CB-OD1 3.3Å; S143-D146 WeakPolarHBondContact CB-OD1 3.36Å; S143-D146 WeakPolarHBondContact O-CB 3.47Å; S143-D146 PolarHBondContact O-N 3.14Å; S143-D146 PolarHBondContact OG-N 3.3Å; S143-D146 PolarHBondContact OG-OD1 3.22Å; D146-A148 VanDerWaalsContact C-N 3.35Å; D146-A148 PolarHBondContact O-N 3.37Å; D146-E149 PolarHBondContact O-N 3.24Å; D146-D150 WeakPolarHBondContact O-CB 3.4Å; D146-D150 PolarHBondContact O-N 2.9Å; D146-R166 IonicContact OD2-CZ 2.85Å; D146-R166 IonicContact OD2-NH2 3.1Å; D146-R166 PolarHBondContact OD2-NH2 3.18Å
147	V	89.3	Confident	87.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-36.4	-176.7	-167.4	0	0	0	0	111.7	Y31 F75 L117 V142 S143 A144 T145 L151	Y31-V147 HydrophobicContact CD1-CB 4.33Å; Y31-V147 HydrophobicContact CD1-CG1 4.05Å; Y31-V147 HydrophobicContact CD1-CG2 3.47Å; Y31-V147 VanDerWaalsContact CD1-CG2 3.47Å; Y31-V147 HydrophobicContact CD2-CG1 3.99Å; Y31-V147 HydrophobicContact CE1-CB 4.44Å; Y31-V147 HydrophobicContact CE1-CG1 4.24Å; Y31-V147 HydrophobicContact CE1-CG2 3.85Å; Y31-V147 HydrophobicContact CE2-CG1 4.23Å; Y31-V147 HydrophobicContact CG-CG1 3.91Å; Y31-V147 HydrophobicContact CG-CG2 4.02Å; F75-V147 HydrophobicContact CE2-CG1 4.42Å; F75-V147 HydrophobicContact CZ-CG1 3.76Å; L117-V147 HydrophobicContact CD2-CB 4.25Å; L117-V147 HydrophobicContact CD2-CG1 3.66Å; V142-V147 HydrophobicContact CB-CG2 4.13Å; V142-V147 HydrophobicContact CG1-CG2 3.78Å; S143-V147 WeakPolarHBondContact O-CG2 3.47Å; S143-V147 PolarHBondContact O-N 2.87Å; S143-V147 VanDerWaalsContact O-N 3.16Å; A144-V147 PolarHBondContact O-N 3.33Å; T145-V147 VanDerWaalsContact C-N 3.34Å; T145-V147 PolarHBondContact O-N 3.38Å; V147-L151 VanDerWaalsContact O-CB 3.26Å; V147-L151 WeakPolarHBondContact O-CB 3.27Å; V147-L151 PolarHBondContact O-N 2.86Å
148	A	91.8	Very high	86.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.9	-34.9	175	0	0	0	0	0	112.4	A103 L117 A144 T145 D146 K152	A103-A148 HydrophobicContact CB-CB 4.16Å; L117-A148 HydrophobicContact CD1-CB 3.74Å; A144-A148 WeakPolarHBondContact O-CB 3.42Å; A144-A148 PolarHBondContact O-N 3.29Å; T145-A148 PolarHBondContact O-N 3.14Å; D146-A148 VanDerWaalsContact C-N 3.35Å; D146-A148 PolarHBondContact O-N 3.37Å; A148-K152 WeakPolarHBondContact O-CD 3.32Å; A148-K152 WeakPolarHBondContact O-CG 3.26Å; A148-K152 PolarHBondContact O-N 3.15Å
149	E	90.1	Very high	86	Confident	106 Å²	106	47.6 Å²	47.6	50%	0.495	24%	0.244	S	C	.	.	H	α-helix	trans	-72.3	-43.4	173.3	-72.9	-165.4	-177.4	0	0	112.4	T145 D146 L151 K152 N153	T145-E149 WeakPolarHBondContact O-CG 3.12Å; T145-E149 PolarHBondContact O-N 3.14Å; D146-E149 PolarHBondContact O-N 3.24Å; E149-L151 VanDerWaalsContact C-N 3.27Å; E149-L151 PolarHBondContact O-N 3.41Å; E149-K152 PolarHBondContact O-N 2.89Å; E149-N153 WeakPolarHBondContact O-CB 3.4Å; E149-N153 PolarHBondContact O-N 3.43Å; E149-N153 PolarHBondContact O-ND2 3Å
150	D	89.8	Confident	85	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-41	172.7	-77.7	-24.3	0	0	0	110.9	Y31 F75 D146 N153 Y154 V162	Y31-D150 VanDerWaalsContact OH-CB 3.3Å; Y31-D150 WeakPolarHBondContact OH-CB 3.37Å; Y31-D150 VanDerWaalsContact OH-CG 3.3Å; Y31-D150 PolarHBondContact OH-OD2 3.16Å; F75-D150 HydrophobicContact CD2-CB 4.44Å; F75-D150 HydrophobicContact CE2-CB 3.87Å; D146-D150 WeakPolarHBondContact O-CB 3.4Å; D146-D150 PolarHBondContact O-N 2.9Å; D150-N153 PolarHBondContact O-N 3.07Å; D150-Y154 PolarHBondContact O-N 2.97Å; D150-V162 HydrophobicContact CB-CB 4.46Å; D150-V162 HydrophobicContact CB-CG1 3.89Å; D150-V162 HydrophobicContact CB-CG2 3.87Å; D150-V162 WeakPolarHBondContact O-CG2 3.36Å; D150-V162 WeakPolarHBondContact OD1-CG1 3.36Å; D150-V162 WeakPolarHBondContact OD1-CG2 3.48Å
151	L	90.8	Very high	84.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-40.3	176.1	-173.4	49.7	0	0	0	112.5	F75 V80 L95 I98 P101 F119 V147 E149 N153 Y154 V155	F75-L151 HydrophobicContact CE1-CD1 4.19Å; F75-L151 HydrophobicContact CE2-CB 3.94Å; F75-L151 HydrophobicContact CE2-CD1 4.47Å; F75-L151 HydrophobicContact CZ-CB 3.74Å; F75-L151 HydrophobicContact CZ-CD1 4.11Å; F75-L151 HydrophobicContact CZ-CD2 4.45Å; F75-L151 HydrophobicContact CZ-CG 4.31Å; V80-L151 HydrophobicContact CG2-CD1 3.55Å; L95-L151 HydrophobicContact CD1-CD1 4.36Å; I98-L151 HydrophobicContact CD1-CD1 4.3Å; I98-L151 HydrophobicContact CG2-CD1 4.48Å; I98-L151 HydrophobicContact CG2-CD2 4.29Å; I98-L151 HydrophobicContact CG2-CG 4.45Å; P101-L151 HydrophobicContact CB-CB 4.13Å; P101-L151 HydrophobicContact CB-CD2 4.01Å; P101-L151 HydrophobicContact CB-CG 4.01Å; P101-L151 HydrophobicContact CG-CB 4.3Å; P101-L151 HydrophobicContact CG-CD2 4.06Å; P101-L151 HydrophobicContact CG-CG 3.79Å; F119-L151 HydrophobicContact CB-CD2 4.31Å; F119-L151 HydrophobicContact CD1-CD2 3.66Å; F119-L151 HydrophobicContact CE1-CD2 4.16Å; F119-L151 HydrophobicContact CG-CD2 4.05Å; V147-L151 VanDerWaalsContact O-CB 3.26Å; V147-L151 WeakPolarHBondContact O-CB 3.27Å; V147-L151 PolarHBondContact O-N 2.86Å; E149-L151 VanDerWaalsContact C-N 3.27Å; E149-L151 PolarHBondContact O-N 3.41Å; L151-N153 VanDerWaalsContact C-N 3.33Å; L151-N153 PolarHBondContact O-N 2.83Å; L151-Y154 PolarHBondContact O-N 3.47Å; L151-V155 HydrophobicContact CD1-CG2 4.31Å; L151-V155 WeakPolarHBondContact O-CG2 3.41Å; L151-V155 PolarHBondContact O-N 3.37Å
152	K	91.3	Very high	84.3	Confident	80 Å²	80	56.4 Å²	56.4	35%	0.348	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-44.1	171.3	-71.7	161	-159.4	163.9	0	111.3	P101 A148 E149 Y154 V155 Q156	P101-K152 HydrophobicContact CB-CG 4.13Å; P101-K152 HydrophobicContact CG-CG 4.17Å; P101-K152 WeakPolarHBondContact O-CE 3.46Å; A148-K152 WeakPolarHBondContact O-CD 3.32Å; A148-K152 WeakPolarHBondContact O-CG 3.26Å; A148-K152 PolarHBondContact O-N 3.15Å; E149-K152 PolarHBondContact O-N 2.89Å; K152-Y154 VanDerWaalsContact C-N 3.34Å; K152-Y154 PolarHBondContact O-N 3.02Å; K152-V155 PolarHBondContact O-N 2.97Å; K152-Q156 WeakPolarHBondContact O-CB 3.38Å; K152-Q156 VanDerWaalsContact O-CG 3.27Å; K152-Q156 WeakPolarHBondContact O-CG 3.31Å; K152-Q156 PolarHBondContact O-N 3.46Å
153	N	88.4	Confident	83.5	Confident	21 Å²	21	65.4 Å²	65.4	11%	0.112	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-39.7	177	-74.5	-55.3	0	0	0	111.3	E149 D150 L151 Q156 G157 Q158 V162	E149-N153 WeakPolarHBondContact O-CB 3.4Å; E149-N153 PolarHBondContact O-N 3.43Å; E149-N153 PolarHBondContact O-ND2 3Å; D150-N153 PolarHBondContact O-N 3.07Å; L151-N153 VanDerWaalsContact C-N 3.33Å; L151-N153 PolarHBondContact O-N 2.83Å; N153-Q156 PolarHBondContact O-N 2.78Å; N153-G157 PolarHBondContact O-N 2.76Å; N153-Q158 HydrophobicContact CB-CB 4.43Å; N153-Q158 WeakPolarHBondContact O-CA 3.3Å; N153-Q158 PolarHBondContact O-N 3.41Å; N153-V162 HydrophobicContact CB-CG2 3.51Å
154	Y	87.5	Confident	82.1	Confident	8 Å²	8	67.7 Å²	67.7	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-50.6	173	-99.1	-110	0	0	0	112.4	P29 F75 L95 D150 L151 K152 Q156 G157 F159 V162	P29-Y154 WeakPolarHBondContact CD-OH 3.39Å; P29-Y154 HydrophobicContact CG-CE2 4Å; F75-Y154 HydrophobicContact CB-CD1 3.81Å; F75-Y154 HydrophobicContact CB-CD2 4.36Å; F75-Y154 HydrophobicContact CB-CE1 3.63Å; F75-Y154 HydrophobicContact CB-CE2 4.21Å; F75-Y154 HydrophobicContact CB-CG 4.18Å; F75-Y154 HydrophobicContact CD2-CD2 4.02Å; F75-Y154 HydrophobicContact CD2-CE2 4.34Å; F75-Y154 HydrophobicContact CD2-CG 4.21Å; L95-Y154 HydrophobicContact CD2-CD1 4.34Å; L95-Y154 WeakPolarHBondContact CD2-O 3.35Å; D150-Y154 PolarHBondContact O-N 2.97Å; L151-Y154 PolarHBondContact O-N 3.47Å; K152-Y154 VanDerWaalsContact C-N 3.34Å; K152-Y154 PolarHBondContact O-N 3.02Å; Y154-Q156 PolarHBondContact O-N 3.22Å; Y154-G157 PolarHBondContact O-N 2.64Å; Y154-F159 AromaticContact CD1-CD1 3.43Å; Y154-F159 HydrophobicContact CD1-CD1 3.43Å; Y154-F159 VanDerWaalsContact CD1-CD1 3.43Å; Y154-F159 AromaticContact CD1-CE1 3.51Å; Y154-F159 HydrophobicContact CD1-CE1 3.51Å; Y154-F159 AromaticContact CD2-CD1 3.95Å; Y154-F159 HydrophobicContact CD2-CD1 3.95Å; Y154-F159 AromaticContact CE1-CD1 3.5Å; Y154-F159 HydrophobicContact CE1-CD1 3.5Å; Y154-F159 VanDerWaalsContact CE1-CD1 3.5Å; Y154-F159 AromaticContact CE1-CE1 3.9Å; Y154-F159 HydrophobicContact CE1-CE1 3.9Å; Y154-F159 HydrophobicContact CE2-CB 4.45Å; Y154-F159 HydrophobicContact CE2-CD1 4Å; Y154-F159 AromaticContact CG-CD1 3.66Å; Y154-F159 HydrophobicContact CG-CD1 3.66Å; Y154-F159 AromaticContact CG-CE1 3.94Å; Y154-F159 HydrophobicContact CG-CE1 3.94Å; Y154-F159 AromaticContact CZ-CD1 3.78Å; Y154-F159 WeakPolarHBondContact O-CE1 3.46Å; Y154-V162 HydrophobicContact CD2-CB 4.19Å; Y154-V162 HydrophobicContact CD2-CG1 4.35Å; Y154-V162 HydrophobicContact CD2-CG2 3.63Å; Y154-V162 HydrophobicContact CE2-CB 3.82Å; Y154-V162 HydrophobicContact CE2-CG1 3.82Å; Y154-V162 HydrophobicContact CE2-CG2 3.8Å
155	V	88.4	Confident	80.2	Confident	57 Å²	57	68 Å²	68	35%	0.345	32%	0.317	S	S	.	.	H	α-helix	trans	-58.8	-31.8	178.1	173	0	0	0	0	111.8	L95 I98 L151 K152 G157	L95-V155 HydrophobicContact CD1-CB 4.45Å; L95-V155 HydrophobicContact CD1-CG2 3.6Å; L95-V155 HydrophobicContact CG-CG2 4.34Å; I98-V155 HydrophobicContact CB-CG2 4.07Å; I98-V155 HydrophobicContact CG2-CG2 4.06Å; L151-V155 HydrophobicContact CD1-CG2 4.31Å; L151-V155 WeakPolarHBondContact O-CG2 3.41Å; L151-V155 PolarHBondContact O-N 3.37Å; K152-V155 PolarHBondContact O-N 2.97Å; V155-G157 VanDerWaalsContact C-N 3.29Å; V155-G157 PolarHBondContact O-N 2.76Å
156	Q	86.4	Confident	78.1	Confident	118 Å²	118	73 Å²	73	55%	0.551	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	3.5	174.6	-66.9	176.2	24.8	0	0	114.4	K152 N153 Y154 Q158	K152-Q156 WeakPolarHBondContact O-CB 3.38Å; K152-Q156 VanDerWaalsContact O-CG 3.27Å; K152-Q156 WeakPolarHBondContact O-CG 3.31Å; K152-Q156 PolarHBondContact O-N 3.46Å; N153-Q156 PolarHBondContact O-N 2.78Å; Y154-Q156 PolarHBondContact O-N 3.22Å; Q156-Q158 HydrophobicContact CB-CG 4.04Å; Q156-Q158 PolarHBondContact O-N 3.23Å
157	G	81.6	Confident	75.8	Confident	44 Å²	44	76.6 Å²	76.6	45%	0.454	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	9.7	-176.4	0	0	0	0	0	114.6	N153 Y154 V155 F159	N153-G157 PolarHBondContact O-N 2.76Å; Y154-G157 PolarHBondContact O-N 2.64Å; V155-G157 VanDerWaalsContact C-N 3.29Å; V155-G157 PolarHBondContact O-N 2.76Å; G157-F159 WeakPolarHBondContact O-CD2 3.43Å; G157-F159 PolarHBondContact O-N 2.78Å; G157-F159 VanDerWaalsContact O-N 3.12Å
158	Q	82.1	Confident	73	Confident	68 Å²	68	81.7 Å²	81.7	32%	0.318	37%	0.37	S	S	.	.			trans	-88.1	40.1	-175.3	-59.3	-177.2	27.9	0	0	112	N153 Q156 R160 R161	N153-Q158 HydrophobicContact CB-CB 4.43Å; N153-Q158 WeakPolarHBondContact O-CA 3.3Å; N153-Q158 PolarHBondContact O-N 3.41Å; Q156-Q158 HydrophobicContact CB-CG 4.04Å; Q156-Q158 PolarHBondContact O-N 3.23Å; Q158-R160 PolarHBondContact O-N 2.69Å; Q158-R161 HydrophobicContact CB-CG 4.26Å; Q158-R161 WeakPolarHBondContact O-CB 3.41Å; Q158-R161 PolarHBondContact O-N 2.98Å
159	F	78.4	Confident	69.8	Low	62 Å²	62	86 Å²	86	27%	0.272	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-48.6	-34.5	-174.2	-48.1	-61.4	0	0	0	114	H77 L95 Y154 G157 R161 V162	H77-F159 VanDerWaalsContact O-CZ 3.3Å; H77-F159 WeakPolarHBondContact O-CZ 3.33Å; L95-F159 HydrophobicContact CD2-CE1 3.96Å; L95-F159 HydrophobicContact CD2-CZ 4.33Å; Y154-F159 AromaticContact CD1-CD1 3.43Å; Y154-F159 HydrophobicContact CD1-CD1 3.43Å; Y154-F159 VanDerWaalsContact CD1-CD1 3.43Å; Y154-F159 AromaticContact CD1-CE1 3.51Å; Y154-F159 HydrophobicContact CD1-CE1 3.51Å; Y154-F159 AromaticContact CD2-CD1 3.95Å; Y154-F159 HydrophobicContact CD2-CD1 3.95Å; Y154-F159 AromaticContact CE1-CD1 3.5Å; Y154-F159 HydrophobicContact CE1-CD1 3.5Å; Y154-F159 VanDerWaalsContact CE1-CD1 3.5Å; Y154-F159 AromaticContact CE1-CE1 3.9Å; Y154-F159 HydrophobicContact CE1-CE1 3.9Å; Y154-F159 HydrophobicContact CE2-CB 4.45Å; Y154-F159 HydrophobicContact CE2-CD1 4Å; Y154-F159 AromaticContact CG-CD1 3.66Å; Y154-F159 HydrophobicContact CG-CD1 3.66Å; Y154-F159 AromaticContact CG-CE1 3.94Å; Y154-F159 HydrophobicContact CG-CE1 3.94Å; Y154-F159 AromaticContact CZ-CD1 3.78Å; Y154-F159 WeakPolarHBondContact O-CE1 3.46Å; G157-F159 WeakPolarHBondContact O-CD2 3.43Å; G157-F159 PolarHBondContact O-N 2.78Å; G157-F159 VanDerWaalsContact O-N 3.12Å; F159-R161 PolarHBondContact O-N 3.05Å; F159-V162 PolarHBondContact O-N 2.99Å
160	R	68.1	Low	66.6	Low	249 Å²	249	84 Å²	84	94%	0.94	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-69.3	-12.7	179	-63.9	-174.8	-179.9	-173.6	0.1	115.2	Q158	Q158-R160 PolarHBondContact O-N 2.69Å
161	R	65.8	Low	64.2	Low	165 Å²	165	88.3 Å²	88.3	62%	0.623	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-86.7	-24.7	175.3	-63.8	-177.2	70.3	-165.1	-4.8	112.4	Q158 F159	Q158-R161 HydrophobicContact CB-CG 4.26Å; Q158-R161 WeakPolarHBondContact O-CB 3.41Å; Q158-R161 PolarHBondContact O-N 2.98Å; F159-R161 PolarHBondContact O-N 3.05Å
162	V	67.1	Low	61.2	Low	10 Å²	10	95.2 Å²	95.2	6%	0.061	48%	0.479	C	S	.	.	S	Bend	trans	-72.6	133.9	177.1	169.6	0	0	0	0	109.8	P29 D150 N153 Y154 F159	P29-V162 HydrophobicContact CB-CG1 4.38Å; P29-V162 HydrophobicContact CG-CG1 3.65Å; D150-V162 HydrophobicContact CB-CB 4.46Å; D150-V162 HydrophobicContact CB-CG1 3.89Å; D150-V162 HydrophobicContact CB-CG2 3.87Å; D150-V162 WeakPolarHBondContact O-CG2 3.36Å; D150-V162 WeakPolarHBondContact OD1-CG1 3.36Å; D150-V162 WeakPolarHBondContact OD1-CG2 3.48Å; N153-V162 HydrophobicContact CB-CG2 3.51Å; Y154-V162 HydrophobicContact CD2-CB 4.19Å; Y154-V162 HydrophobicContact CD2-CG1 4.35Å; Y154-V162 HydrophobicContact CD2-CG2 3.63Å; Y154-V162 HydrophobicContact CE2-CB 3.82Å; Y154-V162 HydrophobicContact CE2-CG1 3.82Å; Y154-V162 HydrophobicContact CE2-CG2 3.8Å; F159-V162 PolarHBondContact O-N 2.99Å
163	R	62.8	Low	58.5	Low	208 Å²	208	99.2 Å²	99.2	79%	0.785	50%	0.498	S	S	*	.			trans	-76.4	128.1	169.6	-65.9	177	-179.9	167.8	1.2	107.2	G165	R163-G165 PolarHBondContact O-N 2.72Å
164	N	56.6	Low	55.7	Low	90 Å²	90	104.6 Å²	104.6	48%	0.481	53%	0.527	S	S	.	.			trans	-53	114.2	173.9	-74.6	-19.3	0	0	0	109	V27	V27-N164 HydrophobicContact CG1-CB 3.84Å; V27-N164 WeakPolarHBondContact CG1-ND2 3.46Å; V27-N164 PolarHBondContact O-OD1 2.79Å
165	G	49.6	Very low	53	Low	8 Å²	8	112.6 Å²	112.6	8%	0.082	56%	0.564	C	S	.	*			trans	-49.8	144.9	-162.4	0	0	0	0	0	112.8	R163 R167	R163-G165 PolarHBondContact O-N 2.72Å; G165-R167 PolarHBondContact O-N 2.89Å
166	R	47.1	Very low	50.3	Low	164 Å²	164	114.5 Å²	114.5	62%	0.619	59%	0.586	S	S	*	*			trans	-61.2	68	-162.6	-53.4	-177.3	-166	-169.3	3.1	113.5	D146 T168	D146-R166 IonicContact OD2-CZ 2.85Å; D146-R166 IonicContact OD2-NH2 3.1Å; D146-R166 PolarHBondContact OD2-NH2 3.18Å; R166-T168 PolarHBondContact O-N 3.26Å
167	R	38.6	Very low	47.5	Very low	129 Å²	129	118 Å²	118	49%	0.487	60%	0.602	S	S	.	*			trans	-58.5	123.8	169.9	-66.7	-169.8	-171.7	174.6	10	107.2	D26 T28 G165 A169	D26-R167 PolarHBondContact O-NH1 2.54Å; D26-R167 PolarHBondContact O-NH2 3.31Å; D26-R167 VanDerWaalsContact O-NH2 3.09Å; T28-R167 PolarHBondContact O-NH2 3.46Å; G165-R167 PolarHBondContact O-N 2.89Å; R167-A169 PolarHBondContact O-N 3.43Å; R167-A169 VanDerWaalsContact O-N 3.16Å
168	T	30	Very low	45.2	Very low	107 Å²	107	124.2 Å²	124.2	66%	0.656	62%	0.62	S	S	*	*			trans	-29.2	111	-178.8	49.4	0	0	0	0	113.4	R166 A170	R166-T168 PolarHBondContact O-N 3.26Å; T168-A170 PolarHBondContact O-N 3.19Å
169	A	24.9	Very low	42.8	Very low	89 Å²	89	129.5 Å²	129.5	74%	0.736	64%	0.644	S	S	*	*			trans	-77.8	64.9	-170.8	0	0	0	0	0	113.8	R167	R167-A169 PolarHBondContact O-N 3.43Å; R167-A169 VanDerWaalsContact O-N 3.16Å
170	A	22.7	Very low	40.6	Very low	65 Å²	65	135 Å²	135	54%	0.537	67%	0.671	S	S	.	*			trans	-91	138	150	0	0	0	0	0	107.8	T168 D378	T168-A170 PolarHBondContact O-N 3.19Å; A170-D378 WeakPolarHBondContact CB-O 3.48Å
171	P	41.2	Very low	38.5	Very low	112 Å²	112	131 Å²	131	73%	0.727	67%	0.665	S	S	*	*			trans	-84.3	146.4	-151	30.6	-37	0	0	0	115.1
172	T	27.6	Very low	37.1	Very low	145 Å²	145	127.8 Å²	127.8	89%	0.89	67%	0.666	S	S	*	*			trans	-133.6	124.7	145.6	-58.1	0	0	0	0	108.7
173	H	33.4	Very low	35.3	Very low	164 Å²	164	137 Å²	137	76%	0.759	71%	0.705	S	S	*	*			trans	-80.1	130.3	-171.3	156.2	-66	0	0	0	111.6
174	L	30.3	Very low	33.8	Very low	135 Å²	135	136.5 Å²	136.5	71%	0.707	70%	0.704	S	S	*	*			trans	-166	129	145	-108.2	165.7	0	0	0	113.8
175	Q	31	Very low	32.9	Very low	175 Å²	175	137.2 Å²	137.2	82%	0.818	71%	0.714	S	S	*	*			trans	52.9	110.4	154.3	-78.9	165.5	-6	0	0	120.5
176	A	30.7	Very low	32.3	Very low	98 Å²	98	141.7 Å²	141.7	81%	0.81	74%	0.742	S	S	*	*			trans	-74.2	151.2	156	0	0	0	0	0	111.7
177	Q	28.4	Very low	31.6	Very low	190 Å²	190	140.7 Å²	140.7	89%	0.888	75%	0.749	S	S	*	*			trans	-128.7	134	149	-110.9	-175.9	6.7	0	0	109.4
178	Q	32.9	Very low	31.5	Very low	175 Å²	175	141.4 Å²	141.4	82%	0.818	76%	0.762	S	S	*	*			trans	-78.1	141.3	178.6	-65	169.4	-14.8	0	0	110.1
179	Q	31.1	Very low	32	Very low	179 Å²	179	140.3 Å²	140.3	84%	0.836	76%	0.764	S	S	*	*			trans	-145.2	119.1	149.8	-120.8	155.1	80.4	0	0	109.1
180	Q	32.2	Very low	32.5	Very low	177 Å²	177	138.6 Å²	138.6	83%	0.827	75%	0.747	S	S	*	*			trans	-76.3	136	175.1	-63	168.2	-5.9	0	0	108.2
181	M	24.8	Very low	33.1	Very low	167 Å²	167	140 Å²	140	82%	0.823	74%	0.744	S	S	*	*			trans	-132.1	153.8	165.3	-74.6	-61.1	-71.1	0	0	109.8
182	P	35.7	Very low	33	Very low	97 Å²	97	138.8 Å²	138.8	63%	0.63	74%	0.738	S	S	*	*			trans	-73.9	153.4	-162.2	-19.7	34.3	0	0	0	114.5	Y184	P182-Y184 PolarHBondContact O-N 3.48Å
183	F	29.7	Very low	33.7	Very low	204 Å²	204	134.8 Å²	134.8	90%	0.895	72%	0.716	S	S	*	*			trans	-65	120.2	170.1	-133.9	-99.1	0	0	0	110.1
184	Y	31.3	Very low	34.2	Very low	196 Å²	196	133.2 Å²	133.2	77%	0.769	71%	0.709	S	S	*	*			trans	-112.1	142.5	155.8	-86.7	-94.6	0	0	0	107.7	P182	P182-Y184 PolarHBondContact O-N 3.48Å
185	P	37.2	Very low	35.1	Very low	106 Å²	106	130.8 Å²	130.8	69%	0.688	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-66.1	137.5	173.6	29.3	-33.6	0	0	0	109.8
186	P	38.6	Very low	36.4	Very low	102 Å²	102	126.1 Å²	126.1	66%	0.662	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-69.9	141.6	171.3	-15.6	30.3	0	0	0	111.3	S190	P186-S190 WeakPolarHBondContact CB-OG 3.42Å
187	D	31.8	Very low	38.2	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-71	150.2	162.5	-63.8	-60.4	0	0	0	110.1	A189 S190	D187-A189 PolarHBondContact O-N 3.29Å; D187-S190 PolarHBondContact O-N 2.91Å
188	D	35.8	Very low	40	Very low	144 Å²	144	121.6 Å²	121.6	77%	0.77	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-55.5	-9.4	-172.6	-78.2	-58.4	0	0	0	116.2	S190	D188-S190 VanDerWaalsContact C-N 3.33Å; D188-S190 PolarHBondContact O-N 2.89Å
189	A	40.7	Very low	42.2	Very low	84 Å²	84	116.9 Å²	116.9	69%	0.694	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-69.7	-21.3	177.4	0	0	0	0	0	114.5	D187 S192	D187-A189 PolarHBondContact O-N 3.29Å; A189-S192 PolarHBondContact O-OG 3.3Å
190	S	36.4	Very low	44.5	Very low	53 Å²	53	114 Å²	114	37%	0.371	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-78.3	-20.8	-175.6	63.3	0	0	0	0	114.6	P186 D187 D188 S192 S193 E194	P186-S190 WeakPolarHBondContact CB-OG 3.42Å; D187-S190 PolarHBondContact O-N 2.91Å; D188-S190 VanDerWaalsContact C-N 3.33Å; D188-S190 PolarHBondContact O-N 2.89Å; S190-S192 VanDerWaalsContact C-N 3.27Å; S190-S192 PolarHBondContact O-N 3.08Å; S190-S193 PolarHBondContact O-N 2.97Å; S190-E194 PolarHBondContact O-N 2.85Å
191	I	34.1	Very low	46.9	Very low	96 Å²	96	109.7 Å²	109.7	49%	0.492	59%	0.589	S	S	.	*	H	α-helix	trans	-65.9	-28.7	-172.3	-59.3	173.9	0	0	0	112	T195	I191-T195 PolarHBondContact O-N 3.13Å; I191-T195 PolarHBondContact O-OG1 3.4Å; I191-T195 VanDerWaalsContact O-OG1 3.14Å
192	S	40.1	Very low	49.8	Very low	85 Å²	85	102 Å²	102	59%	0.594	55%	0.551	S	S	*	*	H	α-helix	trans	-73.9	-31.8	176.6	56.5	0	0	0	0	113.3	A189 S190 T195 S196	A189-S192 PolarHBondContact O-OG 3.3Å; S190-S192 VanDerWaalsContact C-N 3.27Å; S190-S192 PolarHBondContact O-N 3.08Å; S192-T195 PolarHBondContact O-OG1 3.37Å; S192-S196 PolarHBondContact O-N 3.04Å
193	S	42.3	Very low	52.3	Low	61 Å²	61	99.2 Å²	99.2	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-69.2	-47.2	174.7	-159.8	0	0	0	0	110.6	S190 T195 S196 E197	S190-S193 PolarHBondContact O-N 2.97Å; S193-T195 VanDerWaalsContact C-N 3.29Å; S193-T195 PolarHBondContact O-N 2.92Å; S193-S196 WeakPolarHBondContact O-CB 3.44Å; S193-S196 PolarHBondContact O-N 3.07Å; S193-E197 WeakPolarHBondContact O-CG 3.48Å; S193-E197 PolarHBondContact O-N 3.16Å; S193-E197 PolarHBondContact OG-OE1 3.2Å
194	E	43.4	Very low	55	Low	132 Å²	132	93.1 Å²	93.1	62%	0.617	51%	0.509	S	S	*	.	H	α-helix	trans	-64.4	-32.8	-175.8	-169.4	171.8	-161.2	0	0	112.8	S190 M198	S190-E194 PolarHBondContact O-N 2.85Å; E194-M198 WeakPolarHBondContact O-CB 3.47Å; E194-M198 PolarHBondContact O-N 2.72Å; E194-M198 VanDerWaalsContact O-N 3.08Å
195	T	48.7	Very low	57.8	Low	84 Å²	84	83.8 Å²	83.8	52%	0.515	47%	0.473	S	S	.	.	H	α-helix	trans	-71.9	-36.1	173.1	50.2	0	0	0	0	112.7	I191 S192 S193 F199	I191-T195 PolarHBondContact O-N 3.13Å; I191-T195 PolarHBondContact O-OG1 3.4Å; I191-T195 VanDerWaalsContact O-OG1 3.14Å; S192-T195 PolarHBondContact O-OG1 3.37Å; S193-T195 VanDerWaalsContact C-N 3.29Å; S193-T195 PolarHBondContact O-N 2.92Å; T195-F199 WeakPolarHBondContact O-CB 3.34Å; T195-F199 PolarHBondContact O-N 3.17Å
196	S	59.4	Low	60.5	Low	76 Å²	76	78.9 Å²	78.9	53%	0.531	44%	0.441	S	S	.	.	H	α-helix	trans	-67.8	-48.6	174.8	-167.8	0	0	0	0	112.4	S192 S193 M198 F199 E200	S192-S196 PolarHBondContact O-N 3.04Å; S193-S196 WeakPolarHBondContact O-CB 3.44Å; S193-S196 PolarHBondContact O-N 3.07Å; S196-M198 VanDerWaalsContact C-N 3.31Å; S196-M198 PolarHBondContact O-N 2.94Å; S196-F199 WeakPolarHBondContact O-CB 2.98Å; S196-F199 PolarHBondContact O-N 3.08Å; S196-F199 VanDerWaalsContact O-N 3.1Å; S196-E200 PolarHBondContact O-N 3.28Å
197	E	68.4	Low	63.1	Low	122 Å²	122	77.8 Å²	77.8	57%	0.57	43%	0.429	S	S	*	.	H	α-helix	trans	-61.2	-38.5	176.6	-71	172.9	-125.2	0	0	112	S193 R201	S193-E197 WeakPolarHBondContact O-CG 3.48Å; S193-E197 PolarHBondContact O-N 3.16Å; S193-E197 PolarHBondContact OG-OE1 3.2Å; E197-R201 WeakPolarHBondContact O-CB 3.41Å; E197-R201 PolarHBondContact O-N 2.83Å
198	M	66	Low	65.9	Low	71 Å²	71	74 Å²	74	35%	0.35	40%	0.404	S	S	.	.	H	α-helix	trans	-68.4	-36.6	174.1	175	149.8	50.6	0	0	112.4	E194 S196 R201 D202	E194-M198 WeakPolarHBondContact O-CB 3.47Å; E194-M198 PolarHBondContact O-N 2.72Å; E194-M198 VanDerWaalsContact O-N 3.08Å; S196-M198 VanDerWaalsContact C-N 3.31Å; S196-M198 PolarHBondContact O-N 2.94Å; M198-R201 PolarHBondContact SD-NH2 3.22Å; M198-R201 VanDerWaalsContact SD-NH2 3.4Å; M198-D202 VanDerWaalsContact O-CB 3.31Å; M198-D202 WeakPolarHBondContact O-CB 3.42Å; M198-D202 PolarHBondContact O-N 3.12Å
199	F	77.5	Confident	68.7	Low	76 Å²	76	67.1 Å²	67.1	33%	0.333	37%	0.367	S	S	.	.	H	α-helix	trans	-65.5	-48.8	174.3	178.4	-90	0	0	0	111.7	T195 S196 R201 D202 V203 L286 H289	T195-F199 WeakPolarHBondContact O-CB 3.34Å; T195-F199 PolarHBondContact O-N 3.17Å; S196-F199 WeakPolarHBondContact O-CB 2.98Å; S196-F199 PolarHBondContact O-N 3.08Å; S196-F199 VanDerWaalsContact O-N 3.1Å; F199-R201 VanDerWaalsContact C-N 3.34Å; F199-R201 PolarHBondContact O-N 3.26Å; F199-D202 PolarHBondContact O-N 2.96Å; F199-D202 VanDerWaalsContact O-N 3.14Å; F199-V203 HydrophobicContact CD1-CG2 4.19Å; F199-V203 HydrophobicContact CE1-CG2 3.72Å; F199-V203 HydrophobicContact CE2-CG2 4.36Å; F199-V203 HydrophobicContact CZ-CG2 3.81Å; F199-V203 WeakPolarHBondContact O-CG2 3.44Å; F199-V203 PolarHBondContact O-N 3.33Å; F199-L286 HydrophobicContact CD2-CD2 3.53Å; F199-L286 HydrophobicContact CE2-CD2 3.35Å; F199-L286 HydrophobicContact CG-CD2 4.44Å; F199-L286 HydrophobicContact CZ-CD2 4.15Å; F199-H289 HydrophobicContact CE2-CB 3.49Å; F199-H289 VanDerWaalsContact CE2-CB 3.49Å; F199-H289 AromaticContact CE2-CG 3.54Å; F199-H289 AromaticContact CE2-ND1 3.7Å; F199-H289 HydrophobicContact CZ-CB 3.51Å
200	E	79.6	Confident	71.3	Confident	118 Å²	118	65.5 Å²	65.5	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-58	-46.7	177.4	-167.7	-161.2	146.7	0	0	110.9	S196 D202 V203 N204	S196-E200 PolarHBondContact O-N 3.28Å; E200-D202 VanDerWaalsContact C-N 3.3Å; E200-D202 PolarHBondContact O-N 3.49Å; E200-V203 PolarHBondContact O-N 3.05Å; E200-N204 VanDerWaalsContact O-CB 3.27Å; E200-N204 WeakPolarHBondContact O-CB 3.48Å; E200-N204 PolarHBondContact O-N 3.04Å
201	R	82.9	Confident	74	Confident	88 Å²	88	65 Å²	65	33%	0.332	34%	0.338	S	S	.	.	H	α-helix	trans	-58.1	-42.2	176.1	-176.3	-170.2	67	-158.9	-7.5	112.1	E197 M198 F199 N204 T205 P382	E197-R201 WeakPolarHBondContact O-CB 3.41Å; E197-R201 PolarHBondContact O-N 2.83Å; M198-R201 PolarHBondContact SD-NH2 3.22Å; M198-R201 VanDerWaalsContact SD-NH2 3.4Å; F199-R201 VanDerWaalsContact C-N 3.34Å; F199-R201 PolarHBondContact O-N 3.26Å; R201-N204 PolarHBondContact O-N 3.01Å; R201-T205 VanDerWaalsContact O-CB 3.29Å; R201-T205 WeakPolarHBondContact O-CB 3.5Å; R201-T205 PolarHBondContact O-N 3.17Å; R201-T205 PolarHBondContact O-OG1 2.72Å; R201-P382 HydrophobicContact CG-CB 4.05Å
202	D	86.5	Confident	76.9	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-71.8	-37.9	-176.7	-74.3	0.4	0	0	0	111.4	M198 F199 E200 T205 L206 L282 K285 L286	M198-D202 VanDerWaalsContact O-CB 3.31Å; M198-D202 WeakPolarHBondContact O-CB 3.42Å; M198-D202 PolarHBondContact O-N 3.12Å; F199-D202 PolarHBondContact O-N 2.96Å; F199-D202 VanDerWaalsContact O-N 3.14Å; E200-D202 VanDerWaalsContact C-N 3.3Å; E200-D202 PolarHBondContact O-N 3.49Å; D202-T205 PolarHBondContact O-N 2.88Å; D202-L206 PolarHBondContact O-N 3.15Å; D202-L282 HydrophobicContact CB-CD2 3.81Å; D202-K285 WeakPolarHBondContact OD2-CE 3.44Å; D202-K285 IonicContact OD2-NZ 3.05Å; D202-K285 PolarHBondContact OD2-NZ 3.35Å; D202-L286 HydrophobicContact CB-CD2 4.36Å
203	V	87.3	Confident	79.6	Confident	40 Å²	40	57.4 Å²	57.4	24%	0.242	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-46.3	169.9	172.6	0	0	0	0	111.5	F199 E200 T205 L206 N207 L286	F199-V203 HydrophobicContact CD1-CG2 4.19Å; F199-V203 HydrophobicContact CE1-CG2 3.72Å; F199-V203 HydrophobicContact CE2-CG2 4.36Å; F199-V203 HydrophobicContact CZ-CG2 3.81Å; F199-V203 WeakPolarHBondContact O-CG2 3.44Å; F199-V203 PolarHBondContact O-N 3.33Å; E200-V203 PolarHBondContact O-N 3.05Å; V203-T205 VanDerWaalsContact C-N 3.3Å; V203-T205 PolarHBondContact O-N 3.42Å; V203-L206 WeakPolarHBondContact O-CB 3.4Å; V203-L206 PolarHBondContact O-N 3.01Å; V203-N207 PolarHBondContact O-N 2.64Å; V203-L286 HydrophobicContact CG2-CD1 3.95Å; V203-L286 HydrophobicContact CG2-CD2 3.99Å
204	N	88	Confident	82.1	Confident	75 Å²	75	61.4 Å²	61.4	40%	0.401	30%	0.304	S	S	.	.	H	α-helix	trans	-65.4	-35.8	-179.8	-155.3	-19.9	0	0	0	111.4	E200 R201 R208	E200-N204 VanDerWaalsContact O-CB 3.27Å; E200-N204 WeakPolarHBondContact O-CB 3.48Å; E200-N204 PolarHBondContact O-N 3.04Å; R201-N204 PolarHBondContact O-N 3.01Å; N204-R208 WeakPolarHBondContact O-CG 3.15Å; N204-R208 PolarHBondContact O-N 3.45Å; N204-R208 VanDerWaalsContact O-N 3.08Å
205	T	89.7	Confident	84.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-41.7	172	-58.3	0	0	0	0	112.1	R201 D202 V203 R208 C209 L278 L282 F376 P382	R201-T205 VanDerWaalsContact O-CB 3.29Å; R201-T205 WeakPolarHBondContact O-CB 3.5Å; R201-T205 PolarHBondContact O-N 3.17Å; R201-T205 PolarHBondContact O-OG1 2.72Å; D202-T205 PolarHBondContact O-N 2.88Å; V203-T205 VanDerWaalsContact C-N 3.3Å; V203-T205 PolarHBondContact O-N 3.42Å; T205-R208 PolarHBondContact O-N 3.25Å; T205-C209 PolarHBondContact O-N 2.9Å; T205-L278 HydrophobicContact CG2-CD2 3.9Å; T205-L282 HydrophobicContact CG2-CD1 3.75Å; T205-F376 HydrophobicContact CG2-CE2 4.06Å; T205-F376 HydrophobicContact CG2-CZ 3.87Å; T205-P382 HydrophobicContact CG2-CG 3.88Å; T205-P382 WeakPolarHBondContact OG1-CB 3.3Å
206	L	93.1	Very high	86.7	Confident	3 Å²	3	57 Å²	57	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-44.5	176.6	176.2	61.8	0	0	0	111.5	D202 V203 R208 C209 F210 L282 L283 L286 I290	D202-L206 PolarHBondContact O-N 3.15Å; V203-L206 WeakPolarHBondContact O-CB 3.4Å; V203-L206 PolarHBondContact O-N 3.01Å; L206-R208 PolarHBondContact O-N 2.99Å; L206-C209 WeakPolarHBondContact O-CB 3.32Å; L206-C209 PolarHBondContact O-N 3.35Å; L206-C209 VanDerWaalsContact O-N 3.14Å; L206-F210 HydrophobicContact CD1-CE1 4.18Å; L206-F210 HydrophobicContact CD1-CE2 3.93Å; L206-F210 HydrophobicContact CD1-CZ 3.66Å; L206-F210 HydrophobicContact CD2-CE2 4.16Å; L206-F210 HydrophobicContact CD2-CZ 4.29Å; L206-F210 HydrophobicContact CG-CD2 4.35Å; L206-F210 HydrophobicContact CG-CE2 3.64Å; L206-F210 HydrophobicContact CG-CZ 3.88Å; L206-F210 WeakPolarHBondContact O-CD2 3.3Å; L206-F210 PolarHBondContact O-N 2.85Å; L206-F210 VanDerWaalsContact O-N 3.08Å; L206-L282 HydrophobicContact CB-CB 4.23Å; L206-L282 HydrophobicContact CB-CD1 4.03Å; L206-L282 HydrophobicContact CD1-CB 4.24Å; L206-L283 HydrophobicContact CD1-CD2 4.43Å; L206-L283 HydrophobicContact CD1-CG 4.12Å; L206-L283 HydrophobicContact CD2-CD2 3.75Å; L206-L283 HydrophobicContact CD2-CG 4.19Å; L206-L286 HydrophobicContact CD2-CD1 4.02Å; L206-I290 HydrophobicContact CD2-CD1 3.95Å
207	N	92.6	Very high	88.4	Confident	79 Å²	79	54 Å²	54	42%	0.422	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-44.1	176.5	-70.7	-19.6	0	0	0	112	V203 C209 F210 D211	V203-N207 PolarHBondContact O-N 2.64Å; N207-C209 VanDerWaalsContact C-N 3.28Å; N207-C209 PolarHBondContact O-N 2.93Å; N207-F210 WeakPolarHBondContact O-CB 3.41Å; N207-F210 PolarHBondContact O-N 3.32Å; N207-D211 PolarHBondContact O-N 3.15Å
208	R	91.1	Very high	89.6	Confident	62 Å²	62	50.7 Å²	50.7	23%	0.234	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-29.3	173.9	-70.9	-82.2	85.4	146.8	6.6	113.5	N204 T205 L206 D211 D212 F376 D378 F380	N204-R208 WeakPolarHBondContact O-CG 3.15Å; N204-R208 PolarHBondContact O-N 3.45Å; N204-R208 VanDerWaalsContact O-N 3.08Å; T205-R208 PolarHBondContact O-N 3.25Å; L206-R208 PolarHBondContact O-N 2.99Å; R208-D211 IonicContact CZ-OD2 2.72Å; R208-D211 IonicContact NE-OD2 2.72Å; R208-D211 PolarHBondContact NE-OD2 3.48Å; R208-D211 IonicContact NH2-OD1 3.6Å; R208-D211 PolarHBondContact NH2-OD1 2.99Å; R208-D211 VanDerWaalsContact NH2-OD1 3.13Å; R208-D211 IonicContact NH2-OD2 2.72Å; R208-D211 PolarHBondContact NH2-OD2 2.88Å; R208-D212 PolarHBondContact O-N 3.5Å; R208-D212 VanDerWaalsContact O-N 3.17Å; R208-F376 HydrophobicContact CB-CB 4.48Å; R208-F376 HydrophobicContact CB-CD1 3.7Å; R208-F376 HydrophobicContact CB-CD2 4.04Å; R208-F376 HydrophobicContact CB-CE1 3.83Å; R208-F376 HydrophobicContact CB-CE2 4.15Å; R208-F376 HydrophobicContact CB-CG 3.81Å; R208-F376 HydrophobicContact CB-CZ 4.04Å; R208-F376 WeakPolarHBondContact O-CD1 3.39Å; R208-D378 VanDerWaalsContact CD-OD2 3.26Å; R208-D378 WeakPolarHBondContact CD-OD2 3.44Å; R208-D378 IonicContact CZ-OD2 2.73Å; R208-D378 IonicContact NE-OD2 3.06Å; R208-D378 IonicContact NH1-OD2 3.52Å; R208-D378 PolarHBondContact NH1-OD2 3.5Å; R208-F380 HydrophobicContact CG-CD1 4.08Å
209	C	95.3	Very high	90.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.6	-44.5	168.2	-74.3	0	0	0	0	111.8	T205 L206 N207 D212 I213 K275 S279 F376	T205-C209 PolarHBondContact O-N 2.9Å; L206-C209 WeakPolarHBondContact O-CB 3.32Å; L206-C209 PolarHBondContact O-N 3.35Å; L206-C209 VanDerWaalsContact O-N 3.14Å; N207-C209 VanDerWaalsContact C-N 3.28Å; N207-C209 PolarHBondContact O-N 2.93Å; C209-D212 PolarHBondContact O-N 2.96Å; C209-I213 WeakPolarHBondContact O-CB 3.37Å; C209-I213 WeakPolarHBondContact O-CD1 3.4Å; C209-I213 WeakPolarHBondContact O-CG1 3.4Å; C209-I213 PolarHBondContact O-N 3.47Å; C209-K275 HydrophobicContact CB-CB 4.45Å; C209-S279 WeakPolarHBondContact CB-OG 3.33Å; C209-F376 HydrophobicContact CB-CE1 4.33Å
210	F	95.2	Very high	91.6	Very high	51 Å²	51	49.1 Å²	49.1	22%	0.224	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-45.4	176.2	-61.7	-47.6	0	0	0	111.7	L206 N207 D212 I213 E214 L298 L302	L206-F210 HydrophobicContact CD1-CE1 4.18Å; L206-F210 HydrophobicContact CD1-CE2 3.93Å; L206-F210 HydrophobicContact CD1-CZ 3.66Å; L206-F210 HydrophobicContact CD2-CE2 4.16Å; L206-F210 HydrophobicContact CD2-CZ 4.29Å; L206-F210 HydrophobicContact CG-CD2 4.35Å; L206-F210 HydrophobicContact CG-CE2 3.64Å; L206-F210 HydrophobicContact CG-CZ 3.88Å; L206-F210 WeakPolarHBondContact O-CD2 3.3Å; L206-F210 PolarHBondContact O-N 2.85Å; L206-F210 VanDerWaalsContact O-N 3.08Å; N207-F210 WeakPolarHBondContact O-CB 3.41Å; N207-F210 PolarHBondContact O-N 3.32Å; F210-D212 PolarHBondContact O-N 3.49Å; F210-I213 PolarHBondContact O-N 3.38Å; F210-E214 PolarHBondContact O-N 3.13Å; F210-L298 HydrophobicContact CE2-CD2 4.14Å; F210-L298 HydrophobicContact CZ-CB 4.38Å; F210-L298 HydrophobicContact CZ-CD1 4.48Å; F210-L298 HydrophobicContact CZ-CD2 3.86Å; F210-L298 HydrophobicContact CZ-CG 4.48Å; F210-L302 HydrophobicContact CD1-CD2 3.87Å; F210-L302 HydrophobicContact CD1-CG 4.48Å; F210-L302 HydrophobicContact CE1-CD1 4.04Å; F210-L302 HydrophobicContact CE1-CD2 3.75Å; F210-L302 HydrophobicContact CE1-CG 3.87Å
211	D	93.6	Very high	92.2	Very high	43 Å²	43	48.5 Å²	48.5	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-52.5	-53	174.9	-78.8	-78.1	0	0	0	112.4	N207 R208 I213 R215	N207-D211 PolarHBondContact O-N 3.15Å; R208-D211 IonicContact CZ-OD2 2.72Å; R208-D211 IonicContact NE-OD2 2.72Å; R208-D211 PolarHBondContact NE-OD2 3.48Å; R208-D211 IonicContact NH2-OD1 3.6Å; R208-D211 PolarHBondContact NH2-OD1 2.99Å; R208-D211 VanDerWaalsContact NH2-OD1 3.13Å; R208-D211 IonicContact NH2-OD2 2.72Å; R208-D211 PolarHBondContact NH2-OD2 2.88Å; D211-I213 VanDerWaalsContact C-N 3.32Å; D211-I213 PolarHBondContact O-N 3.48Å; D211-R215 WeakPolarHBondContact O-CB 3.48Å; D211-R215 VanDerWaalsContact O-CD 3.26Å; D211-R215 WeakPolarHBondContact O-CD 3.16Å; D211-R215 WeakPolarHBondContact O-CG 3.4Å; D211-R215 PolarHBondContact O-N 3.04Å
212	D	95.1	Very high	92.5	Very high	15 Å²	15	46.9 Å²	46.9	8%	0.08	23%	0.232	C	C	.	.	H	α-helix	trans	-66.7	-35.2	-178.1	-90.7	9.3	0	0	0	111.1	R208 C209 F210 F216 I272 K275 F376 N377	R208-D212 PolarHBondContact O-N 3.5Å; R208-D212 VanDerWaalsContact O-N 3.17Å; C209-D212 PolarHBondContact O-N 2.96Å; F210-D212 PolarHBondContact O-N 3.49Å; D212-F216 VanDerWaalsContact O-CB 3.27Å; D212-F216 WeakPolarHBondContact O-CB 3.32Å; D212-F216 PolarHBondContact O-N 3.02Å; D212-I272 HydrophobicContact CB-CD1 3.97Å; D212-I272 WeakPolarHBondContact O-CD1 3.33Å; D212-K275 HydrophobicContact CB-CD 4.09Å; D212-K275 WeakPolarHBondContact OD2-CE 3.43Å; D212-K275 IonicContact OD2-NZ 3.66Å; D212-K275 PolarHBondContact OD2-NZ 3.48Å; D212-F376 WeakPolarHBondContact OD2-CA 3.3Å; D212-N377 WeakPolarHBondContact OD1-CB 3.2Å; D212-N377 PolarHBondContact OD1-N 2.88Å; D212-N377 PolarHBondContact OD2-N 3.43Å
213	I	96.3	Very high	92.6	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-66.5	-48.7	177.3	-73	165.4	0	0	0	110.8	C209 F210 D211 R215 F216 V217 I272 F276 L302 P305	C209-I213 WeakPolarHBondContact O-CB 3.37Å; C209-I213 WeakPolarHBondContact O-CD1 3.4Å; C209-I213 WeakPolarHBondContact O-CG1 3.4Å; C209-I213 PolarHBondContact O-N 3.47Å; F210-I213 PolarHBondContact O-N 3.38Å; D211-I213 VanDerWaalsContact C-N 3.32Å; D211-I213 PolarHBondContact O-N 3.48Å; I213-R215 PolarHBondContact O-N 3.5Å; I213-F216 PolarHBondContact O-N 3.06Å; I213-V217 WeakPolarHBondContact O-CG2 3.49Å; I213-V217 PolarHBondContact O-N 3.29Å; I213-I272 HydrophobicContact CG1-CD1 3.88Å; I213-I272 HydrophobicContact CG1-CG1 3.92Å; I213-F276 HydrophobicContact CB-CZ 4.37Å; I213-F276 HydrophobicContact CD1-CD1 3.96Å; I213-F276 HydrophobicContact CD1-CD2 4.06Å; I213-F276 HydrophobicContact CD1-CE1 3.86Å; I213-F276 HydrophobicContact CD1-CE2 3.95Å; I213-F276 HydrophobicContact CD1-CG 4.06Å; I213-F276 HydrophobicContact CD1-CZ 3.86Å; I213-F276 HydrophobicContact CG1-CD2 4.24Å; I213-F276 HydrophobicContact CG1-CE1 4.47Å; I213-F276 HydrophobicContact CG1-CE2 3.82Å; I213-F276 HydrophobicContact CG1-CZ 3.96Å; I213-F276 HydrophobicContact CG2-CE1 4.14Å; I213-F276 HydrophobicContact CG2-CE2 4.03Å; I213-F276 HydrophobicContact CG2-CZ 3.47Å; I213-F276 VanDerWaalsContact CG2-CZ 3.47Å; I213-L302 HydrophobicContact CD1-CD2 3.77Å; I213-P305 HydrophobicContact CG2-CB 3.87Å; I213-P305 HydrophobicContact CG2-CG 4.01Å
214	E	95.3	Very high	92.7	Very high	145 Å²	145	46.8 Å²	46.8	68%	0.678	24%	0.235	S	C	*	.	H	α-helix	trans	-60.1	-47	177.1	-172.4	-174.1	-167.3	0	0	110.9	F210 F216 V217 A218	F210-E214 PolarHBondContact O-N 3.13Å; E214-F216 VanDerWaalsContact C-N 3.28Å; E214-F216 PolarHBondContact O-N 2.84Å; E214-V217 PolarHBondContact O-N 3.32Å; E214-A218 WeakPolarHBondContact O-CB 3.29Å; E214-A218 PolarHBondContact O-N 3.24Å
215	R	92.6	Very high	92.7	Very high	118 Å²	118	48.7 Å²	48.7	45%	0.445	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-37.8	176.1	-70.8	164.9	-171.5	-127.8	-1.1	112.4	D211 I213 R219	D211-R215 WeakPolarHBondContact O-CB 3.48Å; D211-R215 VanDerWaalsContact O-CD 3.26Å; D211-R215 WeakPolarHBondContact O-CD 3.16Å; D211-R215 WeakPolarHBondContact O-CG 3.4Å; D211-R215 PolarHBondContact O-N 3.04Å; I213-R215 PolarHBondContact O-N 3.5Å; R215-R219 WeakPolarHBondContact O-CG 3.2Å; R215-R219 PolarHBondContact O-N 3.46Å; R215-R219 VanDerWaalsContact O-N 3.12Å
216	F	95.3	Very high	92.6	Very high	5 Å²	5	49 Å²	49	2%	0.022	25%	0.248	C	C	.	.	H	α-helix	trans	-70.4	-43.1	178.4	-166.4	-96.1	0	0	0	112	D212 I213 E214 R219 I220 P264 E268 F269 I272 I309	D212-F216 VanDerWaalsContact O-CB 3.27Å; D212-F216 WeakPolarHBondContact O-CB 3.32Å; D212-F216 PolarHBondContact O-N 3.02Å; I213-F216 PolarHBondContact O-N 3.06Å; E214-F216 VanDerWaalsContact C-N 3.28Å; E214-F216 PolarHBondContact O-N 2.84Å; F216-R219 PolarHBondContact O-N 3.42Å; F216-I220 HydrophobicContact CD1-CD1 3.67Å; F216-I220 HydrophobicContact CD1-CG1 4.49Å; F216-I220 HydrophobicContact CE1-CD1 3.45Å; F216-I220 VanDerWaalsContact CE1-CD1 3.45Å; F216-I220 HydrophobicContact CE1-CG1 4.3Å; F216-I220 HydrophobicContact CZ-CD1 4.38Å; F216-I220 PolarHBondContact O-N 3.4Å; F216-P264 HydrophobicContact CD2-CB 4.45Å; F216-P264 HydrophobicContact CD2-CG 4.32Å; F216-P264 HydrophobicContact CE2-CB 3.44Å; F216-P264 VanDerWaalsContact CE2-CB 3.44Å; F216-P264 HydrophobicContact CE2-CG 3.63Å; F216-P264 HydrophobicContact CZ-CB 3.68Å; F216-P264 HydrophobicContact CZ-CG 3.77Å; F216-E268 HydrophobicContact CE2-CB 3.73Å; F216-E268 HydrophobicContact CZ-CB 4.47Å; F216-F269 AromaticContact CE1-CD1 3.69Å; F216-F269 HydrophobicContact CE1-CD1 3.69Å; F216-F269 AromaticContact CE1-CE1 3.74Å; F216-F269 HydrophobicContact CE1-CE1 3.74Å; F216-F269 HydrophobicContact CE1-CG 4.23Å; F216-F269 HydrophobicContact CE1-CZ 4.29Å; F216-F269 HydrophobicContact CZ-CB 4.37Å; F216-F269 AromaticContact CZ-CD1 3.69Å; F216-F269 HydrophobicContact CZ-CD1 3.69Å; F216-F269 AromaticContact CZ-CD2 3.97Å; F216-F269 HydrophobicContact CZ-CD2 3.97Å; F216-F269 AromaticContact CZ-CE1 3.91Å; F216-F269 HydrophobicContact CZ-CE1 3.91Å; F216-F269 HydrophobicContact CZ-CE2 4.18Å; F216-F269 AromaticContact CZ-CG 3.73Å; F216-F269 HydrophobicContact CZ-CG 3.73Å; F216-F269 HydrophobicContact CZ-CZ 4.15Å; F216-I272 HydrophobicContact CB-CD1 3.99Å; F216-I272 HydrophobicContact CB-CG1 3.94Å; F216-I272 HydrophobicContact CD1-CB 4.25Å; F216-I272 HydrophobicContact CD1-CG1 4.19Å; F216-I272 HydrophobicContact CD1-CG2 3.73Å; F216-I272 HydrophobicContact CD2-CB 4.36Å; F216-I272 HydrophobicContact CD2-CG2 4.5Å; F216-I272 HydrophobicContact CE1-CB 4.5Å; F216-I272 HydrophobicContact CE1-CG2 3.66Å; F216-I272 HydrophobicContact CE2-CG2 4.47Å; F216-I272 HydrophobicContact CG-CB 4.17Å; F216-I272 HydrophobicContact CG-CD1 4.38Å; F216-I272 HydrophobicContact CG-CG1 3.98Å; F216-I272 HydrophobicContact CG-CG2 4.15Å; F216-I272 HydrophobicContact CZ-CG2 4.07Å; F216-I309 HydrophobicContact CD1-CD1 3.73Å; F216-I309 HydrophobicContact CD1-CG1 3.86Å; F216-I309 HydrophobicContact CE1-CD1 4.34Å; F216-I309 HydrophobicContact CE1-CG1 4.12Å; F216-I309 HydrophobicContact CE1-CG2 4.2Å
217	V	95.4	Very high	92.4	Very high	15 Å²	15	52 Å²	52	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-43.9	173.4	172.1	0	0	0	0	111.3	I213 E214 R219 I220 Q221 P305 V308 I309	I213-V217 WeakPolarHBondContact O-CG2 3.49Å; I213-V217 PolarHBondContact O-N 3.29Å; E214-V217 PolarHBondContact O-N 3.32Å; V217-R219 VanDerWaalsContact C-N 3.29Å; V217-R219 PolarHBondContact O-N 3.27Å; V217-I220 PolarHBondContact O-N 2.96Å; V217-I220 VanDerWaalsContact O-N 3.15Å; V217-Q221 HydrophobicContact CG1-CG 4.25Å; V217-Q221 WeakPolarHBondContact O-CG 3.1Å; V217-Q221 PolarHBondContact O-N 3.49Å; V217-P305 HydrophobicContact CG2-CB 3.63Å; V217-V308 HydrophobicContact CG1-CG1 4.32Å; V217-I309 HydrophobicContact CG2-CD1 3.81Å; V217-I309 HydrophobicContact CG2-CG1 4.03Å
218	A	93.1	Very high	92.2	Very high	52 Å²	52	56.3 Å²	56.3	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-37.5	176.4	0	0	0	0	0	112.3	E214 S222	E214-A218 WeakPolarHBondContact O-CB 3.29Å; E214-A218 PolarHBondContact O-N 3.24Å; A218-S222 WeakPolarHBondContact O-CB 3.37Å; A218-S222 PolarHBondContact O-N 3.4Å
219	R	92.4	Very high	92	Very high	108 Å²	108	58.8 Å²	58.8	41%	0.408	29%	0.286	S	S	.	.	H	α-helix	trans	-65.1	-45.3	172.4	-75.1	-164	-69.4	151.5	-10.6	112.4	R215 F216 V217 S222 A223 E268	R215-R219 WeakPolarHBondContact O-CG 3.2Å; R215-R219 PolarHBondContact O-N 3.46Å; R215-R219 VanDerWaalsContact O-N 3.12Å; F216-R219 PolarHBondContact O-N 3.42Å; V217-R219 VanDerWaalsContact C-N 3.29Å; V217-R219 PolarHBondContact O-N 3.27Å; R219-S222 PolarHBondContact O-N 3.24Å; R219-A223 PolarHBondContact O-N 2.81Å; R219-E268 IonicContact CZ-OE1 3.97Å; R219-E268 IonicContact NH1-OE1 2.79Å; R219-E268 PolarHBondContact NH1-OE1 2.97Å; R219-E268 IonicContact NH1-OE2 2.9Å; R219-E268 IonicContact NH2-OE1 2.64Å; R219-E268 PolarHBondContact NH2-OE1 3.28Å
220	I	93.1	Very high	91.4	Very high	5 Å²	5	60.1 Å²	60.1	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-47.5	175.6	-74.3	165.8	0	0	0	111.3	F216 V217 S222 A223 A224 L263 P264 F269 V308 I309 A312	F216-I220 HydrophobicContact CD1-CD1 3.67Å; F216-I220 HydrophobicContact CD1-CG1 4.49Å; F216-I220 HydrophobicContact CE1-CD1 3.45Å; F216-I220 VanDerWaalsContact CE1-CD1 3.45Å; F216-I220 HydrophobicContact CE1-CG1 4.3Å; F216-I220 HydrophobicContact CZ-CD1 4.38Å; F216-I220 PolarHBondContact O-N 3.4Å; V217-I220 PolarHBondContact O-N 2.96Å; V217-I220 VanDerWaalsContact O-N 3.15Å; I220-S222 PolarHBondContact O-N 2.95Å; I220-A223 PolarHBondContact O-N 3.02Å; I220-A224 PolarHBondContact O-N 3.15Å; I220-L263 HydrophobicContact CG1-CD2 4.21Å; I220-P264 HydrophobicContact CG1-CG 4.38Å; I220-F269 HydrophobicContact CD1-CE1 3.88Å; I220-F269 HydrophobicContact CD1-CZ 4.12Å; I220-F269 HydrophobicContact CG1-CZ 4.37Å; I220-V308 HydrophobicContact CG2-CG1 4.27Å; I220-I309 HydrophobicContact CD1-CG1 3.8Å; I220-A312 HydrophobicContact CD1-CB 3.76Å; I220-A312 HydrophobicContact CG1-CB 4.11Å; I220-A312 HydrophobicContact CG2-CB 3.71Å
221	Q	92.5	Very high	91	Very high	106 Å²	106	64.4 Å²	64.4	50%	0.495	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-42.4	179.4	-70.3	178.2	0.9	0	0	111.5	V217 A223 A224 L225	V217-Q221 HydrophobicContact CG1-CG 4.25Å; V217-Q221 WeakPolarHBondContact O-CG 3.1Å; V217-Q221 PolarHBondContact O-N 3.49Å; Q221-A223 VanDerWaalsContact C-N 3.32Å; Q221-A223 PolarHBondContact O-N 3.04Å; Q221-A224 PolarHBondContact O-N 2.95Å; Q221-L225 WeakPolarHBondContact O-CB 3.44Å; Q221-L225 VanDerWaalsContact O-CG 3.3Å; Q221-L225 WeakPolarHBondContact O-CG 3.49Å; Q221-L225 PolarHBondContact O-N 3.26Å
222	S	88.9	Confident	90.7	Very high	54 Å²	54	66.6 Å²	66.6	38%	0.378	32%	0.323	S	S	.	.	H	α-helix	trans	-60.2	-40.3	173.6	-177.8	0	0	0	0	112.2	A218 R219 I220 A226	A218-S222 WeakPolarHBondContact O-CB 3.37Å; A218-S222 PolarHBondContact O-N 3.4Å; R219-S222 PolarHBondContact O-N 3.24Å; I220-S222 PolarHBondContact O-N 2.95Å; S222-A226 WeakPolarHBondContact O-CB 3.39Å; S222-A226 PolarHBondContact O-N 3.14Å
223	A	89.3	Confident	90.1	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-66.5	-47.1	177.9	0	0	0	0	0	112	R219 I220 Q221 L225 A226 Q227 R260 L263	R219-A223 PolarHBondContact O-N 2.81Å; I220-A223 PolarHBondContact O-N 3.02Å; Q221-A223 VanDerWaalsContact C-N 3.32Å; Q221-A223 PolarHBondContact O-N 3.04Å; A223-L225 VanDerWaalsContact C-N 3.33Å; A223-L225 PolarHBondContact O-N 2.89Å; A223-A226 PolarHBondContact O-N 3.42Å; A223-Q227 VanDerWaalsContact O-CG 3.32Å; A223-Q227 WeakPolarHBondContact O-CG 3.23Å; A223-Q227 PolarHBondContact O-N 2.86Å; A223-R260 VanDerWaalsContact CA-O 3.3Å; A223-R260 WeakPolarHBondContact CA-O 3.32Å; A223-L263 HydrophobicContact CB-CD2 4.19Å
224	A	89.3	Confident	89.5	Confident	40 Å²	40	72.2 Å²	72.2	33%	0.331	35%	0.35	S	S	.	.	H	α-helix	trans	-60.8	-40.2	177	0	0	0	0	0	112.5	I220 Q221 R228 W315	I220-A224 PolarHBondContact O-N 3.15Å; Q221-A224 PolarHBondContact O-N 2.95Å; A224-R228 WeakPolarHBondContact O-CB 3.46Å; A224-R228 PolarHBondContact O-N 2.93Å; A224-R228 VanDerWaalsContact O-N 3.07Å; A224-W315 HydrophobicContact CB-CH2 4.42Å; A224-W315 HydrophobicContact CB-CZ2 4.18Å
225	L	88.1	Confident	89	Confident	116 Å²	116	71.2 Å²	71.2	61%	0.607	35%	0.345	S	S	*	.	H	α-helix	trans	-64.9	-45.7	175.2	-72.3	172.3	0	0	0	112	Q221 A223 R228 E229	Q221-L225 WeakPolarHBondContact O-CB 3.44Å; Q221-L225 VanDerWaalsContact O-CG 3.3Å; Q221-L225 WeakPolarHBondContact O-CG 3.49Å; Q221-L225 PolarHBondContact O-N 3.26Å; A223-L225 VanDerWaalsContact C-N 3.33Å; A223-L225 PolarHBondContact O-N 2.89Å; L225-R228 PolarHBondContact O-N 3.32Å; L225-E229 PolarHBondContact O-N 3.38Å
226	A	88.3	Confident	88.5	Confident	6 Å²	6	73.5 Å²	73.5	5%	0.05	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-40	178.3	0	0	0	0	0	112.3	S222 A223 E229 I230 L257 R260 A261	S222-A226 WeakPolarHBondContact O-CB 3.39Å; S222-A226 PolarHBondContact O-N 3.14Å; A223-A226 PolarHBondContact O-N 3.42Å; A226-E229 PolarHBondContact O-N 2.84Å; A226-I230 WeakPolarHBondContact O-CG1 3.35Å; A226-I230 PolarHBondContact O-N 3.33Å; A226-L257 HydrophobicContact CB-CD1 3.97Å; A226-R260 HydrophobicContact CB-CB 3.91Å; A226-A261 HydrophobicContact CB-CB 3.91Å
227	Q	87.1	Confident	87.8	Confident	67 Å²	67	76.1 Å²	76.1	31%	0.313	36%	0.363	S	S	.	.	H	α-helix	trans	-59.4	-48.3	172.9	-72.8	176.2	11.8	0	0	111.7	A223 E229 I230 E231 A261	A223-Q227 VanDerWaalsContact O-CG 3.32Å; A223-Q227 WeakPolarHBondContact O-CG 3.23Å; A223-Q227 PolarHBondContact O-N 2.86Å; Q227-E229 PolarHBondContact O-N 2.89Å; Q227-I230 WeakPolarHBondContact O-CB 3.47Å; Q227-I230 PolarHBondContact O-N 2.94Å; Q227-I230 VanDerWaalsContact O-N 3.11Å; Q227-E231 PolarHBondContact O-N 3.29Å; Q227-A261 HydrophobicContact CG-CB 3.7Å; Q227-A261 PolarHBondContact NE2-O 3.41Å
228	R	88.1	Confident	87.2	Confident	169 Å²	169	83.7 Å²	83.7	64%	0.638	39%	0.39	S	S	*	.	H	α-helix	trans	-62	-27.6	177.2	-170.4	179.8	178.3	-172.6	0.9	113	A224 L225 Q232	A224-R228 WeakPolarHBondContact O-CB 3.46Å; A224-R228 PolarHBondContact O-N 2.93Å; A224-R228 VanDerWaalsContact O-N 3.07Å; L225-R228 PolarHBondContact O-N 3.32Å; R228-Q232 WeakPolarHBondContact O-CG 3.45Å; R228-Q232 PolarHBondContact O-N 3.03Å; R228-Q232 PolarHBondContact O-NE2 3.43Å
229	E	87.6	Confident	86.5	Confident	113 Å²	113	84 Å²	84	53%	0.528	39%	0.387	S	S	.	.	H	α-helix	trans	-76.7	-40.3	173.1	-170.1	164.2	-156.1	0	0	112.2	L225 A226 Q227 E231 Q232 Q233 L257	L225-E229 PolarHBondContact O-N 3.38Å; A226-E229 PolarHBondContact O-N 2.84Å; Q227-E229 PolarHBondContact O-N 2.89Å; E229-E231 VanDerWaalsContact C-N 3.33Å; E229-E231 PolarHBondContact O-N 3.06Å; E229-Q232 WeakPolarHBondContact O-CB 3.32Å; E229-Q232 PolarHBondContact O-N 3.15Å; E229-Q233 WeakPolarHBondContact O-CB 3.26Å; E229-Q233 PolarHBondContact O-N 2.88Å; E229-L257 HydrophobicContact CB-CD1 4.29Å; E229-L257 HydrophobicContact CB-CD2 4.26Å; E229-L257 HydrophobicContact CG-CD1 4.43Å; E229-L257 HydrophobicContact CG-CD2 4Å
230	I	83.8	Confident	85.6	Confident	29 Å²	29	79.7 Å²	79.7	15%	0.149	38%	0.375	C	S	.	.	H	α-helix	trans	-60.5	-41	172.9	-67.4	165.1	0	0	0	111.3	A226 Q227 Q233 N234 L257 F258 A261	A226-I230 WeakPolarHBondContact O-CG1 3.35Å; A226-I230 PolarHBondContact O-N 3.33Å; Q227-I230 WeakPolarHBondContact O-CB 3.47Å; Q227-I230 PolarHBondContact O-N 2.94Å; Q227-I230 VanDerWaalsContact O-N 3.11Å; I230-Q233 PolarHBondContact O-N 3.34Å; I230-N234 WeakPolarHBondContact CG2-ND2 3.43Å; I230-N234 WeakPolarHBondContact O-CB 3.4Å; I230-N234 PolarHBondContact O-N 3.02Å; I230-N234 PolarHBondContact O-ND2 3.05Å; I230-L257 HydrophobicContact CD1-CG 4.21Å; I230-L257 HydrophobicContact CG1-CD2 3.64Å; I230-L257 HydrophobicContact CG1-CG 3.73Å; I230-F258 HydrophobicContact CD1-CB 4.39Å; I230-F258 HydrophobicContact CD1-CD2 4.12Å; I230-A261 HydrophobicContact CD1-CB 3.4Å; I230-A261 VanDerWaalsContact CD1-CB 3.4Å
231	E	86.8	Confident	84.3	Confident	141 Å²	141	82.7 Å²	82.7	66%	0.659	39%	0.391	S	S	*	.	H	α-helix	trans	-62.5	-43.5	174.9	-71.7	-169.2	147.3	0	0	112.1	Q227 E229 N234 H235	Q227-E231 PolarHBondContact O-N 3.29Å; E229-E231 VanDerWaalsContact C-N 3.33Å; E229-E231 PolarHBondContact O-N 3.06Å; E231-N234 PolarHBondContact O-N 2.83Å; E231-H235 WeakPolarHBondContact O-CB 3.47Å; E231-H235 PolarHBondContact O-N 3.39Å
232	Q	86.4	Confident	83.2	Confident	89 Å²	89	88.2 Å²	88.2	42%	0.416	41%	0.407	S	S	.	.	H	α-helix	trans	-64.1	-41.2	174.8	-75.6	173.5	81.3	0	0	112.2	R228 E229 H235 R236	R228-Q232 WeakPolarHBondContact O-CG 3.45Å; R228-Q232 PolarHBondContact O-N 3.03Å; R228-Q232 PolarHBondContact O-NE2 3.43Å; E229-Q232 WeakPolarHBondContact O-CB 3.32Å; E229-Q232 PolarHBondContact O-N 3.15Å; Q232-H235 PolarHBondContact O-N 3.1Å; Q232-R236 WeakPolarHBondContact O-CB 3.39Å; Q232-R236 VanDerWaalsContact O-CG 3.27Å; Q232-R236 WeakPolarHBondContact O-CG 3.29Å; Q232-R236 PolarHBondContact O-N 3.44Å
233	Q	82.8	Confident	82.1	Confident	90 Å²	90	95.5 Å²	95.5	42%	0.421	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-43.6	176.1	-166.8	179.6	16.5	0	0	111	E229 I230 H235 R236 Y237 P251	E229-Q233 WeakPolarHBondContact O-CB 3.26Å; E229-Q233 PolarHBondContact O-N 2.88Å; I230-Q233 PolarHBondContact O-N 3.34Å; Q233-H235 PolarHBondContact O-N 2.95Å; Q233-R236 PolarHBondContact O-N 3.35Å; Q233-Y237 WeakPolarHBondContact O-CB 3.43Å; Q233-Y237 PolarHBondContact O-N 3.2Å; Q233-P251 HydrophobicContact CG-CB 4.49Å
234	N	84.3	Confident	80.6	Confident	47 Å²	47	101.9 Å²	101.9	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-61.7	-39.8	172.8	-85.6	-68.9	0	0	0	112.5	I230 E231 Y237 R238	I230-N234 WeakPolarHBondContact CG2-ND2 3.43Å; I230-N234 WeakPolarHBondContact O-CB 3.4Å; I230-N234 PolarHBondContact O-N 3.02Å; I230-N234 PolarHBondContact O-ND2 3.05Å; E231-N234 PolarHBondContact O-N 2.83Å; N234-Y237 PolarHBondContact O-N 3.1Å; N234-R238 WeakPolarHBondContact O-CB 3.16Å; N234-R238 WeakPolarHBondContact O-CG 3.17Å; N234-R238 PolarHBondContact O-N 3.33Å
235	H	84.9	Confident	79.2	Confident	125 Å²	125	107.6 Å²	107.6	58%	0.579	48%	0.478	S	S	*	.	H	α-helix	trans	-66	-43	175.6	-168.6	99.9	0	0	0	111.8	E231 Q232 Q233 R238 T239	E231-H235 WeakPolarHBondContact O-CB 3.47Å; E231-H235 PolarHBondContact O-N 3.39Å; Q232-H235 PolarHBondContact O-N 3.1Å; Q233-H235 PolarHBondContact O-N 2.95Å; H235-R238 PolarHBondContact O-N 3.27Å; H235-T239 WeakPolarHBondContact O-CB 3.34Å; H235-T239 WeakPolarHBondContact O-CG2 3.3Å; H235-T239 PolarHBondContact O-N 3Å; H235-T239 PolarHBondContact O-OG1 3.38Å
236	R	82.3	Confident	77.5	Confident	166 Å²	166	110.6 Å²	110.6	63%	0.626	49%	0.486	S	S	*	.	H	α-helix	trans	-60.6	-45.3	174.1	-70.8	172.1	-170.3	-167.8	6.7	111.2	Q232 Q233 T239 A240	Q232-R236 WeakPolarHBondContact O-CB 3.39Å; Q232-R236 VanDerWaalsContact O-CG 3.27Å; Q232-R236 WeakPolarHBondContact O-CG 3.29Å; Q232-R236 PolarHBondContact O-N 3.44Å; Q233-R236 PolarHBondContact O-N 3.35Å; R236-T239 WeakPolarHBondContact CA-OG1 3.39Å; R236-T239 PolarHBondContact O-N 3.09Å; R236-T239 PolarHBondContact O-OG1 3.01Å; R236-A240 WeakPolarHBondContact O-CB 3.3Å; R236-A240 PolarHBondContact O-N 3.44Å
237	Y	80.1	Confident	75.8	Confident	59 Å²	59	118 Å²	118	23%	0.231	52%	0.524	C	S	.	.	H	α-helix	trans	-62.1	-47.9	176.4	-179	-106.8	0	0	0	112.6	Q233 N234 T239 A240 N241 Q248 P250	Q233-Y237 WeakPolarHBondContact O-CB 3.43Å; Q233-Y237 PolarHBondContact O-N 3.2Å; N234-Y237 PolarHBondContact O-N 3.1Å; Y237-T239 VanDerWaalsContact C-N 3.31Å; Y237-T239 PolarHBondContact O-N 3.33Å; Y237-A240 PolarHBondContact O-N 3.16Å; Y237-N241 WeakPolarHBondContact CE1-ND2 3.41Å; Y237-N241 PolarHBondContact O-N 3.29Å; Y237-N241 PolarHBondContact OH-ND2 3.09Å; Y237-Q248 HydrophobicContact CD2-CB 4.26Å; Y237-Q248 HydrophobicContact CE2-CB 4.42Å; Y237-P250 HydrophobicContact CE2-CB 4.46Å
238	R	81.5	Confident	74.5	Confident	174 Å²	174	119.8 Å²	119.8	66%	0.657	53%	0.533	S	S	*	.	H	α-helix	trans	-61.8	-35.5	177.1	-72	170.8	-173.9	-179.7	4	112.7	N234 H235 R242	N234-R238 WeakPolarHBondContact O-CB 3.16Å; N234-R238 WeakPolarHBondContact O-CG 3.17Å; N234-R238 PolarHBondContact O-N 3.33Å; H235-R238 PolarHBondContact O-N 3.27Å; R238-R242 WeakPolarHBondContact O-CG 3.42Å; R238-R242 PolarHBondContact O-N 3.24Å
239	T	80.2	Confident	73.3	Confident	60 Å²	60	120 Å²	120	37%	0.368	54%	0.541	S	S	.	.	H	α-helix	trans	-80.9	-28.2	177.9	50.2	0	0	0	0	113.3	H235 R236 Y237	H235-T239 WeakPolarHBondContact O-CB 3.34Å; H235-T239 WeakPolarHBondContact O-CG2 3.3Å; H235-T239 PolarHBondContact O-N 3Å; H235-T239 PolarHBondContact O-OG1 3.38Å; R236-T239 WeakPolarHBondContact CA-OG1 3.39Å; R236-T239 PolarHBondContact O-N 3.09Å; R236-T239 PolarHBondContact O-OG1 3.01Å; Y237-T239 VanDerWaalsContact C-N 3.31Å; Y237-T239 PolarHBondContact O-N 3.33Å
240	A	72.3	Confident	72.1	Confident	17 Å²	17	118.8 Å²	118.8	14%	0.14	54%	0.543	C	S	.	.	H	α-helix	trans	-70.3	-45.7	171.9	0	0	0	0	0	112.4	R236 Y237 R242 R243	R236-A240 WeakPolarHBondContact O-CB 3.3Å; R236-A240 PolarHBondContact O-N 3.44Å; Y237-A240 PolarHBondContact O-N 3.16Å; A240-R242 PolarHBondContact O-N 2.58Å; A240-R243 PolarHBondContact O-N 3.01Å
241	N	66.8	Low	71.1	Confident	67 Å²	67	119.1 Å²	119.1	36%	0.358	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-25.1	177.3	-90.8	-19.7	0	0	0	113.3	Y237 R243	Y237-N241 WeakPolarHBondContact CE1-ND2 3.41Å; Y237-N241 PolarHBondContact O-N 3.29Å; Y237-N241 PolarHBondContact OH-ND2 3.09Å; N241-R243 PolarHBondContact O-N 3.25Å
242	R	67.6	Low	70.3	Confident	223 Å²	223	117.4 Å²	117.4	84%	0.842	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-1.1	171.1	-80.3	-177.4	171.5	-174	-2.2	114.7	R238 A240	R238-R242 WeakPolarHBondContact O-CG 3.42Å; R238-R242 PolarHBondContact O-N 3.24Å; A240-R242 PolarHBondContact O-N 2.58Å
243	R	66.8	Low	69.1	Low	206 Å²	206	117.2 Å²	117.2	78%	0.777	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	24.1	-178.6	-67.9	179.4	167.3	178	-4.2	112.6	A240 N241 K245	A240-R243 PolarHBondContact O-N 3.01Å; N241-R243 PolarHBondContact O-N 3.25Å; R243-K245 PolarHBondContact O-N 2.92Å
244	D	58.1	Low	68.4	Low	136 Å²	136	119.2 Å²	119.2	73%	0.727	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.6	17.2	-178.3	-81.6	-64.3	0	0	0	116.3	K246	D244-K246 PolarHBondContact O-N 2.72Å
245	K	59.8	Low	67.9	Low	160 Å²	160	117.9 Å²	117.9	70%	0.696	56%	0.56	S	S	*	*			trans	-78.3	66.3	171.3	-73.7	-163.9	172.3	-171	0	110.7	R243 N247	R243-K245 PolarHBondContact O-N 2.92Å; K245-N247 PolarHBondContact O-N 3.32Å
246	K	51.6	Low	67.4	Low	178 Å²	178	115.6 Å²	115.6	77%	0.774	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	21.5	-168.7	-138	170.6	-168.7	165.6	0	116.3	D244	D244-K246 PolarHBondContact O-N 2.72Å
247	N	53.1	Low	67.1	Low	161 Å²	161	109.8 Å²	109.8	86%	0.861	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.6	23.6	-169.9	-155.2	39.8	0	0	0	113.5	K245	K245-N247 PolarHBondContact O-N 3.32Å
248	Q	60	Low	67.1	Low	106 Å²	106	111.6 Å²	111.6	50%	0.495	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-94.6	132.9	160.3	-75.8	-173.2	-15.9	0	0	108.8	Y237	Y237-Q248 HydrophobicContact CD2-CB 4.26Å; Y237-Q248 HydrophobicContact CE2-CB 4.42Å
249	Q	61.9	Low	66.9	Low	174 Å²	174	109.2 Å²	109.2	81%	0.813	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-71.5	149.2	171	-69.2	173.8	-13.4	0	0	109.8
250	P	62.5	Low	66.8	Low	86 Å²	86	113.7 Å²	113.7	56%	0.558	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-63.1	151.1	169.1	29.3	-35	0	0	0	110.2	Y237 D252	Y237-P250 HydrophobicContact CE2-CB 4.46Å; P250-D252 PolarHBondContact O-N 3.32Å
251	P	63.7	Low	67.4	Low	37 Å²	37	113.3 Å²	113.3	24%	0.24	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-62.3	135.7	175.6	26.6	-33.7	0	0	0	111	Q233 P253	Q233-P251 HydrophobicContact CG-CB 4.49Å; P251-P253 WeakPolarHBondContact O-CD 3.26Å
252	D	69.2	Low	68.2	Low	104 Å²	104	116.1 Å²	116.1	56%	0.556	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-70.7	119.5	-178.9	177.6	10.3	0	0	0	111.3	P250 N254 G255	P250-D252 PolarHBondContact O-N 3.32Å; D252-N254 PolarHBondContact O-N 3.38Å; D252-N254 PolarHBondContact OD1-N 2.63Å; D252-G255 PolarHBondContact O-N 3.45Å; D252-G255 PolarHBondContact OD2-N 2.92Å
253	P	61.4	Low	69.1	Low	86 Å²	86	107.3 Å²	107.3	56%	0.558	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-14.6	177.3	29.6	-36.8	0	0	0	114.1	P251 F258	P251-P253 WeakPolarHBondContact O-CD 3.26Å; P253-F258 WeakPolarHBondContact O-CD1 3.26Å; P253-F258 VanDerWaalsContact O-CG 3.26Å; P253-F258 WeakPolarHBondContact O-CG 3.11Å
254	N	68.9	Low	70.1	Confident	131 Å²	131	97.9 Å²	97.9	70%	0.701	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-0.1	175.1	-68.6	-24.9	0	0	0	113.3	D252	D252-N254 PolarHBondContact O-N 3.38Å; D252-N254 PolarHBondContact OD1-N 2.63Å
255	G	73.1	Confident	71.6	Confident	20 Å²	20	97.1 Å²	97.1	21%	0.206	49%	0.488	C	S	.	.	S	Bend	trans	-62.8	154	-175.7	0	0	0	0	0	113.3	D252 L257 F258 M259	D252-G255 PolarHBondContact O-N 3.45Å; D252-G255 PolarHBondContact OD2-N 2.92Å; G255-L257 PolarHBondContact O-N 3.06Å; G255-F258 WeakPolarHBondContact O-CA 3.12Å; G255-F258 WeakPolarHBondContact O-CB 3.44Å; G255-F258 PolarHBondContact O-N 2.92Å; G255-M259 PolarHBondContact O-N 2.81Å; G255-M259 VanDerWaalsContact O-N 3.11Å
256	I	75.2	Confident	73.1	Confident	77 Å²	77	93 Å²	93	40%	0.395	47%	0.471	S	S	.	.	H	α-helix	trans	-54.4	-31.5	-176.8	-52.5	174.9	0	0	0	112.1	M259 R260 L453	I256-M259 PolarHBondContact O-N 2.96Å; I256-R260 WeakPolarHBondContact O-CG 3.46Å; I256-R260 PolarHBondContact O-N 3.06Å; I256-L453 HydrophobicContact CD1-CD2 3.93Å
257	L	75.6	Confident	74.9	Confident	43 Å²	43	88.3 Å²	88.3	23%	0.225	46%	0.461	C	S	.	.	H	α-helix	trans	-65.2	-41.7	174.7	-172.3	66.5	0	0	0	112.3	A226 E229 I230 G255 R260 A261	A226-L257 HydrophobicContact CB-CD1 3.97Å; E229-L257 HydrophobicContact CB-CD1 4.29Å; E229-L257 HydrophobicContact CB-CD2 4.26Å; E229-L257 HydrophobicContact CG-CD1 4.43Å; E229-L257 HydrophobicContact CG-CD2 4Å; I230-L257 HydrophobicContact CD1-CG 4.21Å; I230-L257 HydrophobicContact CG1-CD2 3.64Å; I230-L257 HydrophobicContact CG1-CG 3.73Å; G255-L257 PolarHBondContact O-N 3.06Å; L257-R260 PolarHBondContact O-N 3.04Å; L257-A261 WeakPolarHBondContact O-CB 3.36Å; L257-A261 PolarHBondContact O-N 2.9Å
258	F	79.5	Confident	76.7	Confident	97 Å²	97	83.3 Å²	83.3	43%	0.425	43%	0.432	S	S	.	.	H	α-helix	trans	-67.8	-37.3	175.5	-167.3	-90.5	0	0	0	111.7	I230 P253 G255 A261	I230-F258 HydrophobicContact CD1-CB 4.39Å; I230-F258 HydrophobicContact CD1-CD2 4.12Å; P253-F258 WeakPolarHBondContact O-CD1 3.26Å; P253-F258 VanDerWaalsContact O-CG 3.26Å; P253-F258 WeakPolarHBondContact O-CG 3.11Å; G255-F258 WeakPolarHBondContact O-CA 3.12Å; G255-F258 WeakPolarHBondContact O-CB 3.44Å; G255-F258 PolarHBondContact O-N 2.92Å; F258-A261 PolarHBondContact O-N 2.83Å
259	M	77.8	Confident	78.3	Confident	124 Å²	124	78.3 Å²	78.3	61%	0.611	41%	0.409	S	S	*	.	H	α-helix	trans	-62.2	-42.9	171.7	-61.5	-170.4	77.2	0	0	112.1	G255 I256 A261 Q262	G255-M259 PolarHBondContact O-N 2.81Å; G255-M259 VanDerWaalsContact O-N 3.11Å; I256-M259 PolarHBondContact O-N 2.96Å; M259-A261 VanDerWaalsContact C-N 3.25Å; M259-A261 PolarHBondContact O-N 3.26Å; M259-Q262 PolarHBondContact O-N 3Å
260	R	78.9	Confident	79.8	Confident	154 Å²	154	71.5 Å²	71.5	58%	0.581	38%	0.379	S	S	*	.	H	α-helix	trans	-67.9	-22.9	176.1	-75.9	-178.1	-179.1	126.8	6.7	113.9	A223 A226 I256 L257 Q262	A223-R260 VanDerWaalsContact CA-O 3.3Å; A223-R260 WeakPolarHBondContact CA-O 3.32Å; A226-R260 HydrophobicContact CB-CB 3.91Å; I256-R260 WeakPolarHBondContact O-CG 3.46Å; I256-R260 PolarHBondContact O-N 3.06Å; L257-R260 PolarHBondContact O-N 3.04Å; R260-Q262 VanDerWaalsContact C-N 3.27Å; R260-Q262 PolarHBondContact O-N 3.19Å
261	A	83.5	Confident	81.3	Confident	10 Å²	10	69.6 Å²	69.6	8%	0.083	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2.7	177.7	0	0	0	0	0	113.9	A226 Q227 I230 L257 F258 M259	A226-A261 HydrophobicContact CB-CB 3.91Å; Q227-A261 HydrophobicContact CG-CB 3.7Å; Q227-A261 PolarHBondContact NE2-O 3.41Å; I230-A261 HydrophobicContact CD1-CB 3.4Å; I230-A261 VanDerWaalsContact CD1-CB 3.4Å; L257-A261 WeakPolarHBondContact O-CB 3.36Å; L257-A261 PolarHBondContact O-N 2.9Å; F258-A261 PolarHBondContact O-N 2.83Å; M259-A261 VanDerWaalsContact C-N 3.25Å; M259-A261 PolarHBondContact O-N 3.26Å
262	Q	84.3	Confident	82.8	Confident	125 Å²	125	68.1 Å²	68.1	58%	0.584	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-78.4	134.2	175.2	-61.3	-175.1	6.6	0	0	110.9	M259 R260	M259-Q262 PolarHBondContact O-N 3Å; R260-Q262 VanDerWaalsContact C-N 3.27Å; R260-Q262 PolarHBondContact O-N 3.19Å
263	L	86.6	Confident	84.1	Confident	38 Å²	38	63.2 Å²	63.2	20%	0.199	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-76	160.7	172.2	-85.3	172.7	0	0	0	111.8	I220 A223 F269 W315	I220-L263 HydrophobicContact CG1-CD2 4.21Å; A223-L263 HydrophobicContact CB-CD2 4.19Å; L263-F269 HydrophobicContact CD2-CZ 4.42Å; L263-W315 HydrophobicContact CD1-CE3 3.95Å; L263-W315 HydrophobicContact CD1-CH2 3.72Å; L263-W315 HydrophobicContact CD1-CZ2 4.4Å; L263-W315 HydrophobicContact CD1-CZ3 3.46Å; L263-W315 VanDerWaalsContact CD1-CZ3 3.46Å; L263-W315 HydrophobicContact CD2-CH2 3.67Å; L263-W315 HydrophobicContact CD2-CZ2 4.06Å; L263-W315 HydrophobicContact CD2-CZ3 4.3Å; L263-W315 HydrophobicContact CG-CH2 3.8Å; L263-W315 HydrophobicContact CG-CZ3 3.95Å
264	P	88.4	Confident	85.7	Confident	9 Å²	9	61.9 Å²	61.9	6%	0.058	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-56	154.8	165.8	-21.6	33.6	0	0	0	112.6	F216 I220 E268 F269	F216-P264 HydrophobicContact CD2-CB 4.45Å; F216-P264 HydrophobicContact CD2-CG 4.32Å; F216-P264 HydrophobicContact CE2-CB 3.44Å; F216-P264 VanDerWaalsContact CE2-CB 3.44Å; F216-P264 HydrophobicContact CE2-CG 3.63Å; F216-P264 HydrophobicContact CZ-CB 3.68Å; F216-P264 HydrophobicContact CZ-CG 3.77Å; I220-P264 HydrophobicContact CG1-CG 4.38Å; P264-E268 WeakPolarHBondContact CA-OE2 3.36Å; P264-E268 HydrophobicContact CB-CB 4.16Å; P264-F269 HydrophobicContact CB-CD2 4.31Å; P264-F269 HydrophobicContact CB-CE2 4.05Å; P264-F269 HydrophobicContact CG-CE2 4.4Å; P264-F269 WeakPolarHBondContact O-CE2 3.36Å
265	L	89.3	Confident	87	Confident	119 Å²	119	56 Å²	56	62%	0.623	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-71.4	153.5	177	-63.1	173.2	0	0	0	111.4	S267 E268 F269	L265-S267 PolarHBondContact O-N 2.93Å; L265-S267 VanDerWaalsContact O-N 3.13Å; L265-E268 HydrophobicContact CB-CG 4.27Å; L265-E268 PolarHBondContact N-OE2 2.92Å; L265-E268 WeakPolarHBondContact O-CA 3.42Å; L265-E268 WeakPolarHBondContact O-CB 3.33Å; L265-E268 PolarHBondContact O-N 3.28Å; L265-F269 PolarHBondContact O-N 3.48Å; L265-F269 VanDerWaalsContact O-N 3.13Å
266	E	89.9	Confident	88.1	Confident	75 Å²	75	55 Å²	55	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-53.1	-35.4	176.8	176.6	170.6	-173.4	0	0	113.1	E268 F269 V270 L317 R319 V321	E266-E268 VanDerWaalsContact C-N 3.27Å; E266-E268 PolarHBondContact O-N 2.88Å; E266-F269 PolarHBondContact O-N 3.34Å; E266-V270 WeakPolarHBondContact O-CG2 3.2Å; E266-V270 PolarHBondContact O-N 2.96Å; E266-L317 HydrophobicContact CB-CD1 4.09Å; E266-L317 HydrophobicContact CB-CD2 4.18Å; E266-L317 HydrophobicContact CG-CD1 4.14Å; E266-R319 IonicContact OE1-CZ 2.63Å; E266-R319 IonicContact OE1-NE 2.84Å; E266-R319 IonicContact OE1-NH2 3.68Å; E266-R319 PolarHBondContact OE1-NH2 2.74Å; E266-R319 IonicContact OE2-CZ 2.68Å; E266-R319 IonicContact OE2-NH2 3.58Å; E266-R319 PolarHBondContact OE2-NH2 3.32Å; E266-V321 HydrophobicContact CG-CG1 4.3Å
267	S	90.2	Very high	89.1	Confident	79 Å²	79	51.3 Å²	51.3	55%	0.552	25%	0.253	S	S	*	.	H	α-helix	trans	-63.5	-30.4	174.7	51.8	0	0	0	0	113.6	L265 D271	L265-S267 PolarHBondContact O-N 2.93Å; L265-S267 VanDerWaalsContact O-N 3.13Å; S267-D271 PolarHBondContact O-N 3.12Å
268	E	91.8	Very high	90.1	Very high	56 Å²	56	49.9 Å²	49.9	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-79.2	-39.2	176.5	-53.5	179.5	76.2	0	0	111.1	F216 R219 P264 L265 E266 V270 D271 I272	F216-E268 HydrophobicContact CE2-CB 3.73Å; F216-E268 HydrophobicContact CZ-CB 4.47Å; R219-E268 IonicContact CZ-OE1 3.97Å; R219-E268 IonicContact NH1-OE1 2.79Å; R219-E268 PolarHBondContact NH1-OE1 2.97Å; R219-E268 IonicContact NH1-OE2 2.9Å; R219-E268 IonicContact NH2-OE1 2.64Å; R219-E268 PolarHBondContact NH2-OE1 3.28Å; P264-E268 WeakPolarHBondContact CA-OE2 3.36Å; P264-E268 HydrophobicContact CB-CB 4.16Å; L265-E268 HydrophobicContact CB-CG 4.27Å; L265-E268 PolarHBondContact N-OE2 2.92Å; L265-E268 WeakPolarHBondContact O-CA 3.42Å; L265-E268 WeakPolarHBondContact O-CB 3.33Å; L265-E268 PolarHBondContact O-N 3.28Å; E266-E268 VanDerWaalsContact C-N 3.27Å; E266-E268 PolarHBondContact O-N 2.88Å; E268-V270 VanDerWaalsContact C-N 3.29Å; E268-V270 PolarHBondContact O-N 3.26Å; E268-D271 PolarHBondContact O-N 2.91Å; E268-I272 PolarHBondContact O-N 2.88Å
269	F	93.6	Very high	90.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-42.6	168.5	-82.3	-81.4	0	0	0	111.4	F216 I220 L263 P264 L265 E266 I272 L273 I309 A312 C313 L317 V321	F216-F269 AromaticContact CE1-CD1 3.69Å; F216-F269 HydrophobicContact CE1-CD1 3.69Å; F216-F269 AromaticContact CE1-CE1 3.74Å; F216-F269 HydrophobicContact CE1-CE1 3.74Å; F216-F269 HydrophobicContact CE1-CG 4.23Å; F216-F269 HydrophobicContact CE1-CZ 4.29Å; F216-F269 HydrophobicContact CZ-CB 4.37Å; F216-F269 AromaticContact CZ-CD1 3.69Å; F216-F269 HydrophobicContact CZ-CD1 3.69Å; F216-F269 AromaticContact CZ-CD2 3.97Å; F216-F269 HydrophobicContact CZ-CD2 3.97Å; F216-F269 AromaticContact CZ-CE1 3.91Å; F216-F269 HydrophobicContact CZ-CE1 3.91Å; F216-F269 HydrophobicContact CZ-CE2 4.18Å; F216-F269 AromaticContact CZ-CG 3.73Å; F216-F269 HydrophobicContact CZ-CG 3.73Å; F216-F269 HydrophobicContact CZ-CZ 4.15Å; I220-F269 HydrophobicContact CD1-CE1 3.88Å; I220-F269 HydrophobicContact CD1-CZ 4.12Å; I220-F269 HydrophobicContact CG1-CZ 4.37Å; L263-F269 HydrophobicContact CD2-CZ 4.42Å; P264-F269 HydrophobicContact CB-CD2 4.31Å; P264-F269 HydrophobicContact CB-CE2 4.05Å; P264-F269 HydrophobicContact CG-CE2 4.4Å; P264-F269 WeakPolarHBondContact O-CE2 3.36Å; L265-F269 PolarHBondContact O-N 3.48Å; L265-F269 VanDerWaalsContact O-N 3.13Å; E266-F269 PolarHBondContact O-N 3.34Å; F269-I272 WeakPolarHBondContact O-CG2 3.38Å; F269-L273 WeakPolarHBondContact O-CB 3.3Å; F269-L273 WeakPolarHBondContact O-CD1 3.34Å; F269-L273 VanDerWaalsContact O-CG 3.22Å; F269-L273 WeakPolarHBondContact O-CG 3.4Å; F269-L273 PolarHBondContact O-N 3.17Å; F269-I309 HydrophobicContact CD1-CG2 4.02Å; F269-I309 HydrophobicContact CE1-CG2 4.26Å; F269-A312 HydrophobicContact CE1-CB 3.91Å; F269-A312 HydrophobicContact CZ-CB 3.98Å; F269-C313 WeakPolarHBondContact CD1-SG 3.34Å; F269-L317 HydrophobicContact CB-CD1 4.29Å; F269-L317 HydrophobicContact CD2-CD1 3.89Å; F269-L317 HydrophobicContact CD2-CG 4.45Å; F269-L317 HydrophobicContact CE2-CD1 4.41Å; F269-L317 HydrophobicContact CG-CD1 4.11Å; F269-V321 HydrophobicContact CB-CG2 4.16Å
270	V	93	Very high	91.8	Very high	32 Å²	32	39.5 Å²	39.5	19%	0.194	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-47.3	174.3	166	0	0	0	0	111.2	E266 E268 L273 K274	E266-V270 WeakPolarHBondContact O-CG2 3.2Å; E266-V270 PolarHBondContact O-N 2.96Å; E268-V270 VanDerWaalsContact C-N 3.29Å; E268-V270 PolarHBondContact O-N 3.26Å; V270-L273 PolarHBondContact O-N 2.92Å; V270-K274 WeakPolarHBondContact O-CG 3.45Å; V270-K274 PolarHBondContact O-N 3.38Å
271	D	93	Very high	92.5	Very high	46 Å²	46	33.6 Å²	33.6	25%	0.246	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-42.2	-179.6	-174.7	61.1	0	0	0	113.2	S267 E268 L273 K274 K275 Y372	S267-D271 PolarHBondContact O-N 3.12Å; E268-D271 PolarHBondContact O-N 2.91Å; D271-L273 VanDerWaalsContact C-N 3.27Å; D271-L273 PolarHBondContact O-N 2.65Å; D271-K274 WeakPolarHBondContact O-CA 3.47Å; D271-K274 WeakPolarHBondContact O-CB 3.4Å; D271-K274 PolarHBondContact O-N 2.7Å; D271-K275 PolarHBondContact O-N 3.03Å; D271-K275 VanDerWaalsContact OD2-CE 3.22Å; D271-K275 WeakPolarHBondContact OD2-CE 3.22Å; D271-K275 IonicContact OD2-NZ 3.56Å; D271-K275 PolarHBondContact OD2-NZ 3.45Å; D271-Y372 PolarHBondContact OD1-OH 3.19Å
272	I	95.9	Very high	93	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-64.5	-35.7	179.1	-153.7	70.6	0	0	0	111.7	D212 I213 F216 E268 F269 K274 K275 F276 I309	D212-I272 HydrophobicContact CB-CD1 3.97Å; D212-I272 WeakPolarHBondContact O-CD1 3.33Å; I213-I272 HydrophobicContact CG1-CD1 3.88Å; I213-I272 HydrophobicContact CG1-CG1 3.92Å; F216-I272 HydrophobicContact CB-CD1 3.99Å; F216-I272 HydrophobicContact CB-CG1 3.94Å; F216-I272 HydrophobicContact CD1-CB 4.25Å; F216-I272 HydrophobicContact CD1-CG1 4.19Å; F216-I272 HydrophobicContact CD1-CG2 3.73Å; F216-I272 HydrophobicContact CD2-CB 4.36Å; F216-I272 HydrophobicContact CD2-CG2 4.5Å; F216-I272 HydrophobicContact CE1-CB 4.5Å; F216-I272 HydrophobicContact CE1-CG2 3.66Å; F216-I272 HydrophobicContact CE2-CG2 4.47Å; F216-I272 HydrophobicContact CG-CB 4.17Å; F216-I272 HydrophobicContact CG-CD1 4.38Å; F216-I272 HydrophobicContact CG-CG1 3.98Å; F216-I272 HydrophobicContact CG-CG2 4.15Å; F216-I272 HydrophobicContact CZ-CG2 4.07Å; E268-I272 PolarHBondContact O-N 2.88Å; F269-I272 WeakPolarHBondContact O-CG2 3.38Å; I272-K274 VanDerWaalsContact C-N 3.29Å; I272-K274 PolarHBondContact O-N 3.13Å; I272-K275 HydrophobicContact CD1-CB 4.48Å; I272-K275 HydrophobicContact CD1-CD 4.11Å; I272-K275 WeakPolarHBondContact O-CA 3.38Å; I272-K275 WeakPolarHBondContact O-CB 3.06Å; I272-K275 PolarHBondContact O-N 3.47Å; I272-F276 HydrophobicContact CG1-CE2 4.41Å; I272-F276 VanDerWaalsContact O-CD2 3.29Å; I272-F276 WeakPolarHBondContact O-CD2 3.38Å; I272-F276 PolarHBondContact O-N 3.47Å; I272-I309 HydrophobicContact CG2-CD1 4.26Å; I272-I309 HydrophobicContact CG2-CG2 4.19Å
273	L	96.1	Very high	93.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.6	-30.7	173.3	-73.2	168.7	0	0	0	112.2	F269 V270 D271 F276 K277 L306 I309 V321 A322 V325 W357	F269-L273 WeakPolarHBondContact O-CB 3.3Å; F269-L273 WeakPolarHBondContact O-CD1 3.34Å; F269-L273 VanDerWaalsContact O-CG 3.22Å; F269-L273 WeakPolarHBondContact O-CG 3.4Å; F269-L273 PolarHBondContact O-N 3.17Å; V270-L273 PolarHBondContact O-N 2.92Å; D271-L273 VanDerWaalsContact C-N 3.27Å; D271-L273 PolarHBondContact O-N 2.65Å; L273-F276 HydrophobicContact CD2-CD2 4.46Å; L273-F276 PolarHBondContact O-N 3.26Å; L273-K277 WeakPolarHBondContact O-CG 3.4Å; L273-K277 PolarHBondContact O-N 2.71Å; L273-L306 HydrophobicContact CD2-CD1 3.68Å; L273-I309 HydrophobicContact CD2-CG2 4.44Å; L273-V321 HydrophobicContact CD1-CG2 3.83Å; L273-A322 HydrophobicContact CD1-CB 4.04Å; L273-A322 HydrophobicContact CD2-CB 4.43Å; L273-V325 HydrophobicContact CB-CB 4.49Å; L273-V325 HydrophobicContact CB-CG1 4.18Å; L273-V325 HydrophobicContact CB-CG2 3.95Å; L273-V325 HydrophobicContact CD1-CG2 4.15Å; L273-W357 HydrophobicContact CB-CH2 4.1Å; L273-W357 HydrophobicContact CB-CZ2 4.01Å; L273-W357 HydrophobicContact CD2-CH2 3.85Å; L273-W357 HydrophobicContact CD2-CZ2 4.05Å; L273-W357 WeakPolarHBondContact O-CH2 3.31Å
274	K	95.3	Very high	93.8	Very high	59 Å²	59	25.8 Å²	25.8	26%	0.257	14%	0.138	S	C	.	.	H	α-helix	trans	-67.7	-36.5	169.1	-57.8	-178	-173.2	159.8	0	112	V270 D271 I272 K277 L278 V325 S327 Y372	V270-K274 WeakPolarHBondContact O-CG 3.45Å; V270-K274 PolarHBondContact O-N 3.38Å; D271-K274 WeakPolarHBondContact O-CA 3.47Å; D271-K274 WeakPolarHBondContact O-CB 3.4Å; D271-K274 PolarHBondContact O-N 2.7Å; I272-K274 VanDerWaalsContact C-N 3.29Å; I272-K274 PolarHBondContact O-N 3.13Å; K274-K277 PolarHBondContact O-N 2.85Å; K274-L278 WeakPolarHBondContact O-CB 3.44Å; K274-L278 PolarHBondContact O-N 3.45Å; K274-V325 HydrophobicContact CB-CG1 4.49Å; K274-V325 HydrophobicContact CG-CG1 3.57Å; K274-S327 WeakPolarHBondContact CD-O 3.14Å; K274-S327 WeakPolarHBondContact CG-O 3.5Å; K274-Y372 HydrophobicContact CB-CD1 4.2Å; K274-Y372 HydrophobicContact CB-CD2 4.2Å; K274-Y372 HydrophobicContact CB-CE1 3.69Å; K274-Y372 HydrophobicContact CB-CE2 3.71Å; K274-Y372 HydrophobicContact CB-CG 4.43Å; K274-Y372 VanDerWaalsContact CB-CZ 3.42Å; K274-Y372 HydrophobicContact CD-CD2 3.69Å; K274-Y372 HydrophobicContact CD-CE2 3.42Å; K274-Y372 VanDerWaalsContact CD-CE2 3.42Å; K274-Y372 HydrophobicContact CG-CE2 4.2Å
275	K	95.9	Very high	93.9	Very high	6 Å²	6	30.8 Å²	30.8	3%	0.026	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-38.9	175.3	-71.6	168.1	175.2	160.6	0	111.6	C209 D212 D271 I272 L278 S279 Y372 I375 F376	C209-K275 HydrophobicContact CB-CB 4.45Å; D212-K275 HydrophobicContact CB-CD 4.09Å; D212-K275 WeakPolarHBondContact OD2-CE 3.43Å; D212-K275 IonicContact OD2-NZ 3.66Å; D212-K275 PolarHBondContact OD2-NZ 3.48Å; D271-K275 PolarHBondContact O-N 3.03Å; D271-K275 VanDerWaalsContact OD2-CE 3.22Å; D271-K275 WeakPolarHBondContact OD2-CE 3.22Å; D271-K275 IonicContact OD2-NZ 3.56Å; D271-K275 PolarHBondContact OD2-NZ 3.45Å; I272-K275 HydrophobicContact CD1-CB 4.48Å; I272-K275 HydrophobicContact CD1-CD 4.11Å; I272-K275 WeakPolarHBondContact O-CA 3.38Å; I272-K275 WeakPolarHBondContact O-CB 3.06Å; I272-K275 PolarHBondContact O-N 3.47Å; K275-L278 PolarHBondContact O-N 3.03Å; K275-S279 PolarHBondContact O-N 2.95Å; K275-S279 PolarHBondContact O-OG 2.9Å; K275-S279 VanDerWaalsContact O-OG 3.14Å; K275-Y372 WeakPolarHBondContact CG-OH 3.5Å; K275-I375 PolarHBondContact NZ-O 3.27Å; K275-F376 HydrophobicContact CD-CD1 4.26Å; K275-F376 HydrophobicContact CD-CE1 4.11Å; K275-F376 HydrophobicContact CG-CE1 4.27Å
276	F	97.3	Very high	93.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.9	-49.8	167.8	-82.8	-79.5	0	0	0	112.8	I213 I272 L273 L278 S279 F280 L302 P305 L306 I309 W357	I213-F276 HydrophobicContact CB-CZ 4.37Å; I213-F276 HydrophobicContact CD1-CD1 3.96Å; I213-F276 HydrophobicContact CD1-CD2 4.06Å; I213-F276 HydrophobicContact CD1-CE1 3.86Å; I213-F276 HydrophobicContact CD1-CE2 3.95Å; I213-F276 HydrophobicContact CD1-CG 4.06Å; I213-F276 HydrophobicContact CD1-CZ 3.86Å; I213-F276 HydrophobicContact CG1-CD2 4.24Å; I213-F276 HydrophobicContact CG1-CE1 4.47Å; I213-F276 HydrophobicContact CG1-CE2 3.82Å; I213-F276 HydrophobicContact CG1-CZ 3.96Å; I213-F276 HydrophobicContact CG2-CE1 4.14Å; I213-F276 HydrophobicContact CG2-CE2 4.03Å; I213-F276 HydrophobicContact CG2-CZ 3.47Å; I213-F276 VanDerWaalsContact CG2-CZ 3.47Å; I272-F276 HydrophobicContact CG1-CE2 4.41Å; I272-F276 VanDerWaalsContact O-CD2 3.29Å; I272-F276 WeakPolarHBondContact O-CD2 3.38Å; I272-F276 PolarHBondContact O-N 3.47Å; L273-F276 HydrophobicContact CD2-CD2 4.46Å; L273-F276 PolarHBondContact O-N 3.26Å; F276-L278 VanDerWaalsContact C-N 3.28Å; F276-L278 PolarHBondContact O-N 3.4Å; F276-S279 WeakPolarHBondContact O-CB 3.4Å; F276-S279 PolarHBondContact O-N 2.98Å; F276-S279 VanDerWaalsContact O-N 3.13Å; F276-F280 HydrophobicContact CB-CE2 4.48Å; F276-F280 HydrophobicContact CD1-CZ 4.31Å; F276-F280 WeakPolarHBondContact O-CD2 3.41Å; F276-F280 WeakPolarHBondContact O-CG 3.29Å; F276-F280 PolarHBondContact O-N 2.95Å; F276-L302 HydrophobicContact CD1-CB 4.31Å; F276-L302 HydrophobicContact CD1-CD2 3.88Å; F276-L302 HydrophobicContact CE1-CB 4.14Å; F276-L302 HydrophobicContact CE1-CD2 3.67Å; F276-L302 VanDerWaalsContact CE1-O 3.31Å; F276-L302 WeakPolarHBondContact CE1-O 3.36Å; F276-P305 HydrophobicContact CE1-CG 4.28Å; F276-P305 HydrophobicContact CZ-CB 4.26Å; F276-P305 HydrophobicContact CZ-CG 4.22Å; F276-L306 HydrophobicContact CD1-CB 4.24Å; F276-L306 HydrophobicContact CD1-CD1 4.36Å; F276-L306 HydrophobicContact CD2-CD1 4.18Å; F276-L306 HydrophobicContact CE1-CB 3.77Å; F276-L306 HydrophobicContact CE1-CD1 4.49Å; F276-L306 HydrophobicContact CE2-CD1 4.33Å; F276-L306 HydrophobicContact CG-CD1 4.21Å; F276-L306 HydrophobicContact CZ-CB 4Å; F276-L306 HydrophobicContact CZ-CD1 4.47Å; F276-I309 HydrophobicContact CE2-CD1 3.56Å; F276-I309 HydrophobicContact CZ-CD1 3.94Å; F276-W357 HydrophobicContact CB-CH2 4.21Å; F276-W357 HydrophobicContact CB-CZ3 4.23Å
277	K	95.7	Very high	93.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.5	-37.8	179.1	-64.6	-175.8	92	-168.4	0	112.4	L273 K274 N281 V325 A326 P328 L330 A356 W357	L273-K277 WeakPolarHBondContact O-CG 3.4Å; L273-K277 PolarHBondContact O-N 2.71Å; K274-K277 PolarHBondContact O-N 2.85Å; K277-N281 PolarHBondContact O-N 3.22Å; K277-V325 HydrophobicContact CD-CG1 4.11Å; K277-V325 PolarHBondContact NZ-O 3.34Å; K277-A326 PolarHBondContact NZ-O 3.37Å; K277-P328 HydrophobicContact CB-CG 3.73Å; K277-P328 WeakPolarHBondContact CD-O 3.49Å; K277-P328 WeakPolarHBondContact CE-O 3.39Å; K277-P328 PolarHBondContact NZ-O 3Å; K277-L330 HydrophobicContact CB-CD2 3.57Å; K277-L330 HydrophobicContact CG-CD2 3.9Å; K277-L330 WeakPolarHBondContact O-CD2 3.27Å; K277-A356 WeakPolarHBondContact CE-O 3.47Å; K277-A356 PolarHBondContact NZ-O 2.81Å; K277-W357 HydrophobicContact CB-CZ3 4.5Å; K277-W357 HydrophobicContact CD-CD2 3.84Å; K277-W357 HydrophobicContact CD-CE3 3.98Å; K277-W357 HydrophobicContact CD-CH2 3.99Å; K277-W357 HydrophobicContact CD-CZ2 3.8Å; K277-W357 HydrophobicContact CD-CZ3 4.06Å; K277-W357 HydrophobicContact CG-CD2 3.91Å; K277-W357 HydrophobicContact CG-CE3 3.5Å; K277-W357 VanDerWaalsContact CG-CE3 3.5Å; K277-W357 HydrophobicContact CG-CH2 3.45Å; K277-W357 VanDerWaalsContact CG-CH2 3.45Å; K277-W357 HydrophobicContact CG-CZ2 3.83Å; K277-W357 HydrophobicContact CG-CZ3 3.26Å
278	L	95.4	Very high	93.6	Very high	13 Å²	13	27.1 Å²	27.1	7%	0.068	13%	0.132	C	C	.	.	H	α-helix	trans	-65.5	-45	173	-178.1	59.5	0	0	0	111.6	T205 K274 K275 F276 F280 N281 L282 P328 Y372 P374	T205-L278 HydrophobicContact CG2-CD2 3.9Å; K274-L278 WeakPolarHBondContact O-CB 3.44Å; K274-L278 PolarHBondContact O-N 3.45Å; K275-L278 PolarHBondContact O-N 3.03Å; F276-L278 VanDerWaalsContact C-N 3.28Å; F276-L278 PolarHBondContact O-N 3.4Å; L278-F280 PolarHBondContact O-N 3.27Å; L278-N281 PolarHBondContact O-N 3.41Å; L278-L282 HydrophobicContact CD1-CD1 4.04Å; L278-L282 HydrophobicContact CD1-CG 4.09Å; L278-L282 HydrophobicContact CD2-CD1 4.47Å; L278-L282 HydrophobicContact CG-CD1 3.8Å; L278-L282 HydrophobicContact CG-CG 4.3Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 VanDerWaalsContact O-CG 3.31Å; L278-L282 WeakPolarHBondContact O-CG 3.37Å; L278-L282 PolarHBondContact O-N 2.89Å; L278-P328 HydrophobicContact CB-CG 4.36Å; L278-Y372 HydrophobicContact CB-CD1 4.34Å; L278-Y372 HydrophobicContact CB-CE1 4.31Å; L278-Y372 HydrophobicContact CD2-CD1 4.19Å; L278-Y372 HydrophobicContact CD2-CE1 4.03Å; L278-P374 HydrophobicContact CD2-CB 4.13Å; L278-P374 HydrophobicContact CD2-CG 3.65Å
279	S	96.8	Very high	92.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.1	-42.6	176.2	-64.7	0	0	0	0	112.6	C209 K275 F276 N281 L282 L283	C209-S279 WeakPolarHBondContact CB-OG 3.33Å; K275-S279 PolarHBondContact O-N 2.95Å; K275-S279 PolarHBondContact O-OG 2.9Å; K275-S279 VanDerWaalsContact O-OG 3.14Å; F276-S279 WeakPolarHBondContact O-CB 3.4Å; F276-S279 PolarHBondContact O-N 2.98Å; F276-S279 VanDerWaalsContact O-N 3.13Å; S279-N281 PolarHBondContact O-N 3.4Å; S279-L282 PolarHBondContact O-N 3.01Å; S279-L283 WeakPolarHBondContact O-CB 3.27Å; S279-L283 VanDerWaalsContact O-CG 3.3Å; S279-L283 WeakPolarHBondContact O-CG 3.35Å; S279-L283 PolarHBondContact O-N 2.81Å
280	F	96.3	Very high	92.5	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.009	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-41.3	177.1	-61.4	-31.1	0	0	0	112.2	F276 L278 A284 L299 L302 F303 L306 L330 M338 W357	F276-F280 HydrophobicContact CB-CE2 4.48Å; F276-F280 HydrophobicContact CD1-CZ 4.31Å; F276-F280 WeakPolarHBondContact O-CD2 3.41Å; F276-F280 WeakPolarHBondContact O-CG 3.29Å; F276-F280 PolarHBondContact O-N 2.95Å; L278-F280 PolarHBondContact O-N 3.27Å; F280-A284 WeakPolarHBondContact O-CB 3.42Å; F280-A284 PolarHBondContact O-N 2.65Å; F280-L299 HydrophobicContact CD1-CD1 3.47Å; F280-L299 VanDerWaalsContact CD1-CD1 3.47Å; F280-L299 HydrophobicContact CE1-CD1 3.58Å; F280-L299 HydrophobicContact CG-CD1 4.4Å; F280-L302 HydrophobicContact CD1-CD1 3.75Å; F280-L302 HydrophobicContact CE1-CB 3.81Å; F280-L302 HydrophobicContact CE1-CD1 3.61Å; F280-L302 HydrophobicContact CE1-CG 4.36Å; F280-F303 HydrophobicContact CE1-CD2 4.48Å; F280-F303 HydrophobicContact CE1-CE2 4.01Å; F280-F303 HydrophobicContact CZ-CD2 4.36Å; F280-F303 AromaticContact CZ-CE2 3.72Å; F280-F303 HydrophobicContact CZ-CE2 3.72Å; F280-F303 HydrophobicContact CZ-CZ 4.19Å; F280-L306 HydrophobicContact CZ-CD2 4.21Å; F280-L330 HydrophobicContact CB-CD2 4.28Å; F280-L330 HydrophobicContact CD2-CD1 4.27Å; F280-L330 HydrophobicContact CD2-CD2 4.35Å; F280-M338 HydrophobicContact CD2-SD 4.16Å; F280-M338 HydrophobicContact CE2-SD 4.43Å; F280-M338 HydrophobicContact CG-SD 4.42Å; F280-W357 HydrophobicContact CD2-CZ3 4.46Å; F280-W357 HydrophobicContact CE2-CE3 4.34Å; F280-W357 AromaticContact CE2-CZ3 3.99Å; F280-W357 HydrophobicContact CE2-CZ3 3.99Å
281	N	94.8	Very high	91.6	Very high	30 Å²	30	36 Å²	36	16%	0.16	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-42.1	174.7	-70.8	-8	0	0	0	112.4	K277 L278 S279 A284 K285 L329 L330 S331	K277-N281 PolarHBondContact O-N 3.22Å; L278-N281 PolarHBondContact O-N 3.41Å; S279-N281 PolarHBondContact O-N 3.4Å; N281-A284 PolarHBondContact O-N 3.05Å; N281-K285 WeakPolarHBondContact O-CB 3.43Å; N281-K285 PolarHBondContact O-N 3.26Å; N281-L329 PolarHBondContact ND2-O 3.02Å; N281-L330 VanDerWaalsContact OD1-CA 3.25Å; N281-L330 WeakPolarHBondContact OD1-CA 3.1Å; N281-S331 PolarHBondContact OD1-N 2.67Å
282	L	94.1	Very high	90.9	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-67.4	-45	178.4	-69	172.3	0	0	0	111.2	D202 T205 L206 L278 S279 A284 K285 L286	D202-L282 HydrophobicContact CB-CD2 3.81Å; T205-L282 HydrophobicContact CG2-CD1 3.75Å; L206-L282 HydrophobicContact CB-CB 4.23Å; L206-L282 HydrophobicContact CB-CD1 4.03Å; L206-L282 HydrophobicContact CD1-CB 4.24Å; L278-L282 HydrophobicContact CD1-CD1 4.04Å; L278-L282 HydrophobicContact CD1-CG 4.09Å; L278-L282 HydrophobicContact CD2-CD1 4.47Å; L278-L282 HydrophobicContact CG-CD1 3.8Å; L278-L282 HydrophobicContact CG-CG 4.3Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 VanDerWaalsContact O-CG 3.31Å; L278-L282 WeakPolarHBondContact O-CG 3.37Å; L278-L282 PolarHBondContact O-N 2.89Å; S279-L282 PolarHBondContact O-N 3.01Å; L282-A284 VanDerWaalsContact C-N 3.3Å; L282-A284 PolarHBondContact O-N 3.4Å; L282-K285 PolarHBondContact O-N 2.86Å; L282-L286 HydrophobicContact CB-CD1 4.28Å; L282-L286 VanDerWaalsContact O-CB 3.23Å; L282-L286 WeakPolarHBondContact O-CB 3.38Å; L282-L286 WeakPolarHBondContact O-CD1 3.37Å; L282-L286 WeakPolarHBondContact O-CG 3.29Å; L282-L286 PolarHBondContact O-N 3.31Å
283	L	94.8	Very high	90.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.7	-43.9	173.1	-74.8	171.8	0	0	0	111.6	L206 S279 K285 L286 K287 A295 L298 L302 L337	L206-L283 HydrophobicContact CD1-CD2 4.43Å; L206-L283 HydrophobicContact CD1-CG 4.12Å; L206-L283 HydrophobicContact CD2-CD2 3.75Å; L206-L283 HydrophobicContact CD2-CG 4.19Å; S279-L283 WeakPolarHBondContact O-CB 3.27Å; S279-L283 VanDerWaalsContact O-CG 3.3Å; S279-L283 WeakPolarHBondContact O-CG 3.35Å; S279-L283 PolarHBondContact O-N 2.81Å; L283-K285 PolarHBondContact O-N 2.87Å; L283-L286 PolarHBondContact O-N 2.98Å; L283-K287 WeakPolarHBondContact O-CA 3Å; L283-K287 WeakPolarHBondContact O-CB 3.33Å; L283-K287 PolarHBondContact O-N 2.86Å; L283-A295 HydrophobicContact CD2-CB 4.24Å; L283-L298 HydrophobicContact CD1-CB 4.13Å; L283-L298 HydrophobicContact CD2-CB 3.62Å; L283-L298 HydrophobicContact CD2-CD1 3.72Å; L283-L298 HydrophobicContact CD2-CG 4.32Å; L283-L302 HydrophobicContact CD1-CD1 3.63Å; L283-L337 HydrophobicContact CB-CD2 4.39Å
284	A	92.3	Very high	90	Very high	2 Å²	2	47.4 Å²	47.4	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-35	178.5	0	0	0	0	0	114	F280 N281 L282 K287 E333 A334 L337	F280-A284 WeakPolarHBondContact O-CB 3.42Å; F280-A284 PolarHBondContact O-N 2.65Å; N281-A284 PolarHBondContact O-N 3.05Å; L282-A284 VanDerWaalsContact C-N 3.3Å; L282-A284 PolarHBondContact O-N 3.4Å; A284-K287 VanDerWaalsContact O-CD 3.26Å; A284-K287 WeakPolarHBondContact O-CD 3.48Å; A284-K287 VanDerWaalsContact O-CE 3.3Å; A284-K287 WeakPolarHBondContact O-CE 3.44Å; A284-K287 WeakPolarHBondContact O-CG 3.35Å; A284-E333 HydrophobicContact CB-CB 4.14Å; A284-A334 VanDerWaalsContact CB-CA 3.46Å; A284-A334 HydrophobicContact CB-CB 3.68Å; A284-L337 HydrophobicContact CB-CD2 4.32Å
285	K	90.8	Very high	89.7	Confident	115 Å²	115	44.7 Å²	44.7	50%	0.5	22%	0.218	S	C	.	.	H	α-helix	trans	-72.6	-39.3	173.5	-174.2	-179.1	-179.4	-175.2	0	112.3	D202 N281 L282 L283	D202-K285 WeakPolarHBondContact OD2-CE 3.44Å; D202-K285 IonicContact OD2-NZ 3.05Å; D202-K285 PolarHBondContact OD2-NZ 3.35Å; N281-K285 WeakPolarHBondContact O-CB 3.43Å; N281-K285 PolarHBondContact O-N 3.26Å; L282-K285 PolarHBondContact O-N 2.86Å; L283-K285 PolarHBondContact O-N 2.87Å
286	L	89.4	Confident	89.5	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-90.9	-7.7	-172.7	-60.3	168.9	0	0	0	113.5	F199 D202 V203 L206 L282 L283 N288 H289 I290	F199-L286 HydrophobicContact CD2-CD2 3.53Å; F199-L286 HydrophobicContact CE2-CD2 3.35Å; F199-L286 HydrophobicContact CG-CD2 4.44Å; F199-L286 HydrophobicContact CZ-CD2 4.15Å; D202-L286 HydrophobicContact CB-CD2 4.36Å; V203-L286 HydrophobicContact CG2-CD1 3.95Å; V203-L286 HydrophobicContact CG2-CD2 3.99Å; L206-L286 HydrophobicContact CD2-CD1 4.02Å; L282-L286 HydrophobicContact CB-CD1 4.28Å; L282-L286 VanDerWaalsContact O-CB 3.23Å; L282-L286 WeakPolarHBondContact O-CB 3.38Å; L282-L286 WeakPolarHBondContact O-CD1 3.37Å; L282-L286 WeakPolarHBondContact O-CG 3.29Å; L282-L286 PolarHBondContact O-N 3.31Å; L283-L286 PolarHBondContact O-N 2.98Å; L286-N288 PolarHBondContact O-N 2.88Å; L286-H289 PolarHBondContact O-N 2.63Å; L286-I290 HydrophobicContact CB-CD1 3.53Å; L286-I290 HydrophobicContact CB-CG1 4.01Å; L286-I290 HydrophobicContact CD1-CD1 4.08Å; L286-I290 HydrophobicContact CG-CD1 4.43Å; L286-I290 PolarHBondContact O-N 3.01Å
287	K	87.2	Confident	89.3	Confident	71 Å²	71	50.2 Å²	50.2	31%	0.309	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-28.5	-171.8	65.8	-171.2	172.7	-173.6	0	117	L283 A284 H289 A295 L337	L283-K287 WeakPolarHBondContact O-CA 3Å; L283-K287 WeakPolarHBondContact O-CB 3.33Å; L283-K287 PolarHBondContact O-N 2.86Å; A284-K287 VanDerWaalsContact O-CD 3.26Å; A284-K287 WeakPolarHBondContact O-CD 3.48Å; A284-K287 VanDerWaalsContact O-CE 3.3Å; A284-K287 WeakPolarHBondContact O-CE 3.44Å; A284-K287 WeakPolarHBondContact O-CG 3.35Å; K287-H289 VanDerWaalsContact C-N 3.3Å; K287-A295 HydrophobicContact CB-CB 3.75Å; K287-L337 HydrophobicContact CD-CD1 4.44Å
288	N	85.6	Confident	89.2	Confident	123 Å²	123	51.3 Å²	51.3	66%	0.658	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-0.6	178.8	-65.7	-7.3	0	0	0	113.8	L286	L286-N288 PolarHBondContact O-N 2.88Å
289	H	78.8	Confident	89.2	Confident	114 Å²	114	50.7 Å²	50.7	53%	0.528	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-1.9	-172.1	-46.6	95.1	0	0	0	113.3	F199 L286 K287	F199-H289 HydrophobicContact CE2-CB 3.49Å; F199-H289 VanDerWaalsContact CE2-CB 3.49Å; F199-H289 AromaticContact CE2-CG 3.54Å; F199-H289 AromaticContact CE2-ND1 3.7Å; F199-H289 HydrophobicContact CZ-CB 3.51Å; L286-H289 PolarHBondContact O-N 2.63Å; K287-H289 VanDerWaalsContact C-N 3.3Å
290	I	84.1	Confident	89	Confident	30 Å²	30	53.4 Å²	53.4	15%	0.154	26%	0.263	C	S	.	.			trans	-117.7	115.7	177	-54.5	176.7	0	0	0	107.7	L206 L286 P293 L298	L206-I290 HydrophobicContact CD2-CD1 3.95Å; L286-I290 HydrophobicContact CB-CD1 3.53Å; L286-I290 HydrophobicContact CB-CG1 4.01Å; L286-I290 HydrophobicContact CD1-CD1 4.08Å; L286-I290 HydrophobicContact CG-CD1 4.43Å; L286-I290 PolarHBondContact O-N 3.01Å; I290-P293 WeakPolarHBondContact CG2-O 3.49Å; I290-L298 HydrophobicContact CG2-CD1 3.81Å
291	H	75.1	Confident	89	Confident	131 Å²	131	59.7 Å²	59.7	61%	0.606	29%	0.29	S	S	*	.	B	Isolated β-bridge	trans	-118.6	-28.1	-170.4	-61.3	-61	0	0	0	114.8	N294	H291-N294 PolarHBondContact O-N 3.29Å
292	E	76.4	Confident	89.1	Confident	189 Å²	189	58.3 Å²	58.3	88%	0.883	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.6	105.7	-175.5	-66.3	-175.6	-166.8	0	0	111.3
293	P	85	Confident	89.2	Confident	55 Å²	55	58.2 Å²	58.2	36%	0.357	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	cis	-61.7	152	-21.1	29.9	-35.7	0	0	0	111.4	I290 E297 L298 F301	I290-P293 WeakPolarHBondContact CG2-O 3.49Å; P293-E297 WeakPolarHBondContact CA-OE2 3.47Å; P293-E297 HydrophobicContact CB-CB 3.95Å; P293-E297 WeakPolarHBondContact CB-OE2 3.44Å; P293-L298 HydrophobicContact CB-CG 4.41Å; P293-L298 HydrophobicContact CG-CD1 4.44Å; P293-L298 HydrophobicContact CG-CD2 3.67Å; P293-L298 HydrophobicContact CG-CG 3.88Å; P293-F301 HydrophobicContact CB-CE2 4.14Å; P293-F301 HydrophobicContact CG-CE2 4.46Å
294	N	88.4	Confident	89.2	Confident	47 Å²	47	62.9 Å²	62.9	25%	0.251	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-76.2	168	-177.8	57.9	61.3	0	0	0	113	H291 P296 E297 L298	H291-N294 PolarHBondContact O-N 3.29Å; N294-P296 VanDerWaalsContact OD1-CD 3.24Å; N294-P296 WeakPolarHBondContact OD1-CD 3.4Å; N294-E297 VanDerWaalsContact CG-CD 3.48Å; N294-E297 PolarHBondContact N-OE2 3.48Å; N294-E297 PolarHBondContact ND2-OE1 2.85Å; N294-E297 PolarHBondContact ND2-OE2 2.72Å; N294-E297 WeakPolarHBondContact O-CB 3.36Å; N294-E297 PolarHBondContact O-N 3.12Å; N294-E297 VanDerWaalsContact O-N 3.12Å; N294-E297 WeakPolarHBondContact OD1-CG 3.42Å; N294-E297 PolarHBondContact OD1-N 3.13Å; N294-L298 WeakPolarHBondContact O-CG 3.5Å; N294-L298 PolarHBondContact O-N 3.49Å
295	A	90.4	Very high	89.4	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-37.6	-177.7	0	0	0	0	0	115	L283 K287 L299	L283-A295 HydrophobicContact CD2-CB 4.24Å; K287-A295 HydrophobicContact CB-CB 3.75Å; A295-L299 WeakPolarHBondContact O-CB 3.4Å; A295-L299 PolarHBondContact O-N 2.77Å
296	P	91.1	Very high	89.6	Confident	42 Å²	42	58.4 Å²	58.4	27%	0.273	29%	0.294	S	S	.	.	H	α-helix	trans	-58.8	-46	167	-28.3	35.2	0	0	0	114.5	N294 L298 L299 H300 C341	N294-P296 VanDerWaalsContact OD1-CD 3.24Å; N294-P296 WeakPolarHBondContact OD1-CD 3.4Å; P296-L298 PolarHBondContact O-N 2.8Å; P296-L299 VanDerWaalsContact O-CB 3.3Å; P296-L299 WeakPolarHBondContact O-CB 3.4Å; P296-L299 PolarHBondContact O-N 2.84Å; P296-L299 VanDerWaalsContact O-N 3.14Å; P296-H300 PolarHBondContact O-CD2 2.97Å; P296-H300 PolarHBondContact O-N 2.71Å; P296-H300 VanDerWaalsContact O-N 3.08Å; P296-C341 HydrophobicContact CB-CB 4.25Å
297	E	92.9	Very high	89.9	Confident	81 Å²	81	60 Å²	60	38%	0.379	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-45.8	175.8	-75.6	159	-162.2	0	0	111.7	P293 N294 L299 H300 F301	P293-E297 WeakPolarHBondContact CA-OE2 3.47Å; P293-E297 HydrophobicContact CB-CB 3.95Å; P293-E297 WeakPolarHBondContact CB-OE2 3.44Å; N294-E297 VanDerWaalsContact CG-CD 3.48Å; N294-E297 PolarHBondContact N-OE2 3.48Å; N294-E297 PolarHBondContact ND2-OE1 2.85Å; N294-E297 PolarHBondContact ND2-OE2 2.72Å; N294-E297 WeakPolarHBondContact O-CB 3.36Å; N294-E297 PolarHBondContact O-N 3.12Å; N294-E297 VanDerWaalsContact O-N 3.12Å; N294-E297 WeakPolarHBondContact OD1-CG 3.42Å; N294-E297 PolarHBondContact OD1-N 3.13Å; E297-L299 PolarHBondContact O-N 3.39Å; E297-H300 PolarHBondContact O-N 2.72Å; E297-F301 HydrophobicContact CB-CD2 4.43Å; E297-F301 HydrophobicContact CB-CE2 4.06Å; E297-F301 WeakPolarHBondContact O-CD2 3.06Å; E297-F301 WeakPolarHBondContact O-CG 3.39Å; E297-F301 PolarHBondContact O-N 3.13Å
298	L	94	Very high	90.2	Very high	22 Å²	22	58.6 Å²	58.6	12%	0.115	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-29.4	174.3	-72.2	170.5	0	0	0	113.1	F210 L283 I290 P293 N294 P296 F301 L302	F210-L298 HydrophobicContact CE2-CD2 4.14Å; F210-L298 HydrophobicContact CZ-CB 4.38Å; F210-L298 HydrophobicContact CZ-CD1 4.48Å; F210-L298 HydrophobicContact CZ-CD2 3.86Å; F210-L298 HydrophobicContact CZ-CG 4.48Å; L283-L298 HydrophobicContact CD1-CB 4.13Å; L283-L298 HydrophobicContact CD2-CB 3.62Å; L283-L298 HydrophobicContact CD2-CD1 3.72Å; L283-L298 HydrophobicContact CD2-CG 4.32Å; I290-L298 HydrophobicContact CG2-CD1 3.81Å; P293-L298 HydrophobicContact CB-CG 4.41Å; P293-L298 HydrophobicContact CG-CD1 4.44Å; P293-L298 HydrophobicContact CG-CD2 3.67Å; P293-L298 HydrophobicContact CG-CG 3.88Å; N294-L298 WeakPolarHBondContact O-CG 3.5Å; N294-L298 PolarHBondContact O-N 3.49Å; P296-L298 PolarHBondContact O-N 2.8Å; L298-F301 HydrophobicContact CD2-CD2 4.47Å; L298-L302 WeakPolarHBondContact O-CG 3.23Å; L298-L302 PolarHBondContact O-N 2.75Å
299	L	95	Very high	90.6	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-48.8	172.5	-174.8	69.5	0	0	0	110.8	F280 A295 P296 E297 F301 L302 F303 L337 M338 C341 L342	F280-L299 HydrophobicContact CD1-CD1 3.47Å; F280-L299 VanDerWaalsContact CD1-CD1 3.47Å; F280-L299 HydrophobicContact CE1-CD1 3.58Å; F280-L299 HydrophobicContact CG-CD1 4.4Å; A295-L299 WeakPolarHBondContact O-CB 3.4Å; A295-L299 PolarHBondContact O-N 2.77Å; P296-L299 VanDerWaalsContact O-CB 3.3Å; P296-L299 WeakPolarHBondContact O-CB 3.4Å; P296-L299 PolarHBondContact O-N 2.84Å; P296-L299 VanDerWaalsContact O-N 3.14Å; E297-L299 PolarHBondContact O-N 3.39Å; L299-F301 VanDerWaalsContact C-N 3.33Å; L299-F301 PolarHBondContact O-N 2.9Å; L299-L302 WeakPolarHBondContact O-CB 3.36Å; L299-L302 PolarHBondContact O-N 3.45Å; L299-F303 HydrophobicContact CD1-CE2 4.13Å; L299-F303 HydrophobicContact CG-CE2 4.38Å; L299-F303 WeakPolarHBondContact O-CD2 3.26Å; L299-F303 PolarHBondContact O-N 2.96Å; L299-L337 HydrophobicContact CD2-CG 4.32Å; L299-M338 HydrophobicContact CD1-CG 4.07Å; L299-M338 HydrophobicContact CD2-CG 4.05Å; L299-C341 HydrophobicContact CD2-CB 4.11Å; L299-L342 HydrophobicContact CD2-CD2 3.6Å; L299-L342 HydrophobicContact CD2-CG 4.14Å; L299-L342 HydrophobicContact CG-CD2 3.79Å
300	H	93.7	Very high	91.3	Very high	57 Å²	57	47.8 Å²	47.8	26%	0.264	25%	0.25	S	S	.	.	H	α-helix	trans	-60.6	-41.2	174.9	-65.8	-63.4	0	0	0	112.3	P296 E297 L302 F303 C341 E346	P296-H300 PolarHBondContact O-CD2 2.97Å; P296-H300 PolarHBondContact O-N 2.71Å; P296-H300 VanDerWaalsContact O-N 3.08Å; E297-H300 PolarHBondContact O-N 2.72Å; H300-L302 PolarHBondContact O-N 3.32Å; H300-F303 PolarHBondContact O-N 3.22Å; H300-F303 VanDerWaalsContact O-N 3.09Å; H300-C341 PolarHBondContact CE1-O 2.94Å; H300-C341 PolarHBondContact NE2-O 3.04Å; H300-E346 WeakPolarHBondContact CA-OE1 3.4Å; H300-E346 IonicContact CE1-OE1 3.44Å; H300-E346 IonicContact CE1-OE2 3.2Å; H300-E346 PolarHBondContact CE1-OE2 3.45Å; H300-E346 VanDerWaalsContact CE1-OE2 3.3Å; H300-E346 IonicContact CG-OE1 3.25Å; H300-E346 VanDerWaalsContact ND1-CD 3.26Å; H300-E346 IonicContact ND1-OE1 2.72Å; H300-E346 PolarHBondContact ND1-OE1 3.47Å; H300-E346 IonicContact ND1-OE2 3.35Å; H300-E346 PolarHBondContact ND1-OE2 3.44Å
301	F	95.1	Very high	91.6	Very high	133 Å²	133	52.3 Å²	52.3	58%	0.583	27%	0.271	S	S	*	.	H	α-helix	trans	-63.7	-19.7	174.7	-65.8	-45.9	0	0	0	113.5	P293 E297 L298 L299 P305	P293-F301 HydrophobicContact CB-CE2 4.14Å; P293-F301 HydrophobicContact CG-CE2 4.46Å; E297-F301 HydrophobicContact CB-CD2 4.43Å; E297-F301 HydrophobicContact CB-CE2 4.06Å; E297-F301 WeakPolarHBondContact O-CD2 3.06Å; E297-F301 WeakPolarHBondContact O-CG 3.39Å; E297-F301 PolarHBondContact O-N 3.13Å; L298-F301 HydrophobicContact CD2-CD2 4.47Å; L299-F301 VanDerWaalsContact C-N 3.33Å; L299-F301 PolarHBondContact O-N 2.9Å; F301-P305 WeakPolarHBondContact O-CD 3.46Å; F301-P305 WeakPolarHBondContact O-CG 3.3Å
302	L	96.6	Very high	92.4	Very high	2 Å²	2	46 Å²	46	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-83.6	-29.9	170.2	-76.6	170.7	0	0	0	113.6	F210 I213 F276 F280 L283 L298 L299 H300 T304 P305 L306	F210-L302 HydrophobicContact CD1-CD2 3.87Å; F210-L302 HydrophobicContact CD1-CG 4.48Å; F210-L302 HydrophobicContact CE1-CD1 4.04Å; F210-L302 HydrophobicContact CE1-CD2 3.75Å; F210-L302 HydrophobicContact CE1-CG 3.87Å; I213-L302 HydrophobicContact CD1-CD2 3.77Å; F276-L302 HydrophobicContact CD1-CB 4.31Å; F276-L302 HydrophobicContact CD1-CD2 3.88Å; F276-L302 HydrophobicContact CE1-CB 4.14Å; F276-L302 HydrophobicContact CE1-CD2 3.67Å; F276-L302 VanDerWaalsContact CE1-O 3.31Å; F276-L302 WeakPolarHBondContact CE1-O 3.36Å; F280-L302 HydrophobicContact CD1-CD1 3.75Å; F280-L302 HydrophobicContact CE1-CB 3.81Å; F280-L302 HydrophobicContact CE1-CD1 3.61Å; F280-L302 HydrophobicContact CE1-CG 4.36Å; L283-L302 HydrophobicContact CD1-CD1 3.63Å; L298-L302 WeakPolarHBondContact O-CG 3.23Å; L298-L302 PolarHBondContact O-N 2.75Å; L299-L302 WeakPolarHBondContact O-CB 3.36Å; L299-L302 PolarHBondContact O-N 3.45Å; H300-L302 PolarHBondContact O-N 3.32Å; L302-T304 VanDerWaalsContact C-N 3.34Å; L302-T304 PolarHBondContact O-N 3.26Å; L302-P305 VanDerWaalsContact O-CD 3.26Å; L302-P305 WeakPolarHBondContact O-CD 3.48Å; L302-P305 VanDerWaalsContact O-CG 3.3Å; L302-P305 WeakPolarHBondContact O-CG 3.35Å; L302-L306 VanDerWaalsContact O-CB 3.23Å; L302-L306 WeakPolarHBondContact O-CB 3.37Å; L302-L306 PolarHBondContact O-N 2.96Å; L302-L306 VanDerWaalsContact O-N 3.08Å
303	F	96.3	Very high	93	Very high	4 Å²	4	37 Å²	37	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-70	-30.9	-178.7	-91.4	-95.8	0	0	0	113.3	F280 L299 H300 L306 A307 L342 E346 I349 W350	F280-F303 HydrophobicContact CE1-CD2 4.48Å; F280-F303 HydrophobicContact CE1-CE2 4.01Å; F280-F303 HydrophobicContact CZ-CD2 4.36Å; F280-F303 AromaticContact CZ-CE2 3.72Å; F280-F303 HydrophobicContact CZ-CE2 3.72Å; F280-F303 HydrophobicContact CZ-CZ 4.19Å; L299-F303 HydrophobicContact CD1-CE2 4.13Å; L299-F303 HydrophobicContact CG-CE2 4.38Å; L299-F303 WeakPolarHBondContact O-CD2 3.26Å; L299-F303 PolarHBondContact O-N 2.96Å; H300-F303 PolarHBondContact O-N 3.22Å; H300-F303 VanDerWaalsContact O-N 3.09Å; F303-L306 HydrophobicContact CD1-CD2 4.24Å; F303-L306 HydrophobicContact CE1-CD2 4.1Å; F303-L306 HydrophobicContact CZ-CD2 4.41Å; F303-L306 PolarHBondContact O-N 3.11Å; F303-A307 WeakPolarHBondContact O-CB 3.31Å; F303-A307 PolarHBondContact O-N 2.95Å; F303-L342 HydrophobicContact CD2-CD2 3.65Å; F303-L342 HydrophobicContact CE1-CD1 4.15Å; F303-L342 HydrophobicContact CE2-CD1 3.81Å; F303-L342 HydrophobicContact CE2-CD2 3.5Å; F303-L342 VanDerWaalsContact CE2-CD2 3.5Å; F303-L342 HydrophobicContact CE2-CG 4.31Å; F303-L342 HydrophobicContact CG-CD2 4.34Å; F303-L342 HydrophobicContact CZ-CD1 3.52Å; F303-L342 HydrophobicContact CZ-CD2 4.04Å; F303-L342 HydrophobicContact CZ-CG 4.45Å; F303-E346 HydrophobicContact CB-CB 4.31Å; F303-E346 HydrophobicContact CB-CG 3.78Å; F303-E346 HydrophobicContact CD1-CB 3.65Å; F303-E346 HydrophobicContact CD1-CG 4.04Å; F303-E346 HydrophobicContact CE1-CB 4.13Å; F303-E346 WeakPolarHBondContact CE1-O 3.27Å; F303-E346 HydrophobicContact CG-CB 3.9Å; F303-E346 HydrophobicContact CG-CG 3.94Å; F303-I349 HydrophobicContact CD1-CB 4.2Å; F303-I349 HydrophobicContact CD1-CG2 3.96Å; F303-I349 HydrophobicContact CE1-CB 4.22Å; F303-I349 HydrophobicContact CE1-CG2 3.96Å; F303-W350 HydrophobicContact CE1-CB 4.04Å; F303-W350 HydrophobicContact CZ-CB 4.05Å
304	T	94.4	Very high	93.1	Very high	99 Å²	99	39.3 Å²	39.3	61%	0.607	21%	0.205	S	C	*	.	H	α-helix	trans	-59.4	-56.9	173.4	-63.5	0	0	0	0	113.3	L302 L306 A307 V308	L302-T304 VanDerWaalsContact C-N 3.34Å; L302-T304 PolarHBondContact O-N 3.26Å; T304-L306 VanDerWaalsContact C-N 3.33Å; T304-L306 PolarHBondContact O-N 2.88Å; T304-A307 PolarHBondContact O-N 3.43Å; T304-V308 PolarHBondContact O-N 2.85Å
305	P	96.3	Very high	92.9	Very high	23 Å²	23	42.1 Å²	42.1	15%	0.149	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-30.7	176	26.5	-34.5	0	0	0	112.9	I213 V217 F276 F301 L302 V308 I309	I213-P305 HydrophobicContact CG2-CB 3.87Å; I213-P305 HydrophobicContact CG2-CG 4.01Å; V217-P305 HydrophobicContact CG2-CB 3.63Å; F276-P305 HydrophobicContact CE1-CG 4.28Å; F276-P305 HydrophobicContact CZ-CB 4.26Å; F276-P305 HydrophobicContact CZ-CG 4.22Å; F301-P305 WeakPolarHBondContact O-CD 3.46Å; F301-P305 WeakPolarHBondContact O-CG 3.3Å; L302-P305 VanDerWaalsContact O-CD 3.26Å; L302-P305 WeakPolarHBondContact O-CD 3.48Å; L302-P305 VanDerWaalsContact O-CG 3.3Å; L302-P305 WeakPolarHBondContact O-CG 3.35Å; P305-V308 PolarHBondContact O-N 3.18Å; P305-I309 VanDerWaalsContact O-CG1 3.32Å; P305-I309 WeakPolarHBondContact O-CG1 3.48Å; P305-I309 PolarHBondContact O-N 3.17Å
306	L	96.5	Very high	92.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-45	174	-179.5	59.7	0	0	0	111.6	L273 F276 F280 L302 F303 T304 V308 I309 L310 I349 L353	L273-L306 HydrophobicContact CD2-CD1 3.68Å; F276-L306 HydrophobicContact CD1-CB 4.24Å; F276-L306 HydrophobicContact CD1-CD1 4.36Å; F276-L306 HydrophobicContact CD2-CD1 4.18Å; F276-L306 HydrophobicContact CE1-CB 3.77Å; F276-L306 HydrophobicContact CE1-CD1 4.49Å; F276-L306 HydrophobicContact CE2-CD1 4.33Å; F276-L306 HydrophobicContact CG-CD1 4.21Å; F276-L306 HydrophobicContact CZ-CB 4Å; F276-L306 HydrophobicContact CZ-CD1 4.47Å; F280-L306 HydrophobicContact CZ-CD2 4.21Å; L302-L306 VanDerWaalsContact O-CB 3.23Å; L302-L306 WeakPolarHBondContact O-CB 3.37Å; L302-L306 PolarHBondContact O-N 2.96Å; L302-L306 VanDerWaalsContact O-N 3.08Å; F303-L306 HydrophobicContact CD1-CD2 4.24Å; F303-L306 HydrophobicContact CE1-CD2 4.1Å; F303-L306 HydrophobicContact CZ-CD2 4.41Å; F303-L306 PolarHBondContact O-N 3.11Å; T304-L306 VanDerWaalsContact C-N 3.33Å; T304-L306 PolarHBondContact O-N 2.88Å; L306-V308 PolarHBondContact O-N 3.28Å; L306-I309 PolarHBondContact O-N 2.79Å; L306-L310 HydrophobicContact CD1-CD1 4.32Å; L306-L310 HydrophobicContact CD1-CG 4.27Å; L306-L310 HydrophobicContact CG-CD1 4.07Å; L306-L310 HydrophobicContact CG-CG 4.48Å; L306-L310 VanDerWaalsContact O-CG 3.3Å; L306-L310 WeakPolarHBondContact O-CG 3.3Å; L306-L310 PolarHBondContact O-N 2.78Å; L306-I349 HydrophobicContact CD2-CG2 4.41Å; L306-L353 HydrophobicContact CD2-CD1 4.12Å
307	A	94.9	Very high	92	Very high	35 Å²	35	43.2 Å²	43.2	29%	0.289	22%	0.223	S	C	.	.	H	α-helix	trans	-58.2	-46.8	176.9	0	0	0	0	0	112.1	F303 T304 I309 L310 E311 I349	F303-A307 WeakPolarHBondContact O-CB 3.31Å; F303-A307 PolarHBondContact O-N 2.95Å; T304-A307 PolarHBondContact O-N 3.43Å; A307-I309 VanDerWaalsContact C-N 3.3Å; A307-I309 PolarHBondContact O-N 3.33Å; A307-L310 PolarHBondContact O-N 3.39Å; A307-E311 PolarHBondContact O-N 2.78Å; A307-I349 HydrophobicContact CB-CD1 4.15Å
308	V	94.1	Very high	91.5	Very high	41 Å²	41	42.6 Å²	42.6	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-38.6	176.8	176.3	0	0	0	0	111.7	V217 I220 T304 P305 L306 A312	V217-V308 HydrophobicContact CG1-CG1 4.32Å; I220-V308 HydrophobicContact CG2-CG1 4.27Å; T304-V308 PolarHBondContact O-N 2.85Å; P305-V308 PolarHBondContact O-N 3.18Å; L306-V308 PolarHBondContact O-N 3.28Å; V308-A312 WeakPolarHBondContact O-CB 3.45Å; V308-A312 PolarHBondContact O-N 2.92Å
309	I	94.1	Very high	91.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70.9	-39.1	178.5	-72.7	166.8	0	0	0	111.4	F216 V217 I220 F269 I272 L273 F276 P305 L306 A307 A312 C313	F216-I309 HydrophobicContact CD1-CD1 3.73Å; F216-I309 HydrophobicContact CD1-CG1 3.86Å; F216-I309 HydrophobicContact CE1-CD1 4.34Å; F216-I309 HydrophobicContact CE1-CG1 4.12Å; F216-I309 HydrophobicContact CE1-CG2 4.2Å; V217-I309 HydrophobicContact CG2-CD1 3.81Å; V217-I309 HydrophobicContact CG2-CG1 4.03Å; I220-I309 HydrophobicContact CD1-CG1 3.8Å; F269-I309 HydrophobicContact CD1-CG2 4.02Å; F269-I309 HydrophobicContact CE1-CG2 4.26Å; I272-I309 HydrophobicContact CG2-CD1 4.26Å; I272-I309 HydrophobicContact CG2-CG2 4.19Å; L273-I309 HydrophobicContact CD2-CG2 4.44Å; F276-I309 HydrophobicContact CE2-CD1 3.56Å; F276-I309 HydrophobicContact CZ-CD1 3.94Å; P305-I309 VanDerWaalsContact O-CG1 3.32Å; P305-I309 WeakPolarHBondContact O-CG1 3.48Å; P305-I309 PolarHBondContact O-N 3.17Å; L306-I309 PolarHBondContact O-N 2.79Å; A307-I309 VanDerWaalsContact C-N 3.3Å; A307-I309 PolarHBondContact O-N 3.33Å; I309-A312 PolarHBondContact O-N 3Å; I309-C313 PolarHBondContact O-N 2.9Å; I309-C313 PolarHBondContact O-SG 3.33Å
310	L	92.8	Very high	90.6	Very high	11 Å²	11	48.9 Å²	48.9	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-67	-41.3	174.6	-66.4	167.8	0	0	0	111.9	L306 A307 A312 C313 H314 A322 I349 L353	L306-L310 HydrophobicContact CD1-CD1 4.32Å; L306-L310 HydrophobicContact CD1-CG 4.27Å; L306-L310 HydrophobicContact CG-CD1 4.07Å; L306-L310 HydrophobicContact CG-CG 4.48Å; L306-L310 VanDerWaalsContact O-CG 3.3Å; L306-L310 WeakPolarHBondContact O-CG 3.3Å; L306-L310 PolarHBondContact O-N 2.78Å; A307-L310 PolarHBondContact O-N 3.39Å; L310-A312 VanDerWaalsContact C-N 3.32Å; L310-A312 PolarHBondContact O-N 3.38Å; L310-C313 WeakPolarHBondContact O-CB 2.95Å; L310-C313 PolarHBondContact O-N 3.15Å; L310-C313 VanDerWaalsContact O-N 3.17Å; L310-H314 PolarHBondContact O-N 2.89Å; L310-H314 VanDerWaalsContact O-N 3.08Å; L310-H314 PolarHBondContact O-ND1 3.19Å; L310-A322 HydrophobicContact CD2-CB 3.95Å; L310-I349 HydrophobicContact CD1-CG2 3.74Å; L310-L353 HydrophobicContact CD1-CD2 3.66Å; L310-L353 HydrophobicContact CD2-CD2 3.81Å; L310-L353 HydrophobicContact CG-CD2 4.33Å
311	E	91.6	Very high	90.5	Very high	124 Å²	124	46.2 Å²	46.2	58%	0.579	25%	0.251	S	S	*	.	H	α-helix	trans	-57.9	-46	172.4	-175.8	174	-155.7	0	0	110.7	A307 C313 H314 W315	A307-E311 PolarHBondContact O-N 2.78Å; E311-C313 VanDerWaalsContact C-N 3.33Å; E311-C313 PolarHBondContact O-N 3.5Å; E311-H314 WeakPolarHBondContact O-CB 3.38Å; E311-H314 PolarHBondContact O-N 3.26Å; E311-H314 VanDerWaalsContact O-N 3.07Å; E311-W315 PolarHBondContact O-N 2.71Å
312	A	90.4	Very high	90.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-29.5	174.9	0	0	0	0	0	114.3	I220 F269 V308 I309 L310 W315 G316	I220-A312 HydrophobicContact CD1-CB 3.76Å; I220-A312 HydrophobicContact CG1-CB 4.11Å; I220-A312 HydrophobicContact CG2-CB 3.71Å; F269-A312 HydrophobicContact CE1-CB 3.91Å; F269-A312 HydrophobicContact CZ-CB 3.98Å; V308-A312 WeakPolarHBondContact O-CB 3.45Å; V308-A312 PolarHBondContact O-N 2.92Å; I309-A312 PolarHBondContact O-N 3Å; L310-A312 VanDerWaalsContact C-N 3.32Å; L310-A312 PolarHBondContact O-N 3.38Å; A312-W315 HydrophobicContact CB-CZ2 4.49Å; A312-G316 VanDerWaalsContact O-CA 3.26Å; A312-G316 WeakPolarHBondContact O-CA 3.38Å; A312-G316 PolarHBondContact O-N 3.37Å
313	C	89.1	Confident	90.1	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-44.7	168.7	-64.1	0	0	0	0	111.1	F269 I309 L310 E311 L317 G318 R319	F269-C313 WeakPolarHBondContact CD1-SG 3.34Å; I309-C313 PolarHBondContact O-N 2.9Å; I309-C313 PolarHBondContact O-SG 3.33Å; L310-C313 WeakPolarHBondContact O-CB 2.95Å; L310-C313 PolarHBondContact O-N 3.15Å; L310-C313 VanDerWaalsContact O-N 3.17Å; E311-C313 VanDerWaalsContact C-N 3.33Å; E311-C313 PolarHBondContact O-N 3.5Å; C313-L317 WeakPolarHBondContact O-CA 3.21Å; C313-L317 WeakPolarHBondContact O-CB 3.5Å; C313-L317 PolarHBondContact O-N 3.15Å; C313-G318 PolarHBondContact O-N 3.07Å; C313-R319 CarbonylContact C-O 3.53Å; C313-R319 WeakPolarHBondContact CB-O 3.4Å; C313-R319 PolarHBondContact O-N 2.88Å; C313-R319 VanDerWaalsContact O-O 3.1Å
314	H	87	Confident	89.8	Confident	103 Å²	103	47.3 Å²	47.3	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-52.9	-178.7	-66.3	117.5	0	0	0	112.7	L310 E311 G318	L310-H314 PolarHBondContact O-N 2.89Å; L310-H314 VanDerWaalsContact O-N 3.08Å; L310-H314 PolarHBondContact O-ND1 3.19Å; E311-H314 WeakPolarHBondContact O-CB 3.38Å; E311-H314 PolarHBondContact O-N 3.26Å; E311-H314 VanDerWaalsContact O-N 3.07Å; H314-G318 VanDerWaalsContact O-CA 3.25Å; H314-G318 WeakPolarHBondContact O-CA 3.48Å; H314-G318 PolarHBondContact O-N 3.37Å
315	W	83.9	Confident	89.7	Confident	105 Å²	105	42.7 Å²	42.7	40%	0.398	24%	0.242	S	C	.	.	H	α-helix	trans	-79.9	-25.3	-178.5	68.9	-106.4	0	0	0	113.6	A224 L263 E311 A312	A224-W315 HydrophobicContact CB-CH2 4.42Å; A224-W315 HydrophobicContact CB-CZ2 4.18Å; L263-W315 HydrophobicContact CD1-CE3 3.95Å; L263-W315 HydrophobicContact CD1-CH2 3.72Å; L263-W315 HydrophobicContact CD1-CZ2 4.4Å; L263-W315 HydrophobicContact CD1-CZ3 3.46Å; L263-W315 VanDerWaalsContact CD1-CZ3 3.46Å; L263-W315 HydrophobicContact CD2-CH2 3.67Å; L263-W315 HydrophobicContact CD2-CZ2 4.06Å; L263-W315 HydrophobicContact CD2-CZ3 4.3Å; L263-W315 HydrophobicContact CG-CH2 3.8Å; L263-W315 HydrophobicContact CG-CZ3 3.95Å; E311-W315 PolarHBondContact O-N 2.71Å; A312-W315 HydrophobicContact CB-CZ2 4.49Å
316	G	80.4	Confident	89.2	Confident	31 Å²	31	43.1 Å²	43.1	32%	0.32	25%	0.248	S	C	.	.	H	α-helix	trans	-90.4	-43.7	-177	0	0	0	0	0	115.8	A312	A312-G316 VanDerWaalsContact O-CA 3.26Å; A312-G316 WeakPolarHBondContact O-CA 3.38Å; A312-G316 PolarHBondContact O-N 3.37Å
317	L	83.1	Confident	88.8	Confident	35 Å²	35	44 Å²	44	18%	0.183	25%	0.253	C	S	.	.	H	α-helix	trans	-106.5	-2.2	-177.2	-56	177.9	0	0	0	112.8	E266 F269 C313 R319 V321	E266-L317 HydrophobicContact CB-CD1 4.09Å; E266-L317 HydrophobicContact CB-CD2 4.18Å; E266-L317 HydrophobicContact CG-CD1 4.14Å; F269-L317 HydrophobicContact CB-CD1 4.29Å; F269-L317 HydrophobicContact CD2-CD1 3.89Å; F269-L317 HydrophobicContact CD2-CG 4.45Å; F269-L317 HydrophobicContact CE2-CD1 4.41Å; F269-L317 HydrophobicContact CG-CD1 4.11Å; C313-L317 WeakPolarHBondContact O-CA 3.21Å; C313-L317 WeakPolarHBondContact O-CB 3.5Å; C313-L317 PolarHBondContact O-N 3.15Å; L317-R319 HydrophobicContact CB-CG 4.49Å; L317-R319 PolarHBondContact O-N 3Å; L317-R319 PolarHBondContact O-NH1 3.09Å; L317-V321 HydrophobicContact CD1-CG1 3.85Å; L317-V321 HydrophobicContact CD1-CG2 4.4Å
318	G	82.3	Confident	88.7	Confident	68 Å²	68	43.1 Å²	43.1	70%	0.701	25%	0.245	S	C	*	.	S	Bend	trans	68.9	7.5	-176.6	0	0	0	0	0	114.5	C313 H314	C313-G318 PolarHBondContact O-N 3.07Å; H314-G318 VanDerWaalsContact O-CA 3.25Å; H314-G318 WeakPolarHBondContact O-CA 3.48Å; H314-G318 PolarHBondContact O-N 3.37Å
319	R	85.2	Confident	88.4	Confident	119 Å²	119	41.9 Å²	41.9	45%	0.449	24%	0.237	S	C	.	.	S	Bend	trans	-161	152.1	-173.2	67.5	-168.8	-178.5	-86.2	14.6	112.5	E266 C313 L317 V321	E266-R319 IonicContact OE1-CZ 2.63Å; E266-R319 IonicContact OE1-NE 2.84Å; E266-R319 IonicContact OE1-NH2 3.68Å; E266-R319 PolarHBondContact OE1-NH2 2.74Å; E266-R319 IonicContact OE2-CZ 2.68Å; E266-R319 IonicContact OE2-NH2 3.58Å; E266-R319 PolarHBondContact OE2-NH2 3.32Å; C313-R319 CarbonylContact C-O 3.53Å; C313-R319 WeakPolarHBondContact CB-O 3.4Å; C313-R319 PolarHBondContact O-N 2.88Å; C313-R319 VanDerWaalsContact O-O 3.1Å; L317-R319 HydrophobicContact CB-CG 4.49Å; L317-R319 PolarHBondContact O-N 3Å; L317-R319 PolarHBondContact O-NH1 3.09Å; R319-V321 HydrophobicContact CG-CG1 4.22Å; R319-V321 PolarHBondContact O-N 2.99Å
320	N	85.7	Confident	88.2	Confident	37 Å²	37	42 Å²	42	20%	0.198	24%	0.237	C	C	.	.			trans	-74.6	121.8	167	-169.1	-10.6	0	0	0	110	A322	N320-A322 VanDerWaalsContact OD1-CB 3.26Å; N320-A322 WeakPolarHBondContact OD1-CB 3.19Å; N320-A322 PolarHBondContact OD1-N 2.88Å
321	V	90.3	Very high	88.1	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	24%	0.243	C	C	.	.			trans	-92.7	-14.2	176.4	-63.9	0	0	0	0	113.5	E266 F269 L273 L317 R319 P323 T324	E266-V321 HydrophobicContact CG-CG1 4.3Å; F269-V321 HydrophobicContact CB-CG2 4.16Å; L273-V321 HydrophobicContact CD1-CG2 3.83Å; L317-V321 HydrophobicContact CD1-CG1 3.85Å; L317-V321 HydrophobicContact CD1-CG2 4.4Å; R319-V321 HydrophobicContact CG-CG1 4.22Å; R319-V321 PolarHBondContact O-N 2.99Å; V321-P323 VanDerWaalsContact C-CD 3.49Å; V321-T324 WeakPolarHBondContact O-CB 3.37Å; V321-T324 PolarHBondContact O-N 3.25Å; V321-T324 PolarHBondContact O-OG1 3.22Å
322	A	91.2	Very high	88	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-55	-39	-178.2	0	0	0	0	0	114.4	L273 L310 N320 T324 V325 L353 W357	L273-A322 HydrophobicContact CD1-CB 4.04Å; L273-A322 HydrophobicContact CD2-CB 4.43Å; L310-A322 HydrophobicContact CD2-CB 3.95Å; N320-A322 VanDerWaalsContact OD1-CB 3.26Å; N320-A322 WeakPolarHBondContact OD1-CB 3.19Å; N320-A322 PolarHBondContact OD1-N 2.88Å; A322-T324 PolarHBondContact O-N 2.77Å; A322-V325 WeakPolarHBondContact O-CB 3.36Å; A322-V325 PolarHBondContact O-N 3.22Å; A322-L353 CarbonylContact C-O 3.4Å; A322-L353 HydrophobicContact CB-CB 4.48Å; A322-L353 HydrophobicContact CB-CD2 3.98Å; A322-W357 HydrophobicContact CB-CZ2 4.08Å; A322-W357 PolarHBondContact O-NE1 2.9Å
323	P	91.6	Very high	88	Confident	66 Å²	66	44.2 Å²	44.2	43%	0.429	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-60.7	-17.4	175.9	-26.4	35.7	0	0	0	115.1	V321 L353	V321-P323 VanDerWaalsContact C-CD 3.49Å; P323-L353 VanDerWaalsContact CA-O 3.23Å; P323-L353 WeakPolarHBondContact CA-O 3.49Å; P323-L353 WeakPolarHBondContact CG-O 3.18Å; P323-L353 VanDerWaalsContact N-O 3.17Å
324	T	90.2	Very high	88.1	Confident	96 Å²	96	44.2 Å²	44.2	59%	0.589	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-85.1	-14	176.1	74.5	0	0	0	0	113.3	V321 A322 A326	V321-T324 WeakPolarHBondContact O-CB 3.37Å; V321-T324 PolarHBondContact O-N 3.25Å; V321-T324 PolarHBondContact O-OG1 3.22Å; A322-T324 PolarHBondContact O-N 2.77Å; T324-A326 PolarHBondContact O-N 3.26Å
325	V	92.7	Very high	88.4	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.012	24%	0.239	C	C	.	.			trans	-85.1	77.2	-170.4	-170.8	0	0	0	0	110.6	L273 K274 K277 A322 W357	L273-V325 HydrophobicContact CB-CB 4.49Å; L273-V325 HydrophobicContact CB-CG1 4.18Å; L273-V325 HydrophobicContact CB-CG2 3.95Å; L273-V325 HydrophobicContact CD1-CG2 4.15Å; K274-V325 HydrophobicContact CB-CG1 4.49Å; K274-V325 HydrophobicContact CG-CG1 3.57Å; K277-V325 HydrophobicContact CD-CG1 4.11Å; K277-V325 PolarHBondContact NZ-O 3.34Å; A322-V325 WeakPolarHBondContact O-CB 3.36Å; A322-V325 PolarHBondContact O-N 3.22Å; V325-W357 HydrophobicContact CB-CZ2 4.22Å; V325-W357 HydrophobicContact CG1-CZ2 4.46Å
326	A	86.9	Confident	88.8	Confident	32 Å²	32	40.8 Å²	40.8	26%	0.264	24%	0.239	S	C	.	.			trans	-68.8	-53.4	-177.6	0	0	0	0	0	113.6	K277 T324 P328 L329 P369	K277-A326 PolarHBondContact NZ-O 3.37Å; T324-A326 PolarHBondContact O-N 3.26Å; A326-P328 CarbonylContact O-C 3.58Å; A326-P328 VanDerWaalsContact O-C 3.24Å; A326-P328 VanDerWaalsContact O-O 3.08Å; A326-L329 PolarHBondContact O-N 2.71Å; A326-P369 HydrophobicContact CB-CB 4.11Å; A326-P369 HydrophobicContact CB-CG 4.36Å
327	S	88.1	Confident	89.3	Confident	17 Å²	17	40.1 Å²	40.1	12%	0.119	23%	0.227	C	C	.	.	S	Bend	trans	-94.3	138	-177.6	-166.9	0	0	0	0	112.5	K274 P370 Y372	K274-S327 WeakPolarHBondContact CD-O 3.14Å; K274-S327 WeakPolarHBondContact CG-O 3.5Å; S327-P370 WeakPolarHBondContact CB-O 3.31Å; S327-P370 PolarHBondContact OG-O 3.5Å; S327-Y372 PolarHBondContact OG-N 2.91Å
328	P	91.6	Very high	89.8	Confident	17 Å²	17	38.6 Å²	38.6	11%	0.11	22%	0.219	C	C	.	.	S	Bend	cis	-72.1	152.2	-8.7	30.6	-32	0	0	0	110.6	K277 L278 A326 Y372	K277-P328 HydrophobicContact CB-CG 3.73Å; K277-P328 WeakPolarHBondContact CD-O 3.49Å; K277-P328 WeakPolarHBondContact CE-O 3.39Å; K277-P328 PolarHBondContact NZ-O 3Å; L278-P328 HydrophobicContact CB-CG 4.36Å; A326-P328 CarbonylContact O-C 3.58Å; A326-P328 VanDerWaalsContact O-C 3.24Å; A326-P328 VanDerWaalsContact O-O 3.08Å; P328-Y372 HydrophobicContact CG-CD1 4.02Å; P328-Y372 HydrophobicContact CG-CG 4.41Å
329	L	87.9	Confident	90.3	Very high	15 Å²	15	40.4 Å²	40.4	8%	0.079	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71.5	154.9	164.6	-69.1	173.9	0	0	0	109.3	N281 A326 A356 P361 W364 L368 P369	N281-L329 PolarHBondContact ND2-O 3.02Å; A326-L329 PolarHBondContact O-N 2.71Å; L329-A356 HydrophobicContact CD2-CB 4.36Å; L329-P361 HydrophobicContact CB-CG 4.06Å; L329-P361 HydrophobicContact CD1-CB 4.38Å; L329-P361 HydrophobicContact CD1-CG 4.44Å; L329-W364 HydrophobicContact CD1-CB 3.87Å; L329-W364 HydrophobicContact CD1-CD2 3.89Å; L329-W364 HydrophobicContact CD1-CE3 4.47Å; L329-W364 HydrophobicContact CD1-CG 3.59Å; L329-W364 HydrophobicContact CD2-CD2 3.93Å; L329-W364 HydrophobicContact CD2-CE3 3.85Å; L329-W364 HydrophobicContact CD2-CH2 4.46Å; L329-W364 HydrophobicContact CD2-CZ2 4.5Å; L329-W364 HydrophobicContact CD2-CZ3 4.14Å; L329-L368 HydrophobicContact CD1-CD2 4.01Å; L329-P369 HydrophobicContact CD1-CG 4.21Å; L329-P369 HydrophobicContact CG-CG 3.97Å
330	L	90.9	Very high	90.6	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-84.1	134.1	177.9	-59.9	-171.6	0	0	0	110.1	K277 F280 N281 M338 W357 P360 P361	K277-L330 HydrophobicContact CB-CD2 3.57Å; K277-L330 HydrophobicContact CG-CD2 3.9Å; K277-L330 WeakPolarHBondContact O-CD2 3.27Å; F280-L330 HydrophobicContact CB-CD2 4.28Å; F280-L330 HydrophobicContact CD2-CD1 4.27Å; F280-L330 HydrophobicContact CD2-CD2 4.35Å; N281-L330 VanDerWaalsContact OD1-CA 3.25Å; N281-L330 WeakPolarHBondContact OD1-CA 3.1Å; L330-M338 HydrophobicContact CD1-CE 3.47Å; L330-M338 VanDerWaalsContact CD1-CE 3.47Å; L330-M338 HydrophobicContact CD1-SD 4.34Å; L330-W357 HydrophobicContact CD1-CB 4.45Å; L330-W357 HydrophobicContact CD1-CE3 4.41Å; L330-W357 VanDerWaalsContact CD1-O 3.27Å; L330-W357 WeakPolarHBondContact CD1-O 3.5Å; L330-P360 VanDerWaalsContact O-CA 3.22Å; L330-P360 WeakPolarHBondContact O-CA 3.29Å; L330-P360 WeakPolarHBondContact O-CB 3.31Å; L330-P361 WeakPolarHBondContact O-CD 3.45Å
331	S	90	Very high	91	Very high	26 Å²	26	41.1 Å²	41.1	18%	0.182	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69	161.7	-179.1	83.9	0	0	0	0	111.7	N281 E333 A334 R335	N281-S331 PolarHBondContact OD1-N 2.67Å; S331-E333 VanDerWaalsContact C-N 3.26Å; S331-E333 WeakPolarHBondContact CB-OE2 3.5Å; S331-E333 PolarHBondContact O-N 3.14Å; S331-E333 PolarHBondContact OG-OE2 3.28Å; S331-A334 PolarHBondContact O-N 3.13Å; S331-A334 VanDerWaalsContact O-N 3.12Å; S331-A334 PolarHBondContact OG-N 2.79Å; S331-R335 PolarHBondContact O-N 2.84Å
332	L	89.2	Confident	91.1	Very high	63 Å²	63	42.2 Å²	42.2	33%	0.33	23%	0.23	S	C	.	.	H	α-helix	trans	-55.8	-43.5	176.8	-180	60	0	0	0	111.4	A334 R335 E336	L332-A334 VanDerWaalsContact C-N 3.3Å; L332-A334 PolarHBondContact O-N 3.36Å; L332-R335 WeakPolarHBondContact O-CB 3.26Å; L332-R335 PolarHBondContact O-N 3.32Å; L332-E336 WeakPolarHBondContact O-CG 3.39Å; L332-E336 PolarHBondContact O-N 2.96Å
333	E	90.1	Very high	91.2	Very high	93 Å²	93	45.9 Å²	45.9	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-68	-29.2	179.7	-47.4	81.2	177.7	0	0	112.4	A284 S331 L337	A284-E333 HydrophobicContact CB-CB 4.14Å; S331-E333 VanDerWaalsContact C-N 3.26Å; S331-E333 WeakPolarHBondContact CB-OE2 3.5Å; S331-E333 PolarHBondContact O-N 3.14Å; S331-E333 PolarHBondContact OG-OE2 3.28Å; E333-L337 WeakPolarHBondContact O-CB 3.44Å; E333-L337 PolarHBondContact O-N 2.64Å
334	A	92.4	Very high	91.3	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-75.4	-39.2	174.2	0	0	0	0	0	111.6	A284 S331 L332 E336 L337 M338	A284-A334 VanDerWaalsContact CB-CA 3.46Å; A284-A334 HydrophobicContact CB-CB 3.68Å; S331-A334 PolarHBondContact O-N 3.13Å; S331-A334 VanDerWaalsContact O-N 3.12Å; S331-A334 PolarHBondContact OG-N 2.79Å; L332-A334 VanDerWaalsContact C-N 3.3Å; L332-A334 PolarHBondContact O-N 3.36Å; A334-E336 VanDerWaalsContact C-N 3.32Å; A334-E336 PolarHBondContact O-N 2.64Å; A334-L337 PolarHBondContact O-N 3.33Å; A334-M338 VanDerWaalsContact O-CE 3.31Å; A334-M338 WeakPolarHBondContact O-CE 3.25Å; A334-M338 WeakPolarHBondContact O-CG 3.32Å; A334-M338 PolarHBondContact O-N 3.43Å
335	R	92.6	Very high	91.4	Very high	54 Å²	54	49 Å²	49	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-45	170.6	-174.2	177.8	65	63.7	-11.9	111	S331 L332 Q339 W350 R358	S331-R335 PolarHBondContact O-N 2.84Å; L332-R335 WeakPolarHBondContact O-CB 3.26Å; L332-R335 PolarHBondContact O-N 3.32Å; R335-Q339 WeakPolarHBondContact O-CB 3.43Å; R335-Q339 VanDerWaalsContact O-CG 3.28Å; R335-Q339 WeakPolarHBondContact O-CG 3.29Å; R335-Q339 PolarHBondContact O-N 2.93Å; R335-W350 HydrophobicContact CG-CH2 4.06Å; R335-W350 HydrophobicContact CG-CZ2 4.17Å; R335-R358 WeakPolarHBondContact CD-O 3.25Å
336	E	92.3	Very high	91.5	Very high	82 Å²	82	49.8 Å²	49.8	38%	0.383	27%	0.269	S	S	.	.	H	α-helix	trans	-66.6	-42.3	176.7	-72	175.8	173.7	0	0	112.7	L332 A334 M338 Q339 N340	L332-E336 WeakPolarHBondContact O-CG 3.39Å; L332-E336 PolarHBondContact O-N 2.96Å; A334-E336 VanDerWaalsContact C-N 3.32Å; A334-E336 PolarHBondContact O-N 2.64Å; E336-M338 VanDerWaalsContact C-N 3.35Å; E336-M338 PolarHBondContact O-N 2.69Å; E336-Q339 PolarHBondContact O-N 3Å; E336-N340 PolarHBondContact O-N 3.4Å; E336-N340 VanDerWaalsContact O-N 3.12Å; E336-N340 PolarHBondContact O-ND2 3.41Å
337	L	92.1	Very high	91.9	Very high	16 Å²	16	50.2 Å²	50.2	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-46.3	176.6	-176	67.4	0	0	0	111	L283 A284 K287 L299 E333 A334 N340 C341	L283-L337 HydrophobicContact CB-CD2 4.39Å; A284-L337 HydrophobicContact CB-CD2 4.32Å; K287-L337 HydrophobicContact CD-CD1 4.44Å; L299-L337 HydrophobicContact CD2-CG 4.32Å; E333-L337 WeakPolarHBondContact O-CB 3.44Å; E333-L337 PolarHBondContact O-N 2.64Å; A334-L337 PolarHBondContact O-N 3.33Å; L337-N340 PolarHBondContact O-N 3.08Å; L337-C341 WeakPolarHBondContact O-CB 3.39Å; L337-C341 PolarHBondContact O-N 3.44Å; L337-C341 PolarHBondContact O-SG 2.99Å
338	M	93	Very high	92.1	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-39.7	177.1	-69.5	-177.9	-65.5	0	0	112.9	F280 L299 L330 A334 E336 N340 L342 W350	F280-M338 HydrophobicContact CD2-SD 4.16Å; F280-M338 HydrophobicContact CE2-SD 4.43Å; F280-M338 HydrophobicContact CG-SD 4.42Å; L299-M338 HydrophobicContact CD1-CG 4.07Å; L299-M338 HydrophobicContact CD2-CG 4.05Å; L330-M338 HydrophobicContact CD1-CE 3.47Å; L330-M338 VanDerWaalsContact CD1-CE 3.47Å; L330-M338 HydrophobicContact CD1-SD 4.34Å; A334-M338 VanDerWaalsContact O-CE 3.31Å; A334-M338 WeakPolarHBondContact O-CE 3.25Å; A334-M338 WeakPolarHBondContact O-CG 3.32Å; A334-M338 PolarHBondContact O-N 3.43Å; E336-M338 VanDerWaalsContact C-N 3.35Å; E336-M338 PolarHBondContact O-N 2.69Å; M338-N340 VanDerWaalsContact C-N 3.27Å; M338-N340 PolarHBondContact O-N 3.49Å; M338-L342 HydrophobicContact CB-CD1 3.8Å; M338-L342 HydrophobicContact CB-CG 4.17Å; M338-L342 HydrophobicContact CG-CD1 4.14Å; M338-L342 WeakPolarHBondContact O-CB 3.44Å; M338-L342 VanDerWaalsContact O-CG 3.29Å; M338-L342 WeakPolarHBondContact O-CG 3.46Å; M338-L342 PolarHBondContact O-N 3.14Å; M338-W350 HydrophobicContact CB-CD2 4.42Å; M338-W350 HydrophobicContact CB-CE3 4.31Å; M338-W350 HydrophobicContact CB-CH2 4.28Å; M338-W350 HydrophobicContact CB-CZ2 4.38Å; M338-W350 HydrophobicContact CB-CZ3 4.24Å; M338-W350 HydrophobicContact CE-CD2 4.46Å; M338-W350 HydrophobicContact CE-CH2 4.44Å; M338-W350 HydrophobicContact CE-CZ2 3.57Å; M338-W350 HydrophobicContact SD-CD2 4.29Å; M338-W350 HydrophobicContact SD-CG 4.39Å; M338-W350 HydrophobicContact SD-CZ2 4.42Å
339	Q	92.6	Very high	92.3	Very high	107 Å²	107	54.9 Å²	54.9	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-65.5	-27.9	178.6	-78.1	174.4	-20.7	0	0	113.9	R335 E336 W350	R335-Q339 WeakPolarHBondContact O-CB 3.43Å; R335-Q339 VanDerWaalsContact O-CG 3.28Å; R335-Q339 WeakPolarHBondContact O-CG 3.29Å; R335-Q339 PolarHBondContact O-N 2.93Å; E336-Q339 PolarHBondContact O-N 3Å; Q339-W350 HydrophobicContact CG-CH2 3.65Å; Q339-W350 HydrophobicContact CG-CZ3 3.66Å
340	N	92.1	Very high	92.6	Very high	136 Å²	136	54.3 Å²	54.3	73%	0.727	29%	0.289	S	S	*	.	H	α-helix	trans	-95.6	-23	-178.4	-69.8	-65.4	0	0	0	114	E336 L337 M338	E336-N340 PolarHBondContact O-N 3.4Å; E336-N340 VanDerWaalsContact O-N 3.12Å; E336-N340 PolarHBondContact O-ND2 3.41Å; L337-N340 PolarHBondContact O-N 3.08Å; M338-N340 VanDerWaalsContact C-N 3.27Å; M338-N340 PolarHBondContact O-N 3.49Å
341	C	92.9	Very high	92.7	Very high	34 Å²	34	58.5 Å²	58.5	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-109.8	-28.9	-171.6	-62.5	0	0	0	0	115.2	P296 L299 H300 L337	P296-C341 HydrophobicContact CB-CB 4.25Å; L299-C341 HydrophobicContact CD2-CB 4.11Å; H300-C341 PolarHBondContact CE1-O 2.94Å; H300-C341 PolarHBondContact NE2-O 3.04Å; L337-C341 WeakPolarHBondContact O-CB 3.39Å; L337-C341 PolarHBondContact O-N 3.44Å; L337-C341 PolarHBondContact O-SG 2.99Å
342	L	93.4	Very high	92.8	Very high	25 Å²	25	60.1 Å²	60.1	13%	0.131	32%	0.322	C	S	.	.			trans	-70.4	140.7	-172.6	-66	-177	0	0	0	113.3	L299 F303 M338 E346 W350	L299-L342 HydrophobicContact CD2-CD2 3.6Å; L299-L342 HydrophobicContact CD2-CG 4.14Å; L299-L342 HydrophobicContact CG-CD2 3.79Å; F303-L342 HydrophobicContact CD2-CD2 3.65Å; F303-L342 HydrophobicContact CE1-CD1 4.15Å; F303-L342 HydrophobicContact CE2-CD1 3.81Å; F303-L342 HydrophobicContact CE2-CD2 3.5Å; F303-L342 VanDerWaalsContact CE2-CD2 3.5Å; F303-L342 HydrophobicContact CE2-CG 4.31Å; F303-L342 HydrophobicContact CG-CD2 4.34Å; F303-L342 HydrophobicContact CZ-CD1 3.52Å; F303-L342 HydrophobicContact CZ-CD2 4.04Å; F303-L342 HydrophobicContact CZ-CG 4.45Å; M338-L342 HydrophobicContact CB-CD1 3.8Å; M338-L342 HydrophobicContact CB-CG 4.17Å; M338-L342 HydrophobicContact CG-CD1 4.14Å; M338-L342 WeakPolarHBondContact O-CB 3.44Å; M338-L342 VanDerWaalsContact O-CG 3.29Å; M338-L342 WeakPolarHBondContact O-CG 3.46Å; M338-L342 PolarHBondContact O-N 3.14Å; L342-E346 HydrophobicContact CB-CB 4.06Å; L342-E346 HydrophobicContact CD1-CB 4.41Å; L342-E346 HydrophobicContact CD2-CB 3.96Å; L342-E346 HydrophobicContact CG-CB 4.35Å; L342-W350 HydrophobicContact CD1-CB 4.18Å; L342-W350 HydrophobicContact CD1-CD2 4.44Å; L342-W350 HydrophobicContact CD1-CE3 4.25Å; L342-W350 HydrophobicContact CD1-CG 4.43Å
343	T	93.6	Very high	93	Very high	76 Å²	76	57.1 Å²	57.1	47%	0.466	31%	0.306	S	S	.	.			trans	-67.8	162.5	166.8	66.4	0	0	0	0	110.8	H345 E346 S347	T343-H345 PolarHBondContact O-N 3.35Å; T343-E346 VanDerWaalsContact CB-OE2 3.27Å; T343-E346 WeakPolarHBondContact CB-OE2 3.47Å; T343-E346 VanDerWaalsContact CG2-OE2 3.32Å; T343-E346 WeakPolarHBondContact CG2-OE2 3.48Å; T343-E346 PolarHBondContact N-OE2 2.94Å; T343-E346 PolarHBondContact O-N 3.08Å; T343-E346 VanDerWaalsContact O-N 3.11Å; T343-E346 VanDerWaalsContact OG1-CD 3.31Å; T343-E346 WeakPolarHBondContact OG1-CG 3.08Å; T343-E346 PolarHBondContact OG1-OE2 3.38Å; T343-S347 WeakPolarHBondContact O-CB 3.49Å; T343-S347 PolarHBondContact O-N 3.45Å
344	S	92.6	Very high	93	Very high	100 Å²	100	53.3 Å²	53.3	70%	0.699	29%	0.292	S	S	*	.	H	α-helix	trans	-53.1	-40.8	179.8	-45.5	0	0	0	0	113.1	S347 D348	S344-S347 WeakPolarHBondContact O-CB 3.43Å; S344-S347 PolarHBondContact O-N 2.87Å; S344-D348 PolarHBondContact O-N 3.21Å
345	H	92.1	Very high	92.8	Very high	128 Å²	128	57.1 Å²	57.1	59%	0.593	31%	0.309	S	S	*	.	H	α-helix	trans	-68	-39.8	-179.8	-178.9	46.2	0	0	0	112.7	T343 D348 I349	T343-H345 PolarHBondContact O-N 3.35Å; H345-D348 PolarHBondContact O-N 3.01Å; H345-I349 WeakPolarHBondContact O-CG1 3.28Å; H345-I349 PolarHBondContact O-N 3.4Å
346	E	95.3	Very high	92.6	Very high	19 Å²	19	54.8 Å²	54.8	9%	0.089	30%	0.301	C	S	.	.	H	α-helix	trans	-71.5	-34.5	176.2	-62.5	164.7	121.8	0	0	111.3	H300 F303 L342 T343 I349 W350	H300-E346 WeakPolarHBondContact CA-OE1 3.4Å; H300-E346 IonicContact CE1-OE1 3.44Å; H300-E346 IonicContact CE1-OE2 3.2Å; H300-E346 PolarHBondContact CE1-OE2 3.45Å; H300-E346 VanDerWaalsContact CE1-OE2 3.3Å; H300-E346 IonicContact CG-OE1 3.25Å; H300-E346 VanDerWaalsContact ND1-CD 3.26Å; H300-E346 IonicContact ND1-OE1 2.72Å; H300-E346 PolarHBondContact ND1-OE1 3.47Å; H300-E346 IonicContact ND1-OE2 3.35Å; H300-E346 PolarHBondContact ND1-OE2 3.44Å; F303-E346 HydrophobicContact CB-CB 4.31Å; F303-E346 HydrophobicContact CB-CG 3.78Å; F303-E346 HydrophobicContact CD1-CB 3.65Å; F303-E346 HydrophobicContact CD1-CG 4.04Å; F303-E346 HydrophobicContact CE1-CB 4.13Å; F303-E346 WeakPolarHBondContact CE1-O 3.27Å; F303-E346 HydrophobicContact CG-CB 3.9Å; F303-E346 HydrophobicContact CG-CG 3.94Å; L342-E346 HydrophobicContact CB-CB 4.06Å; L342-E346 HydrophobicContact CD1-CB 4.41Å; L342-E346 HydrophobicContact CD2-CB 3.96Å; L342-E346 HydrophobicContact CG-CB 4.35Å; T343-E346 VanDerWaalsContact CB-OE2 3.27Å; T343-E346 WeakPolarHBondContact CB-OE2 3.47Å; T343-E346 VanDerWaalsContact CG2-OE2 3.32Å; T343-E346 WeakPolarHBondContact CG2-OE2 3.48Å; T343-E346 PolarHBondContact N-OE2 2.94Å; T343-E346 PolarHBondContact O-N 3.08Å; T343-E346 VanDerWaalsContact O-N 3.11Å; T343-E346 VanDerWaalsContact OG1-CD 3.31Å; T343-E346 WeakPolarHBondContact OG1-CG 3.08Å; T343-E346 PolarHBondContact OG1-OE2 3.38Å; E346-I349 WeakPolarHBondContact O-CB 3.36Å; E346-I349 PolarHBondContact O-N 3.08Å; E346-W350 WeakPolarHBondContact O-CB 3.2Å; E346-W350 PolarHBondContact O-N 2.89Å
347	S	94.5	Very high	92.7	Very high	40 Å²	40	50.9 Å²	50.9	28%	0.28	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-44	171.1	-164.1	0	0	0	0	111.2	T343 S344 I349 W350 M351	T343-S347 WeakPolarHBondContact O-CB 3.49Å; T343-S347 PolarHBondContact O-N 3.45Å; S344-S347 WeakPolarHBondContact O-CB 3.43Å; S344-S347 PolarHBondContact O-N 2.87Å; S347-I349 PolarHBondContact O-N 2.91Å; S347-W350 PolarHBondContact O-N 3.25Å; S347-M351 WeakPolarHBondContact O-CB 3.4Å; S347-M351 WeakPolarHBondContact O-CG 3.38Å; S347-M351 PolarHBondContact O-N 2.95Å
348	D	94.1	Very high	92.6	Very high	111 Å²	111	54.1 Å²	54.1	59%	0.594	29%	0.294	S	S	*	.	H	α-helix	trans	-59.5	-43.7	172.7	-71.4	-32.7	0	0	0	111.8	S344 H345 M351 S352	S344-D348 PolarHBondContact O-N 3.21Å; H345-D348 PolarHBondContact O-N 3.01Å; D348-M351 PolarHBondContact O-N 3.04Å; D348-S352 PolarHBondContact O-N 3.13Å
349	I	94.6	Very high	92.2	Very high	21 Å²	21	55.4 Å²	55.4	11%	0.108	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-49.4	173.7	-69.7	165.5	0	0	0	110.1	F303 L306 A307 L310 H345 E346 S347 M351 S352 L353	F303-I349 HydrophobicContact CD1-CB 4.2Å; F303-I349 HydrophobicContact CD1-CG2 3.96Å; F303-I349 HydrophobicContact CE1-CB 4.22Å; F303-I349 HydrophobicContact CE1-CG2 3.96Å; L306-I349 HydrophobicContact CD2-CG2 4.41Å; A307-I349 HydrophobicContact CB-CD1 4.15Å; L310-I349 HydrophobicContact CD1-CG2 3.74Å; H345-I349 WeakPolarHBondContact O-CG1 3.28Å; H345-I349 PolarHBondContact O-N 3.4Å; E346-I349 WeakPolarHBondContact O-CB 3.36Å; E346-I349 PolarHBondContact O-N 3.08Å; S347-I349 PolarHBondContact O-N 2.91Å; I349-M351 PolarHBondContact O-N 3.11Å; I349-S352 WeakPolarHBondContact O-CA 3.1Å; I349-S352 WeakPolarHBondContact O-CB 3.22Å; I349-S352 PolarHBondContact O-N 3.42Å; I349-S352 PolarHBondContact O-OG 2.88Å; I349-L353 WeakPolarHBondContact O-CG 3.21Å; I349-L353 PolarHBondContact O-N 2.88Å
350	W	95.4	Very high	92	Very high	3 Å²	3	50.4 Å²	50.4	1%	0.011	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-40.7	179.1	179.7	41.9	0	0	0	112.6	F303 R335 M338 Q339 L342 E346 S347 S352 L353 W357 R358	F303-W350 HydrophobicContact CE1-CB 4.04Å; F303-W350 HydrophobicContact CZ-CB 4.05Å; R335-W350 HydrophobicContact CG-CH2 4.06Å; R335-W350 HydrophobicContact CG-CZ2 4.17Å; M338-W350 HydrophobicContact CB-CD2 4.42Å; M338-W350 HydrophobicContact CB-CE3 4.31Å; M338-W350 HydrophobicContact CB-CH2 4.28Å; M338-W350 HydrophobicContact CB-CZ2 4.38Å; M338-W350 HydrophobicContact CB-CZ3 4.24Å; M338-W350 HydrophobicContact CE-CD2 4.46Å; M338-W350 HydrophobicContact CE-CH2 4.44Å; M338-W350 HydrophobicContact CE-CZ2 3.57Å; M338-W350 HydrophobicContact SD-CD2 4.29Å; M338-W350 HydrophobicContact SD-CG 4.39Å; M338-W350 HydrophobicContact SD-CZ2 4.42Å; Q339-W350 HydrophobicContact CG-CH2 3.65Å; Q339-W350 HydrophobicContact CG-CZ3 3.66Å; L342-W350 HydrophobicContact CD1-CB 4.18Å; L342-W350 HydrophobicContact CD1-CD2 4.44Å; L342-W350 HydrophobicContact CD1-CE3 4.25Å; L342-W350 HydrophobicContact CD1-CG 4.43Å; E346-W350 WeakPolarHBondContact O-CB 3.2Å; E346-W350 PolarHBondContact O-N 2.89Å; S347-W350 PolarHBondContact O-N 3.25Å; W350-S352 VanDerWaalsContact C-N 3.26Å; W350-S352 PolarHBondContact O-N 3.5Å; W350-L353 PolarHBondContact O-N 2.63Å; W350-W357 PolarHBondContact NE1-O 2.98Å; W350-R358 HydrophobicContact CZ2-CG 4.11Å
351	M	92.7	Very high	91.4	Very high	90 Å²	90	46.2 Å²	46.2	44%	0.443	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-26.5	174	-66.3	-64.9	166.2	0	0	112.4	S347 D348 I349 R358	S347-M351 WeakPolarHBondContact O-CB 3.4Å; S347-M351 WeakPolarHBondContact O-CG 3.38Å; S347-M351 PolarHBondContact O-N 2.95Å; D348-M351 PolarHBondContact O-N 3.04Å; I349-M351 PolarHBondContact O-N 3.11Å; M351-R358 PolarHBondContact O-NH1 3.12Å; M351-R358 WeakPolarHBondContact SD-CD 3.27Å
352	S	92.3	Very high	90.8	Very high	61 Å²	61	51 Å²	51	43%	0.427	28%	0.278	S	S	.	.	H	α-helix	trans	-75	-21.7	173.8	85.7	0	0	0	0	114.7	D348 I349 W350 G354	D348-S352 PolarHBondContact O-N 3.13Å; I349-S352 WeakPolarHBondContact O-CA 3.1Å; I349-S352 WeakPolarHBondContact O-CB 3.22Å; I349-S352 PolarHBondContact O-N 3.42Å; I349-S352 PolarHBondContact O-OG 2.88Å; W350-S352 VanDerWaalsContact C-N 3.26Å; W350-S352 PolarHBondContact O-N 3.5Å; S352-G354 PolarHBondContact O-N 3.37Å
353	L	91.6	Very high	90.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-18	-174.3	-57.4	-179.1	0	0	0	114.5	L306 L310 A322 P323 I349 W350 W357	L306-L353 HydrophobicContact CD2-CD1 4.12Å; L310-L353 HydrophobicContact CD1-CD2 3.66Å; L310-L353 HydrophobicContact CD2-CD2 3.81Å; L310-L353 HydrophobicContact CG-CD2 4.33Å; A322-L353 CarbonylContact C-O 3.4Å; A322-L353 HydrophobicContact CB-CB 4.48Å; A322-L353 HydrophobicContact CB-CD2 3.98Å; P323-L353 VanDerWaalsContact CA-O 3.23Å; P323-L353 WeakPolarHBondContact CA-O 3.49Å; P323-L353 WeakPolarHBondContact CG-O 3.18Å; P323-L353 VanDerWaalsContact N-O 3.17Å; I349-L353 WeakPolarHBondContact O-CG 3.21Å; I349-L353 PolarHBondContact O-N 2.88Å; W350-L353 PolarHBondContact O-N 2.63Å; L353-W357 HydrophobicContact CB-CB 3.78Å; L353-W357 HydrophobicContact CB-CD2 3.8Å; L353-W357 HydrophobicContact CB-CE3 4.41Å; L353-W357 HydrophobicContact CB-CG 3.51Å; L353-W357 HydrophobicContact CD1-CB 4.28Å; L353-W357 HydrophobicContact CD1-CD2 3.61Å; L353-W357 HydrophobicContact CD1-CE3 3.32Å; L353-W357 HydrophobicContact CD1-CG 4.06Å; L353-W357 HydrophobicContact CD1-CH2 4.41Å; L353-W357 HydrophobicContact CD1-CZ3 3.77Å; L353-W357 HydrophobicContact CG-CD2 4.28Å; L353-W357 HydrophobicContact CG-CE3 4.43Å; L353-W357 HydrophobicContact CG-CG 4.42Å
354	G	90.7	Very high	89.7	Confident	13 Å²	13	52.3 Å²	52.3	13%	0.134	28%	0.28	C	S	.	.			trans	98.6	172.8	178.8	0	0	0	0	0	115.2	S352 A356 W357 R358	S352-G354 PolarHBondContact O-N 3.37Å; G354-A356 PolarHBondContact O-N 2.81Å; G354-W357 PolarHBondContact O-N 2.87Å; G354-W357 VanDerWaalsContact O-N 3.09Å; G354-R358 PolarHBondContact O-NH1 2.92Å
355	E	89.1	Confident	89.1	Confident	81 Å²	81	53.5 Å²	53.5	38%	0.379	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-52.6	-46.5	-172.2	-179.2	-162.8	-139.2	0	0	113.8	W357 R358 T359 W364 K366	E355-W357 PolarHBondContact O-N 2.81Å; E355-R358 PolarHBondContact O-N 2.93Å; E355-T359 PolarHBondContact O-N 2.84Å; E355-T359 PolarHBondContact O-OG1 3.39Å; E355-W364 HydrophobicContact CG-CZ3 4.22Å; E355-K366 IonicContact OE1-NZ 3.85Å; E355-K366 PolarHBondContact OE1-NZ 2.95Å; E355-K366 IonicContact OE2-NZ 2.76Å; E355-K366 PolarHBondContact OE2-NZ 3.35Å
356	A	87.9	Confident	88.5	Confident	4 Å²	4	52 Å²	52	3%	0.033	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-66.8	-5.2	-178.2	0	0	0	0	0	114.7	K277 L329 G354 W364	K277-A356 WeakPolarHBondContact CE-O 3.47Å; K277-A356 PolarHBondContact NZ-O 2.81Å; L329-A356 HydrophobicContact CD2-CB 4.36Å; G354-A356 PolarHBondContact O-N 2.81Å; A356-W364 HydrophobicContact CB-CH2 3.8Å; A356-W364 HydrophobicContact CB-CZ3 3.96Å
357	W	93.8	Very high	87.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-101.5	1.2	171.8	-63.3	76	0	0	0	112.7	L273 F276 K277 F280 A322 V325 L330 W350 L353 G354 E355	L273-W357 HydrophobicContact CB-CH2 4.1Å; L273-W357 HydrophobicContact CB-CZ2 4.01Å; L273-W357 HydrophobicContact CD2-CH2 3.85Å; L273-W357 HydrophobicContact CD2-CZ2 4.05Å; L273-W357 WeakPolarHBondContact O-CH2 3.31Å; F276-W357 HydrophobicContact CB-CH2 4.21Å; F276-W357 HydrophobicContact CB-CZ3 4.23Å; K277-W357 HydrophobicContact CB-CZ3 4.5Å; K277-W357 HydrophobicContact CD-CD2 3.84Å; K277-W357 HydrophobicContact CD-CE3 3.98Å; K277-W357 HydrophobicContact CD-CH2 3.99Å; K277-W357 HydrophobicContact CD-CZ2 3.8Å; K277-W357 HydrophobicContact CD-CZ3 4.06Å; K277-W357 HydrophobicContact CG-CD2 3.91Å; K277-W357 HydrophobicContact CG-CE3 3.5Å; K277-W357 VanDerWaalsContact CG-CE3 3.5Å; K277-W357 HydrophobicContact CG-CH2 3.45Å; K277-W357 VanDerWaalsContact CG-CH2 3.45Å; K277-W357 HydrophobicContact CG-CZ2 3.83Å; K277-W357 HydrophobicContact CG-CZ3 3.26Å; F280-W357 HydrophobicContact CD2-CZ3 4.46Å; F280-W357 HydrophobicContact CE2-CE3 4.34Å; F280-W357 AromaticContact CE2-CZ3 3.99Å; F280-W357 HydrophobicContact CE2-CZ3 3.99Å; A322-W357 HydrophobicContact CB-CZ2 4.08Å; A322-W357 PolarHBondContact O-NE1 2.9Å; V325-W357 HydrophobicContact CB-CZ2 4.22Å; V325-W357 HydrophobicContact CG1-CZ2 4.46Å; L330-W357 HydrophobicContact CD1-CB 4.45Å; L330-W357 HydrophobicContact CD1-CE3 4.41Å; L330-W357 VanDerWaalsContact CD1-O 3.27Å; L330-W357 WeakPolarHBondContact CD1-O 3.5Å; W350-W357 PolarHBondContact NE1-O 2.98Å; L353-W357 HydrophobicContact CB-CB 3.78Å; L353-W357 HydrophobicContact CB-CD2 3.8Å; L353-W357 HydrophobicContact CB-CE3 4.41Å; L353-W357 HydrophobicContact CB-CG 3.51Å; L353-W357 HydrophobicContact CD1-CB 4.28Å; L353-W357 HydrophobicContact CD1-CD2 3.61Å; L353-W357 HydrophobicContact CD1-CE3 3.32Å; L353-W357 HydrophobicContact CD1-CG 4.06Å; L353-W357 HydrophobicContact CD1-CH2 4.41Å; L353-W357 HydrophobicContact CD1-CZ3 3.77Å; L353-W357 HydrophobicContact CG-CD2 4.28Å; L353-W357 HydrophobicContact CG-CE3 4.43Å; L353-W357 HydrophobicContact CG-CG 4.42Å; G354-W357 PolarHBondContact O-N 2.87Å; G354-W357 VanDerWaalsContact O-N 3.09Å; E355-W357 PolarHBondContact O-N 2.81Å
358	R	89.8	Confident	86.7	Confident	84 Å²	84	60.7 Å²	60.7	32%	0.317	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-27.5	-178.3	-62.8	-170.3	-64.3	-92.9	15.7	113.6	R335 W350 M351 G354 E355 P360	R335-R358 WeakPolarHBondContact CD-O 3.25Å; W350-R358 HydrophobicContact CZ2-CG 4.11Å; M351-R358 PolarHBondContact O-NH1 3.12Å; M351-R358 WeakPolarHBondContact SD-CD 3.27Å; G354-R358 PolarHBondContact O-NH1 2.92Å; E355-R358 PolarHBondContact O-N 2.93Å; R358-P360 WeakPolarHBondContact O-CD 3.21Å
359	T	86.3	Confident	85.9	Confident	31 Å²	31	56.8 Å²	56.8	19%	0.19	31%	0.306	C	S	.	.	S	Bend	trans	-89.6	117.3	177.5	-53.6	0	0	0	0	110	E355 D363 W364	E355-T359 PolarHBondContact O-N 2.84Å; E355-T359 PolarHBondContact O-OG1 3.39Å; T359-D363 VanDerWaalsContact CG2-C 3.47Å; T359-D363 HydrophobicContact CG2-CB 3.67Å; T359-D363 VanDerWaalsContact CG2-O 3.28Å; T359-D363 WeakPolarHBondContact CG2-O 3.32Å; T359-W364 HydrophobicContact CG2-CB 4.42Å; T359-W364 HydrophobicContact CG2-CE3 3.84Å
360	P	86.8	Confident	84.9	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	33%	0.333	C	S	.	.			trans	-75.3	169.3	175.7	35.3	-39.1	0	0	0	112	L330 R358 E362 D363 W364	L330-P360 VanDerWaalsContact O-CA 3.22Å; L330-P360 WeakPolarHBondContact O-CA 3.29Å; L330-P360 WeakPolarHBondContact O-CB 3.31Å; R358-P360 WeakPolarHBondContact O-CD 3.21Å; P360-E362 WeakPolarHBondContact CB-OE2 3.49Å; P360-E362 PolarHBondContact O-N 3.24Å; P360-E362 VanDerWaalsContact O-N 3.13Å; P360-D363 WeakPolarHBondContact CD-OD2 3.31Å; P360-D363 HydrophobicContact CG-CB 4.16Å; P360-D363 WeakPolarHBondContact CG-OD2 3.42Å; P360-D363 PolarHBondContact O-N 2.85Å; P360-W364 PolarHBondContact O-N 3.44Å
361	P	80.1	Confident	83.9	Confident	49 Å²	49	65.5 Å²	65.5	32%	0.318	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.8	-175.9	-25	32.7	0	0	0	115	L329 L330 W364 L368	L329-P361 HydrophobicContact CB-CG 4.06Å; L329-P361 HydrophobicContact CD1-CB 4.38Å; L329-P361 HydrophobicContact CD1-CG 4.44Å; L330-P361 WeakPolarHBondContact O-CD 3.45Å; P361-W364 PolarHBondContact O-N 2.95Å; P361-L368 HydrophobicContact CB-CD2 4.35Å
362	E	79.8	Confident	83.5	Confident	135 Å²	135	62.5 Å²	62.5	63%	0.631	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-34.7	-176	-57.6	67.5	-141.9	0	0	111.8	P360	P360-E362 WeakPolarHBondContact CB-OE2 3.49Å; P360-E362 PolarHBondContact O-N 3.24Å; P360-E362 VanDerWaalsContact O-N 3.13Å
363	D	79.5	Confident	83	Confident	95 Å²	95	65.6 Å²	65.6	51%	0.508	35%	0.35	S	S	.	.	S	Bend	trans	-90.5	0.3	177.9	-63.5	-42.1	0	0	0	112.3	T359 P360 T365	T359-D363 VanDerWaalsContact CG2-C 3.47Å; T359-D363 HydrophobicContact CG2-CB 3.67Å; T359-D363 VanDerWaalsContact CG2-O 3.28Å; T359-D363 WeakPolarHBondContact CG2-O 3.32Å; P360-D363 WeakPolarHBondContact CD-OD2 3.31Å; P360-D363 HydrophobicContact CG-CB 4.16Å; P360-D363 WeakPolarHBondContact CG-OD2 3.42Å; P360-D363 PolarHBondContact O-N 2.85Å; D363-T365 PolarHBondContact O-N 3.21Å; D363-T365 VanDerWaalsContact O-N 3.07Å
364	W	85.4	Confident	82.8	Confident	32 Å²	32	65.6 Å²	65.6	12%	0.121	35%	0.351	C	S	.	.			trans	-77.9	96.7	-171.4	-171.6	-107.5	0	0	0	112.3	L329 E355 A356 T359 P360 P361 K366 P367 L368	L329-W364 HydrophobicContact CD1-CB 3.87Å; L329-W364 HydrophobicContact CD1-CD2 3.89Å; L329-W364 HydrophobicContact CD1-CE3 4.47Å; L329-W364 HydrophobicContact CD1-CG 3.59Å; L329-W364 HydrophobicContact CD2-CD2 3.93Å; L329-W364 HydrophobicContact CD2-CE3 3.85Å; L329-W364 HydrophobicContact CD2-CH2 4.46Å; L329-W364 HydrophobicContact CD2-CZ2 4.5Å; L329-W364 HydrophobicContact CD2-CZ3 4.14Å; E355-W364 HydrophobicContact CG-CZ3 4.22Å; A356-W364 HydrophobicContact CB-CH2 3.8Å; A356-W364 HydrophobicContact CB-CZ3 3.96Å; T359-W364 HydrophobicContact CG2-CB 4.42Å; T359-W364 HydrophobicContact CG2-CE3 3.84Å; P360-W364 PolarHBondContact O-N 3.44Å; P361-W364 PolarHBondContact O-N 2.95Å; W364-K366 HydrophobicContact CH2-CD 4.17Å; W364-K366 HydrophobicContact CZ2-CB 3.99Å; W364-K366 HydrophobicContact CZ2-CD 3.99Å; W364-K366 PolarHBondContact NE1-O 3.31Å; W364-K366 PolarHBondContact O-N 3.01Å; W364-K366 VanDerWaalsContact O-N 3.15Å; W364-P367 PolarHBondContact NE1-O 3.07Å; W364-P367 VanDerWaalsContact NE1-O 3.09Å; W364-L368 HydrophobicContact CB-CD2 4.37Å; W364-L368 HydrophobicContact CG-CD2 4.48Å
365	T	79.7	Confident	82.6	Confident	126 Å²	126	69 Å²	69	77%	0.773	37%	0.365	S	S	*	.			trans	-68.7	-7.8	-176.5	58	0	0	0	0	115.9	D363	D363-T365 PolarHBondContact O-N 3.21Å; D363-T365 VanDerWaalsContact O-N 3.07Å
366	K	79.1	Confident	82.6	Confident	95 Å²	95	65.5 Å²	65.5	41%	0.413	35%	0.349	S	S	.	.	S	Bend	trans	-103.2	167.1	-178.7	-69.5	159.5	-165.7	170.1	0	109.3	E355 W364 L368	E355-K366 IonicContact OE1-NZ 3.85Å; E355-K366 PolarHBondContact OE1-NZ 2.95Å; E355-K366 IonicContact OE2-NZ 2.76Å; E355-K366 PolarHBondContact OE2-NZ 3.35Å; W364-K366 HydrophobicContact CH2-CD 4.17Å; W364-K366 HydrophobicContact CZ2-CB 3.99Å; W364-K366 HydrophobicContact CZ2-CD 3.99Å; W364-K366 PolarHBondContact NE1-O 3.31Å; W364-K366 PolarHBondContact O-N 3.01Å; W364-K366 VanDerWaalsContact O-N 3.15Å; K366-L368 PolarHBondContact O-N 3.25Å
367	P	76.8	Confident	82.1	Confident	123 Å²	123	70.6 Å²	70.6	80%	0.799	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-51.5	131.8	171.1	-26.9	35.9	0	0	0	110.9	W364	W364-P367 PolarHBondContact NE1-O 3.07Å; W364-P367 VanDerWaalsContact NE1-O 3.09Å
368	L	74.4	Confident	81.2	Confident	120 Å²	120	73.4 Å²	73.4	63%	0.628	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-58.8	129.6	178.4	-76.4	169.6	0	0	0	109.4	L329 P361 W364 K366	L329-L368 HydrophobicContact CD1-CD2 4.01Å; P361-L368 HydrophobicContact CB-CD2 4.35Å; W364-L368 HydrophobicContact CB-CD2 4.37Å; W364-L368 HydrophobicContact CG-CD2 4.48Å; K366-L368 PolarHBondContact O-N 3.25Å
369	P	78.5	Confident	80.7	Confident	29 Å²	29	71 Å²	71	19%	0.188	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-73.1	152.6	-177	33.6	-37	0	0	0	110.2	A326 L329	A326-P369 HydrophobicContact CB-CB 4.11Å; A326-P369 HydrophobicContact CB-CG 4.36Å; L329-P369 HydrophobicContact CD1-CG 4.21Å; L329-P369 HydrophobicContact CG-CG 3.97Å
370	P	73.5	Confident	80.5	Confident	105 Å²	105	72.4 Å²	72.4	68%	0.682	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-54.6	141.4	-178.7	-27.2	35.1	0	0	0	112.4	S327 Y372	S327-P370 WeakPolarHBondContact CB-O 3.31Å; S327-P370 PolarHBondContact OG-O 3.5Å; P370-Y372 PolarHBondContact O-N 3.33Å
371	P	74.6	Confident	80.4	Confident	101 Å²	101	73.5 Å²	73.5	66%	0.656	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-60.4	128.4	-175.3	24.4	-34.4	0	0	0	111	R373	P371-R373 PolarHBondContact O-N 3.29Å
372	Y	85.1	Confident	80.2	Confident	28 Å²	28	72 Å²	72	11%	0.11	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-68.8	123.5	-179.4	-176.7	-131.2	0	0	0	110.6	D271 K274 K275 L278 S327 P328 P370 P374	D271-Y372 PolarHBondContact OD1-OH 3.19Å; K274-Y372 HydrophobicContact CB-CD1 4.2Å; K274-Y372 HydrophobicContact CB-CD2 4.2Å; K274-Y372 HydrophobicContact CB-CE1 3.69Å; K274-Y372 HydrophobicContact CB-CE2 3.71Å; K274-Y372 HydrophobicContact CB-CG 4.43Å; K274-Y372 VanDerWaalsContact CB-CZ 3.42Å; K274-Y372 HydrophobicContact CD-CD2 3.69Å; K274-Y372 HydrophobicContact CD-CE2 3.42Å; K274-Y372 VanDerWaalsContact CD-CE2 3.42Å; K274-Y372 HydrophobicContact CG-CE2 4.2Å; K275-Y372 WeakPolarHBondContact CG-OH 3.5Å; L278-Y372 HydrophobicContact CB-CD1 4.34Å; L278-Y372 HydrophobicContact CB-CE1 4.31Å; L278-Y372 HydrophobicContact CD2-CD1 4.19Å; L278-Y372 HydrophobicContact CD2-CE1 4.03Å; S327-Y372 PolarHBondContact OG-N 2.91Å; P328-Y372 HydrophobicContact CG-CD1 4.02Å; P328-Y372 HydrophobicContact CG-CG 4.41Å; P370-Y372 PolarHBondContact O-N 3.33Å; Y372-P374 HydrophobicContact CD1-CB 4.43Å; Y372-P374 HydrophobicContact CE1-CB 3.66Å; Y372-P374 HydrophobicContact CE1-CG 4.27Å
373	R	81.4	Confident	80	Confident	125 Å²	125	68.7 Å²	68.7	47%	0.472	38%	0.376	S	S	.	.			trans	-113	100.6	167.3	-58	-171.8	-168.9	-106.8	-5.6	106.8	P371 Y383	P371-R373 PolarHBondContact O-N 3.29Å; R373-Y383 PolarHBondContact NH1-O 3.48Å
374	P	86	Confident	79.4	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.006	37%	0.37	C	S	.	.			trans	-64.7	146.8	176.9	28.9	-35.6	0	0	0	109.8	L278 Y372 F376 P382	L278-P374 HydrophobicContact CD2-CB 4.13Å; L278-P374 HydrophobicContact CD2-CG 3.65Å; Y372-P374 HydrophobicContact CD1-CB 4.43Å; Y372-P374 HydrophobicContact CE1-CB 3.66Å; Y372-P374 HydrophobicContact CE1-CG 4.27Å; P374-F376 HydrophobicContact CB-CD2 4.39Å; P374-F376 HydrophobicContact CB-CE1 4.41Å; P374-F376 HydrophobicContact CB-CE2 3.75Å; P374-F376 HydrophobicContact CB-CZ 3.77Å; P374-F376 HydrophobicContact CG-CE2 3.74Å; P374-F376 HydrophobicContact CG-CZ 3.95Å; P374-P382 HydrophobicContact CG-CG 3.85Å
375	I	86.4	Confident	78.3	Confident	85 Å²	85	69.7 Å²	69.7	44%	0.436	40%	0.396	S	S	.	.			trans	-121.9	122.6	161.3	-56.5	177.8	0	0	0	105.4	K275 F380 A381 V385	K275-I375 PolarHBondContact NZ-O 3.27Å; I375-F380 WeakPolarHBondContact CA-O 3.36Å; I375-A381 HydrophobicContact CG1-CB 4.4Å; I375-V385 HydrophobicContact CD1-CG1 4.49Å
376	F	89.4	Confident	76.9	Confident	7 Å²	7	67.2 Å²	67.2	3%	0.031	39%	0.388	C	S	.	.			trans	-89.7	165.6	-177.6	-64.8	-79.5	0	0	0	111.4	T205 R208 C209 D212 K275 P374 D378 G379 F380 P382	T205-F376 HydrophobicContact CG2-CE2 4.06Å; T205-F376 HydrophobicContact CG2-CZ 3.87Å; R208-F376 HydrophobicContact CB-CB 4.48Å; R208-F376 HydrophobicContact CB-CD1 3.7Å; R208-F376 HydrophobicContact CB-CD2 4.04Å; R208-F376 HydrophobicContact CB-CE1 3.83Å; R208-F376 HydrophobicContact CB-CE2 4.15Å; R208-F376 HydrophobicContact CB-CG 3.81Å; R208-F376 HydrophobicContact CB-CZ 4.04Å; R208-F376 WeakPolarHBondContact O-CD1 3.39Å; C209-F376 HydrophobicContact CB-CE1 4.33Å; D212-F376 WeakPolarHBondContact OD2-CA 3.3Å; K275-F376 HydrophobicContact CD-CD1 4.26Å; K275-F376 HydrophobicContact CD-CE1 4.11Å; K275-F376 HydrophobicContact CG-CE1 4.27Å; P374-F376 HydrophobicContact CB-CD2 4.39Å; P374-F376 HydrophobicContact CB-CE1 4.41Å; P374-F376 HydrophobicContact CB-CE2 3.75Å; P374-F376 HydrophobicContact CB-CZ 3.77Å; P374-F376 HydrophobicContact CG-CE2 3.74Å; P374-F376 HydrophobicContact CG-CZ 3.95Å; F376-D378 WeakPolarHBondContact CB-OD1 3.27Å; F376-D378 PolarHBondContact O-N 2.89Å; F376-D378 VanDerWaalsContact O-N 3.08Å; F376-G379 PolarHBondContact O-N 3.18Å; F376-F380 HydrophobicContact CB-CB 4.36Å; F376-F380 HydrophobicContact CD2-CB 4.24Å; F376-F380 AromaticContact CD2-CD1 3.66Å; F376-F380 HydrophobicContact CD2-CD1 3.66Å; F376-F380 HydrophobicContact CD2-CG 4.39Å; F376-F380 WeakPolarHBondContact CD2-O 3.42Å; F376-F380 AromaticContact CE2-CD1 4Å; F376-F380 HydrophobicContact CE2-CD1 4Å; F376-F380 HydrophobicContact CE2-CE1 4.48Å; F376-F380 PolarHBondContact N-O 3.49Å; F376-P382 HydrophobicContact CE2-CG 4.18Å
377	N	76.9	Confident	75.2	Confident	110 Å²	110	69.6 Å²	69.6	59%	0.588	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-16	-175.6	-171.8	106.5	0	0	0	113.9	D212	D212-N377 WeakPolarHBondContact OD1-CB 3.2Å; D212-N377 PolarHBondContact OD1-N 2.88Å; D212-N377 PolarHBondContact OD2-N 3.43Å
378	D	76.5	Confident	73.3	Confident	60 Å²	60	76 Å²	76	32%	0.321	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-3.4	173	63.4	-8.4	0	0	0	113.9	A170 R208 F376 F380	A170-D378 WeakPolarHBondContact CB-O 3.48Å; R208-D378 VanDerWaalsContact CD-OD2 3.26Å; R208-D378 WeakPolarHBondContact CD-OD2 3.44Å; R208-D378 IonicContact CZ-OD2 2.73Å; R208-D378 IonicContact NE-OD2 3.06Å; R208-D378 IonicContact NH1-OD2 3.52Å; R208-D378 PolarHBondContact NH1-OD2 3.5Å; F376-D378 WeakPolarHBondContact CB-OD1 3.27Å; F376-D378 PolarHBondContact O-N 2.89Å; F376-D378 VanDerWaalsContact O-N 3.08Å; D378-F380 WeakPolarHBondContact OD1-CB 3.48Å; D378-F380 PolarHBondContact OD1-N 3.34Å
379	G	79.1	Confident	71.2	Confident	32 Å²	32	74 Å²	74	33%	0.33	42%	0.415	S	S	.	.			trans	87.9	1.3	-174	0	0	0	0	0	114.5	F376	F376-G379 PolarHBondContact O-N 3.18Å
380	F	82.1	Confident	69	Low	62 Å²	62	80.5 Å²	80.5	27%	0.272	45%	0.445	S	S	.	.			trans	-63.1	136.1	175.8	-177.7	-120.5	0	0	0	110.9	R208 I375 F376 D378 P382	R208-F380 HydrophobicContact CG-CD1 4.08Å; I375-F380 WeakPolarHBondContact CA-O 3.36Å; F376-F380 HydrophobicContact CB-CB 4.36Å; F376-F380 HydrophobicContact CD2-CB 4.24Å; F376-F380 AromaticContact CD2-CD1 3.66Å; F376-F380 HydrophobicContact CD2-CD1 3.66Å; F376-F380 HydrophobicContact CD2-CG 4.39Å; F376-F380 WeakPolarHBondContact CD2-O 3.42Å; F376-F380 AromaticContact CE2-CD1 4Å; F376-F380 HydrophobicContact CE2-CD1 4Å; F376-F380 HydrophobicContact CE2-CE1 4.48Å; F376-F380 PolarHBondContact N-O 3.49Å; D378-F380 WeakPolarHBondContact OD1-CB 3.48Å; D378-F380 PolarHBondContact OD1-N 3.34Å; F380-P382 HydrophobicContact CE1-CB 3.84Å; F380-P382 HydrophobicContact CE1-CG 4.08Å; F380-P382 HydrophobicContact CZ-CB 3.82Å
381	A	84.3	Confident	67	Low	23 Å²	23	80.3 Å²	80.3	19%	0.19	45%	0.452	C	S	.	.			trans	-141.7	88.1	-179.5	0	0	0	0	0	109.4	I375 Y383 G384 V385	I375-A381 HydrophobicContact CG1-CB 4.4Å; A381-Y383 PolarHBondContact O-N 3.24Å; A381-G384 PolarHBondContact O-N 2.91Å; A381-V385 HydrophobicContact CB-CG2 4.3Å
382	P	76.5	Confident	64.7	Low	17 Å²	17	80.5 Å²	80.5	11%	0.11	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.6	-170.1	24.7	-35.7	0	0	0	114.3	R201 T205 P374 F376 F380	R201-P382 HydrophobicContact CG-CB 4.05Å; T205-P382 HydrophobicContact CG2-CG 3.88Å; T205-P382 WeakPolarHBondContact OG1-CB 3.3Å; P374-P382 HydrophobicContact CG-CG 3.85Å; F376-P382 HydrophobicContact CE2-CG 4.18Å; F380-P382 HydrophobicContact CE1-CB 3.84Å; F380-P382 HydrophobicContact CE1-CG 4.08Å; F380-P382 HydrophobicContact CZ-CB 3.82Å
383	Y	74.9	Confident	62.3	Low	67 Å²	67	85.1 Å²	85.1	26%	0.263	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	16.9	176.2	-45.1	-47.9	0	0	0	112.3	R373 A381	R373-Y383 PolarHBondContact NH1-O 3.48Å; A381-Y383 PolarHBondContact O-N 3.24Å
384	G	67.2	Low	59.8	Low	36 Å²	36	86.6 Å²	86.6	37%	0.371	50%	0.502	S	S	.	.			trans	73.3	161.1	-177.1	0	0	0	0	0	114.6	A381	A381-G384 PolarHBondContact O-N 2.91Å
385	V	62.3	Low	57.1	Low	111 Å²	111	95.4 Å²	95.4	67%	0.673	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-76.4	139.4	174.7	-174.7	0	0	0	0	109.4	I375 A381 D387	I375-V385 HydrophobicContact CD1-CG1 4.49Å; A381-V385 HydrophobicContact CB-CG2 4.3Å; V385-D387 PolarHBondContact O-N 3.41Å
386	A	50.8	Low	54.5	Low	74 Å²	74	99.4 Å²	99.4	61%	0.612	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-73.3	117.4	179	0	0	0	0	0	111.5	R388	A386-R388 PolarHBondContact O-N 2.63Å
387	D	41.8	Very low	51.7	Low	145 Å²	145	107.7 Å²	107.7	78%	0.775	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-62.2	122.7	173.2	-119.5	-31.2	0	0	0	110.4	V385 A389	V385-D387 PolarHBondContact O-N 3.41Å; D387-A389 PolarHBondContact O-N 3.29Å
388	R	37.5	Very low	49.4	Very low	257 Å²	257	114.6 Å²	114.6	97%	0.97	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	26.8	-174.3	-157.8	-178	169.9	172.9	-2.2	113	A386	A386-R388 PolarHBondContact O-N 2.63Å
389	A	31.1	Very low	47.1	Very low	80 Å²	80	115.1 Å²	115.1	66%	0.661	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	0.3	-165.8	0	0	0	0	0	114.9	D387	D387-A389 PolarHBondContact O-N 3.29Å
390	M	32.1	Very low	44.8	Very low	165 Å²	165	123 Å²	123	81%	0.813	67%	0.667	S	S	*	*			trans	-123.1	69.1	179.9	-76.4	-79.8	167.2	0	0	111.5
391	A	30.1	Very low	42.3	Very low	101 Å²	101	126.2 Å²	126.2	84%	0.835	70%	0.698	S	S	*	*			trans	-108.9	47.6	177.7	0	0	0	0	0	112.6
392	T	27.9	Very low	39.6	Very low	104 Å²	104	129.5 Å²	129.5	64%	0.638	73%	0.725	S	S	*	*	S	Bend	trans	-137.5	126.9	173	47.1	0	0	0	0	110.1	N394	T392-N394 PolarHBondContact O-N 2.92Å
393	P	33.1	Very low	37.6	Very low	126 Å²	126	134.7 Å²	134.7	82%	0.818	76%	0.759	S	S	*	*			trans	-79.8	103.9	-175.7	31.1	-33.6	0	0	0	111.5	Q395	P393-Q395 PolarHBondContact O-N 2.64Å
394	N	29	Very low	36.1	Very low	155 Å²	155	137 Å²	137	83%	0.829	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.6	122.2	170.4	-86.9	-11.9	0	0	0	110.6	T392	T392-N394 PolarHBondContact O-N 2.92Å
395	Q	30.2	Very low	34.1	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.874	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-75.2	158.6	176.2	-61.5	-177.7	14.7	0	0	111.6	P393	P393-Q395 PolarHBondContact O-N 2.64Å
396	I	30.8	Very low	32.5	Very low	169 Å²	169	144.6 Å²	144.6	87%	0.867	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78	132.9	-176.7	-62.5	169.9	0	0	0	110.8
397	H	31.4	Very low	31.4	Very low	181 Å²	181	148.6 Å²	148.6	84%	0.838	80%	0.804	S	S	*	*			trans	-0.2	129.2	171.2	-74.5	12.7	0	0	0	120.3
398	R	27.7	Very low	30.6	Very low	254 Å²	254	152 Å²	152	96%	0.958	81%	0.806	S	S	*	*			trans	-155.7	130.4	141.6	-143.1	174.8	-168	169.5	5	114.4
399	G	28.4	Very low	30	Very low	72 Å²	72	148.3 Å²	148.3	74%	0.742	80%	0.8	S	S	*	*			trans	72	119.1	151.9	0	0	0	0	0	118.8
400	H	31.7	Very low	30.7	Very low	196 Å²	196	149.9 Å²	149.9	91%	0.907	80%	0.803	S	S	*	*			trans	-83.9	134.9	160	-77.4	28.9	0	0	0	110.8
401	S	30.4	Very low	31.6	Very low	131 Å²	131	147.5 Å²	147.5	92%	0.916	80%	0.8	S	S	*	*			trans	-161.5	157.6	159.6	-78.5	0	0	0	0	109.1
402	A	27.7	Very low	32.6	Very low	91 Å²	91	148 Å²	148	75%	0.752	80%	0.795	S	S	*	*			trans	-123.4	-178.8	-157.2	0	0	0	0	0	112.2
403	P	32.7	Very low	32.7	Very low	127 Å²	127	154.3 Å²	154.3	83%	0.825	81%	0.807	S	S	*	*				-127.6	-125.6	-50.6	37.3	-17.8	0	0	0	112.7
404	P	43.7	Very low	32.6	Very low	115 Å²	115	155.2 Å²	155.2	75%	0.747	80%	0.8	S	S	*	*			trans	-128.1	168.1	-139.6	40.6	-19.4	0	0	0	118.2
405	E	26.6	Very low	32.8	Very low	170 Å²	170	156.9 Å²	156.9	79%	0.794	80%	0.795	S	S	*	*			trans	-178.1	168.5	163.7	-93.6	-115	139.8	0	0	109.4
406	H	28	Very low	33	Very low	136 Å²	136	154.2 Å²	154.2	63%	0.63	79%	0.786	S	S	*	*			cis	-167.1	147.6	-46.1	-116.4	14.3	0	0	0	111.6
407	F	27.7	Very low	33	Very low	159 Å²	159	154.3 Å²	154.3	70%	0.697	79%	0.786	S	S	*	*			trans	53.8	140.3	156.7	-73.2	-73.3	0	0	0	127.3
408	R	25	Very low	33.2	Very low	216 Å²	216	151 Å²	151	82%	0.815	78%	0.778	S	S	*	*			trans	67.9	125.7	145	-70.6	169.4	176.6	168.9	-0.4	121.6
409	Q	24	Very low	33.2	Very low	179 Å²	179	145.5 Å²	145.5	84%	0.836	77%	0.767	S	S	*	*				64.5	146.1	61.6	-78.8	-167.2	-0.4	0	0	117.1
410	P	46.4	Very low	33.3	Very low	114 Å²	114	148.8 Å²	148.8	74%	0.74	77%	0.773	S	S	*	*			cis	-137.8	-124.5	-40.8	40.9	-17.9	0	0	0	115.2
411	P	51.3	Low	33.3	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	76%	0.764	S	S	*	*			trans	-121	-147.1	-149.9	42.5	-18.4	0	0	0	114
412	P	50.3	Low	33.8	Very low	110 Å²	110	142.7 Å²	142.7	71%	0.714	76%	0.755	S	S	*	*			cis	-138.8	-163.2	-11	44.2	-23.9	0	0	0	116.1
413	R	30.2	Very low	33.9	Very low	237 Å²	237	146.1 Å²	146.1	89%	0.894	76%	0.761	S	S	*	*			trans	132.4	175.7	156	-76.2	172.8	173	166.7	-1.4	115.6
414	E	31.3	Very low	33.8	Very low	145 Å²	145	146.3 Å²	146.3	68%	0.678	76%	0.76	S	S	*	*				-165.4	151.2	-70.4	-137.5	-156.6	151.9	0	0	112.9
415	R	33	Very low	33.4	Very low	190 Å²	190	146 Å²	146	72%	0.717	76%	0.758	S	S	*	*			trans	67.1	124.2	151.3	-76.6	-179.8	-175.5	-129.6	-5.8	127.1
416	N	34.4	Very low	33.4	Very low	131 Å²	131	146.8 Å²	146.8	70%	0.701	76%	0.762	S	S	*	*				93.3	152.4	120.6	-72.3	11.9	0	0	0	126.8
417	M	32.1	Very low	33.3	Very low	172 Å²	172	145 Å²	145	85%	0.847	77%	0.765	S	S	*	*			trans	80	152.2	159.6	-75.7	175.8	67.5	0	0	120.8
418	V	34.2	Very low	33.4	Very low	112 Å²	112	145 Å²	145	68%	0.679	77%	0.769	S	S	*	*			cis	-166	156.9	-35.3	115	0	0	0	0	111.4
419	D	29	Very low	33.5	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	76%	0.76	S	S	*	*			trans	0.8	143	169.2	-51.3	-35.8	0	0	0	124.3
420	T	29.9	Very low	33.6	Very low	141 Å²	141	143.2 Å²	143.2	87%	0.865	76%	0.76	S	S	*	*				168	146.9	110.6	-67.1	0	0	0	0	112.5
421	A	30.4	Very low	32.8	Very low	88 Å²	88	143.7 Å²	143.7	73%	0.727	76%	0.761	S	S	*	*			trans	-134.4	162.8	170.6	0	0	0	0	0	111.3
422	P	42.3	Very low	31.9	Very low	112 Å²	112	144.5 Å²	144.5	73%	0.727	77%	0.767	S	S	*	*				-152.5	155.3	124.2	37	-19.5	0	0	0	118.5
423	N	28.7	Very low	31	Very low	162 Å²	162	148.3 Å²	148.3	87%	0.866	77%	0.772	S	S	*	*			trans	74.3	142.8	145.2	-66.1	-12	0	0	0	123.8
424	T	30.9	Very low	30.9	Very low	131 Å²	131	142.5 Å²	142.5	80%	0.804	77%	0.767	S	S	*	*			trans	-122.1	168.4	175.3	-24.6	0	0	0	0	108.8
425	P	36.7	Very low	30.8	Very low	109 Å²	109	147.2 Å²	147.2	71%	0.708	78%	0.779	S	S	*	*				-155.8	143.8	95.3	37.1	-17.8	0	0	0	118
426	Q	26.6	Very low	30.8	Very low	186 Å²	186	143.3 Å²	143.3	87%	0.869	78%	0.778	S	S	*	*			trans	60.6	148.7	149.1	-57.8	179	11.2	0	0	118.5
427	S	25.9	Very low	30.9	Very low	100 Å²	100	143 Å²	143	70%	0.699	78%	0.783	S	S	*	*			cis	-158.4	148.7	33.3	-169.8	0	0	0	0	115.6
428	M	28.7	Very low	30.9	Very low	158 Å²	158	144.1 Å²	144.1	78%	0.778	79%	0.786	S	S	*	*			trans	62.6	134.1	153	-80.6	-154.9	177.9	0	0	126.3
429	Q	26.7	Very low	30.9	Very low	136 Å²	136	150.2 Å²	150.2	64%	0.636	80%	0.797	S	S	*	*			trans	65.6	112.3	144.1	-75.2	-167.8	65.6	0	0	119.3
430	R	27.1	Very low	31.3	Very low	222 Å²	222	151.4 Å²	151.4	84%	0.838	80%	0.803	S	S	*	*			cis	-167.5	161.6	41.9	-98.5	155.7	-177.9	-121.7	-0.6	111.5
431	T	30	Very low	31.4	Very low	123 Å²	123	152 Å²	152	76%	0.755	80%	0.798	S	S	*	*			trans	-97.8	154.5	178	55.3	0	0	0	0	113.8
432	P	31.1	Very low	31.9	Very low	133 Å²	133	151.3 Å²	151.3	86%	0.864	79%	0.788	S	S	*	*				-116.6	165.1	123.4	-6.1	26	0	0	0	112.8
433	K	31.6	Very low	31.9	Very low	190 Å²	190	151.3 Å²	151.3	83%	0.826	79%	0.786	S	S	*	*			trans	-104.5	142.8	-177.1	-71.3	-178.6	176.6	179.2	0	113.4
434	S	29.3	Very low	32.3	Very low	114 Å²	114	148.8 Å²	148.8	80%	0.797	77%	0.772	S	S	*	*			trans	4.5	128.6	153.8	57.9	0	0	0	0	120
435	R	29	Very low	32.8	Very low	245 Å²	245	146.8 Å²	146.8	93%	0.925	76%	0.757	S	S	*	*			trans	-96.9	134.3	161.9	-171.9	-177.9	-172.4	-178.1	3.3	110
436	P	31.4	Very low	33.2	Very low	108 Å²	108	147.8 Å²	147.8	70%	0.701	76%	0.755	S	S	*	*			trans	-79.3	163.6	176.8	32.8	-35.3	0	0	0	112.7
437	P	36.8	Very low	34	Very low	124 Å²	124	145 Å²	145	81%	0.805	74%	0.742	S	S	*	*			trans	-77.5	174.6	-177	32.7	-37	0	0	0	114.2
438	H	33.2	Very low	34.7	Very low	195 Å²	195	147.4 Å²	147.4	90%	0.903	74%	0.74	S	S	*	*			trans	-60.4	148.9	-172.3	-68.2	-109	0	0	0	114.3
439	R	33.3	Very low	35.7	Very low	241 Å²	241	144.2 Å²	144.2	91%	0.909	73%	0.727	S	S	*	*			trans	-127.4	131.4	166.6	-144.2	177.7	-170.2	-175	1.2	107.9
440	N	37.2	Very low	37	Very low	161 Å²	161	144.7 Å²	144.7	86%	0.861	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-65	141	174.9	-62.6	-16.6	0	0	0	109.5
441	M	32.5	Very low	38	Very low	153 Å²	153	139 Å²	139	75%	0.754	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-102.9	150.1	166.6	-77.9	-163.1	66.8	0	0	110.5
442	S	40.5	Very low	39.3	Very low	74 Å²	74	136 Å²	136	52%	0.517	69%	0.689	S	S	.	*	P	Polyproline II helix	trans	-81.6	162	-173.6	-161.2	0	0	0	0	112.4	D444	S442-D444 WeakPolarHBondContact CB-OD2 3.37Å; S442-D444 PolarHBondContact O-N 2.92Å; S442-D444 PolarHBondContact OG-OD2 3.31Å
443	V	41.9	Very low	40.7	Very low	113 Å²	113	134 Å²	134	69%	0.685	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-20.4	179.4	-78.2	0	0	0	0	113.7	N445 L446	V443-N445 VanDerWaalsContact C-N 3.29Å; V443-N445 PolarHBondContact O-N 2.83Å; V443-L446 PolarHBondContact O-N 3.45Å
444	D	38.4	Very low	41.9	Very low	109 Å²	109	129.5 Å²	129.5	58%	0.583	65%	0.653	S	S	*	*	H	α-helix	trans	-63.2	-29.3	-171.4	-44.7	-84.2	0	0	0	113.8	S442 L446 E447	S442-D444 WeakPolarHBondContact CB-OD2 3.37Å; S442-D444 PolarHBondContact O-N 2.92Å; S442-D444 PolarHBondContact OG-OD2 3.31Å; D444-L446 VanDerWaalsContact C-N 3.32Å; D444-L446 PolarHBondContact O-N 2.95Å; D444-E447 PolarHBondContact O-N 3.01Å
445	N	41.2	Very low	43.2	Very low	89 Å²	89	131.7 Å²	131.7	48%	0.476	64%	0.644	S	S	.	*	H	α-helix	trans	-64.7	-35	178.3	-90	47	0	0	0	112.8	V443 E447 F448 D449	V443-N445 VanDerWaalsContact C-N 3.29Å; V443-N445 PolarHBondContact O-N 2.83Å; N445-E447 VanDerWaalsContact C-N 3.25Å; N445-E447 PolarHBondContact O-N 3.36Å; N445-F448 PolarHBondContact O-N 3.1Å; N445-D449 PolarHBondContact O-N 3.25Å
446	L	45.7	Very low	44.9	Very low	130 Å²	130	125.3 Å²	125.3	68%	0.681	63%	0.625	S	S	*	*	H	α-helix	trans	-65.5	-29.8	-176.9	-73.1	164	0	0	0	112.3	V443 D444 R450	V443-L446 PolarHBondContact O-N 3.45Å; D444-L446 VanDerWaalsContact C-N 3.32Å; D444-L446 PolarHBondContact O-N 2.95Å; L446-R450 VanDerWaalsContact O-CB 3.22Å; L446-R450 WeakPolarHBondContact O-CB 3.44Å; L446-R450 PolarHBondContact O-N 2.79Å
447	E	42.7	Very low	46.6	Very low	127 Å²	127	127.4 Å²	127.4	59%	0.593	62%	0.619	S	S	*	*	H	α-helix	trans	-77.7	-35.3	177.9	-166.7	161.3	-122.7	0	0	111.8	D444 N445 R450 L451	D444-E447 PolarHBondContact O-N 3.01Å; N445-E447 VanDerWaalsContact C-N 3.25Å; N445-E447 PolarHBondContact O-N 3.36Å; E447-R450 PolarHBondContact O-N 3.06Å; E447-L451 HydrophobicContact CG-CD1 4.35Å; E447-L451 WeakPolarHBondContact O-CB 3.42Å; E447-L451 VanDerWaalsContact O-CG 3.3Å; E447-L451 WeakPolarHBondContact O-CG 3.2Å; E447-L451 PolarHBondContact O-N 3.49Å
448	F	39.9	Very low	47.6	Very low	150 Å²	150	126.1 Å²	126.1	66%	0.658	60%	0.604	S	S	*	*	H	α-helix	trans	-69.6	-42.7	176.4	-159.3	-87	0	0	0	112.4	N445 L451 T452	N445-F448 PolarHBondContact O-N 3.1Å; F448-L451 PolarHBondContact O-N 2.8Å; F448-T452 WeakPolarHBondContact O-CB 3.27Å; F448-T452 PolarHBondContact O-N 3.05Å; F448-T452 PolarHBondContact O-OG1 2.66Å
449	D	50.4	Low	49	Very low	92 Å²	92	121.7 Å²	121.7	49%	0.492	58%	0.584	S	S	.	*	H	α-helix	trans	-64.4	-41	174.9	-72.5	-23.7	0	0	0	111	N445 T452 L453	N445-D449 PolarHBondContact O-N 3.25Å; D449-T452 PolarHBondContact O-N 3.1Å; D449-L453 WeakPolarHBondContact O-CB 3.47Å; D449-L453 WeakPolarHBondContact O-CG 3.46Å; D449-L453 PolarHBondContact O-N 3.19Å
450	R	53.3	Low	50.8	Low	146 Å²	146	117.4 Å²	117.4	55%	0.551	57%	0.572	S	S	*	*	H	α-helix	trans	-60.7	-47	174.7	178.1	174.7	169.2	-103	-19.7	112.4	L446 E447 T452 L453 E454	L446-R450 VanDerWaalsContact O-CB 3.22Å; L446-R450 WeakPolarHBondContact O-CB 3.44Å; L446-R450 PolarHBondContact O-N 2.79Å; E447-R450 PolarHBondContact O-N 3.06Å; R450-T452 VanDerWaalsContact C-N 3.29Å; R450-T452 PolarHBondContact O-N 3.18Å; R450-L453 PolarHBondContact O-N 3.03Å; R450-E454 IonicContact NH2-OE2 3.26Å; R450-E454 WeakPolarHBondContact O-CB 3.46Å; R450-E454 PolarHBondContact O-N 3.13Å
451	L	48	Very low	52.1	Low	102 Å²	102	113.9 Å²	113.9	53%	0.534	55%	0.551	S	S	.	*	H	α-helix	trans	-64.4	-34.2	176.8	-75	167.6	0	0	0	112.3	E447 F448 R455	E447-L451 HydrophobicContact CG-CD1 4.35Å; E447-L451 WeakPolarHBondContact O-CB 3.42Å; E447-L451 VanDerWaalsContact O-CG 3.3Å; E447-L451 WeakPolarHBondContact O-CG 3.2Å; E447-L451 PolarHBondContact O-N 3.49Å; F448-L451 PolarHBondContact O-N 2.8Å; L451-R455 VanDerWaalsContact O-CB 3.31Å; L451-R455 WeakPolarHBondContact O-CB 3.38Å; L451-R455 PolarHBondContact O-N 3.22Å
452	T	58.3	Low	53.4	Low	59 Å²	59	113.4 Å²	113.4	36%	0.362	54%	0.544	S	S	.	.	H	α-helix	trans	-69.3	-46.5	176.8	-56.4	0	0	0	0	111.1	F448 D449 R450 E454 R455 E456	F448-T452 WeakPolarHBondContact O-CB 3.27Å; F448-T452 PolarHBondContact O-N 3.05Å; F448-T452 PolarHBondContact O-OG1 2.66Å; D449-T452 PolarHBondContact O-N 3.1Å; R450-T452 VanDerWaalsContact C-N 3.29Å; R450-T452 PolarHBondContact O-N 3.18Å; T452-E454 PolarHBondContact O-N 3.39Å; T452-R455 WeakPolarHBondContact O-CB 3.38Å; T452-R455 PolarHBondContact O-N 2.88Å; T452-E456 PolarHBondContact O-N 3.4Å
453	L	59.9	Low	54.9	Low	93 Å²	93	112.5 Å²	112.5	49%	0.487	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-39.1	175	-72.9	166.2	0	0	0	112.7	I256 D449 R450 R455 E456 R457	I256-L453 HydrophobicContact CD1-CD2 3.93Å; D449-L453 WeakPolarHBondContact O-CB 3.47Å; D449-L453 WeakPolarHBondContact O-CG 3.46Å; D449-L453 PolarHBondContact O-N 3.19Å; R450-L453 PolarHBondContact O-N 3.03Å; L453-R455 VanDerWaalsContact C-N 3.33Å; L453-E456 PolarHBondContact O-N 3.41Å; L453-R457 VanDerWaalsContact O-CB 3.29Å; L453-R457 WeakPolarHBondContact O-CB 3.26Å; L453-R457 PolarHBondContact O-N 2.76Å
454	E	57.3	Low	56.5	Low	94 Å²	94	114 Å²	114	44%	0.439	54%	0.538	S	S	.	.	H	α-helix	trans	-66.8	-36	176	-173	157.8	-159.4	0	0	111.5	R450 T452 L458	R450-E454 IonicContact NH2-OE2 3.26Å; R450-E454 WeakPolarHBondContact O-CB 3.46Å; R450-E454 PolarHBondContact O-N 3.13Å; T452-E454 PolarHBondContact O-N 3.39Å; E454-L458 WeakPolarHBondContact O-CG 3.39Å; E454-L458 PolarHBondContact O-N 3.36Å; E454-L458 VanDerWaalsContact O-N 3.09Å
455	R	55.3	Low	58	Low	161 Å²	161	113.3 Å²	113.3	61%	0.608	53%	0.534	S	S	*	.	H	α-helix	trans	-66.2	-48.1	171.6	179.3	179	171.4	-168.8	-10.7	112.6	L451 T452 L453 R457 L458 E459	L451-R455 VanDerWaalsContact O-CB 3.31Å; L451-R455 WeakPolarHBondContact O-CB 3.38Å; L451-R455 PolarHBondContact O-N 3.22Å; T452-R455 WeakPolarHBondContact O-CB 3.38Å; T452-R455 PolarHBondContact O-N 2.88Å; L453-R455 VanDerWaalsContact C-N 3.33Å; R455-R457 VanDerWaalsContact C-N 3.3Å; R455-R457 PolarHBondContact O-N 3.03Å; R455-L458 PolarHBondContact O-N 2.83Å; R455-L458 VanDerWaalsContact O-N 3.15Å; R455-E459 IonicContact CZ-OE1 3.7Å; R455-E459 VanDerWaalsContact CZ-OE1 3.26Å; R455-E459 IonicContact NE-OE1 3.74Å; R455-E459 PolarHBondContact NE-OE1 2.87Å; R455-E459 IonicContact NH2-OE1 2.69Å; R455-E459 PolarHBondContact NH2-OE1 3.41Å; R455-E459 PolarHBondContact O-N 3.36Å
456	E	66.4	Low	59.6	Low	111 Å²	111	114.6 Å²	114.6	52%	0.519	54%	0.538	S	S	.	.	H	α-helix	trans	-60.9	-40.3	177	-73.4	-169.7	155.3	0	0	111.7	T452 L453 L458 E459 F460	T452-E456 PolarHBondContact O-N 3.4Å; L453-E456 PolarHBondContact O-N 3.41Å; E456-L458 VanDerWaalsContact C-N 3.33Å; E456-L458 PolarHBondContact O-N 3.43Å; E456-E459 PolarHBondContact O-N 2.8Å; E456-F460 WeakPolarHBondContact O-CB 3.33Å; E456-F460 PolarHBondContact O-N 3.37Å
457	R	66.3	Low	61	Low	152 Å²	152	114.9 Å²	114.9	57%	0.574	54%	0.536	S	S	*	.	H	α-helix	trans	-57.2	-45.1	173.2	-175.1	-170.9	172.4	-65.5	-10.2	111.4	L453 R455 E461	L453-R457 VanDerWaalsContact O-CB 3.29Å; L453-R457 WeakPolarHBondContact O-CB 3.26Å; L453-R457 PolarHBondContact O-N 2.76Å; R455-R457 VanDerWaalsContact C-N 3.3Å; R455-R457 PolarHBondContact O-N 3.03Å; R457-E461 IonicContact CZ-OE2 2.87Å; R457-E461 IonicContact NH1-OE2 2.75Å; R457-E461 PolarHBondContact NH1-OE2 3.14Å; R457-E461 IonicContact NH2-OE2 2.66Å; R457-E461 VanDerWaalsContact O-CB 3.29Å; R457-E461 WeakPolarHBondContact O-CB 3.38Å; R457-E461 PolarHBondContact O-N 3.06Å
458	L	58.3	Low	62.1	Low	97 Å²	97	117.8 Å²	117.8	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-68.9	-38.4	177.2	-74.8	166.6	0	0	0	112.8	E454 R455 E456 K462	E454-L458 WeakPolarHBondContact O-CG 3.39Å; E454-L458 PolarHBondContact O-N 3.36Å; E454-L458 VanDerWaalsContact O-N 3.09Å; R455-L458 PolarHBondContact O-N 2.83Å; R455-L458 VanDerWaalsContact O-N 3.15Å; E456-L458 VanDerWaalsContact C-N 3.33Å; E456-L458 PolarHBondContact O-N 3.43Å; L458-K462 WeakPolarHBondContact O-CB 3.4Å; L458-K462 PolarHBondContact O-N 2.89Å
459	E	61.8	Low	63.5	Low	101 Å²	101	114.6 Å²	114.6	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-67.9	-38.3	176.4	-71.5	-174	-162.9	0	0	111.5	R455 E456 A463	R455-E459 IonicContact CZ-OE1 3.7Å; R455-E459 VanDerWaalsContact CZ-OE1 3.26Å; R455-E459 IonicContact NE-OE1 3.74Å; R455-E459 PolarHBondContact NE-OE1 2.87Å; R455-E459 IonicContact NH2-OE1 2.69Å; R455-E459 PolarHBondContact NH2-OE1 3.41Å; R455-E459 PolarHBondContact O-N 3.36Å; E456-E459 PolarHBondContact O-N 2.8Å; E459-A463 WeakPolarHBondContact O-CB 3.12Å; E459-A463 PolarHBondContact O-N 3.47Å
460	F	71.4	Confident	64.8	Low	151 Å²	151	113 Å²	113	66%	0.662	53%	0.525	S	S	*	.	H	α-helix	trans	-66.4	-45.9	172.5	-177.5	-95.7	0	0	0	112.9	E456 K462 A463 K464	E456-F460 WeakPolarHBondContact O-CB 3.33Å; E456-F460 PolarHBondContact O-N 3.37Å; F460-K462 VanDerWaalsContact C-N 3.31Å; F460-K462 PolarHBondContact O-N 2.81Å; F460-A463 PolarHBondContact O-N 3.42Å; F460-K464 PolarHBondContact O-N 2.99Å
461	E	65	Low	65.9	Low	88 Å²	88	113.5 Å²	113.5	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-39.8	177	-172.1	161.9	-162.3	0	0	111.1	R457 K464 I465	R457-E461 IonicContact CZ-OE2 2.87Å; R457-E461 IonicContact NH1-OE2 2.75Å; R457-E461 PolarHBondContact NH1-OE2 3.14Å; R457-E461 IonicContact NH2-OE2 2.66Å; R457-E461 VanDerWaalsContact O-CB 3.29Å; R457-E461 WeakPolarHBondContact O-CB 3.38Å; R457-E461 PolarHBondContact O-N 3.06Å; E461-K464 PolarHBondContact O-N 3.49Å; E461-I465 WeakPolarHBondContact O-CG1 3.35Å; E461-I465 PolarHBondContact O-N 3.3Å
462	K	58.4	Low	67	Low	143 Å²	143	113 Å²	113	62%	0.622	52%	0.524	S	S	*	.	H	α-helix	trans	-67.6	-36.8	174.1	-172.2	177	-177.3	-176.6	0	113.2	L458 F460 I465 M466	L458-K462 WeakPolarHBondContact O-CB 3.4Å; L458-K462 PolarHBondContact O-N 2.89Å; F460-K462 VanDerWaalsContact C-N 3.31Å; F460-K462 PolarHBondContact O-N 2.81Å; K462-I465 PolarHBondContact O-N 3.46Å; K462-M466 WeakPolarHBondContact O-CB 3.47Å; K462-M466 PolarHBondContact O-N 3.24Å
463	A	73.8	Confident	67.8	Low	54 Å²	54	116.3 Å²	116.3	45%	0.446	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-43.4	172.9	0	0	0	0	0	111.5	E459 F460 I465 M466 E467	E459-A463 WeakPolarHBondContact O-CB 3.12Å; E459-A463 PolarHBondContact O-N 3.47Å; F460-A463 PolarHBondContact O-N 3.42Å; A463-I465 VanDerWaalsContact C-N 3.33Å; A463-I465 PolarHBondContact O-N 2.83Å; A463-M466 PolarHBondContact O-N 3.44Å; A463-M466 VanDerWaalsContact O-N 3.16Å; A463-E467 PolarHBondContact O-N 2.91Å
464	K	74.8	Confident	68.6	Low	145 Å²	145	117.6 Å²	117.6	63%	0.63	53%	0.533	S	S	*	.	H	α-helix	trans	-63.5	-35.7	176.1	-168.4	174.5	-175.8	176.6	0	112.7	F460 E461 R468	F460-K464 PolarHBondContact O-N 2.99Å; E461-K464 PolarHBondContact O-N 3.49Å; K464-R468 WeakPolarHBondContact O-CB 3.49Å; K464-R468 PolarHBondContact O-N 3.05Å; K464-R468 VanDerWaalsContact O-N 3.14Å
465	I	69.8	Low	69.3	Low	94 Å²	94	116.9 Å²	116.9	48%	0.482	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-46.3	171.1	-69.6	162.6	0	0	0	110.7	E461 K462 A463 E467 R468 E469	E461-I465 WeakPolarHBondContact O-CG1 3.35Å; E461-I465 PolarHBondContact O-N 3.3Å; K462-I465 PolarHBondContact O-N 3.46Å; A463-I465 VanDerWaalsContact C-N 3.33Å; A463-I465 PolarHBondContact O-N 2.83Å; I465-E467 VanDerWaalsContact C-N 3.34Å; I465-E467 PolarHBondContact O-N 3.4Å; I465-R468 WeakPolarHBondContact O-CB 3.23Å; I465-R468 PolarHBondContact O-N 3.19Å; I465-R468 VanDerWaalsContact O-N 3.15Å; I465-E469 PolarHBondContact O-N 3.3Å
466	M	74.9	Confident	70.3	Confident	116 Å²	116	115.3 Å²	115.3	57%	0.571	53%	0.529	S	S	*	.	H	α-helix	trans	-62.5	-37.9	179.5	-170.5	-176.6	-62.8	0	0	112.7	K462 A463 S470	K462-M466 WeakPolarHBondContact O-CB 3.47Å; K462-M466 PolarHBondContact O-N 3.24Å; A463-M466 PolarHBondContact O-N 3.44Å; A463-M466 VanDerWaalsContact O-N 3.16Å; M466-S470 WeakPolarHBondContact O-CB 3.36Å; M466-S470 PolarHBondContact O-N 3.04Å
467	E	74.6	Confident	71.1	Confident	137 Å²	137	116.2 Å²	116.2	64%	0.64	53%	0.532	S	S	*	.	H	α-helix	trans	-65.3	-43.2	172.8	-175.4	175.9	-155.9	0	0	111.6	A463 I465 S470 R471	A463-E467 PolarHBondContact O-N 2.91Å; I465-E467 VanDerWaalsContact C-N 3.34Å; I465-E467 PolarHBondContact O-N 3.4Å; E467-S470 WeakPolarHBondContact O-CB 3.24Å; E467-S470 PolarHBondContact O-N 2.88Å; E467-S470 VanDerWaalsContact O-N 3.14Å; E467-R471 PolarHBondContact O-N 3.22Å
468	R	66.3	Low	71.6	Confident	187 Å²	187	115.3 Å²	115.3	71%	0.706	53%	0.534	S	S	*	.	H	α-helix	trans	-61.7	-44	175	-172.4	177.1	-177	171.7	1.6	112	K464 I465 S470 R471 L472	K464-R468 WeakPolarHBondContact O-CB 3.49Å; K464-R468 PolarHBondContact O-N 3.05Å; K464-R468 VanDerWaalsContact O-N 3.14Å; I465-R468 WeakPolarHBondContact O-CB 3.23Å; I465-R468 PolarHBondContact O-N 3.19Å; I465-R468 VanDerWaalsContact O-N 3.15Å; R468-S470 VanDerWaalsContact C-N 3.32Å; R468-S470 PolarHBondContact O-N 3.47Å; R468-R471 PolarHBondContact O-N 3.3Å; R468-L472 HydrophobicContact CG-CD1 4.28Å; R468-L472 WeakPolarHBondContact O-CG 3.42Å; R468-L472 PolarHBondContact O-N 3.22Å
469	E	69.9	Low	72.6	Confident	83 Å²	83	115.5 Å²	115.5	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-63.1	-36.7	172.3	-70.3	-175.5	-167.8	0	0	112.5	I465 R471 L472 R473	I465-E469 PolarHBondContact O-N 3.3Å; E469-R471 VanDerWaalsContact C-N 3.34Å; E469-L472 PolarHBondContact O-N 3.43Å; E469-R473 VanDerWaalsContact CB-NH2 3.26Å; E469-R473 WeakPolarHBondContact O-CB 3.47Å; E469-R473 WeakPolarHBondContact O-CG 3.49Å; E469-R473 PolarHBondContact O-N 3.42Å; E469-R473 IonicContact OE2-CZ 3.76Å; E469-R473 VanDerWaalsContact OE2-CZ 3.23Å; E469-R473 IonicContact OE2-NH1 2.66Å; E469-R473 PolarHBondContact OE2-NH1 3.39Å; E469-R473 IonicContact OE2-NH2 3.48Å; E469-R473 PolarHBondContact OE2-NH2 3.05Å
470	S	77.5	Confident	73.3	Confident	58 Å²	58	115 Å²	115	41%	0.406	53%	0.532	S	S	.	.	H	α-helix	trans	-67.2	-35.5	178.9	-166	0	0	0	0	112.2	M466 E467 R468 H474	M466-S470 WeakPolarHBondContact O-CB 3.36Å; M466-S470 PolarHBondContact O-N 3.04Å; E467-S470 WeakPolarHBondContact O-CB 3.24Å; E467-S470 PolarHBondContact O-N 2.88Å; E467-S470 VanDerWaalsContact O-N 3.14Å; R468-S470 VanDerWaalsContact C-N 3.32Å; R468-S470 PolarHBondContact O-N 3.47Å; S470-H474 PolarHBondContact O-N 2.9Å; S470-H474 PolarHBondContact O-ND1 2.81Å
471	R	75.9	Confident	73.7	Confident	158 Å²	158	111.7 Å²	111.7	60%	0.596	52%	0.521	S	S	*	.	H	α-helix	trans	-66.1	-49.4	168	-84.4	-167.9	58.7	-179.9	-5.6	112.1	E467 R468 E469 R473 H474 E475	E467-R471 PolarHBondContact O-N 3.22Å; R468-R471 PolarHBondContact O-N 3.3Å; E469-R471 VanDerWaalsContact C-N 3.34Å; R471-R473 VanDerWaalsContact C-N 3.32Å; R471-R473 PolarHBondContact O-N 3.32Å; R471-H474 WeakPolarHBondContact O-CA 3.22Å; R471-H474 WeakPolarHBondContact O-CB 3.26Å; R471-H474 PolarHBondContact O-N 3.37Å; R471-E475 IonicContact CZ-OE1 3.3Å; R471-E475 IonicContact NE-OE1 3.94Å; R471-E475 IonicContact NH2-OE1 2.93Å; R471-E475 PolarHBondContact NH2-OE1 3.43Å; R471-E475 PolarHBondContact O-N 2.9Å
472	L	70.5	Confident	74.2	Confident	92 Å²	92	113.6 Å²	113.6	48%	0.482	53%	0.53	S	S	.	.	H	α-helix	trans	-59.5	-41.8	179.3	-72.5	168.6	0	0	0	111.6	R468 E469 H474 E475 E476	R468-L472 HydrophobicContact CG-CD1 4.28Å; R468-L472 WeakPolarHBondContact O-CG 3.42Å; R468-L472 PolarHBondContact O-N 3.22Å; E469-L472 PolarHBondContact O-N 3.43Å; L472-H474 VanDerWaalsContact C-N 3.25Å; L472-H474 PolarHBondContact O-N 3.02Å; L472-E475 PolarHBondContact O-N 3.24Å; L472-E476 WeakPolarHBondContact O-CB 3.28Å; L472-E476 PolarHBondContact O-N 3.29Å
473	R	75.5	Confident	75.2	Confident	127 Å²	127	112.2 Å²	112.2	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-66.3	-21.2	173.5	-75.1	-174	-76.9	-101	0.5	114.1	E469 R471 K477	E469-R473 VanDerWaalsContact CB-NH2 3.26Å; E469-R473 WeakPolarHBondContact O-CB 3.47Å; E469-R473 WeakPolarHBondContact O-CG 3.49Å; E469-R473 PolarHBondContact O-N 3.42Å; E469-R473 IonicContact OE2-CZ 3.76Å; E469-R473 VanDerWaalsContact OE2-CZ 3.23Å; E469-R473 IonicContact OE2-NH1 2.66Å; E469-R473 PolarHBondContact OE2-NH1 3.39Å; E469-R473 IonicContact OE2-NH2 3.48Å; E469-R473 PolarHBondContact OE2-NH2 3.05Å; R471-R473 VanDerWaalsContact C-N 3.32Å; R471-R473 PolarHBondContact O-N 3.32Å; R473-K477 VanDerWaalsContact O-CB 3.32Å; R473-K477 WeakPolarHBondContact O-CB 3.46Å; R473-K477 PolarHBondContact O-N 3.46Å
474	H	77.7	Confident	75.6	Confident	120 Å²	120	118.4 Å²	118.4	56%	0.556	54%	0.536	S	S	*	.	H	α-helix	trans	-82.5	-41.9	170.6	-87.1	82.1	0	0	0	112.2	S470 R471 L472 K477 Q478	S470-H474 PolarHBondContact O-N 2.9Å; S470-H474 PolarHBondContact O-ND1 2.81Å; R471-H474 WeakPolarHBondContact O-CA 3.22Å; R471-H474 WeakPolarHBondContact O-CB 3.26Å; R471-H474 PolarHBondContact O-N 3.37Å; L472-H474 VanDerWaalsContact C-N 3.25Å; L472-H474 PolarHBondContact O-N 3.02Å; H474-K477 PolarHBondContact O-N 3.18Å; H474-Q478 WeakPolarHBondContact O-CG 3.23Å; H474-Q478 PolarHBondContact O-N 3.17Å
475	E	71.8	Confident	75.9	Confident	79 Å²	79	120.7 Å²	120.7	37%	0.369	54%	0.541	S	S	.	.	H	α-helix	trans	-64.3	-47.2	175	-75.9	162.8	-179.6	0	0	110.4	R471 L472 K477 Q478 I479	R471-E475 IonicContact CZ-OE1 3.3Å; R471-E475 IonicContact NE-OE1 3.94Å; R471-E475 IonicContact NH2-OE1 2.93Å; R471-E475 PolarHBondContact NH2-OE1 3.43Å; R471-E475 PolarHBondContact O-N 2.9Å; L472-E475 PolarHBondContact O-N 3.24Å; E475-K477 VanDerWaalsContact C-N 3.34Å; E475-K477 PolarHBondContact O-N 3.09Å; E475-Q478 PolarHBondContact O-N 3.09Å; E475-Q478 VanDerWaalsContact O-N 3.15Å; E475-I479 VanDerWaalsContact O-CG1 3.27Å; E475-I479 WeakPolarHBondContact O-CG1 3.39Å; E475-I479 PolarHBondContact O-N 3.04Å
476	E	75.6	Confident	76.3	Confident	128 Å²	128	122 Å²	122	60%	0.598	55%	0.546	S	S	*	.	H	α-helix	trans	-54.9	-45.1	172.6	179.2	178.9	-141.9	0	0	112.2	L472 I479 E480	L472-E476 WeakPolarHBondContact O-CB 3.28Å; L472-E476 PolarHBondContact O-N 3.29Å; E476-I479 PolarHBondContact O-N 3.11Å; E476-E480 PolarHBondContact O-N 3.19Å
477	K	82.7	Confident	76.4	Confident	131 Å²	131	122 Å²	122	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-65.8	-41.8	176.2	-176	178.3	176.4	-172.2	0	112.3	R473 H474 E475 I479 E480 D481	R473-K477 VanDerWaalsContact O-CB 3.32Å; R473-K477 WeakPolarHBondContact O-CB 3.46Å; R473-K477 PolarHBondContact O-N 3.46Å; H474-K477 PolarHBondContact O-N 3.18Å; E475-K477 VanDerWaalsContact C-N 3.34Å; E475-K477 PolarHBondContact O-N 3.09Å; K477-I479 VanDerWaalsContact C-N 3.32Å; K477-I479 PolarHBondContact O-N 3.02Å; K477-E480 PolarHBondContact O-N 2.92Å; K477-D481 WeakPolarHBondContact CE-OD2 3.42Å; K477-D481 WeakPolarHBondContact O-CB 3.37Å; K477-D481 PolarHBondContact O-N 2.86Å
478	Q	77.4	Confident	76.6	Confident	132 Å²	132	118.5 Å²	118.5	62%	0.617	54%	0.539	S	S	*	.	H	α-helix	trans	-62.1	-41.8	176.2	-75.5	179	8.8	0	0	111.3	H474 E475 D481 E482	H474-Q478 WeakPolarHBondContact O-CG 3.23Å; H474-Q478 PolarHBondContact O-N 3.17Å; E475-Q478 PolarHBondContact O-N 3.09Å; E475-Q478 VanDerWaalsContact O-N 3.15Å; Q478-D481 PolarHBondContact O-N 3.16Å; Q478-E482 VanDerWaalsContact O-CB 3.25Å; Q478-E482 WeakPolarHBondContact O-CB 3.33Å; Q478-E482 PolarHBondContact O-N 3.46Å
479	I	79.1	Confident	77	Confident	102 Å²	102	115 Å²	115	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-42.3	175.8	-67.8	162.8	0	0	0	111	E475 E476 K477 E482 K483	E475-I479 VanDerWaalsContact O-CG1 3.27Å; E475-I479 WeakPolarHBondContact O-CG1 3.39Å; E475-I479 PolarHBondContact O-N 3.04Å; E476-I479 PolarHBondContact O-N 3.11Å; K477-I479 VanDerWaalsContact C-N 3.32Å; K477-I479 PolarHBondContact O-N 3.02Å; I479-E482 PolarHBondContact O-N 2.89Å; I479-K483 WeakPolarHBondContact O-CB 3.44Å; I479-K483 PolarHBondContact O-N 3.21Å
480	E	77.1	Confident	77.2	Confident	91 Å²	91	117.9 Å²	117.9	43%	0.425	54%	0.542	S	S	.	.	H	α-helix	trans	-71.9	-36.1	178.5	-163.9	63.3	-146.1	0	0	112.4	E476 K477 K483 R484	E476-E480 PolarHBondContact O-N 3.19Å; K477-E480 PolarHBondContact O-N 2.92Å; E480-K483 IonicContact OE1-NZ 3.45Å; E480-K483 PolarHBondContact OE1-NZ 2.9Å; E480-K483 IonicContact OE2-NZ 2.73Å; E480-K483 PolarHBondContact OE2-NZ 3.19Å; E480-R484 WeakPolarHBondContact O-CB 3.12Å; E480-R484 PolarHBondContact O-N 2.77Å
481	D	78.4	Confident	76.9	Confident	81 Å²	81	118.4 Å²	118.4	43%	0.433	54%	0.54	S	S	.	.	H	α-helix	trans	-66.2	-37.3	172.5	-80.3	-33.2	0	0	0	111.6	K477 Q478 R484 R485	K477-D481 WeakPolarHBondContact CE-OD2 3.42Å; K477-D481 WeakPolarHBondContact O-CB 3.37Å; K477-D481 PolarHBondContact O-N 2.86Å; Q478-D481 PolarHBondContact O-N 3.16Å; D481-R484 WeakPolarHBondContact O-CB 3.17Å; D481-R485 PolarHBondContact O-N 2.91Å
482	E	75.6	Confident	76.7	Confident	127 Å²	127	116.5 Å²	116.5	59%	0.593	54%	0.541	S	S	*	.	H	α-helix	trans	-70.1	-46.6	174.6	-179.3	169.8	-130.2	0	0	112.1	Q478 I479 R484 R485 M486	Q478-E482 VanDerWaalsContact O-CB 3.25Å; Q478-E482 WeakPolarHBondContact O-CB 3.33Å; Q478-E482 PolarHBondContact O-N 3.46Å; I479-E482 PolarHBondContact O-N 2.89Å; E482-R484 PolarHBondContact O-N 3.16Å; E482-R485 WeakPolarHBondContact O-CA 3.44Å; E482-R485 WeakPolarHBondContact O-CB 3.5Å; E482-R485 PolarHBondContact O-N 2.83Å; E482-M486 PolarHBondContact O-N 3.37Å
483	K	80.3	Confident	76.3	Confident	114 Å²	114	116.5 Å²	116.5	50%	0.496	54%	0.541	S	S	.	.	H	α-helix	trans	-58	-35.2	172.4	177.6	177.4	162.8	-127.7	0	112.1	I479 E480 H487	I479-K483 WeakPolarHBondContact O-CB 3.44Å; I479-K483 PolarHBondContact O-N 3.21Å; E480-K483 IonicContact OE1-NZ 3.45Å; E480-K483 PolarHBondContact OE1-NZ 2.9Å; E480-K483 IonicContact OE2-NZ 2.73Å; E480-K483 PolarHBondContact OE2-NZ 3.19Å; K483-H487 WeakPolarHBondContact O-CB 3.34Å; K483-H487 PolarHBondContact O-N 2.93Å
484	R	82.8	Confident	75.7	Confident	184 Å²	184	114.2 Å²	114.2	69%	0.694	54%	0.541	S	S	*	.	H	α-helix	trans	-63.5	-39.1	170.1	-106.2	-176.7	169.2	-148.7	-5.2	113.2	E480 D481 E482 A488	E480-R484 WeakPolarHBondContact O-CB 3.12Å; E480-R484 PolarHBondContact O-N 2.77Å; D481-R484 WeakPolarHBondContact O-CB 3.17Å; E482-R484 PolarHBondContact O-N 3.16Å; R484-A488 WeakPolarHBondContact O-CB 3.32Å; R484-A488 PolarHBondContact O-N 2.84Å
485	R	80.3	Confident	74.9	Confident	193 Å²	193	115.6 Å²	115.6	73%	0.728	55%	0.546	S	S	*	.	H	α-helix	trans	-65.3	-50.4	174.1	-67.2	174.2	175.2	-149	-2.1	110.9	D481 E482 H487 A488 E489	D481-R485 PolarHBondContact O-N 2.91Å; E482-R485 WeakPolarHBondContact O-CA 3.44Å; E482-R485 WeakPolarHBondContact O-CB 3.5Å; E482-R485 PolarHBondContact O-N 2.83Å; R485-H487 VanDerWaalsContact C-N 3.26Å; R485-H487 PolarHBondContact O-N 3.13Å; R485-A488 PolarHBondContact O-N 2.94Å; R485-A488 VanDerWaalsContact O-N 3.08Å; R485-E489 WeakPolarHBondContact O-CB 3.44Å; R485-E489 PolarHBondContact O-N 2.78Å
486	M	78.1	Confident	74.2	Confident	122 Å²	122	119.1 Å²	119.1	60%	0.601	56%	0.562	S	S	*	*	H	α-helix	trans	-56	-39	177.3	-68.9	-63.8	-65.7	0	0	112.5	E482 K490	E482-M486 PolarHBondContact O-N 3.37Å; M486-K490 WeakPolarHBondContact O-CB 3.46Å; M486-K490 PolarHBondContact O-N 2.91Å
487	H	78.1	Confident	73.1	Confident	115 Å²	115	118.3 Å²	118.3	53%	0.532	57%	0.566	S	S	.	*	H	α-helix	trans	-69.8	-43.1	175.6	-167.5	-11.7	0	0	0	112.2	K483 R485 E489 K490 D491	K483-H487 WeakPolarHBondContact O-CB 3.34Å; K483-H487 PolarHBondContact O-N 2.93Å; R485-H487 VanDerWaalsContact C-N 3.26Å; R485-H487 PolarHBondContact O-N 3.13Å; H487-E489 VanDerWaalsContact C-N 3.32Å; H487-E489 PolarHBondContact O-N 3.35Å; H487-K490 PolarHBondContact O-N 3.29Å; H487-D491 IonicContact CE1-OD1 3.15Å; H487-D491 PolarHBondContact CE1-OD1 3.4Å; H487-D491 IonicContact CE1-OD2 2.7Å; H487-D491 IonicContact ND1-OD1 3.61Å; H487-D491 PolarHBondContact ND1-OD1 2.77Å; H487-D491 IonicContact ND1-OD2 3.13Å; H487-D491 WeakPolarHBondContact O-CB 3.47Å; H487-D491 PolarHBondContact O-N 2.86Å
488	A	78.4	Confident	71.4	Confident	65 Å²	65	117.3 Å²	117.3	54%	0.537	57%	0.571	S	S	.	*	H	α-helix	trans	-64.9	-35.2	177.6	0	0	0	0	0	112.7	R484 R485 L492	R484-A488 WeakPolarHBondContact O-CB 3.32Å; R484-A488 PolarHBondContact O-N 2.84Å; R485-A488 PolarHBondContact O-N 2.94Å; R485-A488 VanDerWaalsContact O-N 3.08Å; A488-L492 PolarHBondContact O-N 2.71Å; A488-L492 VanDerWaalsContact O-N 3.14Å
489	E	75.6	Confident	69.7	Low	113 Å²	113	118.8 Å²	118.8	53%	0.528	58%	0.578	S	S	.	*	H	α-helix	trans	-67.3	-45.4	173.3	-175.3	172	176.5	0	0	111.4	R485 H487 D491 L492 I493	R485-E489 WeakPolarHBondContact O-CB 3.44Å; R485-E489 PolarHBondContact O-N 2.78Å; H487-E489 VanDerWaalsContact C-N 3.32Å; H487-E489 PolarHBondContact O-N 3.35Å; E489-D491 VanDerWaalsContact C-N 3.3Å; E489-D491 PolarHBondContact O-N 2.73Å; E489-L492 VanDerWaalsContact O-CB 3.29Å; E489-L492 WeakPolarHBondContact O-CB 3.41Å; E489-L492 PolarHBondContact O-N 3.06Å; E489-I493 HydrophobicContact CG-CD1 4.27Å; E489-I493 WeakPolarHBondContact O-CG1 3.43Å; E489-I493 PolarHBondContact O-N 3.02Å
490	K	73.1	Confident	68	Low	144 Å²	144	120 Å²	120	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-61	-37.5	174.4	-173	172.8	-178.8	176.3	0	112.7	M486 H487 L492 I493 T494	M486-K490 WeakPolarHBondContact O-CB 3.46Å; M486-K490 PolarHBondContact O-N 2.91Å; H487-K490 PolarHBondContact O-N 3.29Å; K490-L492 VanDerWaalsContact C-N 3.29Å; K490-L492 PolarHBondContact O-N 2.88Å; K490-I493 PolarHBondContact O-N 3.22Å; K490-T494 WeakPolarHBondContact O-CB 3.35Å; K490-T494 PolarHBondContact O-N 3.43Å; K490-T494 PolarHBondContact O-OG1 3.18Å
491	D	71.3	Confident	66.3	Low	68 Å²	68	122.2 Å²	122.2	36%	0.364	61%	0.612	S	S	.	*	H	α-helix	trans	-67.9	-29	174.7	-78.1	15.4	0	0	0	112.4	H487 E489 K495	H487-D491 IonicContact CE1-OD1 3.15Å; H487-D491 PolarHBondContact CE1-OD1 3.4Å; H487-D491 IonicContact CE1-OD2 2.7Å; H487-D491 IonicContact ND1-OD1 3.61Å; H487-D491 PolarHBondContact ND1-OD1 2.77Å; H487-D491 IonicContact ND1-OD2 3.13Å; H487-D491 WeakPolarHBondContact O-CB 3.47Å; H487-D491 PolarHBondContact O-N 2.86Å; E489-D491 VanDerWaalsContact C-N 3.3Å; E489-D491 PolarHBondContact O-N 2.73Å; D491-K495 WeakPolarHBondContact O-CD 3.32Å; D491-K495 WeakPolarHBondContact O-CG 3.3Å; D491-K495 PolarHBondContact O-N 3.42Å
492	L	70.6	Confident	64.4	Low	118 Å²	118	123.8 Å²	123.8	62%	0.618	63%	0.627	S	S	*	*	H	α-helix	trans	-71.1	-50.3	174.5	-157.7	72.6	0	0	0	110.5	A488 E489 K490 T494 K495 E496	A488-L492 PolarHBondContact O-N 2.71Å; A488-L492 VanDerWaalsContact O-N 3.14Å; E489-L492 VanDerWaalsContact O-CB 3.29Å; E489-L492 WeakPolarHBondContact O-CB 3.41Å; E489-L492 PolarHBondContact O-N 3.06Å; K490-L492 VanDerWaalsContact C-N 3.29Å; K490-L492 PolarHBondContact O-N 2.88Å; L492-T494 VanDerWaalsContact C-N 3.28Å; L492-T494 PolarHBondContact O-N 2.88Å; L492-K495 PolarHBondContact O-N 2.84Å; L492-K495 VanDerWaalsContact O-N 3.1Å; L492-E496 PolarHBondContact O-N 3.03Å
493	I	63.7	Low	62.9	Low	93 Å²	93	123.4 Å²	123.4	48%	0.477	64%	0.635	S	S	.	*	H	α-helix	trans	-59	-39.5	177.1	-64.7	164	0	0	0	111.3	E489 K490 K495 E496 T497	E489-I493 HydrophobicContact CG-CD1 4.27Å; E489-I493 WeakPolarHBondContact O-CG1 3.43Å; E489-I493 PolarHBondContact O-N 3.02Å; K490-I493 PolarHBondContact O-N 3.22Å; I493-K495 VanDerWaalsContact C-N 3.33Å; I493-K495 PolarHBondContact O-N 2.88Å; I493-E496 PolarHBondContact O-N 2.99Å; I493-T497 WeakPolarHBondContact O-CB 3.26Å; I493-T497 PolarHBondContact O-N 3.48Å; I493-T497 PolarHBondContact O-OG1 3.04Å
494	T	63.3	Low	61.4	Low	79 Å²	79	124.2 Å²	124.2	49%	0.485	65%	0.652	S	S	.	*	H	α-helix	trans	-65.5	-35.7	178.2	-56.2	0	0	0	0	111.9	K490 L492 T498	K490-T494 WeakPolarHBondContact O-CB 3.35Å; K490-T494 PolarHBondContact O-N 3.43Å; K490-T494 PolarHBondContact O-OG1 3.18Å; L492-T494 VanDerWaalsContact C-N 3.28Å; L492-T494 PolarHBondContact O-N 2.88Å; T494-T498 PolarHBondContact O-OG1 3.33Å
495	K	60.5	Low	58.9	Low	148 Å²	148	120 Å²	120	64%	0.643	66%	0.657	S	S	*	*	H	α-helix	trans	-71.9	-39.4	174.6	-72.6	164.6	-173.3	160.1	0	112.1	D491 L492 I493 T497 T498	D491-K495 WeakPolarHBondContact O-CD 3.32Å; D491-K495 WeakPolarHBondContact O-CG 3.3Å; D491-K495 PolarHBondContact O-N 3.42Å; L492-K495 PolarHBondContact O-N 2.84Å; L492-K495 VanDerWaalsContact O-N 3.1Å; I493-K495 VanDerWaalsContact C-N 3.33Å; I493-K495 PolarHBondContact O-N 2.88Å; K495-T497 VanDerWaalsContact C-N 3.3Å; K495-T497 PolarHBondContact O-N 3.13Å; K495-T498 PolarHBondContact O-N 3.41Å
496	E	56.8	Low	56.6	Low	153 Å²	153	115.3 Å²	115.3	72%	0.715	66%	0.659	S	S	*	*	H	α-helix	trans	-65.5	-33.3	177.1	-168.9	163.7	-148.4	0	0	112.4	L492 I493 T498	L492-E496 PolarHBondContact O-N 3.03Å; I493-E496 PolarHBondContact O-N 2.99Å; E496-T498 PolarHBondContact O-N 2.76Å
497	T	51.3	Low	54.5	Low	112 Å²	112	115.6 Å²	115.6	69%	0.687	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-10.3	175.6	-52.9	0	0	0	0	113.6	I493 K495	I493-T497 WeakPolarHBondContact O-CB 3.26Å; I493-T497 PolarHBondContact O-N 3.48Å; I493-T497 PolarHBondContact O-OG1 3.04Å; K495-T497 VanDerWaalsContact C-N 3.3Å; K495-T497 PolarHBondContact O-N 3.13Å
498	T	48.4	Very low	52.3	Low	109 Å²	109	116.3 Å²	116.3	67%	0.669	68%	0.679	S	S	*	*			trans	-109.9	65.2	-172.4	-46.6	0	0	0	0	112.8	T494 K495 E496	T494-T498 PolarHBondContact O-OG1 3.33Å; K495-T498 PolarHBondContact O-N 3.41Å; E496-T498 PolarHBondContact O-N 2.76Å
499	Q	41.5	Very low	50.1	Low	163 Å²	163	117.3 Å²	117.3	76%	0.762	68%	0.679	S	S	*	*			trans	-121.3	136.5	163.2	-68.2	-164.2	40.6	0	0	111.4
500	P	43.3	Very low	48	Very low	129 Å²	129	119.2 Å²	119.2	84%	0.838	69%	0.688	S	S	*	*			trans	-83.3	140.2	-174.6	32.6	-34.9	0	0	0	113.3
501	V	40.8	Very low	45.9	Very low	137 Å²	137	119.4 Å²	119.4	83%	0.83	69%	0.691	S	S	*	*			trans	-104.8	136.8	175.9	-177.6	0	0	0	0	109.9
502	P	39.2	Very low	44.6	Very low	113 Å²	113	120.6 Å²	120.6	73%	0.734	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-73.1	161.8	179.6	29.2	-35.3	0	0	0	114.2
503	P	44.3	Very low	42.6	Very low	120 Å²	120	121.6 Å²	121.6	78%	0.779	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-83.8	161.8	-165.6	33	-37.5	0	0	0	115.9
504	P	48.7	Very low	41.1	Very low	130 Å²	130	122.5 Å²	122.5	84%	0.844	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-93.5	171.7	-176.7	38.6	-37.6	0	0	0	114.5
505	A	30.3	Very low	39.5	Very low	97 Å²	97	128.1 Å²	128.1	80%	0.802	74%	0.735	S	S	*	*			trans	-142.5	138.6	173.7	0	0	0	0	0	113.5
506	A	31.2	Very low	38.1	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	74%	0.744	S	S	*	*			trans	46.8	123.1	164.1	0	0	0	0	0	119.1
507	V	33.6	Very low	36.8	Very low	128 Å²	128	135.2 Å²	135.2	78%	0.776	75%	0.753	S	S	*	*			cis	68.9	98.6	20.4	-166.5	0	0	0	0	116.6	T509	V507-T509 HydrophobicContact CG1-CG2 4.2Å
508	V	31.5	Very low	36.1	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	75%	0.754	S	S	*	*			trans	-154	112.8	146.7	160.9	0	0	0	0	105
509	T	32.3	Very low	36.4	Very low	87 Å²	87	136.7 Å²	136.7	53%	0.534	76%	0.759	S	S	.	*				71.1	139.4	59.5	68.2	0	0	0	0	113.6	V507	V507-T509 HydrophobicContact CG1-CG2 4.2Å
510	H	33.2	Very low	36.4	Very low	152 Å²	152	134 Å²	134	70%	0.704	76%	0.755	S	S	*	*			cis	-169.5	152.9	1.2	-120.3	-13.8	0	0	0	114.2
511	Q	27.3	Very low	36	Very low	149 Å²	149	135.7 Å²	135.7	70%	0.696	76%	0.755	S	S	*	*			trans	72	170.4	139.2	-60.8	-110.5	11.4	0	0	119.8
512	P	43.8	Very low	35.2	Very low	93 Å²	93	134.9 Å²	134.9	60%	0.604	76%	0.756	S	S	*	*				-151.2	-166.1	-55.8	47.1	-30.3	0	0	0	117.8
513	I	30.1	Very low	34.8	Very low	138 Å²	138	136.8 Å²	136.8	71%	0.708	76%	0.758	S	S	*	*			trans	92.3	101.4	145.8	-78.7	169.9	0	0	0	122.3
514	T	31	Very low	34	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	76%	0.756	S	S	*	*			trans	55.5	164.5	135.6	80.8	0	0	0	0	122.5
515	K	30.7	Very low	33.4	Very low	196 Å²	196	135.6 Å²	135.6	85%	0.852	75%	0.753	S	S	*	*			cis	-154.9	179	6	-135	155.8	-166.1	177.4	0	111.7
516	R	30.6	Very low	33.6	Very low	223 Å²	223	136.5 Å²	136.5	84%	0.842	75%	0.751	S	S	*	*			trans	-76.5	159.2	-165.6	-54.1	179.9	-177.9	179.4	-1.8	118.2
517	Y	28.9	Very low	33.7	Very low	228 Å²	228	138.1 Å²	138.1	89%	0.894	75%	0.753	S	S	*	*			trans	-158.4	159.3	134.4	-114.7	-81.3	0	0	0	110.8
518	D	37.6	Very low	33.6	Very low	133 Å²	133	140.6 Å²	140.6	71%	0.711	76%	0.756	S	S	*	*			trans	-141	169.6	178.3	-68.4	-72.4	0	0	0	108.7
519	P	53.4	Low	33.5	Very low	119 Å²	119	144.8 Å²	144.8	77%	0.773	76%	0.758	S	S	*	*			cis	-123.4	-136.3	-0.2	36.9	-13.8	0	0	0	109.9
520	P	42.1	Very low	33.4	Very low	105 Å²	105	146.8 Å²	146.8	68%	0.682	77%	0.765	S	S	*	*			cis	-137.4	169.4	-18.2	39.3	-19.6	0	0	0	118.7
521	I	35.6	Very low	33.4	Very low	165 Å²	165	146.7 Å²	146.7	85%	0.846	77%	0.77	S	S	*	*			trans	24.1	119.6	145.4	-50.9	168.8	0	0	0	121
522	S	24.7	Very low	33.5	Very low	120 Å²	120	148.5 Å²	148.5	84%	0.839	77%	0.772	S	S	*	*			trans	-161.4	175.9	131.8	-157.5	0	0	0	0	113
523	I	29.3	Very low	33	Very low	154 Å²	154	148.7 Å²	148.7	79%	0.79	78%	0.776	S	S	*	*			trans	-93.6	159.3	-156.1	-64.2	166.8	0	0	0	115.1
524	S	28.4	Very low	33.3	Very low	106 Å²	106	150.6 Å²	150.6	74%	0.741	78%	0.781	S	S	*	*			trans	-50.8	166	173.8	-24.6	0	0	0	0	115.9
525	P	35.4	Very low	33.8	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	76%	0.761	S	S	*	*				-140	-169.8	53.2	44.3	-24.2	0	0	0	114.1
526	P	35.2	Very low	34.3	Very low	117 Å²	117	146.9 Å²	146.9	76%	0.76	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-90.7	161.8	-156.8	36.7	-36.6	0	0	0	116.2
527	P	32	Very low	35.2	Very low	126 Å²	126	137.6 Å²	137.6	82%	0.818	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-79.8	141.1	174.9	32.6	-34.6	0	0	0	113.5
528	Q	33.6	Very low	36.2	Very low	181 Å²	181	133.5 Å²	133.5	85%	0.846	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-59.6	146.3	165.9	-66.7	-79.2	-7.6	0	0	111
529	R	29.3	Very low	37	Very low	217 Å²	217	128.6 Å²	128.6	82%	0.819	70%	0.701	S	S	*	*			trans	-106.8	111.9	174.4	-154.8	177.6	-163.5	-149.8	2	110.7
530	N	30.3	Very low	37	Very low	129 Å²	129	129.2 Å²	129.2	69%	0.69	70%	0.698	S	S	*	*			trans	-68.6	153.1	-175.8	-75.8	-13.9	0	0	0	114
531	N	32.3	Very low	37.3	Very low	151 Å²	151	130.2 Å²	130.2	81%	0.807	71%	0.707	S	S	*	*			trans	32.7	112.1	148.6	-60.6	6.5	0	0	0	118.8
532	Y	29.7	Very low	38.3	Very low	187 Å²	187	130.3 Å²	130.3	73%	0.733	71%	0.709	S	S	*	*			trans	-110.2	154.7	146.5	-84.8	-93.9	0	0	0	110.6
533	S	32.3	Very low	40.3	Very low	97 Å²	97	126.1 Å²	126.1	68%	0.678	68%	0.678	S	S	*	*			trans	-67.2	132.1	-175.2	50.8	0	0	0	0	112.9	V535	S533-V535 PolarHBondContact O-N 2.9Å
534	H	36.9	Very low	42.6	Very low	177 Å²	177	121 Å²	121	82%	0.819	66%	0.656	S	S	*	*			trans	-78.4	90.9	-179.7	-148.3	-21	0	0	0	111
535	V	40.9	Very low	44.9	Very low	45 Å²	45	121.5 Å²	121.5	27%	0.273	66%	0.657	S	S	.	*			trans	-73	123.6	165.5	-179	0	0	0	0	107.5	S533 V555	S533-V535 PolarHBondContact O-N 2.9Å; V535-V555 HydrophobicContact CB-CG1 4.02Å
536	K	42.7	Very low	46.8	Very low	187 Å²	187	123.7 Å²	123.7	81%	0.813	65%	0.65	S	S	*	*			trans	-90.5	106.2	171.2	-94.5	-167.5	170.1	-170.4	0	109.6
537	V	49.4	Very low	48.9	Very low	27 Å²	27	119.6 Å²	119.6	16%	0.164	62%	0.621	C	S	.	*			trans	-77.1	131.9	160.8	-177.5	0	0	0	0	107.9	V539 V555 V614 F616	V537-V539 VanDerWaalsContact C-N 3.33Å; V537-V539 HydrophobicContact CB-CG2 4.09Å; V537-V539 HydrophobicContact CG1-CG2 3.95Å; V537-V539 PolarHBondContact O-N 3.43Å; V537-V539 VanDerWaalsContact O-N 3.08Å; V537-V555 HydrophobicContact CG2-CG2 3.79Å; V537-V614 HydrophobicContact CG1-CG1 3.58Å; V537-F616 HydrophobicContact CG2-CD1 4.25Å; V537-F616 HydrophobicContact CG2-CE1 4.25Å
538	T	48.5	Very low	51.2	Low	142 Å²	142	116.4 Å²	116.4	87%	0.871	60%	0.595	S	S	*	*			trans	-77	85.8	167.1	21.5	0	0	0	0	109.4
539	V	54.5	Low	53.5	Low	31 Å²	31	110.6 Å²	110.6	19%	0.188	58%	0.578	C	S	.	*			trans	-86.1	145.6	170.9	-152.1	0	0	0	0	109.1	V537 T543 I551 Y583	V537-V539 VanDerWaalsContact C-N 3.33Å; V537-V539 HydrophobicContact CB-CG2 4.09Å; V537-V539 HydrophobicContact CG1-CG2 3.95Å; V537-V539 PolarHBondContact O-N 3.43Å; V537-V539 VanDerWaalsContact O-N 3.08Å; V539-T543 HydrophobicContact CG1-CG2 4.17Å; V539-T543 VanDerWaalsContact CG1-OG1 3.29Å; V539-T543 WeakPolarHBondContact CG1-OG1 3.45Å; V539-I551 HydrophobicContact CG1-CD1 3.83Å; V539-I551 HydrophobicContact CG2-CD1 4.38Å; V539-Y583 HydrophobicContact CG1-CD2 4.48Å; V539-Y583 HydrophobicContact CG1-CE2 3.55Å; V539-Y583 WeakPolarHBondContact CG1-OH 3.36Å
540	D	54	Low	56.2	Low	132 Å²	132	100.7 Å²	100.7	71%	0.706	54%	0.541	S	S	*	.			trans	-66.7	138.9	172.4	-80.4	-44.5	0	0	0	111.2	D542 T543	D540-D542 PolarHBondContact O-N 2.96Å; D540-T543 PolarHBondContact O-N 3.2Å; D540-T543 PolarHBondContact O-OG1 3.44Å
541	S	48.7	Very low	58.8	Low	125 Å²	125	94.6 Å²	94.6	87%	0.874	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.1	-161	-54.7	0	0	0	0	116.6
542	D	56.3	Low	61.1	Low	167 Å²	167	91.2 Å²	91.2	89%	0.893	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	10.1	-178.4	-66	-42.1	0	0	0	113.4	D540 S544	D540-D542 PolarHBondContact O-N 2.96Å; D542-S544 PolarHBondContact O-N 3.27Å
543	T	67.4	Low	63.7	Low	32 Å²	32	85 Å²	85	20%	0.196	47%	0.47	C	S	.	.			trans	-65.1	129.9	-178.5	-60.4	0	0	0	0	112.2	V539 D540 Q547 I551	V539-T543 HydrophobicContact CG1-CG2 4.17Å; V539-T543 VanDerWaalsContact CG1-OG1 3.29Å; V539-T543 WeakPolarHBondContact CG1-OG1 3.45Å; D540-T543 PolarHBondContact O-N 3.2Å; D540-T543 PolarHBondContact O-OG1 3.44Å; T543-Q547 HydrophobicContact CG2-CB 3.9Å; T543-Q547 HydrophobicContact CG2-CG 3.83Å; T543-I551 HydrophobicContact CG2-CD1 4.09Å
544	S	78	Confident	66.3	Low	47 Å²	47	80.4 Å²	80.4	33%	0.329	44%	0.437	S	S	.	.			trans	-65	147.5	-175.8	75.3	0	0	0	0	113	D542 R546 Q547 Q548	D542-S544 PolarHBondContact O-N 3.27Å; S544-R546 PolarHBondContact O-N 3.32Å; S544-R546 VanDerWaalsContact O-N 3.08Å; S544-Q547 WeakPolarHBondContact O-CA 3.45Å; S544-Q547 WeakPolarHBondContact O-CB 3.46Å; S544-Q547 PolarHBondContact O-N 3.45Å; S544-Q547 VanDerWaalsContact OG-CB 3.27Å; S544-Q547 WeakPolarHBondContact OG-CB 3.28Å; S544-Q547 PolarHBondContact OG-N 3.03Å; S544-Q548 PolarHBondContact O-N 3.26Å
545	P	76.3	Confident	68.4	Low	116 Å²	116	73.5 Å²	73.5	75%	0.753	41%	0.408	S	S	*	.	H	α-helix	trans	-57.5	-30	-177.8	-28.2	35.6	0	0	0	114.8	A549	P545-A549 WeakPolarHBondContact O-CB 3.41Å; P545-A549 PolarHBondContact O-N 2.94Å; P545-A549 VanDerWaalsContact O-N 3.09Å
546	R	74.3	Confident	70.1	Confident	164 Å²	164	75.1 Å²	75.1	62%	0.619	43%	0.426	S	S	*	.	H	α-helix	trans	-71.5	-36.6	175.7	-174.5	178.9	-176.1	168.6	2.8	112.2	S544 F550 M599	S544-R546 PolarHBondContact O-N 3.32Å; S544-R546 VanDerWaalsContact O-N 3.08Å; R546-F550 PolarHBondContact O-N 2.92Å; R546-M599 HydrophobicContact CG-SD 4.27Å
547	Q	79.1	Confident	72	Confident	31 Å²	31	72.4 Å²	72.4	15%	0.145	41%	0.414	C	S	.	.	H	α-helix	trans	-76.8	-35.9	178.2	-171.3	174.9	-0.8	0	0	110.9	T543 S544 F550 I551 G581 Y583 M599	T543-Q547 HydrophobicContact CG2-CB 3.9Å; T543-Q547 HydrophobicContact CG2-CG 3.83Å; S544-Q547 WeakPolarHBondContact O-CA 3.45Å; S544-Q547 WeakPolarHBondContact O-CB 3.46Å; S544-Q547 PolarHBondContact O-N 3.45Å; S544-Q547 VanDerWaalsContact OG-CB 3.27Å; S544-Q547 WeakPolarHBondContact OG-CB 3.28Å; S544-Q547 PolarHBondContact OG-N 3.03Å; Q547-F550 WeakPolarHBondContact O-CB 3.48Å; Q547-F550 PolarHBondContact O-N 2.96Å; Q547-I551 WeakPolarHBondContact O-CG1 3.41Å; Q547-I551 PolarHBondContact O-N 3.02Å; Q547-G581 PolarHBondContact NE2-O 2.87Å; Q547-Y583 HydrophobicContact CG-CD2 4.35Å; Q547-M599 HydrophobicContact CB-SD 4.3Å
548	Q	81.2	Confident	73.5	Confident	60 Å²	60	74.2 Å²	74.2	28%	0.28	44%	0.438	S	S	.	.	H	α-helix	trans	-59.8	-49.8	169.5	-172.5	60.4	50.4	0	0	111.5	S544 F550 I551 D552	S544-Q548 PolarHBondContact O-N 3.26Å; Q548-F550 PolarHBondContact O-N 3.08Å; Q548-I551 WeakPolarHBondContact O-CB 3.13Å; Q548-I551 PolarHBondContact O-N 3.14Å; Q548-D552 PolarHBondContact NE2-OD1 3.35Å; Q548-D552 PolarHBondContact O-N 3.02Å
549	A	81.8	Confident	75	Confident	58 Å²	58	68.3 Å²	68.3	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-60.8	-27.3	176.9	0	0	0	0	0	113.5	P545 D553	P545-A549 WeakPolarHBondContact O-CB 3.41Å; P545-A549 PolarHBondContact O-N 2.94Å; P545-A549 VanDerWaalsContact O-N 3.09Å; A549-D553 WeakPolarHBondContact O-CB 3.48Å; A549-D553 PolarHBondContact O-N 2.88Å
550	F	85.8	Confident	76.7	Confident	10 Å²	10	71.1 Å²	71.1	4%	0.044	42%	0.415	C	S	.	.	H	α-helix	trans	-75	-40.8	172.9	178.3	-113.9	0	0	0	112.3	R546 Q547 Q548 D553 I554 Y583 E585 N598 M599	R546-F550 PolarHBondContact O-N 2.92Å; Q547-F550 WeakPolarHBondContact O-CB 3.48Å; Q547-F550 PolarHBondContact O-N 2.96Å; Q548-F550 PolarHBondContact O-N 3.08Å; F550-D553 PolarHBondContact O-N 3.15Å; F550-I554 HydrophobicContact CD1-CD1 3.97Å; F550-I554 HydrophobicContact CD2-CD1 4.46Å; F550-I554 HydrophobicContact CE1-CD1 3.6Å; F550-I554 HydrophobicContact CE2-CD1 4.14Å; F550-I554 HydrophobicContact CG-CD1 4.39Å; F550-I554 HydrophobicContact CZ-CD1 3.7Å; F550-I554 HydrophobicContact CZ-CG1 4.49Å; F550-I554 WeakPolarHBondContact O-CG1 3.43Å; F550-I554 PolarHBondContact O-N 2.95Å; F550-I554 VanDerWaalsContact O-N 3.16Å; F550-Y583 WeakPolarHBondContact CE1-O 3.18Å; F550-E585 HydrophobicContact CZ-CB 4.34Å; F550-N598 WeakPolarHBondContact CZ-O 3.5Å; F550-M599 HydrophobicContact CB-CB 4.02Å; F550-M599 HydrophobicContact CD1-CB 3.81Å; F550-M599 HydrophobicContact CD2-CB 4.23Å; F550-M599 HydrophobicContact CE1-CB 4.3Å; F550-M599 HydrophobicContact CG-CB 3.76Å
551	I	84.6	Confident	78.4	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-59.5	-48.5	171.3	-67.9	156.1	0	0	0	110.2	V539 T543 Q547 Q548 D553 I554 V555 L561 Y583	V539-I551 HydrophobicContact CG1-CD1 3.83Å; V539-I551 HydrophobicContact CG2-CD1 4.38Å; T543-I551 HydrophobicContact CG2-CD1 4.09Å; Q547-I551 WeakPolarHBondContact O-CG1 3.41Å; Q547-I551 PolarHBondContact O-N 3.02Å; Q548-I551 WeakPolarHBondContact O-CB 3.13Å; Q548-I551 PolarHBondContact O-N 3.14Å; I551-D553 VanDerWaalsContact C-N 3.29Å; I551-D553 PolarHBondContact O-N 3.39Å; I551-I554 PolarHBondContact O-N 3.34Å; I551-I554 VanDerWaalsContact O-N 3.17Å; I551-V555 HydrophobicContact CG2-CG2 4.15Å; I551-V555 VanDerWaalsContact O-CG2 3.28Å; I551-V555 WeakPolarHBondContact O-CG2 3.29Å; I551-V555 PolarHBondContact O-N 3.29Å; I551-L561 HydrophobicContact CG1-CD1 4.45Å; I551-L561 HydrophobicContact CG2-CD2 3.94Å; I551-Y583 HydrophobicContact CD1-CD1 4.47Å; I551-Y583 HydrophobicContact CD1-CD2 3.65Å; I551-Y583 HydrophobicContact CD1-CE2 4.05Å; I551-Y583 HydrophobicContact CD1-CG 3.9Å; I551-Y583 HydrophobicContact CG1-CD2 4.3Å; I551-Y583 HydrophobicContact CG1-CG 4.05Å
552	D	81.6	Confident	80.5	Confident	80 Å²	80	58.9 Å²	58.9	43%	0.428	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-36.8	-178	-62.6	-22.4	0	0	0	111.9	Q548 A556	Q548-D552 PolarHBondContact NE2-OD1 3.35Å; Q548-D552 PolarHBondContact O-N 3.02Å; D552-A556 VanDerWaalsContact O-CB 3.22Å; D552-A556 WeakPolarHBondContact O-CB 3.23Å; D552-A556 PolarHBondContact O-N 2.59Å
553	D	84.6	Confident	82.2	Confident	57 Å²	57	52.3 Å²	52.3	31%	0.305	31%	0.306	S	S	.	.	H	α-helix	trans	-67.1	-40.7	175	179.5	64.7	0	0	0	112.6	A549 F550 I551 K557	A549-D553 WeakPolarHBondContact O-CB 3.48Å; A549-D553 PolarHBondContact O-N 2.88Å; F550-D553 PolarHBondContact O-N 3.15Å; I551-D553 VanDerWaalsContact C-N 3.29Å; I551-D553 PolarHBondContact O-N 3.39Å; D553-K557 WeakPolarHBondContact O-CD 3.46Å; D553-K557 VanDerWaalsContact O-CG 3.28Å; D553-K557 WeakPolarHBondContact O-CG 3.4Å; D553-K557 PolarHBondContact O-N 2.95Å; D553-K557 WeakPolarHBondContact OD1-CE 3.35Å; D553-K557 IonicContact OD1-NZ 2.75Å; D553-K557 PolarHBondContact OD1-NZ 3.25Å; D553-K557 IonicContact OD2-NZ 2.65Å; D553-K557 PolarHBondContact OD2-NZ 3.12Å
554	I	84.9	Confident	83.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.9	-45.5	174.1	-64.1	162.4	0	0	0	110.4	F550 I551 K557 G558 G559 L561 E585	F550-I554 HydrophobicContact CD1-CD1 3.97Å; F550-I554 HydrophobicContact CD2-CD1 4.46Å; F550-I554 HydrophobicContact CE1-CD1 3.6Å; F550-I554 HydrophobicContact CE2-CD1 4.14Å; F550-I554 HydrophobicContact CG-CD1 4.39Å; F550-I554 HydrophobicContact CZ-CD1 3.7Å; F550-I554 HydrophobicContact CZ-CG1 4.49Å; F550-I554 WeakPolarHBondContact O-CG1 3.43Å; F550-I554 PolarHBondContact O-N 2.95Å; F550-I554 VanDerWaalsContact O-N 3.16Å; I551-I554 PolarHBondContact O-N 3.34Å; I551-I554 VanDerWaalsContact O-N 3.17Å; I554-K557 CarbonylContact O-C 3.58Å; I554-K557 PolarHBondContact O-N 3.19Å; I554-G558 PolarHBondContact O-N 3.29Å; I554-G559 PolarHBondContact O-N 3.29Å; I554-L561 HydrophobicContact CD1-CD1 3.68Å; I554-L561 HydrophobicContact CG2-CB 4.33Å; I554-L561 HydrophobicContact CG2-CD1 4.33Å; I554-E585 HydrophobicContact CD1-CB 3.75Å; I554-E585 HydrophobicContact CG1-CB 4.04Å; I554-E585 HydrophobicContact CG1-CG 4.29Å
555	V	81.5	Confident	83.9	Confident	32 Å²	32	50.8 Å²	50.8	19%	0.194	29%	0.294	C	S	.	.	H	α-helix	trans	-60	-46.5	177.6	170.4	0	0	0	0	110.8	V535 V537 I551 K557 G558 F616	V535-V555 HydrophobicContact CB-CG1 4.02Å; V537-V555 HydrophobicContact CG2-CG2 3.79Å; I551-V555 HydrophobicContact CG2-CG2 4.15Å; I551-V555 VanDerWaalsContact O-CG2 3.28Å; I551-V555 WeakPolarHBondContact O-CG2 3.29Å; I551-V555 PolarHBondContact O-N 3.29Å; V555-K557 PolarHBondContact O-N 3.34Å; V555-G558 PolarHBondContact O-N 3.08Å; V555-G558 VanDerWaalsContact O-N 3.08Å; V555-F616 HydrophobicContact CG2-CE1 3.95Å
556	A	77.6	Confident	84.3	Confident	79 Å²	79	52.3 Å²	52.3	65%	0.653	29%	0.286	S	S	*	.	H	α-helix	trans	-64	-24.6	177.7	0	0	0	0	0	113.7	D552	D552-A556 VanDerWaalsContact O-CB 3.22Å; D552-A556 WeakPolarHBondContact O-CB 3.23Å; D552-A556 PolarHBondContact O-N 2.59Å
557	K	82.3	Confident	84.9	Confident	129 Å²	129	49.4 Å²	49.4	56%	0.561	28%	0.283	S	S	*	.	H	α-helix	trans	-90.3	-10	174.5	-70.3	166.7	-172.9	166.9	0	113.8	D553 I554 V555 G559	D553-K557 WeakPolarHBondContact O-CD 3.46Å; D553-K557 VanDerWaalsContact O-CG 3.28Å; D553-K557 WeakPolarHBondContact O-CG 3.4Å; D553-K557 PolarHBondContact O-N 2.95Å; D553-K557 WeakPolarHBondContact OD1-CE 3.35Å; D553-K557 IonicContact OD1-NZ 2.75Å; D553-K557 PolarHBondContact OD1-NZ 3.25Å; D553-K557 IonicContact OD2-NZ 2.65Å; D553-K557 PolarHBondContact OD2-NZ 3.12Å; I554-K557 CarbonylContact O-C 3.58Å; I554-K557 PolarHBondContact O-N 3.19Å; V555-K557 PolarHBondContact O-N 3.34Å; K557-G559 VanDerWaalsContact C-N 3.29Å
558	G	79.9	Confident	85.3	Confident	66 Å²	66	50.3 Å²	50.3	68%	0.68	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	24.3	-172.6	0	0	0	0	0	113.9	I554 V555	I554-G558 PolarHBondContact O-N 3.29Å; V555-G558 PolarHBondContact O-N 3.08Å; V555-G558 VanDerWaalsContact O-N 3.08Å
559	G	81.8	Confident	85.5	Confident	17 Å²	17	49.7 Å²	49.7	18%	0.175	30%	0.295	C	S	.	.			trans	-72.5	156.1	179.5	0	0	0	0	0	113	I554 K557 L561 F616	I554-G559 PolarHBondContact O-N 3.29Å; K557-G559 VanDerWaalsContact C-N 3.29Å; G559-L561 PolarHBondContact O-N 2.94Å; G559-F616 WeakPolarHBondContact O-CE2 3.48Å; G559-F616 VanDerWaalsContact O-CZ 3.26Å; G559-F616 WeakPolarHBondContact O-CZ 3.45Å
560	K	89.1	Confident	85.7	Confident	90 Å²	90	48.2 Å²	48.2	39%	0.391	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.4	173.8	-68.7	-179.1	-176.2	-177.3	0	109.6	V586 D589 M613	K560-V586 HydrophobicContact CB-CB 3.86Å; K560-V586 PolarHBondContact O-N 3.23Å; K560-D589 IonicContact NZ-OD1 2.67Å; K560-D589 PolarHBondContact NZ-OD1 2.96Å; K560-D589 IonicContact NZ-OD2 3.21Å; K560-D589 PolarHBondContact NZ-OD2 3.31Å; K560-M613 HydrophobicContact CB-CE 3.99Å; K560-M613 HydrophobicContact CG-CE 4.35Å
561	L	90.6	Very high	85	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.9	178.7	-174	70.5	0	0	0	110.8	I551 I554 G559 Y583 V614 F616	I551-L561 HydrophobicContact CG1-CD1 4.45Å; I551-L561 HydrophobicContact CG2-CD2 3.94Å; I554-L561 HydrophobicContact CD1-CD1 3.68Å; I554-L561 HydrophobicContact CG2-CB 4.33Å; I554-L561 HydrophobicContact CG2-CD1 4.33Å; G559-L561 PolarHBondContact O-N 2.94Å; L561-Y583 HydrophobicContact CD1-CD1 4.31Å; L561-Y583 HydrophobicContact CD2-CD1 4.31Å; L561-Y583 HydrophobicContact CG-CD1 4.26Å; L561-V614 HydrophobicContact CB-CB 4.24Å; L561-V614 HydrophobicContact CB-CG2 4.47Å; L561-V614 HydrophobicContact CD2-CB 4Å; L561-V614 HydrophobicContact CD2-CG1 4.09Å; L561-V614 HydrophobicContact CD2-CG2 4.02Å; L561-V614 HydrophobicContact CG-CB 4.14Å; L561-V614 HydrophobicContact CG-CG2 3.95Å; L561-V614 PolarHBondContact O-N 2.78Å; L561-F616 HydrophobicContact CB-CE1 4.29Å; L561-F616 HydrophobicContact CB-CZ 3.77Å
562	A	91.8	Very high	84.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	151.1	171.6	0	0	0	0	0	111.3	Y583 L584 V586 L611 S612 M613	A562-Y583 WeakPolarHBondContact O-CA 3.49Å; A562-L584 PolarHBondContact N-O 2.86Å; A562-L584 PolarHBondContact O-N 3.37Å; A562-V586 HydrophobicContact CB-CG2 3.6Å; A562-L611 HydrophobicContact CB-CB 4.35Å; A562-L611 HydrophobicContact CB-CD2 4.48Å; A562-S612 CarbonylContact C-O 3.43Å; A562-S612 VanDerWaalsContact CA-O 3.31Å; A562-S612 WeakPolarHBondContact CA-O 3.46Å; A562-M613 HydrophobicContact CB-SD 4.11Å
563	V	92.5	Very high	84.7	Confident	30 Å²	30	62.2 Å²	62.2	18%	0.182	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.3	169.8	67.5	0	0	0	0	110.2	Y583 S612 V614	V563-Y583 HydrophobicContact CB-CD1 3.81Å; V563-Y583 HydrophobicContact CB-CE1 3.57Å; V563-Y583 HydrophobicContact CG2-CD1 4.08Å; V563-Y583 HydrophobicContact CG2-CE1 3.78Å; V563-Y583 HydrophobicContact CG2-CE2 4.29Å; V563-Y583 HydrophobicContact CG2-CG 4.46Å; V563-S612 PolarHBondContact N-O 2.91Å; V563-S612 PolarHBondContact O-N 3.43Å; V563-V614 HydrophobicContact CB-CG2 4.46Å
564	V	92.9	Very high	84.7	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.012	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.5	179.5	176.5	0	0	0	0	109.7	Y566 V578 H579 K580 G581 E582 L584 I610 L611	V564-Y566 WeakPolarHBondContact CG1-O 3.43Å; V564-V578 HydrophobicContact CG1-CB 4.12Å; V564-V578 HydrophobicContact CG1-CG2 3.9Å; V564-V578 HydrophobicContact CG2-CB 3.99Å; V564-V578 HydrophobicContact CG2-CG1 4.42Å; V564-V578 HydrophobicContact CG2-CG2 4.35Å; V564-H579 VanDerWaalsContact CB-O 3.25Å; V564-H579 WeakPolarHBondContact CB-O 3.45Å; V564-H579 VanDerWaalsContact CG1-O 3.23Å; V564-H579 WeakPolarHBondContact CG1-O 2.87Å; V564-K580 WeakPolarHBondContact O-CA 3.4Å; V564-G581 PolarHBondContact O-N 3.21Å; V564-E582 HydrophobicContact CB-CB 4.47Å; V564-E582 HydrophobicContact CG2-CB 4.26Å; V564-E582 WeakPolarHBondContact CG2-O 3.45Å; V564-E582 PolarHBondContact N-O 3.5Å; V564-L584 HydrophobicContact CG2-CD1 3.54Å; V564-L584 HydrophobicContact CG2-CG 3.91Å; V564-I610 WeakPolarHBondContact CA-O 3.46Å; V564-L611 HydrophobicContact CG2-CD2 3.82Å
565	T	87.9	Confident	84.9	Confident	44 Å²	44	67.9 Å²	67.9	27%	0.27	38%	0.383	S	S	.	.			trans	-95	-16.9	-174.1	55.1	0	0	0	0	114.2	K580 I610	T565-K580 WeakPolarHBondContact O-CD 3.39Å; T565-K580 WeakPolarHBondContact O-CE 3.33Å; T565-K580 WeakPolarHBondContact O-CG 3.49Å; T565-I610 PolarHBondContact N-O 2.77Å; T565-I610 VanDerWaalsContact OG1-C 3.25Å; T565-I610 WeakPolarHBondContact OG1-CA 3.37Å; T565-I610 PolarHBondContact OG1-O 2.99Å
566	Y	85.3	Confident	85.3	Confident	149 Å²	149	66.8 Å²	66.8	58%	0.584	38%	0.377	S	S	*	.	S	Bend	trans	-146.9	143.8	178.5	-59.6	-85.9	0	0	0	111	V564 I610	V564-Y566 WeakPolarHBondContact CG1-O 3.43Å; Y566-I610 HydrophobicContact CD2-CB 4.34Å; Y566-I610 HydrophobicContact CD2-CG2 4.02Å
567	D	85.9	Confident	85.9	Confident	103 Å²	103	66.5 Å²	66.5	55%	0.551	37%	0.367	S	S	*	.			trans	-64.9	138.5	175.4	-51.6	-78.8	0	0	0	112	H579 K580	D567-H579 WeakPolarHBondContact OD1-CA 3.27Å; D567-K580 PolarHBondContact OD1-N 3.03Å
568	R	86.8	Confident	86.4	Confident	49 Å²	49	60.4 Å²	60.4	19%	0.185	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-153.8	117.1	177.7	-169.5	170.5	-178.7	-74.9	-10.7	112.6	E575 T577 V578 W593 I610	R568-E575 IonicContact CZ-OE2 3.96Å; R568-E575 VanDerWaalsContact CZ-OE2 3.25Å; R568-E575 IonicContact NH1-OE2 3.61Å; R568-E575 PolarHBondContact NH1-OE2 3Å; R568-E575 IonicContact NH2-OE2 3.6Å; R568-E575 PolarHBondContact NH2-OE2 3.03Å; R568-T577 WeakPolarHBondContact O-CA 3.32Å; R568-V578 HydrophobicContact CB-CG2 4.06Å; R568-V578 PolarHBondContact N-O 3.38Å; R568-V578 PolarHBondContact O-N 2.83Å; R568-W593 VanDerWaalsContact NH2-CH2 3.3Å; R568-I610 HydrophobicContact CB-CD1 3.63Å; R568-I610 HydrophobicContact CG-CD1 4.28Å
569	G	86.6	Confident	86.8	Confident	48 Å²	48	62.4 Å²	62.4	50%	0.495	33%	0.332	S	S	.	.			trans	-68.1	136	165.1	0	0	0	0	0	111.9
570	G	86.5	Confident	87.1	Confident	26 Å²	26	68.2 Å²	68.2	27%	0.268	35%	0.352	S	S	.	.			trans	-70.8	125.2	174.5	0	0	0	0	0	111.3	N572 T577	G570-N572 VanDerWaalsContact C-N 3.32Å; G570-N572 PolarHBondContact O-N 3.29Å; G570-T577 PolarHBondContact N-OG1 3.33Å
571	Q	71.2	Confident	86.8	Confident	153 Å²	153	65.6 Å²	65.6	72%	0.715	35%	0.35	S	S	*	.	S	Bend	trans	-83.6	-5.2	-171.4	-59.7	-176.6	-10.4	0	0	114.2	E575	Q571-E575 PolarHBondContact N-OE2 2.88Å; Q571-E575 VanDerWaalsContact N-OE2 3.07Å
572	N	78.3	Confident	86.8	Confident	82 Å²	82	66.5 Å²	66.5	44%	0.439	36%	0.355	S	S	.	.	S	Bend	trans	-161.6	173.8	176.2	59.2	79.1	0	0	0	110.3	G570 K574 E575	G570-N572 VanDerWaalsContact C-N 3.32Å; G570-N572 PolarHBondContact O-N 3.29Å; N572-K574 PolarHBondContact O-N 2.9Å; N572-K574 WeakPolarHBondContact OD1-CB 3.35Å; N572-K574 PolarHBondContact OD1-N 3.35Å; N572-E575 PolarHBondContact ND2-OE1 3.06Å; N572-E575 PolarHBondContact O-N 3.1Å
573	T	80.3	Confident	86.8	Confident	151 Å²	151	67.4 Å²	67.4	93%	0.926	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-1.5	-176.7	53	0	0	0	0	115.9
574	K	85.1	Confident	86.9	Confident	144 Å²	144	66 Å²	66	63%	0.626	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-7.8	171.6	-55.4	-173.1	177.2	-172.1	0	113.4	N572 G604 Y605	N572-K574 PolarHBondContact O-N 2.9Å; N572-K574 WeakPolarHBondContact OD1-CB 3.35Å; N572-K574 PolarHBondContact OD1-N 3.35Å; K574-G604 WeakPolarHBondContact O-CA 3.43Å; K574-Y605 HydrophobicContact CB-CD2 4.09Å; K574-Y605 HydrophobicContact CB-CE2 4.46Å; K574-Y605 WeakPolarHBondContact O-CD2 3.47Å; K574-Y605 PolarHBondContact O-N 2.79Å
575	E	88.8	Confident	86.9	Confident	31 Å²	31	67.3 Å²	67.3	15%	0.145	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-97.1	140.3	178.8	-68.1	-176.4	-146.8	0	0	110.8	R568 Q571 N572 W593 Y605	R568-E575 IonicContact CZ-OE2 3.96Å; R568-E575 VanDerWaalsContact CZ-OE2 3.25Å; R568-E575 IonicContact NH1-OE2 3.61Å; R568-E575 PolarHBondContact NH1-OE2 3Å; R568-E575 IonicContact NH2-OE2 3.6Å; R568-E575 PolarHBondContact NH2-OE2 3.03Å; Q571-E575 PolarHBondContact N-OE2 2.88Å; Q571-E575 VanDerWaalsContact N-OE2 3.07Å; N572-E575 PolarHBondContact ND2-OE1 3.06Å; N572-E575 PolarHBondContact O-N 3.1Å; E575-W593 HydrophobicContact CG-CH2 4.15Å; E575-W593 HydrophobicContact CG-CZ3 3.63Å; E575-W593 WeakPolarHBondContact OE1-CH2 3.3Å; E575-W593 WeakPolarHBondContact OE2-CH2 3.25Å; E575-W593 WeakPolarHBondContact OE2-CZ3 3.45Å; E575-Y605 WeakPolarHBondContact CA-O 3.43Å
576	L	89.9	Confident	87.2	Confident	10 Å²	10	65.6 Å²	65.6	5%	0.052	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-88.1	127.4	176.6	-164.6	65.2	0	0	0	109.6	V578 L584 C596 N598 R602 Y605 V606	L576-V578 HydrophobicContact CB-CG1 4.19Å; L576-V578 HydrophobicContact CD2-CG1 3.96Å; L576-V578 HydrophobicContact CG-CG1 3.92Å; L576-L584 HydrophobicContact CD2-CD2 4.12Å; L576-C596 HydrophobicContact CD2-CB 4.45Å; L576-N598 HydrophobicContact CD2-CB 4.24Å; L576-R602 HydrophobicContact CD1-CB 3.94Å; L576-Y605 PolarHBondContact N-O 2.97Å; L576-Y605 VanDerWaalsContact N-O 3.15Å; L576-V606 HydrophobicContact CB-CG2 3.75Å; L576-V606 HydrophobicContact CD2-CG2 4.22Å
577	T	91.3	Very high	87.5	Confident	72 Å²	72	62.5 Å²	62.5	44%	0.442	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-72.3	127.6	164.9	-66.7	0	0	0	0	108.8	R568 G570	R568-T577 WeakPolarHBondContact O-CA 3.32Å; G570-T577 PolarHBondContact N-OG1 3.33Å
578	V	91.8	Very high	87.6	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-139	147.7	-172.9	-64.1	0	0	0	0	111.3	V564 R568 L576 E582 L584 V606 I610	V564-V578 HydrophobicContact CG1-CB 4.12Å; V564-V578 HydrophobicContact CG1-CG2 3.9Å; V564-V578 HydrophobicContact CG2-CB 3.99Å; V564-V578 HydrophobicContact CG2-CG1 4.42Å; V564-V578 HydrophobicContact CG2-CG2 4.35Å; R568-V578 HydrophobicContact CB-CG2 4.06Å; R568-V578 PolarHBondContact N-O 3.38Å; R568-V578 PolarHBondContact O-N 2.83Å; L576-V578 HydrophobicContact CB-CG1 4.19Å; L576-V578 HydrophobicContact CD2-CG1 3.96Å; L576-V578 HydrophobicContact CG-CG1 3.92Å; V578-E582 WeakPolarHBondContact CA-OE2 3.5Å; V578-L584 HydrophobicContact CG1-CD1 3.91Å; V578-L584 HydrophobicContact CG1-CD2 4.39Å; V578-V606 HydrophobicContact CG1-CG2 3.93Å; V578-V606 HydrophobicContact CG2-CG1 4.24Å; V578-I610 HydrophobicContact CG2-CD1 3.94Å
579	H	89.1	Confident	87.7	Confident	108 Å²	108	61.1 Å²	61.1	50%	0.5	33%	0.331	S	S	.	.			trans	-116	152.4	179.2	-57.7	83.5	0	0	0	111.7	V564 D567 G581 E582	V564-H579 VanDerWaalsContact CB-O 3.25Å; V564-H579 WeakPolarHBondContact CB-O 3.45Å; V564-H579 VanDerWaalsContact CG1-O 3.23Å; V564-H579 WeakPolarHBondContact CG1-O 2.87Å; D567-H579 WeakPolarHBondContact OD1-CA 3.27Å; H579-G581 PolarHBondContact O-N 3.37Å; H579-E582 PolarHBondContact N-OE2 3.35Å; H579-E582 IonicContact ND1-OE2 2.94Å; H579-E582 WeakPolarHBondContact O-CB 3.22Å; H579-E582 PolarHBondContact O-N 3.46Å
580	K	87.6	Confident	87.1	Confident	140 Å²	140	66.1 Å²	66.1	61%	0.609	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	128.4	177.5	-177	177.9	-178.7	-172	0	110.6	V564 T565 D567 E582	V564-K580 WeakPolarHBondContact O-CA 3.4Å; T565-K580 WeakPolarHBondContact O-CD 3.39Å; T565-K580 WeakPolarHBondContact O-CE 3.33Å; T565-K580 WeakPolarHBondContact O-CG 3.49Å; D567-K580 PolarHBondContact OD1-N 3.03Å; K580-E582 VanDerWaalsContact C-N 3.32Å
581	G	82.9	Confident	86.9	Confident	34 Å²	34	73 Å²	73	35%	0.351	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-1.2	-172.7	0	0	0	0	0	114.5	Q547 V564 H579	Q547-G581 PolarHBondContact NE2-O 2.87Å; V564-G581 PolarHBondContact O-N 3.21Å; H579-G581 PolarHBondContact O-N 3.37Å
582	E	90.9	Very high	87.7	Confident	20 Å²	20	71.3 Å²	71.3	9%	0.093	36%	0.355	C	S	.	.			trans	-68.2	136.7	166.9	-166.6	169.5	178.5	0	0	109.5	V564 V578 H579 K580 L584 N598	V564-E582 HydrophobicContact CB-CB 4.47Å; V564-E582 HydrophobicContact CG2-CB 4.26Å; V564-E582 WeakPolarHBondContact CG2-O 3.45Å; V564-E582 PolarHBondContact N-O 3.5Å; V578-E582 WeakPolarHBondContact CA-OE2 3.5Å; H579-E582 PolarHBondContact N-OE2 3.35Å; H579-E582 IonicContact ND1-OE2 2.94Å; H579-E582 WeakPolarHBondContact O-CB 3.22Å; H579-E582 PolarHBondContact O-N 3.46Å; K580-E582 VanDerWaalsContact C-N 3.32Å; E582-L584 HydrophobicContact CG-CD2 4.22Å; E582-N598 VanDerWaalsContact OE1-CB 3.3Å; E582-N598 WeakPolarHBondContact OE1-CB 3.09Å; E582-N598 PolarHBondContact OE1-ND2 3.19Å; E582-N598 VanDerWaalsContact OE1-ND2 3.12Å
583	Y	91.9	Very high	88.3	Confident	18 Å²	18	72.1 Å²	72.1	7%	0.071	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.7	175.5	-76.7	-82.8	0	0	0	109.4	V539 Q547 F550 I551 L561 A562 V563 V614	V539-Y583 HydrophobicContact CG1-CD2 4.48Å; V539-Y583 HydrophobicContact CG1-CE2 3.55Å; V539-Y583 WeakPolarHBondContact CG1-OH 3.36Å; Q547-Y583 HydrophobicContact CG-CD2 4.35Å; F550-Y583 WeakPolarHBondContact CE1-O 3.18Å; I551-Y583 HydrophobicContact CD1-CD1 4.47Å; I551-Y583 HydrophobicContact CD1-CD2 3.65Å; I551-Y583 HydrophobicContact CD1-CE2 4.05Å; I551-Y583 HydrophobicContact CD1-CG 3.9Å; I551-Y583 HydrophobicContact CG1-CD2 4.3Å; I551-Y583 HydrophobicContact CG1-CG 4.05Å; L561-Y583 HydrophobicContact CD1-CD1 4.31Å; L561-Y583 HydrophobicContact CD2-CD1 4.31Å; L561-Y583 HydrophobicContact CG-CD1 4.26Å; A562-Y583 WeakPolarHBondContact O-CA 3.49Å; V563-Y583 HydrophobicContact CB-CD1 3.81Å; V563-Y583 HydrophobicContact CB-CE1 3.57Å; V563-Y583 HydrophobicContact CG2-CD1 4.08Å; V563-Y583 HydrophobicContact CG2-CE1 3.78Å; V563-Y583 HydrophobicContact CG2-CE2 4.29Å; V563-Y583 HydrophobicContact CG2-CG 4.46Å; Y583-V614 HydrophobicContact CD1-CG2 4.23Å; Y583-V614 HydrophobicContact CE1-CG2 3.89Å
584	L	94.1	Very high	88.9	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.2	-174.6	-57	177.9	0	0	0	111.6	A562 V564 L576 V578 E582 C596 K597 N598 V606 L611	A562-L584 PolarHBondContact N-O 2.86Å; A562-L584 PolarHBondContact O-N 3.37Å; V564-L584 HydrophobicContact CG2-CD1 3.54Å; V564-L584 HydrophobicContact CG2-CG 3.91Å; L576-L584 HydrophobicContact CD2-CD2 4.12Å; V578-L584 HydrophobicContact CG1-CD1 3.91Å; V578-L584 HydrophobicContact CG1-CD2 4.39Å; E582-L584 HydrophobicContact CG-CD2 4.22Å; L584-C596 HydrophobicContact CB-CB 4.31Å; L584-C596 HydrophobicContact CD1-CB 3.94Å; L584-K597 WeakPolarHBondContact CA-O 3.35Å; L584-N598 HydrophobicContact CD2-CB 3.47Å; L584-N598 VanDerWaalsContact CD2-CB 3.47Å; L584-V606 HydrophobicContact CD1-CG2 4.27Å; L584-L611 HydrophobicContact CD1-CD2 3.89Å
585	E	93.9	Very high	89.3	Confident	31 Å²	31	62.4 Å²	62.4	15%	0.145	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123	163.8	-176.3	177.4	-153	0	0	108.6	F550 I554 C596 K597	F550-E585 HydrophobicContact CZ-CB 4.34Å; I554-E585 HydrophobicContact CD1-CB 3.75Å; I554-E585 HydrophobicContact CG1-CB 4.04Å; I554-E585 HydrophobicContact CG1-CG 4.29Å; E585-C596 CarbonylContact O-C 3.54Å; E585-C596 VanDerWaalsContact O-CA 3.31Å; E585-C596 WeakPolarHBondContact O-CA 3.32Å; E585-K597 HydrophobicContact CB-CB 4.25Å; E585-K597 PolarHBondContact N-O 3.08Å; E585-K597 PolarHBondContact O-N 2.85Å; E585-K597 WeakPolarHBondContact OE2-CD 3.31Å; E585-K597 IonicContact OE2-NZ 3.82Å; E585-K597 PolarHBondContact OE2-NZ 3.18Å
586	V	93	Very high	89.6	Confident	7 Å²	7	61 Å²	61	4%	0.042	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	110.4	176.3	-178.4	0	0	0	0	108.7	K560 A562 D589 W594 M613	K560-V586 HydrophobicContact CB-CB 3.86Å; K560-V586 PolarHBondContact O-N 3.23Å; A562-V586 HydrophobicContact CB-CG2 3.6Å; V586-D589 HydrophobicContact CG1-CB 4Å; V586-W594 HydrophobicContact CG1-CB 4.41Å; V586-W594 HydrophobicContact CG1-CD2 4.3Å; V586-W594 HydrophobicContact CG1-CE3 3.85Å; V586-W594 HydrophobicContact CG1-CZ3 4.49Å; V586-W594 HydrophobicContact CG2-CE3 4.06Å; V586-W594 HydrophobicContact CG2-CZ3 4.4Å; V586-M613 HydrophobicContact CG2-SD 4.27Å
587	I	92.1	Very high	89.8	Confident	85 Å²	85	61.9 Å²	61.9	44%	0.436	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-41	-179	-60.7	174.4	0	0	0	110.3	E595 K597 V603	I587-E595 HydrophobicContact CB-CB 4.47Å; I587-E595 WeakPolarHBondContact CB-O 3.22Å; I587-E595 PolarHBondContact N-O 2.93Å; I587-K597 HydrophobicContact CD1-CB 3.85Å; I587-K597 HydrophobicContact CD1-CD 4.14Å; I587-K597 HydrophobicContact CG1-CB 4.41Å; I587-V603 HydrophobicContact CD1-CG1 4.03Å; I587-V603 HydrophobicContact CD1-CG2 4.04Å
588	F	88.3	Confident	89.8	Confident	68 Å²	68	58.9 Å²	58.9	30%	0.298	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	122.8	-173.9	-165.8	-103.1	0	0	0	112.4	E590 W594 E595	F588-E590 HydrophobicContact CD1-CB 4.49Å; F588-E590 HydrophobicContact CE1-CB 3.77Å; F588-E590 HydrophobicContact CE1-CG 4.03Å; F588-E590 HydrophobicContact CE2-CG 3.9Å; F588-E590 HydrophobicContact CZ-CB 3.82Å; F588-E590 HydrophobicContact CZ-CG 3.61Å; F588-E590 WeakPolarHBondContact CZ-OE2 3.24Å; F588-W594 CarbonylContact O-C 3.56Å; F588-W594 VanDerWaalsContact O-CA 3.23Å; F588-W594 WeakPolarHBondContact O-CA 3.21Å; F588-W594 WeakPolarHBondContact O-CB 3.26Å; F588-E595 HydrophobicContact CB-CB 3.86Å; F588-E595 PolarHBondContact N-O 2.62Å; F588-E595 PolarHBondContact O-N 3.3Å
589	D	88.7	Confident	89.6	Confident	54 Å²	54	61 Å²	61	29%	0.289	29%	0.285	S	S	.	.			trans	-120.4	5.5	-168.2	52.1	-32.4	0	0	0	115.8	K560 V586 R591 W594	K560-D589 IonicContact NZ-OD1 2.67Å; K560-D589 PolarHBondContact NZ-OD1 2.96Å; K560-D589 IonicContact NZ-OD2 3.21Å; K560-D589 PolarHBondContact NZ-OD2 3.31Å; V586-D589 HydrophobicContact CG1-CB 4Å; D589-R591 PolarHBondContact O-N 3.14Å; D589-W594 VanDerWaalsContact CA-CD1 3.45Å; D589-W594 HydrophobicContact CB-CD2 3.81Å; D589-W594 HydrophobicContact CB-CE3 4.4Å; D589-W594 HydrophobicContact CB-CG 4.02Å; D589-W594 HydrophobicContact CB-CZ2 4.03Å; D589-W594 PolarHBondContact O-NE1 2.85Å
590	E	74.1	Confident	89.4	Confident	154 Å²	154	60.3 Å²	60.3	72%	0.72	28%	0.282	S	S	*	.	S	Bend	trans	-70.4	2.9	-175.7	-57.2	-176.5	-176.7	0	0	115.7	F588	F588-E590 HydrophobicContact CD1-CB 4.49Å; F588-E590 HydrophobicContact CE1-CB 3.77Å; F588-E590 HydrophobicContact CE1-CG 4.03Å; F588-E590 HydrophobicContact CE2-CG 3.9Å; F588-E590 HydrophobicContact CZ-CB 3.82Å; F588-E590 HydrophobicContact CZ-CG 3.61Å; F588-E590 WeakPolarHBondContact CZ-OE2 3.24Å
591	R	82.4	Confident	89.4	Confident	169 Å²	169	58.7 Å²	58.7	64%	0.638	28%	0.277	S	S	*	.	S	Bend	trans	-136.1	165	-170.8	-66.1	-179.1	179	174.4	-0.3	111.7	D589 W593 W594	D589-R591 PolarHBondContact O-N 3.14Å; R591-W593 WeakPolarHBondContact CB-O 3.42Å; R591-W593 PolarHBondContact O-N 3.09Å; R591-W594 PolarHBondContact O-NE1 3.08Å
592	N	86.8	Confident	89.7	Confident	119 Å²	119	65.6 Å²	65.6	64%	0.636	29%	0.292	S	S	*	.	S	Bend	trans	-59.7	-18.3	174	-74.6	-45.7	0	0	0	113.8	H608	N592-H608 PolarHBondContact O-N 2.93Å; N592-H608 VanDerWaalsContact O-N 3.13Å; N592-H608 PolarHBondContact O-ND1 3.18Å; N592-H608 PolarHBondContact OD1-CE1 3.26Å
593	W	90.9	Very high	89.8	Confident	98 Å²	98	68.2 Å²	68.2	37%	0.371	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.4	172.1	-67.4	71.8	0	0	0	107.9	R568 E575 R591 V606 P607	R568-W593 VanDerWaalsContact NH2-CH2 3.3Å; E575-W593 HydrophobicContact CG-CH2 4.15Å; E575-W593 HydrophobicContact CG-CZ3 3.63Å; E575-W593 WeakPolarHBondContact OE1-CH2 3.3Å; E575-W593 WeakPolarHBondContact OE2-CH2 3.25Å; E575-W593 WeakPolarHBondContact OE2-CZ3 3.45Å; R591-W593 WeakPolarHBondContact CB-O 3.42Å; R591-W593 PolarHBondContact O-N 3.09Å; W593-V606 CarbonylContact C-O 3.58Å; W593-V606 WeakPolarHBondContact CA-O 3.21Å; W593-P607 HydrophobicContact CD2-CG 4.12Å; W593-P607 HydrophobicContact CE3-CG 3.84Å; W593-P607 HydrophobicContact CH2-CG 4.14Å; W593-P607 HydrophobicContact CZ2-CG 4.34Å; W593-P607 HydrophobicContact CZ3-CG 3.85Å
594	W	93.8	Very high	89.8	Confident	37 Å²	37	67.6 Å²	67.6	14%	0.14	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	142.9	-179.8	-66.5	-4.3	0	0	0	110.1	V586 F588 D589 R591 C596 Y605 V606 H608 L611 M613	V586-W594 HydrophobicContact CG1-CB 4.41Å; V586-W594 HydrophobicContact CG1-CD2 4.3Å; V586-W594 HydrophobicContact CG1-CE3 3.85Å; V586-W594 HydrophobicContact CG1-CZ3 4.49Å; V586-W594 HydrophobicContact CG2-CE3 4.06Å; V586-W594 HydrophobicContact CG2-CZ3 4.4Å; F588-W594 CarbonylContact O-C 3.56Å; F588-W594 VanDerWaalsContact O-CA 3.23Å; F588-W594 WeakPolarHBondContact O-CA 3.21Å; F588-W594 WeakPolarHBondContact O-CB 3.26Å; D589-W594 VanDerWaalsContact CA-CD1 3.45Å; D589-W594 HydrophobicContact CB-CD2 3.81Å; D589-W594 HydrophobicContact CB-CE3 4.4Å; D589-W594 HydrophobicContact CB-CG 4.02Å; D589-W594 HydrophobicContact CB-CZ2 4.03Å; D589-W594 PolarHBondContact O-NE1 2.85Å; R591-W594 PolarHBondContact O-NE1 3.08Å; W594-C596 PolarHBondContact O-N 3.5Å; W594-Y605 CarbonylContact O-C 3.58Å; W594-Y605 VanDerWaalsContact O-CA 3.3Å; W594-Y605 WeakPolarHBondContact O-CA 3.42Å; W594-V606 PolarHBondContact N-O 2.89Å; W594-V606 PolarHBondContact O-N 3.22Å; W594-H608 HydrophobicContact CD2-CB 3.9Å; W594-H608 HydrophobicContact CG-CB 4.2Å; W594-H608 HydrophobicContact CZ2-CB 3.89Å; W594-L611 HydrophobicContact CB-CD1 4.28Å; W594-L611 HydrophobicContact CD2-CD1 4.21Å; W594-L611 HydrophobicContact CE3-CB 4.38Å; W594-L611 HydrophobicContact CE3-CD1 3.54Å; W594-L611 HydrophobicContact CZ3-CB 4.31Å; W594-L611 HydrophobicContact CZ3-CD1 4.27Å; W594-M613 HydrophobicContact CH2-CG 3.99Å; W594-M613 HydrophobicContact CH2-SD 4.18Å; W594-M613 HydrophobicContact CZ3-CG 4.04Å; W594-M613 HydrophobicContact CZ3-SD 3.74Å
595	E	93.8	Very high	89.8	Confident	55 Å²	55	71.2 Å²	71.2	26%	0.257	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	113.4	170.5	-157.4	162.1	141.6	0	0	108	I587 F588 V603 Y605	I587-E595 HydrophobicContact CB-CB 4.47Å; I587-E595 WeakPolarHBondContact CB-O 3.22Å; I587-E595 PolarHBondContact N-O 2.93Å; F588-E595 HydrophobicContact CB-CB 3.86Å; F588-E595 PolarHBondContact N-O 2.62Å; F588-E595 PolarHBondContact O-N 3.3Å; E595-V603 HydrophobicContact CG-CG1 3.68Å; E595-Y605 HydrophobicContact CB-CD1 4.09Å; E595-Y605 HydrophobicContact CB-CE1 3.7Å; E595-Y605 HydrophobicContact CG-CD1 4.3Å; E595-Y605 HydrophobicContact CG-CE1 3.79Å; E595-Y605 WeakPolarHBondContact OE2-CE1 3.4Å; E595-Y605 PolarHBondContact OE2-OH 2.9Å
596	C	95.4	Very high	89.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.2	-172.3	-65.4	0	0	0	0	111.1	L576 L584 E585 W594 V603 G604 V606	L576-C596 HydrophobicContact CD2-CB 4.45Å; L584-C596 HydrophobicContact CB-CB 4.31Å; L584-C596 HydrophobicContact CD1-CB 3.94Å; E585-C596 CarbonylContact O-C 3.54Å; E585-C596 VanDerWaalsContact O-CA 3.31Å; E585-C596 WeakPolarHBondContact O-CA 3.32Å; W594-C596 PolarHBondContact O-N 3.5Å; C596-V603 CarbonylContact O-C 3.6Å; C596-V603 WeakPolarHBondContact O-CA 3.43Å; C596-G604 PolarHBondContact N-O 3.15Å; C596-G604 PolarHBondContact O-N 2.73Å; C596-G604 VanDerWaalsContact O-O 3.12Å; C596-V606 HydrophobicContact CB-CB 4.46Å; C596-V606 HydrophobicContact CB-CG2 3.98Å
597	K	93.3	Very high	89.6	Confident	30 Å²	30	70.1 Å²	70.1	13%	0.13	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.1	-178.2	172.2	170	161.4	-108.5	0	110.9	L584 E585 I587 R602 V603	L584-K597 WeakPolarHBondContact CA-O 3.35Å; E585-K597 HydrophobicContact CB-CB 4.25Å; E585-K597 PolarHBondContact N-O 3.08Å; E585-K597 PolarHBondContact O-N 2.85Å; E585-K597 WeakPolarHBondContact OE2-CD 3.31Å; E585-K597 IonicContact OE2-NZ 3.82Å; E585-K597 PolarHBondContact OE2-NZ 3.18Å; I587-K597 HydrophobicContact CD1-CB 3.85Å; I587-K597 HydrophobicContact CD1-CD 4.14Å; I587-K597 HydrophobicContact CG1-CB 4.41Å; K597-R602 VanDerWaalsContact CA-O 3.28Å; K597-R602 WeakPolarHBondContact CA-O 3.29Å; K597-V603 HydrophobicContact CB-CG2 4.17Å; K597-V603 HydrophobicContact CD-CG2 3.94Å; K597-V603 HydrophobicContact CG-CG2 4.22Å
598	N	92.2	Very high	89.4	Confident	8 Å²	8	69.5 Å²	69.5	4%	0.043	31%	0.314	C	S	.	.			trans	-102.9	177.7	-177.1	75.1	-7.2	0	0	0	113.9	F550 L576 E582 L584 H600 Q601 R602	F550-N598 WeakPolarHBondContact CZ-O 3.5Å; L576-N598 HydrophobicContact CD2-CB 4.24Å; E582-N598 VanDerWaalsContact OE1-CB 3.3Å; E582-N598 WeakPolarHBondContact OE1-CB 3.09Å; E582-N598 PolarHBondContact OE1-ND2 3.19Å; E582-N598 VanDerWaalsContact OE1-ND2 3.12Å; L584-N598 HydrophobicContact CD2-CB 3.47Å; L584-N598 VanDerWaalsContact CD2-CB 3.47Å; N598-H600 PolarHBondContact O-N 2.76Å; N598-H600 WeakPolarHBondContact OD1-CB 3.34Å; N598-H600 PolarHBondContact OD1-N 2.91Å; N598-Q601 WeakPolarHBondContact O-CA 3.45Å; N598-Q601 PolarHBondContact O-N 3.12Å; N598-R602 PolarHBondContact N-O 2.82Å; N598-R602 PolarHBondContact OD1-N 3.1Å
599	M	86.9	Confident	89.5	Confident	46 Å²	46	71.1 Å²	71.1	23%	0.227	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.1	179.8	68.9	165.9	177.5	0	0	114.7	R546 Q547 F550 Q601	R546-M599 HydrophobicContact CG-SD 4.27Å; Q547-M599 HydrophobicContact CB-SD 4.3Å; F550-M599 HydrophobicContact CB-CB 4.02Å; F550-M599 HydrophobicContact CD1-CB 3.81Å; F550-M599 HydrophobicContact CD2-CB 4.23Å; F550-M599 HydrophobicContact CE1-CB 4.3Å; F550-M599 HydrophobicContact CG-CB 3.76Å; M599-Q601 VanDerWaalsContact C-N 3.28Å
600	H	84.9	Confident	89.5	Confident	93 Å²	93	69.5 Å²	69.5	43%	0.431	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	8.8	172.3	-58.1	102.2	0	0	0	113	N598 R602	N598-H600 PolarHBondContact O-N 2.76Å; N598-H600 WeakPolarHBondContact OD1-CB 3.34Å; N598-H600 PolarHBondContact OD1-N 2.91Å; H600-R602 HydrophobicContact CB-CG 4.28Å; H600-R602 PolarHBondContact O-N 2.92Å; H600-R602 VanDerWaalsContact O-N 3.12Å
601	Q	87.5	Confident	90.3	Very high	107 Å²	107	63 Å²	63	50%	0.5	29%	0.291	S	S	.	.			trans	58.8	14.5	-174.9	-51.9	-69.9	-40.7	0	0	114.1	N598 M599	N598-Q601 WeakPolarHBondContact O-CA 3.45Å; N598-Q601 PolarHBondContact O-N 3.12Å; M599-Q601 VanDerWaalsContact C-N 3.28Å
602	R	88.6	Confident	90.6	Very high	178 Å²	178	57.8 Å²	57.8	67%	0.672	28%	0.28	S	S	*	.			trans	-80.3	133.6	175.6	-64.1	-176.7	179.9	178.6	0.1	109.5	L576 K597 N598 H600	L576-R602 HydrophobicContact CD1-CB 3.94Å; K597-R602 VanDerWaalsContact CA-O 3.28Å; K597-R602 WeakPolarHBondContact CA-O 3.29Å; N598-R602 PolarHBondContact N-O 2.82Å; N598-R602 PolarHBondContact OD1-N 3.1Å; H600-R602 HydrophobicContact CB-CG 4.28Å; H600-R602 PolarHBondContact O-N 2.92Å; H600-R602 VanDerWaalsContact O-N 3.12Å
603	V	92.6	Very high	90.7	Very high	75 Å²	75	55.8 Å²	55.8	46%	0.455	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	140	175.5	-176.6	0	0	0	0	109.4	I587 E595 C596 K597	I587-V603 HydrophobicContact CD1-CG1 4.03Å; I587-V603 HydrophobicContact CD1-CG2 4.04Å; E595-V603 HydrophobicContact CG-CG1 3.68Å; C596-V603 CarbonylContact O-C 3.6Å; C596-V603 WeakPolarHBondContact O-CA 3.43Å; K597-V603 HydrophobicContact CB-CG2 4.17Å; K597-V603 HydrophobicContact CD-CG2 3.94Å; K597-V603 HydrophobicContact CG-CG2 4.22Å
604	G	92.1	Very high	90.4	Very high	6 Å²	6	52 Å²	52	6%	0.062	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	169.1	172.1	0	0	0	0	0	112.7	K574 C596	K574-G604 WeakPolarHBondContact O-CA 3.43Å; C596-G604 PolarHBondContact N-O 3.15Å; C596-G604 PolarHBondContact O-N 2.73Å; C596-G604 VanDerWaalsContact O-O 3.12Å
605	Y	93.9	Very high	89.4	Confident	76 Å²	76	55.4 Å²	55.4	30%	0.298	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	135.9	-178.3	-65.1	-66.2	0	0	0	112.5	K574 E575 L576 W594 E595	K574-Y605 HydrophobicContact CB-CD2 4.09Å; K574-Y605 HydrophobicContact CB-CE2 4.46Å; K574-Y605 WeakPolarHBondContact O-CD2 3.47Å; K574-Y605 PolarHBondContact O-N 2.79Å; E575-Y605 WeakPolarHBondContact CA-O 3.43Å; L576-Y605 PolarHBondContact N-O 2.97Å; L576-Y605 VanDerWaalsContact N-O 3.15Å; W594-Y605 CarbonylContact O-C 3.58Å; W594-Y605 VanDerWaalsContact O-CA 3.3Å; W594-Y605 WeakPolarHBondContact O-CA 3.42Å; E595-Y605 HydrophobicContact CB-CD1 4.09Å; E595-Y605 HydrophobicContact CB-CE1 3.7Å; E595-Y605 HydrophobicContact CG-CD1 4.3Å; E595-Y605 HydrophobicContact CG-CE1 3.79Å; E595-Y605 WeakPolarHBondContact OE2-CE1 3.4Å; E595-Y605 PolarHBondContact OE2-OH 2.9Å
606	V	92.4	Very high	87.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.8	177.3	-175.4	0	0	0	0	109.3	L576 V578 L584 W593 W594 C596 H608 I610 L611	L576-V606 HydrophobicContact CB-CG2 3.75Å; L576-V606 HydrophobicContact CD2-CG2 4.22Å; V578-V606 HydrophobicContact CG1-CG2 3.93Å; V578-V606 HydrophobicContact CG2-CG1 4.24Å; L584-V606 HydrophobicContact CD1-CG2 4.27Å; W593-V606 CarbonylContact C-O 3.58Å; W593-V606 WeakPolarHBondContact CA-O 3.21Å; W594-V606 PolarHBondContact N-O 2.89Å; W594-V606 PolarHBondContact O-N 3.22Å; C596-V606 HydrophobicContact CB-CB 4.46Å; C596-V606 HydrophobicContact CB-CG2 3.98Å; V606-H608 PolarHBondContact O-N 3.14Å; V606-I610 HydrophobicContact CG1-CD1 3.86Å; V606-I610 HydrophobicContact CG1-CG1 3.86Å; V606-L611 HydrophobicContact CB-CD1 4.21Å; V606-L611 HydrophobicContact CG1-CD1 4.06Å; V606-L611 HydrophobicContact CG1-CD2 3.93Å; V606-L611 HydrophobicContact CG1-CG 4Å
607	P	91.2	Very high	85.5	Confident	15 Å²	15	63.4 Å²	63.4	10%	0.097	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	130.9	176.7	-21.6	33.1	0	0	0	112	W593 T609 I610	W593-P607 HydrophobicContact CD2-CG 4.12Å; W593-P607 HydrophobicContact CE3-CG 3.84Å; W593-P607 HydrophobicContact CH2-CG 4.14Å; W593-P607 HydrophobicContact CZ2-CG 4.34Å; W593-P607 HydrophobicContact CZ3-CG 3.85Å; P607-T609 PolarHBondContact O-N 2.78Å; P607-I610 VanDerWaalsContact O-CG1 3.3Å; P607-I610 WeakPolarHBondContact O-CG1 3.39Å; P607-I610 PolarHBondContact O-N 2.82Å; P607-I610 VanDerWaalsContact O-N 3.1Å
608	H	88.1	Confident	83	Confident	72 Å²	72	70 Å²	70	33%	0.333	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-57.6	-26.1	179.1	75.8	-76.3	0	0	0	113.2	N592 W594 V606 I610 L611	N592-H608 PolarHBondContact O-N 2.93Å; N592-H608 VanDerWaalsContact O-N 3.13Å; N592-H608 PolarHBondContact O-ND1 3.18Å; N592-H608 PolarHBondContact OD1-CE1 3.26Å; W594-H608 HydrophobicContact CD2-CB 3.9Å; W594-H608 HydrophobicContact CG-CB 4.2Å; W594-H608 HydrophobicContact CZ2-CB 3.89Å; V606-H608 PolarHBondContact O-N 3.14Å; H608-I610 PolarHBondContact O-N 2.74Å; H608-L611 PolarHBondContact O-N 2.87Å; H608-L611 VanDerWaalsContact O-N 3.13Å
609	T	89.9	Confident	80.1	Confident	101 Å²	101	77.3 Å²	77.3	62%	0.62	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-67.8	-12.7	180	58.7	0	0	0	0	114.5	P607	P607-T609 PolarHBondContact O-N 2.78Å
610	I	89.4	Confident	77.3	Confident	20 Å²	20	84.1 Å²	84.1	10%	0.103	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-111.7	15.6	174.2	67.2	162.4	0	0	0	112.7	V564 T565 Y566 R568 V578 V606 P607 H608	V564-I610 WeakPolarHBondContact CA-O 3.46Å; T565-I610 PolarHBondContact N-O 2.77Å; T565-I610 VanDerWaalsContact OG1-C 3.25Å; T565-I610 WeakPolarHBondContact OG1-CA 3.37Å; T565-I610 PolarHBondContact OG1-O 2.99Å; Y566-I610 HydrophobicContact CD2-CB 4.34Å; Y566-I610 HydrophobicContact CD2-CG2 4.02Å; R568-I610 HydrophobicContact CB-CD1 3.63Å; R568-I610 HydrophobicContact CG-CD1 4.28Å; V578-I610 HydrophobicContact CG2-CD1 3.94Å; V606-I610 HydrophobicContact CG1-CD1 3.86Å; V606-I610 HydrophobicContact CG1-CG1 3.86Å; P607-I610 VanDerWaalsContact O-CG1 3.3Å; P607-I610 WeakPolarHBondContact O-CG1 3.39Å; P607-I610 PolarHBondContact O-N 2.82Å; P607-I610 VanDerWaalsContact O-N 3.1Å; H608-I610 PolarHBondContact O-N 2.74Å
611	L	90.4	Very high	74.7	Confident	18 Å²	18	90.6 Å²	90.6	9%	0.094	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.3	178.3	-62.8	178.2	0	0	0	110.2	A562 V564 L584 W594 V606 H608	A562-L611 HydrophobicContact CB-CB 4.35Å; A562-L611 HydrophobicContact CB-CD2 4.48Å; V564-L611 HydrophobicContact CG2-CD2 3.82Å; L584-L611 HydrophobicContact CD1-CD2 3.89Å; W594-L611 HydrophobicContact CB-CD1 4.28Å; W594-L611 HydrophobicContact CD2-CD1 4.21Å; W594-L611 HydrophobicContact CE3-CB 4.38Å; W594-L611 HydrophobicContact CE3-CD1 3.54Å; W594-L611 HydrophobicContact CZ3-CB 4.31Å; W594-L611 HydrophobicContact CZ3-CD1 4.27Å; V606-L611 HydrophobicContact CB-CD1 4.21Å; V606-L611 HydrophobicContact CG1-CD1 4.06Å; V606-L611 HydrophobicContact CG1-CD2 3.93Å; V606-L611 HydrophobicContact CG1-CG 4Å; H608-L611 PolarHBondContact O-N 2.87Å; H608-L611 VanDerWaalsContact O-N 3.13Å
612	S	89.1	Confident	71.8	Confident	59 Å²	59	90.1 Å²	90.1	41%	0.413	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.6	169.3	-172.4	0	0	0	0	108.9	A562 V563	A562-S612 CarbonylContact C-O 3.43Å; A562-S612 VanDerWaalsContact CA-O 3.31Å; A562-S612 WeakPolarHBondContact CA-O 3.46Å; V563-S612 PolarHBondContact N-O 2.91Å; V563-S612 PolarHBondContact O-N 3.43Å
613	M	87.8	Confident	68.8	Low	78 Å²	78	86.9 Å²	86.9	38%	0.384	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	135.3	177	-77.1	-59.8	-66.3	0	0	110.6	K560 A562 V586 W594 P615	K560-M613 HydrophobicContact CB-CE 3.99Å; K560-M613 HydrophobicContact CG-CE 4.35Å; A562-M613 HydrophobicContact CB-SD 4.11Å; V586-M613 HydrophobicContact CG2-SD 4.27Å; W594-M613 HydrophobicContact CH2-CG 3.99Å; W594-M613 HydrophobicContact CH2-SD 4.18Å; W594-M613 HydrophobicContact CZ3-CG 4.04Å; W594-M613 HydrophobicContact CZ3-SD 3.74Å; M613-P615 WeakPolarHBondContact O-CD 3.47Å
614	V	85.1	Confident	66.1	Low	19 Å²	19	88.4 Å²	88.4	12%	0.115	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-90.8	119.3	177.2	-174	0	0	0	0	108.9	V537 L561 V563 Y583	V537-V614 HydrophobicContact CG1-CG1 3.58Å; L561-V614 HydrophobicContact CB-CB 4.24Å; L561-V614 HydrophobicContact CB-CG2 4.47Å; L561-V614 HydrophobicContact CD2-CB 4Å; L561-V614 HydrophobicContact CD2-CG1 4.09Å; L561-V614 HydrophobicContact CD2-CG2 4.02Å; L561-V614 HydrophobicContact CG-CB 4.14Å; L561-V614 HydrophobicContact CG-CG2 3.95Å; L561-V614 PolarHBondContact O-N 2.78Å; V563-V614 HydrophobicContact CB-CG2 4.46Å; Y583-V614 HydrophobicContact CD1-CG2 4.23Å; Y583-V614 HydrophobicContact CE1-CG2 3.89Å
615	P	72.6	Confident	63.1	Low	108 Å²	108	94.8 Å²	94.8	70%	0.701	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-70.3	141.7	178.8	-18.8	32.8	0	0	0	112.5	M613	M613-P615 WeakPolarHBondContact O-CD 3.47Å
616	F	61.6	Low	60	Low	76 Å²	76	99.7 Å²	99.7	33%	0.333	53%	0.526	S	S	.	.			trans	-102.4	104.8	169.9	-58.9	-61.1	0	0	0	110.3	V537 V555 G559 L561 Q618	V537-F616 HydrophobicContact CG2-CD1 4.25Å; V537-F616 HydrophobicContact CG2-CE1 4.25Å; V555-F616 HydrophobicContact CG2-CE1 3.95Å; G559-F616 WeakPolarHBondContact O-CE2 3.48Å; G559-F616 VanDerWaalsContact O-CZ 3.26Å; G559-F616 WeakPolarHBondContact O-CZ 3.45Å; L561-F616 HydrophobicContact CB-CE1 4.29Å; L561-F616 HydrophobicContact CB-CZ 3.77Å; F616-Q618 PolarHBondContact O-N 3.49Å
617	E	47.1	Very low	56.9	Low	147 Å²	147	107.1 Å²	107.1	69%	0.687	56%	0.561	S	S	*	*			trans	-75.6	103.8	170.9	-73.6	-161.1	159	0	0	111.2	Q619	E617-Q619 PolarHBondContact O-N 3.41Å
618	Q	38.9	Very low	53.8	Low	167 Å²	167	112.9 Å²	112.9	78%	0.78	59%	0.59	S	S	*	*			trans	-82.9	92.4	169.1	-68.8	-177.1	-9.2	0	0	110	F616 Q620	F616-Q618 PolarHBondContact O-N 3.49Å; Q618-Q620 PolarHBondContact O-N 2.87Å; Q618-Q620 VanDerWaalsContact O-N 3.08Å
619	Q	32.6	Very low	50.9	Low	162 Å²	162	115.8 Å²	115.8	76%	0.757	61%	0.608	S	S	*	*			trans	-66.2	107.2	175	-67.3	-173.6	-3.9	0	0	110.7	E617	E617-Q619 PolarHBondContact O-N 3.41Å
620	Q	28.6	Very low	47.8	Very low	189 Å²	189	116 Å²	116	88%	0.883	61%	0.614	S	S	*	*			trans	-73.2	127.7	172.2	-66.2	-175.2	-2.2	0	0	110	Q618 A622	Q618-Q620 PolarHBondContact O-N 2.87Å; Q618-Q620 VanDerWaalsContact O-N 3.08Å; Q620-A622 PolarHBondContact O-N 3.2Å
621	Y	29.3	Very low	45	Very low	229 Å²	229	119.5 Å²	119.5	90%	0.898	64%	0.64	S	S	*	*			trans	-71.7	121.6	-178.8	-70.7	-82.6	0	0	0	112.3
622	A	27	Very low	42	Very low	98 Å²	98	124.3 Å²	124.3	81%	0.81	68%	0.676	S	S	*	*			trans	-128.4	127.4	161.1	0	0	0	0	0	109.4	Q620	Q620-A622 PolarHBondContact O-N 3.2Å
623	S	24.4	Very low	39.1	Very low	110 Å²	110	128.5 Å²	128.5	77%	0.769	70%	0.699	S	S	*	*			trans	-149.9	157.2	-174.3	-77.3	0	0	0	0	109.6
624	P	37.7	Very low	36.1	Very low	106 Å²	106	128.6 Å²	128.6	69%	0.688	72%	0.72	S	S	*	*			cis	-130.8	178.4	-4.4	39	-22.5	0	0	0	114.9
625	N	27.4	Very low	33.3	Very low	141 Å²	141	130.3 Å²	130.3	75%	0.754	74%	0.741	S	S	*	*			trans	59.4	111.3	156.8	-64.3	-10.1	0	0	0	120.2
626	H	30.2	Very low	31.1	Very low	179 Å²	179	135.7 Å²	135.7	83%	0.829	75%	0.749	S	S	*	*				-161.1	162.1	101.6	-108.4	74.4	0	0	0	115.2
627	H	27.3	Very low	29.5	Very low	156 Å²	156	138.1 Å²	138.1	72%	0.722	77%	0.766	S	S	*	*			trans	-63.6	153.5	-165.5	-79.9	85.4	0	0	0	119.1
628	N	26.2	Very low	28.7	Very low	135 Å²	135	138.4 Å²	138.4	72%	0.722	77%	0.772	S	S	*	*			trans	44.1	114.9	141.3	-70.4	-7.1	0	0	0	121.7
629	N	26.3	Very low	28.3	Very low	133 Å²	133	133.7 Å²	133.7	71%	0.711	77%	0.768	S	S	*	*				29.4	115.4	103.7	-176.3	27.3	0	0	0	117.8	S631	N629-S631 PolarHBondContact OD1-N 3.35Å
630	S	25.5	Very low	28.3	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	77%	0.768	S	S	*	*			trans	-123	71.9	171.3	47.7	0	0	0	0	112.6	S632	S630-S632 PolarHBondContact O-N 3.36Å
631	S	29.7	Very low	28.4	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	76%	0.761	S	S	*	*			trans	-73.5	96.2	164.9	58	0	0	0	0	110.8	N629 T633	N629-S631 PolarHBondContact OD1-N 3.35Å; S631-T633 PolarHBondContact O-N 2.72Å
632	S	27.2	Very low	28.3	Very low	120 Å²	120	130.5 Å²	130.5	84%	0.839	76%	0.761	S	S	*	*			trans	-91.2	100.6	-179.1	-65.5	0	0	0	0	112.5	S630	S630-S632 PolarHBondContact O-N 3.36Å
633	T	28.2	Very low	28.1	Very low	146 Å²	146	129.5 Å²	129.5	90%	0.896	76%	0.761	S	S	*	*			trans	-84	155.9	176.6	26.3	0	0	0	0	114	S631	S631-T633 PolarHBondContact O-N 2.72Å
634	G	24.8	Very low	29.3	Very low	81 Å²	81	130.3 Å²	130.3	84%	0.835	76%	0.763	S	S	*	*			trans	-153.7	134.2	150.8	0	0	0	0	0	108.9
635	G	25.7	Very low	28.8	Very low	54 Å²	54	129.7 Å²	129.7	56%	0.557	77%	0.767	S	S	*	*			cis	178.6	175	-6.5	0	0	0	0	0	111.2
636	Y	26.5	Very low	28.9	Very low	222 Å²	222	131 Å²	131	87%	0.871	77%	0.768	S	S	*	*			trans	70.7	146.6	172.8	-43.8	-74.8	0	0	0	115.1
637	N	28.6	Very low	29	Very low	127 Å²	127	128.2 Å²	128.2	68%	0.679	76%	0.76	S	S	*	*			cis	-156.9	146.6	7	-131.5	-1.4	0	0	0	113.8
638	N	31	Very low	29.1	Very low	152 Å²	152	127.9 Å²	127.9	81%	0.813	77%	0.768	S	S	*	*			trans	51	155.7	153.9	-68.9	-12.5	0	0	0	123.9
639	G	30.1	Very low	29.2	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	77%	0.774	S	S	*	*			trans	-169.6	-83.3	177	0	0	0	0	0	120
640	H	31.6	Very low	29.7	Very low	163 Å²	163	135.1 Å²	135.1	76%	0.755	78%	0.777	S	S	*	*			trans	71	124.8	178.8	-73.4	49.2	0	0	0	121.4
641	H	31.8	Very low	30.5	Very low	158 Å²	158	135.8 Å²	135.8	73%	0.731	78%	0.779	S	S	*	*			trans	73.8	105.9	140.5	-57.3	-28.3	0	0	0	126.5
642	Q	26.3	Very low	32	Very low	191 Å²	191	135.5 Å²	135.5	89%	0.893	78%	0.775	S	S	*	*				34.2	114.9	128.1	-63.4	-178.4	-9.4	0	0	125.9
643	G	22.8	Very low	33.3	Very low	78 Å²	78	135.6 Å²	135.6	80%	0.804	77%	0.772	S	S	*	*			trans	74.6	178.6	130.3	0	0	0	0	0	121.3
644	P	50	Low	34.3	Very low	127 Å²	127	133.7 Å²	133.7	83%	0.825	76%	0.763	S	S	*	*			cis	-140.7	-169.2	-25.2	42.1	-24.2	0	0	0	115.3
645	A	27.1	Very low	35.6	Very low	92 Å²	92	134.9 Å²	134.9	76%	0.76	76%	0.755	S	S	*	*			trans	72.9	155	158	0	0	0	0	0	120.8
646	Q	28.8	Very low	35.9	Very low	169 Å²	169	140 Å²	140	79%	0.79	77%	0.769	S	S	*	*			cis	-153.5	130.1	-10.4	-98.2	-137.1	10.9	0	0	113.6
647	N	33.8	Very low	36	Very low	121 Å²	121	135.2 Å²	135.2	65%	0.647	76%	0.763	S	S	*	*				47.3	118.7	116.4	-159.1	29.5	0	0	0	124.6
648	V	27.9	Very low	36.2	Very low	149 Å²	149	134.9 Å²	134.9	90%	0.903	77%	0.771	S	S	*	*			trans	-149.1	160.5	152.6	-179.7	0	0	0	0	111.2
649	Y	30.2	Very low	36.4	Very low	213 Å²	213	135.4 Å²	135.4	84%	0.835	77%	0.773	S	S	*	*			trans	-95.8	171.7	-160.8	-109.8	-115.9	0	0	0	119.3
650	R	35.8	Very low	36.4	Very low	207 Å²	207	136.8 Å²	136.8	78%	0.781	78%	0.778	S	S	*	*			trans	-94.6	173.1	160.6	-120.1	-163.2	-172.7	-151.6	4.7	110.3
651	P	43.2	Very low	36.2	Very low	121 Å²	121	132.8 Å²	132.8	79%	0.786	78%	0.781	S	S	*	*			cis	-139.5	175.4	36.1	30.8	-5.2	0	0	0	118
652	P	60.4	Low	36.4	Very low	86 Å²	86	131.9 Å²	131.9	56%	0.558	79%	0.786	S	S	*	*			trans	-97.6	-171.2	179.7	46.4	-40.6	0	0	0	111.8
653	P	53.6	Low	36.4	Very low	122 Å²	122	132 Å²	132	79%	0.792	79%	0.787	S	S	*	*			cis	-137	-100	44.3	25.9	4.5	0	0	0	122
654	P	49.4	Very low	37.1	Very low	106 Å²	106	134.1 Å²	134.1	69%	0.688	78%	0.784	S	S	*	*			trans	-136	-159.7	-133	46.6	-26.7	0	0	0	116.5
655	P	53.6	Low	36.1	Very low	105 Å²	105	135.8 Å²	135.8	68%	0.682	78%	0.781	S	S	*	*			cis	-128.1	-178.1	-31.8	24.3	-1.2	0	0	0	114
656	L	30.7	Very low	36.4	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	78%	0.775	S	S	*	*				157.6	169.9	124.3	-83.7	174	0	0	0	117.2
657	V	29.9	Very low	36.5	Very low	122 Å²	122	141.1 Å²	141.1	74%	0.739	78%	0.782	S	S	*	*			trans	-72.5	159.4	-164.5	-69.4	0	0	0	0	118.7
658	S	31.5	Very low	36.5	Very low	121 Å²	121	146 Å²	146	85%	0.846	79%	0.791	S	S	*	*				167.9	161.3	110.7	-84.3	0	0	0	0	114.7
659	D	36.1	Very low	36.9	Very low	162 Å²	162	147.8 Å²	147.8	87%	0.866	79%	0.79	S	S	*	*			trans	-113.8	141.2	177.1	174.5	31.3	0	0	0	111
660	A	29.5	Very low	37.2	Very low	99 Å²	99	146.6 Å²	146.6	82%	0.818	79%	0.791	S	S	*	*			trans	167.2	145.2	160.4	0	0	0	0	0	111.7
661	G	28.6	Very low	37.4	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	79%	0.794	S	S	*	*			trans	141.9	78.3	156.6	0	0	0	0	0	117.4
662	V	34.3	Very low	37.2	Very low	140 Å²	140	141.6 Å²	141.6	85%	0.848	79%	0.79	S	S	*	*			trans	-89.2	119.9	161.8	173.9	0	0	0	0	109.2
663	Q	27.2	Very low	36.9	Very low	193 Å²	193	143 Å²	143	90%	0.902	80%	0.799	S	S	*	*			trans	-153.2	142.4	151.6	-126.1	158.1	69.6	0	0	115
664	V	36.8	Very low	37	Very low	123 Å²	123	142.8 Å²	142.8	75%	0.745	80%	0.798	S	S	*	*			trans	-51.8	140.3	179.6	-179	0	0	0	0	113.2
665	E	30.4	Very low	37.2	Very low	162 Å²	162	143.3 Å²	143.3	76%	0.757	80%	0.801	S	S	*	*			trans	-149	143.4	145.2	-159.7	55.5	-88.9	0	0	112.8
666	I	33.2	Very low	37.2	Very low	126 Å²	126	143.6 Å²	143.6	65%	0.646	80%	0.803	S	S	*	*			trans	-47.7	124.5	-168.9	-64.8	156	0	0	0	115.9	R668	I666-R668 HydrophobicContact CG2-CG 4.14Å; I666-R668 PolarHBondContact O-N 2.91Å
667	R	31.2	Very low	37.9	Very low	247 Å²	247	141.8 Å²	141.8	93%	0.932	80%	0.801	S	S	*	*			trans	-76.1	106	164	-178.9	177.3	179.1	168.1	-0.9	110.5
668	R	33.6	Very low	38.8	Very low	223 Å²	223	142 Å²	142	84%	0.842	80%	0.802	S	S	*	*			trans	-107.3	150.9	160.7	-88	-176.3	173.4	178.4	-0.9	110.9	I666	I666-R668 HydrophobicContact CG2-CG 4.14Å; I666-R668 PolarHBondContact O-N 2.91Å
669	E	35.6	Very low	39.8	Very low	186 Å²	186	142.9 Å²	142.9	87%	0.869	80%	0.802	S	S	*	*			trans	-73.3	148	-169.1	-59.6	172.7	126.2	0	0	112.6
670	H	36.9	Very low	40.6	Very low	189 Å²	189	142 Å²	142	88%	0.875	80%	0.796	S	S	*	*			trans	-120.4	120.4	162.3	-96.2	74.7	0	0	0	108.5
671	V	40.3	Very low	41.8	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.8	131.4	171.9	176.4	0	0	0	0	108.4
672	A	38.8	Very low	43.2	Very low	84 Å²	84	144 Å²	144	69%	0.694	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.4	145.6	175.2	0	0	0	0	0	111.4
673	P	54.7	Low	44.2	Very low	117 Å²	117	142.8 Å²	142.8	76%	0.76	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-69.8	157.3	178	30.2	-35.7	0	0	0	112.3
674	P	55.2	Low	45.6	Very low	117 Å²	117	139 Å²	139	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69.5	152.4	-179.8	29.6	-35.9	0	0	0	112.8
675	P	53.1	Low	46.4	Very low	116 Å²	116	138.5 Å²	138.5	75%	0.753	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-70.3	157.7	176.8	30.2	-35.6	0	0	0	112.7
676	P	54.3	Low	47.2	Very low	111 Å²	111	136.6 Å²	136.6	72%	0.721	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.2	158.4	179	29.9	-36.2	0	0	0	112.8	V678	P676-V678 PolarHBondContact O-N 3.43Å
677	P	44.3	Very low	48.1	Very low	124 Å²	124	137.2 Å²	137.2	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-67.7	127.9	-179	27.9	-34.8	0	0	0	112	V679	P677-V679 PolarHBondContact O-N 3.03Å
678	V	49.4	Very low	48.8	Very low	127 Å²	127	136.3 Å²	136.3	77%	0.77	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.9	121.4	173.9	178.6	0	0	0	0	109.7	P676 I680	P676-V678 PolarHBondContact O-N 3.43Å; V678-I680 PolarHBondContact O-N 3.07Å
679	V	52.7	Low	49.8	Very low	138 Å²	138	131.5 Å²	131.5	84%	0.836	78%	0.776	S	S	*	*			trans	-74.1	106.9	169.7	179.1	0	0	0	0	108.4	P677 P681	P677-V679 PolarHBondContact O-N 3.03Å; V679-P681 WeakPolarHBondContact O-CD 3.35Å
680	I	52.9	Low	50.4	Low	143 Å²	143	125.7 Å²	125.7	73%	0.733	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-73.3	121.6	179.3	-58.2	172.5	0	0	0	108.9	V678	V678-I680 PolarHBondContact O-N 3.07Å
681	P	55	Low	51.8	Low	103 Å²	103	120.4 Å²	120.4	67%	0.669	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-67.2	145.5	171.1	29.2	-33.9	0	0	0	110.2	V679	V679-P681 WeakPolarHBondContact O-CD 3.35Å
682	P	57.4	Low	52.2	Low	118 Å²	118	121.4 Å²	121.4	77%	0.766	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-61.6	145.4	-177.8	26.4	-34.8	0	0	0	111.4
683	P	56.2	Low	52.9	Low	114 Å²	114	124.1 Å²	124.1	74%	0.74	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-64.1	146.8	-177.6	27.3	-35.1	0	0	0	111.4
684	P	55.4	Low	53.1	Low	114 Å²	114	123 Å²	123	74%	0.74	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-61.5	146.9	172.8	27.6	-34.5	0	0	0	110.4
685	P	54	Low	53.3	Low	111 Å²	111	121.4 Å²	121.4	72%	0.721	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-61.7	146.9	177.5	27.2	-34.8	0	0	0	110.6	V687	P685-V687 PolarHBondContact O-N 2.84Å
686	P	47	Very low	53.6	Low	123 Å²	123	121 Å²	121	80%	0.799	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-62.1	122.6	-176	25	-34.1	0	0	0	110.8	R688	P686-R688 PolarHBondContact O-N 3.43Å; P686-R688 VanDerWaalsContact O-N 3.09Å
687	V	52.5	Low	54.2	Low	139 Å²	139	124.1 Å²	124.1	84%	0.842	69%	0.689	S	S	*	*			trans	-60.9	114.2	170.7	179.7	0	0	0	0	107.7	P685 T689	P685-V687 PolarHBondContact O-N 2.84Å; V687-T689 PolarHBondContact O-N 2.73Å; V687-T689 VanDerWaalsContact O-N 3.11Å
688	R	46.1	Very low	55.1	Low	228 Å²	228	123.4 Å²	123.4	86%	0.86	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-60.8	116.3	176.9	-77.4	-175.4	170.3	-165.3	-2.3	109.5	P686	P686-R688 PolarHBondContact O-N 3.43Å; P686-R688 VanDerWaalsContact O-N 3.09Å
689	T	53.1	Low	55.6	Low	122 Å²	122	123.5 Å²	123.5	75%	0.748	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-62.2	130.2	161.2	45.4	0	0	0	0	108.3	V687 T691	V687-T689 PolarHBondContact O-N 2.73Å; V687-T689 VanDerWaalsContact O-N 3.11Å; T689-T691 PolarHBondContact O-N 2.99Å
690	P	49.1	Very low	55.7	Low	63 Å²	63	122.6 Å²	122.6	41%	0.409	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-63.8	134	177.6	26.7	-33.9	0	0	0	109.4	E694 L695	P690-E694 HydrophobicContact CB-CB 4.07Å; P690-L695 HydrophobicContact CB-CG 4.22Å; P690-L695 HydrophobicContact CG-CD1 4.48Å; P690-L695 HydrophobicContact CG-CD2 3.95Å; P690-L695 HydrophobicContact CG-CG 4.02Å
691	T	67.1	Low	55.4	Low	78 Å²	78	122.5 Å²	122.5	48%	0.479	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-66.9	164	178.3	60	0	0	0	0	111.3	T689 E693 E694 L695	T689-T691 PolarHBondContact O-N 2.99Å; T691-E693 PolarHBondContact O-N 2.97Å; T691-E694 WeakPolarHBondContact CB-OE2 3.5Å; T691-E694 WeakPolarHBondContact CG2-OE2 3.43Å; T691-E694 PolarHBondContact N-OE2 3.41Å; T691-E694 PolarHBondContact O-N 3.39Å; T691-E694 WeakPolarHBondContact OG1-CG 3.44Å; T691-E694 PolarHBondContact OG1-OE2 3.44Å; T691-L695 PolarHBondContact O-N 3.35Å
692	M	48.5	Very low	55.2	Low	159 Å²	159	124.7 Å²	124.7	78%	0.783	65%	0.652	S	S	*	*	H	α-helix	trans	-57.4	-33.6	-178.8	-160.2	69.6	73	0	0	112.4	L696	M692-L696 WeakPolarHBondContact O-CB 3.38Å; M692-L696 PolarHBondContact O-N 3.06Å
693	E	53.9	Low	54.7	Low	142 Å²	142	125.9 Å²	125.9	66%	0.664	65%	0.648	S	S	*	*	H	α-helix	trans	-72.8	-34.7	174.3	-73.1	-172.4	92.5	0	0	113.4	T691 L696 R697	T691-E693 PolarHBondContact O-N 2.97Å; E693-L696 PolarHBondContact O-N 3.07Å; E693-R697 WeakPolarHBondContact O-CB 3.29Å; E693-R697 VanDerWaalsContact O-CG 3.31Å; E693-R697 WeakPolarHBondContact O-CG 3.38Å; E693-R697 PolarHBondContact O-N 2.97Å
694	E	58.2	Low	53.9	Low	92 Å²	92	126.5 Å²	126.5	43%	0.43	64%	0.641	S	S	.	*	H	α-helix	trans	-69.1	-41.1	175.4	-71.4	166.2	121.2	0	0	111.1	P690 T691 R697 M698	P690-E694 HydrophobicContact CB-CB 4.07Å; T691-E694 WeakPolarHBondContact CB-OE2 3.5Å; T691-E694 WeakPolarHBondContact CG2-OE2 3.43Å; T691-E694 PolarHBondContact N-OE2 3.41Å; T691-E694 PolarHBondContact O-N 3.39Å; T691-E694 WeakPolarHBondContact OG1-CG 3.44Å; T691-E694 PolarHBondContact OG1-OE2 3.44Å; E694-R697 PolarHBondContact O-N 2.99Å; E694-M698 WeakPolarHBondContact O-CG 3.32Å; E694-M698 PolarHBondContact O-N 2.73Å
695	L	59.9	Low	53.2	Low	85 Å²	85	130.5 Å²	130.5	45%	0.445	65%	0.647	S	S	.	*	H	α-helix	trans	-61.2	-42.5	171.5	-75.4	167.1	0	0	0	111.9	P690 T691 M698 Q699	P690-L695 HydrophobicContact CB-CG 4.22Å; P690-L695 HydrophobicContact CG-CD1 4.48Å; P690-L695 HydrophobicContact CG-CD2 3.95Å; P690-L695 HydrophobicContact CG-CG 4.02Å; T691-L695 PolarHBondContact O-N 3.35Å; L695-M698 PolarHBondContact O-N 3.16Å; L695-Q699 PolarHBondContact O-N 3.33Å
696	L	59.2	Low	52.4	Low	106 Å²	106	133.8 Å²	133.8	56%	0.555	65%	0.652	S	S	*	*	H	α-helix	trans	-65.6	-39	176.9	-152.8	71.8	0	0	0	111.7	M692 E693 Q700	M692-L696 WeakPolarHBondContact O-CB 3.38Å; M692-L696 PolarHBondContact O-N 3.06Å; E693-L696 PolarHBondContact O-N 3.07Å; L696-Q700 WeakPolarHBondContact O-CB 3.24Å; L696-Q700 PolarHBondContact O-N 3.34Å
697	R	65.6	Low	51.8	Low	178 Å²	178	138.1 Å²	138.1	67%	0.672	65%	0.653	S	S	*	*	H	α-helix	trans	-64.2	-44.3	172.7	-76.8	177	178.7	-161.6	1	112.2	E693 E694 Q699 Q700 Q701	E693-R697 WeakPolarHBondContact O-CB 3.29Å; E693-R697 VanDerWaalsContact O-CG 3.31Å; E693-R697 WeakPolarHBondContact O-CG 3.38Å; E693-R697 PolarHBondContact O-N 2.97Å; E694-R697 PolarHBondContact O-N 2.99Å; R697-Q699 PolarHBondContact O-N 2.78Å; R697-Q700 PolarHBondContact O-N 3.04Å; R697-Q701 WeakPolarHBondContact O-CB 3.34Å; R697-Q701 PolarHBondContact O-N 3.15Å
698	M	63.7	Low	51	Low	108 Å²	108	140.8 Å²	140.8	53%	0.532	65%	0.653	S	S	.	*	H	α-helix	trans	-61	-43.6	176.4	-75.1	176.6	66.5	0	0	112.1	E694 L695 Q700 Q701 Q702	E694-M698 WeakPolarHBondContact O-CG 3.32Å; E694-M698 PolarHBondContact O-N 2.73Å; L695-M698 PolarHBondContact O-N 3.16Å; M698-Q700 PolarHBondContact O-N 3.06Å; M698-Q701 PolarHBondContact O-N 3.05Å; M698-Q702 PolarHBondContact O-N 3.17Å
699	Q	60	Low	50.3	Low	129 Å²	129	135.2 Å²	135.2	60%	0.603	65%	0.646	S	S	*	*	H	α-helix	trans	-62.7	-41.8	175.6	-173.3	175.4	90.7	0	0	111.7	L695 R697 Q701 Q702 Q703	L695-Q699 PolarHBondContact O-N 3.33Å; R697-Q699 PolarHBondContact O-N 2.78Å; Q699-Q701 VanDerWaalsContact C-N 3.35Å; Q699-Q701 PolarHBondContact O-N 2.84Å; Q699-Q702 PolarHBondContact O-N 3.27Å; Q699-Q703 PolarHBondContact O-N 3.01Å; Q699-Q703 VanDerWaalsContact O-N 3.15Å
700	Q	53.9	Low	49.6	Very low	119 Å²	119	135.2 Å²	135.2	56%	0.556	65%	0.649	S	S	*	*	H	α-helix	trans	-66.7	-34.6	176.9	-165.1	168.8	95	0	0	112.4	L696 R697 M698 Q703 Q704	L696-Q700 WeakPolarHBondContact O-CB 3.24Å; L696-Q700 PolarHBondContact O-N 3.34Å; R697-Q700 PolarHBondContact O-N 3.04Å; M698-Q700 PolarHBondContact O-N 3.06Å; Q700-Q703 PolarHBondContact O-N 3.33Å; Q700-Q704 PolarHBondContact O-N 3.43Å; Q700-Q704 VanDerWaalsContact O-N 3.13Å
701	Q	48.5	Very low	48.8	Very low	142 Å²	142	139 Å²	139	66%	0.664	67%	0.67	S	S	*	*	H	α-helix	trans	-71.9	-37.7	177.7	-148.9	175.4	41.1	0	0	112.5	R697 M698 Q699 Q703 Q704 K705	R697-Q701 WeakPolarHBondContact O-CB 3.34Å; R697-Q701 PolarHBondContact O-N 3.15Å; M698-Q701 PolarHBondContact O-N 3.05Å; Q699-Q701 VanDerWaalsContact C-N 3.35Å; Q699-Q701 PolarHBondContact O-N 2.84Å; Q701-Q703 VanDerWaalsContact C-N 3.3Å; Q701-Q703 PolarHBondContact O-N 3.02Å; Q701-Q704 PolarHBondContact O-N 3.21Å; Q701-K705 PolarHBondContact O-N 3.43Å
702	Q	49.3	Very low	47.1	Very low	148 Å²	148	144.1 Å²	144.1	69%	0.692	69%	0.689	S	S	*	*	H	α-helix	trans	-62.5	-37.7	169.7	-74.1	-171.5	-7.7	0	0	111.9	M698 Q699 Q704 K705	M698-Q702 PolarHBondContact O-N 3.17Å; Q699-Q702 PolarHBondContact O-N 3.27Å; Q702-Q704 VanDerWaalsContact C-N 3.34Å; Q702-Q704 PolarHBondContact O-N 2.86Å; Q702-K705 PolarHBondContact O-N 3.01Å
703	Q	46.6	Very low	46.1	Very low	143 Å²	143	145.2 Å²	145.2	67%	0.668	69%	0.692	S	S	*	*	H	α-helix	trans	-70.6	-26.7	179.9	-160.2	166.2	94.8	0	0	113.2	Q699 Q700 Q701	Q699-Q703 PolarHBondContact O-N 3.01Å; Q699-Q703 VanDerWaalsContact O-N 3.15Å; Q700-Q703 PolarHBondContact O-N 3.33Å; Q701-Q703 VanDerWaalsContact C-N 3.3Å; Q701-Q703 PolarHBondContact O-N 3.02Å
704	Q	40.9	Very low	45	Very low	128 Å²	128	144.8 Å²	144.8	60%	0.598	70%	0.701	S	S	*	*	H	α-helix	trans	-69.9	-32.1	171.5	-73.6	-178.7	-3.9	0	0	112.8	Q700 Q701 Q702 Q706 R707	Q700-Q704 PolarHBondContact O-N 3.43Å; Q700-Q704 VanDerWaalsContact O-N 3.13Å; Q701-Q704 PolarHBondContact O-N 3.21Å; Q702-Q704 VanDerWaalsContact C-N 3.34Å; Q702-Q704 PolarHBondContact O-N 2.86Å; Q704-Q706 PolarHBondContact O-N 3.38Å; Q704-R707 PolarHBondContact O-N 3.06Å
705	K	40.9	Very low	43.5	Very low	198 Å²	198	146.3 Å²	146.3	86%	0.861	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-5	-178.1	-118	-178.5	-177.7	-178.8	0	115.2	Q701 Q702	Q701-K705 PolarHBondContact O-N 3.43Å; Q702-K705 PolarHBondContact O-N 3.01Å
706	Q	36	Very low	41.9	Very low	179 Å²	179	153 Å²	153	84%	0.836	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-2.1	173.3	-63.9	-167.3	16.6	0	0	114.5	Q704 K708	Q704-Q706 PolarHBondContact O-N 3.38Å; Q706-K708 PolarHBondContact O-N 2.71Å
707	R	34.2	Very low	40.3	Very low	215 Å²	215	155.3 Å²	155.3	81%	0.811	75%	0.745	S	S	*	*			trans	-88.5	103.1	178.2	-62.8	-166.9	74.1	-175	2	111.1	Q704	Q704-R707 PolarHBondContact O-N 3.06Å
708	K	36.3	Very low	38.8	Very low	194 Å²	194	151.3 Å²	151.3	84%	0.843	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-61.5	143.8	161.2	-68.6	-174.5	176.9	-175.2	0	109.7	Q706	Q706-K708 PolarHBondContact O-N 2.71Å
709	P	32.3	Very low	37	Very low	112 Å²	112	154.9 Å²	154.9	73%	0.727	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.1	157.5	171.5	30.9	-35.1	0	0	0	111.2
710	P	36.9	Very low	35.7	Very low	122 Å²	122	154.7 Å²	154.7	79%	0.792	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-75.2	157.9	174.3	33.3	-35.1	0	0	0	111.8
711	V	33.6	Very low	34.4	Very low	141 Å²	141	152.5 Å²	152.5	86%	0.855	77%	0.77	S	S	*	*			trans	-118.2	139.9	160.6	177.9	0	0	0	0	106.5
712	E	30.1	Very low	33.3	Very low	187 Å²	187	154.3 Å²	154.3	87%	0.874	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-84.2	135.9	-174.2	-61.5	171.2	127.2	0	0	111.3
713	E	27.3	Very low	32.2	Very low	182 Å²	182	158.6 Å²	158.6	85%	0.85	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-101.5	137.4	162.1	-75.9	-169.7	144	0	0	109.7
714	P	30.5	Very low	31.3	Very low	132 Å²	132	157 Å²	157	86%	0.857	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.5	139.7	175.4	30.9	-34	0	0	0	111.6
715	V	26.9	Very low	30.5	Very low	124 Å²	124	154.6 Å²	154.6	75%	0.752	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84.5	136.8	-175.2	177	0	0	0	0	112.1
716	Y	27.5	Very low	30.3	Very low	227 Å²	227	153.2 Å²	153.2	89%	0.89	81%	0.81	S	S	*	*			trans	-148.1	157.4	145.3	-134.2	-95.7	0	0	0	112.9
717	Q	24.3	Very low	29.8	Very low	153 Å²	153	154 Å²	154	72%	0.715	81%	0.814	S	S	*	*			trans	-141.5	173.2	-172.2	-88.1	-170.7	1.9	0	0	109.2
718	P	35.9	Very low	29.7	Very low	94 Å²	94	150.6 Å²	150.6	61%	0.61	81%	0.81	S	S	*	*			cis	-140.3	154.8	-31.2	35	-17.7	0	0	0	115.3
719	Q	24.1	Very low	29.2	Very low	184 Å²	184	150.9 Å²	150.9	86%	0.86	81%	0.806	S	S	*	*			trans	61.1	176	152.8	-66.7	179.1	25.5	0	0	118.2
720	P	34.3	Very low	29.1	Very low	124 Å²	124	154.9 Å²	154.9	81%	0.805	81%	0.807	S	S	*	*			cis	-106.6	-163	-16.8	38.5	-22.6	0	0	0	110.8
721	A	25.5	Very low	28.7	Very low	74 Å²	74	159.9 Å²	159.9	61%	0.612	81%	0.81	S	S	*	*			cis	-160.5	157.9	15.7	0	0	0	0	0	114.8
722	Q	26.5	Very low	28.7	Very low	180 Å²	180	160.1 Å²	160.1	84%	0.841	81%	0.806	S	S	*	*			trans	56.6	117.4	138.5	-66.8	171.4	29.3	0	0	123.9
723	R	25.2	Very low	28.8	Very low	238 Å²	238	158.7 Å²	158.7	90%	0.898	80%	0.8	S	S	*	*			trans	50.3	109.2	132.3	-74.3	-175.9	170.2	173.5	-2.9	122
724	A	27.3	Very low	29	Very low	108 Å²	108	156.9 Å²	156.9	89%	0.893	80%	0.796	S	S	*	*				54.9	125.4	115.1	0	0	0	0	0	121.8
725	G	24.3	Very low	29.6	Very low	78 Å²	78	156 Å²	156	80%	0.804	79%	0.79	S	S	*	*			trans	173.9	149.8	163.5	0	0	0	0	0	110.8
726	L	37.2	Very low	30.3	Very low	170 Å²	170	158.3 Å²	158.3	89%	0.89	79%	0.793	S	S	*	*			trans	-91.3	147.8	164.2	-63.9	88.8	0	0	0	108.3
727	E	25.5	Very low	31.1	Very low	194 Å²	194	154.4 Å²	154.4	91%	0.907	79%	0.786	S	S	*	*				-175.8	177.1	113.3	-102.6	179.6	-170.6	0	0	112.5
728	I	31.9	Very low	31.9	Very low	144 Å²	144	153 Å²	153	74%	0.738	78%	0.782	S	S	*	*			trans	-101	150.8	-173.1	-64.5	165.1	0	0	0	108.8
729	W	26.9	Very low	32	Very low	201 Å²	201	155.6 Å²	155.6	76%	0.761	79%	0.786	S	S	*	*				169.9	113.9	122.9	-95	89.9	0	0	0	113.8
730	R	28.7	Very low	32.9	Very low	195 Å²	195	154.6 Å²	154.6	74%	0.736	78%	0.782	S	S	*	*			trans	22.2	125.2	142.2	-169.4	-167.2	-61.4	-166.6	0.7	118.5
731	R	29.5	Very low	33.3	Very low	228 Å²	228	154.2 Å²	154.2	86%	0.86	78%	0.777	S	S	*	*			trans	-129.4	127.3	144.2	-149.7	176.8	-167.2	114.9	-0.8	110.4
732	N	33	Very low	33.8	Very low	145 Å²	145	155.5 Å²	155.5	78%	0.775	78%	0.777	S	S	*	*			trans	-145.7	141.5	172.2	-176.1	13	0	0	0	106.5
733	Q	31.6	Very low	34.4	Very low	158 Å²	158	154.6 Å²	154.6	74%	0.738	77%	0.773	S	S	*	*			trans	-146.2	109.1	177.8	-77.1	-167.5	-44.8	0	0	111.7
734	N	33	Very low	35.1	Very low	144 Å²	144	149.2 Å²	149.2	77%	0.77	77%	0.767	S	S	*	*			trans	-151	113.7	136.9	-138.9	-15.7	0	0	0	108.7	Q736	N734-Q736 PolarHBondContact O-N 2.97Å
735	P	43.3	Very low	35.4	Very low	112 Å²	112	150.8 Å²	150.8	73%	0.727	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	39.4	-152.4	39.9	-39.6	0	0	0	115.5
736	Q	41	Very low	35.8	Very low	174 Å²	174	150.6 Å²	150.6	81%	0.813	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-16.3	-178	-73	-176.2	-18.5	0	0	115.6	N734	N734-Q736 PolarHBondContact O-N 2.97Å
737	L	44.8	Very low	35.5	Very low	145 Å²	145	150.4 Å²	150.4	76%	0.759	76%	0.757	S	S	*	*	S	Bend	trans	-91.5	-1.6	-177.4	-127.8	81.1	0	0	0	115.4
738	I	41.3	Very low	35.8	Very low	122 Å²	122	149.3 Å²	149.3	63%	0.626	75%	0.752	S	S	*	*	S	Bend	trans	-92.9	-33.7	-172.3	-65.5	178.1	0	0	0	112	E740 V741 T742	I738-E740 PolarHBondContact O-N 3.34Å; I738-V741 PolarHBondContact O-N 3.49Å; I738-T742 HydrophobicContact CG2-CG2 4.4Å; I738-T742 PolarHBondContact O-N 3Å; I738-T742 PolarHBondContact O-OG1 3.5Å
739	Q	38	Very low	35.8	Very low	150 Å²	150	148.9 Å²	148.9	70%	0.701	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-37.5	-171.4	-169.7	166.5	-8.3	0	0	112.8	V741 T742	Q739-V741 VanDerWaalsContact C-N 3.29Å; Q739-V741 PolarHBondContact O-N 3.32Å; Q739-T742 WeakPolarHBondContact CA-OG1 3.47Å; Q739-T742 PolarHBondContact O-N 3.1Å; Q739-T742 PolarHBondContact O-OG1 2.78Å
740	E	42.7	Very low	35.9	Very low	163 Å²	163	142.6 Å²	142.6	76%	0.762	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-26.1	177.3	-169.6	172.3	-157.6	0	0	113.1	I738	I738-E740 PolarHBondContact O-N 3.34Å
741	V	41.4	Very low	36.5	Very low	116 Å²	116	141.7 Å²	141.7	70%	0.703	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-19.8	-178.7	-175	0	0	0	0	112.1	I738 Q739	I738-V741 PolarHBondContact O-N 3.49Å; Q739-V741 VanDerWaalsContact C-N 3.29Å; Q739-V741 PolarHBondContact O-N 3.32Å
742	T	37.7	Very low	36.6	Very low	101 Å²	101	138.1 Å²	138.1	62%	0.62	77%	0.765	S	S	*	*	S	Bend	trans	-81	-11.5	-176.3	32.7	0	0	0	0	116	I738 Q739	I738-T742 HydrophobicContact CG2-CG2 4.4Å; I738-T742 PolarHBondContact O-N 3Å; I738-T742 PolarHBondContact O-OG1 3.5Å; Q739-T742 WeakPolarHBondContact CA-OG1 3.47Å; Q739-T742 PolarHBondContact O-N 3.1Å; Q739-T742 PolarHBondContact O-OG1 2.78Å
743	E	38.2	Very low	36.8	Very low	160 Å²	160	139 Å²	139	75%	0.748	77%	0.769	S	S	*	*	S	Bend	trans	-95.9	-5.5	-168.3	-67.7	-166.2	153	0	0	116.4
744	T	40.8	Very low	36.6	Very low	126 Å²	126	143.2 Å²	143.2	77%	0.773	78%	0.778	S	S	*	*	S	Bend	trans	-131.6	0.2	-170.4	26.6	0	0	0	0	118.9
745	V	32.6	Very low	36.4	Very low	141 Å²	141	141.5 Å²	141.5	86%	0.855	78%	0.775	S	S	*	*	S	Bend	trans	-139	110.9	173.4	-174.4	0	0	0	0	111.4
746	G	32.1	Very low	36.2	Very low	73 Å²	73	141.5 Å²	141.5	75%	0.753	79%	0.785	S	S	*	*			trans	176.5	4.1	176.7	0	0	0	0	0	121.7
747	Q	30.6	Very low	35.5	Very low	166 Å²	166	140.6 Å²	140.6	78%	0.776	78%	0.782	S	S	*	*			trans	-138.4	154.9	176.9	-69.4	-158.6	17.5	0	0	115.5
748	H	33.4	Very low	34.9	Very low	172 Å²	172	141.1 Å²	141.1	80%	0.796	78%	0.781	S	S	*	*			trans	87.1	112.6	171.6	-46.5	-38.2	0	0	0	117
749	S	32	Very low	34.4	Very low	134 Å²	134	146.4 Å²	146.4	94%	0.937	79%	0.793	S	S	*	*			trans	-86.4	154.3	177.5	-44.7	0	0	0	0	111.7
750	G	27.8	Very low	34.1	Very low	70 Å²	70	144.2 Å²	144.2	72%	0.722	80%	0.801	S	S	*	*			trans	174.1	120.5	168.7	0	0	0	0	0	111.8	I752	G750-I752 PolarHBondContact O-N 3.26Å
751	D	42.7	Very low	33.7	Very low	175 Å²	175	142 Å²	142	94%	0.936	80%	0.799	S	S	*	*			trans	-71.5	118.8	-179.2	-73.1	-75.3	0	0	0	112.3
752	I	31.6	Very low	34.2	Very low	153 Å²	153	145.1 Å²	145.1	79%	0.785	80%	0.798	S	S	*	*			trans	-130.7	134.2	157.6	-59.7	-177.5	0	0	0	108.2	G750 R754	G750-I752 PolarHBondContact O-N 3.26Å; I752-R754 PolarHBondContact O-N 3.45Å
753	L	35.9	Very low	35.3	Very low	164 Å²	164	142 Å²	142	86%	0.859	78%	0.778	S	S	*	*			trans	-46	117.4	176.3	-64.7	164.4	0	0	0	111	P755	L753-P755 WeakPolarHBondContact O-CD 3.45Å; L753-P755 VanDerWaalsContact O-N 3.14Å
754	R	28.5	Very low	36.7	Very low	246 Å²	246	136.8 Å²	136.8	93%	0.928	76%	0.762	S	S	*	*			trans	-56.6	115.8	-179.8	-89.3	-172.7	168.1	-171.6	-3.9	111.1	I752	I752-R754 PolarHBondContact O-N 3.45Å
755	P	28.3	Very low	38.3	Very low	109 Å²	109	130.9 Å²	130.9	71%	0.708	73%	0.726	S	S	*	*			trans	-68.1	155.3	171.6	-17.4	33	0	0	0	110.9	L753 M757	L753-P755 WeakPolarHBondContact O-CD 3.45Å; L753-P755 VanDerWaalsContact O-N 3.14Å; P755-M757 PolarHBondContact O-N 3.26Å
756	A	38.5	Very low	40.2	Very low	112 Å²	112	127.3 Å²	127.3	93%	0.926	70%	0.702	S	S	*	*			trans	-72.7	92.3	176	0	0	0	0	0	111.1
757	M	27.4	Very low	41.7	Very low	154 Å²	154	128.3 Å²	128.3	76%	0.759	69%	0.687	S	S	*	*			trans	-148	130.9	-176.8	-167.4	175.6	-172.1	0	0	111	P755	P755-M757 PolarHBondContact O-N 3.26Å
758	Q	31.5	Very low	43.4	Very low	156 Å²	156	128.8 Å²	128.8	73%	0.729	69%	0.687	S	S	*	*			cis	-148.8	140.1	-21	-119.9	162.5	6.3	0	0	105.8
759	R	30.6	Very low	45.5	Very low	234 Å²	234	121.1 Å²	121.1	88%	0.883	65%	0.652	S	S	*	*			trans	-68.3	136	164.3	-84	179.9	170.7	159.1	-3	107.3	T761	R759-T761 PolarHBondContact O-N 3.15Å
760	A	30.9	Very low	47.7	Very low	104 Å²	104	116.8 Å²	116.8	86%	0.86	62%	0.622	S	S	*	*			trans	-54.5	109.2	169.1	0	0	0	0	0	109	R762	A760-R762 PolarHBondContact O-N 3.14Å; A760-R762 VanDerWaalsContact O-N 3.12Å
761	T	35.9	Very low	50	Low	117 Å²	117	115.6 Å²	115.6	72%	0.718	60%	0.602	S	S	*	*			trans	-75.7	100	-177.2	43.7	0	0	0	0	108.6	R759 V763	R759-T761 PolarHBondContact O-N 3.15Å; T761-V763 PolarHBondContact O-N 2.78Å
762	R	51	Low	51.6	Low	181 Å²	181	113.9 Å²	113.9	68%	0.683	59%	0.588	S	S	*	*			trans	-50.4	114.6	157.9	-80.9	-174.7	172.2	-167.5	-2.7	107.4	A760 A764	A760-R762 PolarHBondContact O-N 3.14Å; A760-R762 VanDerWaalsContact O-N 3.12Å; R762-A764 PolarHBondContact O-N 3.45Å
763	V	60.9	Low	54	Low	36 Å²	36	109 Å²	109	22%	0.218	56%	0.564	C	S	.	*			trans	-60.8	131.9	169.7	-179.2	0	0	0	0	107.1	T761 W777 E780	T761-V763 PolarHBondContact O-N 2.78Å; V763-W777 HydrophobicContact CG1-CB 3.86Å; V763-W777 HydrophobicContact CG1-CG 4.4Å; V763-W777 PolarHBondContact O-NE1 3.12Å; V763-E780 VanDerWaalsContact CB-OE2 3.22Å; V763-E780 WeakPolarHBondContact CB-OE2 3.18Å; V763-E780 VanDerWaalsContact CG2-OE2 3.28Å; V763-E780 WeakPolarHBondContact CG2-OE2 3.3Å; V763-E780 PolarHBondContact N-OE2 3.3Å
764	A	66.8	Low	56	Low	49 Å²	49	101.2 Å²	101.2	41%	0.405	52%	0.523	S	S	.	.			trans	-136.2	98.3	-175.2	0	0	0	0	0	108.3	R762	R762-A764 PolarHBondContact O-N 3.45Å
765	I	76.3	Confident	58.5	Low	3 Å²	3	90.3 Å²	90.3	2%	0.015	48%	0.484	C	S	.	.			trans	-70.2	145.1	179.3	53.7	164.1	0	0	0	111.7	S769 V774 W777 L799 F800 L823 Q826	I765-S769 VanDerWaalsContact CA-OG 3.3Å; I765-S769 WeakPolarHBondContact CA-OG 3.3Å; I765-V774 HydrophobicContact CG2-CG2 4.11Å; I765-W777 HydrophobicContact CD1-CD2 3.74Å; I765-W777 HydrophobicContact CD1-CE3 3.44Å; I765-W777 VanDerWaalsContact CD1-CE3 3.44Å; I765-W777 HydrophobicContact CD1-CG 4.39Å; I765-W777 HydrophobicContact CD1-CH2 4.12Å; I765-W777 HydrophobicContact CD1-CZ2 4.4Å; I765-W777 HydrophobicContact CD1-CZ3 3.66Å; I765-W777 HydrophobicContact CG1-CD2 3.77Å; I765-W777 HydrophobicContact CG1-CE3 4.04Å; I765-W777 HydrophobicContact CG1-CG 4.08Å; I765-W777 HydrophobicContact CG1-CZ2 4.38Å; I765-W777 HydrophobicContact CG1-CZ3 4.44Å; I765-W777 HydrophobicContact CG2-CB 3.69Å; I765-W777 HydrophobicContact CG2-CD2 4.36Å; I765-W777 HydrophobicContact CG2-CG 3.87Å; I765-L799 HydrophobicContact CD1-CD2 4.16Å; I765-F800 HydrophobicContact CD1-CE2 4.31Å; I765-F800 HydrophobicContact CD1-CZ 3.93Å; I765-F800 HydrophobicContact CG1-CE2 4.31Å; I765-F800 HydrophobicContact CG1-CZ 3.89Å; I765-L823 HydrophobicContact CD1-CD2 3.7Å; I765-Q826 HydrophobicContact CG1-CG 4.3Å
766	N	71	Confident	61	Low	66 Å²	66	90.3 Å²	90.3	35%	0.353	47%	0.47	S	S	.	.			trans	-135.2	175.3	173.4	68	88	0	0	0	108.5	K768 S769 G796	N766-K768 PolarHBondContact O-N 3.36Å; N766-K768 PolarHBondContact OD1-N 2.84Å; N766-S769 PolarHBondContact N-OG 3.06Å; N766-S769 PolarHBondContact ND2-OG 3.31Å; N766-S769 VanDerWaalsContact O-CB 3.3Å; N766-S769 WeakPolarHBondContact O-CB 3.41Å; N766-S769 PolarHBondContact O-N 3.47Å; N766-S769 PolarHBondContact O-OG 3.37Å; N766-G796 WeakPolarHBondContact O-CA 3.41Å
767	E	64.8	Low	63.3	Low	94 Å²	94	85 Å²	85	44%	0.439	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-33	179.6	-173.7	-166	138.1	0	0	114.1	A797 F832	E767-A797 HydrophobicContact CG-CB 4.25Å; E767-A797 WeakPolarHBondContact O-CB 3.2Å; E767-A797 PolarHBondContact O-N 2.96Å; E767-F832 HydrophobicContact CB-CD2 4.08Å; E767-F832 HydrophobicContact CB-CE2 4.01Å; E767-F832 HydrophobicContact CG-CD2 4.42Å; E767-F832 HydrophobicContact CG-CE2 3.91Å
768	K	66.3	Low	65.9	Low	175 Å²	175	77.7 Å²	77.7	76%	0.761	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	14	-176.5	-53.8	-174.5	-178	-175.5	0	113.7	N766	N766-K768 PolarHBondContact O-N 3.36Å; N766-K768 PolarHBondContact OD1-N 2.84Å
769	S	77.1	Confident	68.3	Low	11 Å²	11	75.7 Å²	75.7	8%	0.077	38%	0.38	C	S	.	.			trans	-69.4	134.6	173.8	-75.6	0	0	0	0	111	I765 N766 G796	I765-S769 VanDerWaalsContact CA-OG 3.3Å; I765-S769 WeakPolarHBondContact CA-OG 3.3Å; N766-S769 PolarHBondContact N-OG 3.06Å; N766-S769 PolarHBondContact ND2-OG 3.31Å; N766-S769 VanDerWaalsContact O-CB 3.3Å; N766-S769 WeakPolarHBondContact O-CB 3.41Å; N766-S769 PolarHBondContact O-N 3.47Å; N766-S769 PolarHBondContact O-OG 3.37Å; S769-G796 PolarHBondContact O-N 2.99Å
770	S	77.5	Confident	70.7	Confident	44 Å²	44	69.4 Å²	69.4	31%	0.308	36%	0.361	S	S	.	.			trans	-68.6	161	175.7	70.7	0	0	0	0	111.3	E772 D773 V774	S770-E772 PolarHBondContact O-N 2.8Å; S770-D773 WeakPolarHBondContact CB-OD2 3.44Å; S770-D773 PolarHBondContact N-OD2 3.43Å; S770-D773 WeakPolarHBondContact O-CB 3.43Å; S770-D773 PolarHBondContact O-N 2.91Å; S770-D773 PolarHBondContact OG-N 3.4Å; S770-D773 PolarHBondContact OG-OD2 3.04Å; S770-V774 PolarHBondContact O-N 3.39Å
771	P	75.6	Confident	73	Confident	45 Å²	45	67.2 Å²	67.2	29%	0.292	33%	0.332	S	S	.	.	H	α-helix	trans	-54	-39.1	171.6	-28.3	36.5	0	0	0	113.6	D773 V774 T775 G793 Q794 D795	P771-D773 VanDerWaalsContact C-N 3.29Å; P771-D773 PolarHBondContact O-N 2.8Å; P771-V774 WeakPolarHBondContact O-CB 3.37Å; P771-V774 PolarHBondContact O-N 2.74Å; P771-V774 VanDerWaalsContact O-N 3.1Å; P771-T775 PolarHBondContact O-N 2.83Å; P771-T775 PolarHBondContact O-OG1 2.78Å; P771-G793 WeakPolarHBondContact CG-O 3.27Å; P771-Q794 WeakPolarHBondContact CA-O 3.47Å; P771-D795 HydrophobicContact CG-CB 4.13Å
772	E	77.9	Confident	75	Confident	139 Å²	139	64.6 Å²	64.6	65%	0.65	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-36	175.8	-63.3	-177	-158.7	0	0	112.7	S770 R776	S770-E772 PolarHBondContact O-N 2.8Å; E772-R776 WeakPolarHBondContact O-CB 3.44Å; E772-R776 PolarHBondContact O-N 2.81Å; E772-R776 IonicContact OE2-NH2 3.64Å
773	D	80.4	Confident	76.6	Confident	51 Å²	51	56.4 Å²	56.4	27%	0.273	30%	0.297	S	S	.	.	H	α-helix	trans	-72.6	-31.7	175.9	-59.5	-52.4	0	0	0	112	S770 P771 R776 W777	S770-D773 WeakPolarHBondContact CB-OD2 3.44Å; S770-D773 PolarHBondContact N-OD2 3.43Å; S770-D773 WeakPolarHBondContact O-CB 3.43Å; S770-D773 PolarHBondContact O-N 2.91Å; S770-D773 PolarHBondContact OG-N 3.4Å; S770-D773 PolarHBondContact OG-OD2 3.04Å; P771-D773 VanDerWaalsContact C-N 3.29Å; P771-D773 PolarHBondContact O-N 2.8Å; D773-R776 IonicContact OD1-CZ 3.93Å; D773-R776 IonicContact OD1-NH1 3.36Å; D773-R776 PolarHBondContact OD1-NH1 3.34Å; D773-W777 WeakPolarHBondContact O-CB 3.5Å; D773-W777 PolarHBondContact O-N 2.8Å
774	V	79.5	Confident	77.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-70	-52.2	174.4	170.7	0	0	0	0	110.8	I765 S770 P771 R776 W777 L778 Q794 L799	I765-V774 HydrophobicContact CG2-CG2 4.11Å; S770-V774 PolarHBondContact O-N 3.39Å; P771-V774 WeakPolarHBondContact O-CB 3.37Å; P771-V774 PolarHBondContact O-N 2.74Å; P771-V774 VanDerWaalsContact O-N 3.1Å; V774-R776 VanDerWaalsContact C-N 3.32Å; V774-R776 PolarHBondContact O-N 2.99Å; V774-W777 WeakPolarHBondContact O-CA 3.38Å; V774-W777 WeakPolarHBondContact O-CB 3.4Å; V774-W777 PolarHBondContact O-N 3.24Å; V774-L778 HydrophobicContact CG1-CD1 4.23Å; V774-L778 WeakPolarHBondContact O-CG 3.3Å; V774-L778 PolarHBondContact O-N 2.86Å; V774-Q794 WeakPolarHBondContact CB-O 3.3Å; V774-L799 HydrophobicContact CG1-CD2 3.46Å; V774-L799 VanDerWaalsContact CG1-CD2 3.46Å
775	T	80.6	Confident	77.8	Confident	17 Å²	17	58.4 Å²	58.4	10%	0.104	31%	0.308	C	S	.	.	H	α-helix	trans	-57.2	-44.9	175.8	-62.9	0	0	0	0	110.9	P771 W777 L778 Q779 I788 D792	P771-T775 PolarHBondContact O-N 2.83Å; P771-T775 PolarHBondContact O-OG1 2.78Å; T775-W777 VanDerWaalsContact C-N 3.35Å; T775-W777 PolarHBondContact O-N 2.99Å; T775-L778 PolarHBondContact O-N 2.88Å; T775-Q779 VanDerWaalsContact O-CG 3.29Å; T775-Q779 WeakPolarHBondContact O-CG 3.44Å; T775-Q779 PolarHBondContact O-N 3.2Å; T775-Q779 VanDerWaalsContact O-N 3.09Å; T775-I788 HydrophobicContact CG2-CG2 3.87Å; T775-D792 PolarHBondContact OG1-OD1 2.81Å
776	R	80.7	Confident	77.8	Confident	109 Å²	109	66.8 Å²	66.8	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-35.3	174.4	-167.8	-175.2	-54.6	123.7	7.6	113	E772 D773 V774 E780	E772-R776 WeakPolarHBondContact O-CB 3.44Å; E772-R776 PolarHBondContact O-N 2.81Å; E772-R776 IonicContact OE2-NH2 3.64Å; D773-R776 IonicContact OD1-CZ 3.93Å; D773-R776 IonicContact OD1-NH1 3.36Å; D773-R776 PolarHBondContact OD1-NH1 3.34Å; V774-R776 VanDerWaalsContact C-N 3.32Å; V774-R776 PolarHBondContact O-N 2.99Å; R776-E780 PolarHBondContact O-N 3.5Å
777	W	86.3	Confident	78	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-70	-41.8	176.1	179.6	73	0	0	0	112.7	V763 I765 D773 V774 T775 Q779 E780 K781 L819 Q822 L823 Q826	V763-W777 HydrophobicContact CG1-CB 3.86Å; V763-W777 HydrophobicContact CG1-CG 4.4Å; V763-W777 PolarHBondContact O-NE1 3.12Å; I765-W777 HydrophobicContact CD1-CD2 3.74Å; I765-W777 HydrophobicContact CD1-CE3 3.44Å; I765-W777 VanDerWaalsContact CD1-CE3 3.44Å; I765-W777 HydrophobicContact CD1-CG 4.39Å; I765-W777 HydrophobicContact CD1-CH2 4.12Å; I765-W777 HydrophobicContact CD1-CZ2 4.4Å; I765-W777 HydrophobicContact CD1-CZ3 3.66Å; I765-W777 HydrophobicContact CG1-CD2 3.77Å; I765-W777 HydrophobicContact CG1-CE3 4.04Å; I765-W777 HydrophobicContact CG1-CG 4.08Å; I765-W777 HydrophobicContact CG1-CZ2 4.38Å; I765-W777 HydrophobicContact CG1-CZ3 4.44Å; I765-W777 HydrophobicContact CG2-CB 3.69Å; I765-W777 HydrophobicContact CG2-CD2 4.36Å; I765-W777 HydrophobicContact CG2-CG 3.87Å; D773-W777 WeakPolarHBondContact O-CB 3.5Å; D773-W777 PolarHBondContact O-N 2.8Å; V774-W777 WeakPolarHBondContact O-CA 3.38Å; V774-W777 WeakPolarHBondContact O-CB 3.4Å; V774-W777 PolarHBondContact O-N 3.24Å; T775-W777 VanDerWaalsContact C-N 3.35Å; T775-W777 PolarHBondContact O-N 2.99Å; W777-Q779 VanDerWaalsContact C-N 3.28Å; W777-Q779 PolarHBondContact O-N 2.91Å; W777-E780 PolarHBondContact O-N 2.97Å; W777-K781 HydrophobicContact CD2-CG 4.12Å; W777-K781 HydrophobicContact CG-CG 4.49Å; W777-K781 HydrophobicContact CZ2-CD 4.32Å; W777-K781 HydrophobicContact CZ2-CG 4.06Å; W777-K781 VanDerWaalsContact O-CB 3.32Å; W777-K781 WeakPolarHBondContact O-CB 3.16Å; W777-K781 WeakPolarHBondContact O-CG 3.49Å; W777-K781 PolarHBondContact O-N 2.93Å; W777-L819 HydrophobicContact CH2-CD1 4.43Å; W777-L819 HydrophobicContact CZ3-CD1 3.92Å; W777-Q822 HydrophobicContact CH2-CB 3.69Å; W777-Q822 HydrophobicContact CZ2-CB 4Å; W777-L823 HydrophobicContact CH2-CD2 4.03Å; W777-L823 HydrophobicContact CH2-CG 4.29Å; W777-L823 HydrophobicContact CZ3-CD2 3.98Å; W777-L823 HydrophobicContact CZ3-CG 4.45Å; W777-Q826 HydrophobicContact CH2-CG 4.43Å; W777-Q826 HydrophobicContact CZ2-CG 3.66Å
778	L	82.5	Confident	78.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-39	175.3	-67.1	171.5	0	0	0	111	V774 T775 K781 G782 F783 I788 L791 L819	V774-L778 HydrophobicContact CG1-CD1 4.23Å; V774-L778 WeakPolarHBondContact O-CG 3.3Å; V774-L778 PolarHBondContact O-N 2.86Å; T775-L778 PolarHBondContact O-N 2.88Å; L778-K781 PolarHBondContact O-N 3.15Å; L778-G782 PolarHBondContact O-N 3.13Å; L778-F783 HydrophobicContact CB-CD2 4.23Å; L778-F783 HydrophobicContact CD2-CD2 3.58Å; L778-F783 HydrophobicContact CD2-CE2 3.87Å; L778-F783 HydrophobicContact CD2-CG 4.17Å; L778-F783 PolarHBondContact O-N 3.15Å; L778-I788 HydrophobicContact CB-CG1 3.82Å; L778-L791 HydrophobicContact CD1-CB 3.93Å; L778-L791 HydrophobicContact CD1-CD1 4.02Å; L778-L819 HydrophobicContact CD2-CD1 3.64Å
779	Q	81.9	Confident	79	Confident	114 Å²	114	57.6 Å²	57.6	53%	0.533	30%	0.301	S	S	.	.	H	α-helix	trans	-63.5	-50.2	172.9	-70.3	168.7	5.8	0	0	112.7	T775 W777 K781 G782 I788	T775-Q779 VanDerWaalsContact O-CG 3.29Å; T775-Q779 WeakPolarHBondContact O-CG 3.44Å; T775-Q779 PolarHBondContact O-N 3.2Å; T775-Q779 VanDerWaalsContact O-N 3.09Å; W777-Q779 VanDerWaalsContact C-N 3.28Å; W777-Q779 PolarHBondContact O-N 2.91Å; Q779-K781 PolarHBondContact O-N 3.41Å; Q779-K781 VanDerWaalsContact O-N 3.16Å; Q779-G782 PolarHBondContact O-N 3.1Å; Q779-G782 VanDerWaalsContact O-N 3.1Å; Q779-I788 HydrophobicContact CG-CD1 3.79Å; Q779-I788 HydrophobicContact CG-CG1 4.42Å; Q779-I788 HydrophobicContact CG-CG2 4.24Å
780	E	80.9	Confident	78.8	Confident	102 Å²	102	61.3 Å²	61.3	48%	0.477	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-26.3	176.2	-162.7	-160	139.7	0	0	112	V763 R776 W777	V763-E780 VanDerWaalsContact CB-OE2 3.22Å; V763-E780 WeakPolarHBondContact CB-OE2 3.18Å; V763-E780 VanDerWaalsContact CG2-OE2 3.28Å; V763-E780 WeakPolarHBondContact CG2-OE2 3.3Å; V763-E780 PolarHBondContact N-OE2 3.3Å; R776-E780 PolarHBondContact O-N 3.5Å; W777-E780 PolarHBondContact O-N 2.97Å
781	K	78.6	Confident	78.6	Confident	59 Å²	59	59.6 Å²	59.6	26%	0.257	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.6	179	-72.8	-73.8	176.9	171.5	0	115	W777 L778 Q779 F783	W777-K781 HydrophobicContact CD2-CG 4.12Å; W777-K781 HydrophobicContact CG-CG 4.49Å; W777-K781 HydrophobicContact CZ2-CD 4.32Å; W777-K781 HydrophobicContact CZ2-CG 4.06Å; W777-K781 VanDerWaalsContact O-CB 3.32Å; W777-K781 WeakPolarHBondContact O-CB 3.16Å; W777-K781 WeakPolarHBondContact O-CG 3.49Å; W777-K781 PolarHBondContact O-N 2.93Å; L778-K781 PolarHBondContact O-N 3.15Å; Q779-K781 PolarHBondContact O-N 3.41Å; Q779-K781 VanDerWaalsContact O-N 3.16Å; K781-F783 HydrophobicContact CB-CD2 3.62Å; K781-F783 HydrophobicContact CB-CE2 3.5Å; K781-F783 HydrophobicContact CG-CE2 4.21Å
782	G	77.9	Confident	78.5	Confident	61 Å²	61	62.2 Å²	62.2	63%	0.629	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	33.5	178.9	0	0	0	0	0	114.3	L778 Q779	L778-G782 PolarHBondContact O-N 3.13Å; Q779-G782 PolarHBondContact O-N 3.1Å; Q779-G782 VanDerWaalsContact O-N 3.1Å
783	F	84.1	Confident	78	Confident	9 Å²	9	58 Å²	58	4%	0.039	31%	0.312	C	S	.	.			trans	-67	155.5	165.3	-71.5	-81	0	0	0	110.6	L778 K781 V787 I788 Y818 L819 Q822	L778-F783 HydrophobicContact CB-CD2 4.23Å; L778-F783 HydrophobicContact CD2-CD2 3.58Å; L778-F783 HydrophobicContact CD2-CE2 3.87Å; L778-F783 HydrophobicContact CD2-CG 4.17Å; L778-F783 PolarHBondContact O-N 3.15Å; K781-F783 HydrophobicContact CB-CD2 3.62Å; K781-F783 HydrophobicContact CB-CE2 3.5Å; K781-F783 HydrophobicContact CG-CE2 4.21Å; F783-V787 HydrophobicContact CB-CB 4.33Å; F783-V787 HydrophobicContact CB-CG1 4.09Å; F783-V787 HydrophobicContact CD1-CG1 4.18Å; F783-V787 HydrophobicContact CG-CG1 4.34Å; F783-I788 HydrophobicContact CB-CG1 4.45Å; F783-I788 WeakPolarHBondContact O-CD1 3.23Å; F783-Y818 HydrophobicContact CD1-CD1 4.22Å; F783-Y818 AromaticContact CE1-CD1 3.4Å; F783-Y818 HydrophobicContact CE1-CD1 3.4Å; F783-Y818 VanDerWaalsContact CE1-CD1 3.4Å; F783-Y818 AromaticContact CE1-CE1 3.94Å; F783-Y818 HydrophobicContact CE1-CE1 3.94Å; F783-Y818 HydrophobicContact CE1-CG 4.32Å; F783-Y818 AromaticContact CZ-CD1 3.7Å; F783-Y818 HydrophobicContact CZ-CD1 3.7Å; F783-Y818 AromaticContact CZ-CE1 3.88Å; F783-Y818 HydrophobicContact CZ-CE1 3.88Å; F783-L819 HydrophobicContact CE1-CB 3.64Å; F783-L819 HydrophobicContact CE1-CD1 4.16Å; F783-L819 HydrophobicContact CE1-CG 4.43Å; F783-L819 HydrophobicContact CE2-CD1 4.06Å; F783-L819 HydrophobicContact CZ-CB 3.91Å; F783-L819 HydrophobicContact CZ-CD1 3.75Å; F783-L819 HydrophobicContact CZ-CG 4.43Å; F783-Q822 HydrophobicContact CZ-CB 4.48Å; F783-Q822 HydrophobicContact CZ-CG 4.15Å
784	S	80.3	Confident	77.6	Confident	34 Å²	34	57.7 Å²	57.7	24%	0.238	31%	0.309	C	S	.	.			trans	-62.2	150	178.7	73.5	0	0	0	0	111.8	R786 V787 I788 E815	S784-R786 PolarHBondContact O-N 3.05Å; S784-V787 PolarHBondContact O-N 3.13Å; S784-V787 PolarHBondContact OG-N 3.21Å; S784-I788 PolarHBondContact O-N 2.91Å; S784-I788 VanDerWaalsContact O-N 3.1Å; S784-E815 WeakPolarHBondContact CB-OE1 3.42Å; S784-E815 VanDerWaalsContact CB-OE2 3.27Å; S784-E815 WeakPolarHBondContact CB-OE2 3.23Å; S784-E815 PolarHBondContact N-OE1 3Å; S784-E815 PolarHBondContact OG-OE1 3.26Å; S784-E815 PolarHBondContact OG-OE2 3.43Å
785	P	73.1	Confident	77.3	Confident	93 Å²	93	60.3 Å²	60.3	60%	0.604	32%	0.323	S	S	*	.	H	α-helix	trans	-51.7	-40.6	175.1	-28.8	36.1	0	0	0	112.2	V787 I788 D789	P785-V787 VanDerWaalsContact C-N 3.29Å; P785-V787 PolarHBondContact O-N 3.43Å; P785-I788 CarbonylContact O-C 3.46Å; P785-I788 WeakPolarHBondContact O-CA 3.3Å; P785-I788 WeakPolarHBondContact O-CB 3.5Å; P785-I788 PolarHBondContact O-N 3.31Å; P785-D789 WeakPolarHBondContact O-CB 3.21Å; P785-D789 PolarHBondContact O-N 3.25Å
786	R	77.1	Confident	76.6	Confident	180 Å²	180	59.5 Å²	59.5	68%	0.679	32%	0.318	S	S	*	.	H	α-helix	trans	-54.5	-39.6	174	176.2	-179	170.6	179.8	-3.2	113.5	S784 L790	S784-R786 PolarHBondContact O-N 3.05Å; R786-L790 WeakPolarHBondContact O-CB 3.2Å; R786-L790 PolarHBondContact O-N 2.81Å; R786-L790 VanDerWaalsContact O-N 3.1Å
787	V	74.3	Confident	75.7	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-77.2	-30.6	178.9	169	0	0	0	0	111.6	F783 S784 P785 L791 C811 E815 L819	F783-V787 HydrophobicContact CB-CB 4.33Å; F783-V787 HydrophobicContact CB-CG1 4.09Å; F783-V787 HydrophobicContact CD1-CG1 4.18Å; F783-V787 HydrophobicContact CG-CG1 4.34Å; S784-V787 PolarHBondContact O-N 3.13Å; S784-V787 PolarHBondContact OG-N 3.21Å; P785-V787 VanDerWaalsContact C-N 3.29Å; P785-V787 PolarHBondContact O-N 3.43Å; V787-L791 HydrophobicContact CG1-CD1 4.02Å; V787-L791 WeakPolarHBondContact O-CB 3.49Å; V787-L791 WeakPolarHBondContact O-CG 3.06Å; V787-L791 PolarHBondContact O-N 2.91Å; V787-C811 HydrophobicContact CG1-CB 4.28Å; V787-C811 HydrophobicContact CG2-CB 3.77Å; V787-E815 HydrophobicContact CG2-CB 4.16Å; V787-E815 WeakPolarHBondContact CG2-OE2 3.45Å; V787-L819 HydrophobicContact CG1-CD2 4.42Å
788	I	79.1	Confident	74.7	Confident	18 Å²	18	60 Å²	60	9%	0.092	33%	0.334	C	S	.	.	H	α-helix	trans	-68.4	-51.1	173.2	-64.4	157.8	0	0	0	109.7	T775 L778 Q779 F783 S784 P785 L790 L791 D792	T775-I788 HydrophobicContact CG2-CG2 3.87Å; L778-I788 HydrophobicContact CB-CG1 3.82Å; Q779-I788 HydrophobicContact CG-CD1 3.79Å; Q779-I788 HydrophobicContact CG-CG1 4.42Å; Q779-I788 HydrophobicContact CG-CG2 4.24Å; F783-I788 HydrophobicContact CB-CG1 4.45Å; F783-I788 WeakPolarHBondContact O-CD1 3.23Å; S784-I788 PolarHBondContact O-N 2.91Å; S784-I788 VanDerWaalsContact O-N 3.1Å; P785-I788 CarbonylContact O-C 3.46Å; P785-I788 WeakPolarHBondContact O-CA 3.3Å; P785-I788 WeakPolarHBondContact O-CB 3.5Å; P785-I788 PolarHBondContact O-N 3.31Å; I788-L790 VanDerWaalsContact C-N 3.31Å; I788-L790 PolarHBondContact O-N 2.93Å; I788-L791 CarbonylContact O-C 3.55Å; I788-L791 PolarHBondContact O-N 2.93Å; I788-D792 PolarHBondContact O-N 3.45Å
789	D	72.9	Confident	74.2	Confident	122 Å²	122	60 Å²	60	65%	0.652	33%	0.334	S	S	*	.	H	α-helix	trans	-61.6	-36.2	178.9	-57.5	-25.5	0	0	0	112.2	P785 L791	P785-D789 WeakPolarHBondContact O-CB 3.21Å; P785-D789 PolarHBondContact O-N 3.25Å; D789-L791 VanDerWaalsContact C-N 3.32Å; D789-L791 PolarHBondContact O-N 2.88Å
790	L	73.4	Confident	73.6	Confident	89 Å²	89	54.7 Å²	54.7	47%	0.466	31%	0.309	S	S	.	.	H	α-helix	trans	-73.4	-21.5	179.2	-176.7	65.3	0	0	0	113.6	R786 I788 A810	R786-L790 WeakPolarHBondContact O-CB 3.2Å; R786-L790 PolarHBondContact O-N 2.81Å; R786-L790 VanDerWaalsContact O-N 3.1Å; I788-L790 VanDerWaalsContact C-N 3.31Å; I788-L790 PolarHBondContact O-N 2.93Å; L790-A810 HydrophobicContact CD2-CB 4.08Å; L790-A810 WeakPolarHBondContact CD2-O 3.47Å
791	L	72.6	Confident	72.6	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.047	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	7.8	-178.9	-63.4	174.7	0	0	0	112.5	L778 V787 I788 D789 Q794 L799 L819	L778-L791 HydrophobicContact CD1-CB 3.93Å; L778-L791 HydrophobicContact CD1-CD1 4.02Å; V787-L791 HydrophobicContact CG1-CD1 4.02Å; V787-L791 WeakPolarHBondContact O-CB 3.49Å; V787-L791 WeakPolarHBondContact O-CG 3.06Å; V787-L791 PolarHBondContact O-N 2.91Å; I788-L791 CarbonylContact O-C 3.55Å; I788-L791 PolarHBondContact O-N 2.93Å; D789-L791 VanDerWaalsContact C-N 3.32Å; D789-L791 PolarHBondContact O-N 2.88Å; L791-Q794 HydrophobicContact CD2-CG 4.46Å; L791-Q794 VanDerWaalsContact O-CB 3.27Å; L791-Q794 WeakPolarHBondContact O-CB 3.35Å; L791-Q794 WeakPolarHBondContact O-CG 3.48Å; L791-Q794 PolarHBondContact O-N 2.95Å; L791-L799 HydrophobicContact CD1-CD1 4.22Å; L791-L799 HydrophobicContact CD2-CD1 4.48Å; L791-L819 HydrophobicContact CD1-CD2 3.44Å; L791-L819 VanDerWaalsContact CD1-CD2 3.44Å
792	D	74.3	Confident	71.8	Confident	100 Å²	100	52.7 Å²	52.7	54%	0.535	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	146.1	176.4	-162.9	44.6	0	0	0	110.6	T775 I788 Q794	T775-D792 PolarHBondContact OG1-OD1 2.81Å; I788-D792 PolarHBondContact O-N 3.45Å; D792-Q794 PolarHBondContact O-N 2.61Å
793	G	67.7	Low	71	Confident	49 Å²	49	51.5 Å²	51.5	51%	0.505	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-6.6	-171	0	0	0	0	0	115.7	P771	P771-G793 WeakPolarHBondContact CG-O 3.27Å
794	Q	71.5	Confident	70.1	Confident	46 Å²	46	56 Å²	56	22%	0.215	31%	0.313	C	S	.	.			trans	-80.6	125.5	175.6	-59.7	-58.4	-46.2	0	0	111.9	P771 V774 L791 D792	P771-Q794 WeakPolarHBondContact CA-O 3.47Å; V774-Q794 WeakPolarHBondContact CB-O 3.3Å; L791-Q794 HydrophobicContact CD2-CG 4.46Å; L791-Q794 VanDerWaalsContact O-CB 3.27Å; L791-Q794 WeakPolarHBondContact O-CB 3.35Å; L791-Q794 WeakPolarHBondContact O-CG 3.48Å; L791-Q794 PolarHBondContact O-N 2.95Å; D792-Q794 PolarHBondContact O-N 2.61Å
795	D	72.8	Confident	68.8	Low	54 Å²	54	59.2 Å²	59.2	29%	0.289	33%	0.327	S	S	.	.			trans	-80.7	173.4	174.9	71.4	20.3	0	0	0	112.9	P771 A797 N798 L799	P771-D795 HydrophobicContact CG-CB 4.13Å; D795-A797 VanDerWaalsContact C-N 3.34Å; D795-A797 PolarHBondContact O-N 3.45Å; D795-A797 PolarHBondContact OD1-N 3.32Å; D795-A797 VanDerWaalsContact OD1-N 3.15Å; D795-N798 VanDerWaalsContact CG-ND2 3.31Å; D795-N798 WeakPolarHBondContact OD1-CB 3.42Å; D795-N798 PolarHBondContact OD1-N 2.77Å; D795-N798 PolarHBondContact OD1-ND2 3.02Å; D795-N798 PolarHBondContact OD2-ND2 3.2Å; D795-L799 WeakPolarHBondContact O-CB 3.4Å; D795-L799 PolarHBondContact O-N 3.19Å
796	G	67.3	Low	68	Low	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.3	-40.3	179.8	0	0	0	0	0	113.4	N766 S769 F800	N766-G796 WeakPolarHBondContact O-CA 3.41Å; S769-G796 PolarHBondContact O-N 2.99Å; G796-F800 WeakPolarHBondContact O-CB 3.47Å; G796-F800 WeakPolarHBondContact O-CD2 3.33Å; G796-F800 WeakPolarHBondContact O-CG 3.14Å; G796-F800 PolarHBondContact O-N 3.45Å
797	A	61.8	Low	67.4	Low	40 Å²	40	49.6 Å²	49.6	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-48.3	-178.1	0	0	0	0	0	111.6	E767 D795 F800 S801	E767-A797 HydrophobicContact CG-CB 4.25Å; E767-A797 WeakPolarHBondContact O-CB 3.2Å; E767-A797 PolarHBondContact O-N 2.96Å; D795-A797 VanDerWaalsContact C-N 3.34Å; D795-A797 PolarHBondContact O-N 3.45Å; D795-A797 PolarHBondContact OD1-N 3.32Å; D795-A797 VanDerWaalsContact OD1-N 3.15Å; A797-F800 PolarHBondContact O-N 2.59Å; A797-S801 PolarHBondContact O-N 3.34Å
798	N	64.1	Low	67.1	Low	79 Å²	79	51.9 Å²	51.9	42%	0.422	29%	0.292	S	S	.	.	H	α-helix	trans	-67.1	-43.8	178.1	-70	-70.7	0	0	0	111.4	D795 F800 S801 L802	D795-N798 VanDerWaalsContact CG-ND2 3.31Å; D795-N798 WeakPolarHBondContact OD1-CB 3.42Å; D795-N798 PolarHBondContact OD1-N 2.77Å; D795-N798 PolarHBondContact OD1-ND2 3.02Å; D795-N798 PolarHBondContact OD2-ND2 3.2Å; N798-F800 PolarHBondContact O-N 3.48Å; N798-S801 PolarHBondContact O-N 3.14Å; N798-S801 VanDerWaalsContact O-N 3.13Å; N798-S801 PolarHBondContact O-OG 3.16Å; N798-L802 PolarHBondContact O-N 2.82Å
799	L	71.9	Confident	66.1	Low	1 Å²	1	57 Å²	57	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-26.7	176.9	-173.3	59.3	0	0	0	112.7	I765 V774 L791 D795 L802 L807 L819 L823	I765-L799 HydrophobicContact CD1-CD2 4.16Å; V774-L799 HydrophobicContact CG1-CD2 3.46Å; V774-L799 VanDerWaalsContact CG1-CD2 3.46Å; L791-L799 HydrophobicContact CD1-CD1 4.22Å; L791-L799 HydrophobicContact CD2-CD1 4.48Å; D795-L799 WeakPolarHBondContact O-CB 3.4Å; D795-L799 PolarHBondContact O-N 3.19Å; L799-L802 HydrophobicContact CD1-CD1 4.32Å; L799-L807 HydrophobicContact CD1-CD2 4.21Å; L799-L819 HydrophobicContact CD1-CD2 4.49Å; L799-L823 HydrophobicContact CD1-CD1 3.95Å; L799-L823 HydrophobicContact CD2-CD2 3.89Å; L799-L823 HydrophobicContact CG-CD1 3.89Å; L799-L823 HydrophobicContact CG-CD2 3.8Å; L799-L823 HydrophobicContact CG-CG 4.49Å
800	F	70.4	Confident	65.3	Low	2 Å²	2	53.4 Å²	53.4	1%	0.009	30%	0.302	C	S	.	.	H	α-helix	trans	-84.3	-16	173.3	-75	-52.4	0	0	0	114.8	I765 G796 A797 N798 L823 Q826 K827 F832	I765-F800 HydrophobicContact CD1-CE2 4.31Å; I765-F800 HydrophobicContact CD1-CZ 3.93Å; I765-F800 HydrophobicContact CG1-CE2 4.31Å; I765-F800 HydrophobicContact CG1-CZ 3.89Å; G796-F800 WeakPolarHBondContact O-CB 3.47Å; G796-F800 WeakPolarHBondContact O-CD2 3.33Å; G796-F800 WeakPolarHBondContact O-CG 3.14Å; G796-F800 PolarHBondContact O-N 3.45Å; A797-F800 PolarHBondContact O-N 2.59Å; N798-F800 PolarHBondContact O-N 3.48Å; F800-L823 HydrophobicContact CD1-CB 4.19Å; F800-L823 HydrophobicContact CD1-CD2 3.83Å; F800-L823 HydrophobicContact CE1-CB 4.01Å; F800-L823 HydrophobicContact CE1-CD2 3.49Å; F800-L823 VanDerWaalsContact CE1-CD2 3.49Å; F800-L823 HydrophobicContact CE1-CG 4.38Å; F800-L823 WeakPolarHBondContact CE1-O 3.39Å; F800-L823 HydrophobicContact CZ-CD2 4.15Å; F800-Q826 HydrophobicContact CE1-CB 4.03Å; F800-Q826 HydrophobicContact CZ-CB 3.8Å; F800-K827 HydrophobicContact CD1-CD 4.14Å; F800-K827 HydrophobicContact CD1-CG 3.48Å; F800-K827 VanDerWaalsContact CD1-CG 3.48Å; F800-K827 HydrophobicContact CE1-CG 3.72Å; F800-K827 HydrophobicContact CG-CG 4.25Å; F800-K827 WeakPolarHBondContact O-CE 3.44Å; F800-K827 PolarHBondContact O-NZ 3.43Å; F800-F832 HydrophobicContact CB-CE1 4.3Å; F800-F832 HydrophobicContact CB-CZ 4.34Å
801	S	59.4	Low	65.2	Low	80 Å²	80	49.5 Å²	49.5	56%	0.559	28%	0.282	S	S	*	.	H	α-helix	trans	-84.3	-25.5	174	67.3	0	0	0	0	113.1	A797 N798 S803	A797-S801 PolarHBondContact O-N 3.34Å; N798-S801 PolarHBondContact O-N 3.14Å; N798-S801 VanDerWaalsContact O-N 3.13Å; N798-S801 PolarHBondContact O-OG 3.16Å; S801-S803 PolarHBondContact O-N 2.88Å
802	L	61.1	Low	64.9	Low	39 Å²	39	50.5 Å²	50.5	20%	0.204	30%	0.295	C	S	.	.	S	Bend	trans	-60.1	127.3	-179.3	-70	173.3	0	0	0	113.2	N798 L799 L807	N798-L802 PolarHBondContact O-N 2.82Å; L799-L802 HydrophobicContact CD1-CD1 4.32Å; L802-L807 HydrophobicContact CB-CD1 4.42Å; L802-L807 HydrophobicContact CB-CD2 3.9Å; L802-L807 HydrophobicContact CB-CG 3.98Å; L802-L807 HydrophobicContact CD1-CD2 3.76Å; L802-L807 HydrophobicContact CG-CD2 4.48Å
803	S	62.8	Low	64.2	Low	37 Å²	37	55.2 Å²	55.2	26%	0.259	31%	0.305	S	S	.	.			trans	-71.4	158.4	178.4	88.1	0	0	0	0	112	S801 L805 H806 L807	S801-S803 PolarHBondContact O-N 2.88Å; S803-L805 PolarHBondContact O-N 3.19Å; S803-H806 PolarHBondContact O-N 3.31Å; S803-H806 PolarHBondContact OG-ND1 3.25Å; S803-L807 PolarHBondContact O-N 3.17Å; S803-L807 VanDerWaalsContact O-N 3.07Å
804	K	63.8	Low	64.2	Low	103 Å²	103	59.3 Å²	59.3	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-55	-38.3	178.1	-174.5	-178.7	174.1	-172.6	0	112.5	Q808 Y820	K804-Q808 WeakPolarHBondContact O-CB 3.5Å; K804-Q808 VanDerWaalsContact O-CG 3.28Å; K804-Q808 WeakPolarHBondContact O-CG 3.21Å; K804-Q808 PolarHBondContact O-N 2.9Å; K804-Y820 HydrophobicContact CB-CD1 3.86Å; K804-Y820 HydrophobicContact CB-CD2 3.65Å; K804-Y820 HydrophobicContact CB-CE1 3.98Å; K804-Y820 HydrophobicContact CB-CE2 3.78Å; K804-Y820 HydrophobicContact CB-CG 3.69Å; K804-Y820 HydrophobicContact CD-CD1 3.83Å; K804-Y820 HydrophobicContact CD-CE1 4.01Å; K804-Y820 HydrophobicContact CD-CG 4.39Å; K804-Y820 HydrophobicContact CG-CD1 3.71Å; K804-Y820 HydrophobicContact CG-CD2 4.24Å; K804-Y820 HydrophobicContact CG-CE1 4.17Å; K804-Y820 HydrophobicContact CG-CG 3.75Å
805	L	54.2	Low	64.3	Low	101 Å²	101	60.1 Å²	60.1	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-67.8	-46.7	-178.4	-175.3	62.1	0	0	0	111	S803 L807 Q808 Q809	S803-L805 PolarHBondContact O-N 3.19Å; L805-L807 PolarHBondContact O-N 2.69Å; L805-Q808 CarbonylContact O-C 3.56Å; L805-Q808 PolarHBondContact O-N 2.94Å; L805-Q808 VanDerWaalsContact O-N 3.13Å; L805-Q809 WeakPolarHBondContact O-CG 3.42Å; L805-Q809 PolarHBondContact O-N 2.85Å
806	H	54.8	Low	64	Low	70 Å²	70	57.6 Å²	57.6	32%	0.324	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-43.5	177.7	-69	120.1	0	0	0	112.2	S803 Q808 Q809 A810	S803-H806 PolarHBondContact O-N 3.31Å; S803-H806 PolarHBondContact OG-ND1 3.25Å; H806-Q808 VanDerWaalsContact C-N 3.31Å; H806-Q808 PolarHBondContact O-N 3.27Å; H806-Q809 PolarHBondContact CD2-OE1 2.67Å; H806-Q809 PolarHBondContact O-N 3.44Å; H806-A810 WeakPolarHBondContact O-CB 3.48Å; H806-A810 PolarHBondContact O-N 2.96Å
807	L	65.4	Low	63.7	Low	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-38.3	173.9	-66.4	174.6	0	0	0	112	L799 L802 S803 L805 C811 G816 L819 Y820 L823	L799-L807 HydrophobicContact CD1-CD2 4.21Å; L802-L807 HydrophobicContact CB-CD1 4.42Å; L802-L807 HydrophobicContact CB-CD2 3.9Å; L802-L807 HydrophobicContact CB-CG 3.98Å; L802-L807 HydrophobicContact CD1-CD2 3.76Å; L802-L807 HydrophobicContact CG-CD2 4.48Å; S803-L807 PolarHBondContact O-N 3.17Å; S803-L807 VanDerWaalsContact O-N 3.07Å; L805-L807 PolarHBondContact O-N 2.69Å; L807-C811 VanDerWaalsContact O-CB 3.29Å; L807-C811 WeakPolarHBondContact O-CB 3.36Å; L807-C811 PolarHBondContact O-N 3.27Å; L807-G816 VanDerWaalsContact O-CA 3.32Å; L807-G816 WeakPolarHBondContact O-CA 3.25Å; L807-L819 HydrophobicContact CD1-CG 4.44Å; L807-L819 HydrophobicContact CD2-CD2 3.98Å; L807-Y820 HydrophobicContact CD1-CD2 4.11Å; L807-L823 HydrophobicContact CD1-CD1 3.76Å
808	Q	68.8	Low	64.2	Low	50 Å²	50	61.4 Å²	61.4	23%	0.234	32%	0.316	C	S	.	.	H	α-helix	trans	-72.5	-22.6	175.7	-74.3	-172.1	-62.8	0	0	114.2	K804 L805 H806 G812 R813	K804-Q808 WeakPolarHBondContact O-CB 3.5Å; K804-Q808 VanDerWaalsContact O-CG 3.28Å; K804-Q808 WeakPolarHBondContact O-CG 3.21Å; K804-Q808 PolarHBondContact O-N 2.9Å; L805-Q808 CarbonylContact O-C 3.56Å; L805-Q808 PolarHBondContact O-N 2.94Å; L805-Q808 VanDerWaalsContact O-N 3.13Å; H806-Q808 VanDerWaalsContact C-N 3.31Å; H806-Q808 PolarHBondContact O-N 3.27Å; Q808-G812 CarbonylContact O-C 3.49Å; Q808-G812 VanDerWaalsContact O-CA 3.23Å; Q808-G812 WeakPolarHBondContact O-CA 3.38Å; Q808-G812 PolarHBondContact O-N 3.03Å; Q808-R813 WeakPolarHBondContact CG-O 2.98Å; Q808-R813 PolarHBondContact NE2-O 2.6Å; Q808-R813 PolarHBondContact O-N 2.89Å
809	Q	57.8	Low	64.8	Low	125 Å²	125	57.6 Å²	57.6	58%	0.584	30%	0.296	S	S	*	.	H	α-helix	trans	-80.8	-47.2	172.8	-73.5	165.6	-25.3	0	0	111.3	L805 H806	L805-Q809 WeakPolarHBondContact O-CG 3.42Å; L805-Q809 PolarHBondContact O-N 2.85Å; H806-Q809 PolarHBondContact CD2-OE1 2.67Å; H806-Q809 PolarHBondContact O-N 3.44Å
810	A	55.4	Low	64.9	Low	46 Å²	46	60.9 Å²	60.9	38%	0.38	31%	0.309	S	S	.	.	H	α-helix	trans	-70.1	-57.6	-178.7	0	0	0	0	0	112.2	L790 H806 G812	L790-A810 HydrophobicContact CD2-CB 4.08Å; L790-A810 WeakPolarHBondContact CD2-O 3.47Å; H806-A810 WeakPolarHBondContact O-CB 3.48Å; H806-A810 PolarHBondContact O-N 2.96Å; A810-G812 VanDerWaalsContact C-N 3.3Å; A810-G812 PolarHBondContact O-N 3.4Å
811	C	70.7	Confident	65	Low	7 Å²	7	63.7 Å²	63.7	5%	0.047	33%	0.328	C	S	.	.	S	Bend	trans	-84.5	-3	-176.2	-52.7	0	0	0	0	113.2	V787 L807 E815	V787-C811 HydrophobicContact CG1-CB 4.28Å; V787-C811 HydrophobicContact CG2-CB 3.77Å; L807-C811 VanDerWaalsContact O-CB 3.29Å; L807-C811 WeakPolarHBondContact O-CB 3.36Å; L807-C811 PolarHBondContact O-N 3.27Å; C811-E815 HydrophobicContact CB-CB 4.47Å
812	G	66.5	Low	65.9	Low	30 Å²	30	61.5 Å²	61.5	31%	0.309	31%	0.309	S	S	.	.			trans	81.8	160.2	-169.9	0	0	0	0	0	113.1	Q808 A810 D814 G816	Q808-G812 CarbonylContact O-C 3.49Å; Q808-G812 VanDerWaalsContact O-CA 3.23Å; Q808-G812 WeakPolarHBondContact O-CA 3.38Å; Q808-G812 PolarHBondContact O-N 3.03Å; A810-G812 VanDerWaalsContact C-N 3.3Å; A810-G812 PolarHBondContact O-N 3.4Å; G812-D814 VanDerWaalsContact C-N 3.32Å; G812-D814 PolarHBondContact O-N 2.78Å; G812-G816 WeakPolarHBondContact O-CA 3.1Å; G812-G816 PolarHBondContact O-N 3.07Å
813	R	61	Low	66.5	Low	199 Å²	199	59.8 Å²	59.8	75%	0.751	30%	0.3	S	S	*	.	H	α-helix	trans	-58.9	-39.3	-163.5	-157.3	-179.3	-157.9	178.7	7.5	113.8	Q808 G817	Q808-R813 WeakPolarHBondContact CG-O 2.98Å; Q808-R813 PolarHBondContact NE2-O 2.6Å; Q808-R813 PolarHBondContact O-N 2.89Å; R813-G817 PolarHBondContact O-N 2.95Å
814	D	66.1	Low	66.8	Low	136 Å²	136	62.4 Å²	62.4	73%	0.727	31%	0.311	S	S	*	.	H	α-helix	trans	-89.7	-50.3	-173.2	-56.6	-53.8	0	0	0	111.9	G812 G816 G817 Y818	G812-D814 VanDerWaalsContact C-N 3.32Å; G812-D814 PolarHBondContact O-N 2.78Å; D814-G816 PolarHBondContact O-N 2.97Å; D814-G817 PolarHBondContact O-N 3.02Å; D814-Y818 WeakPolarHBondContact O-CB 3.4Å; D814-Y818 PolarHBondContact O-N 3.13Å
815	E	74.3	Confident	67.2	Low	63 Å²	63	61.7 Å²	61.7	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-41.9	176	-67.9	-156.8	88.7	0	0	112	S784 V787 C811 G817 Y818 L819	S784-E815 WeakPolarHBondContact CB-OE1 3.42Å; S784-E815 VanDerWaalsContact CB-OE2 3.27Å; S784-E815 WeakPolarHBondContact CB-OE2 3.23Å; S784-E815 PolarHBondContact N-OE1 3Å; S784-E815 PolarHBondContact OG-OE1 3.26Å; S784-E815 PolarHBondContact OG-OE2 3.43Å; V787-E815 HydrophobicContact CG2-CB 4.16Å; V787-E815 WeakPolarHBondContact CG2-OE2 3.45Å; C811-E815 HydrophobicContact CB-CB 4.47Å; E815-G817 VanDerWaalsContact C-N 3.35Å; E815-G817 PolarHBondContact O-N 3.3Å; E815-Y818 PolarHBondContact O-N 3.47Å; E815-L819 VanDerWaalsContact O-CB 3.29Å; E815-L819 WeakPolarHBondContact O-CB 3.24Å; E815-L819 PolarHBondContact O-N 3.01Å
816	G	66.3	Low	68	Low	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.1	-34.5	175.4	0	0	0	0	0	113.6	L807 G812 D814 L819 Y820	L807-G816 VanDerWaalsContact O-CA 3.32Å; L807-G816 WeakPolarHBondContact O-CA 3.25Å; G812-G816 WeakPolarHBondContact O-CA 3.1Å; G812-G816 PolarHBondContact O-N 3.07Å; D814-G816 PolarHBondContact O-N 2.97Å; G816-L819 PolarHBondContact O-N 3Å; G816-Y820 WeakPolarHBondContact O-CB 3.31Å; G816-Y820 PolarHBondContact O-N 3.05Å
817	G	60.2	Low	68.4	Low	11 Å²	11	55.4 Å²	55.4	11%	0.113	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-38	173.9	0	0	0	0	0	112.3	R813 D814 E815 S821	R813-G817 PolarHBondContact O-N 2.95Å; D814-G817 PolarHBondContact O-N 3.02Å; E815-G817 VanDerWaalsContact C-N 3.35Å; E815-G817 PolarHBondContact O-N 3.3Å; G817-S821 WeakPolarHBondContact O-CB 3.35Å; G817-S821 PolarHBondContact O-N 2.92Å; G817-S821 PolarHBondContact O-OG 3.23Å
818	Y	73.6	Confident	68	Low	109 Å²	109	64.6 Å²	64.6	43%	0.427	32%	0.323	S	S	.	.	H	α-helix	trans	-69.2	-41.5	173.3	-179.4	-121.9	0	0	0	111.9	F783 D814 E815 S821 Q822	F783-Y818 HydrophobicContact CD1-CD1 4.22Å; F783-Y818 AromaticContact CE1-CD1 3.4Å; F783-Y818 HydrophobicContact CE1-CD1 3.4Å; F783-Y818 VanDerWaalsContact CE1-CD1 3.4Å; F783-Y818 AromaticContact CE1-CE1 3.94Å; F783-Y818 HydrophobicContact CE1-CE1 3.94Å; F783-Y818 HydrophobicContact CE1-CG 4.32Å; F783-Y818 AromaticContact CZ-CD1 3.7Å; F783-Y818 HydrophobicContact CZ-CD1 3.7Å; F783-Y818 AromaticContact CZ-CE1 3.88Å; F783-Y818 HydrophobicContact CZ-CE1 3.88Å; D814-Y818 WeakPolarHBondContact O-CB 3.4Å; D814-Y818 PolarHBondContact O-N 3.13Å; E815-Y818 PolarHBondContact O-N 3.47Å; Y818-S821 WeakPolarHBondContact O-CB 3.36Å; Y818-S821 PolarHBondContact O-N 2.9Å; Y818-Q822 HydrophobicContact CD2-CG 4.44Å; Y818-Q822 HydrophobicContact CE1-CG 4.35Å; Y818-Q822 HydrophobicContact CE2-CG 4.1Å; Y818-Q822 VanDerWaalsContact CE2-NE2 3.27Å; Y818-Q822 WeakPolarHBondContact O-CG 3.45Å; Y818-Q822 PolarHBondContact O-N 2.72Å; Y818-Q822 PolarHBondContact OH-NE2 3.19Å; Y818-Q822 VanDerWaalsContact OH-NE2 3.15Å
819	L	76.5	Confident	67.4	Low	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-60.3	-52.5	175.5	178.5	55.1	0	0	0	111.7	W777 L778 F783 V787 L791 L799 L807 E815 G816 S821 Q822 L823	W777-L819 HydrophobicContact CH2-CD1 4.43Å; W777-L819 HydrophobicContact CZ3-CD1 3.92Å; L778-L819 HydrophobicContact CD2-CD1 3.64Å; F783-L819 HydrophobicContact CE1-CB 3.64Å; F783-L819 HydrophobicContact CE1-CD1 4.16Å; F783-L819 HydrophobicContact CE1-CG 4.43Å; F783-L819 HydrophobicContact CE2-CD1 4.06Å; F783-L819 HydrophobicContact CZ-CB 3.91Å; F783-L819 HydrophobicContact CZ-CD1 3.75Å; F783-L819 HydrophobicContact CZ-CG 4.43Å; V787-L819 HydrophobicContact CG1-CD2 4.42Å; L791-L819 HydrophobicContact CD1-CD2 3.44Å; L791-L819 VanDerWaalsContact CD1-CD2 3.44Å; L799-L819 HydrophobicContact CD1-CD2 4.49Å; L807-L819 HydrophobicContact CD1-CG 4.44Å; L807-L819 HydrophobicContact CD2-CD2 3.98Å; E815-L819 VanDerWaalsContact O-CB 3.29Å; E815-L819 WeakPolarHBondContact O-CB 3.24Å; E815-L819 PolarHBondContact O-N 3.01Å; G816-L819 PolarHBondContact O-N 3Å; L819-S821 PolarHBondContact O-N 3.26Å; L819-Q822 PolarHBondContact O-N 3.17Å; L819-Q822 VanDerWaalsContact O-N 3.11Å; L819-L823 HydrophobicContact CD1-CD1 3.9Å; L819-L823 HydrophobicContact CD1-CG 4.06Å; L819-L823 HydrophobicContact CG-CD1 3.87Å; L819-L823 HydrophobicContact CG-CG 4.47Å; L819-L823 WeakPolarHBondContact O-CB 3.28Å; L819-L823 VanDerWaalsContact O-CG 3.31Å; L819-L823 WeakPolarHBondContact O-CG 3.31Å; L819-L823 PolarHBondContact O-N 2.86Å
820	Y	74.1	Confident	67.2	Low	70 Å²	70	66.2 Å²	66.2	28%	0.275	33%	0.33	S	S	.	.	H	α-helix	trans	-54.3	-39.5	173.5	-178.7	-97.3	0	0	0	112	K804 L807 G816 L823 L824	K804-Y820 HydrophobicContact CB-CD1 3.86Å; K804-Y820 HydrophobicContact CB-CD2 3.65Å; K804-Y820 HydrophobicContact CB-CE1 3.98Å; K804-Y820 HydrophobicContact CB-CE2 3.78Å; K804-Y820 HydrophobicContact CB-CG 3.69Å; K804-Y820 HydrophobicContact CD-CD1 3.83Å; K804-Y820 HydrophobicContact CD-CE1 4.01Å; K804-Y820 HydrophobicContact CD-CG 4.39Å; K804-Y820 HydrophobicContact CG-CD1 3.71Å; K804-Y820 HydrophobicContact CG-CD2 4.24Å; K804-Y820 HydrophobicContact CG-CE1 4.17Å; K804-Y820 HydrophobicContact CG-CG 3.75Å; L807-Y820 HydrophobicContact CD1-CD2 4.11Å; G816-Y820 WeakPolarHBondContact O-CB 3.31Å; G816-Y820 PolarHBondContact O-N 3.05Å; Y820-L823 PolarHBondContact O-N 2.86Å; Y820-L824 WeakPolarHBondContact O-CB 3.45Å; Y820-L824 PolarHBondContact O-N 3.37Å
821	S	73	Confident	66.8	Low	61 Å²	61	67.1 Å²	67.1	43%	0.427	34%	0.343	S	S	.	.	H	α-helix	trans	-68.2	-40	178.3	-57.5	0	0	0	0	112.8	G817 Y818 L819 V825	G817-S821 WeakPolarHBondContact O-CB 3.35Å; G817-S821 PolarHBondContact O-N 2.92Å; G817-S821 PolarHBondContact O-OG 3.23Å; Y818-S821 WeakPolarHBondContact O-CB 3.36Å; Y818-S821 PolarHBondContact O-N 2.9Å; L819-S821 PolarHBondContact O-N 3.26Å; S821-V825 WeakPolarHBondContact O-CG2 3.34Å; S821-V825 PolarHBondContact O-N 2.86Å
822	Q	76.6	Confident	65.5	Low	33 Å²	33	68.8 Å²	68.8	15%	0.154	35%	0.349	C	S	.	.	H	α-helix	trans	-67.6	-40	173.6	-68.4	-68.8	-26.3	0	0	111.5	W777 F783 Y818 L819 V825 Q826	W777-Q822 HydrophobicContact CH2-CB 3.69Å; W777-Q822 HydrophobicContact CZ2-CB 4Å; F783-Q822 HydrophobicContact CZ-CB 4.48Å; F783-Q822 HydrophobicContact CZ-CG 4.15Å; Y818-Q822 HydrophobicContact CD2-CG 4.44Å; Y818-Q822 HydrophobicContact CE1-CG 4.35Å; Y818-Q822 HydrophobicContact CE2-CG 4.1Å; Y818-Q822 VanDerWaalsContact CE2-NE2 3.27Å; Y818-Q822 WeakPolarHBondContact O-CG 3.45Å; Y818-Q822 PolarHBondContact O-N 2.72Å; Y818-Q822 PolarHBondContact OH-NE2 3.19Å; Y818-Q822 VanDerWaalsContact OH-NE2 3.15Å; L819-Q822 PolarHBondContact O-N 3.17Å; L819-Q822 VanDerWaalsContact O-N 3.11Å; Q822-V825 PolarHBondContact O-N 2.83Å; Q822-Q826 WeakPolarHBondContact O-CG 3.3Å; Q822-Q826 PolarHBondContact O-N 2.67Å
823	L	75.1	Confident	64.2	Low	4 Å²	4	77.4 Å²	77.4	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-63.3	-43.9	176	-70.5	166.7	0	0	0	111.4	I765 W777 L799 F800 L807 L819 Y820 V825 Q826 K827	I765-L823 HydrophobicContact CD1-CD2 3.7Å; W777-L823 HydrophobicContact CH2-CD2 4.03Å; W777-L823 HydrophobicContact CH2-CG 4.29Å; W777-L823 HydrophobicContact CZ3-CD2 3.98Å; W777-L823 HydrophobicContact CZ3-CG 4.45Å; L799-L823 HydrophobicContact CD1-CD1 3.95Å; L799-L823 HydrophobicContact CD2-CD2 3.89Å; L799-L823 HydrophobicContact CG-CD1 3.89Å; L799-L823 HydrophobicContact CG-CD2 3.8Å; L799-L823 HydrophobicContact CG-CG 4.49Å; F800-L823 HydrophobicContact CD1-CB 4.19Å; F800-L823 HydrophobicContact CD1-CD2 3.83Å; F800-L823 HydrophobicContact CE1-CB 4.01Å; F800-L823 HydrophobicContact CE1-CD2 3.49Å; F800-L823 VanDerWaalsContact CE1-CD2 3.49Å; F800-L823 HydrophobicContact CE1-CG 4.38Å; F800-L823 WeakPolarHBondContact CE1-O 3.39Å; F800-L823 HydrophobicContact CZ-CD2 4.15Å; L807-L823 HydrophobicContact CD1-CD1 3.76Å; L819-L823 HydrophobicContact CD1-CD1 3.9Å; L819-L823 HydrophobicContact CD1-CG 4.06Å; L819-L823 HydrophobicContact CG-CD1 3.87Å; L819-L823 HydrophobicContact CG-CG 4.47Å; L819-L823 WeakPolarHBondContact O-CB 3.28Å; L819-L823 VanDerWaalsContact O-CG 3.31Å; L819-L823 WeakPolarHBondContact O-CG 3.31Å; L819-L823 PolarHBondContact O-N 2.86Å; Y820-L823 PolarHBondContact O-N 2.86Å; L823-V825 VanDerWaalsContact C-N 3.27Å; L823-V825 PolarHBondContact O-N 3.27Å; L823-Q826 CarbonylContact O-C 3.22Å; L823-Q826 PolarHBondContact O-N 2.67Å; L823-K827 WeakPolarHBondContact O-CG 3.4Å; L823-K827 PolarHBondContact O-N 3.42Å
824	L	69.5	Low	63.1	Low	92 Å²	92	70.9 Å²	70.9	48%	0.482	36%	0.355	S	S	.	.	H	α-helix	trans	-59.3	-37.4	175.2	-173.2	63.9	0	0	0	112.3	Y820 K828	Y820-L824 WeakPolarHBondContact O-CB 3.45Å; Y820-L824 PolarHBondContact O-N 3.37Å; L824-K828 WeakPolarHBondContact O-CB 3.4Å; L824-K828 PolarHBondContact O-N 2.95Å; L824-K828 VanDerWaalsContact O-N 3.14Å
825	V	70.9	Confident	62	Low	88 Å²	88	70.1 Å²	70.1	53%	0.533	35%	0.347	S	S	.	.	H	α-helix	trans	-66.8	-36.7	173.3	170.8	0	0	0	0	111.9	S821 Q822 L823 R829	S821-V825 WeakPolarHBondContact O-CG2 3.34Å; S821-V825 PolarHBondContact O-N 2.86Å; Q822-V825 PolarHBondContact O-N 2.83Å; L823-V825 VanDerWaalsContact C-N 3.27Å; L823-V825 PolarHBondContact O-N 3.27Å; V825-R829 VanDerWaalsContact O-CB 3.28Å; V825-R829 WeakPolarHBondContact O-CB 3.26Å; V825-R829 PolarHBondContact O-N 2.76Å
826	Q	71.2	Confident	60.9	Low	11 Å²	11	69.5 Å²	69.5	5%	0.051	35%	0.348	C	S	.	.	H	α-helix	trans	-72.4	-44.9	175	-61.3	-69.6	33	0	0	112	I765 W777 F800 Q822 L823 K828 R829 S830	I765-Q826 HydrophobicContact CG1-CG 4.3Å; W777-Q826 HydrophobicContact CH2-CG 4.43Å; W777-Q826 HydrophobicContact CZ2-CG 3.66Å; F800-Q826 HydrophobicContact CE1-CB 4.03Å; F800-Q826 HydrophobicContact CZ-CB 3.8Å; Q822-Q826 WeakPolarHBondContact O-CG 3.3Å; Q822-Q826 PolarHBondContact O-N 2.67Å; L823-Q826 CarbonylContact O-C 3.22Å; L823-Q826 PolarHBondContact O-N 2.67Å; Q826-K828 VanDerWaalsContact C-N 3.28Å; Q826-K828 PolarHBondContact O-N 2.74Å; Q826-R829 CarbonylContact O-C 3.48Å; Q826-R829 WeakPolarHBondContact O-CA 3.41Å; Q826-R829 PolarHBondContact O-N 3.26Å; Q826-S830 PolarHBondContact O-N 3.07Å; Q826-S830 PolarHBondContact O-OG 3.12Å; Q826-S830 VanDerWaalsContact O-OG 3.07Å
827	K	64.1	Low	59.9	Low	28 Å²	28	69.8 Å²	69.8	12%	0.122	35%	0.35	C	S	.	.	H	α-helix	trans	-49.1	-50.3	173.4	-72.2	-176.6	171.7	-175.7	0	111.1	F800 L823 R829 S830 G831 F832 T834	F800-K827 HydrophobicContact CD1-CD 4.14Å; F800-K827 HydrophobicContact CD1-CG 3.48Å; F800-K827 VanDerWaalsContact CD1-CG 3.48Å; F800-K827 HydrophobicContact CE1-CG 3.72Å; F800-K827 HydrophobicContact CG-CG 4.25Å; F800-K827 WeakPolarHBondContact O-CE 3.44Å; F800-K827 PolarHBondContact O-NZ 3.43Å; L823-K827 WeakPolarHBondContact O-CG 3.4Å; L823-K827 PolarHBondContact O-N 3.42Å; K827-R829 PolarHBondContact O-N 3.23Å; K827-S830 PolarHBondContact O-OG 3.21Å; K827-G831 PolarHBondContact O-N 3.34Å; K827-F832 HydrophobicContact CB-CB 4.33Å; K827-F832 HydrophobicContact CB-CD1 4.16Å; K827-F832 HydrophobicContact CD-CD1 3.95Å; K827-F832 HydrophobicContact CD-CE1 4.22Å; K827-F832 HydrophobicContact CG-CD1 3.72Å; K827-F832 HydrophobicContact CG-CE1 4.35Å; K827-F832 HydrophobicContact CG-CG 4.49Å; K827-F832 PolarHBondContact O-N 3.28Å; K827-F832 VanDerWaalsContact O-N 3.14Å; K827-T834 HydrophobicContact CD-CG2 3.82Å
828	K	55.9	Low	59.3	Low	194 Å²	194	72.6 Å²	72.6	84%	0.843	36%	0.363	S	S	*	.	H	α-helix	trans	-66.4	-17.7	178.4	-169.6	167.6	-175.7	172	0	114.1	L824 Q826	L824-K828 WeakPolarHBondContact O-CB 3.4Å; L824-K828 PolarHBondContact O-N 2.95Å; L824-K828 VanDerWaalsContact O-N 3.14Å; Q826-K828 VanDerWaalsContact C-N 3.28Å; Q826-K828 PolarHBondContact O-N 2.74Å
829	R	55.6	Low	58.5	Low	155 Å²	155	72.7 Å²	72.7	59%	0.585	37%	0.367	S	S	*	.	H	α-helix	trans	-104.4	-25.4	-176	-168	173.6	-174.1	-125.8	-5.2	113.8	V825 Q826 K827 G831	V825-R829 VanDerWaalsContact O-CB 3.28Å; V825-R829 WeakPolarHBondContact O-CB 3.26Å; V825-R829 PolarHBondContact O-N 2.76Å; Q826-R829 CarbonylContact O-C 3.48Å; Q826-R829 WeakPolarHBondContact O-CA 3.41Å; Q826-R829 PolarHBondContact O-N 3.26Å; K827-R829 PolarHBondContact O-N 3.23Å; R829-G831 VanDerWaalsContact C-N 3.34Å
830	S	55	Low	57.4	Low	54 Å²	54	74.2 Å²	74.2	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-82.8	-11.1	171.3	57.2	0	0	0	0	113.1	Q826 K827 F832	Q826-S830 PolarHBondContact O-N 3.07Å; Q826-S830 PolarHBondContact O-OG 3.12Å; Q826-S830 VanDerWaalsContact O-OG 3.07Å; K827-S830 PolarHBondContact O-OG 3.21Å; S830-F832 VanDerWaalsContact C-N 3.3Å; S830-F832 WeakPolarHBondContact OG-CB 3.39Å
831	G	46.9	Very low	56.6	Low	64 Å²	64	75.5 Å²	75.5	66%	0.66	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	18.1	-173.8	0	0	0	0	0	113.2	K827 R829 R833	K827-G831 PolarHBondContact O-N 3.34Å; R829-G831 VanDerWaalsContact C-N 3.34Å; G831-R833 PolarHBondContact O-N 2.87Å
832	F	43.2	Very low	55.8	Low	42 Å²	42	74.5 Å²	74.5	18%	0.184	38%	0.377	C	S	.	.			trans	-62.8	120.7	-177.9	-178.2	-109.2	0	0	0	111.1	E767 F800 K827 S830 T834	E767-F832 HydrophobicContact CB-CD2 4.08Å; E767-F832 HydrophobicContact CB-CE2 4.01Å; E767-F832 HydrophobicContact CG-CD2 4.42Å; E767-F832 HydrophobicContact CG-CE2 3.91Å; F800-F832 HydrophobicContact CB-CE1 4.3Å; F800-F832 HydrophobicContact CB-CZ 4.34Å; K827-F832 HydrophobicContact CB-CB 4.33Å; K827-F832 HydrophobicContact CB-CD1 4.16Å; K827-F832 HydrophobicContact CD-CD1 3.95Å; K827-F832 HydrophobicContact CD-CE1 4.22Å; K827-F832 HydrophobicContact CG-CD1 3.72Å; K827-F832 HydrophobicContact CG-CE1 4.35Å; K827-F832 HydrophobicContact CG-CG 4.49Å; K827-F832 PolarHBondContact O-N 3.28Å; K827-F832 VanDerWaalsContact O-N 3.14Å; S830-F832 VanDerWaalsContact C-N 3.3Å; S830-F832 WeakPolarHBondContact OG-CB 3.39Å; F832-T834 HydrophobicContact CD1-CG2 3.95Å; F832-T834 HydrophobicContact CE1-CG2 3.76Å; F832-T834 PolarHBondContact O-N 3.29Å
833	R	38.3	Very low	54.8	Low	212 Å²	212	74.3 Å²	74.3	80%	0.8	38%	0.377	S	S	*	.			trans	-81.1	107.9	166.2	-65	-174.6	-178.9	-155.7	0.2	107.6	G831 H835	G831-R833 PolarHBondContact O-N 2.87Å; R833-H835 PolarHBondContact O-N 3.12Å
834	T	38.5	Very low	53.9	Low	62 Å²	62	74.7 Å²	74.7	38%	0.38	38%	0.379	S	S	.	.			trans	-60.3	131.2	164.2	38.2	0	0	0	0	109.1	K827 F832 T836	K827-T834 HydrophobicContact CD-CG2 3.82Å; F832-T834 HydrophobicContact CD1-CG2 3.95Å; F832-T834 HydrophobicContact CE1-CG2 3.76Å; F832-T834 PolarHBondContact O-N 3.29Å; T834-T836 PolarHBondContact O-N 3.45Å; T834-T836 PolarHBondContact O-OG1 3.12Å
835	H	42.3	Very low	53.4	Low	119 Å²	119	74.1 Å²	74.1	55%	0.551	38%	0.376	S	S	*	.			trans	-71.4	68.2	176.2	-81.8	-100.8	0	0	0	111.6	R833 G837 D838 E839	R833-H835 PolarHBondContact O-N 3.12Å; H835-G837 VanDerWaalsContact C-N 3.34Å; H835-G837 PolarHBondContact O-N 3.18Å; H835-D838 HydrophobicContact CB-CB 4.12Å; H835-D838 IonicContact CE1-OD2 3.84Å; H835-D838 IonicContact CG-OD2 3.02Å; H835-D838 IonicContact ND1-OD2 3.9Å; H835-D838 PolarHBondContact ND1-OD2 3.19Å; H835-D838 PolarHBondContact O-N 3.33Å; H835-E839 WeakPolarHBondContact O-CB 3.44Å; H835-E839 PolarHBondContact O-N 2.9Å
836	T	51.7	Low	52.8	Low	51 Å²	51	72.1 Å²	72.1	31%	0.313	36%	0.361	S	S	.	.	H	α-helix	trans	-56.3	-48.1	174	24.3	0	0	0	0	111.1	E88 T834 L840	E88-T836 PolarHBondContact OE2-OG1 3.32Å; T834-T836 PolarHBondContact O-N 3.45Å; T834-T836 PolarHBondContact O-OG1 3.12Å; T836-L840 VanDerWaalsContact O-CB 3.29Å; T836-L840 WeakPolarHBondContact O-CB 3.38Å; T836-L840 PolarHBondContact O-N 2.93Å
837	G	45.2	Very low	52.3	Low	5 Å²	5	75 Å²	75	5%	0.052	37%	0.371	C	S	.	.	H	α-helix	trans	-60.6	-49	174.8	0	0	0	0	0	114.2	E88 H835 K841	E88-G837 PolarHBondContact OE2-N 2.84Å; H835-G837 VanDerWaalsContact C-N 3.34Å; H835-G837 PolarHBondContact O-N 3.18Å; G837-K841 WeakPolarHBondContact O-CB 3.45Å; G837-K841 PolarHBondContact O-N 3Å
838	D	48.7	Very low	52.1	Low	71 Å²	71	75.7 Å²	75.7	38%	0.38	37%	0.373	S	S	.	.	H	α-helix	trans	-79	-26.3	-175.3	-62.7	-65	0	0	0	114.1	H835 K841 A842	H835-D838 HydrophobicContact CB-CB 4.12Å; H835-D838 IonicContact CE1-OD2 3.84Å; H835-D838 IonicContact CG-OD2 3.02Å; H835-D838 IonicContact ND1-OD2 3.9Å; H835-D838 PolarHBondContact ND1-OD2 3.19Å; H835-D838 PolarHBondContact O-N 3.33Å; D838-K841 IonicContact OD1-NZ 3.01Å; D838-K841 PolarHBondContact OD1-NZ 2.86Å; D838-A842 VanDerWaalsContact O-CB 3.26Å; D838-A842 WeakPolarHBondContact O-CB 3.48Å; D838-A842 PolarHBondContact O-N 2.98Å
839	E	55.2	Low	52	Low	110 Å²	110	69.3 Å²	69.3	51%	0.514	35%	0.351	S	S	.	.	H	α-helix	trans	-63.7	-47.8	168.6	-176.4	173.4	-172	0	0	110.1	H835 K841 A842 I843	H835-E839 WeakPolarHBondContact O-CB 3.44Å; H835-E839 PolarHBondContact O-N 2.9Å; E839-K841 PolarHBondContact O-N 2.88Å; E839-A842 WeakPolarHBondContact O-CB 3.29Å; E839-A842 PolarHBondContact O-N 3.45Å; E839-I843 WeakPolarHBondContact O-CG1 3.49Å; E839-I843 PolarHBondContact O-N 2.86Å
840	L	55.3	Low	51.8	Low	33 Å²	33	66.3 Å²	66.3	17%	0.173	34%	0.343	C	S	.	.	H	α-helix	trans	-66.3	-36.9	179.6	-156.9	66.7	0	0	0	112.7	Q69 L71 D84 V90 T836 I843 L844	Q69-L840 HydrophobicContact CG-CD1 4.23Å; Q69-L840 VanDerWaalsContact NE2-CG 3.3Å; L71-L840 HydrophobicContact CD2-CD2 3.79Å; D84-L840 HydrophobicContact CB-CD2 4.2Å; V90-L840 HydrophobicContact CG1-CB 4.49Å; V90-L840 HydrophobicContact CG1-CD2 4.21Å; V90-L840 HydrophobicContact CG1-CG 4.32Å; V90-L840 HydrophobicContact CG2-CD2 3.87Å; T836-L840 VanDerWaalsContact O-CB 3.29Å; T836-L840 WeakPolarHBondContact O-CB 3.38Å; T836-L840 PolarHBondContact O-N 2.93Å; L840-I843 WeakPolarHBondContact O-CB 3.27Å; L840-I843 PolarHBondContact O-N 2.62Å; L840-L844 WeakPolarHBondContact O-CG 3.46Å; L840-L844 PolarHBondContact O-N 3.46Å
841	K	56.2	Low	51.7	Low	97 Å²	97	64.6 Å²	64.6	42%	0.422	33%	0.33	S	S	.	.	H	α-helix	trans	-72	-33.4	174.4	178.4	177.6	163.5	-160.1	0	112.7	G837 D838 E839 N845	G837-K841 WeakPolarHBondContact O-CB 3.45Å; G837-K841 PolarHBondContact O-N 3Å; D838-K841 IonicContact OD1-NZ 3.01Å; D838-K841 PolarHBondContact OD1-NZ 2.86Å; E839-K841 PolarHBondContact O-N 2.88Å; K841-N845 VanDerWaalsContact O-CB 3.22Å; K841-N845 WeakPolarHBondContact O-CB 3.38Å; K841-N845 PolarHBondContact O-N 3.06Å
842	A	56.4	Low	51.8	Low	39 Å²	39	65.5 Å²	65.5	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-65.1	-41.6	169.8	0	0	0	0	0	111.2	D838 E839 N845 H846 F864	D838-A842 VanDerWaalsContact O-CB 3.26Å; D838-A842 WeakPolarHBondContact O-CB 3.48Å; D838-A842 PolarHBondContact O-N 2.98Å; E839-A842 WeakPolarHBondContact O-CB 3.29Å; E839-A842 PolarHBondContact O-N 3.45Å; A842-N845 PolarHBondContact O-N 3.23Å; A842-H846 VanDerWaalsContact O-CB 3.26Å; A842-H846 WeakPolarHBondContact O-CB 3.39Å; A842-H846 PolarHBondContact O-N 3.44Å; A842-F864 HydrophobicContact CB-CZ 4.36Å
843	I	54.5	Low	52.1	Low	30 Å²	30	70.8 Å²	70.8	15%	0.154	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-48.9	174.1	-69.8	164.2	0	0	0	111.1	E839 L840 H846 R847	E839-I843 WeakPolarHBondContact O-CG1 3.49Å; E839-I843 PolarHBondContact O-N 2.86Å; L840-I843 WeakPolarHBondContact O-CB 3.27Å; L840-I843 PolarHBondContact O-N 2.62Å; I843-H846 PolarHBondContact O-N 3.16Å; I843-R847 VanDerWaalsContact CG2-CZ 3.49Å; I843-R847 VanDerWaalsContact CG2-NH2 3.33Å; I843-R847 WeakPolarHBondContact O-CG 3.34Å; I843-R847 PolarHBondContact O-N 2.97Å
844	L	58	Low	53	Low	12 Å²	12	63.2 Å²	63.2	6%	0.063	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-38.8	177.9	-70	174.6	0	0	0	112.8	V90 L840 R847 R848	V90-L844 HydrophobicContact CG1-CD1 3.49Å; V90-L844 VanDerWaalsContact CG1-CD1 3.49Å; L840-L844 WeakPolarHBondContact O-CG 3.46Å; L840-L844 PolarHBondContact O-N 3.46Å; L844-R847 WeakPolarHBondContact O-CB 3.44Å; L844-R847 PolarHBondContact O-N 2.95Å; L844-R848 PolarHBondContact O-N 3.03Å
845	N	58.4	Low	54.1	Low	79 Å²	79	60.6 Å²	60.6	42%	0.422	31%	0.31	S	S	.	.	H	α-helix	trans	-72	-32.2	178.1	-160.5	72.1	0	0	0	112.5	K841 A842 R848 T849	K841-N845 VanDerWaalsContact O-CB 3.22Å; K841-N845 WeakPolarHBondContact O-CB 3.38Å; K841-N845 PolarHBondContact O-N 3.06Å; A842-N845 PolarHBondContact O-N 3.23Å; N845-R848 WeakPolarHBondContact O-CB 3.26Å; N845-R848 PolarHBondContact O-N 3.08Å; N845-T849 PolarHBondContact O-N 2.93Å; N845-T849 PolarHBondContact O-OG1 3.25Å
846	H	59	Low	54.7	Low	47 Å²	47	61.2 Å²	61.2	22%	0.218	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-45.5	169.9	175.9	74.6	0	0	0	111.2	A842 I843 R848 T849 H850 P862	A842-H846 VanDerWaalsContact O-CB 3.26Å; A842-H846 WeakPolarHBondContact O-CB 3.39Å; A842-H846 PolarHBondContact O-N 3.44Å; I843-H846 PolarHBondContact O-N 3.16Å; H846-R848 VanDerWaalsContact C-N 3.34Å; H846-R848 PolarHBondContact O-N 3.17Å; H846-T849 WeakPolarHBondContact CA-OG1 3.38Å; H846-T849 PolarHBondContact O-N 3.09Å; H846-T849 VanDerWaalsContact O-N 3.16Å; H846-T849 PolarHBondContact O-OG1 3.18Å; H846-H850 AromaticContact CE1-CD2 3.27Å; H846-H850 PolarHBondContact CE1-CD2 2.65Å; H846-H850 AromaticContact CE1-NE2 3.17Å; H846-H850 PolarHBondContact CE1-NE2 3.44Å; H846-H850 AromaticContact ND1-NE2 3.94Å; H846-H850 AromaticContact NE2-CD2 3.58Å; H846-H850 AromaticContact NE2-NE2 3.69Å; H846-H850 PolarHBondContact O-N 3.17Å; H846-H850 AromaticContact ND1-CD2 3.73Å; H846-P862 HydrophobicContact CB-CB 4.3Å; H846-P862 HydrophobicContact CB-CG 4.5Å
847	R	59.3	Low	54.5	Low	70 Å²	70	61.1 Å²	61.1	26%	0.264	32%	0.317	S	S	.	.	H	α-helix	trans	-55	-47.5	172.6	-71.6	174	-173.8	152.7	11.2	111.4	I843 L844 T849 H850 V851	I843-R847 VanDerWaalsContact CG2-CZ 3.49Å; I843-R847 VanDerWaalsContact CG2-NH2 3.33Å; I843-R847 WeakPolarHBondContact O-CG 3.34Å; I843-R847 PolarHBondContact O-N 2.97Å; L844-R847 WeakPolarHBondContact O-CB 3.44Å; L844-R847 PolarHBondContact O-N 2.95Å; R847-T849 PolarHBondContact O-N 3.08Å; R847-H850 PolarHBondContact O-N 3.22Å; R847-V851 WeakPolarHBondContact O-CB 3.49Å; R847-V851 PolarHBondContact O-N 2.81Å; R847-V851 WeakPolarHBondContact O-CG2 3.06Å; R847-V851 VanDerWaalsContact O-CB 3.3Å
848	R	60.8	Low	54.4	Low	44 Å²	44	63.5 Å²	63.5	17%	0.166	34%	0.337	C	S	.	.	H	α-helix	trans	-51.2	-52.7	173	168.6	179	-73.7	119.4	7.5	111.9	E91 E133 L844 N845 H846 H850 V851 E852	E91-R848 IonicContact OE1-CZ 2.92Å; E91-R848 IonicContact OE1-NH1 3.18Å; E91-R848 PolarHBondContact OE1-NH1 3.08Å; E91-R848 IonicContact OE1-NH2 2.71Å; E91-R848 PolarHBondContact OE1-NH2 2.88Å; E133-R848 IonicContact OE1-CZ 3.66Å; E133-R848 IonicContact OE1-NE 2.84Å; E133-R848 PolarHBondContact OE1-NE 2.81Å; E133-R848 IonicContact OE1-NH2 3.85Å; E133-R848 IonicContact OE2-CZ 2.67Å; E133-R848 IonicContact OE2-NE 2.73Å; E133-R848 PolarHBondContact OE2-NE 2.91Å; E133-R848 IonicContact OE2-NH2 2.69Å; E133-R848 PolarHBondContact OE2-NH2 3.13Å; L844-R848 PolarHBondContact O-N 3.03Å; N845-R848 WeakPolarHBondContact O-CB 3.26Å; N845-R848 PolarHBondContact O-N 3.08Å; H846-R848 VanDerWaalsContact C-N 3.34Å; H846-R848 PolarHBondContact O-N 3.17Å; R848-H850 VanDerWaalsContact C-N 3.33Å; R848-H850 PolarHBondContact O-N 3.2Å; R848-V851 WeakPolarHBondContact O-CB 3.42Å; R848-V851 PolarHBondContact O-N 3.24Å; R848-V851 VanDerWaalsContact O-N 3.15Å; R848-E852 WeakPolarHBondContact O-CG 3.33Å; R848-E852 VanDerWaalsContact O-N 3.07Å; R848-E852 PolarHBondContact O-N 3.04Å
849	T	52.6	Low	54.3	Low	59 Å²	59	65 Å²	65	36%	0.362	36%	0.359	S	S	.	.	H	α-helix	trans	-65.1	-28.5	-178.8	51.9	0	0	0	0	114.9	N845 H846 R847	N845-T849 PolarHBondContact O-N 2.93Å; N845-T849 PolarHBondContact O-OG1 3.25Å; H846-T849 WeakPolarHBondContact CA-OG1 3.38Å; H846-T849 PolarHBondContact O-N 3.09Å; H846-T849 VanDerWaalsContact O-N 3.16Å; H846-T849 PolarHBondContact O-OG1 3.18Å; R847-T849 PolarHBondContact O-N 3.08Å
850	H	52.5	Low	53.6	Low	92 Å²	92	66.3 Å²	66.3	43%	0.426	37%	0.369	S	S	.	.	H	α-helix	trans	-78.5	-35.7	172	-86.7	-95.4	0	0	0	112.5	H846 R847 R848 E852 L853	H846-H850 AromaticContact CE1-CD2 3.27Å; H846-H850 PolarHBondContact CE1-CD2 2.65Å; H846-H850 AromaticContact CE1-NE2 3.17Å; H846-H850 PolarHBondContact CE1-NE2 3.44Å; H846-H850 AromaticContact ND1-NE2 3.94Å; H846-H850 AromaticContact NE2-CD2 3.58Å; H846-H850 AromaticContact NE2-NE2 3.69Å; H846-H850 PolarHBondContact O-N 3.17Å; H846-H850 AromaticContact ND1-CD2 3.73Å; R847-H850 PolarHBondContact O-N 3.22Å; R848-H850 VanDerWaalsContact C-N 3.33Å; R848-H850 PolarHBondContact O-N 3.2Å; H850-E852 VanDerWaalsContact C-N 3.3Å; H850-E852 PolarHBondContact O-N 2.89Å; H850-L853 PolarHBondContact O-N 2.87Å
851	V	52.5	Low	52.8	Low	18 Å²	18	70.9 Å²	70.9	11%	0.109	39%	0.39	C	S	.	.	H	α-helix	trans	-64.2	-33.5	178.1	160.9	0	0	0	0	112.3	T38 A40 R847 R848 L853 N855	T38-V851 VanDerWaalsContact O-CG2 3.3Å; T38-V851 WeakPolarHBondContact O-CG2 3.26Å; A40-V851 HydrophobicContact CB-CG1 3.93Å; R847-V851 WeakPolarHBondContact O-CB 3.49Å; R847-V851 PolarHBondContact O-N 2.81Å; R847-V851 WeakPolarHBondContact O-CG2 3.06Å; R847-V851 VanDerWaalsContact O-CB 3.3Å; R848-V851 WeakPolarHBondContact O-CB 3.42Å; R848-V851 PolarHBondContact O-N 3.24Å; R848-V851 VanDerWaalsContact O-N 3.15Å; V851-L853 PolarHBondContact O-N 2.75Å; V851-N855 PolarHBondContact O-N 3.34Å
852	E	49.3	Very low	51.9	Low	83 Å²	83	67.6 Å²	67.6	39%	0.388	38%	0.379	S	S	.	.	H	α-helix	trans	-58.2	-25.3	176.1	-78.3	175.3	163.3	0	0	114.6	P131 R848 H850	P131-E852 WeakPolarHBondContact CD-OE1 3.3Å; P131-E852 HydrophobicContact CG-CG 4.09Å; R848-E852 WeakPolarHBondContact O-CG 3.33Å; R848-E852 VanDerWaalsContact O-N 3.07Å; R848-E852 PolarHBondContact O-N 3.04Å; H850-E852 VanDerWaalsContact C-N 3.3Å; H850-E852 PolarHBondContact O-N 2.89Å
853	L	49.9	Very low	50.9	Low	153 Å²	153	70.7 Å²	70.7	80%	0.801	39%	0.393	S	S	*	.	H	α-helix	trans	-101	-31.2	-171	-74.7	164.5	0	0	0	115	H850 V851	H850-L853 PolarHBondContact O-N 2.87Å; V851-L853 PolarHBondContact O-N 2.75Å
854	S	57.1	Low	50	Low	54 Å²	54	76.6 Å²	76.6	38%	0.378	42%	0.418	S	S	.	.	H	α-helix	trans	-146.8	-12.2	-178.6	68.1	0	0	0	0	117.3	E856	S854-E856 PolarHBondContact OG-N 3.28Å; S854-E856 PolarHBondContact OG-OE2 2.88Å; S854-E856 WeakPolarHBondContact OG-CB 3.28Å; S854-E856 PolarHBondContact O-N 3.18Å
855	N	60.7	Low	48.6	Very low	6 Å²	6	81 Å²	81	3%	0.032	45%	0.446	C	S	.	.	S	Bend	trans	50.9	33	-164.9	-84.5	-61.6	0	0	0	112.6	F39 A40 F45 K56 V851	F39-N855 WeakPolarHBondContact CA-OD1 3.47Å; F39-N855 WeakPolarHBondContact CB-OD1 3.22Å; A40-N855 PolarHBondContact N-OD1 3.23Å; A40-N855 PolarHBondContact O-ND2 2.79Å; F45-N855 WeakPolarHBondContact CD1-ND2 3.22Å; F45-N855 WeakPolarHBondContact CG-ND2 3.28Å; K56-N855 WeakPolarHBondContact CE-O 3.33Å; K56-N855 PolarHBondContact NZ-O 3.26Å; V851-N855 PolarHBondContact O-N 3.34Å
856	E	56	Low	47.2	Very low	133 Å²	133	82.6 Å²	82.6	62%	0.621	45%	0.453	S	S	*	.			trans	-105.3	166.1	170.9	-61	176.9	135	0	0	110.6	S854	S854-E856 PolarHBondContact OG-N 3.28Å; S854-E856 PolarHBondContact OG-OE2 2.88Å; S854-E856 WeakPolarHBondContact OG-CB 3.28Å; S854-E856 PolarHBondContact O-N 3.18Å
857	A	46.9	Very low	45.8	Very low	48 Å²	48	86.9 Å²	86.9	40%	0.397	48%	0.477	S	S	.	.			trans	-80.8	138.3	178.9	0	0	0	0	0	111.6	M60 A65	M60-A857 HydrophobicContact CE-CB 4.21Å; A65-A857 HydrophobicContact CB-CB 3.58Å
858	A	43.8	Very low	44.4	Very low	56 Å²	56	89 Å²	89	46%	0.463	50%	0.501	S	S	.	.			trans	-66.4	132.1	159.6	0	0	0	0	0	109
859	A	45.5	Very low	42.9	Very low	102 Å²	102	94.6 Å²	94.6	84%	0.843	53%	0.532	S	S	*	.	S	Bend	trans	-81.9	-19	-179.1	0	0	0	0	0	113.4
860	D	41.6	Very low	41.8	Very low	137 Å²	137	103.2 Å²	103.2	73%	0.733	57%	0.574	S	S	*	*	S	Bend	trans	-135.5	165.6	-178.8	-74.8	-67.6	0	0	0	110.2
861	E	38.2	Very low	41.3	Very low	130 Å²	130	103.8 Å²	103.8	61%	0.607	58%	0.582	S	S	*	*			trans	-67.8	162.3	174.7	-78.6	-164.9	159.8	0	0	113.2	V863	E861-V863 PolarHBondContact O-N 3.31Å
862	P	36.4	Very low	40.7	Very low	28 Å²	28	108.3 Å²	108.3	18%	0.182	61%	0.607	C	S	.	*			trans	-55.8	100.5	166.1	21	-31.8	0	0	0	111.4	H846 F864	H846-P862 HydrophobicContact CB-CB 4.3Å; H846-P862 HydrophobicContact CB-CG 4.5Å; P862-F864 PolarHBondContact O-N 3.08Å
863	V	35.7	Very low	40.2	Very low	104 Å²	104	109.7 Å²	109.7	63%	0.63	62%	0.619	S	S	*	*			trans	-64.2	106.4	168.3	178.4	0	0	0	0	108	E861 T865	E861-V863 PolarHBondContact O-N 3.31Å; V863-T865 PolarHBondContact O-N 3.17Å; V863-T865 PolarHBondContact O-OG1 3.05Å
864	F	35.2	Very low	39.6	Very low	154 Å²	154	107.1 Å²	107.1	68%	0.675	61%	0.608	S	S	*	*			trans	-69.4	87	166.1	-77	-83.6	0	0	0	108.5	A842 P862 I866	A842-F864 HydrophobicContact CB-CZ 4.36Å; P862-F864 PolarHBondContact O-N 3.08Å; F864-I866 PolarHBondContact O-N 3.39Å
865	T	29.5	Very low	38.5	Very low	105 Å²	105	110.4 Å²	110.4	64%	0.644	62%	0.622	S	S	*	*			trans	-61.4	103.9	-175.5	-50.3	0	0	0	0	110.9	V863 N867	V863-T865 PolarHBondContact O-N 3.17Å; V863-T865 PolarHBondContact O-OG1 3.05Å; T865-N867 PolarHBondContact O-N 3.49Å
866	I	29.8	Very low	37	Very low	112 Å²	112	117.4 Å²	117.4	57%	0.574	66%	0.662	S	S	*	*			trans	-55.5	128.6	157.3	-59.8	175.2	0	0	0	106.4	F864	F864-I866 PolarHBondContact O-N 3.39Å
867	N	27.6	Very low	35.7	Very low	136 Å²	136	116.3 Å²	116.3	73%	0.727	67%	0.665	S	S	*	*			trans	-49.5	128.2	-177.2	-75.7	-57.7	0	0	0	110.6	T865 I869	T865-N867 PolarHBondContact O-N 3.49Å; N867-I869 PolarHBondContact O-N 3.43Å
868	P	30.1	Very low	34.8	Very low	116 Å²	116	121.5 Å²	121.5	75%	0.753	69%	0.685	S	S	*	*			trans	-66.8	109.3	175.5	27.2	-33	0	0	0	109.1
869	I	29.6	Very low	34.1	Very low	160 Å²	160	127 Å²	127	82%	0.821	70%	0.704	S	S	*	*			trans	-85	142.9	167.4	-59.4	-179.7	0	0	0	107.9	N867	N867-I869 PolarHBondContact O-N 3.43Å
870	L	29.9	Very low	33	Very low	240 Å²	240	129.3 Å²	129.3	100%	1.257	69%	0.691	S	S	*	*			trans	-65.1	0	-174.2	-68.3	160.4	0	0	0	113.8

Retrieved 870 of 870 residues in 367 ms (Link to these results)

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